A0A077Z943_TRITR Loading...

Pregnancy-associated glycoprotein 12

AlphaFold DB , UniProt , Accession A0A077Z943, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 602 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	36.5	Very low	34.8	Very low	238 Å²	238	143.8 Å²	143.8	100%	1.172	80%	0.796	S	S	*	*				0	142.8	0	-82.4	167.2	73.5	0	0	108.8
2	S	36.9	Very low	34.9	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	78%	0.782	S	S	*	*			trans	56.4	100.2	171	54.9	0	0	0	0	117.3
3	A	35.3	Very low	34.8	Very low	89 Å²	89	142.6 Å²	142.6	74%	0.736	79%	0.788	S	S	*	*				73.1	107.1	60	0	0	0	0	0	114.6
4	L	32.3	Very low	34.8	Very low	155 Å²	155	142.9 Å²	142.9	81%	0.812	79%	0.786	S	S	*	*			trans	58.5	112.7	132.7	-75.1	138.4	0	0	0	120.6
5	S	37	Very low	34.9	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	77%	0.773	S	S	*	*				-169.2	91.9	129.6	57.5	0	0	0	0	108.4
6	I	35.9	Very low	34.8	Very low	145 Å²	145	140.8 Å²	140.8	74%	0.744	77%	0.771	S	S	*	*				57.8	108.1	100.6	-58.8	172.8	0	0	0	113.4
7	L	28.3	Very low	34.7	Very low	129 Å²	129	142.6 Å²	142.6	68%	0.675	77%	0.77	S	S	*	*			trans	-48.2	144.2	160.7	-86.9	78	0	0	0	112.3
8	P	36.4	Very low	34.5	Very low	122 Å²	122	142.4 Å²	142.4	79%	0.792	77%	0.766	S	S	*	*				-109.8	123.1	128.2	30.9	-21.2	0	0	0	109.3
9	H	33.5	Very low	34.5	Very low	153 Å²	153	141.6 Å²	141.6	71%	0.708	76%	0.76	S	S	*	*			trans	-58.5	137.3	159.4	-70	-82.6	0	0	0	110.1
10	L	35.1	Very low	34.6	Very low	135 Å²	135	140.4 Å²	140.4	71%	0.707	76%	0.762	S	S	*	*				141	131.8	129.7	-90.9	116.9	0	0	0	114
11	F	35.3	Very low	35	Very low	193 Å²	193	135.9 Å²	135.9	85%	0.846	75%	0.748	S	S	*	*	S	Bend	trans	72.1	115.1	170.9	-58	-77.6	0	0	0	115.5
12	A	35.9	Very low	35.6	Very low	76 Å²	76	128.2 Å²	128.2	63%	0.628	72%	0.715	S	S	*	*			cis	-148.2	124.7	20.7	0	0	0	0	0	109.2	L14	A12-L14 PolarHBondContact O-N 3.12Å
13	F	34.2	Very low	36.4	Very low	196 Å²	196	128.9 Å²	128.9	86%	0.86	71%	0.705	S	S	*	*			trans	-62.8	76.1	152.1	-87.3	-93.6	0	0	0	107.9	L15	F13-L15 HydrophobicContact CD1-CD1 3.72Å; F13-L15 HydrophobicContact CD1-CG 4.15Å; F13-L15 HydrophobicContact CE1-CD1 4.42Å; F13-L15 PolarHBondContact O-N 3.43Å
14	L	34.9	Very low	37.4	Very low	146 Å²	146	129.7 Å²	129.7	76%	0.764	70%	0.701	S	S	*	*			trans	-71.7	71.7	147.8	-102	141.6	0	0	0	105.4	A12 L16	A12-L14 PolarHBondContact O-N 3.12Å; L14-L16 PolarHBondContact O-N 3.2Å
15	L	36.6	Very low	38.5	Very low	114 Å²	114	131 Å²	131	60%	0.597	70%	0.695	S	S	*	*			trans	-59.2	90	152	-97.1	150	0	0	0	104.4	F13 F17	F13-L15 HydrophobicContact CD1-CD1 3.72Å; F13-L15 HydrophobicContact CD1-CG 4.15Å; F13-L15 HydrophobicContact CE1-CD1 4.42Å; F13-L15 PolarHBondContact O-N 3.43Å; L15-F17 PolarHBondContact O-N 3.22Å
16	L	32.9	Very low	39.6	Very low	139 Å²	139	132 Å²	132	73%	0.728	69%	0.691	S	S	*	*			trans	-46.2	87.4	147.4	-84.8	140.7	0	0	0	105.6	L14 I18	L14-L16 PolarHBondContact O-N 3.2Å; L16-I18 HydrophobicContact CB-CG1 4.37Å; L16-I18 PolarHBondContact O-N 3.39Å
17	F	32.6	Very low	40.4	Very low	172 Å²	172	130.9 Å²	130.9	75%	0.754	69%	0.692	S	S	*	*			trans	-58.7	88.2	147.2	-84	-84.4	0	0	0	104.2	L15 I19	L15-F17 PolarHBondContact O-N 3.22Å; F17-I19 HydrophobicContact CB-CG1 4.37Å; F17-I19 PolarHBondContact O-N 3.24Å
18	I	31	Very low	41.8	Very low	138 Å²	138	130.5 Å²	130.5	71%	0.708	69%	0.691	S	S	*	*			trans	-58.5	92.3	154.2	-61.7	173.6	0	0	0	102.6	L16 C20	L16-I18 HydrophobicContact CB-CG1 4.37Å; L16-I18 PolarHBondContact O-N 3.39Å; I18-C20 HydrophobicContact CG2-CB 4.42Å; I18-C20 PolarHBondContact O-N 3.14Å
19	I	35.1	Very low	42.8	Very low	127 Å²	127	136.1 Å²	136.1	65%	0.651	70%	0.696	S	S	*	*			trans	-66.6	84.3	168.4	-58.7	175.4	0	0	0	104	F17 G21 T22	F17-I19 HydrophobicContact CB-CG1 4.37Å; F17-I19 PolarHBondContact O-N 3.24Å; I19-G21 VanDerWaalsContact C-N 3.31Å; I19-G21 PolarHBondContact O-N 3.43Å; I19-T22 HydrophobicContact CG2-CG2 3.35Å
20	C	36.1	Very low	43.7	Very low	118 Å²	118	132.9 Å²	132.9	80%	0.797	69%	0.687	S	S	*	*			trans	-68.9	94.3	177.7	-167.7	0	0	0	0	106.2	I18	I18-C20 HydrophobicContact CG2-CB 4.42Å; I18-C20 PolarHBondContact O-N 3.14Å
21	G	43.8	Very low	44.5	Very low	46 Å²	46	130.3 Å²	130.3	47%	0.474	68%	0.677	S	S	.	*			trans	46.8	96.4	171.6	0	0	0	0	0	114.9	I19 E23	I19-G21 VanDerWaalsContact C-N 3.31Å; I19-G21 PolarHBondContact O-N 3.43Å; G21-E23 VanDerWaalsContact C-N 3.3Å; G21-E23 PolarHBondContact O-N 2.8Å
22	T	48.8	Very low	45	Very low	76 Å²	76	124.7 Å²	124.7	47%	0.466	66%	0.655	S	S	.	*			trans	-65.3	86.9	172.9	51.2	0	0	0	0	111.3	I19	I19-T22 HydrophobicContact CG2-CG2 3.35Å
23	E	53.5	Low	45.4	Very low	128 Å²	128	125 Å²	125	60%	0.598	66%	0.659	S	S	*	*			trans	-74.6	120.4	160.7	-169.3	-169.3	162.5	0	0	108.1	G21 R25	G21-E23 VanDerWaalsContact C-N 3.3Å; G21-E23 PolarHBondContact O-N 2.8Å; E23-R25 VanDerWaalsContact CD-NE 3.29Å; E23-R25 HydrophobicContact CG-CG 4.3Å; E23-R25 WeakPolarHBondContact OE1-CG 3.34Å; E23-R25 IonicContact OE1-CZ 3.9Å; E23-R25 IonicContact OE1-NE 2.87Å; E23-R25 PolarHBondContact OE1-NE 2.8Å; E23-R25 IonicContact OE1-NH2 2.84Å; E23-R25 PolarHBondContact OE1-NH2 2.94Å; E23-R25 IonicContact OE2-CZ 3.49Å; E23-R25 IonicContact OE2-NE 2.86Å; E23-R25 PolarHBondContact OE2-NE 3.3Å; E23-R25 IonicContact OE2-NH2 2.66Å; E23-R25 PolarHBondContact OE2-NH2 3.01Å
24	V	55.9	Low	45.6	Very low	106 Å²	106	118.9 Å²	118.9	64%	0.642	65%	0.651	S	S	*	*			trans	-101.9	108.3	175.8	-178.3	0	0	0	0	108.6	I26	V24-I26 HydrophobicContact CG1-CG1 4.32Å
25	R	55.9	Low	45.5	Very low	181 Å²	181	116.6 Å²	116.6	68%	0.683	64%	0.643	S	S	*	*			trans	-96	120.9	176.3	-65.3	-175.3	-178.8	174.9	8.2	110.6	E23	E23-R25 VanDerWaalsContact CD-NE 3.29Å; E23-R25 HydrophobicContact CG-CG 4.3Å; E23-R25 WeakPolarHBondContact OE1-CG 3.34Å; E23-R25 IonicContact OE1-CZ 3.9Å; E23-R25 IonicContact OE1-NE 2.87Å; E23-R25 PolarHBondContact OE1-NE 2.8Å; E23-R25 IonicContact OE1-NH2 2.84Å; E23-R25 PolarHBondContact OE1-NH2 2.94Å; E23-R25 IonicContact OE2-CZ 3.49Å; E23-R25 IonicContact OE2-NE 2.86Å; E23-R25 PolarHBondContact OE2-NE 3.3Å; E23-R25 IonicContact OE2-NH2 2.66Å; E23-R25 PolarHBondContact OE2-NH2 3.01Å
26	I	59.7	Low	45.3	Very low	133 Å²	133	114.3 Å²	114.3	68%	0.682	63%	0.633	S	S	*	*			trans	-108.4	112.4	175.7	-55.1	177.3	0	0	0	108.2	V24 L28	V24-I26 HydrophobicContact CG1-CG1 4.32Å; I26-L28 PolarHBondContact O-N 3.27Å
27	P	53.9	Low	45.1	Very low	120 Å²	120	118.7 Å²	118.7	78%	0.779	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-68.8	124.9	178.2	27.4	-32.7	0	0	0	110.6
28	L	57.6	Low	45	Very low	122 Å²	122	115.5 Å²	115.5	64%	0.639	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-89.5	133	174.2	-59.6	177.7	0	0	0	110.2	I26 I455	I26-L28 PolarHBondContact O-N 3.27Å; L28-I455 HydrophobicContact CD1-CG2 4.15Å
29	R	55.7	Low	44.7	Very low	240 Å²	240	117.8 Å²	117.8	91%	0.906	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-93.2	129	172.7	-70.3	-175.1	179	179	0.8	110.1
30	T	53.5	Low	44.2	Very low	85 Å²	85	118.5 Å²	118.5	52%	0.521	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-98.7	129.2	170.5	59.3	0	0	0	0	108.6	K457	T30-K457 HydrophobicContact CG2-CD 4.11Å; T30-K457 VanDerWaalsContact CG2-CE 3.47Å; T30-K457 HydrophobicContact CG2-CG 4.35Å
31	V	50.7	Low	43.9	Very low	81 Å²	81	117.3 Å²	117.3	49%	0.491	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-100.1	135.2	175.4	-173.5	0	0	0	0	109.6	P418	V31-P418 HydrophobicContact CB-CB 3.49Å; V31-P418 VanDerWaalsContact CB-CB 3.49Å; V31-P418 HydrophobicContact CB-CG 3.44Å; V31-P418 VanDerWaalsContact CB-CG 3.44Å; V31-P418 HydrophobicContact CG1-CB 3.34Å; V31-P418 HydrophobicContact CG1-CG 3.72Å; V31-P418 HydrophobicContact CG2-CB 3.76Å; V31-P418 HydrophobicContact CG2-CG 4.01Å
32	D	46.1	Very low	43.2	Very low	74 Å²	74	120.6 Å²	120.6	40%	0.396	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-83	116.3	176.7	-149.4	-42	0	0	0	108.6	G34 T35 K460	D32-G34 PolarHBondContact O-N 2.97Å; D32-T35 HydrophobicContact CB-CG2 4.15Å; D32-T35 VanDerWaalsContact CB-OG1 3.31Å; D32-T35 WeakPolarHBondContact CB-OG1 3.48Å; D32-T35 PolarHBondContact O-N 3.26Å; D32-T35 PolarHBondContact O-OG1 2.94Å; D32-K460 IonicContact OD2-NZ 2.86Å; D32-K460 PolarHBondContact OD2-NZ 2.81Å
33	A	45.9	Very low	42.3	Very low	84 Å²	84	124.2 Å²	124.2	69%	0.694	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-22.9	-178.9	0	0	0	0	0	112.5	T36	A33-T36 PolarHBondContact O-OG1 3.14Å
34	G	37.4	Very low	41.2	Very low	67 Å²	67	125.4 Å²	125.4	69%	0.691	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-8.7	176.5	0	0	0	0	0	116	D32	D32-G34 PolarHBondContact O-N 2.97Å
35	T	32.9	Very low	39.7	Very low	98 Å²	98	126.7 Å²	126.7	60%	0.601	68%	0.677	S	S	*	*			trans	-110.1	11	-179.5	64	0	0	0	0	114.2	D32 R37	D32-T35 HydrophobicContact CB-CG2 4.15Å; D32-T35 VanDerWaalsContact CB-OG1 3.31Å; D32-T35 WeakPolarHBondContact CB-OG1 3.48Å; D32-T35 PolarHBondContact O-N 3.26Å; D32-T35 PolarHBondContact O-OG1 2.94Å; T35-R37 PolarHBondContact O-N 2.95Å; T35-R37 VanDerWaalsContact O-N 3.09Å
36	T	33.4	Very low	38.4	Very low	65 Å²	65	124.7 Å²	124.7	40%	0.399	68%	0.68	S	S	.	*	S	Bend	trans	-46.5	124.1	150	38.2	0	0	0	0	106.4	A33 S38	A33-T36 PolarHBondContact O-OG1 3.14Å; T36-S38 PolarHBondContact O-N 3.22Å
37	R	27.9	Very low	37.2	Very low	231 Å²	231	127 Å²	127	87%	0.872	69%	0.688	S	S	*	*			trans	-60	82	-176.1	-83.8	177.6	168.9	-179.5	-3.2	109.6	T35 K39	T35-R37 PolarHBondContact O-N 2.95Å; T35-R37 VanDerWaalsContact O-N 3.09Å; R37-K39 PolarHBondContact O-N 3.34Å
38	S	29.7	Very low	36.1	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	69%	0.689	S	S	*	*			trans	-86	35.3	160.4	173.7	0	0	0	0	109.1	T36 N40	T36-S38 PolarHBondContact O-N 3.22Å; S38-N40 PolarHBondContact O-N 2.83Å
39	K	25.3	Very low	34.8	Very low	186 Å²	186	128 Å²	128	81%	0.809	69%	0.688	S	S	*	*	S	Bend	trans	-87.9	99.8	161.5	-77.8	-168.4	175.6	-175.2	0	105.9	R37	R37-K39 PolarHBondContact O-N 3.34Å
40	N	25.6	Very low	33.7	Very low	142 Å²	142	123 Å²	123	76%	0.759	68%	0.679	S	S	*	*	S	Bend	trans	74.7	47.3	164.2	-53.1	-6.3	0	0	0	117.1	S38	S38-N40 PolarHBondContact O-N 2.83Å
41	V	28.9	Very low	32.7	Very low	92 Å²	92	125.6 Å²	125.6	56%	0.558	68%	0.683	S	S	*	*			trans	-96.2	8.8	169.5	-169.7	0	0	0	0	112.3	E43	V41-E43 VanDerWaalsContact C-N 3.28Å
42	S	29	Very low	32.2	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	68%	0.678	S	S	*	*	S	Bend	trans	-78.4	-10.6	169.1	61.5	0	0	0	0	113.4
43	E	29.4	Very low	32.1	Very low	153 Å²	153	127.9 Å²	127.9	72%	0.715	69%	0.691	S	S	*	*	S	Bend	trans	-138	112.8	-179.1	-68.7	-178.1	168.9	0	0	110.2	V41	V41-E43 VanDerWaalsContact C-N 3.28Å
44	N	30.8	Very low	32.3	Very low	153 Å²	153	123.9 Å²	123.9	82%	0.818	66%	0.658	S	S	*	*			trans	72.5	73.7	167.4	-57.2	-25.1	0	0	0	117.7
45	M	25.6	Very low	32.9	Very low	132 Å²	132	122.9 Å²	122.9	65%	0.65	64%	0.636	S	S	*	*			trans	-131.4	104.9	146.1	-72.2	-165.4	72.3	0	0	110.6
46	N	26.9	Very low	34.4	Very low	140 Å²	140	118.9 Å²	118.9	75%	0.749	61%	0.61	S	S	*	*			trans	-61	145.1	173.5	-75.9	-22.3	0	0	0	111.2	Q48	N46-Q48 PolarHBondContact O-N 2.98Å
47	E	34.4	Very low	35.9	Very low	182 Å²	182	119.9 Å²	119.9	85%	0.85	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	4.1	-173.5	-133	176.3	-176.2	0	0	117
48	Q	31.7	Very low	37.3	Very low	171 Å²	171	108.9 Å²	108.9	80%	0.799	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-8	-170.6	-89.5	-175.8	-19.5	0	0	116.4	N46	N46-Q48 PolarHBondContact O-N 2.98Å
49	S	30.6	Very low	38.2	Very low	90 Å²	90	105.2 Å²	105.2	63%	0.629	54%	0.535	S	S	*	.	S	Bend	trans	-102.9	1.6	-165.8	-44.4	0	0	0	0	117
50	L	32.5	Very low	39.2	Very low	137 Å²	137	96.7 Å²	96.7	72%	0.717	50%	0.498	S	S	*	.			trans	-107.1	74.8	176.7	-73.4	166	0	0	0	110.9
51	K	31.4	Very low	40.1	Very low	138 Å²	138	91.5 Å²	91.5	60%	0.6	47%	0.468	S	S	*	.			trans	-88.2	100.2	169.8	-82.7	-174.7	170	-174.1	0	109.3	V144	K51-V144 HydrophobicContact CB-CG1 3.48Å; K51-V144 VanDerWaalsContact CB-CG1 3.48Å; K51-V144 HydrophobicContact CD-CG1 3.72Å; K51-V144 HydrophobicContact CG-CG1 3.63Å
52	L	40.5	Very low	40.9	Very low	74 Å²	74	88.6 Å²	88.6	39%	0.387	45%	0.454	S	S	.	.			trans	-61.7	144.5	169.1	-103.8	91.2	0	0	0	110.5	G54 Q55 V144 W415	L52-G54 PolarHBondContact O-N 2.84Å; L52-G54 VanDerWaalsContact O-N 3.13Å; L52-Q55 HydrophobicContact CB-CB 4.01Å; L52-Q55 HydrophobicContact CB-CG 4.22Å; L52-Q55 PolarHBondContact O-N 3.37Å; L52-V144 WeakPolarHBondContact O-CG1 3.47Å; L52-W415 HydrophobicContact CD1-CE3 3.83Å; L52-W415 HydrophobicContact CD1-CH2 3.73Å; L52-W415 HydrophobicContact CD1-CZ3 3.05Å; L52-W415 HydrophobicContact CG-CZ3 4.48Å
53	L	43.8	Very low	41.8	Very low	129 Å²	129	83.9 Å²	83.9	68%	0.675	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	117.2	172.8	-81.9	158.4	0	0	0	110.8	Q55 N145 L146	L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.66Å; L53-N145 WeakPolarHBondContact CA-ND2 3.01Å; L53-N145 VanDerWaalsContact CA-OD1 3.29Å; L53-N145 WeakPolarHBondContact CA-OD1 3.25Å; L53-N145 WeakPolarHBondContact CD2-ND2 3.22Å; L53-N145 WeakPolarHBondContact CG-ND2 3.44Å; L53-L146 HydrophobicContact CD2-CD2 4.25Å
54	G	50.4	Low	42.8	Very low	0 Å²	0	77.8 Å²	77.8	0%	0	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	10.5	171.9	0	0	0	0	0	117.6	L52 N145 V243	L52-G54 PolarHBondContact O-N 2.84Å; L52-G54 VanDerWaalsContact O-N 3.13Å; G54-N145 PolarHBondContact N-OD1 2.88Å; G54-V243 PolarHBondContact O-N 3.47Å
55	Q	50.7	Low	44.2	Very low	47 Å²	47	70.9 Å²	70.9	22%	0.22	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	106.4	177.7	-75	-171.2	-5.6	0	0	111.8	L52 L53 V144 L240 L241 T242	L52-Q55 HydrophobicContact CB-CB 4.01Å; L52-Q55 HydrophobicContact CB-CG 4.22Å; L52-Q55 PolarHBondContact O-N 3.37Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.66Å; Q55-V144 VanDerWaalsContact O-CG2 3.28Å; Q55-V144 WeakPolarHBondContact O-CG2 3.29Å; Q55-L240 HydrophobicContact CB-CD1 4.18Å; Q55-L240 HydrophobicContact CG-CD2 4.45Å; Q55-L241 CarbonylContact C-O 3.54Å; Q55-L241 WeakPolarHBondContact CA-O 3.37Å; Q55-T242 HydrophobicContact CG-CG2 4.17Å
56	Q	64.9	Low	46.5	Very low	13 Å²	13	64.6 Å²	64.6	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.3	175.6	177.7	57.8	44.9	0	0	110.6	D69 M143 V144 L241	Q56-D69 PolarHBondContact OE1-O 3.35Å; Q56-M143 HydrophobicContact CB-CG 3.66Å; Q56-M143 HydrophobicContact CB-SD 3.5Å; Q56-M143 WeakPolarHBondContact CB-SD 3.38Å; Q56-M143 HydrophobicContact CG-CG 4.07Å; Q56-M143 HydrophobicContact CG-SD 4.16Å; Q56-V144 HydrophobicContact CB-CG2 4.22Å; Q56-V144 VanDerWaalsContact OE1-CG2 3.22Å; Q56-L241 HydrophobicContact CB-CB 4.3Å; Q56-L241 PolarHBondContact N-O 2.82Å; Q56-L241 PolarHBondContact O-N 3.19Å
57	R	65.1	Low	48.9	Very low	86 Å²	86	58 Å²	58	33%	0.325	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	136	170.1	-67.2	-178.8	-178.9	-165.9	12	109.8	E237	R57-E237 WeakPolarHBondContact CD-OE1 3.5Å; R57-E237 WeakPolarHBondContact CD-OE2 3.41Å; R57-E237 IonicContact CZ-OE1 3.99Å; R57-E237 IonicContact CZ-OE2 3.35Å; R57-E237 IonicContact NE-OE1 3.86Å; R57-E237 PolarHBondContact NE-OE1 3.2Å; R57-E237 IonicContact NE-OE2 2.67Å; R57-E237 IonicContact NH1-OE1 3.41Å; R57-E237 IonicContact NH1-OE2 3.2Å; R57-E237 PolarHBondContact NH1-OE2 2.96Å
58	L	56.3	Low	51.3	Low	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.2	176	-54.6	174.1	0	0	0	109.1	T66 I67 I83 I204 S238 G239 L241	L58-T66 HydrophobicContact CB-CG2 4.02Å; L58-T66 HydrophobicContact CD1-CG2 3.57Å; L58-T66 HydrophobicContact CD2-CG2 3.8Å; L58-T66 HydrophobicContact CG-CG2 3.97Å; L58-I67 CarbonylContact C-O 3.55Å; L58-I67 VanDerWaalsContact CA-O 3.31Å; L58-I67 WeakPolarHBondContact CA-O 3.45Å; L58-I83 HydrophobicContact CD2-CG1 3.8Å; L58-I204 HydrophobicContact CD1-CG2 4.19Å; L58-S238 PolarHBondContact O-N 3.17Å; L58-S238 PolarHBondContact O-OG 3.44Å; L58-G239 PolarHBondContact N-O 3.32Å; L58-L241 HydrophobicContact CD1-CB 4.17Å; L58-L241 HydrophobicContact CD2-CB 3.95Å; L58-L241 HydrophobicContact CG-CB 4.27Å
59	Y	48.6	Very low	53.9	Low	30 Å²	30	43.6 Å²	43.6	12%	0.118	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130	177.1	-62.3	-71.9	0	0	0	109.3	I67 G235	Y59-I67 PolarHBondContact N-O 2.98Å; Y59-I67 PolarHBondContact O-N 2.76Å; Y59-I67 VanDerWaalsContact O-N 3.16Å; Y59-G235 WeakPolarHBondContact CD1-O 3.33Å
60	D	47.1	Very low	56.8	Low	6 Å²	6	39.4 Å²	39.4	3%	0.032	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.9	168.7	-144.4	-55.6	0	0	0	111.7	N63 I64 K206 G235 I236 S238	D60-N63 VanDerWaalsContact CG-CA 3.42Å; D60-N63 WeakPolarHBondContact OD1-CA 3.36Å; D60-N63 PolarHBondContact OD1-N 3.06Å; D60-I64 PolarHBondContact OD1-N 2.82Å; D60-K206 IonicContact OD2-NZ 2.8Å; D60-K206 PolarHBondContact OD2-NZ 2.89Å; D60-G235 WeakPolarHBondContact O-CA 3.27Å; D60-I236 PolarHBondContact N-O 2.83Å; D60-I236 PolarHBondContact O-N 2.66Å; D60-S238 VanDerWaalsContact CB-OG 3.32Å; D60-S238 WeakPolarHBondContact CB-OG 3.32Å; D60-S238 PolarHBondContact N-OG 2.8Å
61	Y	44.1	Very low	59.8	Low	33 Å²	33	34.3 Å²	34.3	13%	0.129	17%	0.168	C	C	.	.	S	Bend	trans	-109.6	103.5	166	-74.3	-99.4	0	0	0	109.5	N63 I64 I67 P167 A232	Y61-N63 VanDerWaalsContact C-N 3.26Å; Y61-N63 PolarHBondContact O-N 3.15Å; Y61-I64 WeakPolarHBondContact O-CB 3.29Å; Y61-I64 PolarHBondContact O-N 2.85Å; Y61-I67 HydrophobicContact CD2-CD1 3.34Å; Y61-I67 HydrophobicContact CD2-CG1 4.43Å; Y61-I67 HydrophobicContact CE2-CD1 3.73Å; Y61-I67 HydrophobicContact CG-CD1 4.12Å; Y61-P167 HydrophobicContact CD1-CB 3.43Å; Y61-P167 VanDerWaalsContact CD1-CB 3.43Å; Y61-P167 HydrophobicContact CD1-CG 3.89Å; Y61-P167 HydrophobicContact CD2-CB 4.19Å; Y61-P167 HydrophobicContact CD2-CG 4.26Å; Y61-P167 HydrophobicContact CE1-CB 3.72Å; Y61-P167 HydrophobicContact CE2-CB 4.42Å; Y61-P167 HydrophobicContact CG-CB 3.67Å; Y61-P167 HydrophobicContact CG-CG 3.66Å; Y61-A232 HydrophobicContact CD1-CB 3.95Å; Y61-A232 HydrophobicContact CE1-CB 4.33Å
62	A	45.9	Very low	63	Low	31 Å²	31	27.8 Å²	27.8	26%	0.256	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	28.6	176.5	0	0	0	0	0	115.4	I64	A62-I64 VanDerWaalsContact C-N 3.27Å; A62-I64 HydrophobicContact CB-CD1 4.16Å; A62-I64 HydrophobicContact CB-CG1 4.13Å; A62-I64 WeakPolarHBondContact O-CG1 3.49Å
63	N	47.6	Very low	65.6	Low	16 Å²	16	24.4 Å²	24.4	9%	0.086	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	8.9	-172.3	-52.5	-70	0	0	0	114.9	D60 Y61 Q209 K210 L211 E212 L301	D60-N63 VanDerWaalsContact CG-CA 3.42Å; D60-N63 WeakPolarHBondContact OD1-CA 3.36Å; D60-N63 PolarHBondContact OD1-N 3.06Å; Y61-N63 VanDerWaalsContact C-N 3.26Å; Y61-N63 PolarHBondContact O-N 3.15Å; N63-Q209 PolarHBondContact OD1-OE1 3.18Å; N63-K210 PolarHBondContact ND2-O 2.96Å; N63-K210 VanDerWaalsContact ND2-O 3.12Å; N63-L211 HydrophobicContact CB-CD2 3.88Å; N63-E212 PolarHBondContact ND2-N 3.06Å; N63-L301 WeakPolarHBondContact O-CD2 3.15Å
64	I	50.2	Low	68.2	Low	26 Å²	26	21 Å²	21	13%	0.133	11%	0.108	C	C	.	.	S	Bend	trans	-97.8	-38.1	-165.2	-48.5	-174.2	0	0	0	113.5	D60 Y61 A62 L216 F229 L301	D60-I64 PolarHBondContact OD1-N 2.82Å; Y61-I64 WeakPolarHBondContact O-CB 3.29Å; Y61-I64 PolarHBondContact O-N 2.85Å; A62-I64 VanDerWaalsContact C-N 3.27Å; A62-I64 HydrophobicContact CB-CD1 4.16Å; A62-I64 HydrophobicContact CB-CG1 4.13Å; A62-I64 WeakPolarHBondContact O-CG1 3.49Å; I64-L216 HydrophobicContact CD1-CD1 4.33Å; I64-L216 HydrophobicContact CD1-CG 4.44Å; I64-F229 HydrophobicContact CD1-CE1 4.36Å; I64-F229 HydrophobicContact CD1-CZ 4.47Å; I64-L301 HydrophobicContact CB-CD1 4.23Å; I64-L301 HydrophobicContact CB-CD2 4.3Å; I64-L301 HydrophobicContact CB-CG 4.29Å; I64-L301 HydrophobicContact CG1-CD1 4.07Å; I64-L301 HydrophobicContact CG1-CD2 4.29Å; I64-L301 HydrophobicContact CG1-CG 4.5Å; I64-L301 HydrophobicContact CG2-CD1 3.72Å; I64-L301 HydrophobicContact CG2-CG 3.96Å
65	L	60.9	Low	70.4	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.042	13%	0.134	C	C	.	.			trans	-139.2	122.3	-162.1	-64.4	159.3	0	0	0	110.8	I67 M82 F166 P167 Y168	L65-I67 HydrophobicContact CB-CD1 3.93Å; L65-I67 HydrophobicContact CB-CG1 4.04Å; L65-I67 PolarHBondContact O-N 3.13Å; L65-M82 HydrophobicContact CD2-CG 4.32Å; L65-M82 HydrophobicContact CD2-SD 3.63Å; L65-F166 HydrophobicContact CD1-CD1 4.03Å; L65-P167 HydrophobicContact CD1-CG 3.73Å; L65-Y168 HydrophobicContact CD1-CD1 3.8Å; L65-Y168 HydrophobicContact CD1-CE1 3.6Å; L65-Y168 HydrophobicContact CD2-CD1 4.43Å; L65-Y168 HydrophobicContact CD2-CE1 3.79Å; L65-Y168 HydrophobicContact CG-CE1 4.23Å
66	T	72.8	Confident	72.6	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	101.6	170.7	-59.8	0	0	0	0	108.9	L58 I83 S298	L58-T66 HydrophobicContact CB-CG2 4.02Å; L58-T66 HydrophobicContact CD1-CG2 3.57Å; L58-T66 HydrophobicContact CD2-CG2 3.8Å; L58-T66 HydrophobicContact CG-CG2 3.97Å; T66-I83 HydrophobicContact CG2-CB 4.04Å; T66-I83 HydrophobicContact CG2-CG1 4.34Å; T66-I83 PolarHBondContact O-N 3.21Å; T66-S298 WeakPolarHBondContact CB-O 3.43Å; T66-S298 PolarHBondContact OG1-O 3.04Å; T66-S298 VanDerWaalsContact OG1-O 3.06Å
67	I	77.9	Confident	74.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.3	-176	-67.4	162.4	0	0	0	110.8	L58 Y59 Y61 L65 V81 P167 Y168	L58-I67 CarbonylContact C-O 3.55Å; L58-I67 VanDerWaalsContact CA-O 3.31Å; L58-I67 WeakPolarHBondContact CA-O 3.45Å; Y59-I67 PolarHBondContact N-O 2.98Å; Y59-I67 PolarHBondContact O-N 2.76Å; Y59-I67 VanDerWaalsContact O-N 3.16Å; Y61-I67 HydrophobicContact CD2-CD1 3.34Å; Y61-I67 HydrophobicContact CD2-CG1 4.43Å; Y61-I67 HydrophobicContact CE2-CD1 3.73Å; Y61-I67 HydrophobicContact CG-CD1 4.12Å; L65-I67 HydrophobicContact CB-CD1 3.93Å; L65-I67 HydrophobicContact CB-CG1 4.04Å; L65-I67 PolarHBondContact O-N 3.13Å; I67-V81 WeakPolarHBondContact CA-O 3.16Å; I67-P167 HydrophobicContact CD1-CB 4.27Å; I67-P167 HydrophobicContact CD1-CG 3.89Å; I67-Y168 HydrophobicContact CD1-CD1 4.16Å; I67-Y168 HydrophobicContact CG1-CD1 4.42Å
68	G	83.6	Confident	75.6	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	159.9	170.8	0	0	0	0	0	111.2	V81	G68-V81 PolarHBondContact N-O 2.92Å; G68-V81 WeakPolarHBondContact O-CG2 3.37Å; G68-V81 PolarHBondContact O-N 3.3Å
69	D	87.4	Confident	77.4	Confident	51 Å²	51	26.5 Å²	26.5	27%	0.273	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	135.6	176	-69.3	-28.9	0	0	0	110.6	Q56 F79 S80	Q56-D69 PolarHBondContact OE1-O 3.35Å; D69-F79 WeakPolarHBondContact CA-O 3.39Å; D69-S80 PolarHBondContact OD1-OG 3.32Å
70	I	92	Very high	79.2	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	162.7	169.3	62.5	170.1	0	0	0	109.6	I72 T78 F79 V81 I141 C142 M143 L172	I70-I72 HydrophobicContact CD1-CD1 4.04Å; I70-I72 HydrophobicContact CD1-CG1 4.18Å; I70-T78 CarbonylContact O-C 3.46Å; I70-T78 WeakPolarHBondContact O-CA 3.26Å; I70-F79 HydrophobicContact CG1-CB 4.25Å; I70-F79 PolarHBondContact N-O 2.87Å; I70-F79 PolarHBondContact O-N 3.25Å; I70-V81 HydrophobicContact CB-CG2 4.46Å; I70-V81 HydrophobicContact CD1-CB 4.48Å; I70-V81 HydrophobicContact CD1-CG1 3.72Å; I70-V81 HydrophobicContact CD1-CG2 3.99Å; I70-V81 HydrophobicContact CG1-CG1 3.87Å; I70-V81 HydrophobicContact CG1-CG2 3.88Å; I70-V81 HydrophobicContact CG2-CG2 3.88Å; I70-I141 HydrophobicContact CB-CG2 4.39Å; I70-I141 HydrophobicContact CD1-CG2 4.08Å; I70-C142 CarbonylContact C-O 3.49Å; I70-C142 VanDerWaalsContact CA-O 3.31Å; I70-C142 WeakPolarHBondContact CA-O 3.2Å; I70-M143 HydrophobicContact CG2-CE 4.49Å; I70-L172 HydrophobicContact CG2-CD2 4.27Å
71	T	95.6	Very high	81.2	Confident	30 Å²	30	26.3 Å²	26.3	18%	0.184	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.5	166.2	65.2	0	0	0	0	110.9	P76 Q77 T78 I141 C142	T71-P76 HydrophobicContact CG2-CB 4.14Å; T71-Q77 CarbonylContact C-O 3.57Å; T71-Q77 WeakPolarHBondContact CA-O 3.42Å; T71-T78 HydrophobicContact CG2-CG2 4.45Å; T71-I141 CarbonylContact O-C 3.43Å; T71-I141 WeakPolarHBondContact O-CA 3.4Å; T71-C142 PolarHBondContact N-O 2.82Å; T71-C142 PolarHBondContact O-N 2.88Å; T71-C142 WeakPolarHBondContact OG1-CB 3.07Å
72	I	97	Very high	83.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.2	179	-51.1	-178.3	0	0	0	108.6	I70 Q77 F79 I92 F108 D139 S140 I141 F153	I70-I72 HydrophobicContact CD1-CD1 4.04Å; I70-I72 HydrophobicContact CD1-CG1 4.18Å; I72-Q77 PolarHBondContact N-O 3.04Å; I72-Q77 WeakPolarHBondContact O-CB 3.37Å; I72-Q77 PolarHBondContact O-N 2.97Å; I72-F79 HydrophobicContact CB-CD2 4.34Å; I72-F79 HydrophobicContact CB-CE2 4.02Å; I72-F79 HydrophobicContact CD1-CD2 3.99Å; I72-F79 HydrophobicContact CD1-CE2 4.19Å; I72-F79 HydrophobicContact CG1-CD2 3.95Å; I72-F79 HydrophobicContact CG1-CE2 4.11Å; I72-I92 HydrophobicContact CD1-CB 4.42Å; I72-I92 HydrophobicContact CD1-CG1 3.73Å; I72-I92 HydrophobicContact CD1-CG2 3.79Å; I72-F108 HydrophobicContact CB-CD2 4.19Å; I72-F108 HydrophobicContact CB-CE2 3.97Å; I72-F108 HydrophobicContact CG2-CD2 4.11Å; I72-F108 HydrophobicContact CG2-CE2 3.58Å; I72-F108 HydrophobicContact CG2-CZ 3.9Å; I72-D139 HydrophobicContact CG2-CB 3.89Å; I72-S140 WeakPolarHBondContact CA-O 3.39Å; I72-I141 HydrophobicContact CD1-CD1 4.13Å; I72-I141 HydrophobicContact CD1-CG1 4.37Å; I72-I141 HydrophobicContact CG1-CD1 4.3Å; I72-I141 HydrophobicContact CG1-CG1 4.01Å; I72-I141 HydrophobicContact CG1-CG2 4.46Å; I72-I141 HydrophobicContact CG2-CG1 4.24Å; I72-F153 HydrophobicContact CG2-CE1 4.19Å; I72-F153 HydrophobicContact CG2-CZ 4.19Å
73	G	96.6	Very high	85.2	Confident	4 Å²	4	23.9 Å²	23.9	4%	0.041	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	173.6	171.6	0	0	0	0	0	116.3	P75 P76 S113 D139 S140	G73-P75 CarbonylContact C-O 3.54Å; G73-P75 VanDerWaalsContact C-O 3.28Å; G73-P75 CarbonylContact O-C 3.5Å; G73-P76 WeakPolarHBondContact O-CA 3.4Å; G73-S113 WeakPolarHBondContact CA-OG 3.48Å; G73-D139 WeakPolarHBondContact CA-OD1 3.46Å; G73-D139 WeakPolarHBondContact CA-OD2 3.2Å; G73-S140 PolarHBondContact N-O 2.86Å
74	T	96.6	Very high	87.2	Confident	56 Å²	56	23.5 Å²	23.5	34%	0.344	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	103.4	174.3	-56.9	0	0	0	0	110.5	S113 S114 T115	T74-S113 PolarHBondContact N-OG 2.61Å; T74-S113 WeakPolarHBondContact O-CA 3.48Å; T74-S114 WeakPolarHBondContact CB-OG 3.44Å; T74-S114 PolarHBondContact O-N 3.48Å; T74-S114 PolarHBondContact O-OG 3.02Å; T74-T115 WeakPolarHBondContact CB-OG1 3.37Å; T74-T115 PolarHBondContact N-OG1 3.46Å; T74-T115 PolarHBondContact OG1-OG1 2.77Å
75	P	97.3	Very high	89	Confident	87 Å²	87	22.3 Å²	22.3	57%	0.565	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	cis	-70.8	158.1	7.3	30.5	-36.5	0	0	0	113.8	G73 Q77 L112	G73-P75 CarbonylContact C-O 3.54Å; G73-P75 VanDerWaalsContact C-O 3.28Å; G73-P75 CarbonylContact O-C 3.5Å; P75-Q77 PolarHBondContact O-N 3.05Å; P75-L112 WeakPolarHBondContact CD-O 3.38Å
76	P	97.1	Very high	90.2	Very high	86 Å²	86	22.9 Å²	22.9	56%	0.558	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	131.5	-175.6	-18.1	31.2	0	0	0	113.3	T71 G73	T71-P76 HydrophobicContact CG2-CB 4.14Å; G73-P76 WeakPolarHBondContact O-CA 3.4Å
77	Q	97.5	Very high	90.9	Very high	23 Å²	23	23.8 Å²	23.8	11%	0.107	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.7	170.1	-59.9	174.5	53.2	0	0	109	T71 I72 P75 F79 F108 D109	T71-Q77 CarbonylContact C-O 3.57Å; T71-Q77 WeakPolarHBondContact CA-O 3.42Å; I72-Q77 PolarHBondContact N-O 3.04Å; I72-Q77 WeakPolarHBondContact O-CB 3.37Å; I72-Q77 PolarHBondContact O-N 2.97Å; P75-Q77 PolarHBondContact O-N 3.05Å; Q77-F79 HydrophobicContact CB-CE2 3.66Å; Q77-F79 HydrophobicContact CB-CZ 3.87Å; Q77-F79 VanDerWaalsContact O-CD2 3.25Å; Q77-F79 WeakPolarHBondContact O-CD2 3.01Å; Q77-F79 WeakPolarHBondContact O-CE2 3.17Å; Q77-F108 HydrophobicContact CB-CD2 4.47Å; Q77-D109 PolarHBondContact NE2-O 3.47Å
78	T	95.2	Very high	91.3	Very high	66 Å²	66	24 Å²	24	41%	0.405	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	138.8	-176.8	-47.8	0	0	0	0	112.8	I70 T71 K106	I70-T78 CarbonylContact O-C 3.46Å; I70-T78 WeakPolarHBondContact O-CA 3.26Å; T71-T78 HydrophobicContact CG2-CG2 4.45Å; T78-K106 WeakPolarHBondContact O-CD 3.27Å; T78-K106 WeakPolarHBondContact O-CE 3.4Å; T78-K106 PolarHBondContact O-NZ 3.04Å
79	F	93.4	Very high	91.4	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.3	174.1	-58.4	-84.1	0	0	0	110.1	D69 I70 I72 Q77 V81 I92 K106 F108 D169	D69-F79 WeakPolarHBondContact CA-O 3.39Å; I70-F79 HydrophobicContact CG1-CB 4.25Å; I70-F79 PolarHBondContact N-O 2.87Å; I70-F79 PolarHBondContact O-N 3.25Å; I72-F79 HydrophobicContact CB-CD2 4.34Å; I72-F79 HydrophobicContact CB-CE2 4.02Å; I72-F79 HydrophobicContact CD1-CD2 3.99Å; I72-F79 HydrophobicContact CD1-CE2 4.19Å; I72-F79 HydrophobicContact CG1-CD2 3.95Å; I72-F79 HydrophobicContact CG1-CE2 4.11Å; Q77-F79 HydrophobicContact CB-CE2 3.66Å; Q77-F79 HydrophobicContact CB-CZ 3.87Å; Q77-F79 VanDerWaalsContact O-CD2 3.25Å; Q77-F79 WeakPolarHBondContact O-CD2 3.01Å; Q77-F79 WeakPolarHBondContact O-CE2 3.17Å; F79-V81 HydrophobicContact CB-CG1 4.21Å; F79-I92 HydrophobicContact CG-CG2 4.32Å; F79-K106 HydrophobicContact CD1-CB 4.21Å; F79-K106 HydrophobicContact CD1-CD 4.28Å; F79-K106 HydrophobicContact CD1-CG 4.2Å; F79-K106 HydrophobicContact CE1-CB 4.33Å; F79-K106 HydrophobicContact CE1-CD 4.24Å; F79-K106 HydrophobicContact CE1-CG 3.94Å; F79-F108 HydrophobicContact CE1-CB 4.16Å; F79-F108 HydrophobicContact CE2-CB 4.38Å; F79-F108 AromaticContact CE2-CD2 3.92Å; F79-F108 HydrophobicContact CE2-CD2 3.92Å; F79-F108 HydrophobicContact CZ-CB 3.64Å; F79-F108 AromaticContact CZ-CD2 3.82Å; F79-F108 HydrophobicContact CZ-CD2 3.82Å; F79-F108 HydrophobicContact CZ-CG 4.22Å; F79-D169 WeakPolarHBondContact CA-OD2 3.3Å; F79-D169 HydrophobicContact CB-CB 4.27Å; F79-D169 HydrophobicContact CD1-CB 4.14Å
80	S	88.2	Confident	91.7	Very high	32 Å²	32	22.1 Å²	22.1	22%	0.224	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.2	169	-67	0	0	0	0	108.2	D69 Y168 D169	D69-S80 PolarHBondContact OD1-OG 3.32Å; S80-Y168 CarbonylContact O-C 3.57Å; S80-Y168 WeakPolarHBondContact O-CB 3.05Å; S80-D169 PolarHBondContact N-OD2 3.03Å; S80-D169 WeakPolarHBondContact O-CB 3.32Å; S80-D169 PolarHBondContact O-N 3.41Å
81	V	88.8	Confident	91.8	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.2	-172.6	-65.9	0	0	0	0	111.7	I67 G68 I70 F79 I83 I92 G170 L172	I67-V81 WeakPolarHBondContact CA-O 3.16Å; G68-V81 PolarHBondContact N-O 2.92Å; G68-V81 WeakPolarHBondContact O-CG2 3.37Å; G68-V81 PolarHBondContact O-N 3.3Å; I70-V81 HydrophobicContact CB-CG2 4.46Å; I70-V81 HydrophobicContact CD1-CB 4.48Å; I70-V81 HydrophobicContact CD1-CG1 3.72Å; I70-V81 HydrophobicContact CD1-CG2 3.99Å; I70-V81 HydrophobicContact CG1-CG1 3.87Å; I70-V81 HydrophobicContact CG1-CG2 3.88Å; I70-V81 HydrophobicContact CG2-CG2 3.88Å; F79-V81 HydrophobicContact CB-CG1 4.21Å; V81-I83 HydrophobicContact CG2-CD1 4.28Å; V81-I83 PolarHBondContact O-N 3.38Å; V81-I92 HydrophobicContact CG1-CG2 4.44Å; V81-G170 CarbonylContact C-O 3.58Å; V81-G170 VanDerWaalsContact CA-O 3.31Å; V81-G170 WeakPolarHBondContact CA-O 3.33Å; V81-L172 HydrophobicContact CB-CB 4.34Å; V81-L172 HydrophobicContact CG2-CB 3.79Å
82	M	85.7	Confident	91.8	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.059	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.5	168.2	-177.3	178.2	77.7	0	0	109.1	L65 D84 Y168 G170 V171 L172	L65-M82 HydrophobicContact CD2-CG 4.32Å; L65-M82 HydrophobicContact CD2-SD 3.63Å; M82-D84 HydrophobicContact CE-CB 3.89Å; M82-D84 PolarHBondContact O-N 3.01Å; M82-Y168 HydrophobicContact CB-CD1 4.14Å; M82-Y168 HydrophobicContact CB-CD2 4.28Å; M82-Y168 HydrophobicContact CB-CE1 4.22Å; M82-Y168 HydrophobicContact CB-CE2 4.37Å; M82-Y168 HydrophobicContact CB-CG 4.18Å; M82-Y168 HydrophobicContact SD-CE1 4.22Å; M82-G170 PolarHBondContact N-O 3.47Å; M82-V171 HydrophobicContact CB-CG2 4.36Å; M82-V171 HydrophobicContact CE-CB 4.47Å; M82-V171 HydrophobicContact CE-CG1 3.93Å; M82-V171 HydrophobicContact CE-CG2 3.71Å; M82-L172 PolarHBondContact O-N 3.32Å
83	I	87.8	Confident	91.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	111.7	172.7	-52.6	-58.7	0	0	0	107.4	L58 T66 V81 L172 L174 I204 L241 S298	L58-I83 HydrophobicContact CD2-CG1 3.8Å; T66-I83 HydrophobicContact CG2-CB 4.04Å; T66-I83 HydrophobicContact CG2-CG1 4.34Å; T66-I83 PolarHBondContact O-N 3.21Å; V81-I83 HydrophobicContact CG2-CD1 4.28Å; V81-I83 PolarHBondContact O-N 3.38Å; I83-L172 HydrophobicContact CD1-CB 4.26Å; I83-L172 HydrophobicContact CD1-CD2 3.73Å; I83-L174 HydrophobicContact CG2-CD1 3.62Å; I83-I204 HydrophobicContact CG2-CD1 4.43Å; I83-L241 HydrophobicContact CD1-CD2 4.4Å; I83-L241 HydrophobicContact CG2-CD2 4.21Å; I83-S298 WeakPolarHBondContact O-CB 3.19Å; I83-S298 PolarHBondContact O-OG 2.92Å
84	D	88.9	Confident	91.5	Very high	9 Å²	9	20.4 Å²	20.4	5%	0.048	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	104.5	-171.7	-170.6	10.6	0	0	0	112	M82 A86 S87 V171 L172 L174 S299	M82-D84 HydrophobicContact CE-CB 3.89Å; M82-D84 PolarHBondContact O-N 3.01Å; D84-A86 VanDerWaalsContact C-N 3.25Å; D84-A86 PolarHBondContact O-N 2.89Å; D84-A86 PolarHBondContact OD1-N 2.84Å; D84-A86 VanDerWaalsContact OD1-N 3.08Å; D84-S87 WeakPolarHBondContact CB-OG 3.38Å; D84-S87 VanDerWaalsContact OD2-CB 3.23Å; D84-S87 WeakPolarHBondContact OD2-CB 3.16Å; D84-S87 PolarHBondContact OD2-OG 3.16Å; D84-V171 HydrophobicContact CB-CG1 3.74Å; D84-L172 PolarHBondContact N-O 2.89Å; D84-L174 PolarHBondContact O-N 2.91Å; D84-S299 PolarHBondContact OD1-OG 3.16Å
85	T	88.7	Confident	91.2	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.006	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.5	176.3	56.6	0	0	0	0	113.8	L174 F202 I204 V296 S298	T85-L174 HydrophobicContact CG2-CB 4.48Å; T85-L174 HydrophobicContact CG2-CD1 4.48Å; T85-F202 HydrophobicContact CG2-CE2 4.05Å; T85-F202 HydrophobicContact CG2-CZ 4.3Å; T85-I204 HydrophobicContact CG2-CD1 3.45Å; T85-I204 VanDerWaalsContact CG2-CD1 3.45Å; T85-V296 PolarHBondContact OG1-O 2.7Å; T85-S298 PolarHBondContact N-OG 2.87Å; T85-S298 VanDerWaalsContact N-OG 3.11Å; T85-S298 PolarHBondContact OG1-N 2.88Å; T85-S298 VanDerWaalsContact OG1-N 3.15Å; T85-S298 PolarHBondContact OG1-OG 3.18Å
86	A	86	Confident	90.5	Very high	20 Å²	20	25.6 Å²	25.6	17%	0.165	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	2.2	-179.8	0	0	0	0	0	113.4	D84 Y264 I295	D84-A86 VanDerWaalsContact C-N 3.25Å; D84-A86 PolarHBondContact O-N 2.89Å; D84-A86 PolarHBondContact OD1-N 2.84Å; D84-A86 VanDerWaalsContact OD1-N 3.08Å; A86-Y264 VanDerWaalsContact O-CD1 3.3Å; A86-Y264 WeakPolarHBondContact O-CD1 3.4Å; A86-Y264 WeakPolarHBondContact O-CE1 3.25Å; A86-I295 HydrophobicContact CB-CD1 3.93Å
87	S	86.8	Confident	90.1	Very high	19 Å²	19	21.5 Å²	21.5	13%	0.133	11%	0.106	C	C	.	.			trans	-128.3	154	170.7	66	0	0	0	0	111.2	D84 G173 L174 A175	D84-S87 WeakPolarHBondContact CB-OG 3.38Å; D84-S87 VanDerWaalsContact OD2-CB 3.23Å; D84-S87 WeakPolarHBondContact OD2-CB 3.16Å; D84-S87 PolarHBondContact OD2-OG 3.16Å; S87-G173 CarbonylContact O-C 3.53Å; S87-G173 VanDerWaalsContact O-C 3.32Å; S87-G173 WeakPolarHBondContact O-CA 3.17Å; S87-L174 PolarHBondContact O-N 2.93Å; S87-A175 VanDerWaalsContact O-CB 3.27Å; S87-A175 WeakPolarHBondContact O-CB 3.44Å; S87-A175 PolarHBondContact O-N 3.24Å
88	A	86.4	Confident	89.2	Confident	4 Å²	4	22.6 Å²	22.6	3%	0.033	12%	0.117	C	C	.	.			trans	-107	-21.5	-177.4	0	0	0	0	0	113	A175 F176	A88-A175 HydrophobicContact CB-CB 3.92Å; A88-F176 VanDerWaalsContact CB-O 3.3Å; A88-F176 WeakPolarHBondContact CB-O 3.35Å
89	D	86.7	Confident	88.2	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.043	13%	0.132	C	C	.	.			trans	-89.7	122	-174.9	-60	-59.5	0	0	0	110.9	I125 S180 R181 I182	D89-I125 HydrophobicContact CB-CD1 3.6Å; D89-I125 HydrophobicContact CB-CG1 4.41Å; D89-S180 WeakPolarHBondContact OD1-CA 3.4Å; D89-S180 VanDerWaalsContact OD1-CB 3.3Å; D89-S180 WeakPolarHBondContact OD1-CB 3.46Å; D89-S180 PolarHBondContact OD1-OG 2.88Å; D89-R181 VanDerWaalsContact CG-N 3.35Å; D89-R181 PolarHBondContact OD1-N 2.66Å; D89-R181 WeakPolarHBondContact OD2-CB 3.25Å; D89-R181 WeakPolarHBondContact OD2-CG 3.29Å; D89-R181 PolarHBondContact OD2-N 2.9Å; D89-I182 WeakPolarHBondContact OD1-CG1 3.32Å; D89-I182 PolarHBondContact OD1-N 3.37Å
90	T	93.9	Very high	87.4	Confident	4 Å²	4	29.3 Å²	29.3	3%	0.025	14%	0.14	C	C	.	.			trans	-83.7	132.7	167.9	-60.9	0	0	0	0	109.5	I141 F153 V154 V171 L172 G173	T90-I141 HydrophobicContact CG2-CD1 4.22Å; T90-F153 HydrophobicContact CG2-CB 4.05Å; T90-F153 CarbonylContact O-C 3.52Å; T90-F153 WeakPolarHBondContact O-CA 3.37Å; T90-F153 WeakPolarHBondContact O-CB 3.37Å; T90-V154 PolarHBondContact O-N 2.88Å; T90-V171 CarbonylContact C-O 3.48Å; T90-V171 VanDerWaalsContact CA-O 3.24Å; T90-V171 WeakPolarHBondContact CA-O 3.43Å; T90-V171 WeakPolarHBondContact CG2-O 3.13Å; T90-L172 HydrophobicContact CG2-CD1 3.96Å; T90-G173 PolarHBondContact OG1-N 3.16Å
91	W	93.8	Very high	86.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	148.1	174.9	73.5	-91.1	0	0	0	112.3	P93 M105 I125 H127 V132 V154 W164 G170 V171	W91-P93 HydrophobicContact CZ3-CG 4.17Å; W91-M105 HydrophobicContact CH2-CE 3.76Å; W91-M105 HydrophobicContact CZ3-CE 4.31Å; W91-I125 HydrophobicContact CB-CD1 4.45Å; W91-H127 AromaticContact CD1-NE2 3.42Å; W91-H127 AromaticContact CE2-NE2 3.96Å; W91-H127 AromaticContact NE1-CD2 3.64Å; W91-H127 AromaticContact NE1-CE1 3.59Å; W91-H127 AromaticContact NE1-NE2 2.91Å; W91-H127 PolarHBondContact NE1-NE2 2.79Å; W91-V132 HydrophobicContact CD2-CG1 4Å; W91-V132 HydrophobicContact CD2-CG2 4.12Å; W91-V132 HydrophobicContact CE3-CG1 3.8Å; W91-V132 HydrophobicContact CE3-CG2 4.29Å; W91-V132 HydrophobicContact CH2-CG2 3.78Å; W91-V132 HydrophobicContact CZ2-CG2 3.59Å; W91-V132 HydrophobicContact CZ3-CG1 4.12Å; W91-V132 HydrophobicContact CZ3-CG2 4.13Å; W91-V154 WeakPolarHBondContact CA-O 3.23Å; W91-V154 HydrophobicContact CB-CB 3.82Å; W91-V154 HydrophobicContact CB-CG1 4.41Å; W91-V154 WeakPolarHBondContact CB-O 3.43Å; W91-W164 HydrophobicContact CZ2-CZ2 4.21Å; W91-G170 WeakPolarHBondContact O-CA 3.44Å; W91-V171 HydrophobicContact CZ2-CG2 4.12Å; W91-V171 PolarHBondContact N-O 3Å; W91-V171 VanDerWaalsContact NE1-CG2 3.26Å; W91-V171 PolarHBondContact O-N 2.79Å
92	I	95.5	Very high	86.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	157.1	170.9	53.1	58.5	0	0	0	110.4	I72 F79 V81 G94 F108 F153 V154 E155 G156	I72-I92 HydrophobicContact CD1-CB 4.42Å; I72-I92 HydrophobicContact CD1-CG1 3.73Å; I72-I92 HydrophobicContact CD1-CG2 3.79Å; F79-I92 HydrophobicContact CG-CG2 4.32Å; V81-I92 HydrophobicContact CG1-CG2 4.44Å; I92-G94 PolarHBondContact O-N 2.75Å; I92-F108 HydrophobicContact CD1-CB 3.3Å; I92-F108 HydrophobicContact CD1-CD1 3.92Å; I92-F108 HydrophobicContact CD1-CG 3.81Å; I92-F108 HydrophobicContact CG1-CB 4.01Å; I92-F108 HydrophobicContact CG1-CG 4.45Å; I92-F153 HydrophobicContact CD1-CD2 4.02Å; I92-F153 HydrophobicContact CD1-CE2 3.51Å; I92-F153 HydrophobicContact CG1-CD2 3.88Å; I92-F153 HydrophobicContact CG1-CE2 3.75Å; I92-V154 PolarHBondContact N-O 3.49Å; I92-E155 HydrophobicContact CD1-CG 4.36Å; I92-G156 PolarHBondContact O-N 2.8Å
93	P	93.5	Very high	86.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	127.7	173.2	-20	34.7	0	0	0	109.5	W91 C97 C102 M105 E107 F108 D169	W91-P93 HydrophobicContact CZ3-CG 4.17Å; P93-C97 HydrophobicContact CB-CB 3.98Å; P93-C102 HydrophobicContact CB-CB 4.14Å; P93-C102 HydrophobicContact CG-CB 4.47Å; P93-M105 HydrophobicContact CG-CB 3.85Å; P93-M105 HydrophobicContact CG-CE 4.33Å; P93-M105 HydrophobicContact CG-SD 4.39Å; P93-E107 HydrophobicContact CB-CG 4.22Å; P93-E107 CarbonylContact O-C 3.46Å; P93-E107 WeakPolarHBondContact O-CA 3.4Å; P93-F108 PolarHBondContact O-N 2.78Å; P93-D169 WeakPolarHBondContact CD-O 3.44Å; P93-D169 WeakPolarHBondContact CG-O 3.33Å
94	G	94	Very high	85.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.01	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-78.6	169.4	168.2	0	0	0	0	0	112.1	I92 Y96 C97 E107 E155 G156	I92-G94 PolarHBondContact O-N 2.75Å; G94-Y96 PolarHBondContact O-N 2.92Å; G94-C97 WeakPolarHBondContact O-CB 3.3Å; G94-C97 PolarHBondContact O-N 2.82Å; G94-E107 WeakPolarHBondContact O-CG 3.27Å; G94-E155 VanDerWaalsContact CA-CG 3.41Å; G94-G156 PolarHBondContact N-O 3.17Å
95	R	89.6	Confident	85.4	Confident	95 Å²	95	33.8 Å²	33.8	36%	0.358	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-16	-177.4	-164.3	-177.5	-153.8	167.7	14.7	117	E107 F108 D109 S111	R95-E107 VanDerWaalsContact O-OE2 3.11Å; R95-F108 PolarHBondContact N-O 2.88Å; R95-D109 VanDerWaalsContact CZ-CG 3.42Å; R95-D109 IonicContact CZ-OD1 2.75Å; R95-D109 IonicContact CZ-OD2 3.8Å; R95-D109 IonicContact NE-OD1 2.71Å; R95-D109 PolarHBondContact NE-OD1 2.93Å; R95-D109 IonicContact NE-OD2 2.83Å; R95-D109 PolarHBondContact NE-OD2 2.77Å; R95-D109 IonicContact NH1-OD1 2.63Å; R95-D109 PolarHBondContact NH1-OD1 3.17Å; R95-D109 IonicContact NH1-OD2 3.8Å; R95-D109 IonicContact NH2-OD1 3.18Å; R95-D109 PolarHBondContact NH2-OD1 3.39Å; R95-D109 IonicContact NH2-OD2 3.59Å; R95-D109 PolarHBondContact NH2-OD2 3.32Å; R95-S111 PolarHBondContact NH1-OG 2.99Å; R95-S111 PolarHBondContact NH2-OG 3.06Å
96	Y	83.2	Confident	85.4	Confident	156 Å²	156	38.2 Å²	38.2	61%	0.612	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.9	8.8	-176.5	-57.6	-60.4	0	0	0	113.3	G94 Y99	G94-Y96 PolarHBondContact O-N 2.92Å; Y96-Y99 HydrophobicContact CD1-CE2 4.44Å
97	C	88.1	Confident	85.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-76.3	-26	-173.5	-162.8	0	0	0	0	114	P93 G94 Y99 S100 G101 C102 E107 G156	P93-C97 HydrophobicContact CB-CB 3.98Å; G94-C97 WeakPolarHBondContact O-CB 3.3Å; G94-C97 PolarHBondContact O-N 2.82Å; C97-Y99 PolarHBondContact O-N 3.41Å; C97-S100 CarbonylContact O-C 3.53Å; C97-S100 PolarHBondContact O-N 3.32Å; C97-S100 PolarHBondContact O-OG 3.01Å; C97-G101 PolarHBondContact O-N 2.94Å; C97-C102 HydrophobicContact CB-CB 3.49Å; C97-C102 VanDerWaalsContact CB-CB 3.49Å; C97-C102 WeakPolarHBondContact CB-SG 3.44Å; C97-C102 WeakPolarHBondContact O-CB 3.17Å; C97-C102 PolarHBondContact O-N 3.42Å; C97-C102 WeakPolarHBondContact SG-CB 3.3Å; C97-C102 CovalentContact SG-SG 2.02Å; C97-C102 PolarHBondContact SG-SG 3.14Å; C97-E107 PolarHBondContact N-OE1 2.92Å; C97-G156 VanDerWaalsContact CB-O 3.3Å; C97-G156 WeakPolarHBondContact CB-O 3.28Å
98	S	78.2	Confident	86.2	Confident	47 Å²	47	38.8 Å²	38.8	33%	0.329	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-61.7	-29.6	179.5	-62.6	0	0	0	0	111.5	S100 G103 E107	S98-S100 PolarHBondContact O-N 2.84Å; S98-G103 PolarHBondContact OG-O 2.91Å; S98-E107 WeakPolarHBondContact CA-OE1 3.4Å; S98-E107 WeakPolarHBondContact CB-OE1 3.35Å; S98-E107 PolarHBondContact N-OE1 3.33Å; S98-E107 PolarHBondContact OG-OE1 3.03Å
99	Y	74.5	Confident	86.7	Confident	183 Å²	183	39.8 Å²	39.8	72%	0.718	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-73.2	-9.5	176.4	-59.8	-71.7	0	0	0	113.8	Y96 C97	Y96-Y99 HydrophobicContact CD1-CE2 4.44Å; C97-Y99 PolarHBondContact O-N 3.41Å
