A0A087XKV7_POEFO Loading...

Beta-secretase 2

AlphaFold DB , UniProt , Accession A0A087XKV7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 508 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	34.3	Very low	250 Å²	250	149.1 Å²	149.1	100%	1.232	82%	0.816	S	S	*	*				0	118.7	0	-74.1	-174.9	-91.7	0	0	106.6
2	A	36.2	Very low	34.1	Very low	100 Å²	100	150.4 Å²	150.4	83%	0.826	81%	0.809	S	S	*	*			cis	-153.2	151	1.1	0	0	0	0	0	108
3	N	33.8	Very low	34.1	Very low	163 Å²	163	149.1 Å²	149.1	87%	0.872	81%	0.808	S	S	*	*			trans	-58.4	140.3	173.5	-77	-38.4	0	0	0	112.8
4	I	36.4	Very low	33.8	Very low	174 Å²	174	151.8 Å²	151.8	89%	0.892	81%	0.809	S	S	*	*			trans	-136.9	128.6	142.9	-60.2	-176.4	0	0	0	108.5
5	A	35.7	Very low	33.7	Very low	75 Å²	75	147.9 Å²	147.9	62%	0.62	80%	0.799	S	S	*	*			trans	-103.3	152.8	-174	0	0	0	0	0	111.5
6	L	34.2	Very low	33.5	Very low	153 Å²	153	148.1 Å²	148.1	80%	0.801	80%	0.799	S	S	*	*			trans	49.6	128.8	154.7	-82.5	96.5	0	0	0	120.2
7	F	29.8	Very low	33.4	Very low	194 Å²	194	148 Å²	148	85%	0.851	80%	0.797	S	S	*	*				-164.4	123.7	104.3	-107.9	-80.5	0	0	0	110.5
8	S	35.5	Very low	33.4	Very low	92 Å²	92	150.8 Å²	150.8	64%	0.643	80%	0.801	S	S	*	*			trans	-83.6	122.2	169.5	171.9	0	0	0	0	108.2
9	I	34.6	Very low	33.2	Very low	148 Å²	148	146.3 Å²	146.3	76%	0.759	80%	0.795	S	S	*	*			trans	-118.8	106	169.2	-63.3	175.3	0	0	0	106.9	A11	I9-A11 PolarHBondContact O-N 2.92Å
10	W	33	Very low	33.2	Very low	206 Å²	206	142.6 Å²	142.6	78%	0.78	79%	0.785	S	S	*	*			trans	-74.2	108.2	165.9	-85.9	55.7	0	0	0	108.6	F12	W10-F12 HydrophobicContact CE3-CD2 4.11Å; W10-F12 AromaticContact CE3-CE2 3.66Å; W10-F12 HydrophobicContact CE3-CE2 3.66Å; W10-F12 AromaticContact CZ3-CE2 3.85Å; W10-F12 HydrophobicContact CZ3-CE2 3.85Å; W10-F12 HydrophobicContact CZ3-CZ 4.41Å
11	A	32.9	Very low	33	Very low	85 Å²	85	142.2 Å²	142.2	70%	0.702	79%	0.787	S	S	*	*			trans	-93.5	100.4	166.1	0	0	0	0	0	108.8	I9 V13	I9-A11 PolarHBondContact O-N 2.92Å; A11-V13 PolarHBondContact O-N 3.5Å
12	F	32.3	Very low	33	Very low	165 Å²	165	138.8 Å²	138.8	72%	0.724	76%	0.762	S	S	*	*			trans	-72.9	107.5	162	-101.1	-91.2	0	0	0	108	W10	W10-F12 HydrophobicContact CE3-CD2 4.11Å; W10-F12 AromaticContact CE3-