100	S	76.6	Confident	87.1	Confident	25 Å²	25	40.7 Å²	40.7	18%	0.175	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-141.7	21.4	-165.7	57.5	0	0	0	0	113.2	C97 S98 Y157 Q158 T159	C97-S100 CarbonylContact O-C 3.53Å; C97-S100 PolarHBondContact O-N 3.32Å; C97-S100 PolarHBondContact O-OG 3.01Å; S98-S100 PolarHBondContact O-N 2.84Å; S100-Y157 PolarHBondContact OG-O 3.31Å; S100-Q158 WeakPolarHBondContact O-CG 3.24Å; S100-Q158 WeakPolarHBondContact OG-CA 3.47Å; S100-T159 PolarHBondContact O-N 3.48Å; S100-T159 VanDerWaalsContact O-N 3.1Å
101	G	78	Confident	87.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.01	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	119.7	-3.3	167	0	0	0	0	0	116.9	C97 G103 T159	C97-G101 PolarHBondContact O-N 2.94Å; G101-G103 PolarHBondContact O-N 3.13Å; G101-T159 WeakPolarHBondContact CA-OG1 3.19Å; G101-T159 PolarHBondContact O-OG1 3.1Å
102	C	80.2	Confident	87.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.254	C	S	.	.			trans	-75.6	-4.6	173.2	-75.9	0	0	0	0	114	P93 C97 S104 M105	P93-C102 HydrophobicContact CB-CB 4.14Å; P93-C102 HydrophobicContact CG-CB 4.47Å; C97-C102 HydrophobicContact CB-CB 3.49Å; C97-C102 VanDerWaalsContact CB-CB 3.49Å; C97-C102 WeakPolarHBondContact CB-SG 3.44Å; C97-C102 WeakPolarHBondContact O-CB 3.17Å; C97-C102 PolarHBondContact O-N 3.42Å; C97-C102 WeakPolarHBondContact SG-CB 3.3Å; C97-C102 CovalentContact SG-SG 2.02Å; C97-C102 PolarHBondContact SG-SG 3.14Å; C102-S104 PolarHBondContact O-N 3.18Å; C102-S104 VanDerWaalsContact O-N 3.17Å; C102-M105 HydrophobicContact CB-CB 4.46Å; C102-M105 HydrophobicContact CB-SD 4.18Å; C102-M105 VanDerWaalsContact O-CB 3.3Å; C102-M105 WeakPolarHBondContact O-CB 3.16Å; C102-M105 WeakPolarHBondContact O-CG 3.48Å; C102-M105 PolarHBondContact O-N 2.67Å
103	G	78.1	Confident	87.5	Confident	32 Å²	32	49.4 Å²	49.4	33%	0.33	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	-120.1	171.9	0	0	0	0	0	112.9	S98 G101	S98-G103 PolarHBondContact OG-O 2.91Å; G101-G103 PolarHBondContact O-N 3.13Å
104	S	76.6	Confident	87.7	Confident	104 Å²	104	54 Å²	54	73%	0.727	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	13.1	179.8	65.9	0	0	0	0	114	C102	C102-S104 PolarHBondContact O-N 3.18Å; C102-S104 VanDerWaalsContact O-N 3.17Å
105	M	84.1	Confident	87.8	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.049	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64.2	144.8	176.9	-61.1	167.8	90.5	0	0	109.5	W91 P93 C102 E107 W164 Y168 D169	W91-M105 HydrophobicContact CH2-CE 3.76Å; W91-M105 HydrophobicContact CZ3-CE 4.31Å; P93-M105 HydrophobicContact CG-CB 3.85Å; P93-M105 HydrophobicContact CG-CE 4.33Å; P93-M105 HydrophobicContact CG-SD 4.39Å; C102-M105 HydrophobicContact CB-CB 4.46Å; C102-M105 HydrophobicContact CB-SD 4.18Å; C102-M105 VanDerWaalsContact O-CB 3.3Å; C102-M105 WeakPolarHBondContact O-CB 3.16Å; C102-M105 WeakPolarHBondContact O-CG 3.48Å; C102-M105 PolarHBondContact O-N 2.67Å; M105-E107 PolarHBondContact O-N 3.46Å; M105-W164 HydrophobicContact CE-CG 4.48Å; M105-W164 HydrophobicContact SD-CB 3.92Å; M105-W164 HydrophobicContact SD-CG 4.02Å; M105-Y168 HydrophobicContact CE-CD2 4.45Å; M105-Y168 VanDerWaalsContact CE-O 3.25Å; M105-Y168 WeakPolarHBondContact CE-O 3.4Å; M105-D169 WeakPolarHBondContact CE-O 3.2Å
106	K	89.6	Confident	88.1	Confident	94 Å²	94	55 Å²	55	41%	0.409	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-69.2	130.3	177.8	-172.4	176.3	172.5	-178.3	0	110.7	T78 F79 D169	T78-K106 WeakPolarHBondContact O-CD 3.27Å; T78-K106 WeakPolarHBondContact O-CE 3.4Å; T78-K106 PolarHBondContact O-NZ 3.04Å; F79-K106 HydrophobicContact CD1-CB 4.21Å; F79-K106 HydrophobicContact CD1-CD 4.28Å; F79-K106 HydrophobicContact CD1-CG 4.2Å; F79-K106 HydrophobicContact CE1-CB 4.33Å; F79-K106 HydrophobicContact CE1-CD 4.24Å; F79-K106 HydrophobicContact CE1-CG 3.94Å; K106-D169 HydrophobicContact CB-CB 4.36Å; K106-D169 WeakPolarHBondContact CB-OD1 3.44Å; K106-D169 PolarHBondContact N-OD1 3.36Å
107	E	92.9	Very high	88.6	Confident	50 Å²	50	55 Å²	55	23%	0.234	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-94.6	142.8	-179.5	-60.9	179.8	149.2	0	0	112.1	P93 G94 R95 C97 S98 M105	P93-E107 HydrophobicContact CB-CG 4.22Å; P93-E107 CarbonylContact O-C 3.46Å; P93-E107 WeakPolarHBondContact O-CA 3.4Å; G94-E107 WeakPolarHBondContact O-CG 3.27Å; R95-E107 VanDerWaalsContact O-OE2 3.11Å; C97-E107 PolarHBondContact N-OE1 2.92Å; S98-E107 WeakPolarHBondContact CA-OE1 3.4Å; S98-E107 WeakPolarHBondContact CB-OE1 3.35Å; S98-E107 PolarHBondContact N-OE1 3.33Å; S98-E107 PolarHBondContact OG-OE1 3.03Å; M105-E107 PolarHBondContact O-N 3.46Å
108	F	96.8	Very high	88.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-83	123.3	169.6	179	-111.5	0	0	0	110.6	I72 Q77 F79 I92 P93 R95 Y116 D139 F153	I72-F108 HydrophobicContact CB-CD2 4.19Å; I72-F108 HydrophobicContact CB-CE2 3.97Å; I72-F108 HydrophobicContact CG2-CD2 4.11Å; I72-F108 HydrophobicContact CG2-CE2 3.58Å; I72-F108 HydrophobicContact CG2-CZ 3.9Å; Q77-F108 HydrophobicContact CB-CD2 4.47Å; F79-F108 HydrophobicContact CE1-CB 4.16Å; F79-F108 HydrophobicContact CE2-CB 4.38Å; F79-F108 AromaticContact CE2-CD2 3.92Å; F79-F108 HydrophobicContact CE2-CD2 3.92Å; F79-F108 HydrophobicContact CZ-CB 3.64Å; F79-F108 AromaticContact CZ-CD2 3.82Å; F79-F108 HydrophobicContact CZ-CD2 3.82Å; F79-F108 HydrophobicContact CZ-CG 4.22Å; I92-F108 HydrophobicContact CD1-CB 3.3Å; I92-F108 HydrophobicContact CD1-CD1 3.92Å; I92-F108 HydrophobicContact CD1-CG 3.81Å; I92-F108 HydrophobicContact CG1-CB 4.01Å; I92-F108 HydrophobicContact CG1-CG 4.45Å; P93-F108 PolarHBondContact O-N 2.78Å; R95-F108 PolarHBondContact N-O 2.88Å; F108-Y116 AromaticContact CE1-CD2 3.67Å; F108-Y116 HydrophobicContact CE1-CD2 3.67Å; F108-Y116 AromaticContact CE1-CE2 3.77Å; F108-Y116 HydrophobicContact CE1-CE2 3.77Å; F108-Y116 HydrophobicContact CZ-CD2 4.03Å; F108-D139 WeakPolarHBondContact CZ-OD2 3.39Å; F108-F153 HydrophobicContact CD1-CE2 4.39Å; F108-F153 HydrophobicContact CD1-CZ 4.24Å; F108-F153 HydrophobicContact CE1-CE2 4.49Å; F108-F153 AromaticContact CE1-CZ 3.9Å; F108-F153 HydrophobicContact CE1-CZ 3.9Å; F108-F153 HydrophobicContact CZ-CZ 4.42Å
109	D	96.2	Very high	89	Confident	25 Å²	25	63.2 Å²	63.2	13%	0.134	33%	0.332	C	S	.	.			trans	-99.4	94.8	174.6	-170	-15.6	0	0	0	109.5	Q77 R95 S111 L112	Q77-D109 PolarHBondContact NE2-O 3.47Å; R95-D109 VanDerWaalsContact CZ-CG 3.42Å; R95-D109 IonicContact CZ-OD1 2.75Å; R95-D109 IonicContact CZ-OD2 3.8Å; R95-D109 IonicContact NE-OD1 2.71Å; R95-D109 PolarHBondContact NE-OD1 2.93Å; R95-D109 IonicContact NE-OD2 2.83Å; R95-D109 PolarHBondContact NE-OD2 2.77Å; R95-D109 IonicContact NH1-OD1 2.63Å; R95-D109 PolarHBondContact NH1-OD1 3.17Å; R95-D109 IonicContact NH1-OD2 3.8Å; R95-D109 IonicContact NH2-OD1 3.18Å; R95-D109 PolarHBondContact NH2-OD1 3.39Å; R95-D109 IonicContact NH2-OD2 3.59Å; R95-D109 PolarHBondContact NH2-OD2 3.32Å; D109-S111 PolarHBondContact O-N 2.85Å; D109-S111 WeakPolarHBondContact OD1-CB 3.35Å; D109-S111 PolarHBondContact OD1-N 3.03Å; D109-S111 VanDerWaalsContact OD1-N 3.1Å; D109-S111 PolarHBondContact OD1-OG 2.78Å; D109-L112 HydrophobicContact CB-CD1 3.86Å; D109-L112 HydrophobicContact CB-CG 3.98Å; D109-L112 PolarHBondContact O-N 3.21Å; D109-L112 VanDerWaalsContact O-N 3.14Å
110	S	95.9	Very high	89.5	Confident	28 Å²	28	55.5 Å²	55.5	20%	0.196	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-59.6	-25.6	179	50.2	0	0	0	0	113.3	L112 S113 Y116	S110-L112 PolarHBondContact O-N 2.87Å; S110-S113 PolarHBondContact O-N 3.4Å; S110-Y116 VanDerWaalsContact CB-CE2 3.41Å
111	S	96.1	Very high	90	Very high	76 Å²	76	59.3 Å²	59.3	53%	0.531	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-70.9	-17.3	179.1	72.6	0	0	0	0	114.1	R95 D109	R95-S111 PolarHBondContact NH1-OG 2.99Å; R95-S111 PolarHBondContact NH2-OG 3.06Å; D109-S111 PolarHBondContact O-N 2.85Å; D109-S111 WeakPolarHBondContact OD1-CB 3.35Å; D109-S111 PolarHBondContact OD1-N 3.03Å; D109-S111 VanDerWaalsContact OD1-N 3.1Å; D109-S111 PolarHBondContact OD1-OG 2.78Å
112	L	96.8	Very high	90.5	Very high	99 Å²	99	67.1 Å²	67.1	52%	0.518	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-86.4	-16.6	176.5	-59.4	-179.3	0	0	0	112.7	P75 D109 S110	P75-L112 WeakPolarHBondContact CD-O 3.38Å; D109-L112 HydrophobicContact CB-CD1 3.86Å; D109-L112 HydrophobicContact CB-CG 3.98Å; D109-L112 PolarHBondContact O-N 3.21Å; D109-L112 VanDerWaalsContact O-N 3.14Å; S110-L112 PolarHBondContact O-N 2.87Å
113	S	97.9	Very high	90.9	Very high	11 Å²	11	68 Å²	68	8%	0.077	37%	0.365	C	S	.	.			trans	-96.9	118.8	-174.8	179.8	0	0	0	0	112.1	G73 T74 S110 T115 Y116 D139	G73-S113 WeakPolarHBondContact CA-OG 3.48Å; T74-S113 PolarHBondContact N-OG 2.61Å; T74-S113 WeakPolarHBondContact O-CA 3.48Å; S110-S113 PolarHBondContact O-N 3.4Å; S113-T115 VanDerWaalsContact C-N 3.26Å; S113-T115 PolarHBondContact O-N 3.17Å; S113-T115 PolarHBondContact OG-N 3.08Å; S113-T115 PolarHBondContact OG-OG1 2.83Å; S113-Y116 WeakPolarHBondContact O-CB 3.35Å; S113-Y116 PolarHBondContact O-N 3.21Å; S113-Y116 PolarHBondContact OG-N 2.85Å; S113-D139 VanDerWaalsContact CB-OD2 3.26Å; S113-D139 WeakPolarHBondContact CB-OD2 3.49Å; S113-D139 PolarHBondContact OG-OD1 3.11Å; S113-D139 PolarHBondContact OG-OD2 2.88Å
114	S	97.8	Very high	91.4	Very high	98 Å²	98	68.8 Å²	68.8	69%	0.685	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.4	175.3	56.4	0	0	0	0	114.4	T74	T74-S114 WeakPolarHBondContact CB-OG 3.44Å; T74-S114 PolarHBondContact O-N 3.48Å; T74-S114 PolarHBondContact O-OG 3.02Å
115	T	96.2	Very high	91.7	Very high	68 Å²	68	64.2 Å²	64.2	42%	0.417	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	2.4	-179.9	42.5	0	0	0	0	113.1	T74 S113 D139	T74-T115 WeakPolarHBondContact CB-OG1 3.37Å; T74-T115 PolarHBondContact N-OG1 3.46Å; T74-T115 PolarHBondContact OG1-OG1 2.77Å; S113-T115 VanDerWaalsContact C-N 3.26Å; S113-T115 PolarHBondContact O-N 3.17Å; S113-T115 PolarHBondContact OG-N 3.08Å; S113-T115 PolarHBondContact OG-OG1 2.83Å; T115-D139 PolarHBondContact OG1-OD1 2.9Å
116	Y	97.2	Very high	91.4	Very high	48 Å²	48	66.5 Å²	66.5	19%	0.188	36%	0.362	C	S	.	.			trans	-64.9	136	175.7	178	-102	0	0	0	112	F108 S110 S113 R118 A137 D139 E155	F108-Y116 AromaticContact CE1-CD2 3.67Å; F108-Y116 HydrophobicContact CE1-CD2 3.67Å; F108-Y116 AromaticContact CE1-CE2 3.77Å; F108-Y116 HydrophobicContact CE1-CE2 3.77Å; F108-Y116 HydrophobicContact CZ-CD2 4.03Å; S110-Y116 VanDerWaalsContact CB-CE2 3.41Å; S113-Y116 WeakPolarHBondContact O-CB 3.35Å; S113-Y116 PolarHBondContact O-N 3.21Å; S113-Y116 PolarHBondContact OG-N 2.85Å; Y116-R118 HydrophobicContact CE1-CB 3.8Å; Y116-A137 HydrophobicContact CD2-CB 4.47Å; Y116-A137 HydrophobicContact CE2-CB 3.58Å; Y116-D139 WeakPolarHBondContact CA-OD2 3.47Å; Y116-D139 WeakPolarHBondContact CB-OD2 3.48Å; Y116-D139 PolarHBondContact N-OD2 3.42Å; Y116-E155 PolarHBondContact OH-OE2 2.92Å
117	Y	92.3	Very high	90.4	Very high	157 Å²	157	63.7 Å²	63.7	62%	0.616	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	118.5	174.1	178.7	-97.6	0	0	0	110.2	N119 A137 A138	Y117-N119 HydrophobicContact CE1-CB 4.37Å; Y117-A137 CarbonylContact O-C 3.5Å; Y117-A137 WeakPolarHBondContact O-CA 3.2Å; Y117-A138 HydrophobicContact CD1-CB 4.36Å; Y117-A138 PolarHBondContact N-O 3.1Å; Y117-A138 PolarHBondContact O-N 2.97Å
118	R	90.1	Very high	88.9	Confident	138 Å²	138	65.5 Å²	65.5	52%	0.521	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	116.5	177	-167.5	170.5	-169.7	-88.3	-4.1	110.4	Y116 F135	Y116-R118 HydrophobicContact CE1-CB 3.8Å; R118-F135 HydrophobicContact CG-CD2 4.47Å; R118-F135 HydrophobicContact CG-CE2 4.47Å
119	N	84.9	Confident	87.1	Confident	80 Å²	80	67.2 Å²	67.2	43%	0.428	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-42.6	170.1	-177.2	-12.6	0	0	0	110.2	Y117 T136 E152	Y117-N119 HydrophobicContact CE1-CB 4.37Å; N119-T136 WeakPolarHBondContact CB-OG1 3.21Å; N119-T136 PolarHBondContact N-O 3.16Å; N119-E152 PolarHBondContact ND2-OE1 2.93Å
120	G	85.8	Confident	86	Confident	22 Å²	22	66.6 Å²	66.6	23%	0.227	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.4	2.1	164.9	0	0	0	0	0	116.8	K122 T136	G120-K122 PolarHBondContact O-N 3.42Å; G120-T136 PolarHBondContact N-O 2.91Å; G120-T136 PolarHBondContact N-OG1 3.47Å
121	L	86.7	Confident	85.5	Confident	105 Å²	105	67.1 Å²	67.1	55%	0.55	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	122.6	173.4	-179	71	0	0	0	110	V123 F135 T136	L121-V123 HydrophobicContact CD2-CG1 4.23Å; L121-V123 HydrophobicContact CG-CG1 4.24Å; L121-F135 CarbonylContact O-C 3.28Å; L121-F135 WeakPolarHBondContact O-CA 3.37Å; L121-T136 HydrophobicContact CB-CG2 4Å; L121-T136 WeakPolarHBondContact CB-OG1 3.34Å; L121-T136 HydrophobicContact CD2-CG2 4.43Å; L121-T136 PolarHBondContact N-OG1 3.46Å; L121-T136 PolarHBondContact O-N 3.43Å
122	K	88.8	Confident	85.1	Confident	164 Å²	164	63.5 Å²	63.5	71%	0.713	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.3	176	-67.7	-175.3	179.8	-178.4	0	110.8	G120 G134	G120-K122 PolarHBondContact O-N 3.42Å; K122-G134 WeakPolarHBondContact CA-O 3.39Å
123	V	88.7	Confident	84.9	Confident	18 Å²	18	62.9 Å²	62.9	11%	0.109	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	150.9	-173.6	-66.5	0	0	0	0	110.6	L121 G134 T136 V154 I182	L121-V123 HydrophobicContact CD2-CG1 4.23Å; L121-V123 HydrophobicContact CG-CG1 4.24Å; V123-G134 PolarHBondContact N-O 3Å; V123-G134 PolarHBondContact O-N 2.98Å; V123-T136 HydrophobicContact CG1-CG2 4.1Å; V123-V154 HydrophobicContact CG2-CB 4.22Å; V123-V154 HydrophobicContact CG2-CG1 3.45Å; V123-V154 VanDerWaalsContact CG2-CG1 3.45Å; V123-V154 HydrophobicContact CG2-CG2 3.67Å; V123-I182 HydrophobicContact CB-CG2 4.26Å; V123-I182 HydrophobicContact CG1-CG2 3.55Å; V123-I182 HydrophobicContact CG2-CG2 4.41Å
124	A	88.3	Confident	84.6	Confident	50 Å²	50	62.3 Å²	62.3	41%	0.413	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.2	174.3	0	0	0	0	0	109.1	T131 V132 Y133	A124-T131 HydrophobicContact CB-CG2 3.92Å; A124-V132 CarbonylContact C-O 3.57Å; A124-V132 WeakPolarHBondContact CA-O 3.36Å; A124-Y133 HydrophobicContact CB-CD1 3.84Å; A124-Y133 HydrophobicContact CB-CE1 3.88Å
125	I	83.4	Confident	84.3	Confident	8 Å²	8	59 Å²	59	4%	0.041	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.8	-178.1	-56.8	169.4	0	0	0	108.7	D89 W91 H127 T131 V132 V154 R181	D89-I125 HydrophobicContact CB-CD1 3.6Å; D89-I125 HydrophobicContact CB-CG1 4.41Å; W91-I125 HydrophobicContact CB-CD1 4.45Å; I125-H127 VanDerWaalsContact CG2-NE2 3.29Å; I125-H127 WeakPolarHBondContact CG2-NE2 3.35Å; I125-T131 CarbonylContact O-C 3.37Å; I125-T131 VanDerWaalsContact O-CA 3.31Å; I125-T131 WeakPolarHBondContact O-CA 3.36Å; I125-V132 PolarHBondContact N-O 3.28Å; I125-V132 PolarHBondContact O-N 3.11Å; I125-V154 HydrophobicContact CD1-CB 4.08Å; I125-V154 HydrophobicContact CD1-CG1 4.29Å; I125-V154 HydrophobicContact CD1-CG2 3.74Å; I125-R181 HydrophobicContact CG1-CG 4.49Å
126	G	76.2	Confident	84.1	Confident	57 Å²	57	55.9 Å²	55.9	59%	0.588	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.9	175.6	0	0	0	0	0	111.5
127	H	69	Low	83.9	Confident	35 Å²	35	53.6 Å²	53.6	16%	0.162	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	168.2	168.3	-65.6	-78.6	0	0	0	110.2	W91 I125 G130 W164	W91-H127 AromaticContact CD1-NE2 3.42Å; W91-H127 AromaticContact CE2-NE2 3.96Å; W91-H127 AromaticContact NE1-CD2 3.64Å; W91-H127 AromaticContact NE1-CE1 3.59Å; W91-H127 AromaticContact NE1-NE2 2.91Å; W91-H127 PolarHBondContact NE1-NE2 2.79Å; I125-H127 VanDerWaalsContact CG2-NE2 3.29Å; I125-H127 WeakPolarHBondContact CG2-NE2 3.35Å; H127-G130 CarbonylContact C-O 3.6Å; H127-G130 WeakPolarHBondContact CA-O 3.4Å; H127-G130 PolarHBondContact N-O 2.92Å; H127-G130 PolarHBondContact O-N 3.45Å; H127-W164 HydrophobicContact CB-CH2 4.24Å; H127-W164 HydrophobicContact CB-CZ2 4.27Å
128	G	61.7	Low	83.9	Confident	88 Å²	88	46.4 Å²	46.4	91%	0.907	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-50.4	177.4	0	0	0	0	0	115
129	P	59.9	Low	84.2	Confident	36 Å²	36	39.9 Å²	39.9	23%	0.234	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.1	179.1	28.5	-35.6	0	0	0	114.4	W161 W164 F166	P129-W161 HydrophobicContact CB-CE3 3.84Å; P129-W161 HydrophobicContact CB-CZ3 3.94Å; P129-W164 HydrophobicContact CB-CH2 4.43Å; P129-W164 HydrophobicContact CB-CZ2 4.42Å; P129-W164 HydrophobicContact CG-CD2 4.43Å; P129-W164 HydrophobicContact CG-CH2 3.66Å; P129-W164 HydrophobicContact CG-CZ2 3.37Å; P129-W164 HydrophobicContact CG-CZ3 4.27Å; P129-F166 HydrophobicContact CB-CE2 3.76Å; P129-F166 HydrophobicContact CB-CZ 3.91Å; P129-F166 HydrophobicContact CG-CE2 3.71Å; P129-F166 HydrophobicContact CG-CZ 3.9Å
130	G	73.3	Confident	84.7	Confident	12 Å²	12	36.9 Å²	36.9	12%	0.124	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.6	-173.3	-175.2	0	0	0	0	0	114.1	H127 S160	H127-G130 CarbonylContact C-O 3.6Å; H127-G130 WeakPolarHBondContact CA-O 3.4Å; H127-G130 PolarHBondContact N-O 2.92Å; H127-G130 PolarHBondContact O-N 3.45Å; G130-S160 WeakPolarHBondContact CA-OG 3.48Å
131	T	84.8	Confident	85.2	Confident	39 Å²	39	35.9 Å²	35.9	24%	0.239	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.2	179	-56.6	0	0	0	0	110.6	A124 I125 Y133 T159 S160	A124-T131 HydrophobicContact CB-CG2 3.92Å; I125-T131 CarbonylContact O-C 3.37Å; I125-T131 VanDerWaalsContact O-CA 3.31Å; I125-T131 WeakPolarHBondContact O-CA 3.36Å; T131-Y133 HydrophobicContact CG2-CD1 4.47Å; T131-Y133 HydrophobicContact CG2-CD2 4.38Å; T131-Y133 HydrophobicContact CG2-CE1 4.01Å; T131-Y133 HydrophobicContact CG2-CE2 3.91Å; T131-T159 CarbonylContact O-C 3.59Å; T131-T159 WeakPolarHBondContact O-CA 3.5Å; T131-S160 PolarHBondContact N-OG 2.85Å; T131-S160 PolarHBondContact O-N 3.38Å
132	V	88.1	Confident	85.3	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.8	169.7	179.4	0	0	0	0	108.3	W91 A124 I125 T159 W164	W91-V132 HydrophobicContact CD2-CG1 4Å; W91-V132 HydrophobicContact CD2-CG2 4.12Å; W91-V132 HydrophobicContact CE3-CG1 3.8Å; W91-V132 HydrophobicContact CE3-CG2 4.29Å; W91-V132 HydrophobicContact CH2-CG2 3.78Å; W91-V132 HydrophobicContact CZ2-CG2 3.59Å; W91-V132 HydrophobicContact CZ3-CG1 4.12Å; W91-V132 HydrophobicContact CZ3-CG2 4.13Å; A124-V132 CarbonylContact C-O 3.57Å; A124-V132 WeakPolarHBondContact CA-O 3.36Å; I125-V132 PolarHBondContact N-O 3.28Å; I125-V132 PolarHBondContact O-N 3.11Å; V132-T159 HydrophobicContact CG2-CG2 4.27Å; V132-W164 HydrophobicContact CG2-CH2 3.91Å; V132-W164 HydrophobicContact CG2-CZ2 4.32Å; V132-W164 HydrophobicContact CG2-CZ3 4.38Å
133	Y	90.8	Very high	85	Confident	85 Å²	85	23.9 Å²	23.9	33%	0.333	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.4	173.7	-59.3	-87.7	0	0	0	108.7	A124 T131 G156 Y157 Q158	A124-Y133 HydrophobicContact CB-CD1 3.84Å; A124-Y133 HydrophobicContact CB-CE1 3.88Å; T131-Y133 HydrophobicContact CG2-CD1 4.47Å; T131-Y133 HydrophobicContact CG2-CD2 4.38Å; T131-Y133 HydrophobicContact CG2-CE1 4.01Å; T131-Y133 HydrophobicContact CG2-CE2 3.91Å; Y133-G156 CarbonylContact O-C 3.55Å; Y133-G156 WeakPolarHBondContact O-CA 3.44Å; Y133-Y157 PolarHBondContact O-N 3.42Å; Y133-Q158 HydrophobicContact CD2-CG 4.17Å; Y133-Q158 PolarHBondContact N-O 3.33Å; Y133-Q158 PolarHBondContact O-N 3.06Å
134	G	92.7	Very high	84.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-174.9	-173.8	0	0	0	0	0	112.9	K122 V123 E155 Y157	K122-G134 WeakPolarHBondContact CA-O 3.39Å; V123-G134 PolarHBondContact N-O 3Å; V123-G134 PolarHBondContact O-N 2.98Å; G134-E155 CarbonylContact C-O 3.54Å; G134-E155 WeakPolarHBondContact CA-O 3.4Å; G134-Y157 VanDerWaalsContact CA-CD1 3.5Å
135	F	92	Very high	83.9	Confident	28 Å²	28	24.9 Å²	24.9	12%	0.123	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.1	166.8	52.2	-94.6	0	0	0	111	R118 L121 E155 Y157	R118-F135 HydrophobicContact CG-CD2 4.47Å; R118-F135 HydrophobicContact CG-CE2 4.47Å; L121-F135 CarbonylContact O-C 3.28Å; L121-F135 WeakPolarHBondContact O-CA 3.37Å; F135-E155 HydrophobicContact CD2-CB 4.15Å; F135-E155 HydrophobicContact CE2-CB 3.72Å; F135-E155 HydrophobicContact CE2-CG 4.08Å; F135-E155 WeakPolarHBondContact CE2-OE2 2.98Å; F135-E155 HydrophobicContact CZ-CB 3.94Å; F135-E155 HydrophobicContact CZ-CG 3.86Å; F135-E155 WeakPolarHBondContact CZ-OE2 3.3Å; F135-E155 PolarHBondContact N-O 3.35Å; F135-E155 PolarHBondContact O-N 3.25Å; F135-Y157 AromaticContact CD1-CD1 3.84Å; F135-Y157 HydrophobicContact CD1-CD1 3.84Å; F135-Y157 HydrophobicContact CD1-CE1 4.43Å; F135-Y157 HydrophobicContact CE1-CD1 4.21Å
136	T	91.1	Very high	83.9	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	135.6	178	54.7	0	0	0	0	111.4	N119 G120 L121 V123 F153 I182	N119-T136 WeakPolarHBondContact CB-OG1 3.21Å; N119-T136 PolarHBondContact N-O 3.16Å; G120-T136 PolarHBondContact N-O 2.91Å; G120-T136 PolarHBondContact N-OG1 3.47Å; L121-T136 HydrophobicContact CB-CG2 4Å; L121-T136 WeakPolarHBondContact CB-OG1 3.34Å; L121-T136 HydrophobicContact CD2-CG2 4.43Å; L121-T136 PolarHBondContact N-OG1 3.46Å; L121-T136 PolarHBondContact O-N 3.43Å; V123-T136 HydrophobicContact CG1-CG2 4.1Å; T136-F153 WeakPolarHBondContact CA-O 3.5Å; T136-I182 HydrophobicContact CG2-CB 3.99Å; T136-I182 HydrophobicContact CG2-CD1 4.28Å; T136-I182 HydrophobicContact CG2-CG2 3.65Å
137	A	92.6	Very high	84.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	165.8	171.9	0	0	0	0	0	109.5	Y116 Y117 E152 F153	Y116-A137 HydrophobicContact CD2-CB 4.47Å; Y116-A137 HydrophobicContact CE2-CB 3.58Å; Y117-A137 CarbonylContact O-C 3.5Å; Y117-A137 WeakPolarHBondContact O-CA 3.2Å; A137-E152 CarbonylContact O-C 3.54Å; A137-E152 VanDerWaalsContact O-CA 3.27Å; A137-E152 WeakPolarHBondContact O-CA 3.15Å; A137-F153 HydrophobicContact CB-CE1 4.03Å; A137-F153 HydrophobicContact CB-CE2 4.19Å; A137-F153 HydrophobicContact CB-CZ 3.8Å; A137-F153 PolarHBondContact N-O 3.48Å; A137-F153 PolarHBondContact O-N 2.72Å
138	A	93.9	Very high	85.5	Confident	5 Å²	5	23 Å²	23	4%	0.041	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.6	171.7	0	0	0	0	0	109.8	Y117 Q151 E152	Y117-A138 HydrophobicContact CD1-CB 4.36Å; Y117-A138 PolarHBondContact N-O 3.1Å; Y117-A138 PolarHBondContact O-N 2.97Å; A138-Q151 VanDerWaalsContact CA-O 3.3Å; A138-Q151 WeakPolarHBondContact CA-O 3.31Å; A138-E152 HydrophobicContact CB-CG 4.13Å
139	D	96.5	Very high	86.8	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	-180	175.3	-150.7	-33.3	0	0	0	109.4	I72 G73 F108 S113 T115 Y116 I141 R150 Q151 F153	I72-D139 HydrophobicContact CG2-CB 3.89Å; G73-D139 WeakPolarHBondContact CA-OD1 3.46Å; G73-D139 WeakPolarHBondContact CA-OD2 3.2Å; F108-D139 WeakPolarHBondContact CZ-OD2 3.39Å; S113-D139 VanDerWaalsContact CB-OD2 3.26Å; S113-D139 WeakPolarHBondContact CB-OD2 3.49Å; S113-D139 PolarHBondContact OG-OD1 3.11Å; S113-D139 PolarHBondContact OG-OD2 2.88Å; T115-D139 PolarHBondContact OG1-OD1 2.9Å; Y116-D139 WeakPolarHBondContact CA-OD2 3.47Å; Y116-D139 WeakPolarHBondContact CB-OD2 3.48Å; Y116-D139 PolarHBondContact N-OD2 3.42Å; D139-I141 PolarHBondContact O-N 2.95Å; D139-R150 CarbonylContact O-C 3.5Å; D139-R150 PolarHBondContact O-N 2.74Å; D139-Q151 PolarHBondContact N-O 2.87Å; D139-Q151 VanDerWaalsContact N-O 3.15Å; D139-Q151 PolarHBondContact O-N 2.96Å; D139-F153 HydrophobicContact CB-CE1 3.8Å; D139-F153 HydrophobicContact CB-CZ 4.47Å
140	S	95.3	Very high	88.3	Confident	18 Å²	18	37.7 Å²	37.7	13%	0.126	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	114.7	168.4	-173.7	0	0	0	0	109.7	I72 G73 S148	I72-S140 WeakPolarHBondContact CA-O 3.39Å; G73-S140 PolarHBondContact N-O 2.86Å; S140-S148 WeakPolarHBondContact CA-O 3.44Å
141	I	95.4	Very high	89.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.9	171.2	-58.4	-168.6	0	0	0	108.7	I70 T71 I72 T90 D139 C147 S148 Q151 F153 M187	I70-I141 HydrophobicContact CB-CG2 4.39Å; I70-I141 HydrophobicContact CD1-CG2 4.08Å; T71-I141 CarbonylContact O-C 3.43Å; T71-I141 WeakPolarHBondContact O-CA 3.4Å; I72-I141 HydrophobicContact CD1-CD1 4.13Å; I72-I141 HydrophobicContact CD1-CG1 4.37Å; I72-I141 HydrophobicContact CG1-CD1 4.3Å; I72-I141 HydrophobicContact CG1-CG1 4.01Å; I72-I141 HydrophobicContact CG1-CG2 4.46Å; I72-I141 HydrophobicContact CG2-CG1 4.24Å; T90-I141 HydrophobicContact CG2-CD1 4.22Å; D139-I141 PolarHBondContact O-N 2.95Å; I141-C147 WeakPolarHBondContact O-CA 3.32Å; I141-S148 PolarHBondContact N-O 3.16Å; I141-S148 PolarHBondContact O-N 2.91Å; I141-Q151 HydrophobicContact CB-CB 4.05Å; I141-Q151 HydrophobicContact CB-CG 4.01Å; I141-Q151 HydrophobicContact CD1-CB 4.13Å; I141-Q151 HydrophobicContact CD1-CG 3.57Å; I141-Q151 HydrophobicContact CG1-CB 3.85Å; I141-Q151 HydrophobicContact CG1-CG 3.82Å; I141-F153 HydrophobicContact CD1-CB 4.15Å; I141-F153 HydrophobicContact CD1-CD1 4.03Å; I141-F153 HydrophobicContact CD1-CG 4.24Å; I141-M187 HydrophobicContact CG2-SD 3.89Å; I141-M187 WeakPolarHBondContact O-CE 3.12Å
142	C	88.6	Confident	89.4	Confident	14 Å²	14	38.3 Å²	38.3	10%	0.095	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.3	177.4	-51	0	0	0	0	111.6	I70 T71 L146 C147	I70-C142 CarbonylContact C-O 3.49Å; I70-C142 VanDerWaalsContact CA-O 3.31Å; I70-C142 WeakPolarHBondContact CA-O 3.2Å; T71-C142 PolarHBondContact N-O 2.82Å; T71-C142 PolarHBondContact O-N 2.88Å; T71-C142 WeakPolarHBondContact OG1-CB 3.07Å; C142-L146 CarbonylContact C-O 3.58Å; C142-L146 WeakPolarHBondContact CA-O 3.47Å; C142-C147 HydrophobicContact CB-CB 4.05Å; C142-C147 WeakPolarHBondContact CB-SG 3.23Å; C142-C147 WeakPolarHBondContact SG-CB 3.47Å; C142-C147 CovalentContact SG-SG 2.04Å; C142-C147 PolarHBondContact SG-SG 3.16Å
143	M	82.7	Confident	89.7	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.02	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.6	167.9	-178.5	-176	-64.7	0	0	106.3	Q56 I70 N145 L146 L172 M187 L241 V243	Q56-M143 HydrophobicContact CB-CG 3.66Å; Q56-M143 HydrophobicContact CB-SD 3.5Å; Q56-M143 WeakPolarHBondContact CB-SD 3.38Å; Q56-M143 HydrophobicContact CG-CG 4.07Å; Q56-M143 HydrophobicContact CG-SD 4.16Å; I70-M143 HydrophobicContact CG2-CE 4.49Å; M143-N145 PolarHBondContact O-N 2.94Å; M143-L146 PolarHBondContact N-O 3.32Å; M143-L146 PolarHBondContact O-N 2.57Å; M143-L172 HydrophobicContact CE-CD2 3.37Å; M143-M187 HydrophobicContact CB-CE 3.73Å; M143-M187 HydrophobicContact CB-SD 4.23Å; M143-L241 HydrophobicContact CE-CD2 3.6Å; M143-L241 HydrophobicContact SD-CD2 3.66Å; M143-L241 HydrophobicContact SD-CG 4.34Å; M143-V243 HydrophobicContact SD-CG2 3.96Å
144	V	76.2	Confident	89.9	Confident	26 Å²	26	34.2 Å²	34.2	16%	0.158	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-91.1	-173.3	-175.8	0	0	0	0	112.1	K51 L52 Q55 Q56	K51-V144 HydrophobicContact CB-CG1 3.48Å; K51-V144 VanDerWaalsContact CB-CG1 3.48Å; K51-V144 HydrophobicContact CD-CG1 3.72Å; K51-V144 HydrophobicContact CG-CG1 3.63Å; L52-V144 WeakPolarHBondContact O-CG1 3.47Å; Q55-V144 VanDerWaalsContact O-CG2 3.28Å; Q55-V144 WeakPolarHBondContact O-CG2 3.29Å; Q56-V144 HydrophobicContact CB-CG2 4.22Å; Q56-V144 VanDerWaalsContact OE1-CG2 3.22Å
145	N	78	Confident	89.9	Confident	63 Å²	63	34.7 Å²	34.7	34%	0.337	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	0.8	179.9	58.1	-3.1	0	0	0	113.1	L53 G54 M143	L53-N145 WeakPolarHBondContact CA-ND2 3.01Å; L53-N145 VanDerWaalsContact CA-OD1 3.29Å; L53-N145 WeakPolarHBondContact CA-OD1 3.25Å; L53-N145 WeakPolarHBondContact CD2-ND2 3.22Å; L53-N145 WeakPolarHBondContact CG-ND2 3.44Å; G54-N145 PolarHBondContact N-OD1 2.88Å; M143-N145 PolarHBondContact O-N 2.94Å
146	L	82.9	Confident	90	Very high	16 Å²	16	33.3 Å²	33.3	8%	0.084	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	120.8	170.9	-67.5	-178.8	0	0	0	109	L53 C142 M143 M187 L191 L197 V243	L53-L146 HydrophobicContact CD2-CD2 4.25Å; C142-L146 CarbonylContact C-O 3.58Å; C142-L146 WeakPolarHBondContact CA-O 3.47Å; M143-L146 PolarHBondContact N-O 3.32Å; M143-L146 PolarHBondContact O-N 2.57Å; L146-M187 WeakPolarHBondContact O-CE 3.34Å; L146-L191 HydrophobicContact CB-CD1 3.98Å; L146-L191 HydrophobicContact CB-CD2 4.14Å; L146-L191 HydrophobicContact CD1-CD1 4.24Å; L146-L197 HydrophobicContact CD1-CD2 3.63Å; L146-V243 HydrophobicContact CD1-CB 4.12Å; L146-V243 HydrophobicContact CD1-CG1 4.15Å
147	C	88.7	Confident	90	Very high	44 Å²	44	36.9 Å²	36.9	30%	0.297	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.5	-177	-65.2	0	0	0	0	111.1	I141 C142	I141-C147 WeakPolarHBondContact O-CA 3.32Å; C142-C147 HydrophobicContact CB-CB 4.05Å; C142-C147 WeakPolarHBondContact CB-SG 3.23Å; C142-C147 WeakPolarHBondContact SG-CB 3.47Å; C142-C147 CovalentContact SG-SG 2.04Å; C142-C147 PolarHBondContact SG-SG 3.16Å
148	S	89.6	Confident	89.8	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.7	167.2	-179.7	0	0	0	0	108.7	S140 I141 Q151 N190	S140-S148 WeakPolarHBondContact CA-O 3.44Å; I141-S148 PolarHBondContact N-O 3.16Å; I141-S148 PolarHBondContact O-N 2.91Å; S148-Q151 PolarHBondContact OG-OE1 3.21Å; S148-N190 WeakPolarHBondContact OG-CB 3.29Å
149	R	90.5	Very high	89.3	Confident	213 Å²	213	40.8 Å²	40.8	80%	0.804	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.5	178.8	-65.2	-177.4	177.5	-176.2	-0.5	110	Q151	R149-Q151 PolarHBondContact O-N 2.79Å
150	R	89.8	Confident	88.4	Confident	218 Å²	218	44 Å²	44	82%	0.823	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	53.4	35.9	-176.6	-59.4	-177	174.7	178.7	-1.9	112.4	D139 E152	D139-R150 CarbonylContact O-C 3.5Å; D139-R150 PolarHBondContact O-N 2.74Å; R150-E152 PolarHBondContact O-N 3.44Å
151	Q	92.5	Very high	86.9	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	119.7	174.5	177.2	57.9	58.4	0	0	108.7	A138 D139 I141 S148 R149 K185 N190	A138-Q151 VanDerWaalsContact CA-O 3.3Å; A138-Q151 WeakPolarHBondContact CA-O 3.31Å; D139-Q151 PolarHBondContact N-O 2.87Å; D139-Q151 VanDerWaalsContact N-O 3.15Å; D139-Q151 PolarHBondContact O-N 2.96Å; I141-Q151 HydrophobicContact CB-CB 4.05Å; I141-Q151 HydrophobicContact CB-CG 4.01Å; I141-Q151 HydrophobicContact CD1-CB 4.13Å; I141-Q151 HydrophobicContact CD1-CG 3.57Å; I141-Q151 HydrophobicContact CG1-CB 3.85Å; I141-Q151 HydrophobicContact CG1-CG 3.82Å; S148-Q151 PolarHBondContact OG-OE1 3.21Å; R149-Q151 PolarHBondContact O-N 2.79Å; Q151-K185 PolarHBondContact NE2-O 2.95Å; Q151-N190 PolarHBondContact OE1-ND2 3.31Å
152	E	89.9	Confident	85	Confident	63 Å²	63	57.4 Å²	57.4	29%	0.294	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	138.1	174.6	-64.4	-174.9	123.2	0	0	110.8	N119 A137 A138 R150 I182 S184	N119-E152 PolarHBondContact ND2-OE1 2.93Å; A137-E152 CarbonylContact O-C 3.54Å; A137-E152 VanDerWaalsContact O-CA 3.27Å; A137-E152 WeakPolarHBondContact O-CA 3.15Å; A138-E152 HydrophobicContact CB-CG 4.13Å; R150-E152 PolarHBondContact O-N 3.44Å; E152-I182 HydrophobicContact CB-CD1 4.4Å; E152-S184 WeakPolarHBondContact CB-OG 2.96Å; E152-S184 PolarHBondContact O-OG 2.83Å
153	F	95	Very high	83.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	175.5	177.1	68.9	-81.9	0	0	0	109.8	I72 T90 I92 F108 T136 A137 D139 I141 E155	I72-F153 HydrophobicContact CG2-CE1 4.19Å; I72-F153 HydrophobicContact CG2-CZ 4.19Å; T90-F153 HydrophobicContact CG2-CB 4.05Å; T90-F153 CarbonylContact O-C 3.52Å; T90-F153 WeakPolarHBondContact O-CA 3.37Å; T90-F153 WeakPolarHBondContact O-CB 3.37Å; I92-F153 HydrophobicContact CD1-CD2 4.02Å; I92-F153 HydrophobicContact CD1-CE2 3.51Å; I92-F153 HydrophobicContact CG1-CD2 3.88Å; I92-F153 HydrophobicContact CG1-CE2 3.75Å; F108-F153 HydrophobicContact CD1-CE2 4.39Å; F108-F153 HydrophobicContact CD1-CZ 4.24Å; F108-F153 HydrophobicContact CE1-CE2 4.49Å; F108-F153 AromaticContact CE1-CZ 3.9Å; F108-F153 HydrophobicContact CE1-CZ 3.9Å; F108-F153 HydrophobicContact CZ-CZ 4.42Å; T136-F153 WeakPolarHBondContact CA-O 3.5Å; A137-F153 HydrophobicContact CB-CE1 4.03Å; A137-F153 HydrophobicContact CB-CE2 4.19Å; A137-F153 HydrophobicContact CB-CZ 3.8Å; A137-F153 PolarHBondContact N-O 3.48Å; A137-F153 PolarHBondContact O-N 2.72Å; D139-F153 HydrophobicContact CB-CE1 3.8Å; D139-F153 HydrophobicContact CB-CZ 4.47Å; I141-F153 HydrophobicContact CD1-CB 4.15Å; I141-F153 HydrophobicContact CD1-CD1 4.03Å; I141-F153 HydrophobicContact CD1-CG 4.24Å; F153-E155 HydrophobicContact CE2-CB 4.4Å
154	V	93.2	Very high	82.3	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124	176.6	178.3	0	0	0	0	110.5	T90 W91 I92 V123 I125 G156 I182	T90-V154 PolarHBondContact O-N 2.88Å; W91-V154 WeakPolarHBondContact CA-O 3.23Å; W91-V154 HydrophobicContact CB-CB 3.82Å; W91-V154 HydrophobicContact CB-CG1 4.41Å; W91-V154 WeakPolarHBondContact CB-O 3.43Å; I92-V154 PolarHBondContact N-O 3.49Å; V123-V154 HydrophobicContact CG2-CB 4.22Å; V123-V154 HydrophobicContact CG2-CG1 3.45Å; V123-V154 VanDerWaalsContact CG2-CG1 3.45Å; V123-V154 HydrophobicContact CG2-CG2 3.67Å; I125-V154 HydrophobicContact CD1-CB 4.08Å; I125-V154 HydrophobicContact CD1-CG1 4.29Å; I125-V154 HydrophobicContact CD1-CG2 3.74Å; V154-G156 PolarHBondContact O-N 3.18Å; V154-I182 HydrophobicContact CG2-CD1 4.13Å; V154-I182 HydrophobicContact CG2-CG2 4.05Å
155	E	94.3	Very high	81.7	Confident	9 Å²	9	64.9 Å²	64.9	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	103.5	167.5	-170.1	178.5	156.1	0	0	108.4	I92 G94 Y116 G134 F135 F153 Y157	I92-E155 HydrophobicContact CD1-CG 4.36Å; G94-E155 VanDerWaalsContact CA-CG 3.41Å; Y116-E155 PolarHBondContact OH-OE2 2.92Å; G134-E155 CarbonylContact C-O 3.54Å; G134-E155 WeakPolarHBondContact CA-O 3.4Å; F135-E155 HydrophobicContact CD2-CB 4.15Å; F135-E155 HydrophobicContact CE2-CB 3.72Å; F135-E155 HydrophobicContact CE2-CG 4.08Å; F135-E155 WeakPolarHBondContact CE2-OE2 2.98Å; F135-E155 HydrophobicContact CZ-CB 3.94Å; F135-E155 HydrophobicContact CZ-CG 3.86Å; F135-E155 WeakPolarHBondContact CZ-OE2 3.3Å; F135-E155 PolarHBondContact N-O 3.35Å; F135-E155 PolarHBondContact O-N 3.25Å; F153-E155 HydrophobicContact CE2-CB 4.4Å; E155-Y157 PolarHBondContact O-N 3.26Å
156	G	92.7	Very high	81.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.2	179.4	0	0	0	0	0	110.6	I92 G94 C97 Y133 V154	I92-G156 PolarHBondContact O-N 2.8Å; G94-G156 PolarHBondContact N-O 3.17Å; C97-G156 VanDerWaalsContact CB-O 3.3Å; C97-G156 WeakPolarHBondContact CB-O 3.28Å; Y133-G156 CarbonylContact O-C 3.55Å; Y133-G156 WeakPolarHBondContact O-CA 3.44Å; V154-G156 PolarHBondContact O-N 3.18Å
157	Y	91.2	Very high	80.7	Confident	77 Å²	77	65.6 Å²	65.6	30%	0.302	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-6.2	175.8	65.8	-100.4	0	0	0	112.5	S100 Y133 G134 F135 E155	S100-Y157 PolarHBondContact OG-O 3.31Å; Y133-Y157 PolarHBondContact O-N 3.42Å; G134-Y157 VanDerWaalsContact CA-CD1 3.5Å; F135-Y157 AromaticContact CD1-CD1 3.84Å; F135-Y157 HydrophobicContact CD1-CD1 3.84Å; F135-Y157 HydrophobicContact CD1-CE1 4.43Å; F135-Y157 HydrophobicContact CE1-CD1 4.21Å; E155-Y157 PolarHBondContact O-N 3.26Å
158	Q	88.8	Confident	80.3	Confident	83 Å²	83	64 Å²	64	39%	0.388	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	147.5	179.4	173	172.8	9.5	0	0	111.1	S100 Y133	S100-Q158 WeakPolarHBondContact O-CG 3.24Å; S100-Q158 WeakPolarHBondContact OG-CA 3.47Å; Y133-Q158 HydrophobicContact CD2-CG 4.17Å; Y133-Q158 PolarHBondContact N-O 3.33Å; Y133-Q158 PolarHBondContact O-N 3.06Å
159	T	83.5	Confident	80.1	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.8	167.1	70.7	0	0	0	0	110.2	S100 G101 T131 V132 W161 W164	S100-T159 PolarHBondContact O-N 3.48Å; S100-T159 VanDerWaalsContact O-N 3.1Å; G101-T159 WeakPolarHBondContact CA-OG1 3.19Å; G101-T159 PolarHBondContact O-OG1 3.1Å; T131-T159 CarbonylContact O-C 3.59Å; T131-T159 WeakPolarHBondContact O-CA 3.5Å; V132-T159 HydrophobicContact CG2-CG2 4.27Å; T159-W161 PolarHBondContact O-N 3.07Å; T159-W161 PolarHBondContact OG1-O 3.34Å; T159-W164 HydrophobicContact CG2-CD2 4.47Å; T159-W164 HydrophobicContact CG2-CE3 3.96Å; T159-W164 HydrophobicContact CG2-CZ3 4.29Å
160	S	77.8	Confident	80.1	Confident	67 Å²	67	55 Å²	55	47%	0.469	24%	0.239	S	C	.	.	S	Bend	trans	-74.2	-10.1	179.3	70	0	0	0	0	113.8	G130 T131	G130-S160 WeakPolarHBondContact CA-OG 3.48Å; T131-S160 PolarHBondContact N-OG 2.85Å; T131-S160 PolarHBondContact O-N 3.38Å
161	W	63.4	Low	80.2	Confident	140 Å²	140	44.6 Å²	44.6	53%	0.53	20%	0.2	S	C	.	.	S	Bend	trans	-120.3	119.5	-179.9	-161.7	-9.3	0	0	0	109.8	P129 T159 Y163 W164	P129-W161 HydrophobicContact CB-CE3 3.84Å; P129-W161 HydrophobicContact CB-CZ3 3.94Å; T159-W161 PolarHBondContact O-N 3.07Å; T159-W161 PolarHBondContact OG1-O 3.34Å; W161-Y163 PolarHBondContact O-N 3Å; W161-W164 HydrophobicContact CB-CE3 4.43Å
162	Y	55.9	Low	80.2	Confident	160 Å²	160	44.6 Å²	44.6	63%	0.627	20%	0.199	S	C	*	.	S	Bend	trans	-60.6	-7.2	-177.1	-126.1	-89.7	0	0	0	115.7
163	Y	54.6	Low	80.3	Confident	151 Å²	151	41.6 Å²	41.6	59%	0.592	19%	0.185	S	C	*	.			trans	-139.9	66.9	-176.5	-68	-74.6	0	0	0	111.6	W161 N165	W161-Y163 PolarHBondContact O-N 3Å; Y163-N165 PolarHBondContact O-N 2.97Å
164	W	60.5	Low	80.1	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.011	19%	0.185	C	C	.	.			trans	-72.5	63	170	-147.2	-77.2	0	0	0	111.1	W91 M105 H127 P129 V132 T159 W161 F166	W91-W164 HydrophobicContact CZ2-CZ2 4.21Å; M105-W164 HydrophobicContact CE-CG 4.48Å; M105-W164 HydrophobicContact SD-CB 3.92Å; M105-W164 HydrophobicContact SD-CG 4.02Å; H127-W164 HydrophobicContact CB-CH2 4.24Å; H127-W164 HydrophobicContact CB-CZ2 4.27Å; P129-W164 HydrophobicContact CB-CH2 4.43Å; P129-W164 HydrophobicContact CB-CZ2 4.42Å; P129-W164 HydrophobicContact CG-CD2 4.43Å; P129-W164 HydrophobicContact CG-CH2 3.66Å; P129-W164 HydrophobicContact CG-CZ2 3.37Å; P129-W164 HydrophobicContact CG-CZ3 4.27Å; V132-W164 HydrophobicContact CG2-CH2 3.91Å; V132-W164 HydrophobicContact CG2-CZ2 4.32Å; V132-W164 HydrophobicContact CG2-CZ3 4.38Å; T159-W164 HydrophobicContact CG2-CD2 4.47Å; T159-W164 HydrophobicContact CG2-CE3 3.96Å; T159-W164 HydrophobicContact CG2-CZ3 4.29Å; W161-W164 HydrophobicContact CB-CE3 4.43Å; W164-F166 AromaticContact CD1-CD2 3.3Å; W164-F166 AromaticContact CG-CD2 3.99Å; W164-F166 HydrophobicContact CG-CD2 3.99Å; W164-F166 HydrophobicContact CG-CE2 4.41Å; W164-F166 AromaticContact NE1-CD2 3.42Å; W164-F166 AromaticContact NE1-CE2 3.87Å; W164-F166 PolarHBondContact O-N 2.72Å
165	N	63.6	Low	79.9	Confident	48 Å²	48	41.5 Å²	41.5	26%	0.257	19%	0.185	S	C	.	.			trans	-84.1	55.9	-176	-70	-25.4	0	0	0	111.9	Y163 A226	Y163-N165 PolarHBondContact O-N 2.97Å; N165-A226 WeakPolarHBondContact ND2-CB 3.06Å
166	F	70.5	Confident	79.3	Confident	68 Å²	68	41.6 Å²	41.6	30%	0.298	19%	0.185	S	C	.	.			trans	-94	155.3	173.7	-72.5	-85.9	0	0	0	110.9	L65 P129 W164 Y168	L65-F166 HydrophobicContact CD1-CD1 4.03Å; P129-F166 HydrophobicContact CB-CE2 3.76Å; P129-F166 HydrophobicContact CB-CZ 3.91Å; P129-F166 HydrophobicContact CG-CE2 3.71Å; P129-F166 HydrophobicContact CG-CZ 3.9Å; W164-F166 AromaticContact CD1-CD2 3.3Å; W164-F166 AromaticContact CG-CD2 3.99Å; W164-F166 HydrophobicContact CG-CD2 3.99Å; W164-F166 HydrophobicContact CG-CE2 4.41Å; W164-F166 AromaticContact NE1-CD2 3.42Å; W164-F166 AromaticContact NE1-CE2 3.87Å; W164-F166 PolarHBondContact O-N 2.72Å; F166-Y168 HydrophobicContact CB-CD1 3.83Å; F166-Y168 HydrophobicContact CB-CE1 3.48Å; F166-Y168 VanDerWaalsContact CB-CE1 3.48Å; F166-Y168 HydrophobicContact CB-CE2 4.22Å; F166-Y168 HydrophobicContact CB-CG 4.33Å; F166-Y168 AromaticContact CD1-CE1 3.81Å; F166-Y168 HydrophobicContact CD1-CE1 3.81Å; F166-Y168 AromaticContact CG-CE1 3.79Å; F166-Y168 HydrophobicContact CG-CE1 3.79Å; F166-Y168 AromaticContact CG-CZ 3.82Å; F166-Y168 PolarHBondContact O-N 3.49Å
167	P	69.9	Low	78.8	Confident	25 Å²	25	43.2 Å²	43.2	16%	0.162	20%	0.196	C	C	.	.	S	Bend	trans	-76.1	19.3	180	31.4	-35	0	0	0	114	Y61 L65 I67 F229	Y61-P167 HydrophobicContact CD1-CB 3.43Å; Y61-P167 VanDerWaalsContact CD1-CB 3.43Å; Y61-P167 HydrophobicContact CD1-CG 3.89Å; Y61-P167 HydrophobicContact CD2-CB 4.19Å; Y61-P167 HydrophobicContact CD2-CG 4.26Å; Y61-P167 HydrophobicContact CE1-CB 3.72Å; Y61-P167 HydrophobicContact CE2-CB 4.42Å; Y61-P167 HydrophobicContact CG-CB 3.67Å; Y61-P167 HydrophobicContact CG-CG 3.66Å; L65-P167 HydrophobicContact CD1-CG 3.73Å; I67-P167 HydrophobicContact CD1-CB 4.27Å; I67-P167 HydrophobicContact CD1-CG 3.89Å; P167-F229 HydrophobicContact CG-CD1 4.38Å
168	Y	79.2	Confident	78.2	Confident	10 Å²	10	42.8 Å²	42.8	4%	0.039	21%	0.208	C	C	.	.	S	Bend	trans	-136.1	154.6	178.9	60.1	-100.4	0	0	0	110.3	L65 I67 S80 M82 M105 F166 G170 V171	L65-Y168 HydrophobicContact CD1-CD1 3.8Å; L65-Y168 HydrophobicContact CD1-CE1 3.6Å; L65-Y168 HydrophobicContact CD2-CD1 4.43Å; L65-Y168 HydrophobicContact CD2-CE1 3.79Å; L65-Y168 HydrophobicContact CG-CE1 4.23Å; I67-Y168 HydrophobicContact CD1-CD1 4.16Å; I67-Y168 HydrophobicContact CG1-CD1 4.42Å; S80-Y168 CarbonylContact O-C 3.57Å; S80-Y168 WeakPolarHBondContact O-CB 3.05Å; M82-Y168 HydrophobicContact CB-CD1 4.14Å; M82-Y168 HydrophobicContact CB-CD2 4.28Å; M82-Y168 HydrophobicContact CB-CE1 4.22Å; M82-Y168 HydrophobicContact CB-CE2 4.37Å; M82-Y168 HydrophobicContact CB-CG 4.18Å; M82-Y168 HydrophobicContact SD-CE1 4.22Å; M105-Y168 HydrophobicContact CE-CD2 4.45Å; M105-Y168 VanDerWaalsContact CE-O 3.25Å; M105-Y168 WeakPolarHBondContact CE-O 3.4Å; F166-Y168 HydrophobicContact CB-CD1 3.83Å; F166-Y168 HydrophobicContact CB-CE1 3.48Å; F166-Y168 VanDerWaalsContact CB-CE1 3.48Å; F166-Y168 HydrophobicContact CB-CE2 4.22Å; F166-Y168 HydrophobicContact CB-CG 4.33Å; F166-Y168 AromaticContact CD1-CE1 3.81Å; F166-Y168 HydrophobicContact CD1-CE1 3.81Å; F166-Y168 AromaticContact CG-CE1 3.79Å; F166-Y168 HydrophobicContact CG-CE1 3.79Å; F166-Y168 AromaticContact CG-CZ 3.82Å; F166-Y168 PolarHBondContact O-N 3.49Å; Y168-G170 WeakPolarHBondContact CD2-O 3.34Å; Y168-V171 HydrophobicContact CE2-CG2 4.37Å
169	D	86.5	Confident	77.7	Confident	26 Å²	26	39.5 Å²	39.5	14%	0.139	19%	0.194	C	C	.	.	S	Bend	trans	-86.6	-29.9	-180	-55.1	-48.9	0	0	0	112.3	F79 S80 P93 M105 K106	F79-D169 WeakPolarHBondContact CA-OD2 3.3Å; F79-D169 HydrophobicContact CB-CB 4.27Å; F79-D169 HydrophobicContact CD1-CB 4.14Å; S80-D169 PolarHBondContact N-OD2 3.03Å; S80-D169 WeakPolarHBondContact O-CB 3.32Å; S80-D169 PolarHBondContact O-N 3.41Å; P93-D169 WeakPolarHBondContact CD-O 3.44Å; P93-D169 WeakPolarHBondContact CG-O 3.33Å; M105-D169 WeakPolarHBondContact CE-O 3.2Å; K106-D169 HydrophobicContact CB-CB 4.36Å; K106-D169 WeakPolarHBondContact CB-OD1 3.44Å; K106-D169 PolarHBondContact N-OD1 3.36Å
170	G	90.3	Very high	77.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	-164.4	-177.7	0	0	0	0	0	113.9	V81 M82 W91 Y168	V81-G170 CarbonylContact C-O 3.58Å; V81-G170 VanDerWaalsContact CA-O 3.31Å; V81-G170 WeakPolarHBondContact CA-O 3.33Å; M82-G170 PolarHBondContact N-O 3.47Å; W91-G170 WeakPolarHBondContact O-CA 3.44Å; Y168-G170 WeakPolarHBondContact CD2-O 3.34Å
171	V	90.8	Very high	77.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.2	-179.8	-180	0	0	0	0	109.9	M82 D84 T90 W91 Y168	M82-V171 HydrophobicContact CB-CG2 4.36Å; M82-V171 HydrophobicContact CE-CB 4.47Å; M82-V171 HydrophobicContact CE-CG1 3.93Å; M82-V171 HydrophobicContact CE-CG2 3.71Å; D84-V171 HydrophobicContact CB-CG1 3.74Å; T90-V171 CarbonylContact C-O 3.48Å; T90-V171 VanDerWaalsContact CA-O 3.24Å; T90-V171 WeakPolarHBondContact CA-O 3.43Å; T90-V171 WeakPolarHBondContact CG2-O 3.13Å; W91-V171 HydrophobicContact CZ2-CG2 4.12Å; W91-V171 PolarHBondContact N-O 3Å; W91-V171 VanDerWaalsContact NE1-CG2 3.26Å; W91-V171 PolarHBondContact O-N 2.79Å; Y168-V171 HydrophobicContact CE2-CG2 4.37Å
172	L	92.8	Very high	78.1	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	101.8	168.3	-177.5	71.8	0	0	0	108.7	I70 V81 M82 I83 D84 T90 M143 L174	I70-L172 HydrophobicContact CG2-CD2 4.27Å; V81-L172 HydrophobicContact CB-CB 4.34Å; V81-L172 HydrophobicContact CG2-CB 3.79Å; M82-L172 PolarHBondContact O-N 3.32Å; I83-L172 HydrophobicContact CD1-CB 4.26Å; I83-L172 HydrophobicContact CD1-CD2 3.73Å; D84-L172 PolarHBondContact N-O 2.89Å; T90-L172 HydrophobicContact CG2-CD1 3.96Å; M143-L172 HydrophobicContact CE-CD2 3.37Å; L172-L174 HydrophobicContact CD2-CD2 4.41Å; L172-L174 HydrophobicContact CG-CD2 4.35Å
173	G	92.3	Very high	79.3	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	130.5	178.8	0	0	0	0	0	111.9	S87 T90 N186	S87-G173 CarbonylContact O-C 3.53Å; S87-G173 VanDerWaalsContact O-C 3.32Å; S87-G173 WeakPolarHBondContact O-CA 3.17Å; T90-G173 PolarHBondContact OG1-N 3.16Å; G173-N186 WeakPolarHBondContact O-CB 3.37Å
174	L	91.1	Very high	80.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.			trans	-118.2	6	-178.9	-63.5	179.4	0	0	0	113.9	I83 D84 T85 S87 L172 N186 V188 F202 W265	I83-L174 HydrophobicContact CG2-CD1 3.62Å; D84-L174 PolarHBondContact O-N 2.91Å; T85-L174 HydrophobicContact CG2-CB 4.48Å; T85-L174 HydrophobicContact CG2-CD1 4.48Å; S87-L174 PolarHBondContact O-N 2.93Å; L172-L174 HydrophobicContact CD2-CD2 4.41Å; L172-L174 HydrophobicContact CG-CD2 4.35Å; L174-N186 PolarHBondContact O-ND2 3.16Å; L174-V188 HydrophobicContact CD2-CG2 3.97Å; L174-F202 HydrophobicContact CB-CZ 4.05Å; L174-F202 HydrophobicContact CD1-CD2 4.36Å; L174-F202 HydrophobicContact CD1-CE2 3.94Å; L174-F202 HydrophobicContact CD1-CZ 4.2Å; L174-W265 PolarHBondContact O-NE1 3.34Å
175	A	87.8	Confident	81.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-74.7	176	170.7	0	0	0	0	0	112.5	S87 A88 N186	S87-A175 VanDerWaalsContact O-CB 3.27Å; S87-A175 WeakPolarHBondContact O-CB 3.44Å; S87-A175 PolarHBondContact O-N 3.24Å; A88-A175 HydrophobicContact CB-CB 3.92Å; A175-N186 PolarHBondContact O-ND2 3.39Å
176	F	83.2	Confident	82.9	Confident	11 Å²	11	34.6 Å²	34.6	5%	0.048	17%	0.166	C	C	.	.			trans	-78.7	157.1	-176.7	-71.9	-89.4	0	0	0	112.6	A88 A178 S179 R262 D263 W265 F397	A88-F176 VanDerWaalsContact CB-O 3.3Å; A88-F176 WeakPolarHBondContact CB-O 3.35Å; F176-A178 PolarHBondContact O-N 2.63Å; F176-S179 PolarHBondContact O-N 3.22Å; F176-R262 VanDerWaalsContact CB-O 3.25Å; F176-R262 WeakPolarHBondContact CB-O 3.45Å; F176-R262 HydrophobicContact CD1-CB 4.11Å; F176-R262 HydrophobicContact CD1-CG 4.44Å; F176-R262 HydrophobicContact CD2-CB 4.48Å; F176-R262 HydrophobicContact CE1-CB 4.3Å; F176-R262 HydrophobicContact CE1-CG 4.16Å; F176-R262 HydrophobicContact CG-CB 4.2Å; F176-R262 HydrophobicContact CZ-CG 4.37Å; F176-D263 WeakPolarHBondContact CB-O 3.25Å; F176-D263 PolarHBondContact N-O 3.22Å; F176-D263 VanDerWaalsContact N-O 3.1Å; F176-W265 HydrophobicContact CD2-CD2 4.1Å; F176-W265 HydrophobicContact CD2-CE3 4.4Å; F176-W265 HydrophobicContact CD2-CZ2 4.28Å; F176-W265 HydrophobicContact CE1-CH2 4.22Å; F176-W265 HydrophobicContact CE1-CZ3 4.44Å; F176-W265 AromaticContact CE2-CD2 3.44Å; F176-W265 HydrophobicContact CE2-CD2 3.44Å; F176-W265 VanDerWaalsContact CE2-CD2 3.44Å; F176-W265 AromaticContact CE2-CE2 3.64Å; F176-W265 AromaticContact CE2-CE3 3.33Å; F176-W265 HydrophobicContact CE2-CE3 3.33Å; F176-W265 HydrophobicContact CE2-CG 4.18Å; F176-W265 AromaticContact CE2-CH2 3.66Å; F176-W265 HydrophobicContact CE2-CH2 3.66Å; F176-W265 AromaticContact CE2-CZ2 3.77Å; F176-W265 HydrophobicContact CE2-CZ2 3.77Å; F176-W265 AromaticContact CE2-CZ3 3.43Å; F176-W265 HydrophobicContact CE2-CZ3 3.43Å; F176-W265 VanDerWaalsContact CE2-CZ3 3.43Å; F176-W265 HydrophobicContact CZ-CD2 4.21Å; F176-W265 AromaticContact CZ-CE3 3.74Å; F176-W265 HydrophobicContact CZ-CE3 3.74Å; F176-W265 AromaticContact CZ-CH2 3.45Å; F176-W265 HydrophobicContact CZ-CH2 3.45Å; F176-W265 VanDerWaalsContact CZ-CH2 3.45Å; F176-W265 AromaticContact CZ-CZ2 3.96Å; F176-W265 HydrophobicContact CZ-CZ2 3.96Å; F176-W265 AromaticContact CZ-CZ3 3.32Å; F176-W265 HydrophobicContact CZ-CZ3 3.32Å; F176-F397 HydrophobicContact CD1-CD1 4.23Å; F176-F397 AromaticContact CE1-CD1 3.67Å; F176-F397 HydrophobicContact CE1-CD1 3.67Å; F176-F397 HydrophobicContact CE1-CE1 4.24Å; F176-F397 HydrophobicContact CZ-CD1 4.1Å
177	P	80.4	Confident	83.7	Confident	34 Å²	34	31.5 Å²	31.5	22%	0.221	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-52.6	-30.4	176.6	-28.1	34.1	0	0	0	115	S179 S180 K185 I189	P177-S179 PolarHBondContact O-N 3.46Å; P177-S179 VanDerWaalsContact O-N 3.14Å; P177-S180 WeakPolarHBondContact O-CB 2.94Å; P177-S180 PolarHBondContact O-N 3.2Å; P177-K185 HydrophobicContact CG-CG 4.16Å; P177-I189 HydrophobicContact CG-CD1 4.34Å
178	A	80.1	Confident	84.5	Confident	67 Å²	67	30.4 Å²	30.4	55%	0.554	15%	0.145	S	C	*	.	G	3₁₀ helix	trans	-64	-17.9	178.1	0	0	0	0	0	113.7	F176 R262	F176-A178 PolarHBondContact O-N 2.63Å; A178-R262 WeakPolarHBondContact CB-O 3.28Å
179	S	78.6	Confident	84.7	Confident	15 Å²	15	30.8 Å²	30.8	11%	0.105	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-99.9	-6.8	175	-59.5	0	0	0	0	113.1	F176 P177 D263 Y264	F176-S179 PolarHBondContact O-N 3.22Å; P177-S179 PolarHBondContact O-N 3.46Å; P177-S179 VanDerWaalsContact O-N 3.14Å; S179-D263 WeakPolarHBondContact OG-CA 3.37Å; S179-D263 PolarHBondContact OG-O 2.75Å; S179-Y264 WeakPolarHBondContact OG-CD2 3.27Å; S179-Y264 VanDerWaalsContact OG-CE2 3.27Å; S179-Y264 WeakPolarHBondContact OG-CE2 3.47Å
180	S	76	Confident	84.6	Confident	5 Å²	5	30.8 Å²	30.8	4%	0.035	15%	0.148	C	C	.	.			trans	-79.7	136.6	-179.1	168.4	0	0	0	0	110.5	D89 P177 I182 Y183 S184	D89-S180 WeakPolarHBondContact OD1-CA 3.4Å; D89-S180 VanDerWaalsContact OD1-CB 3.3Å; D89-S180 WeakPolarHBondContact OD1-CB 3.46Å; D89-S180 PolarHBondContact OD1-OG 2.88Å; P177-S180 WeakPolarHBondContact O-CB 2.94Å; P177-S180 PolarHBondContact O-N 3.2Å; S180-I182 PolarHBondContact O-N 3.27Å; S180-I182 WeakPolarHBondContact OG-CG1 3.35Å; S180-I182 PolarHBondContact OG-N 2.86Å; S180-I182 VanDerWaalsContact OG-N 3.09Å; S180-Y183 PolarHBondContact O-N 2.94Å; S180-Y183 PolarHBondContact OG-N 2.83Å; S180-S184 PolarHBondContact OG-N 2.83Å; S180-S184 VanDerWaalsContact OG-N 3.17Å
181	R	78.4	Confident	84.2	Confident	176 Å²	176	30.9 Å²	30.9	66%	0.664	15%	0.148	S	C	*	.	S	Bend	trans	-67.3	-23.1	171	-67.3	-60.9	-173.4	177.2	1.1	112.5	D89 I125	D89-R181 VanDerWaalsContact CG-N 3.35Å; D89-R181 PolarHBondContact OD1-N 2.66Å; D89-R181 WeakPolarHBondContact OD2-CB 3.25Å; D89-R181 WeakPolarHBondContact OD2-CG 3.29Å; D89-R181 PolarHBondContact OD2-N 2.9Å; I125-R181 HydrophobicContact CG1-CG 4.49Å
182	I	78.6	Confident	83.7	Confident	20 Å²	20	32.1 Å²	32.1	10%	0.103	16%	0.158	C	C	.	.	S	Bend	trans	-108	2.6	-179.1	71.3	170.3	0	0	0	112.6	D89 V123 T136 E152 V154 S180 S184	D89-I182 WeakPolarHBondContact OD1-CG1 3.32Å; D89-I182 PolarHBondContact OD1-N 3.37Å; V123-I182 HydrophobicContact CB-CG2 4.26Å; V123-I182 HydrophobicContact CG1-CG2 3.55Å; V123-I182 HydrophobicContact CG2-CG2 4.41Å; T136-I182 HydrophobicContact CG2-CB 3.99Å; T136-I182 HydrophobicContact CG2-CD1 4.28Å; T136-I182 HydrophobicContact CG2-CG2 3.65Å; E152-I182 HydrophobicContact CB-CD1 4.4Å; V154-I182 HydrophobicContact CG2-CD1 4.13Å; V154-I182 HydrophobicContact CG2-CG2 4.05Å; S180-I182 PolarHBondContact O-N 3.27Å; S180-I182 WeakPolarHBondContact OG-CG1 3.35Å; S180-I182 PolarHBondContact OG-N 2.86Å; S180-I182 VanDerWaalsContact OG-N 3.09Å; I182-S184 PolarHBondContact O-N 2.81Å; I182-S184 VanDerWaalsContact O-N 3.13Å
183	Y	79.6	Confident	83.1	Confident	181 Å²	181	37.9 Å²	37.9	71%	0.71	19%	0.185	S	C	*	.			trans	54	24.3	-175.2	-57.6	-82.7	0	0	0	114.3	S180	S180-Y183 PolarHBondContact O-N 2.94Å; S180-Y183 PolarHBondContact OG-N 2.83Å
184	S	82.3	Confident	82.5	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.042	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-75.5	146.2	-178.4	170.4	0	0	0	0	111.3	E152 S180 I182	E152-S184 WeakPolarHBondContact CB-OG 2.96Å; E152-S184 PolarHBondContact O-OG 2.83Å; S180-S184 PolarHBondContact OG-N 2.83Å; S180-S184 VanDerWaalsContact OG-N 3.17Å; I182-S184 PolarHBondContact O-N 2.81Å; I182-S184 VanDerWaalsContact O-N 3.13Å
185	K	84.1	Confident	81.7	Confident	82 Å²	82	44.6 Å²	44.6	36%	0.357	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-72.4	129.5	165.8	-64.7	-178.2	-171.1	-169.2	0	109.2	Q151 P177 I189 N190 E193	Q151-K185 PolarHBondContact NE2-O 2.95Å; P177-K185 HydrophobicContact CG-CG 4.16Å; K185-I189 HydrophobicContact CB-CB 4.3Å; K185-I189 HydrophobicContact CB-CG2 4.16Å; K185-I189 HydrophobicContact CD-CG2 3.88Å; K185-I189 HydrophobicContact CG-CG2 4.18Å; K185-N190 VanDerWaalsContact CB-OD1 3.3Å; K185-N190 WeakPolarHBondContact CB-OD1 3.37Å; K185-N190 WeakPolarHBondContact CD-OD1 3.26Å; K185-N190 PolarHBondContact O-ND2 2.83Å; K185-E193 IonicContact NZ-OE1 2.83Å; K185-E193 PolarHBondContact NZ-OE1 2.74Å; K185-E193 IonicContact NZ-OE2 3.37Å; K185-E193 PolarHBondContact NZ-OE2 3.12Å
186	N	88.6	Confident	81.2	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-63.9	164.9	171.1	72.8	51	0	0	0	111.1	G173 L174 A175 V188 I189 N190 F397	G173-N186 WeakPolarHBondContact O-CB 3.37Å; L174-N186 PolarHBondContact O-ND2 3.16Å; A175-N186 PolarHBondContact O-ND2 3.39Å; N186-V188 VanDerWaalsContact C-N 3.3Å; N186-V188 PolarHBondContact O-N 3.38Å; N186-V188 PolarHBondContact OD1-N 3.09Å; N186-I189 PolarHBondContact O-N 3.12Å; N186-I189 PolarHBondContact OD1-N 3.42Å; N186-N190 PolarHBondContact O-N 3.5Å; N186-F397 VanDerWaalsContact ND2-CE1 3.28Å; N186-F397 WeakPolarHBondContact ND2-CE1 3.5Å; N186-F397 VanDerWaalsContact ND2-CZ 3.35Å; N186-F397 WeakPolarHBondContact ND2-CZ 3.43Å
187	M	86.8	Confident	80.8	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-56.9	-39.4	-176.4	-179.8	176.2	175.6	0	0	113.9	I141 M143 L146 N190 L191	I141-M187 HydrophobicContact CG2-SD 3.89Å; I141-M187 WeakPolarHBondContact O-CE 3.12Å; M143-M187 HydrophobicContact CB-CE 3.73Å; M143-M187 HydrophobicContact CB-SD 4.23Å; L146-M187 WeakPolarHBondContact O-CE 3.34Å; M187-N190 PolarHBondContact O-N 3.12Å; M187-L191 HydrophobicContact CE-CD1 3.8Å; M187-L191 HydrophobicContact CG-CD1 3.95Å; M187-L191 HydrophobicContact CG-CG 4.34Å; M187-L191 VanDerWaalsContact O-CG 3.25Å; M187-L191 WeakPolarHBondContact O-CG 3.49Å; M187-L191 PolarHBondContact O-N 2.87Å
188	V	86.6	Confident	80.7	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-70.5	-37.7	-176.1	-175.2	0	0	0	0	111.1	L174 N186 L191 A192 L197 F202 V243 F397	L174-V188 HydrophobicContact CD2-CG2 3.97Å; N186-V188 VanDerWaalsContact C-N 3.3Å; N186-V188 PolarHBondContact O-N 3.38Å; N186-V188 PolarHBondContact OD1-N 3.09Å; V188-L191 PolarHBondContact O-N 2.87Å; V188-A192 WeakPolarHBondContact O-CB 3.29Å; V188-A192 PolarHBondContact O-N 3Å; V188-L197 HydrophobicContact CG1-CD1 3.85Å; V188-F202 HydrophobicContact CB-CD1 4.5Å; V188-F202 HydrophobicContact CG1-CB 4.44Å; V188-F202 HydrophobicContact CG1-CD1 4.2Å; V188-F202 HydrophobicContact CG2-CD1 4.31Å; V188-V243 HydrophobicContact CG1-CG1 3.88Å; V188-V243 HydrophobicContact CG2-CG1 4.06Å; V188-V243 HydrophobicContact CG2-CG2 4.5Å; V188-F397 HydrophobicContact CB-CD2 4.47Å; V188-F397 HydrophobicContact CB-CE2 3.59Å; V188-F397 HydrophobicContact CB-CZ 4.07Å; V188-F397 HydrophobicContact CG1-CD2 3.99Å; V188-F397 HydrophobicContact CG1-CE2 3.42Å; V188-F397 VanDerWaalsContact CG1-CE2 3.42Å; V188-F397 HydrophobicContact CG1-CZ 4.38Å
189	I	84.4	Confident	80.4	Confident	17 Å²	17	54.7 Å²	54.7	9%	0.087	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-48.5	173	-63.6	170.7	0	0	0	110.1	P177 K185 N186 L191 A192 E193 F397	P177-I189 HydrophobicContact CG-CD1 4.34Å; K185-I189 HydrophobicContact CB-CB 4.3Å; K185-I189 HydrophobicContact CB-CG2 4.16Å; K185-I189 HydrophobicContact CD-CG2 3.88Å; K185-I189 HydrophobicContact CG-CG2 4.18Å; N186-I189 PolarHBondContact O-N 3.12Å; N186-I189 PolarHBondContact OD1-N 3.42Å; I189-L191 VanDerWaalsContact C-N 3.33Å; I189-L191 PolarHBondContact O-N 3.42Å; I189-A192 WeakPolarHBondContact O-CB 3.38Å; I189-A192 PolarHBondContact O-N 2.93Å; I189-E193 HydrophobicContact CG2-CG 4.3Å; I189-E193 WeakPolarHBondContact O-CG 3.44Å; I189-E193 PolarHBondContact O-N 3.08Å; I189-F397 HydrophobicContact CD1-CD1 3.64Å; I189-F397 HydrophobicContact CD1-CE1 3.57Å; I189-F397 HydrophobicContact CD1-CZ 4.45Å; I189-F397 HydrophobicContact CG1-CB 4.44Å; I189-F397 HydrophobicContact CG1-CD1 3.26Å; I189-F397 HydrophobicContact CG1-CD2 4.25Å; I189-F397 HydrophobicContact CG1-CE1 3.33Å; I189-F397 HydrophobicContact CG1-CE2 4.31Å; I189-F397 HydrophobicContact CG1-CG 3.75Å; I189-F397 HydrophobicContact CG1-CZ 3.87Å
190	N	83.2	Confident	80.5	Confident	27 Å²	27	55.6 Å²	55.6	14%	0.144	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-38.7	-179	-76.4	-24.5	0	0	0	112.4	S148 Q151 K185 N186 M187 S194	S148-N190 WeakPolarHBondContact OG-CB 3.29Å; Q151-N190 PolarHBondContact OE1-ND2 3.31Å; K185-N190 VanDerWaalsContact CB-OD1 3.3Å; K185-N190 WeakPolarHBondContact CB-OD1 3.37Å; K185-N190 WeakPolarHBondContact CD-OD1 3.26Å; K185-N190 PolarHBondContact O-ND2 2.83Å; N186-N190 PolarHBondContact O-N 3.5Å; M187-N190 PolarHBondContact O-N 3.12Å; N190-S194 VanDerWaalsContact O-CB 3.28Å; N190-S194 WeakPolarHBondContact O-CB 3.43Å; N190-S194 PolarHBondContact O-N 2.84Å; N190-S194 PolarHBondContact O-OG 3.08Å
191	L	83.1	Confident	80.7	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-41.9	173.8	-71.1	169.7	0	0	0	112	L146 M187 V188 I189 S194 G195 L196 L197 V243	L146-L191 HydrophobicContact CB-CD1 3.98Å; L146-L191 HydrophobicContact CB-CD2 4.14Å; L146-L191 HydrophobicContact CD1-CD1 4.24Å; M187-L191 HydrophobicContact CE-CD1 3.8Å; M187-L191 HydrophobicContact CG-CD1 3.95Å; M187-L191 HydrophobicContact CG-CG 4.34Å; M187-L191 VanDerWaalsContact O-CG 3.25Å; M187-L191 WeakPolarHBondContact O-CG 3.49Å; M187-L191 PolarHBondContact O-N 2.87Å; V188-L191 PolarHBondContact O-N 2.87Å; I189-L191 VanDerWaalsContact C-N 3.33Å; I189-L191 PolarHBondContact O-N 3.42Å; L191-S194 PolarHBondContact O-N 2.93Å; L191-G195 PolarHBondContact O-N 3.42Å; L191-L196 HydrophobicContact CD2-CB 4.26Å; L191-L196 HydrophobicContact CD2-CD1 3.76Å; L191-L196 PolarHBondContact O-N 2.87Å; L191-L197 HydrophobicContact CB-CD1 3.89Å; L191-L197 HydrophobicContact CB-CD2 3.96Å; L191-L197 HydrophobicContact CB-CG 3.77Å; L191-L197 HydrophobicContact CD1-CD2 4.35Å; L191-V243 HydrophobicContact CD1-CG1 4.31Å
192	A	79.6	Confident	81.1	Confident	26 Å²	26	47.5 Å²	47.5	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-49	177.4	0	0	0	0	0	111.8	V188 I189 S194 G195 L197 P200	V188-A192 WeakPolarHBondContact O-CB 3.29Å; V188-A192 PolarHBondContact O-N 3Å; I189-A192 WeakPolarHBondContact O-CB 3.38Å; I189-A192 PolarHBondContact O-N 2.93Å; A192-S194 PolarHBondContact O-N 3.4Å; A192-G195 PolarHBondContact O-N 2.92Å; A192-L197 HydrophobicContact CB-CD1 4.1Å; A192-P200 HydrophobicContact CB-CB 3.92Å
193	E	81.3	Confident	81.4	Confident	120 Å²	120	46.6 Å²	46.6	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-65.1	-28.3	178.6	-71	-176.9	175.5	0	0	112.8	K185 I189 G195	K185-E193 IonicContact NZ-OE1 2.83Å; K185-E193 PolarHBondContact NZ-OE1 2.74Å; K185-E193 IonicContact NZ-OE2 3.37Å; K185-E193 PolarHBondContact NZ-OE2 3.12Å; I189-E193 HydrophobicContact CG2-CG 4.3Å; I189-E193 WeakPolarHBondContact O-CG 3.44Å; I189-E193 PolarHBondContact O-N 3.08Å; E193-G195 PolarHBondContact O-N 3.03Å
194	S	78.3	Confident	81.8	Confident	79 Å²	79	38 Å²	38	55%	0.552	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-1.4	173.6	-57.8	0	0	0	0	113.5	N190 L191 A192 L196	N190-S194 VanDerWaalsContact O-CB 3.28Å; N190-S194 WeakPolarHBondContact O-CB 3.43Å; N190-S194 PolarHBondContact O-N 2.84Å; N190-S194 PolarHBondContact O-OG 3.08Å; L191-S194 PolarHBondContact O-N 2.93Å; A192-S194 PolarHBondContact O-N 3.4Å; S194-L196 VanDerWaalsContact C-N 3.26Å; S194-L196 PolarHBondContact O-N 3.09Å
195	G	75.6	Confident	81.9	Confident	63 Å²	63	39.3 Å²	39.3	65%	0.649	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	20.1	-178	0	0	0	0	0	114.2	L191 A192 E193	L191-G195 PolarHBondContact O-N 3.42Å; A192-G195 PolarHBondContact O-N 2.92Å; E193-G195 PolarHBondContact O-N 3.03Å
196	L	76.5	Confident	81.8	Confident	95 Å²	95	35.5 Å²	35.5	50%	0.497	22%	0.216	S	C	.	.			trans	-87.7	-7.3	-178.5	-66.7	174	0	0	0	113.3	L191 S194	L191-L196 HydrophobicContact CD2-CB 4.26Å; L191-L196 HydrophobicContact CD2-CD1 3.76Å; L191-L196 PolarHBondContact O-N 2.87Å; S194-L196 VanDerWaalsContact C-N 3.26Å; S194-L196 PolarHBondContact O-N 3.09Å
197	L	74.6	Confident	81.5	Confident	22 Å²	22	36.6 Å²	36.6	12%	0.115	23%	0.225	C	C	.	.	S	Bend	trans	-113.8	138.2	179.3	-55.1	-174.1	0	0	0	110.8	L146 V188 L191 A192 Q199 V243	L146-L197 HydrophobicContact CD1-CD2 3.63Å; V188-L197 HydrophobicContact CG1-CD1 3.85Å; L191-L197 HydrophobicContact CB-CD1 3.89Å; L191-L197 HydrophobicContact CB-CD2 3.96Å; L191-L197 HydrophobicContact CB-CG 3.77Å; L191-L197 HydrophobicContact CD1-CD2 4.35Å; A192-L197 HydrophobicContact CB-CD1 4.1Å; L197-Q199 VanDerWaalsContact CB-O 3.31Å; L197-Q199 WeakPolarHBondContact CB-O 3.33Å; L197-Q199 PolarHBondContact O-N 2.8Å; L197-V243 HydrophobicContact CD1-CG1 3.83Å; L197-V243 HydrophobicContact CD2-CG1 3.78Å; L197-V243 HydrophobicContact CG-CG1 4.5Å
198	S	77.5	Confident	81	Confident	122 Å²	122	41 Å²	41	85%	0.853	24%	0.242	S	C	*	.	S	Bend	trans	-62.9	-33.3	172.7	-55.3	0	0	0	0	112.3
199	Q	75.6	Confident	80.3	Confident	84 Å²	84	42.8 Å²	42.8	39%	0.393	25%	0.25	S	C	.	.	S	Bend	trans	-139	148.5	174.4	-64.6	-177.8	45.3	0	0	110.4	L197 I201 G244	L197-Q199 VanDerWaalsContact CB-O 3.31Å; L197-Q199 WeakPolarHBondContact CB-O 3.33Å; L197-Q199 PolarHBondContact O-N 2.8Å; Q199-I201 HydrophobicContact CB-CD1 4.1Å; Q199-I201 HydrophobicContact CB-CG1 3.88Å; Q199-I201 HydrophobicContact CB-CG2 4.35Å; Q199-I201 PolarHBondContact O-N 2.76Å; Q199-G244 WeakPolarHBondContact CB-O 3.35Å; Q199-G244 PolarHBondContact N-O 3.03Å; Q199-G244 VanDerWaalsContact O-CA 3.31Å; Q199-G244 WeakPolarHBondContact O-CA 3.32Å
200	P	79	Confident	79.5	Confident	34 Å²	34	49.2 Å²	49.2	22%	0.221	28%	0.277	C	S	.	.	S	Bend	trans	-80.1	49.4	179.7	35.8	-38	0	0	0	111.4	A192 F397 C398	A192-P200 HydrophobicContact CB-CB 3.92Å; P200-F397 WeakPolarHBondContact O-CD2 3.19Å; P200-F397 PolarHBondContact O-N 2.88Å; P200-C398 HydrophobicContact CB-CB 4.16Å; P200-C398 WeakPolarHBondContact CB-SG 3.36Å; P200-C398 HydrophobicContact CG-CB 3.48Å; P200-C398 VanDerWaalsContact CG-CB 3.48Å; P200-C398 WeakPolarHBondContact CG-SG 3.49Å
201	I	80.5	Confident	78.5	Confident	12 Å²	12	48.1 Å²	48.1	6%	0.062	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	160.6	-174.2	72.5	179.5	0	0	0	111.6	Q199 G244 I394 Q395	Q199-I201 HydrophobicContact CB-CD1 4.1Å; Q199-I201 HydrophobicContact CB-CG1 3.88Å; Q199-I201 HydrophobicContact CB-CG2 4.35Å; Q199-I201 PolarHBondContact O-N 2.76Å; I201-G244 PolarHBondContact O-N 2.97Å; I201-I394 HydrophobicContact CB-CG2 4.23Å; I201-I394 HydrophobicContact CD1-CG2 4.03Å; I201-Q395 CarbonylContact C-O 3.5Å; I201-Q395 WeakPolarHBondContact CA-O 3.36Å; I201-Q395 WeakPolarHBondContact CB-O 3.49Å
202	F	86.3	Confident	77.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153	159.5	66.7	-83	0	0	0	110.4	T85 L174 V188 I204 L241 T242 V243 W265 I394 Q395 F397	T85-F202 HydrophobicContact CG2-CE2 4.05Å; T85-F202 HydrophobicContact CG2-CZ 4.3Å; L174-F202 HydrophobicContact CB-CZ 4.05Å; L174-F202 HydrophobicContact CD1-CD2 4.36Å; L174-F202 HydrophobicContact CD1-CE2 3.94Å; L174-F202 HydrophobicContact CD1-CZ 4.2Å; V188-F202 HydrophobicContact CB-CD1 4.5Å; V188-F202 HydrophobicContact CG1-CB 4.44Å; V188-F202 HydrophobicContact CG1-CD1 4.2Å; V188-F202 HydrophobicContact CG2-CD1 4.31Å; F202-I204 HydrophobicContact CD2-CD1 4.4Å; F202-I204 HydrophobicContact CD2-CG1 4.12Å; F202-I204 HydrophobicContact CE2-CD1 3.98Å; F202-I204 HydrophobicContact CE2-CG1 4.17Å; F202-L241 HydrophobicContact CB-CD1 4.05Å; F202-L241 HydrophobicContact CD2-CD1 3.64Å; F202-L241 HydrophobicContact CG-CD1 4.23Å; F202-T242 CarbonylContact C-O 3.52Å; F202-T242 WeakPolarHBondContact CA-O 3.38Å; F202-V243 HydrophobicContact CB-CG2 4.44Å; F202-W265 HydrophobicContact CE1-CH2 4.27Å; F202-W265 AromaticContact CE1-CZ2 3.81Å; F202-W265 HydrophobicContact CE1-CZ2 3.81Å; F202-W265 HydrophobicContact CZ-CZ2 4.27Å; F202-I394 WeakPolarHBondContact O-CA 3.32Å; F202-Q395 HydrophobicContact CD1-CB 3.94Å; F202-Q395 HydrophobicContact CE1-CB 3.4Å; F202-Q395 HydrophobicContact CE1-CG 4.13Å; F202-Q395 HydrophobicContact CE2-CB 4.07Å; F202-Q395 VanDerWaalsContact CE2-CD 3.46Å; F202-Q395 HydrophobicContact CE2-CG 4.18Å; F202-Q395 VanDerWaalsContact CE2-OE1 3.29Å; F202-Q395 HydrophobicContact CZ-CB 3.48Å; F202-Q395 VanDerWaalsContact CZ-CB 3.48Å; F202-Q395 VanDerWaalsContact CZ-CD 3.47Å; F202-Q395 HydrophobicContact CZ-CG 3.69Å; F202-Q395 PolarHBondContact N-O 3.41Å; F202-Q395 PolarHBondContact O-N 2.76Å; F202-F397 AromaticContact CD1-CE2 3.62Å; F202-F397 HydrophobicContact CD1-CE2 3.62Å; F202-F397 HydrophobicContact CD1-CZ 4.08Å; F202-F397 AromaticContact CE1-CE2 3.67Å; F202-F397 HydrophobicContact CE1-CE2 3.67Å; F202-F397 AromaticContact CE1-CZ 3.66Å; F202-F397 HydrophobicContact CE1-CZ 3.66Å
203	T	85.3	Confident	76.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.6	178.6	-52.9	0	0	0	0	110.3	L241 T242 A245 Q246 D247 H393 I394	T203-L241 CarbonylContact O-C 3.53Å; T203-L241 WeakPolarHBondContact O-CA 3.26Å; T203-T242 PolarHBondContact N-O 2.9Å; T203-T242 PolarHBondContact O-N 3.13Å; T203-A245 PolarHBondContact OG1-O 3.03Å; T203-A245 VanDerWaalsContact OG1-O 3.08Å; T203-Q246 WeakPolarHBondContact OG1-CA 3.5Å; T203-D247 HydrophobicContact CG2-CB 3.75Å; T203-H393 CarbonylContact C-O 3.52Å; T203-H393 WeakPolarHBondContact CA-O 3.45Å; T203-I394 HydrophobicContact CG2-CG1 3.98Å
204	I	88.4	Confident	74.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.8	167.7	-61.6	175.9	0	0	0	108.3	L58 I83 T85 F202 L241 L388 H393	L58-I204 HydrophobicContact CD1-CG2 4.19Å; I83-I204 HydrophobicContact CG2-CD1 4.43Å; T85-I204 HydrophobicContact CG2-CD1 3.45Å; T85-I204 VanDerWaalsContact CG2-CD1 3.45Å; F202-I204 HydrophobicContact CD2-CD1 4.4Å; F202-I204 HydrophobicContact CD2-CG1 4.12Å; F202-I204 HydrophobicContact CE2-CD1 3.98Å; F202-I204 HydrophobicContact CE2-CG1 4.17Å; I204-L241 HydrophobicContact CG1-CD1 3.79Å; I204-L388 HydrophobicContact CG2-CD2 4.12Å; I204-H393 HydrophobicContact CB-CB 4.35Å; I204-H393 PolarHBondContact N-O 3.18Å; I204-H393 PolarHBondContact O-N 2.75Å
205	W	83.9	Confident	72.7	Confident	34 Å²	34	54.5 Å²	54.5	13%	0.129	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.9	166.9	166.7	73	0	0	0	109.3	A207 G239 L240 H250	W205-A207 HydrophobicContact CH2-CB 3.79Å; W205-A207 HydrophobicContact CZ2-CB 3.78Å; W205-G239 CarbonylContact O-C 3.57Å; W205-G239 WeakPolarHBondContact O-CA 3.29Å; W205-L240 HydrophobicContact CE3-CB 3.92Å; W205-L240 PolarHBondContact N-O 3.26Å; W205-L240 PolarHBondContact O-N 3.14Å; W205-H250 HydrophobicContact CB-CB 4.15Å; W205-H250 HydrophobicContact CD2-CB 3.39Å; W205-H250 AromaticContact CD2-CD2 3.85Å; W205-H250 AromaticContact CD2-CG 3.4Å; W205-H250 AromaticContact CD2-ND1 3.8Å; W205-H250 VanDerWaalsContact CE2-CB 3.49Å; W205-H250 AromaticContact CE2-CD2 3.71Å; W205-H250 AromaticContact CE2-CG 3.61Å; W205-H250 HydrophobicContact CE3-CB 4.04Å; W205-H250 AromaticContact CE3-CD2 3.77Å; W205-H250 AromaticContact CE3-CE1 3.72Å; W205-H250 AromaticContact CE3-CG 3.5Å; W205-H250 AromaticContact CE3-ND1 3.49Å; W205-H250 AromaticContact CE3-NE2 3.93Å; W205-H250 HydrophobicContact CG-CB 3.41Å; W205-H250 VanDerWaalsContact CG-CB 3.41Å; W205-H250 AromaticContact CG-CG 3.94Å; W205-H250 AromaticContact CH2-CD2 3.38Å; W205-H250 WeakPolarHBondContact CH2-CD2 3.38Å; W205-H250 AromaticContact CH2-CG 3.97Å; W205-H250 AromaticContact CH2-NE2 3.58Å; W205-H250 HydrophobicContact CZ2-CB 4.17Å; W205-H250 AromaticContact CZ2-CD2 3.47Å; W205-H250 VanDerWaalsContact CZ2-CD2 3.47Å; W205-H250 WeakPolarHBondContact CZ2-CD2 3.39Å; W205-H250 AromaticContact CZ2-CG 3.89Å; W205-H250 AromaticContact CZ3-CD2 3.54Å; W205-H250 AromaticContact CZ3-CE1 3.62Å; W205-H250 AromaticContact CZ3-CG 3.8Å; W205-H250 AromaticContact CZ3-ND1 3.84Å; W205-H250 AromaticContact CZ3-NE2 3.45Å; W205-H250 WeakPolarHBondContact CZ3-NE2 3.16Å
206	K	83.4	Confident	70.9	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.1	166.6	-64.2	-156	75.9	-170.3	0	110.5	D60 S238 E385 L388 Q389	D60-K206 IonicContact OD2-NZ 2.8Å; D60-K206 PolarHBondContact OD2-NZ 2.89Å; K206-S238 CarbonylContact C-O 3.57Å; K206-S238 WeakPolarHBondContact CA-O 3.36Å; K206-E385 VanDerWaalsContact CD-OE1 3.29Å; K206-E385 WeakPolarHBondContact CD-OE1 3.3Å; K206-E385 WeakPolarHBondContact CD-OE2 3.46Å; K206-E385 WeakPolarHBondContact CE-OE1 3.39Å; K206-E385 WeakPolarHBondContact CE-OE2 3.34Å; K206-E385 IonicContact NZ-OE1 3.38Å; K206-E385 PolarHBondContact NZ-OE1 3Å; K206-E385 IonicContact NZ-OE2 3.73Å; K206-E385 PolarHBondContact NZ-OE2 2.84Å; K206-L388 HydrophobicContact CD-CB 4.13Å; K206-L388 HydrophobicContact CG-CB 4.24Å; K206-Q389 HydrophobicContact CB-CG 4.22Å
207	A	80.8	Confident	69	Low	24 Å²	24	53 Å²	53	20%	0.198	26%	0.263	C	S	.	.			trans	-64.1	144.7	168.3	0	0	0	0	0	109.8	W205 Q209 S238	W205-A207 HydrophobicContact CH2-CB 3.79Å; W205-A207 HydrophobicContact CZ2-CB 3.78Å; A207-Q209 PolarHBondContact O-N 2.99Å; A207-S238 PolarHBondContact N-O 2.81Å
208	R	77.8	Confident	67	Low	96 Å²	96	56.2 Å²	56.2	36%	0.362	28%	0.284	S	S	.	.			trans	-66.6	125.2	173.5	-64.8	-179.2	-172.9	-174.9	-5.8	109.7	E355	R208-E355 IonicContact CZ-OE1 2.87Å; R208-E355 IonicContact NE-OE1 2.98Å; R208-E355 IonicContact NH1-OE1 2.74Å; R208-E355 PolarHBondContact NH1-OE1 2.76Å; R208-E355 IonicContact NH1-OE2 3.31Å
209	Q	70.4	Confident	64.9	Low	39 Å²	39	61 Å²	61	18%	0.182	29%	0.289	C	S	.	.			trans	-131.7	148.8	177.8	-62	-166.8	-0.6	0	0	109.6	N63 A207 L211 Q389	N63-Q209 PolarHBondContact OD1-OE1 3.18Å; A207-Q209 PolarHBondContact O-N 2.99Å; Q209-L211 PolarHBondContact O-N 3.4Å; Q209-L211 VanDerWaalsContact O-N 3.1Å; Q209-Q389 PolarHBondContact O-OE1 2.87Å; Q209-Q389 VanDerWaalsContact O-OE1 3.08Å
210	K	69.1	Low	63.1	Low	151 Å²	151	61 Å²	61	66%	0.657	30%	0.304	S	S	*	.			trans	-67.1	115.3	169.3	-70.9	178.6	-174.1	165.8	0	107.3	N63 E212	N63-K210 PolarHBondContact ND2-O 2.96Å; N63-K210 VanDerWaalsContact ND2-O 3.12Å; K210-E212 PolarHBondContact O-N 3.45Å
211	L	60.4	Low	61.1	Low	4 Å²	4	63 Å²	63	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	110.6	170.5	-64.9	179	0	0	0	108.6	N63 Q209 N356 I359 K360 A369 E385 P386	N63-L211 HydrophobicContact CB-CD2 3.88Å; Q209-L211 PolarHBondContact O-N 3.4Å; Q209-L211 VanDerWaalsContact O-N 3.1Å; L211-N356 WeakPolarHBondContact CD1-O 3.46Å; L211-I359 HydrophobicContact CB-CB 4.17Å; L211-I359 HydrophobicContact CB-CG1 3.79Å; L211-I359 HydrophobicContact CB-CG2 4.26Å; L211-I359 HydrophobicContact CD1-CG1 3.76Å; L211-I359 HydrophobicContact CG-CG1 4.44Å; L211-I359 CarbonylContact O-C 3.55Å; L211-I359 WeakPolarHBondContact O-CA 3.12Å; L211-K360 PolarHBondContact O-N 3.42Å; L211-A369 HydrophobicContact CD1-CB 3.98Å; L211-E385 HydrophobicContact CD2-CB 4.34Å; L211-P386 HydrophobicContact CD1-CG 4.29Å
212	E	60.1	Low	59.1	Low	73 Å²	73	67 Å²	67	34%	0.341	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.6	175.4	-71.4	-174	175.9	0	0	109.4	N63 K210 K214 K360	N63-E212 PolarHBondContact ND2-N 3.06Å; K210-E212 PolarHBondContact O-N 3.45Å; E212-K214 HydrophobicContact CB-CG 4.48Å; E212-K214 PolarHBondContact O-N 3.03Å; E212-K214 VanDerWaalsContact O-N 3.09Å; E212-K214 WeakPolarHBondContact OE2-CE 3.49Å; E212-K214 IonicContact OE2-NZ 3.01Å; E212-K214 PolarHBondContact OE2-NZ 3.17Å; E212-K360 WeakPolarHBondContact CA-O 3.41Å
213	M	55.7	Low	57	Low	59 Å²	59	74.3 Å²	74.3	29%	0.291	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	89.1	166	-88.7	176.9	40.4	0	0	109	Y215 M327 I359 L367	M213-Y215 PolarHBondContact O-N 2.92Å; M213-M327 HydrophobicContact SD-SD 4.21Å; M213-I359 HydrophobicContact CB-CG2 4.05Å; M213-I359 HydrophobicContact CG-CG2 3.8Å; M213-I359 HydrophobicContact SD-CG2 4.15Å; M213-L367 HydrophobicContact CE-CD1 3.94Å; M213-L367 HydrophobicContact SD-CD1 3.92Å
214	K	48.8	Very low	54.8	Low	93 Å²	93	81.8 Å²	81.8	40%	0.404	41%	0.406	S	S	.	.			trans	-81.4	92.3	167.8	-68.1	-174.9	-173.5	166.5	0	109.1	E212 L216 Y228	E212-K214 HydrophobicContact CB-CG 4.48Å; E212-K214 PolarHBondContact O-N 3.03Å; E212-K214 VanDerWaalsContact O-N 3.09Å; E212-K214 WeakPolarHBondContact OE2-CE 3.49Å; E212-K214 IonicContact OE2-NZ 3.01Å; E212-K214 PolarHBondContact OE2-NZ 3.17Å; K214-L216 PolarHBondContact O-N 3.45Å; K214-Y228 HydrophobicContact CB-CE1 4.06Å; K214-Y228 VanDerWaalsContact CB-OH 3.26Å; K214-Y228 WeakPolarHBondContact CB-OH 3.09Å; K214-Y228 WeakPolarHBondContact CD-OH 3.42Å
215	Y	37.8	Very low	52.6	Low	136 Å²	136	83.9 Å²	83.9	53%	0.533	42%	0.417	S	S	.	.			trans	37.3	77.3	165.3	-116.9	-96.1	0	0	0	115.5	M213 G217	M213-Y215 PolarHBondContact O-N 2.92Å; Y215-G217 VanDerWaalsContact C-N 3.26Å; Y215-G217 PolarHBondContact O-N 2.91Å; Y215-G217 VanDerWaalsContact O-N 3.11Å
216	L	37.7	Very low	50.7	Low	110 Å²	110	83.5 Å²	83.5	58%	0.576	42%	0.422	S	S	*	.			trans	-70.7	96.2	145.3	-78.4	167.3	0	0	0	105.1	I64 K214 F229	I64-L216 HydrophobicContact CD1-CD1 4.33Å; I64-L216 HydrophobicContact CD1-CG 4.44Å; K214-L216 PolarHBondContact O-N 3.45Å; L216-F229 HydrophobicContact CD2-CE2 4.1Å; L216-F229 HydrophobicContact CD2-CZ 3.74Å
217	G	36.8	Very low	48.5	Very low	17 Å²	17	88 Å²	88	18%	0.175	45%	0.446	C	S	.	.			trans	-54	146.6	-166.3	0	0	0	0	0	113.2	Y215 N225	Y215-G217 VanDerWaalsContact C-N 3.26Å; Y215-G217 PolarHBondContact O-N 2.91Å; Y215-G217 VanDerWaalsContact O-N 3.11Å; G217-N225 WeakPolarHBondContact CA-ND2 3.32Å; G217-N225 VanDerWaalsContact CA-OD1 3.27Å; G217-N225 WeakPolarHBondContact CA-OD1 2.97Å; G217-N225 PolarHBondContact N-ND2 3.49Å; G217-N225 PolarHBondContact N-OD1 2.94Å
218	T	30.9	Very low	46.5	Very low	89 Å²	89	91.7 Å²	91.7	55%	0.546	46%	0.455	S	S	.	.			trans	-44.3	150.2	168.5	53.5	0	0	0	0	110.1	A220 N221	T218-A220 PolarHBondContact O-N 3.28Å; T218-N221 PolarHBondContact O-N 2.72Å
219	K	35	Very low	44.8	Very low	223 Å²	223	88.6 Å²	88.6	97%	0.97	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-7	174.6	-73.1	-175.9	175.3	-178.8	0	114.7
220	A	37.2	Very low	43.4	Very low	84 Å²	84	96.4 Å²	96.4	69%	0.694	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.5	-174	0	0	0	0	0	115.1	T218	T218-A220 PolarHBondContact O-N 3.28Å
221	N	35.8	Very low	41.9	Very low	75 Å²	75	99.7 Å²	99.7	40%	0.401	48%	0.48	S	S	.	.			trans	-158.1	90.9	179.8	-143.7	-24.2	0	0	0	116.1	T218 E223	T218-N221 PolarHBondContact O-N 2.72Å; N221-E223 PolarHBondContact O-N 3.23Å
222	P	39.4	Very low	41.1	Very low	98 Å²	98	101.4 Å²	101.4	64%	0.636	50%	0.495	S	S	*	.	H	α-helix	trans	-62.1	-35.3	-177.9	-21.3	31.7	0	0	0	115	N225 A226	P222-N225 PolarHBondContact O-N 2.98Å; P222-A226 PolarHBondContact O-N 3.45Å
223	E	42.3	Very low	40.1	Very low	152 Å²	152	106.4 Å²	106.4	71%	0.71	52%	0.519	S	S	*	.	H	α-helix	trans	-71.9	-33	-173	-68.6	-175.7	172.2	0	0	113.5	N221 N225	N221-E223 PolarHBondContact O-N 3.23Å; E223-N225 VanDerWaalsContact C-N 3.33Å
224	K	39.2	Very low	39.7	Very low	157 Å²	157	111.2 Å²	111.2	68%	0.683	54%	0.538	S	S	*	.	H	α-helix	trans	-71.2	-29.3	175.6	-80.2	-172.2	176.6	-178.9	0	112.5
225	N	42.4	Very low	39.9	Very low	45 Å²	45	107.2 Å²	107.2	24%	0.241	52%	0.523	C	S	.	.	H	α-helix	trans	-70.3	-34.5	177.5	-65.4	-16.6	0	0	0	112	G217 P222 E223 N227 Y228	G217-N225 WeakPolarHBondContact CA-ND2 3.32Å; G217-N225 VanDerWaalsContact CA-OD1 3.27Å; G217-N225 WeakPolarHBondContact CA-OD1 2.97Å; G217-N225 PolarHBondContact N-ND2 3.49Å; G217-N225 PolarHBondContact N-OD1 2.94Å; P222-N225 PolarHBondContact O-N 2.98Å; E223-N225 VanDerWaalsContact C-N 3.33Å; N225-N227 PolarHBondContact O-N 3.37Å; N225-Y228 PolarHBondContact O-N 3.07Å
226	A	42.8	Very low	41	Very low	27 Å²	27	106.5 Å²	106.5	22%	0.223	53%	0.527	C	S	.	.	H	α-helix	trans	-61.9	-39.1	179.2	0	0	0	0	0	113.2	N165 P222 Y228	N165-A226 WeakPolarHBondContact ND2-CB 3.06Å; P222-A226 PolarHBondContact O-N 3.45Å; A226-Y228 VanDerWaalsContact C-N 3.31Å; A226-Y228 PolarHBondContact O-N 3.42Å
227	N	38.2	Very low	42.3	Very low	97 Å²	97	105.9 Å²	105.9	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-76.1	-16.1	-179.1	-76.3	-47.4	0	0	0	113.9	N225 R231	N225-N227 PolarHBondContact O-N 3.37Å; N227-R231 PolarHBondContact O-N 3.21Å
228	Y	39.7	Very low	44	Very low	100 Å²	100	105 Å²	105	39%	0.392	51%	0.513	S	S	.	.	H	α-helix	trans	-77	-48.7	-179.1	-174.7	-104.2	0	0	0	112.2	K214 N225 A226 R230 R231 A232	K214-Y228 HydrophobicContact CB-CE1 4.06Å; K214-Y228 VanDerWaalsContact CB-OH 3.26Å; K214-Y228 WeakPolarHBondContact CB-OH 3.09Å; K214-Y228 WeakPolarHBondContact CD-OH 3.42Å; N225-Y228 PolarHBondContact O-N 3.07Å; A226-Y228 VanDerWaalsContact C-N 3.31Å; A226-Y228 PolarHBondContact O-N 3.42Å; Y228-R230 PolarHBondContact O-N 3.01Å; Y228-R231 PolarHBondContact O-N 3.21Å; Y228-A232 PolarHBondContact O-N 3.35Å
229	F	42.1	Very low	46.3	Very low	32 Å²	32	100.9 Å²	100.9	14%	0.14	49%	0.487	C	S	.	.	H	α-helix	trans	-60.5	-32.2	173.8	-70	-74.4	0	0	0	111.9	I64 P167 L216 R231 A232	I64-F229 HydrophobicContact CD1-CE1 4.36Å; I64-F229 HydrophobicContact CD1-CZ 4.47Å; P167-F229 HydrophobicContact CG-CD1 4.38Å; L216-F229 HydrophobicContact CD2-CE2 4.1Å; L216-F229 HydrophobicContact CD2-CZ 3.74Å; F229-R231 VanDerWaalsContact C-N 3.25Å; F229-R231 PolarHBondContact O-N 2.88Å; F229-A232 PolarHBondContact O-N 3.31Å
230	R	40.7	Very low	48.6	Very low	202 Å²	202	90.9 Å²	90.9	76%	0.762	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.9	175.8	-145.5	-178.6	81.8	142.8	4	114.5	Y228	Y228-R230 PolarHBondContact O-N 3.01Å
231	R	37.1	Very low	50.9	Low	220 Å²	220	86.9 Å²	86.9	83%	0.83	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-6.5	179.9	-96.3	-176.1	178.7	165.1	0.5	113.8	N227 Y228 F229 Q233	N227-R231 PolarHBondContact O-N 3.21Å; Y228-R231 PolarHBondContact O-N 3.21Å; F229-R231 VanDerWaalsContact C-N 3.25Å; F229-R231 PolarHBondContact O-N 2.88Å; R231-Q233 VanDerWaalsContact C-N 3.32Å; R231-Q233 PolarHBondContact O-N 3.41Å
232	A	42.6	Very low	53.1	Low	40 Å²	40	83.6 Å²	83.6	33%	0.331	39%	0.394	S	S	.	.	S	Bend	trans	-61.6	102.3	167	0	0	0	0	0	106.8	Y61 Y228 F229	Y61-A232 HydrophobicContact CD1-CB 3.95Å; Y61-A232 HydrophobicContact CE1-CB 4.33Å; Y228-A232 PolarHBondContact O-N 3.35Å; F229-A232 PolarHBondContact O-N 3.31Å
233	Q	40	Very low	55.1	Low	178 Å²	178	79.4 Å²	79.4	83%	0.832	37%	0.366	S	S	*	.			trans	-43.8	147.6	169.5	-72.8	171.4	-35.5	0	0	108.9	R231 G235	R231-Q233 VanDerWaalsContact C-N 3.32Å; R231-Q233 PolarHBondContact O-N 3.41Å; Q233-G235 PolarHBondContact O-N 2.68Å
234	K	46.9	Very low	56.9	Low	161 Å²	161	72.3 Å²	72.3	70%	0.7	34%	0.335	S	S	*	.	S	Bend	trans	-25.9	114.3	171.5	-172	179	-177.3	-175.6	0	109.2
235	G	53.4	Low	58.8	Low	8 Å²	8	66.6 Å²	66.6	8%	0.082	32%	0.317	C	S	.	.			trans	-49.4	154.2	-164.3	0	0	0	0	0	112.7	Y59 D60 Q233 E237	Y59-G235 WeakPolarHBondContact CD1-O 3.33Å; D60-G235 WeakPolarHBondContact O-CA 3.27Å; Q233-G235 PolarHBondContact O-N 2.68Å; G235-E237 PolarHBondContact O-N 3.17Å
236	I	61.2	Low	60.4	Low	121 Å²	121	66.9 Å²	66.9	62%	0.621	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.6	176.5	-60.1	173	0	0	0	106.9	D60 S238	D60-I236 PolarHBondContact N-O 2.83Å; D60-I236 PolarHBondContact O-N 2.66Å; I236-S238 WeakPolarHBondContact O-CB 3.27Å; I236-S238 PolarHBondContact O-N 3.03Å
237	E	63.7	Low	62	Low	97 Å²	97	65.7 Å²	65.7	45%	0.453	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	113	171.1	-173.8	169.1	167.3	0	0	108.3	R57 G235	R57-E237 WeakPolarHBondContact CD-OE1 3.5Å; R57-E237 WeakPolarHBondContact CD-OE2 3.41Å; R57-E237 IonicContact CZ-OE1 3.99Å; R57-E237 IonicContact CZ-OE2 3.35Å; R57-E237 IonicContact NE-OE1 3.86Å; R57-E237 PolarHBondContact NE-OE1 3.2Å; R57-E237 IonicContact NE-OE2 2.67Å; R57-E237 IonicContact NH1-OE1 3.41Å; R57-E237 IonicContact NH1-OE2 3.2Å; R57-E237 PolarHBondContact NH1-OE2 2.96Å; G235-E237 PolarHBondContact O-N 3.17Å
238	S	72.8	Confident	63.8	Low	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	1.3	-164.7	66.8	0	0	0	0	113.8	L58 D60 K206 A207 I236	L58-S238 PolarHBondContact O-N 3.17Å; L58-S238 PolarHBondContact O-OG 3.44Å; D60-S238 VanDerWaalsContact CB-OG 3.32Å; D60-S238 WeakPolarHBondContact CB-OG 3.32Å; D60-S238 PolarHBondContact N-OG 2.8Å; K206-S238 CarbonylContact C-O 3.57Å; K206-S238 WeakPolarHBondContact CA-O 3.36Å; A207-S238 PolarHBondContact N-O 2.81Å; I236-S238 WeakPolarHBondContact O-CB 3.27Å; I236-S238 PolarHBondContact O-N 3.03Å
239	G	80.6	Confident	65.5	Low	1 Å²	1	61.6 Å²	61.6	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	177.3	-176.9	0	0	0	0	0	112.5	L58 W205	L58-G239 PolarHBondContact N-O 3.32Å; W205-G239 CarbonylContact O-C 3.57Å; W205-G239 WeakPolarHBondContact O-CA 3.29Å
240	L	82	Confident	67.2	Low	14 Å²	14	61.1 Å²	61.1	7%	0.073	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.7	-178.8	-167.9	64.6	0	0	0	109.7	Q55 W205 D247	Q55-L240 HydrophobicContact CB-CD1 4.18Å; Q55-L240 HydrophobicContact CG-CD2 4.45Å; W205-L240 HydrophobicContact CE3-CB 3.92Å; W205-L240 PolarHBondContact N-O 3.26Å; W205-L240 PolarHBondContact O-N 3.14Å; L240-D247 WeakPolarHBondContact CD2-OD2 3.32Å
241	L	84.9	Confident	68.9	Low	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	110.9	164.5	171	64.3	0	0	0	107.9	Q55 Q56 L58 I83 M143 F202 T203 I204 V243	Q55-L241 CarbonylContact C-O 3.54Å; Q55-L241 WeakPolarHBondContact CA-O 3.37Å; Q56-L241 HydrophobicContact CB-CB 4.3Å; Q56-L241 PolarHBondContact N-O 2.82Å; Q56-L241 PolarHBondContact O-N 3.19Å; L58-L241 HydrophobicContact CD1-CB 4.17Å; L58-L241 HydrophobicContact CD2-CB 3.95Å; L58-L241 HydrophobicContact CG-CB 4.27Å; I83-L241 HydrophobicContact CD1-CD2 4.4Å; I83-L241 HydrophobicContact CG2-CD2 4.21Å; M143-L241 HydrophobicContact CE-CD2 3.6Å; M143-L241 HydrophobicContact SD-CD2 3.66Å; M143-L241 HydrophobicContact SD-CG 4.34Å; F202-L241 HydrophobicContact CB-CD1 4.05Å; F202-L241 HydrophobicContact CD2-CD1 3.64Å; F202-L241 HydrophobicContact CG-CD1 4.23Å; T203-L241 CarbonylContact O-C 3.53Å; T203-L241 WeakPolarHBondContact O-CA 3.26Å; I204-L241 HydrophobicContact CG1-CD1 3.79Å; L241-V243 HydrophobicContact CD1-CG2 4.38Å; L241-V243 HydrophobicContact CD2-CG2 4.41Å; L241-V243 HydrophobicContact CG-CG2 4.06Å
242	T	82.1	Confident	70.7	Confident	6 Å²	6	42.9 Å²	42.9	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.7	175.3	-60.3	0	0	0	0	109.2	Q55 F202 T203 A245	Q55-T242 HydrophobicContact CG-CG2 4.17Å; F202-T242 CarbonylContact C-O 3.52Å; F202-T242 WeakPolarHBondContact CA-O 3.38Å; T203-T242 PolarHBondContact N-O 2.9Å; T203-T242 PolarHBondContact O-N 3.13Å; T242-A245 HydrophobicContact CG2-CB 4.19Å; T242-A245 WeakPolarHBondContact CG2-O 3.43Å
243	V	83	Confident	71.7	Confident	9 Å²	9	43.9 Å²	43.9	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.4	179.2	-174.2	0	0	0	0	109.6	G54 M143 L146 V188 L191 L197 F202 L241	G54-V243 PolarHBondContact O-N 3.47Å; M143-V243 HydrophobicContact SD-CG2 3.96Å; L146-V243 HydrophobicContact CD1-CB 4.12Å; L146-V243 HydrophobicContact CD1-CG1 4.15Å; V188-V243 HydrophobicContact CG1-CG1 3.88Å; V188-V243 HydrophobicContact CG2-CG1 4.06Å; V188-V243 HydrophobicContact CG2-CG2 4.5Å; L191-V243 HydrophobicContact CD1-CG1 4.31Å; L197-V243 HydrophobicContact CD1-CG1 3.83Å; L197-V243 HydrophobicContact CD2-CG1 3.78Å; L197-V243 HydrophobicContact CG-CG1 4.5Å; F202-V243 HydrophobicContact CB-CG2 4.44Å; L241-V243 HydrophobicContact CD1-CG2 4.38Å; L241-V243 HydrophobicContact CD2-CG2 4.41Å; L241-V243 HydrophobicContact CG-CG2 4.06Å
244	G	80.2	Confident	73.2	Confident	4 Å²	4	39.2 Å²	39.2	4%	0.041	23%	0.228	C	C	.	.	S	Bend	trans	91.7	-2.9	177.2	0	0	0	0	0	115.8	Q199 I201	Q199-G244 WeakPolarHBondContact CB-O 3.35Å; Q199-G244 PolarHBondContact N-O 3.03Å; Q199-G244 VanDerWaalsContact O-CA 3.31Å; Q199-G244 WeakPolarHBondContact O-CA 3.32Å; I201-G244 PolarHBondContact O-N 2.97Å
245	A	78.4	Confident	74.5	Confident	37 Å²	37	32.2 Å²	32.2	31%	0.306	20%	0.199	S	C	.	.	S	Bend	trans	-156.7	165.2	-179.5	0	0	0	0	0	111.9	T203 T242	T203-A245 PolarHBondContact OG1-O 3.03Å; T203-A245 VanDerWaalsContact OG1-O 3.08Å; T242-A245 HydrophobicContact CG2-CB 4.19Å; T242-A245 WeakPolarHBondContact CG2-O 3.43Å
246	Q	75.7	Confident	75.7	Confident	50 Å²	50	33.5 Å²	33.5	23%	0.234	20%	0.204	C	C	.	.			trans	-73.9	141.3	164.4	176.5	168.2	-10.3	0	0	109.9	T203 S248 S252 I394	T203-Q246 WeakPolarHBondContact OG1-CA 3.5Å; Q246-S248 PolarHBondContact O-N 2.91Å; Q246-S252 PolarHBondContact NE2-O 3.11Å; Q246-I394 HydrophobicContact CB-CD1 4.05Å; Q246-I394 VanDerWaalsContact CD-CD1 3.45Å; Q246-I394 HydrophobicContact CG-CD1 3.55Å
247	D	76.1	Confident	76.7	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.011	19%	0.185	C	C	.	.			trans	-73.6	93.4	169.4	-175.3	-17.5	0	0	0	110.1	T203 L240 L249 H250 C251	T203-D247 HydrophobicContact CG2-CB 3.75Å; L240-D247 WeakPolarHBondContact CD2-OD2 3.32Å; D247-L249 PolarHBondContact O-N 3.1Å; D247-L249 WeakPolarHBondContact OD1-CB 3.42Å; D247-L249 PolarHBondContact OD1-N 2.86Å; D247-H250 VanDerWaalsContact CG-ND1 3.32Å; D247-H250 IonicContact OD1-CG 3.96Å; D247-H250 PolarHBondContact OD1-N 3.33Å; D247-H250 IonicContact OD1-ND1 3.42Å; D247-H250 PolarHBondContact OD1-ND1 2.69Å; D247-H250 IonicContact OD2-CE1 3.06Å; D247-H250 IonicContact OD2-CG 2.64Å; D247-H250 IonicContact OD2-ND1 3.16Å; D247-H250 PolarHBondContact OD2-ND1 2.84Å; D247-C251 WeakPolarHBondContact O-CB 3.33Å; D247-C251 PolarHBondContact O-N 2.77Å; D247-C251 PolarHBondContact O-SG 2.9Å
248	S	76.7	Confident	77.6	Confident	80 Å²	80	26.1 Å²	26.1	56%	0.559	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-11.2	179.3	60.5	0	0	0	0	113.9	Q246	Q246-S248 PolarHBondContact O-N 2.91Å
249	L	75.3	Confident	78.1	Confident	32 Å²	32	31.1 Å²	31.1	17%	0.168	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-49.1	179	174.1	53.9	0	0	0	109.6	D247 T410 Y412 F414	D247-L249 PolarHBondContact O-N 3.1Å; D247-L249 WeakPolarHBondContact OD1-CB 3.42Å; D247-L249 PolarHBondContact OD1-N 2.86Å; L249-T410 HydrophobicContact CD1-CG2 4.37Å; L249-T410 WeakPolarHBondContact O-CG2 3.38Å; L249-Y412 WeakPolarHBondContact CD1-O 3.29Å; L249-F414 HydrophobicContact CB-CG 4.48Å; L249-F414 HydrophobicContact CD1-CB 3.87Å; L249-F414 HydrophobicContact CD1-CD2 3.74Å; L249-F414 HydrophobicContact CD1-CG 4.11Å; L249-F414 HydrophobicContact CD2-CB 4.03Å; L249-F414 HydrophobicContact CG-CB 4.35Å
250	H	77.1	Confident	78.3	Confident	21 Å²	21	31.2 Å²	31.2	10%	0.097	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-16.9	-170.6	-52	106.5	0	0	0	114.5	W205 D247 Y408	W205-H250 HydrophobicContact CB-CB 4.15Å; W205-H250 HydrophobicContact CD2-CB 3.39Å; W205-H250 AromaticContact CD2-CD2 3.85Å; W205-H250 AromaticContact CD2-CG 3.4Å; W205-H250 AromaticContact CD2-ND1 3.8Å; W205-H250 VanDerWaalsContact CE2-CB 3.49Å; W205-H250 AromaticContact CE2-CD2 3.71Å; W205-H250 AromaticContact CE2-CG 3.61Å; W205-H250 HydrophobicContact CE3-CB 4.04Å; W205-H250 AromaticContact CE3-CD2 3.77Å; W205-H250 AromaticContact CE3-CE1 3.72Å; W205-H250 AromaticContact CE3-CG 3.5Å; W205-H250 AromaticContact CE3-ND1 3.49Å; W205-H250 AromaticContact CE3-NE2 3.93Å; W205-H250 HydrophobicContact CG-CB 3.41Å; W205-H250 VanDerWaalsContact CG-CB 3.41Å; W205-H250 AromaticContact CG-CG 3.94Å; W205-H250 AromaticContact CH2-CD2 3.38Å; W205-H250 WeakPolarHBondContact CH2-CD2 3.38Å; W205-H250 AromaticContact CH2-CG 3.97Å; W205-H250 AromaticContact CH2-NE2 3.58Å; W205-H250 HydrophobicContact CZ2-CB 4.17Å; W205-H250 AromaticContact CZ2-CD2 3.47Å; W205-H250 VanDerWaalsContact CZ2-CD2 3.47Å; W205-H250 WeakPolarHBondContact CZ2-CD2 3.39Å; W205-H250 AromaticContact CZ2-CG 3.89Å; W205-H250 AromaticContact CZ3-CD2 3.54Å; W205-H250 AromaticContact CZ3-CE1 3.62Å; W205-H250 AromaticContact CZ3-CG 3.8Å; W205-H250 AromaticContact CZ3-ND1 3.84Å; W205-H250 AromaticContact CZ3-NE2 3.45Å; W205-H250 WeakPolarHBondContact CZ3-NE2 3.16Å; D247-H250 VanDerWaalsContact CG-ND1 3.32Å; D247-H250 IonicContact OD1-CG 3.96Å; D247-H250 PolarHBondContact OD1-N 3.33Å; D247-H250 IonicContact OD1-ND1 3.42Å; D247-H250 PolarHBondContact OD1-ND1 2.69Å; D247-H250 IonicContact OD2-CE1 3.06Å; D247-H250 IonicContact OD2-CG 2.64Å; D247-H250 IonicContact OD2-ND1 3.16Å; D247-H250 PolarHBondContact OD2-ND1 2.84Å; H250-Y408 PolarHBondContact O-N 2.97Å
251	C	78	Confident	78.4	Confident	12 Å²	12	32.1 Å²	32.1	8%	0.081	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-110.8	143.6	-173.7	-47.1	0	0	0	0	112.1	D247 C392 I405	D247-C251 WeakPolarHBondContact O-CB 3.33Å; D247-C251 PolarHBondContact O-N 2.77Å; D247-C251 PolarHBondContact O-SG 2.9Å; C251-C392 WeakPolarHBondContact CA-SG 3.49Å; C251-C392 HydrophobicContact CB-CB 3.64Å; C251-C392 WeakPolarHBondContact CB-SG 2.99Å; C251-C392 WeakPolarHBondContact SG-CB 3.23Å; C251-C392 CovalentContact SG-SG 2.02Å; C251-C392 PolarHBondContact SG-SG 2.93Å; C251-I405 HydrophobicContact CB-CD1 4.22Å; C251-I405 HydrophobicContact CB-CG2 4.35Å
252	S	74.3	Confident	78.3	Confident	28 Å²	28	38.2 Å²	38.2	20%	0.196	23%	0.228	C	C	.	.			trans	-61.5	157.6	171.2	-163.7	0	0	0	0	112.1	Q246 S254 I405	Q246-S252 PolarHBondContact NE2-O 3.11Å; S252-S254 VanDerWaalsContact C-N 3.32Å; S252-I405 VanDerWaalsContact N-CG2 3.28Å; S252-I405 WeakPolarHBondContact O-CG2 3.46Å
253	A	63.8	Low	78.3	Confident	60 Å²	60	39 Å²	39	50%	0.496	23%	0.232	S	C	.	.	S	Bend	trans	-70.1	-27.1	171.3	0	0	0	0	0	112.7	L432	A253-L432 WeakPolarHBondContact O-CD1 3.3Å
254	S	71.4	Confident	78.4	Confident	80 Å²	80	40.5 Å²	40.5	56%	0.559	24%	0.237	S	C	*	.			trans	-90	124.8	-176.1	-171.4	0	0	0	0	112.1	S252 I405	S252-S254 VanDerWaalsContact C-N 3.32Å; S254-I405 WeakPolarHBondContact O-CG2 3.43Å
255	C	74.4	Confident	78.8	Confident	15 Å²	15	40.3 Å²	40.3	10%	0.101	24%	0.236	C	C	.	.			trans	-123	138.1	-174.6	-37.6	0	0	0	0	111.7	Y257 I405	C255-Y257 HydrophobicContact CB-CD2 4.2Å; C255-Y257 HydrophobicContact CB-CE2 3.66Å; C255-Y257 PolarHBondContact O-N 2.9Å; C255-I405 HydrophobicContact CB-CD1 4.02Å; C255-I405 HydrophobicContact CB-CG1 3.6Å; C255-I405 WeakPolarHBondContact SG-CD1 3.15Å; C255-I405 WeakPolarHBondContact SG-CG1 3.24Å
256	L	79.2	Confident	79.4	Confident	35 Å²	35	41.6 Å²	41.6	18%	0.183	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	107.5	163.1	177.4	67	0	0	0	108.7	V258 I345 V348 L350 S403 F404	L256-V258 HydrophobicContact CD2-CG1 4.3Å; L256-V258 HydrophobicContact CG-CG1 4.18Å; L256-I345 HydrophobicContact CD2-CB 4.4Å; L256-I345 HydrophobicContact CD2-CG2 4.34Å; L256-V348 HydrophobicContact CD1-CB 4.39Å; L256-V348 HydrophobicContact CD1-CG2 3.86Å; L256-V348 HydrophobicContact CD2-CB 4.03Å; L256-V348 HydrophobicContact CD2-CG1 4.37Å; L256-V348 HydrophobicContact CD2-CG2 4.4Å; L256-L350 HydrophobicContact CD2-CD1 3.74Å; L256-L350 HydrophobicContact CD2-CG 4.43Å; L256-S403 CarbonylContact O-C 3.6Å; L256-S403 WeakPolarHBondContact O-CA 3.03Å; L256-S403 WeakPolarHBondContact O-CB 3.3Å; L256-F404 PolarHBondContact N-O 3.42Å; L256-F404 PolarHBondContact O-N 2.75Å; L256-F404 VanDerWaalsContact O-N 3.08Å
257	Y	81.5	Confident	80.1	Confident	55 Å²	55	39.3 Å²	39.3	22%	0.216	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134.7	172.7	-63.8	-88.7	0	0	0	111.5	C255 K401 Q402 L432 I433	C255-Y257 HydrophobicContact CB-CD2 4.2Å; C255-Y257 HydrophobicContact CB-CE2 3.66Å; C255-Y257 PolarHBondContact O-N 2.9Å; Y257-K401 HydrophobicContact CD1-CB 4.23Å; Y257-Q402 CarbonylContact C-O 3.46Å; Y257-Q402 WeakPolarHBondContact CA-O 3.2Å; Y257-L432 HydrophobicContact CE2-CB 3.85Å; Y257-L432 VanDerWaalsContact CE2-O 3.27Å; Y257-L432 WeakPolarHBondContact CE2-O 3.27Å; Y257-I433 HydrophobicContact CE1-CG2 4.23Å
258	V	81.9	Confident	80.7	Confident	8 Å²	8	42 Å²	42	5%	0.048	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.9	177.9	-57.3	0	0	0	0	109.5	L256 F267 I345 N346 K401 Q402 F404	L256-V258 HydrophobicContact CD2-CG1 4.3Å; L256-V258 HydrophobicContact CG-CG1 4.18Å; V258-F267 HydrophobicContact CB-CB 4.48Å; V258-F267 HydrophobicContact CG2-CB 3.85Å; V258-F267 HydrophobicContact CG2-CD2 4.34Å; V258-F267 HydrophobicContact CG2-CG 4.07Å; V258-I345 HydrophobicContact CG1-CG2 3.56Å; V258-N346 HydrophobicContact CG1-CB 4.41Å; V258-K401 CarbonylContact O-C 3.52Å; V258-K401 VanDerWaalsContact O-CA 3.24Å; V258-K401 WeakPolarHBondContact O-CA 3.35Å; V258-Q402 HydrophobicContact CG2-CB 3.98Å; V258-Q402 HydrophobicContact CG2-CG 4.49Å; V258-Q402 WeakPolarHBondContact CG2-O 3.02Å; V258-Q402 PolarHBondContact N-O 2.83Å; V258-Q402 PolarHBondContact O-N 2.63Å; V258-F404 HydrophobicContact CG1-CE2 4.2Å; V258-F404 HydrophobicContact CG2-CE2 3.72Å; V258-F404 HydrophobicContact CG2-CZ 4.25Å
259	T	83.4	Confident	81.3	Confident	104 Å²	104	38.1 Å²	38.1	64%	0.638	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.3	176.9	-53.1	0	0	0	0	110.6	E400	T259-E400 CarbonylContact C-O 3.44Å; T259-E400 WeakPolarHBondContact CA-O 3.35Å; T259-E400 HydrophobicContact CG2-CB 4.39Å; T259-E400 WeakPolarHBondContact CG2-O 3.47Å
260	T	85.5	Confident	81.8	Confident	4 Å²	4	38.7 Å²	38.7	3%	0.025	21%	0.214	C	C	.	.			trans	-117.3	146.7	178	54.5	0	0	0	0	113.1	R266 F267 E400 Q402	T260-R266 CarbonylContact C-O 3.57Å; T260-R266 VanDerWaalsContact CA-O 3.28Å; T260-R266 WeakPolarHBondContact CA-O 3.46Å; T260-F267 HydrophobicContact CG2-CB 4.31Å; T260-E400 PolarHBondContact N-O 3.13Å; T260-Q402 HydrophobicContact CG2-CB 3.34Å; T260-Q402 HydrophobicContact CG2-CG 4.45Å
261	A	83.6	Confident	82	Confident	32 Å²	32	39.1 Å²	39.1	26%	0.264	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-76.6	143.6	164	0	0	0	0	0	110.5	D263 R266	A261-D263 WeakPolarHBondContact CB-OD1 3.37Å; A261-D263 PolarHBondContact O-N 3.35Å; A261-R266 HydrophobicContact CB-CB 4.3Å; A261-R266 PolarHBondContact N-O 3.12Å
262	R	82	Confident	82.4	Confident	128 Å²	128	38.8 Å²	38.8	48%	0.483	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	45.5	178.8	-63.3	-177.2	-179.4	-123.3	-4.8	113	F176 A178 E400	F176-R262 VanDerWaalsContact CB-O 3.25Å; F176-R262 WeakPolarHBondContact CB-O 3.45Å; F176-R262 HydrophobicContact CD1-CB 4.11Å; F176-R262 HydrophobicContact CD1-CG 4.44Å; F176-R262 HydrophobicContact CD2-CB 4.48Å; F176-R262 HydrophobicContact CE1-CB 4.3Å; F176-R262 HydrophobicContact CE1-CG 4.16Å; F176-R262 HydrophobicContact CG-CB 4.2Å; F176-R262 HydrophobicContact CZ-CG 4.37Å; A178-R262 WeakPolarHBondContact CB-O 3.28Å; R262-E400 IonicContact CZ-OE1 3.97Å; R262-E400 IonicContact NE-OE1 3.58Å; R262-E400 PolarHBondContact NE-OE1 3.08Å; R262-E400 IonicContact NH2-OE1 3.21Å; R262-E400 PolarHBondContact NH2-OE1 3.45Å
263	D	82.9	Confident	83.1	Confident	22 Å²	22	38.3 Å²	38.3	12%	0.118	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-87.1	176.2	57.6	5.7	0	0	0	111.6	F176 S179 A261 R266	F176-D263 WeakPolarHBondContact CB-O 3.25Å; F176-D263 PolarHBondContact N-O 3.22Å; F176-D263 VanDerWaalsContact N-O 3.1Å; S179-D263 WeakPolarHBondContact OG-CA 3.37Å; S179-D263 PolarHBondContact OG-O 2.75Å; A261-D263 WeakPolarHBondContact CB-OD1 3.37Å; A261-D263 PolarHBondContact O-N 3.35Å; D263-R266 VanDerWaalsContact OD1-CB 3.28Å; D263-R266 WeakPolarHBondContact OD1-CB 3.49Å; D263-R266 IonicContact OD1-NE 3.49Å; D263-R266 IonicContact OD2-CZ 3.44Å; D263-R266 IonicContact OD2-NE 2.72Å; D263-R266 PolarHBondContact OD2-NE 3.01Å; D263-R266 IonicContact OD2-NH2 3.4Å; D263-R266 PolarHBondContact OD2-NH2 2.98Å
264	Y	85.5	Confident	84.3	Confident	41 Å²	41	35.9 Å²	35.9	16%	0.161	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	25.4	-178.8	-63.2	-90.5	0	0	0	111.6	A86 S179 R266 I295 K378	A86-Y264 VanDerWaalsContact O-CD1 3.3Å; A86-Y264 WeakPolarHBondContact O-CD1 3.4Å; A86-Y264 WeakPolarHBondContact O-CE1 3.25Å; S179-Y264 WeakPolarHBondContact OG-CD2 3.27Å; S179-Y264 VanDerWaalsContact OG-CE2 3.27Å; S179-Y264 WeakPolarHBondContact OG-CE2 3.47Å; Y264-R266 PolarHBondContact O-N 3.21Å; Y264-I295 WeakPolarHBondContact O-CG2 3.45Å; Y264-K378 HydrophobicContact CD2-CD 4.07Å; Y264-K378 HydrophobicContact CE2-CD 3.32Å; Y264-K378 VanDerWaalsContact CE2-NZ 3.33Å; Y264-K378 PolarHBondContact OH-NZ 3.17Å; Y264-K378 VanDerWaalsContact OH-NZ 3.08Å
265	W	88.9	Confident	84.9	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	37.5	-166.3	-50.3	95.3	0	0	0	111.9	L174 F176 F202 F267 Q395 S396 F397 Q402	L174-W265 PolarHBondContact O-NE1 3.34Å; F176-W265 HydrophobicContact CD2-CD2 4.1Å; F176-W265 HydrophobicContact CD2-CE3 4.4Å; F176-W265 HydrophobicContact CD2-CZ2 4.28Å; F176-W265 HydrophobicContact CE1-CH2 4.22Å; F176-W265 HydrophobicContact CE1-CZ3 4.44Å; F176-W265 AromaticContact CE2-CD2 3.44Å; F176-W265 HydrophobicContact CE2-CD2 3.44Å; F176-W265 VanDerWaalsContact CE2-CD2 3.44Å; F176-W265 AromaticContact CE2-CE2 3.64Å; F176-W265 AromaticContact CE2-CE3 3.33Å; F176-W265 HydrophobicContact CE2-CE3 3.33Å; F176-W265 HydrophobicContact CE2-CG 4.18Å; F176-W265 AromaticContact CE2-CH2 3.66Å; F176-W265 HydrophobicContact CE2-CH2 3.66Å; F176-W265 AromaticContact CE2-CZ2 3.77Å; F176-W265 HydrophobicContact CE2-CZ2 3.77Å; F176-W265 AromaticContact CE2-CZ3 3.43Å; F176-W265 HydrophobicContact CE2-CZ3 3.43Å; F176-W265 VanDerWaalsContact CE2-CZ3 3.43Å; F176-W265 HydrophobicContact CZ-CD2 4.21Å; F176-W265 AromaticContact CZ-CE3 3.74Å; F176-W265 HydrophobicContact CZ-CE3 3.74Å; F176-W265 AromaticContact CZ-CH2 3.45Å; F176-W265 HydrophobicContact CZ-CH2 3.45Å; F176-W265 VanDerWaalsContact CZ-CH2 3.45Å; F176-W265 AromaticContact CZ-CZ2 3.96Å; F176-W265 HydrophobicContact CZ-CZ2 3.96Å; F176-W265 AromaticContact CZ-CZ3 3.32Å; F176-W265 HydrophobicContact CZ-CZ3 3.32Å; F202-W265 HydrophobicContact CE1-CH2 4.27Å; F202-W265 AromaticContact CE1-CZ2 3.81Å; F202-W265 HydrophobicContact CE1-CZ2 3.81Å; F202-W265 HydrophobicContact CZ-CZ2 4.27Å; W265-F267 WeakPolarHBondContact O-CD1 3.48Å; W265-F267 PolarHBondContact O-N 3.11Å; W265-Q395 HydrophobicContact CD2-CB 4.23Å; W265-Q395 HydrophobicContact CD2-CG 3.83Å; W265-Q395 HydrophobicContact CE3-CB 3.94Å; W265-Q395 HydrophobicContact CE3-CG 3.85Å; W265-Q395 HydrophobicContact CG-CG 4.29Å; W265-Q395 HydrophobicContact CH2-CB 3.75Å; W265-Q395 HydrophobicContact CH2-CG 4.42Å; W265-Q395 HydrophobicContact CZ2-CB 4.03Å; W265-Q395 HydrophobicContact CZ2-CG 4.38Å; W265-Q395 HydrophobicContact CZ3-CB 3.71Å; W265-Q395 HydrophobicContact CZ3-CG 4.16Å; W265-S396 VanDerWaalsContact CZ3-O 3.29Å; W265-S396 WeakPolarHBondContact CZ3-O 3.29Å; W265-F397 AromaticContact CH2-CD1 3.4Å; W265-F397 HydrophobicContact CH2-CD1 3.4Å; W265-F397 VanDerWaalsContact CH2-CD1 3.4Å; W265-F397 HydrophobicContact CH2-CD2 4.17Å; W265-F397 AromaticContact CH2-CE1 3.25Å; W265-F397 HydrophobicContact CH2-CE1 3.25Å; W265-F397 HydrophobicContact CH2-CE2 4.02Å; W265-F397 AromaticContact CH2-CG 3.89Å; W265-F397 HydrophobicContact CH2-CG 3.89Å; W265-F397 AromaticContact CH2-CZ 3.6Å; W265-F397 HydrophobicContact CH2-CZ 3.6Å; W265-F397 AromaticContact CZ2-CD1 3.8Å; W265-F397 HydrophobicContact CZ2-CD1 3.8Å; W265-F397 AromaticContact CZ2-CE1 3.12Å; W265-F397 HydrophobicContact CZ2-CE1 3.12Å; W265-F397 HydrophobicContact CZ2-CE2 4.16Å; W265-F397 AromaticContact CZ2-CZ 3.35Å; W265-F397 HydrophobicContact CZ2-CZ 3.35Å; W265-Q402 PolarHBondContact O-OE1 3.23Å
266	R	89.8	Confident	84.9	Confident	63 Å²	63	37 Å²	37	24%	0.238	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-73.6	127.3	-170.5	179.7	168.7	50.9	87.6	-0.7	111.2	T260 A261 D263 Y264 N293 A294 I295 K378	T260-R266 CarbonylContact C-O 3.57Å; T260-R266 VanDerWaalsContact CA-O 3.28Å; T260-R266 WeakPolarHBondContact CA-O 3.46Å; A261-R266 HydrophobicContact CB-CB 4.3Å; A261-R266 PolarHBondContact N-O 3.12Å; D263-R266 VanDerWaalsContact OD1-CB 3.28Å; D263-R266 WeakPolarHBondContact OD1-CB 3.49Å; D263-R266 IonicContact OD1-NE 3.49Å; D263-R266 IonicContact OD2-CZ 3.44Å; D263-R266 IonicContact OD2-NE 2.72Å; D263-R266 PolarHBondContact OD2-NE 3.01Å; D263-R266 IonicContact OD2-NH2 3.4Å; D263-R266 PolarHBondContact OD2-NH2 2.98Å; Y264-R266 PolarHBondContact O-N 3.21Å; R266-N293 HydrophobicContact CG-CB 3.99Å; R266-N293 PolarHBondContact NH1-OD1 2.82Å; R266-A294 CarbonylContact C-O 3.56Å; R266-A294 VanDerWaalsContact CA-O 3.27Å; R266-A294 WeakPolarHBondContact CA-O 3.39Å; R266-I295 HydrophobicContact CB-CG2 4.08Å; R266-I295 HydrophobicContact CG-CG2 4.43Å; R266-K378 WeakPolarHBondContact CD-O 3.3Å
267	F	90.1	Very high	84.3	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	179.9	176.8	63	-80.9	0	0	0	110.2	V258 T260 W265 V269 A294 V296 I345 L383 F404	V258-F267 HydrophobicContact CB-CB 4.48Å; V258-F267 HydrophobicContact CG2-CB 3.85Å; V258-F267 HydrophobicContact CG2-CD2 4.34Å; V258-F267 HydrophobicContact CG2-CG 4.07Å; T260-F267 HydrophobicContact CG2-CB 4.31Å; W265-F267 WeakPolarHBondContact O-CD1 3.48Å; W265-F267 PolarHBondContact O-N 3.11Å; F267-V269 HydrophobicContact CD2-CG2 4.4Å; F267-V269 HydrophobicContact CE2-CG2 3.72Å; F267-V269 HydrophobicContact CZ-CG2 4.47Å; F267-A294 HydrophobicContact CD1-CB 4.49Å; F267-A294 WeakPolarHBondContact CD1-O 3.5Å; F267-A294 HydrophobicContact CD2-CB 4.18Å; F267-A294 HydrophobicContact CE1-CB 4.04Å; F267-A294 HydrophobicContact CE2-CB 3.7Å; F267-A294 HydrophobicContact CZ-CB 3.63Å; F267-A294 PolarHBondContact N-O 2.89Å; F267-A294 PolarHBondContact O-N 2.9Å; F267-V296 HydrophobicContact CE1-CG2 3.87Å; F267-V296 HydrophobicContact CZ-CG2 4.23Å; F267-I345 HydrophobicContact CD2-CG2 4.17Å; F267-I345 HydrophobicContact CE2-CD1 3.71Å; F267-I345 HydrophobicContact CE2-CG1 4.35Å; F267-I345 HydrophobicContact CE2-CG2 4.36Å; F267-I345 HydrophobicContact CZ-CD1 4.49Å; F267-L383 HydrophobicContact CE2-CD1 4.37Å; F267-L383 HydrophobicContact CZ-CD1 3.7Å; F267-L383 HydrophobicContact CZ-CG 4.39Å; F267-F404 HydrophobicContact CD1-CZ 4.19Å; F267-F404 HydrophobicContact CD2-CE2 4.28Å; F267-F404 HydrophobicContact CD2-CZ 4.32Å; F267-F404 AromaticContact CE1-CZ 3.79Å; F267-F404 HydrophobicContact CE1-CZ 3.79Å; F267-F404 HydrophobicContact CE2-CE2 4.03Å; F267-F404 AromaticContact CE2-CZ 3.92Å; F267-F404 HydrophobicContact CE2-CZ 3.92Å; F267-F404 HydrophobicContact CG-CZ 4.45Å; F267-F404 HydrophobicContact CZ-CE2 4.22Å; F267-F404 AromaticContact CZ-CZ 3.64Å; F267-F404 HydrophobicContact CZ-CZ 3.64Å
268	T	90	Very high	83.4	Confident	58 Å²	58	45.6 Å²	45.6	36%	0.356	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.3	-176.9	-64.7	0	0	0	0	112.2	T291 F292	T268-T291 VanDerWaalsContact CG2-CB 3.4Å; T268-T291 HydrophobicContact CG2-CG2 3.54Å; T268-F292 WeakPolarHBondContact CA-O 3.33Å
269	V	89.1	Confident	82.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.5	165.6	170.5	0	0	0	0	108.1	F267 F292 A294 I345	F267-V269 HydrophobicContact CD2-CG2 4.4Å; F267-V269 HydrophobicContact CE2-CG2 3.72Å; F267-V269 HydrophobicContact CZ-CG2 4.47Å; V269-F292 PolarHBondContact N-O 3.22Å; V269-F292 PolarHBondContact O-N 2.94Å; V269-A294 HydrophobicContact CB-CB 4.19Å; V269-A294 HydrophobicContact CG2-CB 3.37Å; V269-I345 HydrophobicContact CG2-CD1 4.3Å; V269-I345 HydrophobicContact CG2-CG1 4.02Å
270	N	85.5	Confident	81.3	Confident	43 Å²	43	48.9 Å²	48.9	23%	0.23	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-41.2	176.4	-60.8	98.6	0	0	0	111.3	T344 N346 G347	N270-T344 HydrophobicContact CB-CG2 3.95Å; N270-T344 WeakPolarHBondContact CB-O 3.09Å; N270-T344 PolarHBondContact N-O 2.77Å; N270-T344 PolarHBondContact OD1-O 3.01Å; N270-N346 PolarHBondContact OD1-N 2.6Å; N270-G347 PolarHBondContact OD1-N 3.26Å
271	R	81.3	Confident	80	Confident	30 Å²	30	54 Å²	54	11%	0.113	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	163.8	-178.7	57.5	179.6	-174.1	172	7.7	112.6	Y273 E281 L343 T344	R271-Y273 HydrophobicContact CG-CD1 3.94Å; R271-Y273 HydrophobicContact CG-CE1 4.21Å; R271-Y273 VanDerWaalsContact NE-CE1 3.25Å; R271-Y273 VanDerWaalsContact NH2-CZ 3.27Å; R271-Y273 PolarHBondContact NH2-OH 2.9Å; R271-E281 PolarHBondContact NH1-O 3.46Å; R271-E281 PolarHBondContact NH2-O 3.15Å; R271-L343 WeakPolarHBondContact O-CA 3.47Å; R271-T344 WeakPolarHBondContact CG-OG1 3.3Å; R271-T344 PolarHBondContact NE-OG1 2.83Å; R271-T344 VanDerWaalsContact NE-OG1 3.16Å; R271-T344 PolarHBondContact O-N 2.87Å
272	G	87.4	Confident	78.9	Confident	5 Å²	5	52.8 Å²	52.8	5%	0.052	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.3	161.9	0	0	0	0	0	112.3	I342 L343	G272-I342 CarbonylContact C-O 3.32Å; G272-I342 VanDerWaalsContact CA-O 3.29Å; G272-I342 WeakPolarHBondContact CA-O 3.29Å; G272-L343 VanDerWaalsContact CA-CD2 3.47Å
273	Y	87.3	Confident	77.7	Confident	18 Å²	18	50.3 Å²	50.3	7%	0.071	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	172.5	-176.6	68.8	-75.4	0	0	0	113.4	R271 L275 I342 T344 D349	R271-Y273 HydrophobicContact CG-CD1 3.94Å; R271-Y273 HydrophobicContact CG-CE1 4.21Å; R271-Y273 VanDerWaalsContact NE-CE1 3.25Å; R271-Y273 VanDerWaalsContact NH2-CZ 3.27Å; R271-Y273 PolarHBondContact NH2-OH 2.9Å; Y273-L275 HydrophobicContact CE2-CD2 3.73Å; Y273-L275 HydrophobicContact CE2-CG 4.25Å; Y273-I342 HydrophobicContact CD1-CB 4.25Å; Y273-I342 HydrophobicContact CD1-CG2 4.41Å; Y273-I342 HydrophobicContact CE1-CB 3.83Å; Y273-I342 HydrophobicContact CE1-CG2 3.6Å; Y273-I342 HydrophobicContact CE2-CB 4.4Å; Y273-I342 HydrophobicContact CE2-CD1 4.14Å; Y273-I342 PolarHBondContact N-O 2.81Å; Y273-I342 PolarHBondContact O-N 3.47Å; Y273-T344 WeakPolarHBondContact CE1-OG1 3.27Å; Y273-D349 PolarHBondContact OH-OD1 3.35Å; Y273-D349 PolarHBondContact OH-OD2 2.87Å
274	V	90.1	Very high	76.2	Confident	10 Å²	10	53.9 Å²	53.9	6%	0.061	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.4	173.5	177.5	0	0	0	0	108.4	I313 R316 L317 P339 V341	V274-I313 HydrophobicContact CG2-CG2 4.22Å; V274-R316 HydrophobicContact CB-CB 3.86Å; V274-R316 HydrophobicContact CG1-CB 4.18Å; V274-R316 HydrophobicContact CG2-CB 4.35Å; V274-L317 HydrophobicContact CG1-CD2 4.34Å; V274-L317 HydrophobicContact CG2-CD2 4.2Å; V274-L317 HydrophobicContact CG2-CG 4.2Å; V274-P339 HydrophobicContact CG1-CB 4.05Å; V274-P339 HydrophobicContact CG1-CG 3.42Å; V274-P339 VanDerWaalsContact CG1-CG 3.42Å; V274-V341 HydrophobicContact CG2-CG2 3.93Å
275	L	83.4	Confident	74.4	Confident	85 Å²	85	54.4 Å²	54.4	45%	0.445	29%	0.292	S	S	.	.			trans	-69.5	143.4	176.6	-68.9	171.6	0	0	0	111.1	Y273 P280 I342	Y273-L275 HydrophobicContact CE2-CD2 3.73Å; Y273-L275 HydrophobicContact CE2-CG 4.25Å; L275-P280 WeakPolarHBondContact CD2-O 3.46Å; L275-I342 HydrophobicContact CD1-CD1 3.63Å; L275-I342 HydrophobicContact CD2-CD1 4.32Å; L275-I342 HydrophobicContact CG-CD1 3.67Å
276	S	74.7	Confident	72.4	Confident	32 Å²	32	64.1 Å²	64.1	22%	0.224	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-146.6	154	173.4	63.7	0	0	0	0	111.2	G278 F279 R316	S276-G278 PolarHBondContact O-N 2.98Å; S276-F279 CarbonylContact O-C 3.44Å; S276-F279 VanDerWaalsContact O-C 3.24Å; S276-F279 PolarHBondContact O-N 3.09Å; S276-R316 PolarHBondContact OG-NH1 3.25Å; S276-R316 VanDerWaalsContact OG-NH1 3.16Å
277	E	66.2	Low	70.5	Confident	211 Å²	211	63.1 Å²	63.1	99%	0.986	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.2	-175.5	-77.6	-173.6	152.2	0	0	114.4
278	G	63.6	Low	68.6	Low	60 Å²	60	67.5 Å²	67.5	62%	0.619	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.2	174.8	0	0	0	0	0	115.6	S276	S276-G278 PolarHBondContact O-N 2.98Å
279	F	64.5	Low	66.8	Low	84 Å²	84	74.2 Å²	74.2	37%	0.368	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-141.6	64.9	-178	-65.1	-91.7	0	0	0	110.2	S276 E281 G282 N283	S276-F279 CarbonylContact O-C 3.44Å; S276-F279 VanDerWaalsContact O-C 3.24Å; S276-F279 PolarHBondContact O-N 3.09Å; F279-E281 PolarHBondContact O-N 2.97Å; F279-E281 VanDerWaalsContact O-N 3.16Å; F279-G282 PolarHBondContact O-N 3.39Å; F279-N283 HydrophobicContact CD1-CB 4.43Å; F279-N283 WeakPolarHBondContact CE1-OD1 3.25Å
280	P	56.6	Low	65.8	Low	98 Å²	98	83 Å²	83	64%	0.636	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.9	-177.6	25.2	-33.6	0	0	0	112.7	L275	L275-P280 WeakPolarHBondContact CD2-O 3.46Å
281	E	58.3	Low	65.3	Low	112 Å²	112	85.2 Å²	85.2	52%	0.523	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	9.5	174.5	-55.6	-170	119.4	0	0	113.3	R271 F279 K284	R271-E281 PolarHBondContact NH1-O 3.46Å; R271-E281 PolarHBondContact NH2-O 3.15Å; F279-E281 PolarHBondContact O-N 2.97Å; F279-E281 VanDerWaalsContact O-N 3.16Å; E281-K284 HydrophobicContact CB-CD 4.21Å; E281-K284 IonicContact OE1-NZ 3.31Å; E281-K284 PolarHBondContact OE1-NZ 3.17Å; E281-K284 WeakPolarHBondContact OE2-CD 3.37Å; E281-K284 VanDerWaalsContact OE2-CE 3.22Å; E281-K284 WeakPolarHBondContact OE2-CE 3.4Å; E281-K284 IonicContact OE2-NZ 2.8Å; E281-K284 PolarHBondContact OE2-NZ 2.89Å
282	G	59.6	Low	65.6	Low	6 Å²	6	85.3 Å²	85.3	6%	0.062	43%	0.427	C	S	.	.			trans	69.9	168.2	-166.3	0	0	0	0	0	112.4	F279 K284	F279-G282 PolarHBondContact O-N 3.39Å; G282-K284 VanDerWaalsContact C-N 3.34Å; G282-K284 PolarHBondContact O-N 2.92Å
283	N	56.6	Low	65.8	Low	75 Å²	75	87.5 Å²	87.5	40%	0.401	44%	0.437	S	S	.	.			trans	-70.8	87	179.7	-145.2	4.6	0	0	0	109.8	F279 T285	F279-N283 HydrophobicContact CD1-CB 4.43Å; F279-N283 WeakPolarHBondContact CE1-OD1 3.25Å; N283-T285 VanDerWaalsContact C-N 3.3Å; N283-T285 PolarHBondContact O-N 3.3Å
284	K	51.4	Low	66.1	Low	98 Å²	98	86.6 Å²	86.6	43%	0.426	43%	0.434	S	S	.	.			trans	-69.4	80.6	177	-73.9	-177.8	170.8	171.5	0	110.3	E281 G282 Y288	E281-K284 HydrophobicContact CB-CD 4.21Å; E281-K284 IonicContact OE1-NZ 3.31Å; E281-K284 PolarHBondContact OE1-NZ 3.17Å; E281-K284 WeakPolarHBondContact OE2-CD 3.37Å; E281-K284 VanDerWaalsContact OE2-CE 3.22Å; E281-K284 WeakPolarHBondContact OE2-CE 3.4Å; E281-K284 IonicContact OE2-NZ 2.8Å; E281-K284 PolarHBondContact OE2-NZ 2.89Å; G282-K284 VanDerWaalsContact C-N 3.34Å; G282-K284 PolarHBondContact O-N 2.92Å; K284-Y288 HydrophobicContact CG-CD2 4.08Å; K284-Y288 HydrophobicContact CG-CE2 4.16Å
285	T	47.9	Very low	66.2	Low	51 Å²	51	86.3 Å²	86.3	31%	0.313	43%	0.432	S	S	.	.			trans	-87.8	170.8	172.1	61.7	0	0	0	0	111.2	N283 A287 Y288	N283-T285 VanDerWaalsContact C-N 3.3Å; N283-T285 PolarHBondContact O-N 3.3Å; T285-A287 PolarHBondContact O-N 3.12Å; T285-Y288 WeakPolarHBondContact O-CB 3.42Å; T285-Y288 PolarHBondContact O-N 3.12Å
286	K	47.1	Very low	66.6	Low	205 Å²	205	82.3 Å²	82.3	89%	0.891	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-53.5	-20.4	173.1	-85.6	-177.4	176.5	178.2	0	113.9	Y288	K286-Y288 PolarHBondContact O-N 2.95Å
287	A	48.8	Very low	67.3	Low	42 Å²	42	81 Å²	81	35%	0.347	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-68.1	-13.3	172.1	0	0	0	0	0	113.7	T285 Y289 R290	T285-A287 PolarHBondContact O-N 3.12Å; A287-Y289 PolarHBondContact O-N 2.84Å; A287-Y289 VanDerWaalsContact O-N 3.16Å; A287-R290 PolarHBondContact O-N 2.96Å
288	Y	50.1	Low	68.3	Low	95 Å²	95	71 Å²	71	37%	0.373	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-55.1	-28.7	176.7	-178.9	-99.7	0	0	0	114	K284 T285 K286	K284-Y288 HydrophobicContact CG-CD2 4.08Å; K284-Y288 HydrophobicContact CG-CE2 4.16Å; T285-Y288 WeakPolarHBondContact O-CB 3.42Å; T285-Y288 PolarHBondContact O-N 3.12Å; K286-Y288 PolarHBondContact O-N 2.95Å
289	Y	53.5	Low	69	Low	198 Å²	198	69.9 Å²	69.9	78%	0.776	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-87.2	-5.2	179.2	-61.6	-73.1	0	0	0	113.9	A287 T291	A287-Y289 PolarHBondContact O-N 2.84Å; A287-Y289 VanDerWaalsContact O-N 3.16Å; Y289-T291 PolarHBondContact O-N 2.96Å
290	R	66.9	Low	69.9	Low	185 Å²	185	66.5 Å²	66.5	70%	0.698	32%	0.324	S	S	*	.			trans	-83.7	110.9	174.5	-81.8	-170.6	174.5	-168.9	-1.4	109.4	A287 F292	A287-R290 PolarHBondContact O-N 2.96Å; R290-F292 HydrophobicContact CB-CE2 4.34Å; R290-F292 HydrophobicContact CB-CZ 4.18Å; R290-F292 WeakPolarHBondContact O-CD2 3.39Å; R290-F292 WeakPolarHBondContact O-CE2 3.29Å
291	T	76	Confident	70.9	Confident	89 Å²	89	63.9 Å²	63.9	55%	0.546	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-72.6	125.4	164.2	47.6	0	0	0	0	109.4	T268 Y289	T268-T291 VanDerWaalsContact CG2-CB 3.4Å; T268-T291 HydrophobicContact CG2-CG2 3.54Å; Y289-T291 PolarHBondContact O-N 2.96Å
292	F	87.8	Confident	72.3	Confident	33 Å²	33	59.4 Å²	59.4	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	145	176.6	-65.1	-77.8	0	0	0	110.5	T268 V269 R290 P306 D380	T268-F292 WeakPolarHBondContact CA-O 3.33Å; V269-F292 PolarHBondContact N-O 3.22Å; V269-F292 PolarHBondContact O-N 2.94Å; R290-F292 HydrophobicContact CB-CE2 4.34Å; R290-F292 HydrophobicContact CB-CZ 4.18Å; R290-F292 WeakPolarHBondContact O-CD2 3.39Å; R290-F292 WeakPolarHBondContact O-CE2 3.29Å; F292-P306 HydrophobicContact CD1-CG 4.04Å; F292-P306 HydrophobicContact CE1-CG 4.06Å; F292-P306 HydrophobicContact CG-CG 4.39Å; F292-P306 HydrophobicContact CZ-CG 4.43Å; F292-D380 HydrophobicContact CB-CB 3.98Å; F292-D380 HydrophobicContact CD1-CB 3.84Å; F292-D380 HydrophobicContact CG-CB 4.31Å
293	N	92	Very high	73.8	Confident	50 Å²	50	59.1 Å²	59.1	27%	0.267	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	135.1	174.1	-80.8	-49.1	0	0	0	109.8	R266 K378 F379 D380 W381	R266-N293 HydrophobicContact CG-CB 3.99Å; R266-N293 PolarHBondContact NH1-OD1 2.82Å; N293-K378 VanDerWaalsContact CB-O 3.26Å; N293-K378 WeakPolarHBondContact CB-O 3.47Å; N293-K378 PolarHBondContact ND2-O 3.13Å; N293-F379 HydrophobicContact CB-CB 4.15Å; N293-D380 PolarHBondContact N-OD2 2.61Å; N293-D380 PolarHBondContact O-N 2.72Å; N293-W381 PolarHBondContact O-N 3.39Å
294	A	93	Very high	75.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	149.3	-177.8	0	0	0	0	0	111.6	R266 F267 V269 W381	R266-A294 CarbonylContact C-O 3.56Å; R266-A294 VanDerWaalsContact CA-O 3.27Å; R266-A294 WeakPolarHBondContact CA-O 3.39Å; F267-A294 HydrophobicContact CD1-CB 4.49Å; F267-A294 WeakPolarHBondContact CD1-O 3.5Å; F267-A294 HydrophobicContact CD2-CB 4.18Å; F267-A294 HydrophobicContact CE1-CB 4.04Å; F267-A294 HydrophobicContact CE2-CB 3.7Å; F267-A294 HydrophobicContact CZ-CB 3.63Å; F267-A294 PolarHBondContact N-O 2.89Å; F267-A294 PolarHBondContact O-N 2.9Å; V269-A294 HydrophobicContact CB-CB 4.19Å; V269-A294 HydrophobicContact CG2-CB 3.37Å; A294-W381 WeakPolarHBondContact CA-O 3.49Å; A294-W381 HydrophobicContact CB-CB 3.68Å
295	I	92.5	Very high	77.3	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	158.4	170.1	65.1	167.1	0	0	0	109.6	A86 Y264 R266 F379 W381 V382 L383	A86-I295 HydrophobicContact CB-CD1 3.93Å; Y264-I295 WeakPolarHBondContact O-CG2 3.45Å; R266-I295 HydrophobicContact CB-CG2 4.08Å; R266-I295 HydrophobicContact CG-CG2 4.43Å; I295-F379 HydrophobicContact CD1-CD1 4.02Å; I295-F379 HydrophobicContact CD1-CD2 4.21Å; I295-F379 HydrophobicContact CD1-CE1 3.74Å; I295-F379 HydrophobicContact CD1-CE2 3.95Å; I295-F379 HydrophobicContact CD1-CG 4.25Å; I295-F379 HydrophobicContact CD1-CZ 3.7Å; I295-F379 HydrophobicContact CG1-CD1 4.34Å; I295-F379 HydrophobicContact CG1-CD2 4.17Å; I295-F379 HydrophobicContact CG1-CE2 4.36Å; I295-F379 HydrophobicContact CG1-CG 4.17Å; I295-F379 HydrophobicContact CG2-CB 4.21Å; I295-F379 HydrophobicContact CG2-CD1 3.95Å; I295-F379 HydrophobicContact CG2-CG 4.12Å; I295-W381 PolarHBondContact N-O 2.99Å; I295-V382 HydrophobicContact CD1-CG2 4.02Å; I295-V382 HydrophobicContact CG1-CB 4.36Å; I295-V382 HydrophobicContact CG1-CG1 4.37Å; I295-V382 HydrophobicContact CG1-CG2 3.84Å; I295-V382 WeakPolarHBondContact O-CA 3.42Å; I295-L383 PolarHBondContact O-N 3.33Å
296	V	92.5	Very high	79.3	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.1	168.1	-176.1	0	0	0	0	108.9	T85 F267 L383 L388 H393 F404	T85-V296 PolarHBondContact OG1-O 2.7Å; F267-V296 HydrophobicContact CE1-CG2 3.87Å; F267-V296 HydrophobicContact CZ-CG2 4.23Å; V296-L383 WeakPolarHBondContact CA-O 3.22Å; V296-L383 WeakPolarHBondContact CG1-O 3.25Å; V296-L383 HydrophobicContact CG2-CB 4.3Å; V296-L388 HydrophobicContact CG1-CD2 4.02Å; V296-L388 HydrophobicContact CG1-CG 4.18Å; V296-H393 WeakPolarHBondContact CG1-CE1 3.47Å; V296-F404 HydrophobicContact CG2-CE1 3.79Å; V296-F404 HydrophobicContact CG2-CZ 4.26Å
297	S	89.6	Confident	81.2	Confident	5 Å²	5	44.7 Å²	44.7	4%	0.035	22%	0.221	C	C	.	.			trans	-123.5	112.2	178.6	-179.8	0	0	0	0	111.6	S299 S300 L383 L388	S297-S299 PolarHBondContact O-N 3.39Å; S297-S299 PolarHBondContact OG-N 3.41Å; S297-S299 PolarHBondContact OG-OG 2.74Å; S297-S300 PolarHBondContact O-N 3.18Å; S297-S300 PolarHBondContact OG-N 2.86Å; S297-L383 PolarHBondContact N-O 3.01Å; S297-L388 WeakPolarHBondContact O-CD1 3.5Å
298	S	85.4	Confident	82.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.5	170	54.9	0	0	0	0	114.5	T66 I83 T85	T66-S298 WeakPolarHBondContact CB-O 3.43Å; T66-S298 PolarHBondContact OG1-O 3.04Å; T66-S298 VanDerWaalsContact OG1-O 3.06Å; I83-S298 WeakPolarHBondContact O-CB 3.19Å; I83-S298 PolarHBondContact O-OG 2.92Å; T85-S298 PolarHBondContact N-OG 2.87Å; T85-S298 VanDerWaalsContact N-OG 3.11Å; T85-S298 PolarHBondContact OG1-N 2.88Å; T85-S298 VanDerWaalsContact OG1-N 3.15Å; T85-S298 PolarHBondContact OG1-OG 3.18Å
299	S	79	Confident	84.7	Confident	36 Å²	36	43.8 Å²	43.8	25%	0.252	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-1.7	174.1	61.5	0	0	0	0	113	D84 S297	D84-S299 PolarHBondContact OD1-OG 3.16Å; S297-S299 PolarHBondContact O-N 3.39Å; S297-S299 PolarHBondContact OG-N 3.41Å; S297-S299 PolarHBondContact OG-OG 2.74Å
300	S	83.4	Confident	86.5	Confident	13 Å²	13	34.4 Å²	34.4	9%	0.091	17%	0.173	C	C	.	.			trans	-98.2	121.2	-179.5	-173.4	0	0	0	0	112	S297 L302 H304 G384 E385	S297-S300 PolarHBondContact O-N 3.18Å; S297-S300 PolarHBondContact OG-N 2.86Å; S300-L302 VanDerWaalsContact C-N 3.28Å; S300-L302 PolarHBondContact O-N 2.98Å; S300-L302 PolarHBondContact OG-O 2.86Å; S300-H304 PolarHBondContact OG-CD2 2.8Å; S300-G384 CarbonylContact O-C 3.56Å; S300-G384 WeakPolarHBondContact O-CA 3.34Å; S300-E385 PolarHBondContact O-N 2.77Å
301	L	78.3	Confident	87.6	Confident	44 Å²	44	31.6 Å²	31.6	23%	0.23	16%	0.163	C	C	.	.	S	Bend	trans	-67	-26.3	173.6	-95.1	-179.9	0	0	0	114.7	N63 I64 E385	N63-L301 WeakPolarHBondContact O-CD2 3.15Å; I64-L301 HydrophobicContact CB-CD1 4.23Å; I64-L301 HydrophobicContact CB-CD2 4.3Å; I64-L301 HydrophobicContact CB-CG 4.29Å; I64-L301 HydrophobicContact CG1-CD1 4.07Å; I64-L301 HydrophobicContact CG1-CD2 4.29Å; I64-L301 HydrophobicContact CG1-CG 4.5Å; I64-L301 HydrophobicContact CG2-CD1 3.72Å; I64-L301 HydrophobicContact CG2-CG 3.96Å; L301-E385 HydrophobicContact CD2-CG 4.39Å
302	L	86.6	Confident	88.2	Confident	18 Å²	18	28.8 Å²	28.8	9%	0.094	15%	0.145	C	C	.	.	S	Bend	trans	-125.6	158.8	-167.9	-51.9	176.2	0	0	0	109.5	S300 M327 I359 A369 Q371 G384	S300-L302 VanDerWaalsContact C-N 3.28Å; S300-L302 PolarHBondContact O-N 2.98Å; S300-L302 PolarHBondContact OG-O 2.86Å; L302-M327 HydrophobicContact CD1-CE 3.96Å; L302-M327 HydrophobicContact CD2-CE 3.71Å; L302-I359 HydrophobicContact CD2-CD1 3.63Å; L302-A369 HydrophobicContact CD2-CB 4.11Å; L302-Q371 HydrophobicContact CD1-CB 4.08Å; L302-G384 WeakPolarHBondContact O-CA 3.5Å; L302-G384 PolarHBondContact O-N 3.27Å
303	I	92.6	Very high	88.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.1	161	-65.6	175.8	0	0	0	107.5	I352 A369 F370 Q371 W381 V382 L383 P386 W387	I303-I352 HydrophobicContact CD1-CD1 3.44Å; I303-I352 VanDerWaalsContact CD1-CD1 3.44Å; I303-A369 PolarHBondContact N-O 3.35Å; I303-F370 HydrophobicContact CB-CD1 3.69Å; I303-F370 HydrophobicContact CB-CE1 3.8Å; I303-F370 HydrophobicContact CD1-CD1 4.46Å; I303-F370 HydrophobicContact CD1-CE1 3.69Å; I303-F370 HydrophobicContact CD1-CZ 4.29Å; I303-F370 HydrophobicContact CG1-CE1 4.3Å; I303-F370 HydrophobicContact CG2-CD1 3.86Å; I303-F370 HydrophobicContact CG2-CE1 3.92Å; I303-F370 WeakPolarHBondContact O-CA 3.34Å; I303-Q371 PolarHBondContact O-N 3.07Å; I303-W381 HydrophobicContact CG2-CE3 3.92Å; I303-W381 HydrophobicContact CG2-CZ3 3.83Å; I303-V382 WeakPolarHBondContact CA-O 3.3Å; I303-L383 HydrophobicContact CG2-CD2 4.03Å; I303-P386 HydrophobicContact CD1-CB 3.84Å; I303-P386 HydrophobicContact CD1-CG 4.29Å; I303-P386 HydrophobicContact CG1-CB 4.22Å; I303-P386 HydrophobicContact CG1-CG 4.15Å; I303-W387 HydrophobicContact CD1-CB 4.13Å
304	H	90.3	Very high	88.4	Confident	42 Å²	42	25 Å²	25	19%	0.194	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	139	172.6	-61.5	-90.9	0	0	0	110.3	S300 Q371 M373 W381 V382	S300-H304 PolarHBondContact OG-CD2 2.8Å; H304-Q371 WeakPolarHBondContact CA-O 3.37Å; H304-M373 HydrophobicContact CB-CB 4.18Å; H304-M373 HydrophobicContact CB-CE 3.31Å; H304-M373 WeakPolarHBondContact O-CE 3.38Å; H304-W381 CarbonylContact O-C 3.53Å; H304-W381 VanDerWaalsContact O-CA 3.29Å; H304-W381 WeakPolarHBondContact O-CA 3.28Å; H304-W381 VanDerWaalsContact O-CE3 3.3Å; H304-V382 HydrophobicContact CB-CB 4.16Å; H304-V382 PolarHBondContact N-O 2.8Å; H304-V382 PolarHBondContact O-N 3.45Å
305	G	91.3	Very high	88.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	179.7	-179.7	0	0	0	0	0	114.5	Q371 K372 M373 D380 W381	G305-Q371 PolarHBondContact N-O 3.03Å; G305-Q371 VanDerWaalsContact N-O 3.09Å; G305-K372 WeakPolarHBondContact O-CA 3.12Å; G305-M373 PolarHBondContact O-N 3.27Å; G305-D380 CarbonylContact C-O 3.55Å; G305-D380 WeakPolarHBondContact CA-O 3.37Å; G305-W381 VanDerWaalsContact CA-CE3 3.47Å
306	P	87.8	Confident	88.2	Confident	20 Å²	20	32.9 Å²	32.9	13%	0.13	16%	0.163	C	C	.	.			trans	-55	142.2	173.6	-23.8	33.7	0	0	0	111.7	F292 Y308 D309 I310 D380 W381	F292-P306 HydrophobicContact CD1-CG 4.04Å; F292-P306 HydrophobicContact CE1-CG 4.06Å; F292-P306 HydrophobicContact CG-CG 4.39Å; F292-P306 HydrophobicContact CZ-CG 4.43Å; P306-Y308 PolarHBondContact O-N 3Å; P306-D309 HydrophobicContact CB-CB 4.42Å; P306-D309 PolarHBondContact O-N 3.27Å; P306-I310 WeakPolarHBondContact O-CG1 3.11Å; P306-I310 PolarHBondContact O-N 2.83Å; P306-D380 WeakPolarHBondContact CD-O 3.41Å; P306-D380 HydrophobicContact CG-CB 4.14Å; P306-W381 VanDerWaalsContact CD-CZ2 3.5Å; P306-W381 VanDerWaalsContact CD-NE1 3.32Å; P306-W381 HydrophobicContact CG-CZ2 4.34Å
307	S	87.4	Confident	88.2	Confident	63 Å²	63	33 Å²	33	44%	0.441	16%	0.164	S	C	.	.	H	α-helix	trans	-56.7	-37.4	-176.4	-68.6	0	0	0	0	113.4	W311	S307-W311 WeakPolarHBondContact O-CB 3.48Å; S307-W311 PolarHBondContact O-N 3.08Å
308	Y	85.3	Confident	88.4	Confident	103 Å²	103	40.1 Å²	40.1	40%	0.404	20%	0.196	S	C	.	.	H	α-helix	trans	-69.2	-44.3	179.3	-177.3	-107.1	0	0	0	112.4	P306 W311 N312	P306-Y308 PolarHBondContact O-N 3Å; Y308-W311 HydrophobicContact CD2-CE3 4.34Å; Y308-W311 HydrophobicContact CE2-CE3 4.33Å; Y308-W311 HydrophobicContact CE2-CZ3 4.21Å; Y308-W311 PolarHBondContact O-N 2.88Å; Y308-N312 VanDerWaalsContact CD1-ND2 3.3Å; Y308-N312 WeakPolarHBondContact CD1-ND2 3.32Å; Y308-N312 WeakPolarHBondContact CE1-ND2 3.29Å; Y308-N312 WeakPolarHBondContact O-CB 3.29Å; Y308-N312 PolarHBondContact O-N 3.14Å; Y308-N312 PolarHBondContact O-ND2 3.44Å; Y308-N312 VanDerWaalsContact O-ND2 3.16Å
309	D	87.6	Confident	88.8	Confident	16 Å²	16	40.8 Å²	40.8	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-44.9	-178.2	-67.8	1.8	0	0	0	110.8	P306 W311 N312 I313 W381	P306-D309 HydrophobicContact CB-CB 4.42Å; P306-D309 PolarHBondContact O-N 3.27Å; D309-W311 VanDerWaalsContact C-N 3.33Å; D309-W311 PolarHBondContact O-N 2.03Å; D309-N312 PolarHBondContact O-N 2.9Å; D309-I313 VanDerWaalsContact O-CG1 3.29Å; D309-I313 WeakPolarHBondContact O-CG1 3.12Å; D309-I313 PolarHBondContact O-N 3.12Å; D309-W381 HydrophobicContact CB-CH2 3.96Å; D309-W381 HydrophobicContact CB-CZ2 3.69Å; D309-W381 WeakPolarHBondContact OD2-CZ2 3.28Å
310	I	91.3	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-41	176.1	-61.3	-67.6	0	0	0	111.2	P306 I313 A314 Y328 F370 W381	P306-I310 WeakPolarHBondContact O-CG1 3.11Å; P306-I310 PolarHBondContact O-N 2.83Å; I310-I313 PolarHBondContact O-N 3.27Å; I310-A314 WeakPolarHBondContact O-CB 3.31Å; I310-A314 PolarHBondContact O-N 3.04Å; I310-Y328 HydrophobicContact CG2-CD2 4.36Å; I310-Y328 HydrophobicContact CG2-CE2 3.81Å; I310-F370 HydrophobicContact CD1-CB 4.07Å; I310-F370 HydrophobicContact CD1-CD1 4.25Å; I310-F370 HydrophobicContact CG2-CB 4.46Å; I310-W381 HydrophobicContact CD1-CH2 4.31Å; I310-W381 HydrophobicContact CD1-CZ3 4.04Å
311	W	89.3	Confident	89.9	Confident	126 Å²	126	49.9 Å²	49.9	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-45.8	175.6	174.7	76.4	0	0	0	111.7	S307 Y308 D309 I313 A314 T315	S307-W311 WeakPolarHBondContact O-CB 3.48Å; S307-W311 PolarHBondContact O-N 3.08Å; Y308-W311 HydrophobicContact CD2-CE3 4.34Å; Y308-W311 HydrophobicContact CE2-CE3 4.33Å; Y308-W311 HydrophobicContact CE2-CZ3 4.21Å; Y308-W311 PolarHBondContact O-N 2.88Å; D309-W311 VanDerWaalsContact C-N 3.33Å; D309-W311 PolarHBondContact O-N 2.03Å; W311-I313 PolarHBondContact O-N 3.32Å; W311-A314 PolarHBondContact O-N 3.4Å; W311-T315 WeakPolarHBondContact O-CB 3.46Å; W311-T315 PolarHBondContact O-N 2.87Å; W311-T315 PolarHBondContact O-OG1 3.41Å; W311-T315 VanDerWaalsContact O-OG1 3.07Å
312	N	88.6	Confident	90.3	Very high	31 Å²	31	48.4 Å²	48.4	17%	0.166	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-45.8	176.4	-77.7	-41	0	0	0	112.2	Y308 D309 T315 R316	Y308-N312 VanDerWaalsContact CD1-ND2 3.3Å; Y308-N312 WeakPolarHBondContact CD1-ND2 3.32Å; Y308-N312 WeakPolarHBondContact CE1-ND2 3.29Å; Y308-N312 WeakPolarHBondContact O-CB 3.29Å; Y308-N312 PolarHBondContact O-N 3.14Å; Y308-N312 PolarHBondContact O-ND2 3.44Å; Y308-N312 VanDerWaalsContact O-ND2 3.16Å; D309-N312 PolarHBondContact O-N 2.9Å; N312-T315 PolarHBondContact O-N 3.38Å; N312-R316 WeakPolarHBondContact O-CB 3.45Å; N312-R316 WeakPolarHBondContact O-CG 3.42Å; N312-R316 PolarHBondContact O-N 3Å
313	I	92.5	Very high	90.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.2	-51.3	176.2	-70.6	163.1	0	0	0	109.6	V274 D309 I310 W311 T315 R316 L317 V341 F370 W381	V274-I313 HydrophobicContact CG2-CG2 4.22Å; D309-I313 VanDerWaalsContact O-CG1 3.29Å; D309-I313 WeakPolarHBondContact O-CG1 3.12Å; D309-I313 PolarHBondContact O-N 3.12Å; I310-I313 PolarHBondContact O-N 3.27Å; W311-I313 PolarHBondContact O-N 3.32Å; I313-T315 PolarHBondContact O-N 2.84Å; I313-R316 PolarHBondContact O-N 3.17Å; I313-L317 HydrophobicContact CG2-CD1 3.86Å; I313-L317 WeakPolarHBondContact O-CG 3.45Å; I313-L317 PolarHBondContact O-N 3.42Å; I313-V341 HydrophobicContact CD1-CG1 3.84Å; I313-V341 HydrophobicContact CG1-CG1 4.14Å; I313-V341 HydrophobicContact CG2-CG1 4.14Å; I313-V341 HydrophobicContact CG2-CG2 3.89Å; I313-F370 HydrophobicContact CG2-CD2 4.26Å; I313-F370 HydrophobicContact CG2-CE2 4.41Å; I313-W381 HydrophobicContact CD1-CH2 4.32Å
314	A	93.4	Very high	89.5	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-46.7	-179.9	0	0	0	0	0	112.4	I310 W311 R316 L317 E318 A319 Y328 L368	I310-A314 WeakPolarHBondContact O-CB 3.31Å; I310-A314 PolarHBondContact O-N 3.04Å; W311-A314 PolarHBondContact O-N 3.4Å; A314-R316 VanDerWaalsContact C-N 3.3Å; A314-R316 PolarHBondContact O-N 3.45Å; A314-L317 CarbonylContact O-C 3.58Å; A314-L317 PolarHBondContact O-N 2.97Å; A314-E318 PolarHBondContact O-N 2.94Å; A314-A319 HydrophobicContact CB-CB 4.2Å; A314-A319 VanDerWaalsContact O-CB 3.32Å; A314-A319 WeakPolarHBondContact O-CB 3.41Å; A314-A319 PolarHBondContact O-N 2.97Å; A314-Y328 HydrophobicContact CB-CD1 3.42Å; A314-Y328 VanDerWaalsContact CB-CD1 3.42Å; A314-Y328 HydrophobicContact CB-CD2 3.96Å; A314-Y328 HydrophobicContact CB-CE1 3.5Å; A314-Y328 VanDerWaalsContact CB-CE1 3.5Å; A314-Y328 HydrophobicContact CB-CE2 4.05Å; A314-Y328 HydrophobicContact CB-CG 3.65Å; A314-L368 HydrophobicContact CB-CD1 4.34Å
315	T	91	Very high	88.8	Confident	69 Å²	69	60.7 Å²	60.7	42%	0.423	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-38.3	177.8	-62.9	0	0	0	0	112.1	W311 N312 I313 L317 E318	W311-T315 WeakPolarHBondContact O-CB 3.46Å; W311-T315 PolarHBondContact O-N 2.87Å; W311-T315 PolarHBondContact O-OG1 3.41Å; W311-T315 VanDerWaalsContact O-OG1 3.07Å; N312-T315 PolarHBondContact O-N 3.38Å; I313-T315 PolarHBondContact O-N 2.84Å; T315-L317 VanDerWaalsContact C-N 3.34Å; T315-E318 PolarHBondContact O-N 2.81Å
316	R	89.7	Confident	88.3	Confident	101 Å²	101	62.9 Å²	62.9	38%	0.381	32%	0.316	S	S	.	.	H	α-helix	trans	-75.8	-21.9	178.4	-67.8	-43.2	-171.9	126.9	2.8	114.5	V274 S276 N312 I313 A314	V274-R316 HydrophobicContact CB-CB 3.86Å; V274-R316 HydrophobicContact CG1-CB 4.18Å; V274-R316 HydrophobicContact CG2-CB 4.35Å; S276-R316 PolarHBondContact OG-NH1 3.25Å; S276-R316 VanDerWaalsContact OG-NH1 3.16Å; N312-R316 WeakPolarHBondContact O-CB 3.45Å; N312-R316 WeakPolarHBondContact O-CG 3.42Å; N312-R316 PolarHBondContact O-N 3Å; I313-R316 PolarHBondContact O-N 3.17Å; A314-R316 VanDerWaalsContact C-N 3.3Å; A314-R316 PolarHBondContact O-N 3.45Å
317	L	93	Very high	88.3	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	9.9	170.2	-63.5	175.6	0	0	0	112.6	V274 I313 A314 T315 A319 L338 P339 V341 Y357 L368	V274-L317 HydrophobicContact CG1-CD2 4.34Å; V274-L317 HydrophobicContact CG2-CD2 4.2Å; V274-L317 HydrophobicContact CG2-CG 4.2Å; I313-L317 HydrophobicContact CG2-CD1 3.86Å; I313-L317 WeakPolarHBondContact O-CG 3.45Å; I313-L317 PolarHBondContact O-N 3.42Å; A314-L317 CarbonylContact O-C 3.58Å; A314-L317 PolarHBondContact O-N 2.97Å; T315-L317 VanDerWaalsContact C-N 3.34Å; L317-A319 PolarHBondContact O-N 2.86Å; L317-A319 VanDerWaalsContact O-N 3.12Å; L317-L338 HydrophobicContact CD2-CB 4.33Å; L317-L338 HydrophobicContact CD2-CD2 4.28Å; L317-P339 HydrophobicContact CD2-CG 3.85Å; L317-V341 HydrophobicContact CD1-CG2 4.01Å; L317-Y357 HydrophobicContact CD1-CE2 4Å; L317-L368 HydrophobicContact CB-CD1 4.42Å; L317-L368 HydrophobicContact CD1-CD1 3.84Å; L317-L368 HydrophobicContact CD1-CD2 4Å
318	E	92	Very high	88.5	Confident	154 Å²	154	61 Å²	61	72%	0.72	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	30	-175.7	-60.1	179.7	-166.3	0	0	112.8	A314 T315	A314-E318 PolarHBondContact O-N 2.94Å; T315-E318 PolarHBondContact O-N 2.81Å
319	A	94.8	Very high	88.9	Confident	15 Å²	15	57.4 Å²	57.4	12%	0.124	28%	0.284	C	S	.	.			trans	-84.2	141.9	-177.9	0	0	0	0	0	111.2	A314 L317 M329 V330 L368	A314-A319 HydrophobicContact CB-CB 4.2Å; A314-A319 VanDerWaalsContact O-CB 3.32Å; A314-A319 WeakPolarHBondContact O-CB 3.41Å; A314-A319 PolarHBondContact O-N 2.97Å; L317-A319 PolarHBondContact O-N 2.86Å; L317-A319 VanDerWaalsContact O-N 3.12Å; A319-M329 CarbonylContact C-O 3.59Å; A319-M329 WeakPolarHBondContact CA-O 3.49Å; A319-M329 VanDerWaalsContact CB-O 3.29Å; A319-M329 WeakPolarHBondContact CB-O 3.31Å; A319-V330 HydrophobicContact CB-CG1 3.47Å; A319-V330 VanDerWaalsContact CB-CG1 3.47Å; A319-L368 HydrophobicContact CB-CD1 3.57Å; A319-L368 HydrophobicContact CB-CG 4.19Å
320	W	92.9	Very high	89.2	Confident	131 Å²	131	56.9 Å²	56.9	50%	0.496	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	145.3	173.4	66.2	96.3	0	0	0	110.7	Y328 M329	W320-Y328 CarbonylContact O-C 3.57Å; W320-Y328 WeakPolarHBondContact O-CA 3.21Å; W320-M329 HydrophobicContact CD2-CB 4.1Å; W320-M329 HydrophobicContact CH2-CB 4.43Å; W320-M329 HydrophobicContact CZ2-CB 3.8Å; W320-M329 HydrophobicContact CZ2-CE 3.79Å; W320-M329 PolarHBondContact N-O 3.08Å; W320-M329 PolarHBondContact O-N 3.4Å
321	Y	92.1	Very high	89.2	Confident	109 Å²	109	60.2 Å²	60.2	43%	0.427	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.7	179.2	-170	-96.4	0	0	0	110.6	T323 A326 Y328	Y321-T323 HydrophobicContact CD1-CG2 4.47Å; Y321-A326 WeakPolarHBondContact OH-CA 3.31Å; Y321-A326 PolarHBondContact OH-O 3.44Å; Y321-Y328 HydrophobicContact CD2-CD1 4.07Å; Y321-Y328 HydrophobicContact CD2-CD2 4.19Å; Y321-Y328 AromaticContact CD2-CE1 3.94Å; Y321-Y328 HydrophobicContact CD2-CE1 3.94Å; Y321-Y328 HydrophobicContact CD2-CE2 4.03Å; Y321-Y328 HydrophobicContact CD2-CG 4.2Å; Y321-Y328 AromaticContact CD2-CZ 3.92Å; Y321-Y328 HydrophobicContact CG-CE1 4.39Å
322	S	87.1	Confident	89.3	Confident	13 Å²	13	56.3 Å²	56.3	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.4	172.6	176.4	0	0	0	0	110.9	S324 Y325 A326 M327 M329	S322-S324 VanDerWaalsContact C-N 3.28Å; S322-S324 PolarHBondContact O-N 3.48Å; S322-S324 PolarHBondContact OG-N 3.15Å; S322-S324 PolarHBondContact OG-OG 2.81Å; S322-Y325 WeakPolarHBondContact OG-CD2 3.35Å; S322-Y325 PolarHBondContact OG-N 2.99Å; S322-A326 WeakPolarHBondContact O-CA 3.35Å; S322-A326 PolarHBondContact O-N 2.02Å; S322-M327 PolarHBondContact N-O 3.3Å; S322-M327 PolarHBondContact O-N 3.34Å; S322-M329 WeakPolarHBondContact CB-SD 3.26Å
323	T	84.6	Confident	89.5	Confident	133 Å²	133	63.5 Å²	63.5	82%	0.816	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-26.6	174	52.4	0	0	0	0	112.5	Y321	Y321-T323 HydrophobicContact CD1-CG2 4.47Å
324	S	77.2	Confident	89.3	Confident	100 Å²	100	67 Å²	67	70%	0.699	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-35.9	179.1	60	0	0	0	0	112.8	S322	S322-S324 VanDerWaalsContact C-N 3.28Å; S322-S324 PolarHBondContact O-N 3.48Å; S322-S324 PolarHBondContact OG-N 3.15Å; S322-S324 PolarHBondContact OG-OG 2.81Å
325	Y	76.3	Confident	89	Confident	84 Å²	84	67.1 Å²	67.1	33%	0.329	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-13.8	174.5	-65.7	-73.9	0	0	0	113.4	S322 M327 M329 T363 V365 L367	S322-Y325 WeakPolarHBondContact OG-CD2 3.35Å; S322-Y325 PolarHBondContact OG-N 2.99Å; Y325-M327 WeakPolarHBondContact O-CG 3.28Å; Y325-M327 PolarHBondContact O-N 3.46Å; Y325-M329 HydrophobicContact CD2-SD 3.78Å; Y325-M329 HydrophobicContact CE2-SD 4.09Å; Y325-T363 PolarHBondContact OH-OG1 2.93Å; Y325-V365 HydrophobicContact CE2-CG1 4.36Å; Y325-L367 HydrophobicContact CD1-CD1 4.49Å; Y325-L367 HydrophobicContact CD2-CD2 4.26Å; Y325-L367 HydrophobicContact CG-CD2 4.16Å
326	A	80.1	Confident	88.7	Confident	46 Å²	46	73.1 Å²	73.1	38%	0.38	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	33.5	-169.7	0	0	0	0	0	113.7	Y321 S322	Y321-A326 WeakPolarHBondContact OH-CA 3.31Å; Y321-A326 PolarHBondContact OH-O 3.44Å; S322-A326 WeakPolarHBondContact O-CA 3.35Å; S322-A326 PolarHBondContact O-N 2.02Å
327	M	87.9	Confident	88.7	Confident	16 Å²	16	72.5 Å²	72.5	8%	0.079	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160.9	-175.3	-67	-179	74.7	0	0	110.6	M213 L302 S322 Y325 I359 L367 L368	M213-M327 HydrophobicContact SD-SD 4.21Å; L302-M327 HydrophobicContact CD1-CE 3.96Å; L302-M327 HydrophobicContact CD2-CE 3.71Å; S322-M327 PolarHBondContact N-O 3.3Å; S322-M327 PolarHBondContact O-N 3.34Å; Y325-M327 WeakPolarHBondContact O-CG 3.28Å; Y325-M327 PolarHBondContact O-N 3.46Å; M327-I359 HydrophobicContact CE-CD1 3.91Å; M327-L367 HydrophobicContact CB-CD2 4.25Å; M327-L367 HydrophobicContact CE-CB 4.33Å; M327-L367 HydrophobicContact SD-CD1 4.08Å; M327-L368 VanDerWaalsContact CE-O 3.32Å; M327-L368 WeakPolarHBondContact CE-O 3.22Å
328	Y	92.8	Very high	88.7	Confident	29 Å²	29	73.3 Å²	73.3	11%	0.114	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	135	172.6	-68.9	-80.5	0	0	0	111	I310 A314 W320 Y321 L367 L368	I310-Y328 HydrophobicContact CG2-CD2 4.36Å; I310-Y328 HydrophobicContact CG2-CE2 3.81Å; A314-Y328 HydrophobicContact CB-CD1 3.42Å; A314-Y328 VanDerWaalsContact CB-CD1 3.42Å; A314-Y328 HydrophobicContact CB-CD2 3.96Å; A314-Y328 HydrophobicContact CB-CE1 3.5Å; A314-Y328 VanDerWaalsContact CB-CE1 3.5Å; A314-Y328 HydrophobicContact CB-CE2 4.05Å; A314-Y328 HydrophobicContact CB-CG 3.65Å; W320-Y328 CarbonylContact O-C 3.57Å; W320-Y328 WeakPolarHBondContact O-CA 3.21Å; Y321-Y328 HydrophobicContact CD2-CD1 4.07Å; Y321-Y328 HydrophobicContact CD2-CD2 4.19Å; Y321-Y328 AromaticContact CD2-CE1 3.94Å; Y321-Y328 HydrophobicContact CD2-CE1 3.94Å; Y321-Y328 HydrophobicContact CD2-CE2 4.03Å; Y321-Y328 HydrophobicContact CD2-CG 4.2Å; Y321-Y328 AromaticContact CD2-CZ 3.92Å; Y321-Y328 HydrophobicContact CG-CE1 4.39Å; Y328-L367 CarbonylContact O-C 3.57Å; Y328-L367 WeakPolarHBondContact O-CA 3.37Å; Y328-L368 PolarHBondContact O-N 3.32Å
329	M	92	Very high	88.7	Confident	26 Å²	26	68.6 Å²	68.6	13%	0.128	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	147.5	178.3	-79.7	177.5	60.8	0	0	110.6	A319 W320 S322 Y325 V365 C366 L367	A319-M329 CarbonylContact C-O 3.59Å; A319-M329 WeakPolarHBondContact CA-O 3.49Å; A319-M329 VanDerWaalsContact CB-O 3.29Å; A319-M329 WeakPolarHBondContact CB-O 3.31Å; W320-M329 HydrophobicContact CD2-CB 4.1Å; W320-M329 HydrophobicContact CH2-CB 4.43Å; W320-M329 HydrophobicContact CZ2-CB 3.8Å; W320-M329 HydrophobicContact CZ2-CE 3.79Å; W320-M329 PolarHBondContact N-O 3.08Å; W320-M329 PolarHBondContact O-N 3.4Å; S322-M329 WeakPolarHBondContact CB-SD 3.26Å; Y325-M329 HydrophobicContact CD2-SD 3.78Å; Y325-M329 HydrophobicContact CE2-SD 4.09Å; M329-V365 HydrophobicContact CE-CB 4.38Å; M329-V365 HydrophobicContact CE-CG1 3.28Å; M329-V365 HydrophobicContact CE-CG2 4.19Å; M329-V365 HydrophobicContact CG-CG1 3.96Å; M329-V365 HydrophobicContact SD-CG1 3.9Å; M329-C366 WeakPolarHBondContact CA-O 3.47Å; M329-L367 HydrophobicContact CG-CD2 3.4Å; M329-L367 HydrophobicContact SD-CD2 4.41Å
330	V	93.9	Very high	88.7	Confident	6 Å²	6	71.3 Å²	71.3	4%	0.036	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.7	172.4	-68.4	0	0	0	0	110.8	A319 C332 L338 I358 C366 L368	A319-V330 HydrophobicContact CB-CG1 3.47Å; A319-V330 VanDerWaalsContact CB-CG1 3.47Å; V330-C332 PolarHBondContact O-N 3.48Å; V330-L338 HydrophobicContact CB-CD1 4.45Å; V330-L338 HydrophobicContact CG1-CD1 4.41Å; V330-L338 HydrophobicContact CG2-CD1 4.15Å; V330-I358 HydrophobicContact CG2-CD1 3.71Å; V330-C366 HydrophobicContact CG2-CB 3.92Å; V330-C366 PolarHBondContact N-O 2.83Å; V330-L368 HydrophobicContact CG1-CD1 4.42Å; V330-L368 HydrophobicContact CG1-CD2 3.68Å; V330-L368 HydrophobicContact CG1-CG 4.03Å; V330-L368 HydrophobicContact CG2-CD2 4.14Å
331	D	92.6	Very high	88.8	Confident	70 Å²	70	65.1 Å²	65.1	37%	0.374	35%	0.348	S	S	.	.			trans	-65.9	120.6	170.9	-172	-13.3	0	0	0	110.1	K333 L334 A335	D331-K333 PolarHBondContact O-N 2.91Å; D331-K333 VanDerWaalsContact O-N 3.13Å; D331-K333 WeakPolarHBondContact OD1-CB 3.28Å; D331-K333 WeakPolarHBondContact OD1-CG 3.46Å; D331-K333 PolarHBondContact OD1-N 3.26Å; D331-L334 HydrophobicContact CB-CD1 4.21Å; D331-L334 HydrophobicContact CB-CG 4.19Å; D331-L334 PolarHBondContact O-N 3.4Å; D331-A335 PolarHBondContact O-N 3.33Å
332	C	91.1	Very high	88.8	Confident	44 Å²	44	60.5 Å²	60.5	30%	0.297	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.9	175.6	-75.3	0	0	0	0	114.2	V330 L334 A335 G364 V365 C366	V330-C332 PolarHBondContact O-N 3.48Å; C332-L334 VanDerWaalsContact C-N 3.28Å; C332-A335 WeakPolarHBondContact O-CB 2.98Å; C332-A335 PolarHBondContact O-N 3.36Å; C332-G364 PolarHBondContact SG-O 2.84Å; C332-V365 VanDerWaalsContact SG-C 3.53Å; C332-C366 WeakPolarHBondContact CA-SG 3.19Å; C332-C366 HydrophobicContact CB-CB 4.09Å; C332-C366 WeakPolarHBondContact CB-SG 3.32Å; C332-C366 WeakPolarHBondContact SG-CB 3.34Å; C332-C366 PolarHBondContact SG-N 2.99Å; C332-C366 CovalentContact SG-SG 2.04Å; C332-C366 PolarHBondContact SG-SG 3.39Å
333	K	91.7	Very high	89	Confident	182 Å²	182	59.9 Å²	59.9	79%	0.791	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-33	175.2	-63.9	175.9	-176.7	174.3	0	111.8	D331	D331-K333 PolarHBondContact O-N 2.91Å; D331-K333 VanDerWaalsContact O-N 3.13Å; D331-K333 WeakPolarHBondContact OD1-CB 3.28Å; D331-K333 WeakPolarHBondContact OD1-CG 3.46Å; D331-K333 PolarHBondContact OD1-N 3.26Å
334	L	89.6	Confident	89.1	Confident	72 Å²	72	54 Å²	54	38%	0.377	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.3	179	-59.5	178.9	0	0	0	112.6	D331 C332 K336 S337 L338	D331-L334 HydrophobicContact CB-CD1 4.21Å; D331-L334 HydrophobicContact CB-CG 4.19Å; D331-L334 PolarHBondContact O-N 3.4Å; C332-L334 VanDerWaalsContact C-N 3.28Å; L334-K336 PolarHBondContact O-N 3.18Å; L334-S337 CarbonylContact O-C 3.56Å; L334-S337 PolarHBondContact O-N 2.94Å; L334-S337 PolarHBondContact O-OG 3.09Å; L334-L338 HydrophobicContact CB-CD2 4.37Å; L334-L338 WeakPolarHBondContact O-CG 3.29Å; L334-L338 PolarHBondContact O-N 3.15Å; L334-L338 VanDerWaalsContact O-N 3.12Å
335	A	85.8	Confident	89.6	Confident	6 Å²	6	49.2 Å²	49.2	5%	0.05	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-33.9	-171.9	0	0	0	0	0	115.6	D331 C332 A354 I358	D331-A335 PolarHBondContact O-N 3.33Å; C332-A335 WeakPolarHBondContact O-CB 2.98Å; C332-A335 PolarHBondContact O-N 3.36Å; A335-A354 WeakPolarHBondContact O-CB 3.24Å; A335-I358 HydrophobicContact CB-CG1 4.37Å; A335-I358 HydrophobicContact CB-CG2 4Å
336	K	85.2	Confident	89.8	Confident	194 Å²	194	50.7 Å²	50.7	84%	0.843	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-20	179	-69.2	-172.7	178.8	-177.2	0	114	L334	L334-K336 PolarHBondContact O-N 3.18Å
337	S	89.2	Confident	89.8	Confident	88 Å²	88	51.3 Å²	51.3	62%	0.615	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	1.8	-177	57.7	0	0	0	0	112.9	L334	L334-S337 CarbonylContact O-C 3.56Å; L334-S337 PolarHBondContact O-N 2.94Å; L334-S337 PolarHBondContact O-OG 3.09Å
338	L	93	Very high	89.7	Confident	21 Å²	21	53.5 Å²	53.5	11%	0.11	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-64.8	143.2	176.4	-70.3	174.4	0	0	0	110.6	L317 V330 L334 A354 Y357 I358	L317-L338 HydrophobicContact CD2-CB 4.33Å; L317-L338 HydrophobicContact CD2-CD2 4.28Å; V330-L338 HydrophobicContact CB-CD1 4.45Å; V330-L338 HydrophobicContact CG1-CD1 4.41Å; V330-L338 HydrophobicContact CG2-CD1 4.15Å; L334-L338 HydrophobicContact CB-CD2 4.37Å; L334-L338 WeakPolarHBondContact O-CG 3.29Å; L334-L338 PolarHBondContact O-N 3.15Å; L334-L338 VanDerWaalsContact O-N 3.12Å; L338-A354 HydrophobicContact CB-CB 4.03Å; L338-Y357 VanDerWaalsContact CB-OH 3.29Å; L338-Y357 WeakPolarHBondContact CB-OH 3.42Å; L338-Y357 HydrophobicContact CD1-CE2 4.34Å; L338-I358 HydrophobicContact CD1-CD1 3.68Å; L338-I358 HydrophobicContact CD1-CG1 4.21Å
339	P	93.7	Very high	89.4	Confident	56 Å²	56	55.7 Å²	55.7	36%	0.364	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-74.7	152.3	-179.5	31.6	-37.3	0	0	0	112.1	V274 L317 Y357	V274-P339 HydrophobicContact CG1-CB 4.05Å; V274-P339 HydrophobicContact CG1-CG 3.42Å; V274-P339 VanDerWaalsContact CG1-CG 3.42Å; L317-P339 HydrophobicContact CD2-CG 3.85Å; P339-Y357 PolarHBondContact O-OH 3.1Å
340	D	93.7	Very high	89.4	Confident	72 Å²	72	55.3 Å²	55.3	39%	0.385	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-57.2	140.4	176.4	-64.3	-14.5	0	0	0	112.4	P351 I352 S353	D340-P351 HydrophobicContact CB-CB 3.78Å; D340-I352 WeakPolarHBondContact CA-O 3.03Å; D340-S353 WeakPolarHBondContact OD1-CA 3.44Å
341	V	94.3	Very high	89.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.9	168.5	178.8	0	0	0	0	108.2	V274 I313 L317 I352 Y357 F370	V274-V341 HydrophobicContact CG2-CG2 3.93Å; I313-V341 HydrophobicContact CD1-CG1 3.84Å; I313-V341 HydrophobicContact CG1-CG1 4.14Å; I313-V341 HydrophobicContact CG2-CG1 4.14Å; I313-V341 HydrophobicContact CG2-CG2 3.89Å; L317-V341 HydrophobicContact CD1-CG2 4.01Å; V341-I352 PolarHBondContact N-O 3.33Å; V341-I352 WeakPolarHBondContact O-CB 3.27Å; V341-I352 WeakPolarHBondContact O-CG1 3.48Å; V341-I352 PolarHBondContact O-N 2.92Å; V341-Y357 HydrophobicContact CB-CD1 4.49Å; V341-Y357 HydrophobicContact CB-CE1 4.38Å; V341-Y357 HydrophobicContact CG2-CD1 4.09Å; V341-Y357 HydrophobicContact CG2-CE1 3.79Å; V341-F370 HydrophobicContact CB-CE2 4.25Å; V341-F370 HydrophobicContact CB-CZ 3.77Å; V341-F370 HydrophobicContact CG1-CE1 4.06Å; V341-F370 HydrophobicContact CG1-CE2 4.39Å; V341-F370 HydrophobicContact CG1-CZ 3.69Å; V341-F370 HydrophobicContact CG2-CE2 3.7Å; V341-F370 HydrophobicContact CG2-CZ 3.75Å
342	I	91.9	Very high	89.5	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.067	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130	-173.9	-58.7	178.7	0	0	0	109.7	G272 Y273 L275 D349 L350 P351	G272-I342 CarbonylContact C-O 3.32Å; G272-I342 VanDerWaalsContact CA-O 3.29Å; G272-I342 WeakPolarHBondContact CA-O 3.29Å; Y273-I342 HydrophobicContact CD1-CB 4.25Å; Y273-I342 HydrophobicContact CD1-CG2 4.41Å; Y273-I342 HydrophobicContact CE1-CB 3.83Å; Y273-I342 HydrophobicContact CE1-CG2 3.6Å; Y273-I342 HydrophobicContact CE2-CB 4.4Å; Y273-I342 HydrophobicContact CE2-CD1 4.14Å; Y273-I342 PolarHBondContact N-O 2.81Å; Y273-I342 PolarHBondContact O-N 3.47Å; L275-I342 HydrophobicContact CD1-CD1 3.63Å; L275-I342 HydrophobicContact CD2-CD1 4.32Å; L275-I342 HydrophobicContact CG-CD1 3.67Å; I342-D349 HydrophobicContact CG2-CB 3.59Å; I342-L350 WeakPolarHBondContact CA-O 3.3Å; I342-P351 HydrophobicContact CG1-CB 4.45Å
343	L	91.7	Very high	89.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.7	163	-58.8	-171.2	0	0	0	109.5	R271 G272 I345 L350 I352 W381 L383 W387	R271-L343 WeakPolarHBondContact O-CA 3.47Å; G272-L343 VanDerWaalsContact CA-CD2 3.47Å; L343-I345 HydrophobicContact CB-CG1 4.49Å; L343-L350 PolarHBondContact N-O 2.95Å; L343-L350 PolarHBondContact O-N 3.27Å; L343-I352 HydrophobicContact CD1-CD1 4.32Å; L343-I352 HydrophobicContact CG-CD1 4.21Å; L343-W381 HydrophobicContact CD2-CH2 4.15Å; L343-W381 HydrophobicContact CD2-CZ3 4.23Å; L343-L383 HydrophobicContact CD1-CD1 4Å; L343-L383 HydrophobicContact CD1-CD2 3.51Å; L343-L383 HydrophobicContact CD1-CG 4.44Å; L343-W387 HydrophobicContact CB-CH2 4.3Å; L343-W387 HydrophobicContact CB-CZ3 3.88Å; L343-W387 HydrophobicContact CD1-CE3 3.77Å; L343-W387 HydrophobicContact CD1-CH2 4.31Å; L343-W387 HydrophobicContact CD1-CZ3 3.56Å; L343-W387 HydrophobicContact CG-CE3 4.44Å; L343-W387 HydrophobicContact CG-CZ3 3.91Å
344	T	87.4	Confident	89.7	Confident	9 Å²	9	44.2 Å²	44.2	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.8	172.6	-51.4	0	0	0	0	108.6	N270 R271 Y273 V348 D349	N270-T344 HydrophobicContact CB-CG2 3.95Å; N270-T344 WeakPolarHBondContact CB-O 3.09Å; N270-T344 PolarHBondContact N-O 2.77Å; N270-T344 PolarHBondContact OD1-O 3.01Å; R271-T344 WeakPolarHBondContact CG-OG1 3.3Å; R271-T344 PolarHBondContact NE-OG1 2.83Å; R271-T344 VanDerWaalsContact NE-OG1 3.16Å; R271-T344 PolarHBondContact O-N 2.87Å; Y273-T344 WeakPolarHBondContact CE1-OG1 3.27Å; T344-V348 CarbonylContact C-O 3.55Å; T344-V348 WeakPolarHBondContact CA-O 3.15Å; T344-D349 WeakPolarHBondContact CB-OD1 3.49Å; T344-D349 WeakPolarHBondContact CG2-OD1 3.42Å; T344-D349 PolarHBondContact OG1-OD1 2.67Å
345	I	87.8	Confident	89.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.4	179.1	-61.4	179.7	0	0	0	108.4	L256 V258 F267 V269 L343 G347 V348 L350 W387 F404	L256-I345 HydrophobicContact CD2-CB 4.4Å; L256-I345 HydrophobicContact CD2-CG2 4.34Å; V258-I345 HydrophobicContact CG1-CG2 3.56Å; F267-I345 HydrophobicContact CD2-CG2 4.17Å; F267-I345 HydrophobicContact CE2-CD1 3.71Å; F267-I345 HydrophobicContact CE2-CG1 4.35Å; F267-I345 HydrophobicContact CE2-CG2 4.36Å; F267-I345 HydrophobicContact CZ-CD1 4.49Å; V269-I345 HydrophobicContact CG2-CD1 4.3Å; V269-I345 HydrophobicContact CG2-CG1 4.02Å; L343-I345 HydrophobicContact CB-CG1 4.49Å; I345-G347 PolarHBondContact O-N 2.96Å; I345-V348 PolarHBondContact N-O 3.42Å; I345-V348 WeakPolarHBondContact O-CB 3.16Å; I345-V348 PolarHBondContact O-N 3.37Å; I345-L350 HydrophobicContact CB-CD1 4.32Å; I345-L350 HydrophobicContact CD1-CD1 4.06Å; I345-L350 HydrophobicContact CG1-CD1 4.46Å; I345-W387 HydrophobicContact CD1-CH2 3.44Å; I345-W387 VanDerWaalsContact CD1-CH2 3.44Å; I345-W387 HydrophobicContact CD1-CZ2 3.59Å; I345-W387 HydrophobicContact CD1-CZ3 4.49Å; I345-F404 HydrophobicContact CD1-CD2 4.31Å; I345-F404 HydrophobicContact CD1-CE2 4.05Å; I345-F404 HydrophobicContact CG2-CE2 4.37Å
346	N	79.5	Confident	89.9	Confident	114 Å²	114	45.6 Å²	45.6	61%	0.61	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	37.8	-177	-162.5	27	0	0	0	112.9	V258 N270 V348	V258-N346 HydrophobicContact CG1-CB 4.41Å; N270-N346 PolarHBondContact OD1-N 2.6Å; N346-V348 PolarHBondContact O-N 3.08Å
347	G	80.4	Confident	90.2	Very high	60 Å²	60	36.4 Å²	36.4	62%	0.619	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	1.7	-176.6	0	0	0	0	0	115.7	N270 I345	N270-G347 PolarHBondContact OD1-N 3.26Å; I345-G347 PolarHBondContact O-N 2.96Å
348	V	85.3	Confident	90.3	Very high	61 Å²	61	32.7 Å²	32.7	37%	0.37	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.7	176.5	-177.9	0	0	0	0	109.8	L256 T344 I345 N346 L350	L256-V348 HydrophobicContact CD1-CB 4.39Å; L256-V348 HydrophobicContact CD1-CG2 3.86Å; L256-V348 HydrophobicContact CD2-CB 4.03Å; L256-V348 HydrophobicContact CD2-CG1 4.37Å; L256-V348 HydrophobicContact CD2-CG2 4.4Å; T344-V348 CarbonylContact C-O 3.55Å; T344-V348 WeakPolarHBondContact CA-O 3.15Å; I345-V348 PolarHBondContact N-O 3.42Å; I345-V348 WeakPolarHBondContact O-CB 3.16Å; I345-V348 PolarHBondContact O-N 3.37Å; N346-V348 PolarHBondContact O-N 3.08Å; V348-L350 HydrophobicContact CG1-CD2 4.14Å; V348-L350 HydrophobicContact CG1-CG 4.37Å
349	D	88.4	Confident	89.9	Confident	75 Å²	75	32 Å²	32	40%	0.401	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.4	176.4	-73	-20.8	0	0	0	110.6	Y273 I342 T344	Y273-D349 PolarHBondContact OH-OD1 3.35Å; Y273-D349 PolarHBondContact OH-OD2 2.87Å; I342-D349 HydrophobicContact CG2-CB 3.59Å; T344-D349 WeakPolarHBondContact CB-OD1 3.49Å; T344-D349 WeakPolarHBondContact CG2-OD1 3.42Å; T344-D349 PolarHBondContact OG1-OD1 2.67Å
350	L	91.4	Very high	89.4	Confident	19 Å²	19	33 Å²	33	10%	0.099	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	109.5	-177.2	-69.6	178.2	0	0	0	110.5	L256 I342 L343 I345 V348 W387 Y391	L256-L350 HydrophobicContact CD2-CD1 3.74Å; L256-L350 HydrophobicContact CD2-CG 4.43Å; I342-L350 WeakPolarHBondContact CA-O 3.3Å; L343-L350 PolarHBondContact N-O 2.95Å; L343-L350 PolarHBondContact O-N 3.27Å; I345-L350 HydrophobicContact CB-CD1 4.32Å; I345-L350 HydrophobicContact CD1-CD1 4.06Å; I345-L350 HydrophobicContact CG1-CD1 4.46Å; V348-L350 HydrophobicContact CG1-CD2 4.14Å; V348-L350 HydrophobicContact CG1-CG 4.37Å; L350-W387 HydrophobicContact CB-CH2 3.83Å; L350-W387 HydrophobicContact CB-CZ3 4.28Å; L350-W387 HydrophobicContact CD1-CH2 3.71Å; L350-W387 HydrophobicContact CD1-CZ2 4.1Å; L350-W387 HydrophobicContact CG-CH2 4.46Å; L350-Y391 VanDerWaalsContact C-OH 3.28Å; L350-Y391 WeakPolarHBondContact CA-OH 3.36Å; L350-Y391 HydrophobicContact CB-CE2 4.27Å; L350-Y391 WeakPolarHBondContact CB-OH 3.49Å; L350-Y391 HydrophobicContact CD2-CE1 4.16Å
351	P	94.1	Very high	88.4	Confident	44 Å²	44	30.3 Å²	30.3	29%	0.286	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	139.7	-177.4	31.2	-35.3	0	0	0	113.3	D340 I342 Q390 Y391	D340-P351 HydrophobicContact CB-CB 3.78Å; I342-P351 HydrophobicContact CG1-CB 4.45Å; P351-Q390 WeakPolarHBondContact O-CG 3.29Å; P351-Q390 PolarHBondContact O-NE2 2.8Å; P351-Y391 VanDerWaalsContact CD-OH 3.29Å; P351-Y391 WeakPolarHBondContact CD-OH 3.38Å; P351-Y391 VanDerWaalsContact N-OH 3.13Å; P351-Y391 PolarHBondContact O-OH 2.84Å
352	I	94.5	Very high	87.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.9	169.8	-48.8	169.1	0	0	0	107.1	I303 D340 V341 L343 N356 Y357 F370 P386 W387	I303-I352 HydrophobicContact CD1-CD1 3.44Å; I303-I352 VanDerWaalsContact CD1-CD1 3.44Å; D340-I352 WeakPolarHBondContact CA-O 3.03Å; V341-I352 PolarHBondContact N-O 3.33Å; V341-I352 WeakPolarHBondContact O-CB 3.27Å; V341-I352 WeakPolarHBondContact O-CG1 3.48Å; V341-I352 PolarHBondContact O-N 2.92Å; L343-I352 HydrophobicContact CD1-CD1 4.32Å; L343-I352 HydrophobicContact CG-CD1 4.21Å; I352-N356 HydrophobicContact CG2-CB 4.33Å; I352-Y357 HydrophobicContact CB-CD1 4.46Å; I352-Y357 HydrophobicContact CG2-CD1 4.08Å; I352-Y357 VanDerWaalsContact O-CE1 3.28Å; I352-Y357 WeakPolarHBondContact O-CE1 3.02Å; I352-F370 HydrophobicContact CD1-CE1 4.5Å; I352-F370 HydrophobicContact CD1-CZ 4.43Å; I352-P386 HydrophobicContact CG2-CB 4.2Å; I352-W387 HydrophobicContact CD1-CE3 3.69Å; I352-W387 HydrophobicContact CD1-CZ3 4.15Å; I352-W387 HydrophobicContact CG1-CE3 3.83Å; I352-W387 HydrophobicContact CG1-CZ3 4.09Å
353	S	93.3	Very high	86.5	Confident	16 Å²	16	37.6 Å²	37.6	11%	0.112	23%	0.225	C	C	.	.			trans	-77.1	152.2	-175.9	56.7	0	0	0	0	113.2	D340 E355 N356 Y357 Q390	D340-S353 WeakPolarHBondContact OD1-CA 3.44Å; S353-E355 PolarHBondContact O-N 2.84Å; S353-E355 VanDerWaalsContact O-N 3.17Å; S353-E355 WeakPolarHBondContact OG-CG 2.95Å; S353-E355 PolarHBondContact OG-OE1 3.24Å; S353-N356 PolarHBondContact O-N 2.84Å; S353-N356 PolarHBondContact OG-ND2 2.78Å; S353-Y357 VanDerWaalsContact C-CE1 3.41Å; S353-Y357 WeakPolarHBondContact O-CD1 3.48Å; S353-Y357 WeakPolarHBondContact O-CE1 2.87Å; S353-Y357 PolarHBondContact O-N 3.17Å; S353-Q390 PolarHBondContact OG-OE1 2.51Å
354	A	92.6	Very high	86	Confident	8 Å²	8	40.4 Å²	40.4	7%	0.066	25%	0.254	C	S	.	.	H	α-helix	trans	-56.4	-31.7	-179.7	0	0	0	0	0	114.6	A335 L338 N356 Y357 I358	A335-A354 WeakPolarHBondContact O-CB 3.24Å; L338-A354 HydrophobicContact CB-CB 4.03Å; A354-N356 PolarHBondContact O-N 2.87Å; A354-Y357 HydrophobicContact CB-CE1 4.08Å; A354-Y357 HydrophobicContact CB-CE2 4.25Å; A354-Y357 VanDerWaalsContact CB-OH 3.31Å; A354-Y357 WeakPolarHBondContact CB-OH 3.25Å; A354-Y357 VanDerWaalsContact N-CE1 3.31Å; A354-I358 WeakPolarHBondContact O-CB 3.49Å; A354-I358 WeakPolarHBondContact O-CG1 3.41Å; A354-I358 PolarHBondContact O-N 2.97Å
355	E	89	Confident	85.9	Confident	106 Å²	106	41.4 Å²	41.4	50%	0.495	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-28.5	174.1	54.9	-179.8	-177.2	0	0	113.6	R208 S353	R208-E355 IonicContact CZ-OE1 2.87Å; R208-E355 IonicContact NE-OE1 2.98Å; R208-E355 IonicContact NH1-OE1 2.74Å; R208-E355 PolarHBondContact NH1-OE1 2.76Å; R208-E355 IonicContact NH1-OE2 3.31Å; S353-E355 PolarHBondContact O-N 2.84Å; S353-E355 VanDerWaalsContact O-N 3.17Å; S353-E355 WeakPolarHBondContact OG-CG 2.95Å; S353-E355 PolarHBondContact OG-OE1 3.24Å
356	N	90.7	Very high	86	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.011	26%	0.26	C	S	.	.	H	α-helix	trans	-95.4	-26.1	-175.6	-67.2	-18.6	0	0	0	112.9	L211 I352 S353 A354 P386 Q390	L211-N356 WeakPolarHBondContact CD1-O 3.46Å; I352-N356 HydrophobicContact CG2-CB 4.33Å; S353-N356 PolarHBondContact O-N 2.84Å; S353-N356 PolarHBondContact OG-ND2 2.78Å; A354-N356 PolarHBondContact O-N 2.87Å; N356-P386 HydrophobicContact CB-CB 4.49Å; N356-P386 WeakPolarHBondContact O-CA 3.5Å; N356-P386 VanDerWaalsContact O-CB 3.28Å; N356-P386 WeakPolarHBondContact O-CB 3.17Å; N356-Q390 PolarHBondContact ND2-OE1 2.95Å
357	Y	92.5	Very high	86.6	Confident	0 Å²	0	36 Å²	36	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-104.3	-0.3	-179	68.3	-111.4	0	0	0	114.9	L317 L338 P339 V341 I352 S353 A354 L368 A369 F370	L317-Y357 HydrophobicContact CD1-CE2 4Å; L338-Y357 VanDerWaalsContact CB-OH 3.29Å; L338-Y357 WeakPolarHBondContact CB-OH 3.42Å; L338-Y357 HydrophobicContact CD1-CE2 4.34Å; P339-Y357 PolarHBondContact O-OH 3.1Å; V341-Y357 HydrophobicContact CB-CD1 4.49Å; V341-Y357 HydrophobicContact CB-CE1 4.38Å; V341-Y357 HydrophobicContact CG2-CD1 4.09Å; V341-Y357 HydrophobicContact CG2-CE1 3.79Å; I352-Y357 HydrophobicContact CB-CD1 4.46Å; I352-Y357 HydrophobicContact CG2-CD1 4.08Å; I352-Y357 VanDerWaalsContact O-CE1 3.28Å; I352-Y357 WeakPolarHBondContact O-CE1 3.02Å; S353-Y357 VanDerWaalsContact C-CE1 3.41Å; S353-Y357 WeakPolarHBondContact O-CD1 3.48Å; S353-Y357 WeakPolarHBondContact O-CE1 2.87Å; S353-Y357 PolarHBondContact O-N 3.17Å; A354-Y357 HydrophobicContact CB-CE1 4.08Å; A354-Y357 HydrophobicContact CB-CE2 4.25Å; A354-Y357 VanDerWaalsContact CB-OH 3.31Å; A354-Y357 WeakPolarHBondContact CB-OH 3.25Å; A354-Y357 VanDerWaalsContact N-CE1 3.31Å; Y357-L368 HydrophobicContact CD2-CD2 4.21Å; Y357-L368 HydrophobicContact CE2-CD2 4.31Å; Y357-A369 WeakPolarHBondContact O-CB 3.37Å; Y357-A369 PolarHBondContact O-N 2.77Å; Y357-F370 VanDerWaalsContact CB-CE2 3.4Å; Y357-F370 HydrophobicContact CD1-CE2 4.07Å; Y357-F370 HydrophobicContact CD1-CZ 4.32Å; Y357-F370 HydrophobicContact CD2-CD2 4.49Å; Y357-F370 AromaticContact CD2-CE2 3.8Å; Y357-F370 HydrophobicContact CD2-CE2 3.8Å; Y357-F370 HydrophobicContact CG-CD2 4.5Å; Y357-F370 AromaticContact CG-CE2 3.5Å; Y357-F370 HydrophobicContact CG-CE2 3.5Å; Y357-F370 HydrophobicContact CG-CZ 4.1Å
358	I	91	Very high	87.1	Confident	10 Å²	10	33.2 Å²	33.2	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.5	173.3	-63.1	-58.7	0	0	0	111.2	V330 A335 L338 A354 K360 C366 L368	V330-I358 HydrophobicContact CG2-CD1 3.71Å; A335-I358 HydrophobicContact CB-CG1 4.37Å; A335-I358 HydrophobicContact CB-CG2 4Å; L338-I358 HydrophobicContact CD1-CD1 3.68Å; L338-I358 HydrophobicContact CD1-CG1 4.21Å; A354-I358 WeakPolarHBondContact O-CB 3.49Å; A354-I358 WeakPolarHBondContact O-CG1 3.41Å; A354-I358 PolarHBondContact O-N 2.97Å; I358-K360 HydrophobicContact CG2-CG 4.46Å; I358-C366 HydrophobicContact CG2-CB 4.05Å; I358-L368 HydrophobicContact CD1-CD2 3.48Å; I358-L368 VanDerWaalsContact CD1-CD2 3.48Å
359	I	84.8	Confident	87.4	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	121.9	174.6	-52.6	171.2	0	0	0	108.9	L211 M213 L302 M327 C366 L367 A369	L211-I359 HydrophobicContact CB-CB 4.17Å; L211-I359 HydrophobicContact CB-CG1 3.79Å; L211-I359 HydrophobicContact CB-CG2 4.26Å; L211-I359 HydrophobicContact CD1-CG1 3.76Å; L211-I359 HydrophobicContact CG-CG1 4.44Å; L211-I359 CarbonylContact O-C 3.55Å; L211-I359 WeakPolarHBondContact O-CA 3.12Å; M213-I359 HydrophobicContact CB-CG2 4.05Å; M213-I359 HydrophobicContact CG-CG2 3.8Å; M213-I359 HydrophobicContact SD-CG2 4.15Å; L302-I359 HydrophobicContact CD2-CD1 3.63Å; M327-I359 HydrophobicContact CE-CD1 3.91Å; I359-C366 CarbonylContact O-C 3.59Å; I359-C366 WeakPolarHBondContact O-CA 3.49Å; I359-L367 HydrophobicContact CB-CB 4.19Å; I359-L367 PolarHBondContact N-O 3.43Å; I359-L367 PolarHBondContact O-N 3.29Å; I359-A369 HydrophobicContact CD1-CB 3.86Å; I359-A369 HydrophobicContact CG1-CB 3.96Å
360	K	82.3	Confident	87.7	Confident	79 Å²	79	26.8 Å²	26.8	34%	0.343	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121.7	173.6	-66.8	-174.4	177.3	-175	0	109.8	L211 E212 I358	L211-K360 PolarHBondContact O-N 3.42Å; E212-K360 WeakPolarHBondContact CA-O 3.41Å; I358-K360 HydrophobicContact CG2-CG 4.46Å
361	T	73.9	Confident	87.6	Confident	15 Å²	15	29.2 Å²	29.2	9%	0.092	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	159.7	175.9	71.4	0	0	0	0	110.7	T363 G364 V365 L367	T361-T363 PolarHBondContact O-N 3.26Å; T361-T363 PolarHBondContact OG1-N 3.13Å; T361-T363 PolarHBondContact OG1-OG1 2.98Å; T361-G364 PolarHBondContact O-N 2.84Å; T361-G364 PolarHBondContact OG1-N 3.38Å; T361-V365 HydrophobicContact CG2-CB 4.24Å; T361-V365 PolarHBondContact N-O 2.74Å; T361-V365 WeakPolarHBondContact OG1-CB 3.28Å; T361-V365 PolarHBondContact OG1-N 3.01Å; T361-V365 PolarHBondContact OG1-O 3.02Å; T361-L367 HydrophobicContact CG2-CD1 3.62Å; T361-L367 HydrophobicContact CG2-CG 4.06Å
362	S	71.2	Confident	87.3	Confident	84 Å²	84	32.5 Å²	32.5	59%	0.587	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.5	171.1	62.2	0	0	0	0	113.5	G364	S362-G364 VanDerWaalsContact C-N 3.28Å
363	T	74.4	Confident	86.8	Confident	82 Å²	82	33.8 Å²	33.8	50%	0.503	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-0.7	176.1	54.2	0	0	0	0	113.2	Y325 T361	Y325-T363 PolarHBondContact OH-OG1 2.93Å; T361-T363 PolarHBondContact O-N 3.26Å; T361-T363 PolarHBondContact OG1-N 3.13Å; T361-T363 PolarHBondContact OG1-OG1 2.98Å
364	G	81.8	Confident	86	Confident	58 Å²	58	36.7 Å²	36.7	60%	0.598	22%	0.217	S	C	*	.	S	Bend	trans	82	14.5	-178.9	0	0	0	0	0	114.4	C332 T361 S362	C332-G364 PolarHBondContact SG-O 2.84Å; T361-G364 PolarHBondContact O-N 2.84Å; T361-G364 PolarHBondContact OG1-N 3.38Å; S362-G364 VanDerWaalsContact C-N 3.28Å
365	V	85.5	Confident	85.1	Confident	31 Å²	31	42.4 Å²	42.4	19%	0.188	25%	0.254	C	S	.	.			trans	-91.2	146.4	175.2	172.6	0	0	0	0	109.9	Y325 M329 C332 T361 L367	Y325-V365 HydrophobicContact CE2-CG1 4.36Å; M329-V365 HydrophobicContact CE-CB 4.38Å; M329-V365 HydrophobicContact CE-CG1 3.28Å; M329-V365 HydrophobicContact CE-CG2 4.19Å; M329-V365 HydrophobicContact CG-CG1 3.96Å; M329-V365 HydrophobicContact SD-CG1 3.9Å; C332-V365 VanDerWaalsContact SG-C 3.53Å; T361-V365 HydrophobicContact CG2-CB 4.24Å; T361-V365 PolarHBondContact N-O 2.74Å; T361-V365 WeakPolarHBondContact OG1-CB 3.28Å; T361-V365 PolarHBondContact OG1-N 3.01Å; T361-V365 PolarHBondContact OG1-O 3.02Å; V365-L367 HydrophobicContact CG1-CD2 4.12Å; V365-L367 HydrophobicContact CG1-CG 4.4Å
366	C	90.3	Very high	84.6	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.1	174.7	-67.2	0	0	0	0	110.3	M329 V330 C332 I358 I359	M329-C366 WeakPolarHBondContact CA-O 3.47Å; V330-C366 HydrophobicContact CG2-CB 3.92Å; V330-C366 PolarHBondContact N-O 2.83Å; C332-C366 WeakPolarHBondContact CA-SG 3.19Å; C332-C366 HydrophobicContact CB-CB 4.09Å; C332-C366 WeakPolarHBondContact CB-SG 3.32Å; C332-C366 WeakPolarHBondContact SG-CB 3.34Å; C332-C366 PolarHBondContact SG-N 2.99Å; C332-C366 CovalentContact SG-SG 2.04Å; C332-C366 PolarHBondContact SG-SG 3.39Å; I358-C366 HydrophobicContact CG2-CB 4.05Å; I359-C366 CarbonylContact O-C 3.59Å; I359-C366 WeakPolarHBondContact O-CA 3.49Å
367	L	90.2	Very high	83.9	Confident	0 Å²	0	46 Å²	46	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.9	179.1	-55	166.8	0	0	0	109.7	M213 Y325 M327 Y328 M329 I359 T361 V365	M213-L367 HydrophobicContact CE-CD1 3.94Å; M213-L367 HydrophobicContact SD-CD1 3.92Å; Y325-L367 HydrophobicContact CD1-CD1 4.49Å; Y325-L367 HydrophobicContact CD2-CD2 4.26Å; Y325-L367 HydrophobicContact CG-CD2 4.16Å; M327-L367 HydrophobicContact CB-CD2 4.25Å; M327-L367 HydrophobicContact CE-CB 4.33Å; M327-L367 HydrophobicContact SD-CD1 4.08Å; Y328-L367 CarbonylContact O-C 3.57Å; Y328-L367 WeakPolarHBondContact O-CA 3.37Å; M329-L367 HydrophobicContact CG-CD2 3.4Å; M329-L367 HydrophobicContact SD-CD2 4.41Å; I359-L367 HydrophobicContact CB-CB 4.19Å; I359-L367 PolarHBondContact N-O 3.43Å; I359-L367 PolarHBondContact O-N 3.29Å; T361-L367 HydrophobicContact CG2-CD1 3.62Å; T361-L367 HydrophobicContact CG2-CG 4.06Å; V365-L367 HydrophobicContact CG1-CD2 4.12Å; V365-L367 HydrophobicContact CG1-CG 4.4Å
368	L	92.7	Very high	83.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.5	168.6	-63.4	-169.8	0	0	0	110.1	A314 L317 A319 M327 Y328 V330 Y357 I358 F370	A314-L368 HydrophobicContact CB-CD1 4.34Å; L317-L368 HydrophobicContact CB-CD1 4.42Å; L317-L368 HydrophobicContact CD1-CD1 3.84Å; L317-L368 HydrophobicContact CD1-CD2 4Å; A319-L368 HydrophobicContact CB-CD1 3.57Å; A319-L368 HydrophobicContact CB-CG 4.19Å; M327-L368 VanDerWaalsContact CE-O 3.32Å; M327-L368 WeakPolarHBondContact CE-O 3.22Å; Y328-L368 PolarHBondContact O-N 3.32Å; V330-L368 HydrophobicContact CG1-CD1 4.42Å; V330-L368 HydrophobicContact CG1-CD2 3.68Å; V330-L368 HydrophobicContact CG1-CG 4.03Å; V330-L368 HydrophobicContact CG2-CD2 4.14Å; Y357-L368 HydrophobicContact CD2-CD2 4.21Å; Y357-L368 HydrophobicContact CE2-CD2 4.31Å; I358-L368 HydrophobicContact CD1-CD2 3.48Å; I358-L368 VanDerWaalsContact CD1-CD2 3.48Å; L368-F370 HydrophobicContact CB-CD2 4.25Å; L368-F370 PolarHBondContact O-N 3.21Å
369	A	91.8	Very high	83.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-77.3	33.6	172.8	0	0	0	0	0	113	L211 L302 I303 Y357 I359 P386	L211-A369 HydrophobicContact CD1-CB 3.98Å; L302-A369 HydrophobicContact CD2-CB 4.11Å; I303-A369 PolarHBondContact N-O 3.35Å; Y357-A369 WeakPolarHBondContact O-CB 3.37Å; Y357-A369 PolarHBondContact O-N 2.77Å; I359-A369 HydrophobicContact CD1-CB 3.86Å; I359-A369 HydrophobicContact CG1-CB 3.96Å; A369-P386 HydrophobicContact CB-CG 3.38Å
370	F	93.1	Very high	83.5	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.3	-177.9	-67.4	-74.8	0	0	0	110.1	I303 I310 I313 V341 I352 Y357 L368	I303-F370 HydrophobicContact CB-CD1 3.69Å; I303-F370 HydrophobicContact CB-CE1 3.8Å; I303-F370 HydrophobicContact CD1-CD1 4.46Å; I303-F370 HydrophobicContact CD1-CE1 3.69Å; I303-F370 HydrophobicContact CD1-CZ 4.29Å; I303-F370 HydrophobicContact CG1-CE1 4.3Å; I303-F370 HydrophobicContact CG2-CD1 3.86Å; I303-F370 HydrophobicContact CG2-CE1 3.92Å; I303-F370 WeakPolarHBondContact O-CA 3.34Å; I310-F370 HydrophobicContact CD1-CB 4.07Å; I310-F370 HydrophobicContact CD1-CD1 4.25Å; I310-F370 HydrophobicContact CG2-CB 4.46Å; I313-F370 HydrophobicContact CG2-CD2 4.26Å; I313-F370 HydrophobicContact CG2-CE2 4.41Å; V341-F370 HydrophobicContact CB-CE2 4.25Å; V341-F370 HydrophobicContact CB-CZ 3.77Å; V341-F370 HydrophobicContact CG1-CE1 4.06Å; V341-F370 HydrophobicContact CG1-CE2 4.39Å; V341-F370 HydrophobicContact CG1-CZ 3.69Å; V341-F370 HydrophobicContact CG2-CE2 3.7Å; V341-F370 HydrophobicContact CG2-CZ 3.75Å; I352-F370 HydrophobicContact CD1-CE1 4.5Å; I352-F370 HydrophobicContact CD1-CZ 4.43Å; Y357-F370 VanDerWaalsContact CB-CE2 3.4Å; Y357-F370 HydrophobicContact CD1-CE2 4.07Å; Y357-F370 HydrophobicContact CD1-CZ 4.32Å; Y357-F370 HydrophobicContact CD2-CD2 4.49Å; Y357-F370 AromaticContact CD2-CE2 3.8Å; Y357-F370 HydrophobicContact CD2-CE2 3.8Å; Y357-F370 HydrophobicContact CG-CD2 4.5Å; Y357-F370 AromaticContact CG-CE2 3.5Å; Y357-F370 HydrophobicContact CG-CE2 3.5Å; Y357-F370 HydrophobicContact CG-CZ 4.1Å; L368-F370 HydrophobicContact CB-CD2 4.25Å; L368-F370 PolarHBondContact O-N 3.21Å
371	Q	88.9	Confident	84	Confident	69 Å²	69	49.5 Å²	49.5	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.7	179.7	-172.3	174.9	-13.7	0	0	111.6	L302 I303 H304 G305	L302-Q371 HydrophobicContact CD1-CB 4.08Å; I303-Q371 PolarHBondContact O-N 3.07Å; H304-Q371 WeakPolarHBondContact CA-O 3.37Å; G305-Q371 PolarHBondContact N-O 3.03Å; G305-Q371 VanDerWaalsContact N-O 3.09Å
372	K	88.7	Confident	84.9	Confident	113 Å²	113	49.6 Å²	49.6	49%	0.491	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	138	172	67	-179.7	-175.9	177.3	0	110.2	G305	G305-K372 WeakPolarHBondContact O-CA 3.12Å
373	M	83.4	Confident	86	Confident	27 Å²	27	45.6 Å²	45.6	13%	0.133	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-100.6	154.1	164.9	67.1	171	75.5	0	0	111.4	H304 G305 T376 F379 D380 V382	H304-M373 HydrophobicContact CB-CB 4.18Å; H304-M373 HydrophobicContact CB-CE 3.31Å; H304-M373 WeakPolarHBondContact O-CE 3.38Å; G305-M373 PolarHBondContact O-N 3.27Å; M373-T376 HydrophobicContact SD-CG2 4.13Å; M373-F379 HydrophobicContact SD-CD2 4.42Å; M373-D380 VanDerWaalsContact CE-O 3.25Å; M373-D380 WeakPolarHBondContact CE-O 3.37Å; M373-D380 VanDerWaalsContact SD-C 3.5Å; M373-V382 HydrophobicContact CE-CB 4.03Å; M373-V382 HydrophobicContact CE-CG2 3.63Å
374	A	78	Confident	86.8	Confident	77 Å²	77	41.7 Å²	41.7	64%	0.636	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-66.8	147.6	164.2	0	0	0	0	0	109.4	T376	A374-T376 WeakPolarHBondContact O-CG2 3.33Å; A374-T376 PolarHBondContact O-N 2.97Å
375	P	73.8	Confident	87	Confident	128 Å²	128	38.9 Å²	38.9	83%	0.831	22%	0.223	S	C	*	.	P	Polyproline II helix	trans	-53.9	128.4	175.9	-23.8	33.2	0	0	0	110.8
376	T	77.7	Confident	87.3	Confident	47 Å²	47	37.4 Å²	37.4	29%	0.288	21%	0.214	S	C	.	.			trans	-111	153.3	173.4	92.7	0	0	0	0	109.8	M373 A374 K378 F379	M373-T376 HydrophobicContact SD-CG2 4.13Å; A374-T376 WeakPolarHBondContact O-CG2 3.33Å; A374-T376 PolarHBondContact O-N 2.97Å; T376-K378 PolarHBondContact O-N 3.43Å; T376-K378 PolarHBondContact OG1-N 3.18Å; T376-F379 HydrophobicContact CG2-CE2 4.34Å; T376-F379 PolarHBondContact OG1-N 2.94Å; T376-F379 PolarHBondContact OG1-O 2.96Å
377	P	76.1	Confident	87.5	Confident	138 Å²	138	37.4 Å²	37.4	90%	0.896	21%	0.213	S	C	*	.	S	Bend	trans	-65.8	-18.8	178.4	-21.1	32.6	0	0	0	114.3
378	K	81.8	Confident	87.5	Confident	86 Å²	86	37.5 Å²	37.5	37%	0.374	21%	0.214	S	C	.	.	S	Bend	trans	-110.8	-42	-168.1	-62.5	-165.6	-177	-178.9	0	113.1	Y264 R266 N293 T376	Y264-K378 HydrophobicContact CD2-CD 4.07Å; Y264-K378 HydrophobicContact CE2-CD 3.32Å; Y264-K378 VanDerWaalsContact CE2-NZ 3.33Å; Y264-K378 PolarHBondContact OH-NZ 3.17Å; Y264-K378 VanDerWaalsContact OH-NZ 3.08Å; R266-K378 WeakPolarHBondContact CD-O 3.3Å; N293-K378 VanDerWaalsContact CB-O 3.26Å; N293-K378 WeakPolarHBondContact CB-O 3.47Å; N293-K378 PolarHBondContact ND2-O 3.13Å; T376-K378 PolarHBondContact O-N 3.43Å; T376-K378 PolarHBondContact OG1-N 3.18Å
379	F	87.7	Confident	87.3	Confident	37 Å²	37	37.5 Å²	37.5	16%	0.162	21%	0.214	C	C	.	.			trans	-147.3	152.3	-176.5	52.1	-97.8	0	0	0	112.8	N293 I295 M373 T376 V382	N293-F379 HydrophobicContact CB-CB 4.15Å; I295-F379 HydrophobicContact CD1-CD1 4.02Å; I295-F379 HydrophobicContact CD1-CD2 4.21Å; I295-F379 HydrophobicContact CD1-CE1 3.74Å; I295-F379 HydrophobicContact CD1-CE2 3.95Å; I295-F379 HydrophobicContact CD1-CG 4.25Å; I295-F379 HydrophobicContact CD1-CZ 3.7Å; I295-F379 HydrophobicContact CG1-CD1 4.34Å; I295-F379 HydrophobicContact CG1-CD2 4.17Å; I295-F379 HydrophobicContact CG1-CE2 4.36Å; I295-F379 HydrophobicContact CG1-CG 4.17Å; I295-F379 HydrophobicContact CG2-CB 4.21Å; I295-F379 HydrophobicContact CG2-CD1 3.95Å; I295-F379 HydrophobicContact CG2-CG 4.12Å; M373-F379 HydrophobicContact SD-CD2 4.42Å; T376-F379 HydrophobicContact CG2-CE2 4.34Å; T376-F379 PolarHBondContact OG1-N 2.94Å; T376-F379 PolarHBondContact OG1-O 2.96Å; F379-V382 HydrophobicContact CD2-CG2 3.71Å; F379-V382 HydrophobicContact CE2-CG2 3.4Å; F379-V382 HydrophobicContact CZ-CG2 4.36Å
380	D	90.8	Very high	87.3	Confident	44 Å²	44	37.8 Å²	37.8	24%	0.235	22%	0.215	C	C	.	.	S	Bend	trans	-109	-21.1	-178.1	-48.4	-81.5	0	0	0	112	F292 N293 G305 P306 M373	F292-D380 HydrophobicContact CB-CB 3.98Å; F292-D380 HydrophobicContact CD1-CB 3.84Å; F292-D380 HydrophobicContact CG-CB 4.31Å; N293-D380 PolarHBondContact N-OD2 2.61Å; N293-D380 PolarHBondContact O-N 2.72Å; G305-D380 CarbonylContact C-O 3.55Å; G305-D380 WeakPolarHBondContact CA-O 3.37Å; P306-D380 WeakPolarHBondContact CD-O 3.41Å; P306-D380 HydrophobicContact CG-CB 4.14Å; M373-D380 VanDerWaalsContact CE-O 3.25Å; M373-D380 WeakPolarHBondContact CE-O 3.37Å; M373-D380 VanDerWaalsContact SD-C 3.5Å
381	W	93	Very high	87.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.1	177.8	-71.3	92.8	0	0	0	111.8	N293 A294 I295 I303 H304 G305 P306 D309 I310 I313 L343 L383	N293-W381 PolarHBondContact O-N 3.39Å; A294-W381 WeakPolarHBondContact CA-O 3.49Å; A294-W381 HydrophobicContact CB-CB 3.68Å; I295-W381 PolarHBondContact N-O 2.99Å; I303-W381 HydrophobicContact CG2-CE3 3.92Å; I303-W381 HydrophobicContact CG2-CZ3 3.83Å; H304-W381 CarbonylContact O-C 3.53Å; H304-W381 VanDerWaalsContact O-CA 3.29Å; H304-W381 WeakPolarHBondContact O-CA 3.28Å; H304-W381 VanDerWaalsContact O-CE3 3.3Å; G305-W381 VanDerWaalsContact CA-CE3 3.47Å; P306-W381 VanDerWaalsContact CD-CZ2 3.5Å; P306-W381 VanDerWaalsContact CD-NE1 3.32Å; P306-W381 HydrophobicContact CG-CZ2 4.34Å; D309-W381 HydrophobicContact CB-CH2 3.96Å; D309-W381 HydrophobicContact CB-CZ2 3.69Å; D309-W381 WeakPolarHBondContact OD2-CZ2 3.28Å; I310-W381 HydrophobicContact CD1-CH2 4.31Å; I310-W381 HydrophobicContact CD1-CZ3 4.04Å; I313-W381 HydrophobicContact CD1-CH2 4.32Å; L343-W381 HydrophobicContact CD2-CH2 4.15Å; L343-W381 HydrophobicContact CD2-CZ3 4.23Å; W381-L383 HydrophobicContact CB-CD2 4.32Å; W381-L383 HydrophobicContact CE3-CD2 4.27Å
382	V	92.3	Very high	87.2	Confident	17 Å²	17	34.9 Å²	34.9	10%	0.103	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	110.4	166.6	177.6	0	0	0	0	106.7	I295 I303 H304 M373 F379 G384	I295-V382 HydrophobicContact CD1-CG2 4.02Å; I295-V382 HydrophobicContact CG1-CB 4.36Å; I295-V382 HydrophobicContact CG1-CG1 4.37Å; I295-V382 HydrophobicContact CG1-CG2 3.84Å; I295-V382 WeakPolarHBondContact O-CA 3.42Å; I303-V382 WeakPolarHBondContact CA-O 3.3Å; H304-V382 HydrophobicContact CB-CB 4.16Å; H304-V382 PolarHBondContact N-O 2.8Å; H304-V382 PolarHBondContact O-N 3.45Å; M373-V382 HydrophobicContact CE-CB 4.03Å; M373-V382 HydrophobicContact CE-CG2 3.63Å; F379-V382 HydrophobicContact CD2-CG2 3.71Å; F379-V382 HydrophobicContact CE2-CG2 3.4Å; F379-V382 HydrophobicContact CZ-CG2 4.36Å; V382-G384 PolarHBondContact O-N 3.4Å
383	L	94.1	Very high	87.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	108.2	178.9	-50.3	-169	0	0	0	108.7	F267 I295 V296 S297 I303 L343 W381 W387	F267-L383 HydrophobicContact CE2-CD1 4.37Å; F267-L383 HydrophobicContact CZ-CD1 3.7Å; F267-L383 HydrophobicContact CZ-CG 4.39Å; I295-L383 PolarHBondContact O-N 3.33Å; V296-L383 WeakPolarHBondContact CA-O 3.22Å; V296-L383 WeakPolarHBondContact CG1-O 3.25Å; V296-L383 HydrophobicContact CG2-CB 4.3Å; S297-L383 PolarHBondContact N-O 3.01Å; I303-L383 HydrophobicContact CG2-CD2 4.03Å; L343-L383 HydrophobicContact CD1-CD1 4Å; L343-L383 HydrophobicContact CD1-CD2 3.51Å; L343-L383 HydrophobicContact CD1-CG 4.44Å; W381-L383 HydrophobicContact CB-CD2 4.32Å; W381-L383 HydrophobicContact CE3-CD2 4.27Å; L383-W387 HydrophobicContact CB-CB 3.9Å; L383-W387 HydrophobicContact CB-CD2 4.3Å; L383-W387 HydrophobicContact CB-CG 3.76Å; L383-W387 HydrophobicContact CD1-CD2 3.58Å; L383-W387 HydrophobicContact CD1-CE3 4.03Å; L383-W387 HydrophobicContact CD1-CG 3.91Å; L383-W387 HydrophobicContact CD1-CH2 4.37Å; L383-W387 HydrophobicContact CD1-CZ2 3.96Å; L383-W387 HydrophobicContact CD1-CZ3 4.42Å; L383-W387 HydrophobicContact CG-CD2 4.48Å; L383-W387 HydrophobicContact CG-CG 4.43Å
384	G	90.8	Very high	87.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.174	C	C	.	.			trans	-99.1	-150.5	-178.8	0	0	0	0	0	114.1	S300 L302 V382 W387 L388	S300-G384 CarbonylContact O-C 3.56Å; S300-G384 WeakPolarHBondContact O-CA 3.34Å; L302-G384 WeakPolarHBondContact O-CA 3.5Å; L302-G384 PolarHBondContact O-N 3.27Å; V382-G384 PolarHBondContact O-N 3.4Å; G384-W387 WeakPolarHBondContact O-CA 3.36Å; G384-W387 WeakPolarHBondContact O-CB 3.36Å; G384-W387 PolarHBondContact O-N 2.83Å; G384-L388 PolarHBondContact O-N 2.96Å; G384-L388 VanDerWaalsContact O-N 3.15Å
385	E	87.1	Confident	87.8	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-44.7	-49.5	-175.1	-80.6	-62.2	140.6	0	0	116	K206 L211 S300 L301 W387 L388 Q389	K206-E385 VanDerWaalsContact CD-OE1 3.29Å; K206-E385 WeakPolarHBondContact CD-OE1 3.3Å; K206-E385 WeakPolarHBondContact CD-OE2 3.46Å; K206-E385 WeakPolarHBondContact CE-OE1 3.39Å; K206-E385 WeakPolarHBondContact CE-OE2 3.34Å; K206-E385 IonicContact NZ-OE1 3.38Å; K206-E385 PolarHBondContact NZ-OE1 3Å; K206-E385 IonicContact NZ-OE2 3.73Å; K206-E385 PolarHBondContact NZ-OE2 2.84Å; L211-E385 HydrophobicContact CD2-CB 4.34Å; S300-E385 PolarHBondContact O-N 2.77Å; L301-E385 HydrophobicContact CD2-CG 4.39Å; E385-W387 PolarHBondContact O-N 2.88Å; E385-W387 VanDerWaalsContact O-N 3.08Å; E385-L388 PolarHBondContact O-N 3.33Å; E385-L388 VanDerWaalsContact O-N 3.09Å; E385-Q389 WeakPolarHBondContact O-CG 3.48Å; E385-Q389 PolarHBondContact O-N 3.49Å; E385-Q389 PolarHBondContact OE2-NE2 3.44Å; E385-Q389 VanDerWaalsContact OE2-NE2 3.14Å
386	P	91.8	Very high	88	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-56.9	-32.3	-180	-25	33.3	0	0	0	113.2	L211 I303 I352 N356 A369 Q390	L211-P386 HydrophobicContact CD1-CG 4.29Å; I303-P386 HydrophobicContact CD1-CB 3.84Å; I303-P386 HydrophobicContact CD1-CG 4.29Å; I303-P386 HydrophobicContact CG1-CB 4.22Å; I303-P386 HydrophobicContact CG1-CG 4.15Å; I352-P386 HydrophobicContact CG2-CB 4.2Å; N356-P386 HydrophobicContact CB-CB 4.49Å; N356-P386 WeakPolarHBondContact O-CA 3.5Å; N356-P386 VanDerWaalsContact O-CB 3.28Å; N356-P386 WeakPolarHBondContact O-CB 3.17Å; A369-P386 HydrophobicContact CB-CG 3.38Å; P386-Q390 WeakPolarHBondContact O-CB 3.43Å; P386-Q390 PolarHBondContact O-N 3.33Å
387	W	94	Very high	87.5	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-79.2	-43	178.2	-175.5	-87	0	0	0	111.7	I303 L343 I345 L350 I352 L383 G384 E385 Q389 Q390 Y391 H393 F404	I303-W387 HydrophobicContact CD1-CB 4.13Å; L343-W387 HydrophobicContact CB-CH2 4.3Å; L343-W387 HydrophobicContact CB-CZ3 3.88Å; L343-W387 HydrophobicContact CD1-CE3 3.77Å; L343-W387 HydrophobicContact CD1-CH2 4.31Å; L343-W387 HydrophobicContact CD1-CZ3 3.56Å; L343-W387 HydrophobicContact CG-CE3 4.44Å; L343-W387 HydrophobicContact CG-CZ3 3.91Å; I345-W387 HydrophobicContact CD1-CH2 3.44Å; I345-W387 VanDerWaalsContact CD1-CH2 3.44Å; I345-W387 HydrophobicContact CD1-CZ2 3.59Å; I345-W387 HydrophobicContact CD1-CZ3 4.49Å; L350-W387 HydrophobicContact CB-CH2 3.83Å; L350-W387 HydrophobicContact CB-CZ3 4.28Å; L350-W387 HydrophobicContact CD1-CH2 3.71Å; L350-W387 HydrophobicContact CD1-CZ2 4.1Å; L350-W387 HydrophobicContact CG-CH2 4.46Å; I352-W387 HydrophobicContact CD1-CE3 3.69Å; I352-W387 HydrophobicContact CD1-CZ3 4.15Å; I352-W387 HydrophobicContact CG1-CE3 3.83Å; I352-W387 HydrophobicContact CG1-CZ3 4.09Å; L383-W387 HydrophobicContact CB-CB 3.9Å; L383-W387 HydrophobicContact CB-CD2 4.3Å; L383-W387 HydrophobicContact CB-CG 3.76Å; L383-W387 HydrophobicContact CD1-CD2 3.58Å; L383-W387 HydrophobicContact CD1-CE3 4.03Å; L383-W387 HydrophobicContact CD1-CG 3.91Å; L383-W387 HydrophobicContact CD1-CH2 4.37Å; L383-W387 HydrophobicContact CD1-CZ2 3.96Å; L383-W387 HydrophobicContact CD1-CZ3 4.42Å; L383-W387 HydrophobicContact CG-CD2 4.48Å; L383-W387 HydrophobicContact CG-CG 4.43Å; G384-W387 WeakPolarHBondContact O-CA 3.36Å; G384-W387 WeakPolarHBondContact O-CB 3.36Å; G384-W387 PolarHBondContact O-N 2.83Å; E385-W387 PolarHBondContact O-N 2.88Å; E385-W387 VanDerWaalsContact O-N 3.08Å; W387-Q389 VanDerWaalsContact C-N 3.28Å; W387-Q389 PolarHBondContact O-N 3.09Å; W387-Q390 PolarHBondContact O-N 3.17Å; W387-Q390 VanDerWaalsContact O-N 3.1Å; W387-Y391 AromaticContact CD2-CD2 3.85Å; W387-Y391 HydrophobicContact CD2-CD2 3.85Å; W387-Y391 HydrophobicContact CD2-CE2 4.32Å; W387-Y391 AromaticContact CE2-CD2 3.74Å; W387-Y391 HydrophobicContact CE3-CD2 4.03Å; W387-Y391 HydrophobicContact CE3-CE2 4.02Å; W387-Y391 HydrophobicContact CG-CD2 4.45Å; W387-Y391 HydrophobicContact CH2-CD2 4.05Å; W387-Y391 AromaticContact CH2-CE2 3.85Å; W387-Y391 HydrophobicContact CH2-CE2 3.85Å; W387-Y391 AromaticContact CZ2-CD2 3.87Å; W387-Y391 HydrophobicContact CZ2-CD2 3.87Å; W387-Y391 HydrophobicContact CZ2-CE2 4.15Å; W387-Y391 HydrophobicContact CZ3-CD2 4.11Å; W387-Y391 AromaticContact CZ3-CE2 3.76Å; W387-Y391 HydrophobicContact CZ3-CE2 3.76Å; W387-Y391 PolarHBondContact O-N 2.96Å; W387-H393 AromaticContact CD1-CE1 3.06Å; W387-H393 AromaticContact CD1-NE2 3.18Å; W387-H393 AromaticContact NE1-CE1 3.11Å; W387-H393 PolarHBondContact NE1-CE1 3.28Å; W387-H393 AromaticContact NE1-NE2 3.54Å; W387-F404 HydrophobicContact CZ2-CB 4.42Å; W387-F404 HydrophobicContact CZ2-CD1 4.1Å; W387-F404 HydrophobicContact CZ2-CD2 4.2Å; W387-F404 HydrophobicContact CZ2-CE1 4.47Å; W387-F404 AromaticContact CZ2-CG 3.96Å; W387-F404 HydrophobicContact CZ2-CG 3.96Å; W387-F404 AromaticContact NE1-CD1 3.57Å; W387-F404 AromaticContact NE1-CE1 3.78Å
388	L	89.7	Confident	86.7	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-64.1	-28.3	177.2	-74.9	153.9	0	0	0	113.8	I204 K206 V296 S297 G384 E385 Y391 H393	I204-L388 HydrophobicContact CG2-CD2 4.12Å; K206-L388 HydrophobicContact CD-CB 4.13Å; K206-L388 HydrophobicContact CG-CB 4.24Å; V296-L388 HydrophobicContact CG1-CD2 4.02Å; V296-L388 HydrophobicContact CG1-CG 4.18Å; S297-L388 WeakPolarHBondContact O-CD1 3.5Å; G384-L388 PolarHBondContact O-N 2.96Å; G384-L388 VanDerWaalsContact O-N 3.15Å; E385-L388 PolarHBondContact O-N 3.33Å; E385-L388 VanDerWaalsContact O-N 3.09Å; L388-Y391 VanDerWaalsContact O-O 3.08Å; L388-H393 WeakPolarHBondContact CD2-CD2 3.38Å
389	Q	88.7	Confident	84.9	Confident	1 Å²	1	12 Å²	12	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-81.6	-24.8	174.2	-67.6	-178.2	42.9	0	0	112.8	K206 Q209 E385 W387	K206-Q389 HydrophobicContact CB-CG 4.22Å; Q209-Q389 PolarHBondContact O-OE1 2.87Å; Q209-Q389 VanDerWaalsContact O-OE1 3.08Å; E385-Q389 WeakPolarHBondContact O-CG 3.48Å; E385-Q389 PolarHBondContact O-N 3.49Å; E385-Q389 PolarHBondContact OE2-NE2 3.44Å; E385-Q389 VanDerWaalsContact OE2-NE2 3.14Å; W387-Q389 VanDerWaalsContact C-N 3.28Å; W387-Q389 PolarHBondContact O-N 3.09Å
390	Q	91.7	Very high	83.1	Confident	5 Å²	5	14.7 Å²	14.7	2%	0.023	8%	0.082	C	C	.	.	H	α-helix	trans	-82.5	-39.5	177.7	-176.2	66.6	3.5	0	0	111.6	P351 S353 N356 P386 W387 A407	P351-Q390 WeakPolarHBondContact O-CG 3.29Å; P351-Q390 PolarHBondContact O-NE2 2.8Å; S353-Q390 PolarHBondContact OG-OE1 2.51Å; N356-Q390 PolarHBondContact ND2-OE1 2.95Å; P386-Q390 WeakPolarHBondContact O-CB 3.43Å; P386-Q390 PolarHBondContact O-N 3.33Å; W387-Q390 PolarHBondContact O-N 3.17Å; W387-Q390 VanDerWaalsContact O-N 3.1Å; Q390-A407 PolarHBondContact O-N 3.02Å
391	Y	92.2	Very high	80.7	Confident	10 Å²	10	15.6 Å²	15.6	4%	0.039	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.9	-172.3	-60.9	-74.6	0	0	0	112.1	L350 P351 W387 L388 H393 F404 I405 Q406	L350-Y391 VanDerWaalsContact C-OH 3.28Å; L350-Y391 WeakPolarHBondContact CA-OH 3.36Å; L350-Y391 HydrophobicContact CB-CE2 4.27Å; L350-Y391 WeakPolarHBondContact CB-OH 3.49Å; L350-Y391 HydrophobicContact CD2-CE1 4.16Å; P351-Y391 VanDerWaalsContact CD-OH 3.29Å; P351-Y391 WeakPolarHBondContact CD-OH 3.38Å; P351-Y391 VanDerWaalsContact N-OH 3.13Å; P351-Y391 PolarHBondContact O-OH 2.84Å; W387-Y391 AromaticContact CD2-CD2 3.85Å; W387-Y391 HydrophobicContact CD2-CD2 3.85Å; W387-Y391 HydrophobicContact CD2-CE2 4.32Å; W387-Y391 AromaticContact CE2-CD2 3.74Å; W387-Y391 HydrophobicContact CE3-CD2 4.03Å; W387-Y391 HydrophobicContact CE3-CE2 4.02Å; W387-Y391 HydrophobicContact CG-CD2 4.45Å; W387-Y391 HydrophobicContact CH2-CD2 4.05Å; W387-Y391 AromaticContact CH2-CE2 3.85Å; W387-Y391 HydrophobicContact CH2-CE2 3.85Å; W387-Y391 AromaticContact CZ2-CD2 3.87Å; W387-Y391 HydrophobicContact CZ2-CD2 3.87Å; W387-Y391 HydrophobicContact CZ2-CE2 4.15Å; W387-Y391 HydrophobicContact CZ3-CD2 4.11Å; W387-Y391 AromaticContact CZ3-CE2 3.76Å; W387-Y391 HydrophobicContact CZ3-CE2 3.76Å; W387-Y391 PolarHBondContact O-N 2.96Å; L388-Y391 VanDerWaalsContact O-O 3.08Å; Y391-H393 PolarHBondContact O-CD2 2.97Å; Y391-H393 PolarHBondContact O-NE2 2.62Å; Y391-F404 HydrophobicContact CG-CB 4.45Å; Y391-I405 CarbonylContact C-O 3.56Å; Y391-I405 WeakPolarHBondContact CA-O 3.47Å; Y391-Q406 HydrophobicContact CD1-CB 4.49Å; Y391-Q406 HydrophobicContact CE1-CB 4.41Å
392	C	88.9	Confident	78.1	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	148.1	160.2	-68.3	0	0	0	0	110.7	C251 I405	C251-C392 WeakPolarHBondContact CA-SG 3.49Å; C251-C392 HydrophobicContact CB-CB 3.64Å; C251-C392 WeakPolarHBondContact CB-SG 2.99Å; C251-C392 WeakPolarHBondContact SG-CB 3.23Å; C251-C392 CovalentContact SG-SG 2.02Å; C251-C392 PolarHBondContact SG-SG 2.93Å; C392-I405 HydrophobicContact CB-CB 4.23Å; C392-I405 PolarHBondContact N-O 3.14Å; C392-I405 PolarHBondContact O-N 2.86Å
393	H	88.5	Confident	75.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117	-177.3	-72.4	-93.1	0	0	0	110.5	T203 I204 V296 W387 L388 Y391 Q395 F404	T203-H393 CarbonylContact C-O 3.52Å; T203-H393 WeakPolarHBondContact CA-O 3.45Å; I204-H393 HydrophobicContact CB-CB 4.35Å; I204-H393 PolarHBondContact N-O 3.18Å; I204-H393 PolarHBondContact O-N 2.75Å; V296-H393 WeakPolarHBondContact CG1-CE1 3.47Å; W387-H393 AromaticContact CD1-CE1 3.06Å; W387-H393 AromaticContact CD1-NE2 3.18Å; W387-H393 AromaticContact NE1-CE1 3.11Å; W387-H393 PolarHBondContact NE1-CE1 3.28Å; W387-H393 AromaticContact NE1-NE2 3.54Å; L388-H393 WeakPolarHBondContact CD2-CD2 3.38Å; Y391-H393 PolarHBondContact O-CD2 2.97Å; Y391-H393 PolarHBondContact O-NE2 2.62Å; H393-Q395 PolarHBondContact O-OE1 2.63Å; H393-F404 AromaticContact CE1-CD1 3.75Å; H393-F404 AromaticContact CE1-CE1 3.78Å; H393-F404 AromaticContact ND1-CD1 3.72Å; H393-F404 AromaticContact ND1-CE1 3.66Å
394	I	88	Confident	73.8	Confident	8 Å²	8	15.1 Å²	15.1	4%	0.041	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.1	171.9	-48.5	-177.6	0	0	0	108.1	I201 F202 T203 Q246 Q402 S403 I405	I201-I394 HydrophobicContact CB-CG2 4.23Å; I201-I394 HydrophobicContact CD1-CG2 4.03Å; F202-I394 WeakPolarHBondContact O-CA 3.32Å; T203-I394 HydrophobicContact CG2-CG1 3.98Å; Q246-I394 HydrophobicContact CB-CD1 4.05Å; Q246-I394 VanDerWaalsContact CD-CD1 3.45Å; Q246-I394 HydrophobicContact CG-CD1 3.55Å; I394-Q402 WeakPolarHBondContact O-CA 3.37Å; I394-S403 PolarHBondContact N-O 3.11Å; I394-S403 VanDerWaalsContact N-O 3.11Å; I394-S403 PolarHBondContact O-N 2.71Å; I394-I405 HydrophobicContact CD1-CD1 3.45Å; I394-I405 VanDerWaalsContact CD1-CD1 3.45Å; I394-I405 HydrophobicContact CG1-CD1 4.04Å
395	Q	84.5	Confident	72	Confident	2 Å²	2	15.2 Å²	15.2	1%	0.009	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.3	175	-76	100.5	-33.9	0	0	109.4	I201 F202 W265 H393	I201-Q395 CarbonylContact C-O 3.5Å; I201-Q395 WeakPolarHBondContact CA-O 3.36Å; I201-Q395 WeakPolarHBondContact CB-O 3.49Å; F202-Q395 HydrophobicContact CD1-CB 3.94Å; F202-Q395 HydrophobicContact CE1-CB 3.4Å; F202-Q395 HydrophobicContact CE1-CG 4.13Å; F202-Q395 HydrophobicContact CE2-CB 4.07Å; F202-Q395 VanDerWaalsContact CE2-CD 3.46Å; F202-Q395 HydrophobicContact CE2-CG 4.18Å; F202-Q395 VanDerWaalsContact CE2-OE1 3.29Å; F202-Q395 HydrophobicContact CZ-CB 3.48Å; F202-Q395 VanDerWaalsContact CZ-CB 3.48Å; F202-Q395 VanDerWaalsContact CZ-CD 3.47Å; F202-Q395 HydrophobicContact CZ-CG 3.69Å; F202-Q395 PolarHBondContact N-O 3.41Å; F202-Q395 PolarHBondContact O-N 2.76Å; W265-Q395 HydrophobicContact CD2-CB 4.23Å; W265-Q395 HydrophobicContact CD2-CG 3.83Å; W265-Q395 HydrophobicContact CE3-CB 3.94Å; W265-Q395 HydrophobicContact CE3-CG 3.85Å; W265-Q395 HydrophobicContact CG-CG 4.29Å; W265-Q395 HydrophobicContact CH2-CB 3.75Å; W265-Q395 HydrophobicContact CH2-CG 4.42Å; W265-Q395 HydrophobicContact CZ2-CB 4.03Å; W265-Q395 HydrophobicContact CZ2-CG 4.38Å; W265-Q395 HydrophobicContact CZ3-CB 3.71Å; W265-Q395 HydrophobicContact CZ3-CG 4.16Å; H393-Q395 PolarHBondContact O-OE1 2.63Å
396	S	79.2	Confident	69.9	Low	12 Å²	12	19.4 Å²	19.4	8%	0.084	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.5	179.6	175.9	0	0	0	0	111.7	W265 S399 K401	W265-S396 VanDerWaalsContact CZ3-O 3.29Å; W265-S396 WeakPolarHBondContact CZ3-O 3.29Å; S396-S399 PolarHBondContact OG-N 2.89Å; S396-S399 PolarHBondContact OG-O 3.3Å; S396-S399 PolarHBondContact OG-OG 3.31Å; S396-K401 WeakPolarHBondContact CB-O 3.49Å; S396-K401 PolarHBondContact N-O 2.97Å
397	F	67.1	Low	66.9	Low	16 Å²	16	19.5 Å²	19.5	7%	0.07	10%	0.102	C	C	.	.	S	Bend	trans	-89.8	-17.9	178.9	-66.5	-79.8	0	0	0	114	F176 N186 V188 I189 P200 F202 W265	F176-F397 HydrophobicContact CD1-CD1 4.23Å; F176-F397 AromaticContact CE1-CD1 3.67Å; F176-F397 HydrophobicContact CE1-CD1 3.67Å; F176-F397 HydrophobicContact CE1-CE1 4.24Å; F176-F397 HydrophobicContact CZ-CD1 4.1Å; N186-F397 VanDerWaalsContact ND2-CE1 3.28Å; N186-F397 WeakPolarHBondContact ND2-CE1 3.5Å; N186-F397 VanDerWaalsContact ND2-CZ 3.35Å; N186-F397 WeakPolarHBondContact ND2-CZ 3.43Å; V188-F397 HydrophobicContact CB-CD2 4.47Å; V188-F397 HydrophobicContact CB-CE2 3.59Å; V188-F397 HydrophobicContact CB-CZ 4.07Å; V188-F397 HydrophobicContact CG1-CD2 3.99Å; V188-F397 HydrophobicContact CG1-CE2 3.42Å; V188-F397 VanDerWaalsContact CG1-CE2 3.42Å; V188-F397 HydrophobicContact CG1-CZ 4.38Å; I189-F397 HydrophobicContact CD1-CD1 3.64Å; I189-F397 HydrophobicContact CD1-CE1 3.57Å; I189-F397 HydrophobicContact CD1-CZ 4.45Å; I189-F397 HydrophobicContact CG1-CB 4.44Å; I189-F397 HydrophobicContact CG1-CD1 3.26Å; I189-F397 HydrophobicContact CG1-CD2 4.25Å; I189-F397 HydrophobicContact CG1-CE1 3.33Å; I189-F397 HydrophobicContact CG1-CE2 4.31Å; I189-F397 HydrophobicContact CG1-CG 3.75Å; I189-F397 HydrophobicContact CG1-CZ 3.87Å; P200-F397 WeakPolarHBondContact O-CD2 3.19Å; P200-F397 PolarHBondContact O-N 2.88Å; F202-F397 AromaticContact CD1-CE2 3.62Å; F202-F397 HydrophobicContact CD1-CE2 3.62Å; F202-F397 HydrophobicContact CD1-CZ 4.08Å; F202-F397 AromaticContact CE1-CE2 3.67Å; F202-F397 HydrophobicContact CE1-CE2 3.67Å; F202-F397 AromaticContact CE1-CZ 3.66Å; F202-F397 HydrophobicContact CE1-CZ 3.66Å; W265-F397 AromaticContact CH2-CD1 3.4Å; W265-F397 HydrophobicContact CH2-CD1 3.4Å; W265-F397 VanDerWaalsContact CH2-CD1 3.4Å; W265-F397 HydrophobicContact CH2-CD2 4.17Å; W265-F397 AromaticContact CH2-CE1 3.25Å; W265-F397 HydrophobicContact CH2-CE1 3.25Å; W265-F397 HydrophobicContact CH2-CE2 4.02Å; W265-F397 AromaticContact CH2-CG 3.89Å; W265-F397 HydrophobicContact CH2-CG 3.89Å; W265-F397 AromaticContact CH2-CZ 3.6Å; W265-F397 HydrophobicContact CH2-CZ 3.6Å; W265-F397 AromaticContact CZ2-CD1 3.8Å; W265-F397 HydrophobicContact CZ2-CD1 3.8Å; W265-F397 AromaticContact CZ2-CE1 3.12Å; W265-F397 HydrophobicContact CZ2-CE1 3.12Å; W265-F397 HydrophobicContact CZ2-CE2 4.16Å; W265-F397 AromaticContact CZ2-CZ 3.35Å; W265-F397 HydrophobicContact CZ2-CZ 3.35Å
398	C	58	Low	64.4	Low	84 Å²	84	24.2 Å²	24.2	57%	0.568	12%	0.12	S	C	*	.	S	Bend	trans	-98.7	-38	-176.6	-74.8	0	0	0	0	113.8	P200	P200-C398 HydrophobicContact CB-CB 4.16Å; P200-C398 WeakPolarHBondContact CB-SG 3.36Å; P200-C398 HydrophobicContact CG-CB 3.48Å; P200-C398 VanDerWaalsContact CG-CB 3.48Å; P200-C398 WeakPolarHBondContact CG-SG 3.49Å
399	S	45.4	Very low	61.6	Low	14 Å²	14	32.4 Å²	32.4	10%	0.098	16%	0.158	C	C	.	.	S	Bend	trans	-97.6	131.3	164.7	45.8	0	0	0	0	106.9	S396 K401	S396-S399 PolarHBondContact OG-N 2.89Å; S396-S399 PolarHBondContact OG-O 3.3Å; S396-S399 PolarHBondContact OG-OG 3.31Å; S399-K401 PolarHBondContact O-N 3.06Å
400	E	48.3	Very low	59	Low	93 Å²	93	34.9 Å²	34.9	44%	0.435	17%	0.174	S	C	.	.	S	Bend	trans	-67.2	48.4	175.7	-62.4	179.1	164.8	0	0	111	T259 T260 R262	T259-E400 CarbonylContact C-O 3.44Å; T259-E400 WeakPolarHBondContact CA-O 3.35Å; T259-E400 HydrophobicContact CG2-CB 4.39Å; T259-E400 WeakPolarHBondContact CG2-O 3.47Å; T260-E400 PolarHBondContact N-O 3.13Å; R262-E400 IonicContact CZ-OE1 3.97Å; R262-E400 IonicContact NE-OE1 3.58Å; R262-E400 PolarHBondContact NE-OE1 3.08Å; R262-E400 IonicContact NH2-OE1 3.21Å; R262-E400 PolarHBondContact NH2-OE1 3.45Å
401	K	40.6	Very low	56.1	Low	63 Å²	63	40.6 Å²	40.6	27%	0.274	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.9	-169.2	-64.9	-179	-174.6	172.9	0	108.6	Y257 V258 S396 S399 I433	Y257-K401 HydrophobicContact CD1-CB 4.23Å; V258-K401 CarbonylContact O-C 3.52Å; V258-K401 VanDerWaalsContact O-CA 3.24Å; V258-K401 WeakPolarHBondContact O-CA 3.35Å; S396-K401 WeakPolarHBondContact CB-O 3.49Å; S396-K401 PolarHBondContact N-O 2.97Å; S399-K401 PolarHBondContact O-N 3.06Å; K401-I433 PolarHBondContact NZ-O 3.49Å
402	Q	38.3	Very low	53.3	Low	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	152.5	163.6	175.3	174.8	31.8	0	0	108.1	Y257 V258 T260 W265 I394 F404	Y257-Q402 CarbonylContact C-O 3.46Å; Y257-Q402 WeakPolarHBondContact CA-O 3.2Å; V258-Q402 HydrophobicContact CG2-CB 3.98Å; V258-Q402 HydrophobicContact CG2-CG 4.49Å; V258-Q402 WeakPolarHBondContact CG2-O 3.02Å; V258-Q402 PolarHBondContact N-O 2.83Å; V258-Q402 PolarHBondContact O-N 2.63Å; T260-Q402 HydrophobicContact CG2-CB 3.34Å; T260-Q402 HydrophobicContact CG2-CG 4.45Å; W265-Q402 PolarHBondContact O-OE1 3.23Å; I394-Q402 WeakPolarHBondContact O-CA 3.37Å; Q402-F404 HydrophobicContact CG-CE1 4.03Å; Q402-F404 HydrophobicContact CG-CZ 3.96Å
403	S	46.3	Very low	50.5	Low	1 Å²	1	52.8 Å²	52.8	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.7	172.2	67.3	0	0	0	0	115.1	L256 I394	L256-S403 CarbonylContact O-C 3.6Å; L256-S403 WeakPolarHBondContact O-CA 3.03Å; L256-S403 WeakPolarHBondContact O-CB 3.3Å; I394-S403 PolarHBondContact N-O 3.11Å; I394-S403 VanDerWaalsContact N-O 3.11Å; I394-S403 PolarHBondContact O-N 2.71Å
404	F	51.3	Low	47.8	Very low	6 Å²	6	56.8 Å²	56.8	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.1	177.6	-48.5	-66.3	0	0	0	110.1	L256 V258 F267 V296 I345 W387 Y391 H393 Q402	L256-F404 PolarHBondContact N-O 3.42Å; L256-F404 PolarHBondContact O-N 2.75Å; L256-F404 VanDerWaalsContact O-N 3.08Å; V258-F404 HydrophobicContact CG1-CE2 4.2Å; V258-F404 HydrophobicContact CG2-CE2 3.72Å; V258-F404 HydrophobicContact CG2-CZ 4.25Å; F267-F404 HydrophobicContact CD1-CZ 4.19Å; F267-F404 HydrophobicContact CD2-CE2 4.28Å; F267-F404 HydrophobicContact CD2-CZ 4.32Å; F267-F404 AromaticContact CE1-CZ 3.79Å; F267-F404 HydrophobicContact CE1-CZ 3.79Å; F267-F404 HydrophobicContact CE2-CE2 4.03Å; F267-F404 AromaticContact CE2-CZ 3.92Å; F267-F404 HydrophobicContact CE2-CZ 3.92Å; F267-F404 HydrophobicContact CG-CZ 4.45Å; F267-F404 HydrophobicContact CZ-CE2 4.22Å; F267-F404 AromaticContact CZ-CZ 3.64Å; F267-F404 HydrophobicContact CZ-CZ 3.64Å; V296-F404 HydrophobicContact CG2-CE1 3.79Å; V296-F404 HydrophobicContact CG2-CZ 4.26Å; I345-F404 HydrophobicContact CD1-CD2 4.31Å; I345-F404 HydrophobicContact CD1-CE2 4.05Å; I345-F404 HydrophobicContact CG2-CE2 4.37Å; W387-F404 HydrophobicContact CZ2-CB 4.42Å; W387-F404 HydrophobicContact CZ2-CD1 4.1Å; W387-F404 HydrophobicContact CZ2-CD2 4.2Å; W387-F404 HydrophobicContact CZ2-CE1 4.47Å; W387-F404 AromaticContact CZ2-CG 3.96Å; W387-F404 HydrophobicContact CZ2-CG 3.96Å; W387-F404 AromaticContact NE1-CD1 3.57Å; W387-F404 AromaticContact NE1-CE1 3.78Å; Y391-F404 HydrophobicContact CG-CB 4.45Å; H393-F404 AromaticContact CE1-CD1 3.75Å; H393-F404 AromaticContact CE1-CE1 3.78Å; H393-F404 AromaticContact ND1-CD1 3.72Å; H393-F404 AromaticContact ND1-CE1 3.66Å; Q402-F404 HydrophobicContact CG-CE1 4.03Å; Q402-F404 HydrophobicContact CG-CZ 3.96Å
405	I	52.7	Low	45.6	Very low	3 Å²	3	62.7 Å²	62.7	2%	0.015	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.2	-174.9	-59	164	0	0	0	108.8	C251 S252 S254 C255 Y391 C392 I394 A407	C251-I405 HydrophobicContact CB-CD1 4.22Å; C251-I405 HydrophobicContact CB-CG2 4.35Å; S252-I405 VanDerWaalsContact N-CG2 3.28Å; S252-I405 WeakPolarHBondContact O-CG2 3.46Å; S254-I405 WeakPolarHBondContact O-CG2 3.43Å; C255-I405 HydrophobicContact CB-CD1 4.02Å; C255-I405 HydrophobicContact CB-CG1 3.6Å; C255-I405 WeakPolarHBondContact SG-CD1 3.15Å; C255-I405 WeakPolarHBondContact SG-CG1 3.24Å; Y391-I405 CarbonylContact C-O 3.56Å; Y391-I405 WeakPolarHBondContact CA-O 3.47Å; C392-I405 HydrophobicContact CB-CB 4.23Å; C392-I405 PolarHBondContact N-O 3.14Å; C392-I405 PolarHBondContact O-N 2.86Å; I394-I405 HydrophobicContact CD1-CD1 3.45Å; I394-I405 VanDerWaalsContact CD1-CD1 3.45Å; I394-I405 HydrophobicContact CG1-CD1 4.04Å; I405-A407 PolarHBondContact O-N 3.08Å
406	Q	42.4	Very low	43.5	Very low	87 Å²	87	70.1 Å²	70.1	41%	0.407	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	126.8	177.2	-169.3	175.3	21.2	0	0	111	Y391	Y391-Q406 HydrophobicContact CD1-CB 4.49Å; Y391-Q406 HydrophobicContact CE1-CB 4.41Å
407	A	29.6	Very low	41.7	Very low	3 Å²	3	72.6 Å²	72.6	3%	0.025	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-74.5	135.9	176.4	0	0	0	0	0	110.6	Q390 I405	Q390-A407 PolarHBondContact O-N 3.02Å; I405-A407 PolarHBondContact O-N 3.08Å
408	Y	40.9	Very low	40.8	Very low	98 Å²	98	74.9 Å²	74.9	38%	0.384	37%	0.368	S	S	.	.			trans	-105.7	143.2	170.6	-70.5	-74.2	0	0	0	110.3	H250 T410	H250-Y408 PolarHBondContact O-N 2.97Å; Y408-T410 PolarHBondContact O-N 3.32Å
409	Q	31.9	Very low	40.6	Very low	174 Å²	174	76 Å²	76	81%	0.813	36%	0.361	S	S	*	.			trans	-75.5	111.3	164.1	-168.8	171.8	11.9	0	0	107.5
410	T	33.9	Very low	40.8	Very low	53 Å²	53	83.9 Å²	83.9	33%	0.325	40%	0.402	S	S	.	.			trans	-89.3	138.8	176.4	61.6	0	0	0	0	110.8	L249 Y408	L249-T410 HydrophobicContact CD1-CG2 4.37Å; L249-T410 WeakPolarHBondContact O-CG2 3.38Å; Y408-T410 PolarHBondContact O-N 3.32Å
411	T	31	Very low	41	Very low	125 Å²	125	82 Å²	82	77%	0.767	41%	0.408	S	S	*	.			trans	-112	22.5	168.8	55.3	0	0	0	0	111
412	Y	32.1	Very low	41.9	Very low	131 Å²	131	84.1 Å²	84.1	51%	0.514	43%	0.426	S	S	.	.			trans	-122.4	118.6	-179.9	-76.5	-81.6	0	0	0	110.3	L249 F414 Y518	L249-Y412 WeakPolarHBondContact CD1-O 3.29Å; Y412-F414 PolarHBondContact O-N 3.1Å; Y412-Y518 PolarHBondContact OH-O 2.81Å
413	N	30.2	Very low	42.9	Very low	136 Å²	136	90 Å²	90	73%	0.727	46%	0.457	S	S	*	.			trans	-71.5	109.7	171.7	-76.6	-22.6	0	0	0	109	W415	N413-W415 PolarHBondContact O-N 3.32Å
414	F	33	Very low	43.9	Very low	84 Å²	84	92.2 Å²	92.2	37%	0.368	48%	0.48	S	S	.	.			trans	-72	2.3	175.3	-129.2	-111.4	0	0	0	113.6	L249 Y412 E416 I417	L249-F414 HydrophobicContact CB-CG 4.48Å; L249-F414 HydrophobicContact CD1-CB 3.87Å; L249-F414 HydrophobicContact CD1-CD2 3.74Å; L249-F414 HydrophobicContact CD1-CG 4.11Å; L249-F414 HydrophobicContact CD2-CB 4.03Å; L249-F414 HydrophobicContact CG-CB 4.35Å; Y412-F414 PolarHBondContact O-N 3.1Å; F414-E416 PolarHBondContact O-N 2.86Å; F414-I417 HydrophobicContact CD1-CB 4.47Å; F414-I417 HydrophobicContact CD1-CD1 3.52Å; F414-I417 HydrophobicContact CD1-CG1 4.08Å; F414-I417 HydrophobicContact CD2-CD1 3.83Å; F414-I417 HydrophobicContact CE1-CD1 3.38Å; F414-I417 HydrophobicContact CE1-CG1 4.34Å; F414-I417 HydrophobicContact CE2-CD1 3.69Å; F414-I417 HydrophobicContact CG-CD1 3.77Å; F414-I417 HydrophobicContact CG-CG1 4.31Å; F414-I417 HydrophobicContact CZ-CD1 3.46Å; F414-I417 VanDerWaalsContact CZ-CD1 3.46Å; F414-I417 PolarHBondContact O-N 2.83Å
415	W	41	Very low	44.7	Very low	132 Å²	132	93.9 Å²	93.9	50%	0.5	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	7.7	-171.1	-57	104.6	0	0	0	114.8	L52 N413	L52-W415 HydrophobicContact CD1-CE3 3.83Å; L52-W415 HydrophobicContact CD1-CH2 3.73Å; L52-W415 HydrophobicContact CD1-CZ3 3.05Å; L52-W415 HydrophobicContact CG-CZ3 4.48Å; N413-W415 PolarHBondContact O-N 3.32Å
416	E	40.3	Very low	45.3	Very low	158 Å²	158	96.6 Å²	96.6	74%	0.738	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	10.1	179.6	-65	-175.9	167.4	0	0	113.2	F414	F414-E416 PolarHBondContact O-N 2.86Å
417	I	40.9	Very low	46.4	Very low	64 Å²	64	94.6 Å²	94.6	33%	0.328	51%	0.506	S	S	.	.			trans	-88.2	123.2	-177.8	-54.6	-163	0	0	0	110.9	F414 Y419	F414-I417 HydrophobicContact CD1-CB 4.47Å; F414-I417 HydrophobicContact CD1-CD1 3.52Å; F414-I417 HydrophobicContact CD1-CG1 4.08Å; F414-I417 HydrophobicContact CD2-CD1 3.83Å; F414-I417 HydrophobicContact CE1-CD1 3.38Å; F414-I417 HydrophobicContact CE1-CG1 4.34Å; F414-I417 HydrophobicContact CE2-CD1 3.69Å; F414-I417 HydrophobicContact CG-CD1 3.77Å; F414-I417 HydrophobicContact CG-CG1 4.31Å; F414-I417 HydrophobicContact CZ-CD1 3.46Å; F414-I417 VanDerWaalsContact CZ-CD1 3.46Å; F414-I417 PolarHBondContact O-N 2.83Å; I417-Y419 VanDerWaalsContact C-N 3.34Å; I417-Y419 HydrophobicContact CG2-CD1 3.52Å; I417-Y419 HydrophobicContact CG2-CD2 4.21Å; I417-Y419 HydrophobicContact CG2-CE1 3.06Å; I417-Y419 HydrophobicContact CG2-CE2 3.81Å; I417-Y419 HydrophobicContact CG2-CG 4.08Å; I417-Y419 PolarHBondContact O-N 3.35Å
418	P	48.1	Very low	47.8	Very low	63 Å²	63	95.9 Å²	95.9	41%	0.409	51%	0.514	S	S	.	.			trans	-92.3	34.4	-164.1	37.8	-39.7	0	0	0	114.9	V31	V31-P418 HydrophobicContact CB-CB 3.49Å; V31-P418 VanDerWaalsContact CB-CB 3.49Å; V31-P418 HydrophobicContact CB-CG 3.44Å; V31-P418 VanDerWaalsContact CB-CG 3.44Å; V31-P418 HydrophobicContact CG1-CB 3.34Å; V31-P418 HydrophobicContact CG1-CG 3.72Å; V31-P418 HydrophobicContact CG2-CB 3.76Å; V31-P418 HydrophobicContact CG2-CG 4.01Å
419	Y	55	Low	48.6	Very low	107 Å²	107	96.9 Å²	96.9	42%	0.42	52%	0.523	S	S	.	.			trans	-141.9	148.9	178.7	55.1	-103.9	0	0	0	112.1	I417 V422	I417-Y419 VanDerWaalsContact C-N 3.34Å; I417-Y419 HydrophobicContact CG2-CD1 3.52Å; I417-Y419 HydrophobicContact CG2-CD2 4.21Å; I417-Y419 HydrophobicContact CG2-CE1 3.06Å; I417-Y419 HydrophobicContact CG2-CE2 3.81Å; I417-Y419 HydrophobicContact CG2-CG 4.08Å; I417-Y419 PolarHBondContact O-N 3.35Å; Y419-V422 HydrophobicContact CE2-CG2 3.99Å
420	D	49.3	Very low	49.8	Very low	181 Å²	181	93.8 Å²	93.8	97%	0.968	51%	0.512	S	S	*	.	S	Bend	trans	-81.8	-13.9	-173.2	-55.6	-61.6	0	0	0	114.2
421	G	51.4	Low	50.7	Low	54 Å²	54	92.9 Å²	92.9	56%	0.557	51%	0.508	S	S	*	.			trans	176	176	-178.4	0	0	0	0	0	113.1
422	V	59.5	Low	51.7	Low	106 Å²	106	91 Å²	91	64%	0.642	49%	0.493	S	S	*	.			trans	-112.8	121.4	180	-178.9	0	0	0	0	109.8	Y419	Y419-V422 HydrophobicContact CE2-CG2 3.99Å
423	L	59.8	Low	52.6	Low	125 Å²	125	87.1 Å²	87.1	65%	0.654	48%	0.48	S	S	*	.			trans	-86.5	109	171.7	-177.3	64.3	0	0	0	109.7	L425 A438	L423-L425 HydrophobicContact CD2-CD2 3.88Å; L423-L425 HydrophobicContact CG-CD2 3.86Å; L423-L425 HydrophobicContact CG-CG 4.36Å; L423-L425 PolarHBondContact O-N 2.82Å; L423-A438 HydrophobicContact CD1-CB 4.37Å
424	G	66.9	Low	53.7	Low	47 Å²	47	90.4 Å²	90.4	49%	0.485	48%	0.482	S	S	.	.			trans	-74.5	120.5	176.7	0	0	0	0	0	112.4
425	L	68.4	Low	54.8	Low	41 Å²	41	90.5 Å²	90.5	22%	0.215	48%	0.484	C	S	.	.			trans	-117.2	-6	-177.2	-58	174.8	0	0	0	114.3	L423 I439 F453 I455	L423-L425 HydrophobicContact CD2-CD2 3.88Å; L423-L425 HydrophobicContact CG-CD2 3.86Å; L423-L425 HydrophobicContact CG-CG 4.36Å; L423-L425 PolarHBondContact O-N 2.82Å; L425-I439 HydrophobicContact CB-CG1 4.4Å; L425-I439 HydrophobicContact CD2-CD1 4.12Å; L425-I439 HydrophobicContact CD2-CG1 3.47Å; L425-I439 VanDerWaalsContact CD2-CG1 3.47Å; L425-F453 HydrophobicContact CB-CE1 4.38Å; L425-F453 HydrophobicContact CB-CZ 3.92Å; L425-F453 HydrophobicContact CD1-CE2 4.43Å; L425-I455 HydrophobicContact CD1-CD1 3.84Å
426	A	66.7	Low	55.7	Low	59 Å²	59	86.7 Å²	86.7	49%	0.488	48%	0.478	S	S	.	.	S	Bend	trans	-64.3	159.8	176.9	0	0	0	0	0	111.4	S428 N437	A426-S428 PolarHBondContact O-N 3.35Å; A426-N437 PolarHBondContact O-ND2 3.15Å
427	P	64.2	Low	56.9	Low	45 Å²	45	80.4 Å²	80.4	29%	0.292	45%	0.449	S	S	.	.			trans	-51.6	139.3	175.2	-27.9	37.2	0	0	0	113.2	Q429 D430 S431 F590	P427-Q429 HydrophobicContact CB-CG 3.94Å; P427-Q429 PolarHBondContact O-N 3.22Å; P427-Q429 VanDerWaalsContact O-N 3.13Å; P427-D430 PolarHBondContact O-N 2.86Å; P427-S431 PolarHBondContact O-N 3.24Å; P427-F590 HydrophobicContact CG-CE1 4.33Å
428	S	60.3	Low	58.2	Low	30 Å²	30	79.5 Å²	79.5	21%	0.21	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-61.5	-22.9	-177.6	57.9	0	0	0	0	114.3	A426 D430 S431 E435	A426-S428 PolarHBondContact O-N 3.35Å; S428-D430 PolarHBondContact O-N 2.04Å; S428-S431 WeakPolarHBondContact O-CB 3.48Å; S428-S431 PolarHBondContact O-N 3.17Å; S428-S431 VanDerWaalsContact O-N 3.08Å; S428-E435 WeakPolarHBondContact CB-O 3.31Å
429	Q	57.7	Low	59.2	Low	119 Å²	119	77.8 Å²	77.8	56%	0.556	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-62.6	-28.3	173.6	67.8	-168.9	12.1	0	0	112.7	P427	P427-Q429 HydrophobicContact CB-CG 3.94Å; P427-Q429 PolarHBondContact O-N 3.22Å; P427-Q429 VanDerWaalsContact O-N 3.13Å
430	D	56	Low	59.7	Low	109 Å²	109	73.4 Å²	73.4	58%	0.583	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-92.6	-7.6	176.7	-52.2	-40.5	0	0	0	111.5	P427 S428 L432	P427-D430 PolarHBondContact O-N 2.86Å; S428-D430 PolarHBondContact O-N 2.04Å; D430-L432 PolarHBondContact O-N 3.38Å
431	S	52.9	Low	60.8	Low	35 Å²	35	68.3 Å²	68.3	25%	0.245	40%	0.395	C	S	.	.	S	Bend	trans	-67.4	128.7	173.5	-174.5	0	0	0	0	109.5	P427 S428 I433 R434	P427-S431 PolarHBondContact O-N 3.24Å; S428-S431 WeakPolarHBondContact O-CB 3.48Å; S428-S431 PolarHBondContact O-N 3.17Å; S428-S431 VanDerWaalsContact O-N 3.08Å; S431-I433 PolarHBondContact O-N 2.91Å; S431-I433 VanDerWaalsContact O-N 3.16Å; S431-I433 WeakPolarHBondContact OG-CG1 3.43Å; S431-R434 WeakPolarHBondContact O-CA 3.2Å; S431-R434 PolarHBondContact O-N 3.28Å
432	L	51.3	Low	61.5	Low	85 Å²	85	68.9 Å²	68.9	45%	0.445	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-33.9	176.2	-74	164.3	0	0	0	112.6	A253 Y257 D430	A253-L432 WeakPolarHBondContact O-CD1 3.3Å; Y257-L432 HydrophobicContact CE2-CB 3.85Å; Y257-L432 VanDerWaalsContact CE2-O 3.27Å; Y257-L432 WeakPolarHBondContact CE2-O 3.27Å; D430-L432 PolarHBondContact O-N 3.38Å
433	I	52.4	Low	61.9	Low	50 Å²	50	65.4 Å²	65.4	26%	0.256	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.5	176.8	57	171.6	0	0	0	113.4	Y257 K401 S431 E435	Y257-I433 HydrophobicContact CE1-CG2 4.23Å; K401-I433 PolarHBondContact NZ-O 3.49Å; S431-I433 PolarHBondContact O-N 2.91Å; S431-I433 VanDerWaalsContact O-N 3.16Å; S431-I433 WeakPolarHBondContact OG-CG1 3.43Å; I433-E435 HydrophobicContact CB-CG 4.5Å; I433-E435 HydrophobicContact CD1-CB 3.94Å; I433-E435 HydrophobicContact CD1-CG 4.36Å; I433-E435 HydrophobicContact CG1-CB 4.09Å; I433-E435 HydrophobicContact CG1-CG 4.42Å; I433-E435 PolarHBondContact O-N 3.29Å
434	R	52.9	Low	62.4	Low	204 Å²	204	65.9 Å²	65.9	77%	0.77	36%	0.363	S	S	*	.			trans	56.2	17.2	-174.4	-59.2	-177.4	176.5	-130.6	-0.9	114.8	S431	S431-R434 WeakPolarHBondContact O-CA 3.2Å; S431-R434 PolarHBondContact O-N 3.28Å
435	E	57	Low	62.8	Low	87 Å²	87	67.3 Å²	67.3	41%	0.407	37%	0.365	S	S	.	.			trans	-91	155.7	175.5	-65.4	-172.4	-170.5	0	0	111.2	S428 I433 N437	S428-E435 WeakPolarHBondContact CB-O 3.31Å; I433-E435 HydrophobicContact CB-CG 4.5Å; I433-E435 HydrophobicContact CD1-CB 3.94Å; I433-E435 HydrophobicContact CD1-CG 4.36Å; I433-E435 HydrophobicContact CG1-CB 4.09Å; I433-E435 HydrophobicContact CG1-CG 4.42Å; I433-E435 PolarHBondContact O-N 3.29Å; E435-N437 PolarHBondContact O-N 3.29Å
436	S	59.7	Low	62.8	Low	52 Å²	52	74.1 Å²	74.1	36%	0.364	39%	0.393	S	S	.	.			trans	-66	121.2	176.6	50.9	0	0	0	0	110.9	N441	S436-N441 WeakPolarHBondContact CB-OD1 3.12Å; S436-N441 PolarHBondContact O-ND2 3.3Å; S436-N441 PolarHBondContact OG-OD1 2.99Å
437	N	64.4	Low	62.8	Low	26 Å²	26	74.1 Å²	74.1	14%	0.139	39%	0.393	C	S	.	.			trans	-78.9	174.7	170.6	54.9	55.7	0	0	0	111.5	A426 E435 I439 T440 N441	A426-N437 PolarHBondContact O-ND2 3.15Å; E435-N437 PolarHBondContact O-N 3.29Å; N437-I439 VanDerWaalsContact C-N 3.26Å; N437-I439 PolarHBondContact O-N 3.29Å; N437-I439 PolarHBondContact OD1-N 2.82Å; N437-T440 PolarHBondContact ND2-OG1 2.83Å; N437-T440 PolarHBondContact O-N 2.96Å; N437-T440 PolarHBondContact OD1-N 2.98Å; N437-T440 PolarHBondContact OD1-OG1 2.88Å; N437-N441 PolarHBondContact O-N 2.96Å; N437-N441 PolarHBondContact O-ND2 3.21Å
438	A	68.5	Low	62.9	Low	45 Å²	45	74.1 Å²	74.1	37%	0.372	39%	0.391	S	S	.	.	H	α-helix	trans	-49.1	-45.2	-178.8	0	0	0	0	0	113	L423 N441 I442	L423-A438 HydrophobicContact CD1-CB 4.37Å; A438-N441 PolarHBondContact O-N 3.21Å; A438-I442 WeakPolarHBondContact O-CD1 3.23Å; A438-I442 WeakPolarHBondContact O-CG1 3.29Å; A438-I442 PolarHBondContact O-N 3.07Å
439	I	68.2	Low	62.9	Low	26 Å²	26	79.6 Å²	79.6	13%	0.133	42%	0.417	C	S	.	.	H	α-helix	trans	-69.8	-42.5	179	-66.8	-55.3	0	0	0	111.9	L425 N437 N441 I442 V443 F453 F590	L425-I439 HydrophobicContact CB-CG1 4.4Å; L425-I439 HydrophobicContact CD2-CD1 4.12Å; L425-I439 HydrophobicContact CD2-CG1 3.47Å; L425-I439 VanDerWaalsContact CD2-CG1 3.47Å; N437-I439 VanDerWaalsContact C-N 3.26Å; N437-I439 PolarHBondContact O-N 3.29Å; N437-I439 PolarHBondContact OD1-N 2.82Å; I439-N441 VanDerWaalsContact C-N 3.25Å; I439-N441 PolarHBondContact O-N 3.13Å; I439-I442 HydrophobicContact CD1-CD1 4.19Å; I439-I442 PolarHBondContact O-N 3.04Å; I439-I442 VanDerWaalsContact O-N 3.13Å; I439-V443 HydrophobicContact CG2-CG2 4.16Å; I439-V443 WeakPolarHBondContact O-CB 3.37Å; I439-V443 VanDerWaalsContact O-CG2 3.32Å; I439-V443 WeakPolarHBondContact O-CG2 3.42Å; I439-V443 PolarHBondContact O-N 2.86Å; I439-F453 HydrophobicContact CB-CE1 4.49Å; I439-F453 HydrophobicContact CD1-CD1 4.23Å; I439-F453 HydrophobicContact CG1-CD1 4.13Å; I439-F453 HydrophobicContact CG1-CE1 4.05Å; I439-F453 HydrophobicContact CG2-CD1 3.89Å; I439-F453 HydrophobicContact CG2-CE1 3.94Å; I439-F590 HydrophobicContact CB-CZ 4.43Å; I439-F590 HydrophobicContact CG2-CD1 4.37Å; I439-F590 HydrophobicContact CG2-CD2 4.19Å; I439-F590 HydrophobicContact CG2-CE1 3.87Å; I439-F590 HydrophobicContact CG2-CE2 3.74Å; I439-F590 HydrophobicContact CG2-CZ 3.54Å
440	T	66.9	Low	63.2	Low	15 Å²	15	80.5 Å²	80.5	9%	0.092	42%	0.422	C	S	.	.	H	α-helix	trans	-59.2	-41.2	177.4	-53.1	0	0	0	0	110.7	N437 V443 Q444	N437-T440 PolarHBondContact ND2-OG1 2.83Å; N437-T440 PolarHBondContact O-N 2.96Å; N437-T440 PolarHBondContact OD1-N 2.98Å; N437-T440 PolarHBondContact OD1-OG1 2.88Å; T440-V443 PolarHBondContact O-N 3.47Å; T440-Q444 WeakPolarHBondContact O-CB 3.37Å; T440-Q444 VanDerWaalsContact O-CG 3.29Å; T440-Q444 WeakPolarHBondContact O-CG 3.34Å; T440-Q444 PolarHBondContact O-N 2.98Å
441	N	71.4	Confident	63.9	Low	75 Å²	75	76.4 Å²	76.4	40%	0.401	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-42.1	175.1	-69.6	-26	0	0	0	112.3	S436 N437 A438 I439 V443 Q444 S445	S436-N441 WeakPolarHBondContact CB-OD1 3.12Å; S436-N441 PolarHBondContact O-ND2 3.3Å; S436-N441 PolarHBondContact OG-OD1 2.99Å; N437-N441 PolarHBondContact O-N 2.96Å; N437-N441 PolarHBondContact O-ND2 3.21Å; A438-N441 PolarHBondContact O-N 3.21Å; I439-N441 VanDerWaalsContact C-N 3.25Å; I439-N441 PolarHBondContact O-N 3.13Å; N441-V443 VanDerWaalsContact C-N 3.34Å; N441-Q444 PolarHBondContact O-N 3.4Å; N441-S445 WeakPolarHBondContact O-CB 3.5Å; N441-S445 PolarHBondContact O-N 3.02Å; N441-S445 PolarHBondContact O-OG 2.84Å
442	I	67.2	Low	64.4	Low	65 Å²	65	77.5 Å²	77.5	33%	0.333	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-39.7	176.7	-71.4	163.5	0	0	0	111.4	A438 I439 S445 L448	A438-I442 WeakPolarHBondContact O-CD1 3.23Å; A438-I442 WeakPolarHBondContact O-CG1 3.29Å; A438-I442 PolarHBondContact O-N 3.07Å; I439-I442 HydrophobicContact CD1-CD1 4.19Å; I439-I442 PolarHBondContact O-N 3.04Å; I439-I442 VanDerWaalsContact O-N 3.13Å; I442-S445 PolarHBondContact O-OG 2.91Å; I442-L448 HydrophobicContact CG2-CD1 3.52Å; I442-L448 HydrophobicContact CG2-CD2 4.24Å; I442-L448 HydrophobicContact CG2-CG 3.57Å
443	V	67.9	Low	65.4	Low	34 Å²	34	75 Å²	75	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-67.9	-45.6	176.6	170	0	0	0	0	110.7	I439 T440 N441 S445 K446 F590	I439-V443 HydrophobicContact CG2-CG2 4.16Å; I439-V443 WeakPolarHBondContact O-CB 3.37Å; I439-V443 VanDerWaalsContact O-CG2 3.32Å; I439-V443 WeakPolarHBondContact O-CG2 3.42Å; I439-V443 PolarHBondContact O-N 2.86Å; T440-V443 PolarHBondContact O-N 3.47Å; N441-V443 VanDerWaalsContact C-N 3.34Å; V443-S445 VanDerWaalsContact C-N 3.33Å; V443-S445 PolarHBondContact O-N 3.18Å; V443-K446 PolarHBondContact O-N 2.9Å; V443-K446 VanDerWaalsContact O-N 3.17Å; V443-F590 HydrophobicContact CG2-CB 4.25Å; V443-F590 HydrophobicContact CG2-CG 4.29Å
444	Q	70.3	Confident	65.9	Low	134 Å²	134	75.2 Å²	75.2	63%	0.626	39%	0.393	S	S	*	.	H	α-helix	trans	-64.6	-34.6	178.9	-77.4	179	-9.3	0	0	113.2	T440 N441 K446	T440-Q444 WeakPolarHBondContact O-CB 3.37Å; T440-Q444 VanDerWaalsContact O-CG 3.29Å; T440-Q444 WeakPolarHBondContact O-CG 3.34Å; T440-Q444 PolarHBondContact O-N 2.98Å; N441-Q444 PolarHBondContact O-N 3.4Å; Q444-K446 PolarHBondContact O-N 2.85Å
445	S	74.3	Confident	66.6	Low	77 Å²	77	66.5 Å²	66.5	54%	0.538	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.2	177.5	69.1	0	0	0	0	113.5	N441 I442 V443 A447	N441-S445 WeakPolarHBondContact O-CB 3.5Å; N441-S445 PolarHBondContact O-N 3.02Å; N441-S445 PolarHBondContact O-OG 2.84Å; I442-S445 PolarHBondContact O-OG 2.91Å; V443-S445 VanDerWaalsContact C-N 3.33Å; V443-S445 PolarHBondContact O-N 3.18Å; S445-A447 PolarHBondContact O-N 2.84Å; S445-A447 VanDerWaalsContact OG-CB 3.26Å; S445-A447 WeakPolarHBondContact OG-CB 3.28Å; S445-A447 PolarHBondContact OG-N 3.38Å
446	K	68.3	Low	66.6	Low	185 Å²	185	68.2 Å²	68.2	80%	0.804	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	25.9	-172.3	-55.7	-178.7	178.9	179.7	0	112.6	V443 Q444 L448	V443-K446 PolarHBondContact O-N 2.9Å; V443-K446 VanDerWaalsContact O-N 3.17Å; Q444-K446 PolarHBondContact O-N 2.85Å; K446-L448 PolarHBondContact O-N 2.83Å
447	A	67.2	Low	66.3	Low	58 Å²	58	69 Å²	69	48%	0.479	36%	0.362	S	S	.	.			trans	-69.5	-18	179.5	0	0	0	0	0	112.9	S445	S445-A447 PolarHBondContact O-N 2.84Å; S445-A447 VanDerWaalsContact OG-CB 3.26Å; S445-A447 WeakPolarHBondContact OG-CB 3.28Å; S445-A447 PolarHBondContact OG-N 3.38Å
448	L	65.2	Low	65.6	Low	46 Å²	46	71 Å²	71	24%	0.241	38%	0.381	C	S	.	.	S	Bend	trans	-105.1	137.3	176.3	-58.2	175.8	0	0	0	110.7	I442 K446 Q450	I442-L448 HydrophobicContact CG2-CD1 3.52Å; I442-L448 HydrophobicContact CG2-CD2 4.24Å; I442-L448 HydrophobicContact CG2-CG 3.57Å; K446-L448 PolarHBondContact O-N 2.83Å; L448-Q450 VanDerWaalsContact CB-O 3.27Å; L448-Q450 WeakPolarHBondContact CB-O 3.42Å; L448-Q450 PolarHBondContact O-N 2.96Å
449	N	61.5	Low	64.8	Low	144 Å²	144	73.2 Å²	73.2	77%	0.77	38%	0.38	S	S	*	.	S	Bend	trans	-66.2	-27.2	174.5	-159.6	22.5	0	0	0	112.1
450	Q	63.2	Low	63.5	Low	139 Å²	139	78.5 Å²	78.5	65%	0.65	40%	0.402	S	S	*	.	S	Bend	trans	-134.5	131.6	170.4	-64.5	-179.5	-4.9	0	0	108.4	L448 I452	L448-Q450 VanDerWaalsContact CB-O 3.27Å; L448-Q450 WeakPolarHBondContact CB-O 3.42Å; L448-Q450 PolarHBondContact O-N 2.96Å; Q450-I452 HydrophobicContact CB-CD1 4.18Å; Q450-I452 HydrophobicContact CB-CG1 4.21Å; Q450-I452 PolarHBondContact O-N 2.99Å
451	S	70.8	Confident	61.7	Low	22 Å²	22	83.9 Å²	83.9	15%	0.154	44%	0.437	C	S	.	.	S	Bend	trans	-76.9	52.2	178.7	-51.8	0	0	0	0	112.1	F590 T591	S451-F590 PolarHBondContact O-N 3.5Å; S451-T591 WeakPolarHBondContact CB-OG1 3.46Å; S451-T591 PolarHBondContact OG-OG1 3.44Å
452	I	64.5	Low	59.5	Low	58 Å²	58	90.6 Å²	90.6	30%	0.297	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.9	-175.1	-58.8	176.4	0	0	0	108.5	Q450 V587 H588 D589	Q450-I452 HydrophobicContact CB-CD1 4.18Å; Q450-I452 HydrophobicContact CB-CG1 4.21Å; Q450-I452 PolarHBondContact O-N 2.99Å; I452-V587 HydrophobicContact CG2-CG1 3.57Å; I452-H588 VanDerWaalsContact CA-O 3.3Å; I452-H588 WeakPolarHBondContact CA-O 3.48Å; I452-D589 HydrophobicContact CG1-CB 4.28Å
453	F	72.5	Confident	57.3	Low	32 Å²	32	94.3 Å²	94.3	14%	0.14	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.7	163.5	77.6	-105.1	0	0	0	110.9	L425 I439 I455 H588 F590	L425-F453 HydrophobicContact CB-CE1 4.38Å; L425-F453 HydrophobicContact CB-CZ 3.92Å; L425-F453 HydrophobicContact CD1-CE2 4.43Å; I439-F453 HydrophobicContact CB-CE1 4.49Å; I439-F453 HydrophobicContact CD1-CD1 4.23Å; I439-F453 HydrophobicContact CG1-CD1 4.13Å; I439-F453 HydrophobicContact CG1-CE1 4.05Å; I439-F453 HydrophobicContact CG2-CD1 3.89Å; I439-F453 HydrophobicContact CG2-CE1 3.94Å; F453-I455 HydrophobicContact CD2-CD1 4.4Å; F453-I455 HydrophobicContact CD2-CG1 4.01Å; F453-I455 HydrophobicContact CE2-CD1 3.72Å; F453-I455 HydrophobicContact CE2-CG1 3.81Å; F453-H588 HydrophobicContact CD1-CB 4.05Å; F453-H588 HydrophobicContact CD2-CB 4.36Å; F453-H588 AromaticContact CD2-ND1 3.84Å; F453-H588 HydrophobicContact CE1-CB 3.77Å; F453-H588 HydrophobicContact CE2-CB 4.02Å; F453-H588 AromaticContact CE2-CE1 3.63Å; F453-H588 AromaticContact CE2-CG 3.59Å; F453-H588 AromaticContact CE2-ND1 3.16Å; F453-H588 WeakPolarHBondContact CE2-ND1 3.43Å; F453-H588 HydrophobicContact CG-CB 4.35Å; F453-H588 HydrophobicContact CZ-CB 3.71Å; F453-H588 AromaticContact CZ-CD2 3.82Å; F453-H588 AromaticContact CZ-CE1 3.93Å; F453-H588 AromaticContact CZ-CG 3.42Å; F453-H588 VanDerWaalsContact CZ-CG 3.42Å; F453-H588 AromaticContact CZ-ND1 3.52Å; F453-H588 PolarHBondContact N-O 2.88Å; F453-H588 VanDerWaalsContact N-O 3.14Å; F453-H588 PolarHBondContact O-N 3.31Å; F453-F590 HydrophobicContact CD1-CD2 4.35Å; F453-F590 AromaticContact CD1-CE2 3.74Å; F453-F590 HydrophobicContact CD1-CE2 3.74Å; F453-F590 HydrophobicContact CE1-CD2 4.3Å; F453-F590 AromaticContact CE1-CE2 3.29Å; F453-F590 HydrophobicContact CE1-CE2 3.29Å; F453-F590 AromaticContact CE1-CZ 3.84Å; F453-F590 HydrophobicContact CE1-CZ 3.84Å; F453-F590 HydrophobicContact CZ-CE2 4.29Å
454	T	62.7	Low	55.2	Low	55 Å²	55	98.8 Å²	98.8	34%	0.337	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.6	179.2	-54	0	0	0	0	109.5	W456 C585 V586 V587	T454-W456 HydrophobicContact CG2-CE3 4.03Å; T454-C585 HydrophobicContact CG2-CB 3.89Å; T454-V586 WeakPolarHBondContact CA-O 3.49Å; T454-V587 HydrophobicContact CG2-CG2 4Å
455	I	66.1	Low	52.9	Low	22 Å²	22	98 Å²	98	11%	0.113	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.8	169.5	-59.7	172.6	0	0	0	107.7	L28 L425 F453 F581 V586	L28-I455 HydrophobicContact CD1-CG2 4.15Å; L425-I455 HydrophobicContact CD1-CD1 3.84Å; F453-I455 HydrophobicContact CD2-CD1 4.4Å; F453-I455 HydrophobicContact CD2-CG1 4.01Å; F453-I455 HydrophobicContact CE2-CD1 3.72Å; F453-I455 HydrophobicContact CE2-CG1 3.81Å; I455-F581 HydrophobicContact CB-CD1 4.28Å; I455-F581 HydrophobicContact CB-CE1 4.02Å; I455-F581 HydrophobicContact CG2-CD1 3.83Å; I455-F581 HydrophobicContact CG2-CE1 3.86Å; I455-V586 PolarHBondContact N-O 3.46Å; I455-V586 PolarHBondContact O-N 2.99Å
456	W	58.8	Low	50.3	Low	123 Å²	123	101 Å²	101	47%	0.466	53%	0.534	S	S	.	.			trans	-141.9	159.6	173.4	74.8	93.1	0	0	0	110.7	T454 C585	T454-W456 HydrophobicContact CG2-CE3 4.03Å; W456-C585 HydrophobicContact CB-CB 4.21Å; W456-C585 WeakPolarHBondContact CB-SG 3.26Å
457	K	51.4	Low	48.1	Very low	69 Å²	69	95.6 Å²	95.6	30%	0.3	53%	0.53	S	S	.	.			trans	-123.4	124.6	173.6	-173.9	172.2	173.8	171.4	0	109.7	T30 E578	T30-K457 HydrophobicContact CG2-CD 4.11Å; T30-K457 VanDerWaalsContact CG2-CE 3.47Å; T30-K457 HydrophobicContact CG2-CG 4.35Å; K457-E578 HydrophobicContact CD-CG 4.49Å; K457-E578 VanDerWaalsContact CD-OE1 3.32Å; K457-E578 WeakPolarHBondContact CD-OE1 3.46Å; K457-E578 VanDerWaalsContact CE-OE1 3.26Å; K457-E578 WeakPolarHBondContact CE-OE1 3.04Å; K457-E578 IonicContact NZ-OE1 3.24Å; K457-E578 PolarHBondContact NZ-OE1 2.85Å
458	A	50.7	Low	45.9	Very low	66 Å²	66	102 Å²	102	55%	0.545	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-67.3	144.2	175.7	0	0	0	0	0	111
459	R	52.3	Low	43.8	Very low	93 Å²	93	103.9 Å²	103.9	35%	0.351	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-72	131.3	173.6	-64.2	-177.8	-177.3	-171.5	-0.5	108.7
460	K	40.7	Very low	41.9	Very low	137 Å²	137	103.9 Å²	103.9	60%	0.596	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-62.1	132.5	166.6	-83	-172.8	178.9	178.7	0	107.4	D32 W462	D32-K460 IonicContact OD2-NZ 2.86Å; D32-K460 PolarHBondContact OD2-NZ 2.81Å; K460-W462 PolarHBondContact O-N 2.8Å
461	P	29.7	Very low	40.1	Very low	127 Å²	127	106 Å²	106	83%	0.825	59%	0.585	S	S	*	*			trans	-70.2	99.9	-179.7	27.1	-31.5	0	0	0	109.3
462	W	24.5	Very low	38	Very low	217 Å²	217	109.9 Å²	109.9	82%	0.822	61%	0.613	S	S	*	*			trans	-115.9	129.1	150.8	-72.4	96.6	0	0	0	107.2	K460 V464	K460-W462 PolarHBondContact O-N 2.8Å; W462-V464 PolarHBondContact O-N 3.27Å
463	T	21.5	Very low	36.1	Very low	142 Å²	142	115.7 Å²	115.7	87%	0.871	64%	0.636	S	S	*	*			trans	-53.1	116.3	170.6	28.8	0	0	0	0	109.9
464	V	24	Very low	33.8	Very low	128 Å²	128	124.9 Å²	124.9	78%	0.776	67%	0.67	S	S	*	*			trans	-131.8	120.1	165.9	-176.4	0	0	0	0	108.9	W462	W462-V464 PolarHBondContact O-N 3.27Å
465	S	21	Very low	32	Very low	117 Å²	117	128.2 Å²	128.2	82%	0.818	69%	0.685	S	S	*	*			trans	-64.1	139.2	175	-168.5	0	0	0	0	110.9	G467	S465-G467 PolarHBondContact O-N 3.16Å; S465-G467 VanDerWaalsContact O-N 3.17Å
466	V	20.8	Very low	30	Very low	142 Å²	142	134.3 Å²	134.3	86%	0.861	72%	0.717	S	S	*	*			trans	-74.9	101.6	-178.6	-170	0	0	0	0	108.9
467	G	21.7	Very low	28.3	Very low	70 Å²	70	134 Å²	134	72%	0.722	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-90.9	126.3	168.3	0	0	0	0	0	110.7	S465	S465-G467 PolarHBondContact O-N 3.16Å; S465-G467 VanDerWaalsContact O-N 3.17Å
468	Q	21.3	Very low	27	Very low	192 Å²	192	140.2 Å²	140.2	90%	0.897	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-60.8	129.1	-179.7	-122.4	174	-11.5	0	0	112
469	A	20.8	Very low	25.8	Very low	86 Å²	86	142 Å²	142	71%	0.711	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-79.4	120.3	175.5	0	0	0	0	0	111.1
470	T	21.2	Very low	24.5	Very low	144 Å²	144	145.3 Å²	145.3	88%	0.883	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-100.1	130.1	167	7.5	0	0	0	0	110.6
471	F	25.9	Very low	23.7	Very low	183 Å²	183	150.3 Å²	150.3	80%	0.803	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.6	134.7	-175.2	-71.5	-98.3	0	0	0	111.8
472	S	25.8	Very low	23.9	Very low	105 Å²	105	152.8 Å²	152.8	73%	0.734	80%	0.801	S	S	*	*			trans	-111.6	94	152.2	147.9	0	0	0	0	107.6	R474	S472-R474 PolarHBondContact O-N 3.21Å
473	K	24.4	Very low	24.7	Very low	180 Å²	180	146.2 Å²	146.2	78%	0.783	79%	0.789	S	S	*	*			trans	-60.3	102	164	-85.4	-178.6	174.7	176.6	0	108.3
474	R	24.7	Very low	26.3	Very low	225 Å²	225	145.1 Å²	145.1	85%	0.849	79%	0.786	S	S	*	*			trans	-94.2	100.3	149.7	-81.2	-166.4	178.3	-171.5	0.6	107.6	S472 L476	S472-R474 PolarHBondContact O-N 3.21Å; R474-L476 PolarHBondContact O-N 3.03Å; R474-L476 VanDerWaalsContact O-N 3.14Å
475	N	25	Very low	28.4	Very low	125 Å²	125	143.3 Å²	143.3	67%	0.668	77%	0.767	S	S	*	*			trans	-54.7	113.4	165.7	-81.3	-15.7	0	0	0	108.5	T477	N475-T477 HydrophobicContact CB-CG2 4.4Å; N475-T477 PolarHBondContact O-N 3.06Å; N475-T477 VanDerWaalsContact O-N 3.14Å
476	L	24.7	Very low	30.6	Very low	149 Å²	149	144.1 Å²	144.1	78%	0.78	76%	0.757	S	S	*	*			trans	-81.6	79.4	160.7	-73.2	169.9	0	0	0	107.3	R474 K478	R474-L476 PolarHBondContact O-N 3.03Å; R474-L476 VanDerWaalsContact O-N 3.14Å; L476-K478 PolarHBondContact O-N 3.01Å
477	T	22.6	Very low	32.9	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	74%	0.74	S	S	*	*			trans	-74.4	99.1	166	34.2	0	0	0	0	109.1	N475	N475-T477 HydrophobicContact CB-CG2 4.4Å; N475-T477 PolarHBondContact O-N 3.06Å; N475-T477 VanDerWaalsContact O-N 3.14Å
478	K	23.8	Very low	35.4	Very low	198 Å²	198	139.6 Å²	139.6	86%	0.861	72%	0.72	S	S	*	*			trans	166.1	114.8	135.8	-94.7	173.9	177.1	-179.4	0	109.1	L476 Q480	L476-K478 PolarHBondContact O-N 3.01Å; K478-Q480 PolarHBondContact O-N 3.17Å
479	A	25.1	Very low	37.9	Very low	103 Å²	103	132 Å²	132	85%	0.851	69%	0.687	S	S	*	*			trans	-54.2	122.6	171.4	0	0	0	0	0	111.5
480	Q	24.3	Very low	40.5	Very low	164 Å²	164	129.1 Å²	129.1	77%	0.766	66%	0.662	S	S	*	*			trans	-146.3	113.1	154.7	-74.6	-171.6	-31.9	0	0	107.3	K478 Y482	K478-Q480 PolarHBondContact O-N 3.17Å; Q480-Y482 PolarHBondContact O-N 2.7Å
481	Y	24.8	Very low	42.8	Very low	241 Å²	241	125.5 Å²	125.5	95%	0.945	64%	0.642	S	S	*	*			trans	7.8	93.5	162.1	-72.9	-94.4	0	0	0	115.5	S483	Y481-S483 PolarHBondContact O-N 3.26Å
482	Y	33.7	Very low	44.7	Very low	180 Å²	180	119.6 Å²	119.6	71%	0.706	62%	0.624	S	S	*	*			trans	-80.1	113.8	160.5	-75.6	-78.1	0	0	0	107.2	Q480 S484	Q480-Y482 PolarHBondContact O-N 2.7Å; Y482-S484 PolarHBondContact O-N 3.28Å
483	S	41	Very low	46.8	Very low	79 Å²	79	116.8 Å²	116.8	55%	0.552	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-49.6	122.4	158.7	51	0	0	0	0	107.9	Y481 Y485	Y481-S483 PolarHBondContact O-N 3.26Å; S483-Y485 PolarHBondContact O-N 3.09Å
484	S	56.3	Low	49.3	Very low	118 Å²	118	111.4 Å²	111.4	83%	0.825	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-60.7	122.2	169.2	51	0	0	0	0	108	Y482	Y482-S484 PolarHBondContact O-N 3.28Å
485	Y	66.9	Low	52	Low	91 Å²	91	102.2 Å²	102.2	36%	0.357	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-83.8	143.4	174	-75.1	-57.3	0	0	0	110.2	S483 P499 E502 D573 W574	S483-Y485 PolarHBondContact O-N 3.09Å; Y485-P499 HydrophobicContact CD1-CG 4.3Å; Y485-P499 HydrophobicContact CE1-CG 3.91Å; Y485-E502 HydrophobicContact CE2-CG 4.29Å; Y485-D573 WeakPolarHBondContact CA-OD2 3.24Å; Y485-D573 HydrophobicContact CD1-CB 3.54Å; Y485-D573 WeakPolarHBondContact CD1-OD2 3.42Å; Y485-D573 HydrophobicContact CE1-CB 4.35Å; Y485-D573 HydrophobicContact CG-CB 3.96Å; Y485-W574 AromaticContact CD2-NE1 3.58Å; Y485-W574 AromaticContact CG-NE1 3.84Å
486	E	68	Low	54.9	Low	134 Å²	134	96.3 Å²	96.3	63%	0.626	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-74.7	145.7	168.2	-72	-171.5	168.7	0	0	110.2	P572 D573 W574	E486-P572 HydrophobicContact CB-CB 4.01Å; E486-D573 PolarHBondContact N-OD2 2.96Å; E486-D573 PolarHBondContact O-N 3Å; E486-W574 PolarHBondContact O-N 3.12Å
487	C	69.6	Low	57.6	Low	74 Å²	74	89.6 Å²	89.6	50%	0.5	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	140.8	-173.2	-170.4	0	0	0	0	111.1	W574 L576	C487-W574 WeakPolarHBondContact CA-O 3.34Å; C487-W574 HydrophobicContact CB-CB 4.29Å; C487-L576 WeakPolarHBondContact SG-CD1 3.29Å; C487-L576 VanDerWaalsContact SG-CG 3.53Å
488	S	73	Confident	60.3	Low	43 Å²	43	84 Å²	84	30%	0.301	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	165.9	171.2	62.8	0	0	0	0	111	P572 W574 V575 L576	S488-P572 WeakPolarHBondContact OG-CG 3.2Å; S488-W574 PolarHBondContact N-O 2.81Å; S488-V575 CarbonylContact O-C 3.44Å; S488-V575 WeakPolarHBondContact O-CA 3.31Å; S488-L576 PolarHBondContact O-N 3.32Å
489	T	73.4	Confident	62.8	Low	32 Å²	32	75.6 Å²	75.6	20%	0.196	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140	175.2	61.8	0	0	0	0	110.4	L576 V586 I595 F597	T489-L576 WeakPolarHBondContact CA-O 3.31Å; T489-L576 HydrophobicContact CG2-CB 4.15Å; T489-L576 HydrophobicContact CG2-CD1 4.09Å; T489-V586 HydrophobicContact CG2-CG1 4.13Å; T489-I595 HydrophobicContact CG2-CD1 3.84Å; T489-F597 HydrophobicContact CG2-CE1 4.1Å
490	S	75.8	Confident	65.5	Low	26 Å²	26	76.8 Å²	76.8	18%	0.182	40%	0.402	C	S	.	.			trans	-139.2	114.9	175.1	178.3	0	0	0	0	111.9	S492 L576 G577 F581	S490-S492 PolarHBondContact O-N 3.46Å; S490-S492 PolarHBondContact OG-N 2.73Å; S490-S492 PolarHBondContact OG-OG 3.17Å; S490-L576 PolarHBondContact N-O 3.01Å; S490-G577 WeakPolarHBondContact O-CA 3.48Å; S490-F581 WeakPolarHBondContact O-CE2 3.1Å
491	S	69.5	Low	68.1	Low	68 Å²	68	76.5 Å²	76.5	48%	0.476	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-8.4	177.9	60.5	0	0	0	0	113.6
492	S	67	Low	71	Confident	59 Å²	59	66.5 Å²	66.5	41%	0.413	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-10.2	178.8	61.8	0	0	0	0	113.6	S490	S490-S492 PolarHBondContact O-N 3.46Å; S490-S492 PolarHBondContact OG-N 2.73Å; S490-S492 PolarHBondContact OG-OG 3.17Å
493	L	70	Confident	73.4	Confident	46 Å²	46	57.9 Å²	57.9	24%	0.241	33%	0.327	C	S	.	.			trans	-92.5	127.8	178.8	-71.9	177.5	0	0	0	111.2	F495 L497 V575 G577 E578	L493-F495 PolarHBondContact O-N 3.07Å; L493-L497 HydrophobicContact CD1-CD1 3.87Å; L493-L497 HydrophobicContact CD1-CG 4.26Å; L493-V575 HydrophobicContact CD1-CB 4.14Å; L493-V575 HydrophobicContact CD1-CG1 3.48Å; L493-V575 VanDerWaalsContact CD1-CG1 3.48Å; L493-G577 WeakPolarHBondContact O-CA 3.21Å; L493-E578 WeakPolarHBondContact O-CB 3.36Å; L493-E578 PolarHBondContact O-N 3.14Å
494	P	75.3	Confident	75.4	Confident	67 Å²	67	56.7 Å²	56.7	44%	0.435	31%	0.313	S	S	.	.	S	Bend	trans	-75.1	-7.8	175.3	25.6	-27.8	0	0	0	113.9
495	F	82.9	Confident	76.8	Confident	32 Å²	32	55.7 Å²	55.7	14%	0.14	29%	0.291	C	S	.	.	S	Bend	trans	-124.7	149.7	-175.3	-56.4	-82.5	0	0	0	111.6	L493 L497 L520 I552 A561 Q563 G577	L493-F495 PolarHBondContact O-N 3.07Å; F495-L497 HydrophobicContact CB-CD2 4.1Å; F495-L520 HydrophobicContact CE1-CD2 3.69Å; F495-L520 HydrophobicContact CE2-CD2 4.24Å; F495-L520 HydrophobicContact CZ-CD2 3.48Å; F495-L520 VanDerWaalsContact CZ-CD2 3.48Å; F495-I552 HydrophobicContact CD1-CD1 4.25Å; F495-I552 HydrophobicContact CE1-CD1 3.75Å; F495-I552 HydrophobicContact CZ-CD1 4.26Å; F495-A561 CarbonylContact C-O 3.57Å; F495-A561 WeakPolarHBondContact CA-O 3.32Å; F495-Q563 HydrophobicContact CB-CB 4.14Å; F495-Q563 HydrophobicContact CD1-CB 4.49Å; F495-Q563 HydrophobicContact CG-CB 4.26Å; F495-G577 WeakPolarHBondContact O-CA 3.2Å
496	I	84.1	Confident	77.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	121.4	157.2	-65	175	0	0	0	108.1	F536 I545 A561 F562 Q563 W574 V575 L576 P579	I496-F536 HydrophobicContact CD1-CE2 4.25Å; I496-F536 HydrophobicContact CD1-CZ 4.19Å; I496-F536 HydrophobicContact CG2-CE1 4.5Å; I496-F536 HydrophobicContact CG2-CZ 4.11Å; I496-I545 HydrophobicContact CD1-CG1 4.2Å; I496-A561 PolarHBondContact N-O 3.35Å; I496-F562 HydrophobicContact CB-CD1 3.77Å; I496-F562 HydrophobicContact CB-CE1 3.81Å; I496-F562 HydrophobicContact CD1-CE1 3.76Å; I496-F562 HydrophobicContact CD1-CZ 4.19Å; I496-F562 HydrophobicContact CG1-CE1 4.32Å; I496-F562 HydrophobicContact CG2-CD1 4Å; I496-F562 HydrophobicContact CG2-CE1 3.95Å; I496-F562 WeakPolarHBondContact O-CA 3.32Å; I496-Q563 PolarHBondContact O-N 3.33Å; I496-W574 HydrophobicContact CG2-CE3 3.8Å; I496-W574 HydrophobicContact CG2-CZ3 3.93Å; I496-V575 CarbonylContact C-O 3.57Å; I496-V575 WeakPolarHBondContact CA-O 3.46Å; I496-L576 HydrophobicContact CG2-CD2 4.16Å; I496-P579 HydrophobicContact CD1-CB 3.91Å; I496-P579 HydrophobicContact CD1-CG 4.41Å; I496-P579 HydrophobicContact CG1-CB 4.15Å; I496-P579 HydrophobicContact CG1-CG 4.15Å
497	L	82.1	Confident	78.7	Confident	9 Å²	9	46.2 Å²	46.2	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.8	174.5	-51.6	-176.3	0	0	0	109.7	L493 F495 Q563 N565 F568 W574 V575	L493-L497 HydrophobicContact CD1-CD1 3.87Å; L493-L497 HydrophobicContact CD1-CG 4.26Å; F495-L497 HydrophobicContact CB-CD2 4.1Å; L497-Q563 WeakPolarHBondContact CA-O 3.4Å; L497-Q563 HydrophobicContact CD2-CB 3.71Å; L497-Q563 HydrophobicContact CD2-CG 4.32Å; L497-N565 HydrophobicContact CB-CB 4.15Å; L497-F568 HydrophobicContact CD1-CD2 4.27Å; L497-F568 HydrophobicContact CD1-CE2 3.8Å; L497-W574 CarbonylContact O-C 3.59Å; L497-W574 VanDerWaalsContact O-CA 3.3Å; L497-W574 WeakPolarHBondContact O-CA 3.37Å; L497-W574 VanDerWaalsContact O-CE3 3.27Å; L497-V575 HydrophobicContact CB-CB 4.06Å; L497-V575 HydrophobicContact CB-CG2 4.35Å; L497-V575 HydrophobicContact CD1-CB 4.34Å; L497-V575 HydrophobicContact CD1-CG2 4.39Å; L497-V575 HydrophobicContact CG-CB 4.34Å; L497-V575 PolarHBondContact N-O 3.19Å; L497-V575 PolarHBondContact O-N 3.1Å
498	G	79.4	Confident	79.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	172.8	177.8	0	0	0	0	0	114	Q500 I503 Q563 N565 D573	G498-Q500 PolarHBondContact O-N 3.09Å; G498-I503 WeakPolarHBondContact O-CG1 3.48Å; G498-Q563 PolarHBondContact N-O 2.93Å; G498-Q563 VanDerWaalsContact N-O 3.16Å; G498-N565 WeakPolarHBondContact O-CB 3.35Å; G498-N565 PolarHBondContact O-N 2.82Å; G498-D573 WeakPolarHBondContact CA-O 3.46Å
499	P	76.9	Confident	80.3	Confident	22 Å²	22	54.7 Å²	54.7	14%	0.143	28%	0.275	C	S	.	.			trans	-55.2	138.1	178.6	-26.1	36.1	0	0	0	111.6	Y485 K501 E502 I503 D573 W574	Y485-P499 HydrophobicContact CD1-CG 4.3Å; Y485-P499 HydrophobicContact CE1-CG 3.91Å; P499-K501 PolarHBondContact O-N 3.2Å; P499-K501 VanDerWaalsContact O-N 3.1Å; P499-E502 HydrophobicContact CB-CG 4.4Å; P499-E502 PolarHBondContact O-N 2.8Å; P499-I503 PolarHBondContact O-N 2.04Å; P499-D573 WeakPolarHBondContact CD-O 3.3Å; P499-D573 HydrophobicContact CG-CB 3.92Å; P499-W574 VanDerWaalsContact CD-CE2 3.45Å
500	Q	81.4	Confident	81	Confident	127 Å²	127	53.9 Å²	53.9	59%	0.593	27%	0.27	S	S	*	.	H	α-helix	trans	-50.6	-42.8	-176.5	175.1	174.8	2.3	0	0	112.7	G498 E502 M504 M564	G498-Q500 PolarHBondContact O-N 3.09Å; Q500-E502 PolarHBondContact O-N 3.44Å; Q500-M504 HydrophobicContact CG-CG 4.34Å; Q500-M504 WeakPolarHBondContact O-CB 3.41Å; Q500-M504 WeakPolarHBondContact O-CG 2.92Å; Q500-M504 PolarHBondContact O-N 3.35Å; Q500-M564 HydrophobicContact CB-CG 4.49Å; Q500-M564 HydrophobicContact CB-SD 4.36Å; Q500-M564 HydrophobicContact CG-CG 4.39Å; Q500-M564 HydrophobicContact CG-SD 3.72Å
501	K	79.5	Confident	81.6	Confident	159 Å²	159	60.8 Å²	60.8	69%	0.691	30%	0.296	S	S	*	.	H	α-helix	trans	-60.5	-43.4	179.5	-174.3	-178.3	176.4	-174.1	0	112.1	P499 R505	P499-K501 PolarHBondContact O-N 3.2Å; P499-K501 VanDerWaalsContact O-N 3.1Å; K501-R505 WeakPolarHBondContact O-CB 3.47Å; K501-R505 PolarHBondContact O-N 3.33Å; K501-R505 VanDerWaalsContact O-N 3.11Å
502	E	84.3	Confident	82.5	Confident	30 Å²	30	58.2 Å²	58.2	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-78	-42.3	-177.4	-59.6	-50.2	140.5	0	0	111.8	Y485 P499 Q500 M504 R505 I506 W574	Y485-E502 HydrophobicContact CE2-CG 4.29Å; P499-E502 HydrophobicContact CB-CG 4.4Å; P499-E502 PolarHBondContact O-N 2.8Å; Q500-E502 PolarHBondContact O-N 3.44Å; E502-M504 VanDerWaalsContact C-N 3.33Å; E502-M504 PolarHBondContact O-N 2.8Å; E502-R505 WeakPolarHBondContact O-CA 2.83Å; E502-R505 WeakPolarHBondContact O-CB 3.37Å; E502-R505 PolarHBondContact O-N 3Å; E502-R505 IonicContact OE2-NH1 2.94Å; E502-I506 WeakPolarHBondContact O-CG1 3.34Å; E502-I506 PolarHBondContact O-N 2.88Å; E502-W574 HydrophobicContact CB-CH2 4.08Å; E502-W574 HydrophobicContact CB-CZ2 3.71Å; E502-W574 HydrophobicContact CG-CZ2 4.27Å
503	I	85.8	Confident	83.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-43.2	175	-65.3	-70.2	0	0	0	110.9	G498 P499 R505 I506 A507 F521 F562 Q563 M564 W574	G498-I503 WeakPolarHBondContact O-CG1 3.48Å; P499-I503 PolarHBondContact O-N 2.04Å; I503-R505 VanDerWaalsContact C-N 3.26Å; I503-R505 PolarHBondContact O-N 2.82Å; I503-I506 PolarHBondContact O-N 2.85Å; I503-A507 WeakPolarHBondContact O-CB 3.35Å; I503-A507 PolarHBondContact O-N 2.97Å; I503-F521 HydrophobicContact CG2-CD2 4.45Å; I503-F521 HydrophobicContact CG2-CE2 3.46Å; I503-F521 VanDerWaalsContact CG2-CE2 3.46Å; I503-F521 HydrophobicContact CG2-CZ 3.68Å; I503-F562 HydrophobicContact CD1-CB 4.08Å; I503-F562 HydrophobicContact CD1-CD1 4.07Å; I503-Q563 WeakPolarHBondContact CG1-O 3.41Å; I503-M564 HydrophobicContact CB-CG 4.38Å; I503-M564 HydrophobicContact CG2-CG 4.06Å; I503-W574 HydrophobicContact CD1-CH2 4.13Å; I503-W574 HydrophobicContact CD1-CZ3 3.82Å
504	M	83.3	Confident	83.9	Confident	54 Å²	54	65 Å²	65	27%	0.266	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-30.9	174.9	-75.3	-65.3	-74.2	0	0	112.7	Q500 E502 R508 F521 M564	Q500-M504 HydrophobicContact CG-CG 4.34Å; Q500-M504 WeakPolarHBondContact O-CB 3.41Å; Q500-M504 WeakPolarHBondContact O-CG 2.92Å; Q500-M504 PolarHBondContact O-N 3.35Å; E502-M504 VanDerWaalsContact C-N 3.33Å; E502-M504 PolarHBondContact O-N 2.8Å; M504-R508 WeakPolarHBondContact O-CB 3.41Å; M504-R508 WeakPolarHBondContact O-CG 3.35Å; M504-R508 PolarHBondContact O-N 2.8Å; M504-R508 VanDerWaalsContact O-N 3.08Å; M504-R508 PolarHBondContact O-NE 2.64Å; M504-R508 VanDerWaalsContact O-NE 3.09Å; M504-F521 HydrophobicContact SD-CE1 3.78Å; M504-F521 HydrophobicContact SD-CZ 3.86Å; M504-M564 HydrophobicContact CG-CE 3.63Å; M504-M564 HydrophobicContact SD-CE 3.25Å; M504-M564 WeakPolarHBondContact SD-CE 3.2Å
505	R	85.1	Confident	83.7	Confident	97 Å²	97	64 Å²	64	37%	0.366	29%	0.288	S	S	.	.	H	α-helix	trans	-70	-46.7	174.6	-176.9	-176.8	-177.1	179.2	1.1	110.9	K501 E502 I503 R508 L509	K501-R505 WeakPolarHBondContact O-CB 3.47Å; K501-R505 PolarHBondContact O-N 3.33Å; K501-R505 VanDerWaalsContact O-N 3.11Å; E502-R505 WeakPolarHBondContact O-CA 2.83Å; E502-R505 WeakPolarHBondContact O-CB 3.37Å; E502-R505 PolarHBondContact O-N 3Å; E502-R505 IonicContact OE2-NH1 2.94Å; I503-R505 VanDerWaalsContact C-N 3.26Å; I503-R505 PolarHBondContact O-N 2.82Å; R505-R508 PolarHBondContact O-N 2.91Å; R505-L509 HydrophobicContact CG-CD1 4.24Å; R505-L509 WeakPolarHBondContact O-CG 3.35Å; R505-L509 PolarHBondContact O-N 2.87Å
506	I	87.5	Confident	82.8	Confident	23 Å²	23	67 Å²	67	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-52.2	175.2	-68.4	165.9	0	0	0	109.8	E502 I503 R508 L509 L510 V534 F562 W574	E502-I506 WeakPolarHBondContact O-CG1 3.34Å; E502-I506 PolarHBondContact O-N 2.88Å; I503-I506 PolarHBondContact O-N 2.85Å; I506-R508 VanDerWaalsContact C-N 3.31Å; I506-R508 PolarHBondContact O-N 2.97Å; I506-L509 PolarHBondContact O-N 3.04Å; I506-L509 VanDerWaalsContact O-N 3.12Å; I506-L510 HydrophobicContact CG2-CD1 3.76Å; I506-L510 HydrophobicContact CG2-CG 4.38Å; I506-L510 WeakPolarHBondContact O-CG 3.05Å; I506-L510 PolarHBondContact O-N 3.06Å; I506-V534 HydrophobicContact CD1-CG1 4.05Å; I506-V534 HydrophobicContact CG1-CG1 4.35Å; I506-V534 HydrophobicContact CG2-CG2 4.14Å; I506-F562 HydrophobicContact CG2-CD2 4.19Å; I506-F562 HydrophobicContact CG2-CE2 4.31Å; I506-F562 HydrophobicContact CG2-CG 4.41Å; I506-W574 HydrophobicContact CD1-CH2 3.85Å; I506-W574 HydrophobicContact CD1-CZ3 4.46Å
507	A	88	Confident	81.4	Confident	3 Å²	3	73 Å²	73	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-57.8	-42.3	179.6	0	0	0	0	0	112.4	I503 L510 K511 A512 F521 L560	I503-A507 WeakPolarHBondContact O-CB 3.35Å; I503-A507 PolarHBondContact O-N 2.97Å; A507-L510 CarbonylContact O-C 3.57Å; A507-L510 PolarHBondContact O-N 2.89Å; A507-K511 PolarHBondContact O-N 3.49Å; A507-K511 VanDerWaalsContact O-N 3.09Å; A507-A512 HydrophobicContact CB-CB 4.37Å; A507-A512 PolarHBondContact O-N 3.44Å; A507-F521 HydrophobicContact CB-CD1 3.33Å; A507-F521 HydrophobicContact CB-CE1 3.29Å; A507-F521 HydrophobicContact CB-CG 4.08Å; A507-F521 HydrophobicContact CB-CZ 4.02Å; A507-L560 HydrophobicContact CB-CD1 4.33Å
508	R	85.8	Confident	80.3	Confident	163 Å²	163	78.1 Å²	78.1	62%	0.615	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-43.7	175.1	-84	-179.7	-93.8	146.3	-10.6	112.9	M504 R505 I506 L510 K511	M504-R508 WeakPolarHBondContact O-CB 3.41Å; M504-R508 WeakPolarHBondContact O-CG 3.35Å; M504-R508 PolarHBondContact O-N 2.8Å; M504-R508 VanDerWaalsContact O-N 3.08Å; M504-R508 PolarHBondContact O-NE 2.64Å; M504-R508 VanDerWaalsContact O-NE 3.09Å; R505-R508 PolarHBondContact O-N 2.91Å; I506-R508 VanDerWaalsContact C-N 3.31Å; I506-R508 PolarHBondContact O-N 2.97Å; R508-L510 VanDerWaalsContact C-N 3.32Å; R508-L510 PolarHBondContact O-N 3.02Å; R508-K511 PolarHBondContact O-N 3.18Å; R508-K511 VanDerWaalsContact O-N 3.12Å
509	L	88.5	Confident	79.9	Confident	132 Å²	132	84.3 Å²	84.3	69%	0.691	39%	0.385	S	S	*	.	H	α-helix	trans	-65.8	-36.3	178.7	-73	171.3	0	0	0	112.2	R505 I506 K511	R505-L509 HydrophobicContact CG-CD1 4.24Å; R505-L509 WeakPolarHBondContact O-CG 3.35Å; R505-L509 PolarHBondContact O-N 2.87Å; I506-L509 PolarHBondContact O-N 3.04Å; I506-L509 VanDerWaalsContact O-N 3.12Å; L509-K511 PolarHBondContact O-N 2.85Å
510	L	89.6	Confident	79.9	Confident	15 Å²	15	84.7 Å²	84.7	8%	0.079	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.4	174.7	-61.6	178	0	0	0	113	I506 A507 R508 A512 I523 L531 V534 Y550 L560	I506-L510 HydrophobicContact CG2-CD1 3.76Å; I506-L510 HydrophobicContact CG2-CG 4.38Å; I506-L510 WeakPolarHBondContact O-CG 3.05Å; I506-L510 PolarHBondContact O-N 3.06Å; A507-L510 CarbonylContact O-C 3.57Å; A507-L510 PolarHBondContact O-N 2.89Å; R508-L510 VanDerWaalsContact C-N 3.32Å; R508-L510 PolarHBondContact O-N 3.02Å; L510-A512 PolarHBondContact O-N 2.8Å; L510-A512 VanDerWaalsContact O-N 3.12Å; L510-I523 HydrophobicContact CB-CD1 4.32Å; L510-I523 WeakPolarHBondContact O-CD1 3.41Å; L510-L531 HydrophobicContact CD2-CB 4.43Å; L510-L531 HydrophobicContact CD2-CD2 4.37Å; L510-V534 HydrophobicContact CD1-CG2 4.13Å; L510-Y550 HydrophobicContact CD1-CE2 3.96Å; L510-L560 HydrophobicContact CB-CD1 4.3Å; L510-L560 HydrophobicContact CD1-CD1 3.97Å; L510-L560 HydrophobicContact CD1-CD2 3.86Å
511	K	87.8	Confident	80	Confident	171 Å²	171	78.8 Å²	78.8	74%	0.743	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	24.9	-177.8	-55	176.7	-178.1	172.9	0	114.3	A507 R508 L509	A507-K511 PolarHBondContact O-N 3.49Å; A507-K511 VanDerWaalsContact O-N 3.09Å; R508-K511 PolarHBondContact O-N 3.18Å; R508-K511 VanDerWaalsContact O-N 3.12Å; L509-K511 PolarHBondContact O-N 2.85Å
512	A	89.3	Confident	80.2	Confident	13 Å²	13	73.8 Å²	73.8	11%	0.107	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-79.1	144.9	177.6	0	0	0	0	0	111.7	A507 L510 F521 Y522 I523 L560	A507-A512 HydrophobicContact CB-CB 4.37Å; A507-A512 PolarHBondContact O-N 3.44Å; L510-A512 PolarHBondContact O-N 2.8Å; L510-A512 VanDerWaalsContact O-N 3.12Å; A512-F521 HydrophobicContact CB-CB 4.15Å; A512-Y522 CarbonylContact C-O 3.44Å; A512-Y522 VanDerWaalsContact CA-O 3.3Å; A512-Y522 WeakPolarHBondContact CA-O 3.03Å; A512-Y522 WeakPolarHBondContact CB-O 3.47Å; A512-I523 HydrophobicContact CB-CB 4.29Å; A512-L560 HydrophobicContact CB-CD1 3.26Å; A512-L560 HydrophobicContact CB-CG 3.75Å
513	K	82.1	Confident	80.3	Confident	167 Å²	167	73.1 Å²	73.1	73%	0.726	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.1	179.7	-65.6	-178.3	-178.6	177.3	0	109.8	F521 Y522	K513-F521 WeakPolarHBondContact O-CA 3.42Å; K513-Y522 PolarHBondContact N-O 3.3Å; K513-Y522 PolarHBondContact O-N 3.32Å
514	Y	82.8	Confident	80.2	Confident	81 Å²	81	77.2 Å²	77.2	32%	0.318	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.3	175.1	-176.7	-118.8	0	0	0	110.6	P516 R519 F521 M564	Y514-P516 HydrophobicContact CD1-CB 4.43Å; Y514-P516 HydrophobicContact CE1-CB 3.94Å; Y514-R519 HydrophobicContact CE2-CB 4.48Å; Y514-F521 AromaticContact CD2-CD1 3.86Å; Y514-F521 HydrophobicContact CD2-CD1 3.86Å; Y514-F521 HydrophobicContact CD2-CD2 4.24Å; Y514-F521 AromaticContact CD2-CE1 3.51Å; Y514-F521 HydrophobicContact CD2-CE1 3.51Å; Y514-F521 AromaticContact CD2-CE2 3.91Å; Y514-F521 HydrophobicContact CD2-CE2 3.91Å; Y514-F521 HydrophobicContact CD2-CG 4.22Å; Y514-F521 AromaticContact CD2-CZ 3.54Å; Y514-F521 HydrophobicContact CD2-CZ 3.54Å; Y514-F521 HydrophobicContact CE2-CE2 4.28Å; Y514-F521 HydrophobicContact CE2-CZ 4.14Å; Y514-F521 HydrophobicContact CG-CD1 4.3Å; Y514-F521 AromaticContact CG-CE1 3.88Å; Y514-F521 HydrophobicContact CG-CE1 3.88Å; Y514-F521 HydrophobicContact CG-CZ 4.26Å; Y514-M564 HydrophobicContact CD1-CE 4.4Å; Y514-M564 HydrophobicContact CD2-CE 4.01Å; Y514-M564 HydrophobicContact CE1-CE 4.14Å; Y514-M564 HydrophobicContact CE2-CE 3.73Å; Y514-M564 HydrophobicContact CG-CE 4.33Å
515	N	70.9	Confident	80.2	Confident	45 Å²	45	76.1 Å²	76.1	24%	0.241	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	111.8	167.9	-171	-34.2	0	0	0	109.1	L517 Y518 R519 L520 Y522	N515-L517 VanDerWaalsContact C-N 3.29Å; N515-L517 PolarHBondContact O-N 2.87Å; N515-L517 VanDerWaalsContact OD1-CB 3.25Å; N515-L517 WeakPolarHBondContact OD1-CB 3.42Å; N515-L517 PolarHBondContact OD1-N 2.7Å; N515-Y518 WeakPolarHBondContact ND2-CD2 3.32Å; N515-Y518 PolarHBondContact OD1-N 2.94Å; N515-R519 VanDerWaalsContact O-CA 3.24Å; N515-R519 WeakPolarHBondContact O-CA 3.49Å; N515-R519 PolarHBondContact O-N 2.86Å; N515-L520 PolarHBondContact N-O 2.95Å; N515-L520 PolarHBondContact O-N 2.82Å; N515-Y522 HydrophobicContact CB-CD2 3.77Å; N515-Y522 HydrophobicContact CB-CE2 3.34Å
516	P	65.6	Low	80.2	Confident	97 Å²	97	77.7 Å²	77.7	63%	0.63	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-26	-179.1	28	-34.2	0	0	0	113.4	Y514	Y514-P516 HydrophobicContact CD1-CB 4.43Å; Y514-P516 HydrophobicContact CE1-CB 3.94Å
517	L	53.8	Low	80	Confident	125 Å²	125	79.1 Å²	79.1	65%	0.654	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-46.8	179.9	-176.3	66.3	0	0	0	111	N515	N515-L517 VanDerWaalsContact C-N 3.29Å; N515-L517 PolarHBondContact O-N 2.87Å; N515-L517 VanDerWaalsContact OD1-CB 3.25Å; N515-L517 WeakPolarHBondContact OD1-CB 3.42Å; N515-L517 PolarHBondContact OD1-N 2.7Å
518	Y	59.5	Low	79.7	Confident	117 Å²	117	80.4 Å²	80.4	46%	0.459	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-8.5	-180	-57.1	-61.2	0	0	0	113.6	Y412 N515 L520 Y522	Y412-Y518 PolarHBondContact OH-O 2.81Å; N515-Y518 WeakPolarHBondContact ND2-CD2 3.32Å; N515-Y518 PolarHBondContact OD1-N 2.94Å; Y518-L520 WeakPolarHBondContact O-CG 3.16Å; Y518-L520 PolarHBondContact O-N 2.85Å; Y518-Y522 VanDerWaalsContact CD2-OH 3.32Å; Y518-Y522 WeakPolarHBondContact CD2-OH 3.31Å
519	R	70	Confident	79.5	Confident	129 Å²	129	82.5 Å²	82.5	49%	0.487	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	38	-174	-53.3	-178.7	-179.7	-179.8	1.9	113.1	Y514 N515 Q563	Y514-R519 HydrophobicContact CE2-CB 4.48Å; N515-R519 VanDerWaalsContact O-CA 3.24Å; N515-R519 WeakPolarHBondContact O-CA 3.49Å; N515-R519 PolarHBondContact O-N 2.86Å; R519-Q563 PolarHBondContact O-NE2 3.3Å; R519-Q563 VanDerWaalsContact O-NE2 3.13Å
520	L	78.4	Confident	79.4	Confident	31 Å²	31	81.5 Å²	81.5	16%	0.162	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	158	-179.5	-67.5	173.6	0	0	0	110.6	F495 N515 Y518 Y522 L559	F495-L520 HydrophobicContact CE1-CD2 3.69Å; F495-L520 HydrophobicContact CE2-CD2 4.24Å; F495-L520 HydrophobicContact CZ-CD2 3.48Å; F495-L520 VanDerWaalsContact CZ-CD2 3.48Å; N515-L520 PolarHBondContact N-O 2.95Å; N515-L520 PolarHBondContact O-N 2.82Å; Y518-L520 WeakPolarHBondContact O-CG 3.16Å; Y518-L520 PolarHBondContact O-N 2.85Å; L520-Y522 HydrophobicContact CB-CE2 4.08Å; L520-L559 HydrophobicContact CD1-CD1 4.21Å
521	F	82.5	Confident	79.4	Confident	2 Å²	2	82 Å²	82	1%	0.009	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.5	175.1	-64.8	-88.9	0	0	0	110.3	I503 M504 A507 A512 K513 Y514 L559 L560 F562 M564	I503-F521 HydrophobicContact CG2-CD2 4.45Å; I503-F521 HydrophobicContact CG2-CE2 3.46Å; I503-F521 VanDerWaalsContact CG2-CE2 3.46Å; I503-F521 HydrophobicContact CG2-CZ 3.68Å; M504-F521 HydrophobicContact SD-CE1 3.78Å; M504-F521 HydrophobicContact SD-CZ 3.86Å; A507-F521 HydrophobicContact CB-CD1 3.33Å; A507-F521 HydrophobicContact CB-CE1 3.29Å; A507-F521 HydrophobicContact CB-CG 4.08Å; A507-F521 HydrophobicContact CB-CZ 4.02Å; A512-F521 HydrophobicContact CB-CB 4.15Å; K513-F521 WeakPolarHBondContact O-CA 3.42Å; Y514-F521 AromaticContact CD2-CD1 3.86Å; Y514-F521 HydrophobicContact CD2-CD1 3.86Å; Y514-F521 HydrophobicContact CD2-CD2 4.24Å; Y514-F521 AromaticContact CD2-CE1 3.51Å; Y514-F521 HydrophobicContact CD2-CE1 3.51Å; Y514-F521 AromaticContact CD2-CE2 3.91Å; Y514-F521 HydrophobicContact CD2-CE2 3.91Å; Y514-F521 HydrophobicContact CD2-CG 4.22Å; Y514-F521 AromaticContact CD2-CZ 3.54Å; Y514-F521 HydrophobicContact CD2-CZ 3.54Å; Y514-F521 HydrophobicContact CE2-CE2 4.28Å; Y514-F521 HydrophobicContact CE2-CZ 4.14Å; Y514-F521 HydrophobicContact CG-CD1 4.3Å; Y514-F521 AromaticContact CG-CE1 3.88Å; Y514-F521 HydrophobicContact CG-CE1 3.88Å; Y514-F521 HydrophobicContact CG-CZ 4.26Å; F521-L559 CarbonylContact O-C 3.58Å; F521-L559 VanDerWaalsContact O-CA 3.28Å; F521-L559 WeakPolarHBondContact O-CA 3.47Å; F521-L560 HydrophobicContact CB-CB 3.98Å; F521-L560 HydrophobicContact CB-CD1 4.08Å; F521-L560 HydrophobicContact CB-CG 4.18Å; F521-L560 PolarHBondContact O-N 2.99Å; F521-F562 VanDerWaalsContact CD2-O 3.25Å; F521-F562 WeakPolarHBondContact CD2-O 3.12Å; F521-M564 HydrophobicContact CE1-CE 4.48Å; F521-M564 HydrophobicContact CE2-CE 4.43Å; F521-M564 HydrophobicContact CZ-CE 3.67Å
522	Y	83.2	Confident	79.5	Confident	55 Å²	55	76.7 Å²	76.7	22%	0.216	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	141.2	178.3	-63.6	-94.7	0	0	0	109.8	A512 K513 N515 Y518 L520 M557 L559	A512-Y522 CarbonylContact C-O 3.44Å; A512-Y522 VanDerWaalsContact CA-O 3.3Å; A512-Y522 WeakPolarHBondContact CA-O 3.03Å; A512-Y522 WeakPolarHBondContact CB-O 3.47Å; K513-Y522 PolarHBondContact N-O 3.3Å; K513-Y522 PolarHBondContact O-N 3.32Å; N515-Y522 HydrophobicContact CB-CD2 3.77Å; N515-Y522 HydrophobicContact CB-CE2 3.34Å; Y518-Y522 VanDerWaalsContact CD2-OH 3.32Å; Y518-Y522 WeakPolarHBondContact CD2-OH 3.31Å; L520-Y522 HydrophobicContact CB-CE2 4.08Å; Y522-M557 HydrophobicContact CD1-CE 3.85Å; Y522-M557 HydrophobicContact CE1-CE 3.26Å; Y522-L559 HydrophobicContact CD1-CD2 3.37Å; Y522-L559 HydrophobicContact CD2-CD2 4.43Å; Y522-L559 HydrophobicContact CE1-CD2 3.26Å; Y522-L559 HydrophobicContact CE2-CD2 4.32Å; Y522-L559 HydrophobicContact CG-CD2 3.99Å
523	I	86.9	Confident	79.6	Confident	16 Å²	16	78.3 Å²	78.3	8%	0.082	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.6	176.9	-167	163.4	0	0	0	109.5	L510 A512 C525 L531 I551 C558 L560	L510-I523 HydrophobicContact CB-CD1 4.32Å; L510-I523 WeakPolarHBondContact O-CD1 3.41Å; A512-I523 HydrophobicContact CB-CB 4.29Å; I523-C525 PolarHBondContact O-N 3.24Å; I523-L531 HydrophobicContact CD1-CD1 3.7Å; I523-L531 HydrophobicContact CD1-CD2 3.69Å; I523-L531 HydrophobicContact CD1-CG 4.35Å; I523-I551 HydrophobicContact CG2-CD1 3.79Å; I523-C558 HydrophobicContact CG2-CB 3.82Å; I523-C558 PolarHBondContact N-O 2.96Å; I523-C558 WeakPolarHBondContact O-CB 3.49Å; I523-L560 HydrophobicContact CB-CD2 4.5Å; I523-L560 HydrophobicContact CD1-CD2 4.02Å; I523-L560 HydrophobicContact CG2-CD2 4.24Å
524	N	85	Confident	79.9	Confident	85 Å²	85	71.1 Å²	71.1	46%	0.455	37%	0.365	S	S	.	.			trans	-68.6	129.2	174	-172.5	1.4	0	0	0	109.3	D526 D527	N524-D526 PolarHBondContact O-N 3.42Å; N524-D526 PolarHBondContact OD1-N 3.46Å; N524-D527 HydrophobicContact CB-CB 4.48Å; N524-D527 WeakPolarHBondContact CB-OD2 3.21Å; N524-D527 WeakPolarHBondContact O-CB 3Å; N524-D527 PolarHBondContact O-N 3.11Å; N524-D527 VanDerWaalsContact O-N 3.12Å
525	C	82.6	Confident	80.1	Confident	32 Å²	32	74.3 Å²	74.3	22%	0.216	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-61.8	-28.6	179.9	-69.9	0	0	0	0	113.5	I523 D527 C558	I523-C525 PolarHBondContact O-N 3.24Å; C525-D527 VanDerWaalsContact C-N 3.25Å; C525-D527 PolarHBondContact O-N 3.45Å; C525-C558 WeakPolarHBondContact CA-SG 3.35Å; C525-C558 HydrophobicContact CB-CB 4.06Å; C525-C558 WeakPolarHBondContact CB-SG 3.26Å; C525-C558 WeakPolarHBondContact SG-CB 3.43Å; C525-C558 PolarHBondContact SG-N 3.1Å; C525-C558 CovalentContact SG-SG 2.03Å; C525-C558 PolarHBondContact SG-SG 3.02Å
526	D	85.2	Confident	80.7	Confident	130 Å²	130	73.5 Å²	73.5	70%	0.695	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-70.3	-23.9	178.2	-61.9	-36.9	0	0	0	112.6	N524 E528	N524-D526 PolarHBondContact O-N 3.42Å; N524-D526 PolarHBondContact OD1-N 3.46Å; D526-E528 PolarHBondContact O-N 3.49Å
527	D	83.4	Confident	81.1	Confident	52 Å²	52	75 Å²	75	28%	0.278	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-74.1	-15.7	-177.3	-68.4	-18	0	0	0	112	N524 C525 K529 T530 L531	N524-D527 HydrophobicContact CB-CB 4.48Å; N524-D527 WeakPolarHBondContact CB-OD2 3.21Å; N524-D527 WeakPolarHBondContact O-CB 3Å; N524-D527 PolarHBondContact O-N 3.11Å; N524-D527 VanDerWaalsContact O-N 3.12Å; C525-D527 VanDerWaalsContact C-N 3.25Å; C525-D527 PolarHBondContact O-N 3.45Å; D527-K529 VanDerWaalsContact C-N 3.27Å; D527-K529 PolarHBondContact O-N 3.46Å; D527-K529 VanDerWaalsContact O-N 3.13Å; D527-T530 WeakPolarHBondContact O-CA 3.37Å; D527-T530 WeakPolarHBondContact O-CB 3.41Å; D527-T530 PolarHBondContact O-N 3.37Å; D527-T530 PolarHBondContact O-OG1 3.19Å; D527-L531 HydrophobicContact CB-CD2 4.21Å; D527-L531 WeakPolarHBondContact O-CG 3.37Å; D527-L531 PolarHBondContact O-N 3.46Å
528	E	81.2	Confident	81.7	Confident	31 Å²	31	70.8 Å²	70.8	15%	0.145	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-50.8	-42.9	-172.8	-177.8	170.8	120.1	0	0	113.5	D526 T530 L531 P547 I551 R553	D526-E528 PolarHBondContact O-N 3.49Å; E528-T530 PolarHBondContact O-N 3.4Å; E528-L531 PolarHBondContact O-N 2.84Å; E528-P547 HydrophobicContact CG-CB 4.37Å; E528-I551 HydrophobicContact CG-CG1 4.23Å; E528-I551 VanDerWaalsContact OE2-CG2 3.26Å; E528-I551 WeakPolarHBondContact OE2-CG2 2.89Å; E528-R553 VanDerWaalsContact CD-CZ 3.45Å; E528-R553 IonicContact OE1-CZ 3.71Å; E528-R553 VanDerWaalsContact OE1-CZ 3.31Å; E528-R553 IonicContact OE1-NH1 2.61Å; E528-R553 PolarHBondContact OE1-NH1 2.84Å; E528-R553 IonicContact OE1-NH2 2.68Å; E528-R553 PolarHBondContact OE1-NH2 2.54Å; E528-R553 IonicContact OE2-CZ 3Å; E528-R553 IonicContact OE2-NE 2.72Å; E528-R553 IonicContact OE2-NH1 2.66Å; E528-R553 PolarHBondContact OE2-NH1 2.71Å; E528-R553 IonicContact OE2-NH2 3.41Å; E528-R553 PolarHBondContact OE2-NH2 2.02Å
529	K	82.3	Confident	82	Confident	207 Å²	207	74.2 Å²	74.2	90%	0.9	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17.8	179.9	-65.4	-179.1	-179.3	175.9	0	113.5	D527	D527-K529 VanDerWaalsContact C-N 3.27Å; D527-K529 PolarHBondContact O-N 3.46Å; D527-K529 VanDerWaalsContact O-N 3.13Å
530	T	85.9	Confident	82	Confident	111 Å²	111	76 Å²	76	68%	0.681	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-102.2	-7	-179.1	71.7	0	0	0	0	113	D527 E528	D527-T530 WeakPolarHBondContact O-CA 3.37Å; D527-T530 WeakPolarHBondContact O-CB 3.41Å; D527-T530 PolarHBondContact O-N 3.37Å; D527-T530 PolarHBondContact O-OG1 3.19Å; E528-T530 PolarHBondContact O-N 3.4Å
531	L	90.1	Very high	81.7	Confident	24 Å²	24	78.7 Å²	78.7	13%	0.126	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-74.2	143.3	-177	-54.8	179	0	0	0	111.2	L510 I523 D527 E528 P547 Y550 I551	L510-L531 HydrophobicContact CD2-CB 4.43Å; L510-L531 HydrophobicContact CD2-CD2 4.37Å; I523-L531 HydrophobicContact CD1-CD1 3.7Å; I523-L531 HydrophobicContact CD1-CD2 3.69Å; I523-L531 HydrophobicContact CD1-CG 4.35Å; D527-L531 HydrophobicContact CB-CD2 4.21Å; D527-L531 WeakPolarHBondContact O-CG 3.37Å; D527-L531 PolarHBondContact O-N 3.46Å; E528-L531 PolarHBondContact O-N 2.84Å; L531-P547 HydrophobicContact CB-CB 4.03Å; L531-P547 HydrophobicContact CB-CG 3.85Å; L531-P547 WeakPolarHBondContact O-CG 3.47Å; L531-Y550 VanDerWaalsContact CB-OH 3.23Å; L531-Y550 WeakPolarHBondContact CB-OH 3.27Å; L531-Y550 HydrophobicContact CD1-CE2 3.94Å; L531-I551 HydrophobicContact CD1-CD1 3.69Å; L531-I551 HydrophobicContact CD1-CG1 4.05Å
532	A	88.3	Confident	81.6	Confident	60 Å²	60	81 Å²	81	50%	0.496	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-87.3	151.1	176.2	0	0	0	0	0	111	Y550	A532-Y550 PolarHBondContact O-OH 3.39Å
533	P	91.4	Very high	81.6	Confident	47 Å²	47	79.4 Å²	79.4	31%	0.305	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-57.9	142.7	168.6	-22	32.5	0	0	0	111.8	W535 P544 I545	P533-W535 VanDerWaalsContact O-CD1 3.29Å; P533-P544 HydrophobicContact CB-CB 3.81Å; P533-I545 CarbonylContact C-O 3.55Å; P533-I545 VanDerWaalsContact CA-O 3.3Å; P533-I545 WeakPolarHBondContact CA-O 3.4Å
534	V	89.3	Confident	81.8	Confident	17 Å²	17	79.9 Å²	79.9	10%	0.103	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118	171.5	-177.5	0	0	0	0	108.1	I506 L510 F536 I545 Y550 F562	I506-V534 HydrophobicContact CD1-CG1 4.05Å; I506-V534 HydrophobicContact CG1-CG1 4.35Å; I506-V534 HydrophobicContact CG2-CG2 4.14Å; L510-V534 HydrophobicContact CD1-CG2 4.13Å; V534-F536 HydrophobicContact CB-CE2 4.39Å; V534-F536 HydrophobicContact CG1-CD2 4.45Å; V534-F536 HydrophobicContact CG1-CE2 3.8Å; V534-F536 HydrophobicContact CG1-CZ 4.28Å; V534-I545 PolarHBondContact N-O 2.89Å; V534-I545 PolarHBondContact O-N 3.31Å; V534-Y550 HydrophobicContact CG2-CD1 4.16Å; V534-Y550 HydrophobicContact CG2-CE1 3.81Å; V534-F562 HydrophobicContact CB-CZ 3.98Å; V534-F562 HydrophobicContact CG1-CE1 4.46Å; V534-F562 HydrophobicContact CG1-CZ 4.02Å; V534-F562 HydrophobicContact CG2-CE2 3.91Å; V534-F562 HydrophobicContact CG2-CZ 3.86Å
535	W	87.1	Confident	81.9	Confident	148 Å²	148	75.8 Å²	75.8	56%	0.561	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	128	-175.2	-67.7	83.5	0	0	0	111.5	P533 A542 P544	P533-W535 VanDerWaalsContact O-CD1 3.29Å; W535-A542 HydrophobicContact CE3-CB 3.69Å; W535-A542 HydrophobicContact CZ3-CB 3.92Å; W535-P544 HydrophobicContact CD2-CB 3.89Å; W535-P544 HydrophobicContact CE3-CB 3.85Å; W535-P544 HydrophobicContact CE3-CG 4.15Å; W535-P544 HydrophobicContact CH2-CB 3.97Å; W535-P544 HydrophobicContact CH2-CG 3.82Å; W535-P544 HydrophobicContact CZ2-CB 3.96Å; W535-P544 HydrophobicContact CZ2-CG 4.27Å; W535-P544 HydrophobicContact CZ3-CB 3.92Å; W535-P544 VanDerWaalsContact CZ3-CD 3.47Å; W535-P544 HydrophobicContact CZ3-CG 3.76Å
536	F	82.8	Confident	82.3	Confident	27 Å²	27	76.1 Å²	76.1	12%	0.118	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127	171.2	-70.8	-95	0	0	0	109.1	I496 V534 L543 I545 F562 W574 L576 W580	I496-F536 HydrophobicContact CD1-CE2 4.25Å; I496-F536 HydrophobicContact CD1-CZ 4.19Å; I496-F536 HydrophobicContact CG2-CE1 4.5Å; I496-F536 HydrophobicContact CG2-CZ 4.11Å; V534-F536 HydrophobicContact CB-CE2 4.39Å; V534-F536 HydrophobicContact CG1-CD2 4.45Å; V534-F536 HydrophobicContact CG1-CE2 3.8Å; V534-F536 HydrophobicContact CG1-CZ 4.28Å; F536-L543 PolarHBondContact N-O 3.44Å; F536-L543 PolarHBondContact O-N 3Å; F536-I545 HydrophobicContact CD2-CG1 4.02Å; F536-I545 HydrophobicContact CE2-CG1 3.91Å; F536-F562 HydrophobicContact CE2-CE1 4.3Å; F536-F562 AromaticContact CZ-CE1 3.95Å; F536-F562 HydrophobicContact CZ-CE1 3.95Å; F536-W574 HydrophobicContact CE1-CD2 4.2Å; F536-W574 AromaticContact CE1-CE3 3.72Å; F536-W574 HydrophobicContact CE1-CE3 3.72Å; F536-W574 HydrophobicContact CE1-CH2 4.13Å; F536-W574 AromaticContact CE1-CZ3 3.68Å; F536-W574 HydrophobicContact CE1-CZ3 3.68Å; F536-W574 HydrophobicContact CZ-CE3 4.36Å; F536-W574 HydrophobicContact CZ-CZ3 4Å; F536-L576 HydrophobicContact CD1-CD2 4.39Å; F536-L576 HydrophobicContact CE1-CD2 4.18Å; F536-W580 HydrophobicContact CB-CH2 3.94Å; F536-W580 HydrophobicContact CB-CZ3 3.74Å; F536-W580 HydrophobicContact CD1-CZ3 4.32Å; F536-W580 HydrophobicContact CD2-CE3 4.43Å; F536-W580 AromaticContact CD2-CZ3 3.7Å; F536-W580 HydrophobicContact CD2-CZ3 3.7Å; F536-W580 HydrophobicContact CE2-CZ3 4.4Å; F536-W580 HydrophobicContact CG-CH2 4.33Å; F536-W580 AromaticContact CG-CZ3 3.65Å; F536-W580 HydrophobicContact CG-CZ3 3.65Å
537	N	73.6	Confident	82.5	Confident	128 Å²	128	70.6 Å²	70.6	68%	0.684	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	107	173.8	-65	-22.9	0	0	0	108.2	V541	N537-V541 WeakPolarHBondContact CA-O 3.44Å
538	A	67.3	Low	82.6	Confident	37 Å²	37	72.4 Å²	72.4	31%	0.306	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	108.6	168.7	0	0	0	0	0	107.4	N540 V541 L543	A538-N540 PolarHBondContact O-N 3.46Å; A538-N540 VanDerWaalsContact O-N 3.12Å; A538-V541 PolarHBondContact N-O 3.31Å; A538-V541 PolarHBondContact O-N 2.64Å; A538-L543 HydrophobicContact CB-CD1 3.93Å
539	E	66.6	Low	83	Confident	190 Å²	190	71.3 Å²	71.3	89%	0.888	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	-114.7	-170.8	-55.8	-179.8	173.9	0	0	111.4
540	N	69	Low	83.3	Confident	167 Å²	167	61.4 Å²	61.4	89%	0.893	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	9	179.7	-66.6	-35.8	0	0	0	113.4	A538	A538-N540 PolarHBondContact O-N 3.46Å; A538-N540 VanDerWaalsContact O-N 3.12Å
541	V	73	Confident	83.4	Confident	87 Å²	87	56.8 Å²	56.8	53%	0.527	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.4	-176.9	-174.6	0	0	0	0	110.1	N537 A538 L543	N537-V541 WeakPolarHBondContact CA-O 3.44Å; A538-V541 PolarHBondContact N-O 3.31Å; A538-V541 PolarHBondContact O-N 2.64Å; V541-L543 HydrophobicContact CG1-CD2 3.89Å; V541-L543 HydrophobicContact CG1-CG 4.16Å
542	A	80.5	Confident	82.9	Confident	51 Å²	51	57.4 Å²	57.4	42%	0.421	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	118.6	174.4	0	0	0	0	0	110.1	W535	W535-A542 HydrophobicContact CE3-CB 3.69Å; W535-A542 HydrophobicContact CZ3-CB 3.92Å
543	L	82.6	Confident	82.1	Confident	20 Å²	20	61.4 Å²	61.4	11%	0.105	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	108.8	-175.3	-66.2	175.3	0	0	0	109.9	F536 A538 V541 W580 Y584 F597	F536-L543 PolarHBondContact N-O 3.44Å; F536-L543 PolarHBondContact O-N 3Å; A538-L543 HydrophobicContact CB-CD1 3.93Å; V541-L543 HydrophobicContact CG1-CD2 3.89Å; V541-L543 HydrophobicContact CG1-CG 4.16Å; L543-W580 HydrophobicContact CB-CH2 3.95Å; L543-W580 HydrophobicContact CD1-CH2 3.87Å; L543-W580 HydrophobicContact CD1-CZ2 3.82Å; L543-Y584 VanDerWaalsContact C-OH 3.26Å; L543-Y584 VanDerWaalsContact CA-OH 3.29Å; L543-Y584 WeakPolarHBondContact CA-OH 3.38Å; L543-Y584 HydrophobicContact CB-CE2 4.14Å; L543-Y584 WeakPolarHBondContact CB-OH 3.31Å; L543-Y584 HydrophobicContact CD2-CE1 4.03Å; L543-F597 HydrophobicContact CD1-CB 4.3Å; L543-F597 HydrophobicContact CD1-CD2 3.62Å; L543-F597 HydrophobicContact CD1-CE2 4.38Å; L543-F597 HydrophobicContact CD1-CG 4.29Å
544	P	90.1	Very high	80.8	Confident	26 Å²	26	63.9 Å²	63.9	17%	0.169	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	136.6	179.3	30.4	-33.1	0	0	0	112.8	P533 W535 Q583 Y584	P533-P544 HydrophobicContact CB-CB 3.81Å; W535-P544 HydrophobicContact CD2-CB 3.89Å; W535-P544 HydrophobicContact CE3-CB 3.85Å; W535-P544 HydrophobicContact CE3-CG 4.15Å; W535-P544 HydrophobicContact CH2-CB 3.97Å; W535-P544 HydrophobicContact CH2-CG 3.82Å; W535-P544 HydrophobicContact CZ2-CB 3.96Å; W535-P544 HydrophobicContact CZ2-CG 4.27Å; W535-P544 HydrophobicContact CZ3-CB 3.92Å; W535-P544 VanDerWaalsContact CZ3-CD 3.47Å; W535-P544 HydrophobicContact CZ3-CG 3.76Å; P544-Q583 VanDerWaalsContact O-CD 3.29Å; P544-Q583 VanDerWaalsContact O-CG 3.29Å; P544-Q583 WeakPolarHBondContact O-CG 3.16Å; P544-Y584 WeakPolarHBondContact CD-OH 3.12Å; P544-Y584 VanDerWaalsContact N-OH 3.09Å; P544-Y584 PolarHBondContact O-OH 3.23Å
545	I	88.2	Confident	79.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.9	157.2	-54.3	-57.4	0	0	0	108	I496 P533 V534 F536 N549 Y550 P579 W580 Q583 Y584	I496-I545 HydrophobicContact CD1-CG1 4.2Å; P533-I545 CarbonylContact C-O 3.55Å; P533-I545 VanDerWaalsContact CA-O 3.3Å; P533-I545 WeakPolarHBondContact CA-O 3.4Å; V534-I545 PolarHBondContact N-O 2.89Å; V534-I545 PolarHBondContact O-N 3.31Å; F536-I545 HydrophobicContact CD2-CG1 4.02Å; F536-I545 HydrophobicContact CE2-CG1 3.91Å; I545-N549 HydrophobicContact CG2-CB 3.9Å; I545-Y550 HydrophobicContact CB-CD1 4.38Å; I545-Y550 HydrophobicContact CG2-CD1 3.88Å; I545-Y550 WeakPolarHBondContact O-CD1 3.36Å; I545-Y550 VanDerWaalsContact O-CE1 3.31Å; I545-Y550 WeakPolarHBondContact O-CE1 3.47Å; I545-P579 HydrophobicContact CG2-CB 4.07Å; I545-W580 HydrophobicContact CD1-CD2 4.11Å; I545-W580 HydrophobicContact CD1-CE3 3.52Å; I545-W580 HydrophobicContact CD1-CZ3 4.02Å; I545-W580 HydrophobicContact CG1-CE3 3.94Å; I545-W580 HydrophobicContact CG1-CZ3 4.23Å; I545-Q583 HydrophobicContact CD1-CB 3.65Å; I545-Q583 HydrophobicContact CD1-CG 3.91Å; I545-Y584 HydrophobicContact CD1-CD2 4.12Å; I545-Y584 HydrophobicContact CD1-CE2 3.73Å
546	N	90.2	Very high	79	Confident	38 Å²	38	68.5 Å²	68.5	20%	0.203	37%	0.37	C	S	.	.			trans	-77	157.2	-178.9	-63	-21.6	0	0	0	112.3	E548 N549 Y550	N546-E548 VanDerWaalsContact C-N 3.28Å; N546-E548 HydrophobicContact CB-CG 4.38Å; N546-E548 WeakPolarHBondContact CB-OE1 3.32Å; N546-E548 WeakPolarHBondContact CB-OE2 3.32Å; N546-E548 PolarHBondContact ND2-OE1 2.85Å; N546-E548 PolarHBondContact O-N 2.78Å; N546-N549 PolarHBondContact O-N 2.77Å; N546-Y550 VanDerWaalsContact O-CD1 3.23Å; N546-Y550 WeakPolarHBondContact O-CD1 3.21Å; N546-Y550 PolarHBondContact O-N 2.88Å
547	P	89.4	Confident	78.5	Confident	14 Å²	14	72 Å²	72	9%	0.091	39%	0.388	C	S	.	.	H	α-helix	trans	-50	-41.7	-179.5	-26.9	33.9	0	0	0	115.3	E528 L531 N549 Y550 I551	E528-P547 HydrophobicContact CG-CB 4.37Å; L531-P547 HydrophobicContact CB-CB 4.03Å; L531-P547 HydrophobicContact CB-CG 3.85Å; L531-P547 WeakPolarHBondContact O-CG 3.47Å; P547-N549 PolarHBondContact O-N 2.82Å; P547-Y550 VanDerWaalsContact CA-CE1 3.45Å; P547-Y550 VanDerWaalsContact CA-CZ 3.42Å; P547-Y550 HydrophobicContact CB-CE1 4.36Å; P547-Y550 HydrophobicContact CB-CE2 4.37Å; P547-Y550 HydrophobicContact CG-CE1 4.29Å; P547-Y550 PolarHBondContact O-N 3.49Å; P547-I551 WeakPolarHBondContact O-CG1 3.41Å; P547-I551 PolarHBondContact O-N 3.46Å; P547-I551 VanDerWaalsContact O-N 3.14Å
548	E	85.8	Confident	78.8	Confident	90 Å²	90	66 Å²	66	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-59.2	-21.6	179.5	64.8	-86.8	-165.2	0	0	113.5	N546	N546-E548 VanDerWaalsContact C-N 3.28Å; N546-E548 HydrophobicContact CB-CG 4.38Å; N546-E548 WeakPolarHBondContact CB-OE1 3.32Å; N546-E548 WeakPolarHBondContact CB-OE2 3.32Å; N546-E548 PolarHBondContact ND2-OE1 2.85Å; N546-E548 PolarHBondContact O-N 2.78Å
549	N	88.8	Confident	79.6	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.043	34%	0.344	C	S	.	.	H	α-helix	trans	-96.7	-29.1	-176.5	-66.9	-33.7	0	0	0	113.1	I545 N546 P547 P579 K582 Q583	I545-N549 HydrophobicContact CG2-CB 3.9Å; N546-N549 PolarHBondContact O-N 2.77Å; P547-N549 PolarHBondContact O-N 2.82Å; N549-P579 WeakPolarHBondContact O-CA 3.07Å; N549-P579 WeakPolarHBondContact O-CB 3.48Å; N549-K582 HydrophobicContact CB-CB 4.09Å; N549-K582 HydrophobicContact CB-CD 4.23Å; N549-K582 WeakPolarHBondContact OD1-CB 3.3Å; N549-Q583 PolarHBondContact ND2-OE1 3.19Å
550	Y	89.4	Confident	80.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-102.1	1.7	-179.3	66.5	-116.5	0	0	0	114.7	L510 L531 A532 V534 I545 N546 P547 L560 A561 F562	L510-Y550 HydrophobicContact CD1-CE2 3.96Å; L531-Y550 VanDerWaalsContact CB-OH 3.23Å; L531-Y550 WeakPolarHBondContact CB-OH 3.27Å; L531-Y550 HydrophobicContact CD1-CE2 3.94Å; A532-Y550 PolarHBondContact O-OH 3.39Å; V534-Y550 HydrophobicContact CG2-CD1 4.16Å; V534-Y550 HydrophobicContact CG2-CE1 3.81Å; I545-Y550 HydrophobicContact CB-CD1 4.38Å; I545-Y550 HydrophobicContact CG2-CD1 3.88Å; I545-Y550 WeakPolarHBondContact O-CD1 3.36Å; I545-Y550 VanDerWaalsContact O-CE1 3.31Å; I545-Y550 WeakPolarHBondContact O-CE1 3.47Å; N546-Y550 VanDerWaalsContact O-CD1 3.23Å; N546-Y550 WeakPolarHBondContact O-CD1 3.21Å; N546-Y550 PolarHBondContact O-N 2.88Å; P547-Y550 VanDerWaalsContact CA-CE1 3.45Å; P547-Y550 VanDerWaalsContact CA-CZ 3.42Å; P547-Y550 HydrophobicContact CB-CE1 4.36Å; P547-Y550 HydrophobicContact CB-CE2 4.37Å; P547-Y550 HydrophobicContact CG-CE1 4.29Å; P547-Y550 PolarHBondContact O-N 3.49Å; Y550-L560 HydrophobicContact CD2-CD2 4.11Å; Y550-L560 HydrophobicContact CE2-CD2 4.19Å; Y550-A561 VanDerWaalsContact O-CB 3.24Å; Y550-A561 WeakPolarHBondContact O-CB 3.39Å; Y550-A561 PolarHBondContact O-N 3.03Å; Y550-F562 HydrophobicContact CD1-CE2 4.06Å; Y550-F562 HydrophobicContact CD1-CZ 4.47Å; Y550-F562 HydrophobicContact CD2-CE2 4.09Å; Y550-F562 AromaticContact CG-CE2 3.66Å; Y550-F562 HydrophobicContact CG-CE2 3.66Å; Y550-F562 HydrophobicContact CG-CZ 4.39Å
551	I	87.8	Confident	81.5	Confident	13 Å²	13	47.8 Å²	47.8	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.8	171.2	-60.4	-61	0	0	0	110.5	I523 E528 L531 P547 R553 C558 L560	I523-I551 HydrophobicContact CG2-CD1 3.79Å; E528-I551 HydrophobicContact CG-CG1 4.23Å; E528-I551 VanDerWaalsContact OE2-CG2 3.26Å; E528-I551 WeakPolarHBondContact OE2-CG2 2.89Å; L531-I551 HydrophobicContact CD1-CD1 3.69Å; L531-I551 HydrophobicContact CD1-CG1 4.05Å; P547-I551 WeakPolarHBondContact O-CG1 3.41Å; P547-I551 PolarHBondContact O-N 3.46Å; P547-I551 VanDerWaalsContact O-N 3.14Å; I551-R553 HydrophobicContact CG2-CG 4.34Å; I551-C558 HydrophobicContact CG2-CB 4.08Å; I551-L560 HydrophobicContact CD1-CD2 3.7Å
552	I	80	Confident	82.1	Confident	37 Å²	37	43.7 Å²	43.7	19%	0.19	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116	172	-52.5	172.7	0	0	0	107.9	F495 I554 C558 L559 A561	F495-I552 HydrophobicContact CD1-CD1 4.25Å; F495-I552 HydrophobicContact CE1-CD1 3.75Å; F495-I552 HydrophobicContact CZ-CD1 4.26Å; I552-I554 HydrophobicContact CG2-CD1 4.33Å; I552-I554 HydrophobicContact CG2-CG1 4Å; I552-C558 WeakPolarHBondContact O-CA 3.2Å; I552-L559 HydrophobicContact CB-CB 4.24Å; I552-L559 PolarHBondContact N-O 2.75Å; I552-L559 PolarHBondContact O-N 3.35Å; I552-A561 HydrophobicContact CD1-CB 3.84Å; I552-A561 HydrophobicContact CG1-CB 3.88Å
553	R	71.6	Confident	82.3	Confident	144 Å²	144	43.5 Å²	43.5	54%	0.543	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.7	173.1	-70.5	-169.8	168.9	96.7	-6.3	110.2	E528 I551	E528-R553 VanDerWaalsContact CD-CZ 3.45Å; E528-R553 IonicContact OE1-CZ 3.71Å; E528-R553 VanDerWaalsContact OE1-CZ 3.31Å; E528-R553 IonicContact OE1-NH1 2.61Å; E528-R553 PolarHBondContact OE1-NH1 2.84Å; E528-R553 IonicContact OE1-NH2 2.68Å; E528-R553 PolarHBondContact OE1-NH2 2.54Å; E528-R553 IonicContact OE2-CZ 3Å; E528-R553 IonicContact OE2-NE 2.72Å; E528-R553 IonicContact OE2-NH1 2.66Å; E528-R553 PolarHBondContact OE2-NH1 2.71Å; E528-R553 IonicContact OE2-NH2 3.41Å; E528-R553 PolarHBondContact OE2-NH2 2.02Å; I551-R553 HydrophobicContact CG2-CG 4.34Å
554	I	63.7	Low	82.2	Confident	99 Å²	99	43.3 Å²	43.3	51%	0.508	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	104.6	172.5	-53.3	179.7	0	0	0	107.2	I552 N556 M557 L559	I552-I554 HydrophobicContact CG2-CD1 4.33Å; I552-I554 HydrophobicContact CG2-CG1 4Å; I554-N556 PolarHBondContact O-N 2.87Å; I554-N556 VanDerWaalsContact O-N 3.17Å; I554-M557 PolarHBondContact N-O 3.34Å; I554-M557 PolarHBondContact O-N 2.84Å; I554-L559 HydrophobicContact CD1-CD1 3.72Å
555	S	68.8	Low	81.3	Confident	113 Å²	113	43.5 Å²	43.5	79%	0.79	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	-121.1	-172.7	-177.3	0	0	0	0	110.7	M557	S555-M557 VanDerWaalsContact C-N 3.33Å; S555-M557 PolarHBondContact O-N 2.72Å
556	N	70.3	Confident	80.2	Confident	150 Å²	150	47.1 Å²	47.1	80%	0.802	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	12.6	-179.4	-65.9	-15.8	0	0	0	114.1	I554	I554-N556 PolarHBondContact O-N 2.87Å; I554-N556 VanDerWaalsContact O-N 3.17Å
557	M	71.4	Confident	78.5	Confident	100 Å²	100	51.5 Å²	51.5	49%	0.493	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.3	-175	-64.7	171	55.2	0	0	111.1	Y522 I554 S555	Y522-M557 HydrophobicContact CD1-CE 3.85Å; Y522-M557 HydrophobicContact CE1-CE 3.26Å; I554-M557 PolarHBondContact N-O 3.34Å; I554-M557 PolarHBondContact O-N 2.84Å; S555-M557 VanDerWaalsContact C-N 3.33Å; S555-M557 PolarHBondContact O-N 2.72Å
558	C	80.2	Confident	76.5	Confident	3 Å²	3	55 Å²	55	2%	0.02	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.6	174.7	-70.1	0	0	0	0	110.9	I523 C525 I551 I552	I523-C558 HydrophobicContact CG2-CB 3.82Å; I523-C558 PolarHBondContact N-O 2.96Å; I523-C558 WeakPolarHBondContact O-CB 3.49Å; C525-C558 WeakPolarHBondContact CA-SG 3.35Å; C525-C558 HydrophobicContact CB-CB 4.06Å; C525-C558 WeakPolarHBondContact CB-SG 3.26Å; C525-C558 WeakPolarHBondContact SG-CB 3.43Å; C525-C558 PolarHBondContact SG-N 3.1Å; C525-C558 CovalentContact SG-SG 2.03Å; C525-C558 PolarHBondContact SG-SG 3.02Å; I551-C558 HydrophobicContact CG2-CB 4.08Å; I552-C558 WeakPolarHBondContact O-CA 3.2Å
559	L	85	Confident	74.6	Confident	10 Å²	10	60.4 Å²	60.4	5%	0.052	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.1	177.3	-54.1	172.9	0	0	0	109.9	L520 F521 Y522 I552 I554	L520-L559 HydrophobicContact CD1-CD1 4.21Å; F521-L559 CarbonylContact O-C 3.58Å; F521-L559 VanDerWaalsContact O-CA 3.28Å; F521-L559 WeakPolarHBondContact O-CA 3.47Å; Y522-L559 HydrophobicContact CD1-CD2 3.37Å; Y522-L559 HydrophobicContact CD2-CD2 4.43Å; Y522-L559 HydrophobicContact CE1-CD2 3.26Å; Y522-L559 HydrophobicContact CE2-CD2 4.32Å; Y522-L559 HydrophobicContact CG-CD2 3.99Å; I552-L559 HydrophobicContact CB-CB 4.24Å; I552-L559 PolarHBondContact N-O 2.75Å; I552-L559 PolarHBondContact O-N 3.35Å; I554-L559 HydrophobicContact CD1-CD1 3.72Å
560	L	84.8	Confident	72.5	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130.8	160.6	-63.8	-175.1	0	0	0	109.3	A507 L510 A512 F521 I523 Y550 I551 F562	A507-L560 HydrophobicContact CB-CD1 4.33Å; L510-L560 HydrophobicContact CB-CD1 4.3Å; L510-L560 HydrophobicContact CD1-CD1 3.97Å; L510-L560 HydrophobicContact CD1-CD2 3.86Å; A512-L560 HydrophobicContact CB-CD1 3.26Å; A512-L560 HydrophobicContact CB-CG 3.75Å; F521-L560 HydrophobicContact CB-CB 3.98Å; F521-L560 HydrophobicContact CB-CD1 4.08Å; F521-L560 HydrophobicContact CB-CG 4.18Å; F521-L560 PolarHBondContact O-N 2.99Å; I523-L560 HydrophobicContact CB-CD2 4.5Å; I523-L560 HydrophobicContact CD1-CD2 4.02Å; I523-L560 HydrophobicContact CG2-CD2 4.24Å; Y550-L560 HydrophobicContact CD2-CD2 4.11Å; Y550-L560 HydrophobicContact CE2-CD2 4.19Å; I551-L560 HydrophobicContact CD1-CD2 3.7Å; L560-F562 HydrophobicContact CB-CB 4.44Å; L560-F562 HydrophobicContact CB-CD2 4.3Å; L560-F562 PolarHBondContact O-N 3.03Å
561	A	89.1	Confident	71	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-75.4	37.7	170.7	0	0	0	0	0	112.2	F495 I496 Y550 I552 P579	F495-A561 CarbonylContact C-O 3.57Å; F495-A561 WeakPolarHBondContact CA-O 3.32Å; I496-A561 PolarHBondContact N-O 3.35Å; Y550-A561 VanDerWaalsContact O-CB 3.24Å; Y550-A561 WeakPolarHBondContact O-CB 3.39Å; Y550-A561 PolarHBondContact O-N 3.03Å; I552-A561 HydrophobicContact CD1-CB 3.84Å; I552-A561 HydrophobicContact CG1-CB 3.88Å; A561-P579 HydrophobicContact CB-CB 4.48Å; A561-P579 HydrophobicContact CB-CG 3.29Å
562	F	86.2	Confident	69.6	Low	2 Å²	2	72.7 Å²	72.7	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.4	178.2	-72.6	-75.3	0	0	0	109	I496 I503 I506 F521 V534 F536 Y550 L560	I496-F562 HydrophobicContact CB-CD1 3.77Å; I496-F562 HydrophobicContact CB-CE1 3.81Å; I496-F562 HydrophobicContact CD1-CE1 3.76Å; I496-F562 HydrophobicContact CD1-CZ 4.19Å; I496-F562 HydrophobicContact CG1-CE1 4.32Å; I496-F562 HydrophobicContact CG2-CD1 4Å; I496-F562 HydrophobicContact CG2-CE1 3.95Å; I496-F562 WeakPolarHBondContact O-CA 3.32Å; I503-F562 HydrophobicContact CD1-CB 4.08Å; I503-F562 HydrophobicContact CD1-CD1 4.07Å; I506-F562 HydrophobicContact CG2-CD2 4.19Å; I506-F562 HydrophobicContact CG2-CE2 4.31Å; I506-F562 HydrophobicContact CG2-CG 4.41Å; F521-F562 VanDerWaalsContact CD2-O 3.25Å; F521-F562 WeakPolarHBondContact CD2-O 3.12Å; V534-F562 HydrophobicContact CB-CZ 3.98Å; V534-F562 HydrophobicContact CG1-CE1 4.46Å; V534-F562 HydrophobicContact CG1-CZ 4.02Å; V534-F562 HydrophobicContact CG2-CE2 3.91Å; V534-F562 HydrophobicContact CG2-CZ 3.86Å; F536-F562 HydrophobicContact CE2-CE1 4.3Å; F536-F562 AromaticContact CZ-CE1 3.95Å; F536-F562 HydrophobicContact CZ-CE1 3.95Å; Y550-F562 HydrophobicContact CD1-CE2 4.06Å; Y550-F562 HydrophobicContact CD1-CZ 4.47Å; Y550-F562 HydrophobicContact CD2-CE2 4.09Å; Y550-F562 AromaticContact CG-CE2 3.66Å; Y550-F562 HydrophobicContact CG-CE2 3.66Å; Y550-F562 HydrophobicContact CG-CZ 4.39Å; L560-F562 HydrophobicContact CB-CB 4.44Å; L560-F562 HydrophobicContact CB-CD2 4.3Å; L560-F562 PolarHBondContact O-N 3.03Å
563	Q	84.4	Confident	68.9	Low	46 Å²	46	73.8 Å²	73.8	22%	0.215	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.1	-179.9	-170.9	176.2	30.7	0	0	111.4	F495 I496 L497 G498 I503 R519 N565	F495-Q563 HydrophobicContact CB-CB 4.14Å; F495-Q563 HydrophobicContact CD1-CB 4.49Å; F495-Q563 HydrophobicContact CG-CB 4.26Å; I496-Q563 PolarHBondContact O-N 3.33Å; L497-Q563 WeakPolarHBondContact CA-O 3.4Å; L497-Q563 HydrophobicContact CD2-CB 3.71Å; L497-Q563 HydrophobicContact CD2-CG 4.32Å; G498-Q563 PolarHBondContact N-O 2.93Å; G498-Q563 VanDerWaalsContact N-O 3.16Å; I503-Q563 WeakPolarHBondContact CG1-O 3.41Å; R519-Q563 PolarHBondContact O-NE2 3.3Å; R519-Q563 VanDerWaalsContact O-NE2 3.13Å; Q563-N565 PolarHBondContact O-N 2.83Å
564	M	81.1	Confident	69.3	Low	17 Å²	17	68.1 Å²	68.1	8%	0.084	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.7	177	-57.3	177.4	-164.3	0	0	109.9	Q500 I503 M504 Y514 F521 T566	Q500-M564 HydrophobicContact CB-CG 4.49Å; Q500-M564 HydrophobicContact CB-SD 4.36Å; Q500-M564 HydrophobicContact CG-CG 4.39Å; Q500-M564 HydrophobicContact CG-SD 3.72Å; I503-M564 HydrophobicContact CB-CG 4.38Å; I503-M564 HydrophobicContact CG2-CG 4.06Å; M504-M564 HydrophobicContact CG-CE 3.63Å; M504-M564 HydrophobicContact SD-CE 3.25Å; M504-M564 WeakPolarHBondContact SD-CE 3.2Å; Y514-M564 HydrophobicContact CD1-CE 4.4Å; Y514-M564 HydrophobicContact CD2-CE 4.01Å; Y514-M564 HydrophobicContact CE1-CE 4.14Å; Y514-M564 HydrophobicContact CE2-CE 3.73Å; Y514-M564 HydrophobicContact CG-CE 4.33Å; F521-M564 HydrophobicContact CE1-CE 4.48Å; F521-M564 HydrophobicContact CE2-CE 4.43Å; F521-M564 HydrophobicContact CZ-CE 3.67Å; M564-T566 VanDerWaalsContact C-N 3.33Å; M564-T566 HydrophobicContact CB-CG2 4.18Å; M564-T566 PolarHBondContact O-N 3.43Å
565	N	72.2	Confident	69.9	Low	29 Å²	29	63.7 Å²	63.7	16%	0.155	32%	0.317	C	S	.	.			trans	-71.5	90.7	171.8	-171.4	-3.1	0	0	0	109.3	L497 G498 Q563 F568 P572 D573	L497-N565 HydrophobicContact CB-CB 4.15Å; G498-N565 WeakPolarHBondContact O-CB 3.35Å; G498-N565 PolarHBondContact O-N 2.82Å; Q563-N565 PolarHBondContact O-N 2.83Å; N565-F568 WeakPolarHBondContact OD1-CB 3.15Å; N565-F568 WeakPolarHBondContact OD1-CD2 3.25Å; N565-F568 PolarHBondContact OD1-N 2.87Å; N565-F568 VanDerWaalsContact OD1-N 3.12Å; N565-P572 PolarHBondContact ND2-O 2.7Å; N565-D573 PolarHBondContact ND2-O 3.39Å; N565-D573 VanDerWaalsContact ND2-O 3.11Å
566	T	64.4	Low	70.6	Confident	76 Å²	76	58.4 Å²	58.4	47%	0.466	28%	0.28	S	S	.	.			trans	-103.1	-8.2	175	52.7	0	0	0	0	112.4	M564	M564-T566 VanDerWaalsContact C-N 3.33Å; M564-T566 HydrophobicContact CB-CG2 4.18Å; M564-T566 PolarHBondContact O-N 3.43Å
567	Q	54	Low	71.2	Confident	131 Å²	131	51.3 Å²	51.3	61%	0.612	24%	0.241	S	C	*	.	S	Bend	trans	-93.5	-37.6	-170.1	-61.7	-66.6	-9.9	0	0	111.9	R569	Q567-R569 PolarHBondContact O-N 3.28Å
568	F	48.6	Very low	71.8	Confident	86 Å²	86	47.7 Å²	47.7	38%	0.377	22%	0.223	S	C	.	.			trans	-102.8	75.8	-172.7	-58.4	-75	0	0	0	111.1	L497 N565 Y570 G571 V575	L497-F568 HydrophobicContact CD1-CD2 4.27Å; L497-F568 HydrophobicContact CD1-CE2 3.8Å; N565-F568 WeakPolarHBondContact OD1-CB 3.15Å; N565-F568 WeakPolarHBondContact OD1-CD2 3.25Å; N565-F568 PolarHBondContact OD1-N 2.87Å; N565-F568 VanDerWaalsContact OD1-N 3.12Å; F568-Y570 PolarHBondContact O-N 3.41Å; F568-G571 PolarHBondContact O-N 3.45Å; F568-V575 HydrophobicContact CD2-CG2 3.98Å; F568-V575 HydrophobicContact CE2-CG2 3.98Å
569	R	44	Very low	72.1	Confident	204 Å²	204	47.5 Å²	47.5	77%	0.77	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.1	-179.8	-137	-175.6	-68.4	-146.1	2.5	113.8	Q567	Q567-R569 PolarHBondContact O-N 3.28Å
570	Y	46.5	Very low	72.2	Confident	221 Å²	221	47.2 Å²	47.2	87%	0.867	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.9	14.5	179.3	-61.5	-73.6	0	0	0	112.8	F568	F568-Y570 PolarHBondContact O-N 3.41Å
571	G	56.2	Low	72.1	Confident	28 Å²	28	47.6 Å²	47.6	29%	0.289	22%	0.222	S	C	.	.	S	Bend	trans	-106.4	-173.1	179.7	0	0	0	0	0	111.7	F568	F568-G571 PolarHBondContact O-N 3.45Å
572	P	59.1	Low	71.8	Confident	30 Å²	30	49.9 Å²	49.9	20%	0.195	23%	0.232	C	C	.	.			trans	-60.4	141.5	-179.5	25.8	-33.4	0	0	0	110.3	E486 S488 N565 W574 V575	E486-P572 HydrophobicContact CB-CB 4.01Å; S488-P572 WeakPolarHBondContact OG-CG 3.2Å; N565-P572 PolarHBondContact ND2-O 2.7Å; P572-W574 PolarHBondContact O-N 2.83Å; P572-V575 HydrophobicContact CG-CG2 4.33Å
573	D	65.8	Low	71.7	Confident	60 Å²	60	50.7 Å²	50.7	32%	0.321	24%	0.236	S	C	.	.	S	Bend	trans	-56.2	-40.2	177.8	-64	-78.6	0	0	0	111.2	Y485 E486 G498 P499 N565	Y485-D573 WeakPolarHBondContact CA-OD2 3.24Å; Y485-D573 HydrophobicContact CD1-CB 3.54Å; Y485-D573 WeakPolarHBondContact CD1-OD2 3.42Å; Y485-D573 HydrophobicContact CE1-CB 4.35Å; Y485-D573 HydrophobicContact CG-CB 3.96Å; E486-D573 PolarHBondContact N-OD2 2.96Å; E486-D573 PolarHBondContact O-N 3Å; G498-D573 WeakPolarHBondContact CA-O 3.46Å; P499-D573 WeakPolarHBondContact CD-O 3.3Å; P499-D573 HydrophobicContact CG-CB 3.92Å; N565-D573 PolarHBondContact ND2-O 3.39Å; N565-D573 VanDerWaalsContact ND2-O 3.11Å
574	W	79.7	Confident	71.7	Confident	25 Å²	25	49 Å²	49	10%	0.095	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.8	177.8	-67.5	89.6	0	0	0	112.9	Y485 E486 C487 S488 I496 L497 P499 E502 I503 I506 F536 P572	Y485-W574 AromaticContact CD2-NE1 3.58Å; Y485-W574 AromaticContact CG-NE1 3.84Å; E486-W574 PolarHBondContact O-N 3.12Å; C487-W574 WeakPolarHBondContact CA-O 3.34Å; C487-W574 HydrophobicContact CB-CB 4.29Å; S488-W574 PolarHBondContact N-O 2.81Å; I496-W574 HydrophobicContact CG2-CE3 3.8Å; I496-W574 HydrophobicContact CG2-CZ3 3.93Å; L497-W574 CarbonylContact O-C 3.59Å; L497-W574 VanDerWaalsContact O-CA 3.3Å; L497-W574 WeakPolarHBondContact O-CA 3.37Å; L497-W574 VanDerWaalsContact O-CE3 3.27Å; P499-W574 VanDerWaalsContact CD-CE2 3.45Å; E502-W574 HydrophobicContact CB-CH2 4.08Å; E502-W574 HydrophobicContact CB-CZ2 3.71Å; E502-W574 HydrophobicContact CG-CZ2 4.27Å; I503-W574 HydrophobicContact CD1-CH2 4.13Å; I503-W574 HydrophobicContact CD1-CZ3 3.82Å; I506-W574 HydrophobicContact CD1-CH2 3.85Å; I506-W574 HydrophobicContact CD1-CZ3 4.46Å; F536-W574 HydrophobicContact CE1-CD2 4.2Å; F536-W574 AromaticContact CE1-CE3 3.72Å; F536-W574 HydrophobicContact CE1-CE3 3.72Å; F536-W574 HydrophobicContact CE1-CH2 4.13Å; F536-W574 AromaticContact CE1-CZ3 3.68Å; F536-W574 HydrophobicContact CE1-CZ3 3.68Å; F536-W574 HydrophobicContact CZ-CE3 4.36Å; F536-W574 HydrophobicContact CZ-CZ3 4Å; P572-W574 PolarHBondContact O-N 2.83Å
575	V	76.5	Confident	71.4	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.036	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	111.5	165.7	-168.2	0	0	0	0	108.6	S488 L493 I496 L497 F568 P572 G577	S488-V575 CarbonylContact O-C 3.44Å; S488-V575 WeakPolarHBondContact O-CA 3.31Å; L493-V575 HydrophobicContact CD1-CB 4.14Å; L493-V575 HydrophobicContact CD1-CG1 3.48Å; L493-V575 VanDerWaalsContact CD1-CG1 3.48Å; I496-V575 CarbonylContact C-O 3.57Å; I496-V575 WeakPolarHBondContact CA-O 3.46Å; L497-V575 HydrophobicContact CB-CB 4.06Å; L497-V575 HydrophobicContact CB-CG2 4.35Å; L497-V575 HydrophobicContact CD1-CB 4.34Å; L497-V575 HydrophobicContact CD1-CG2 4.39Å; L497-V575 HydrophobicContact CG-CB 4.34Å; L497-V575 PolarHBondContact N-O 3.19Å; L497-V575 PolarHBondContact O-N 3.1Å; F568-V575 HydrophobicContact CD2-CG2 3.98Å; F568-V575 HydrophobicContact CE2-CG2 3.98Å; P572-V575 HydrophobicContact CG-CG2 4.33Å; V575-G577 PolarHBondContact O-N 3.25Å
576	L	82.9	Confident	71.6	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	101.6	-178.5	-56	175.5	0	0	0	109.3	C487 S488 T489 S490 I496 F536 W580 F581	C487-L576 WeakPolarHBondContact SG-CD1 3.29Å; C487-L576 VanDerWaalsContact SG-CG 3.53Å; S488-L576 PolarHBondContact O-N 3.32Å; T489-L576 WeakPolarHBondContact CA-O 3.31Å; T489-L576 HydrophobicContact CG2-CB 4.15Å; T489-L576 HydrophobicContact CG2-CD1 4.09Å; S490-L576 PolarHBondContact N-O 3.01Å; I496-L576 HydrophobicContact CG2-CD2 4.16Å; F536-L576 HydrophobicContact CD1-CD2 4.39Å; F536-L576 HydrophobicContact CE1-CD2 4.18Å; L576-W580 HydrophobicContact CB-CB 3.85Å; L576-W580 HydrophobicContact CB-CD2 4.04Å; L576-W580 HydrophobicContact CB-CE3 4.33Å; L576-W580 HydrophobicContact CB-CG 3.81Å; L576-W580 HydrophobicContact CD1-CD2 3.53Å; L576-W580 HydrophobicContact CD1-CE3 3.75Å; L576-W580 HydrophobicContact CD1-CG 4.06Å; L576-W580 HydrophobicContact CD1-CH2 4.03Å; L576-W580 HydrophobicContact CD1-CZ2 3.8Å; L576-W580 HydrophobicContact CD1-CZ3 4.01Å; L576-W580 HydrophobicContact CD2-CD2 4.2Å; L576-W580 HydrophobicContact CD2-CE3 3.67Å; L576-W580 HydrophobicContact CD2-CZ3 4.02Å; L576-W580 HydrophobicContact CG-CD2 4.11Å; L576-W580 HydrophobicContact CG-CE3 4.1Å; L576-W580 HydrophobicContact CG-CG 4.41Å; L576-F581 WeakPolarHBondContact O-CE2 2.86Å
577	G	83.7	Confident	72	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.21	C	C	.	.			trans	-85.7	-157.8	178.9	0	0	0	0	0	114.1	S490 L493 F495 V575 P579 W580 F581	S490-G577 WeakPolarHBondContact O-CA 3.48Å; L493-G577 WeakPolarHBondContact O-CA 3.21Å; F495-G577 WeakPolarHBondContact O-CA 3.2Å; V575-G577 PolarHBondContact O-N 3.25Å; G577-P579 VanDerWaalsContact O-N 3.16Å; G577-W580 VanDerWaalsContact O-CB 3.25Å; G577-W580 WeakPolarHBondContact O-CB 3.37Å; G577-W580 PolarHBondContact O-N 3.3Å; G577-F581 WeakPolarHBondContact O-CD2 2.96Å
578	E	83.1	Confident	72.8	Confident	24 Å²	24	41 Å²	41	11%	0.112	19%	0.188	C	C	.	.	H	α-helix	trans	-49.3	-39.1	-174.3	-161.7	-84.6	171.6	0	0	115.9	K457 L493 W580 F581 K582	K457-E578 HydrophobicContact CD-CG 4.49Å; K457-E578 VanDerWaalsContact CD-OE1 3.32Å; K457-E578 WeakPolarHBondContact CD-OE1 3.46Å; K457-E578 VanDerWaalsContact CE-OE1 3.26Å; K457-E578 WeakPolarHBondContact CE-OE1 3.04Å; K457-E578 IonicContact NZ-OE1 3.24Å; K457-E578 PolarHBondContact NZ-OE1 2.85Å; L493-E578 WeakPolarHBondContact O-CB 3.36Å; L493-E578 PolarHBondContact O-N 3.14Å; E578-W580 PolarHBondContact O-N 3.5Å; E578-F581 PolarHBondContact O-N 3.04Å; E578-F581 VanDerWaalsContact O-N 3.07Å; E578-K582 VanDerWaalsContact CD-CE 3.41Å; E578-K582 PolarHBondContact O-N 2.79Å; E578-K582 WeakPolarHBondContact OE1-CD 3.44Å; E578-K582 WeakPolarHBondContact OE1-CE 3.25Å; E578-K582 VanDerWaalsContact OE1-CG 3.27Å; E578-K582 WeakPolarHBondContact OE1-CG 3.33Å; E578-K582 IonicContact OE1-NZ 2.88Å; E578-K582 PolarHBondContact OE1-NZ 2.98Å; E578-K582 VanDerWaalsContact OE2-CD 3.27Å; E578-K582 WeakPolarHBondContact OE2-CD 3.35Å; E578-K582 WeakPolarHBondContact OE2-CE 3.1Å; E578-K582 IonicContact OE2-NZ 3.63Å; E578-K582 PolarHBondContact OE2-NZ 3.41Å
579	P	87.3	Confident	73.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.6	-34	174.4	-27.8	36.1	0	0	0	113.7	I496 I545 N549 A561 G577 Q583	I496-P579 HydrophobicContact CD1-CB 3.91Å; I496-P579 HydrophobicContact CD1-CG 4.41Å; I496-P579 HydrophobicContact CG1-CB 4.15Å; I496-P579 HydrophobicContact CG1-CG 4.15Å; I545-P579 HydrophobicContact CG2-CB 4.07Å; N549-P579 WeakPolarHBondContact O-CA 3.07Å; N549-P579 WeakPolarHBondContact O-CB 3.48Å; A561-P579 HydrophobicContact CB-CB 4.48Å; A561-P579 HydrophobicContact CB-CG 3.29Å; G577-P579 VanDerWaalsContact O-N 3.16Å; P579-Q583 PolarHBondContact O-N 3Å
580	W	85.8	Confident	74.7	Confident	4 Å²	4	29.8 Å²	29.8	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-70.1	-43.7	176.7	-165	-89.5	0	0	0	111.7	F536 L543 I545 L576 G577 E578 K582 Q583 Y584 F597	F536-W580 HydrophobicContact CB-CH2 3.94Å; F536-W580 HydrophobicContact CB-CZ3 3.74Å; F536-W580 HydrophobicContact CD1-CZ3 4.32Å; F536-W580 HydrophobicContact CD2-CE3 4.43Å; F536-W580 AromaticContact CD2-CZ3 3.7Å; F536-W580 HydrophobicContact CD2-CZ3 3.7Å; F536-W580 HydrophobicContact CE2-CZ3 4.4Å; F536-W580 HydrophobicContact CG-CH2 4.33Å; F536-W580 AromaticContact CG-CZ3 3.65Å; F536-W580 HydrophobicContact CG-CZ3 3.65Å; L543-W580 HydrophobicContact CB-CH2 3.95Å; L543-W580 HydrophobicContact CD1-CH2 3.87Å; L543-W580 HydrophobicContact CD1-CZ2 3.82Å; I545-W580 HydrophobicContact CD1-CD2 4.11Å; I545-W580 HydrophobicContact CD1-CE3 3.52Å; I545-W580 HydrophobicContact CD1-CZ3 4.02Å; I545-W580 HydrophobicContact CG1-CE3 3.94Å; I545-W580 HydrophobicContact CG1-CZ3 4.23Å; L576-W580 HydrophobicContact CB-CB 3.85Å; L576-W580 HydrophobicContact CB-CD2 4.04Å; L576-W580 HydrophobicContact CB-CE3 4.33Å; L576-W580 HydrophobicContact CB-CG 3.81Å; L576-W580 HydrophobicContact CD1-CD2 3.53Å; L576-W580 HydrophobicContact CD1-CE3 3.75Å; L576-W580 HydrophobicContact CD1-CG 4.06Å; L576-W580 HydrophobicContact CD1-CH2 4.03Å; L576-W580 HydrophobicContact CD1-CZ2 3.8Å; L576-W580 HydrophobicContact CD1-CZ3 4.01Å; L576-W580 HydrophobicContact CD2-CD2 4.2Å; L576-W580 HydrophobicContact CD2-CE3 3.67Å; L576-W580 HydrophobicContact CD2-CZ3 4.02Å; L576-W580 HydrophobicContact CG-CD2 4.11Å; L576-W580 HydrophobicContact CG-CE3 4.1Å; L576-W580 HydrophobicContact CG-CG 4.41Å; G577-W580 VanDerWaalsContact O-CB 3.25Å; G577-W580 WeakPolarHBondContact O-CB 3.37Å; G577-W580 PolarHBondContact O-N 3.3Å; E578-W580 PolarHBondContact O-N 3.5Å; W580-K582 VanDerWaalsContact C-N 3.27Å; W580-K582 PolarHBondContact O-N 2.84Å; W580-Q583 PolarHBondContact O-N 2.69Å; W580-Q583 VanDerWaalsContact O-N 3.1Å; W580-Y584 AromaticContact CD2-CD2 3.92Å; W580-Y584 HydrophobicContact CD2-CD2 3.92Å; W580-Y584 HydrophobicContact CD2-CE2 4.38Å; W580-Y584 AromaticContact CE2-CD2 3.64Å; W580-Y584 HydrophobicContact CE3-CD2 4.47Å; W580-Y584 HydrophobicContact CG-CD2 4.28Å; W580-Y584 HydrophobicContact CH2-CD2 4.48Å; W580-Y584 HydrophobicContact CH2-CE2 4.22Å; W580-Y584 AromaticContact CZ2-CD2 3.97Å; W580-Y584 HydrophobicContact CZ2-CD2 3.97Å; W580-Y584 HydrophobicContact CZ2-CE2 4.11Å; W580-Y584 HydrophobicContact CZ3-CE2 4.41Å; W580-Y584 AromaticContact NE1-CD2 3.85Å; W580-Y584 PolarHBondContact O-N 2.56Å; W580-F597 HydrophobicContact CZ2-CD1 4.15Å; W580-F597 AromaticContact CZ2-CD2 3.89Å; W580-F597 HydrophobicContact CZ2-CD2 3.89Å; W580-F597 HydrophobicContact CZ2-CE1 4.25Å; W580-F597 AromaticContact CZ2-CE2 4Å; W580-F597 HydrophobicContact CZ2-CE2 4Å; W580-F597 AromaticContact CZ2-CG 3.96Å; W580-F597 HydrophobicContact CZ2-CG 3.96Å; W580-F597 HydrophobicContact CZ2-CZ 4.17Å; W580-F597 AromaticContact NE1-CD1 3.3Å; W580-F597 VanDerWaalsContact NE1-CD1 3.3Å; W580-F597 AromaticContact NE1-CE1 3.45Å; W580-F597 AromaticContact NE1-CG 3.91Å
581	F	82.5	Confident	75.5	Confident	7 Å²	7	23.7 Å²	23.7	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-70.9	-20	179.2	-69.3	-89.2	0	0	0	113.8	I455 S490 L576 G577 E578 V586	I455-F581 HydrophobicContact CB-CD1 4.28Å; I455-F581 HydrophobicContact CB-CE1 4.02Å; I455-F581 HydrophobicContact CG2-CD1 3.83Å; I455-F581 HydrophobicContact CG2-CE1 3.86Å; S490-F581 WeakPolarHBondContact O-CE2 3.1Å; L576-F581 WeakPolarHBondContact O-CE2 2.86Å; G577-F581 WeakPolarHBondContact O-CD2 2.96Å; E578-F581 PolarHBondContact O-N 3.04Å; E578-F581 VanDerWaalsContact O-N 3.07Å; F581-V586 HydrophobicContact CD1-CB 4.3Å; F581-V586 HydrophobicContact CD1-CG2 3.68Å; F581-V586 HydrophobicContact CE1-CB 3.8Å; F581-V586 HydrophobicContact CE1-CG2 3.47Å; F581-V586 VanDerWaalsContact CE1-CG2 3.47Å; F581-V586 HydrophobicContact CG-CG2 4.4Å; F581-V586 HydrophobicContact CZ-CB 4.49Å; F581-V586 HydrophobicContact CZ-CG2 4.01Å
582	K	84.5	Confident	76	Confident	49 Å²	49	27 Å²	27	21%	0.213	14%	0.143	C	C	.	.	H	α-helix	trans	-73.9	-36.7	167.3	-74.4	173.6	162.3	143.2	0	112.5	N549 E578 W580	N549-K582 HydrophobicContact CB-CB 4.09Å; N549-K582 HydrophobicContact CB-CD 4.23Å; N549-K582 WeakPolarHBondContact OD1-CB 3.3Å; E578-K582 VanDerWaalsContact CD-CE 3.41Å; E578-K582 PolarHBondContact O-N 2.79Å; E578-K582 WeakPolarHBondContact OE1-CD 3.44Å; E578-K582 WeakPolarHBondContact OE1-CE 3.25Å; E578-K582 VanDerWaalsContact OE1-CG 3.27Å; E578-K582 WeakPolarHBondContact OE1-CG 3.33Å; E578-K582 IonicContact OE1-NZ 2.88Å; E578-K582 PolarHBondContact OE1-NZ 2.98Å; E578-K582 VanDerWaalsContact OE2-CD 3.27Å; E578-K582 WeakPolarHBondContact OE2-CD 3.35Å; E578-K582 WeakPolarHBondContact OE2-CE 3.1Å; E578-K582 IonicContact OE2-NZ 3.63Å; E578-K582 PolarHBondContact OE2-NZ 3.41Å; W580-K582 VanDerWaalsContact C-N 3.27Å; W580-K582 PolarHBondContact O-N 2.84Å
583	Q	84.4	Confident	76.4	Confident	19 Å²	19	35.7 Å²	35.7	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-82.4	-38.9	-178.1	-172.2	78.6	47	0	0	112.1	P544 I545 N549 P579 W580 S600	P544-Q583 VanDerWaalsContact O-CD 3.29Å; P544-Q583 VanDerWaalsContact O-CG 3.29Å; P544-Q583 WeakPolarHBondContact O-CG 3.16Å; I545-Q583 HydrophobicContact CD1-CB 3.65Å; I545-Q583 HydrophobicContact CD1-CG 3.91Å; N549-Q583 PolarHBondContact ND2-OE1 3.19Å; P579-Q583 PolarHBondContact O-N 3Å; W580-Q583 PolarHBondContact O-N 2.69Å; W580-Q583 VanDerWaalsContact O-N 3.1Å; Q583-S600 WeakPolarHBondContact O-CB 3.42Å; Q583-S600 PolarHBondContact O-N 3.41Å
584	Y	82.7	Confident	76.4	Confident	10 Å²	10	40.3 Å²	40.3	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.4	-170	-58	-69.3	0	0	0	112.6	L543 P544 I545 W580 F597 C598	L543-Y584 VanDerWaalsContact C-OH 3.26Å; L543-Y584 VanDerWaalsContact CA-OH 3.29Å; L543-Y584 WeakPolarHBondContact CA-OH 3.38Å; L543-Y584 HydrophobicContact CB-CE2 4.14Å; L543-Y584 WeakPolarHBondContact CB-OH 3.31Å; L543-Y584 HydrophobicContact CD2-CE1 4.03Å; P544-Y584 WeakPolarHBondContact CD-OH 3.12Å; P544-Y584 VanDerWaalsContact N-OH 3.09Å; P544-Y584 PolarHBondContact O-OH 3.23Å; I545-Y584 HydrophobicContact CD1-CD2 4.12Å; I545-Y584 HydrophobicContact CD1-CE2 3.73Å; W580-Y584 AromaticContact CD2-CD2 3.92Å; W580-Y584 HydrophobicContact CD2-CD2 3.92Å; W580-Y584 HydrophobicContact CD2-CE2 4.38Å; W580-Y584 AromaticContact CE2-CD2 3.64Å; W580-Y584 HydrophobicContact CE3-CD2 4.47Å; W580-Y584 HydrophobicContact CG-CD2 4.28Å; W580-Y584 HydrophobicContact CH2-CD2 4.48Å; W580-Y584 HydrophobicContact CH2-CE2 4.22Å; W580-Y584 AromaticContact CZ2-CD2 3.97Å; W580-Y584 HydrophobicContact CZ2-CD2 3.97Å; W580-Y584 HydrophobicContact CZ2-CE2 4.11Å; W580-Y584 HydrophobicContact CZ3-CE2 4.41Å; W580-Y584 AromaticContact NE1-CD2 3.85Å; W580-Y584 PolarHBondContact O-N 2.56Å; Y584-F597 HydrophobicContact CD1-CB 4.38Å; Y584-F597 HydrophobicContact CG-CB 4.28Å; Y584-C598 CarbonylContact C-O 3.24Å; Y584-C598 WeakPolarHBondContact CA-O 3.23Å
585	C	76.5	Confident	75.9	Confident	22 Å²	22	43 Å²	43	15%	0.149	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.7	157.4	-63.2	0	0	0	0	108.5	T454 W456 C598	T454-C585 HydrophobicContact CG2-CB 3.89Å; W456-C585 HydrophobicContact CB-CB 4.21Å; W456-C585 WeakPolarHBondContact CB-SG 3.26Å; C585-C598 HydrophobicContact CB-CB 4.32Å; C585-C598 PolarHBondContact N-O 3.18Å; C585-C598 PolarHBondContact O-N 3.01Å
586	V	75.6	Confident	75.6	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	111.8	178.8	-172.7	0	0	0	0	109.1	T454 I455 T489 F581 H588 I595 F597	T454-V586 WeakPolarHBondContact CA-O 3.49Å; I455-V586 PolarHBondContact N-O 3.46Å; I455-V586 PolarHBondContact O-N 2.99Å; T489-V586 HydrophobicContact CG2-CG1 4.13Å; F581-V586 HydrophobicContact CD1-CB 4.3Å; F581-V586 HydrophobicContact CD1-CG2 3.68Å; F581-V586 HydrophobicContact CE1-CB 3.8Å; F581-V586 HydrophobicContact CE1-CG2 3.47Å; F581-V586 VanDerWaalsContact CE1-CG2 3.47Å; F581-V586 HydrophobicContact CG-CG2 4.4Å; F581-V586 HydrophobicContact CZ-CB 4.49Å; F581-V586 HydrophobicContact CZ-CG2 4.01Å; V586-H588 WeakPolarHBondContact CG1-CE1 3.46Å; V586-H588 PolarHBondContact O-ND1 3.06Å; V586-I595 HydrophobicContact CG1-CD1 3.66Å; V586-I595 HydrophobicContact CG1-CG1 3.88Å; V586-F597 HydrophobicContact CG1-CD1 4.29Å; V586-F597 HydrophobicContact CG1-CE1 4.06Å; V586-F597 HydrophobicContact CG2-CD1 4.35Å
587	V	72.6	Confident	75.3	Confident	32 Å²	32	46.4 Å²	46.4	19%	0.194	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.2	-177.5	-175.5	0	0	0	0	109	I452 T454 I595 G596	I452-V587 HydrophobicContact CG2-CG1 3.57Å; T454-V587 HydrophobicContact CG2-CG2 4Å; V587-I595 CarbonylContact O-C 3.54Å; V587-I595 WeakPolarHBondContact O-CA 3.47Å; V587-I595 WeakPolarHBondContact O-CG1 3.33Å; V587-G596 PolarHBondContact N-O 3.42Å; V587-G596 PolarHBondContact O-N 2.64Å
588	H	71	Confident	74.9	Confident	31 Å²	31	49.5 Å²	49.5	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.2	177.5	-59	73.9	0	0	0	109	I452 F453 V586 F590	I452-H588 VanDerWaalsContact CA-O 3.3Å; I452-H588 WeakPolarHBondContact CA-O 3.48Å; F453-H588 HydrophobicContact CD1-CB 4.05Å; F453-H588 HydrophobicContact CD2-CB 4.36Å; F453-H588 AromaticContact CD2-ND1 3.84Å; F453-H588 HydrophobicContact CE1-CB 3.77Å; F453-H588 HydrophobicContact CE2-CB 4.02Å; F453-H588 AromaticContact CE2-CE1 3.63Å; F453-H588 AromaticContact CE2-CG 3.59Å; F453-H588 AromaticContact CE2-ND1 3.16Å; F453-H588 WeakPolarHBondContact CE2-ND1 3.43Å; F453-H588 HydrophobicContact CG-CB 4.35Å; F453-H588 HydrophobicContact CZ-CB 3.71Å; F453-H588 AromaticContact CZ-CD2 3.82Å; F453-H588 AromaticContact CZ-CE1 3.93Å; F453-H588 AromaticContact CZ-CG 3.42Å; F453-H588 VanDerWaalsContact CZ-CG 3.42Å; F453-H588 AromaticContact CZ-ND1 3.52Å; F453-H588 PolarHBondContact N-O 2.88Å; F453-H588 VanDerWaalsContact N-O 3.14Å; F453-H588 PolarHBondContact O-N 3.31Å; V586-H588 WeakPolarHBondContact CG1-CE1 3.46Å; V586-H588 PolarHBondContact O-ND1 3.06Å; H588-F590 HydrophobicContact CB-CD2 4.35Å; H588-F590 HydrophobicContact CB-CE2 3.95Å
589	D	69.5	Low	74.5	Confident	11 Å²	11	53 Å²	53	6%	0.059	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	99	177.4	179.5	-15.8	0	0	0	108.9	I452 T591 N592 R593 R594	I452-D589 HydrophobicContact CG1-CB 4.28Å; D589-T591 VanDerWaalsContact C-N 3.35Å; D589-T591 PolarHBondContact OD1-N 3.04Å; D589-N592 PolarHBondContact OD1-N 3.42Å; D589-N592 PolarHBondContact OD1-ND2 3.35Å; D589-N592 PolarHBondContact OD2-ND2 2.92Å; D589-R593 WeakPolarHBondContact O-CA 3.14Å; D589-R593 PolarHBondContact O-N 2.58Å; D589-R594 HydrophobicContact CB-CG 3.73Å; D589-R594 PolarHBondContact N-O 3.17Å; D589-R594 PolarHBondContact O-N 3.49Å; D589-R594 VanDerWaalsContact O-N 3.15Å; D589-R594 IonicContact OD2-CZ 3.89Å; D589-R594 VanDerWaalsContact OD2-CZ 3.31Å; D589-R594 IonicContact OD2-NE 3.51Å; D589-R594 PolarHBondContact OD2-NE 3.27Å; D589-R594 IonicContact OD2-NH2 3.66Å; D589-R594 PolarHBondContact OD2-NH2 3.2Å
590	F	63.2	Low	73.5	Confident	43 Å²	43	53.4 Å²	53.4	19%	0.189	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-33.8	-175.9	-84.8	-110.3	0	0	0	112.2	P427 I439 V443 S451 F453 H588	P427-F590 HydrophobicContact CG-CE1 4.33Å; I439-F590 HydrophobicContact CB-CZ 4.43Å; I439-F590 HydrophobicContact CG2-CD1 4.37Å; I439-F590 HydrophobicContact CG2-CD2 4.19Å; I439-F590 HydrophobicContact CG2-CE1 3.87Å; I439-F590 HydrophobicContact CG2-CE2 3.74Å; I439-F590 HydrophobicContact CG2-CZ 3.54Å; V443-F590 HydrophobicContact CG2-CB 4.25Å; V443-F590 HydrophobicContact CG2-CG 4.29Å; S451-F590 PolarHBondContact O-N 3.5Å; F453-F590 HydrophobicContact CD1-CD2 4.35Å; F453-F590 AromaticContact CD1-CE2 3.74Å; F453-F590 HydrophobicContact CD1-CE2 3.74Å; F453-F590 HydrophobicContact CE1-CD2 4.3Å; F453-F590 AromaticContact CE1-CE2 3.29Å; F453-F590 HydrophobicContact CE1-CE2 3.29Å; F453-F590 AromaticContact CE1-CZ 3.84Å; F453-F590 HydrophobicContact CE1-CZ 3.84Å; F453-F590 HydrophobicContact CZ-CE2 4.29Å; H588-F590 HydrophobicContact CB-CD2 4.35Å; H588-F590 HydrophobicContact CB-CE2 3.95Å
591	T	63.5	Low	72.2	Confident	94 Å²	94	61.3 Å²	61.3	58%	0.577	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-47.8	-178.8	-59.9	0	0	0	0	110.5	S451 D589	S451-T591 WeakPolarHBondContact CB-OG1 3.46Å; S451-T591 PolarHBondContact OG-OG1 3.44Å; D589-T591 VanDerWaalsContact C-N 3.35Å; D589-T591 PolarHBondContact OD1-N 3.04Å
592	N	66.5	Low	70.3	Confident	98 Å²	98	70.1 Å²	70.1	52%	0.524	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3	-177.3	-60.6	-57.5	0	0	0	113.4	D589 R594	D589-N592 PolarHBondContact OD1-N 3.42Å; D589-N592 PolarHBondContact OD1-ND2 3.35Å; D589-N592 PolarHBondContact OD2-ND2 2.92Å; N592-R594 VanDerWaalsContact C-N 3.26Å; N592-R594 HydrophobicContact CB-CG 3.99Å; N592-R594 PolarHBondContact O-N 3.34Å
593	R	66.7	Low	69.6	Low	211 Å²	211	71.2 Å²	71.2	80%	0.796	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	45.5	-177.9	-60.3	-177.7	177.1	-171.1	-2.6	112.9	D589	D589-R593 WeakPolarHBondContact O-CA 3.14Å; D589-R593 PolarHBondContact O-N 2.58Å
594	R	65.7	Low	68.8	Low	158 Å²	158	73.9 Å²	73.9	60%	0.596	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	153.8	-179	66.1	-176.9	176.7	174.1	-0.6	111.2	D589 N592	D589-R594 HydrophobicContact CB-CG 3.73Å; D589-R594 PolarHBondContact N-O 3.17Å; D589-R594 PolarHBondContact O-N 3.49Å; D589-R594 VanDerWaalsContact O-N 3.15Å; D589-R594 IonicContact OD2-CZ 3.89Å; D589-R594 VanDerWaalsContact OD2-CZ 3.31Å; D589-R594 IonicContact OD2-NE 3.51Å; D589-R594 PolarHBondContact OD2-NE 3.27Å; D589-R594 IonicContact OD2-NH2 3.66Å; D589-R594 PolarHBondContact OD2-NH2 3.2Å; N592-R594 VanDerWaalsContact C-N 3.26Å; N592-R594 HydrophobicContact CB-CG 3.99Å; N592-R594 PolarHBondContact O-N 3.34Å
595	I	69.1	Low	68.1	Low	80 Å²	80	77.5 Å²	77.5	41%	0.41	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.2	173.5	-165.7	170.1	0	0	0	108.7	T489 V586 V587 F597	T489-I595 HydrophobicContact CG2-CD1 3.84Å; V586-I595 HydrophobicContact CG1-CD1 3.66Å; V586-I595 HydrophobicContact CG1-CG1 3.88Å; V587-I595 CarbonylContact O-C 3.54Å; V587-I595 WeakPolarHBondContact O-CA 3.47Å; V587-I595 WeakPolarHBondContact O-CG1 3.33Å; I595-F597 HydrophobicContact CD1-CE1 3.82Å; I595-F597 HydrophobicContact CD1-CZ 4.1Å; I595-F597 HydrophobicContact CG1-CE1 3.9Å; I595-F597 HydrophobicContact CG1-CZ 4.21Å; I595-F597 HydrophobicContact CG2-CE2 4.49Å; I595-F597 HydrophobicContact CG2-CZ 3.99Å
596	G	71.4	Confident	67.6	Low	27 Å²	27	80.8 Å²	80.8	28%	0.278	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.2	178.6	0	0	0	0	0	111.1	V587	V587-G596 PolarHBondContact N-O 3.42Å; V587-G596 PolarHBondContact O-N 2.64Å
597	F	77.2	Confident	67.1	Low	55 Å²	55	85.8 Å²	85.8	24%	0.241	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111.6	174.5	-49.6	-56.9	0	0	0	108.7	T489 L543 W580 Y584 V586 I595	T489-F597 HydrophobicContact CG2-CE1 4.1Å; L543-F597 HydrophobicContact CD1-CB 4.3Å; L543-F597 HydrophobicContact CD1-CD2 3.62Å; L543-F597 HydrophobicContact CD1-CE2 4.38Å; L543-F597 HydrophobicContact CD1-CG 4.29Å; W580-F597 HydrophobicContact CZ2-CD1 4.15Å; W580-F597 AromaticContact CZ2-CD2 3.89Å; W580-F597 HydrophobicContact CZ2-CD2 3.89Å; W580-F597 HydrophobicContact CZ2-CE1 4.25Å; W580-F597 AromaticContact CZ2-CE2 4Å; W580-F597 HydrophobicContact CZ2-CE2 4Å; W580-F597 AromaticContact CZ2-CG 3.96Å; W580-F597 HydrophobicContact CZ2-CG 3.96Å; W580-F597 HydrophobicContact CZ2-CZ 4.17Å; W580-F597 AromaticContact NE1-CD1 3.3Å; W580-F597 VanDerWaalsContact NE1-CD1 3.3Å; W580-F597 AromaticContact NE1-CE1 3.45Å; W580-F597 AromaticContact NE1-CG 3.91Å; Y584-F597 HydrophobicContact CD1-CB 4.38Å; Y584-F597 HydrophobicContact CG-CB 4.28Å; V586-F597 HydrophobicContact CG1-CD1 4.29Å; V586-F597 HydrophobicContact CG1-CE1 4.06Å; V586-F597 HydrophobicContact CG2-CD1 4.35Å; I595-F597 HydrophobicContact CD1-CE1 3.82Å; I595-F597 HydrophobicContact CD1-CZ 4.1Å; I595-F597 HydrophobicContact CG1-CE1 3.9Å; I595-F597 HydrophobicContact CG1-CZ 4.21Å; I595-F597 HydrophobicContact CG2-CE2 4.49Å; I595-F597 HydrophobicContact CG2-CZ 3.99Å
598	C	74.2	Confident	66.7	Low	65 Å²	65	89.4 Å²	89.4	44%	0.439	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	142.1	173.6	-59	0	0	0	0	108.5	Y584 C585 S600	Y584-C598 CarbonylContact C-O 3.24Å; Y584-C598 WeakPolarHBondContact CA-O 3.23Å; C585-C598 HydrophobicContact CB-CB 4.32Å; C585-C598 PolarHBondContact N-O 3.18Å; C585-C598 PolarHBondContact O-N 3.01Å; C598-S600 PolarHBondContact O-N 3.38Å
599	P	74.8	Confident	66.4	Low	97 Å²	97	93.6 Å²	93.6	63%	0.63	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.1	128.5	171.2	-24.9	34	0	0	0	110.4	M601	P599-M601 PolarHBondContact O-N 3.2Å
600	S	67.3	Low	66.2	Low	9 Å²	9	99.9 Å²	99.9	6%	0.063	50%	0.502	C	S	.	.			trans	-66.1	115.9	174.6	-170.8	0	0	0	0	108.4	Q583 C598	Q583-S600 WeakPolarHBondContact O-CB 3.42Å; Q583-S600 PolarHBondContact O-N 3.41Å; C598-S600 PolarHBondContact O-N 3.38Å
601	M	57.3	Low	66.4	Low	169 Å²	169	104.7 Å²	104.7	83%	0.833	53%	0.528	S	S	*	.			trans	-77	142.6	172.8	-60.7	-170.5	-162.3	0	0	108.9	P599	P599-M601 PolarHBondContact O-N 3.2Å
602	M	43.4	Very low	66.7	Low	193 Å²	193	105.6 Å²	105.6	95%	0.951	52%	0.524	S	S	*	.			trans	-52.6	0	-175.5	-73.8	-173.7	-168.9	0	0	113.6

Retrieved 602 of 602 residues in 292.1 ms (Link to these results)

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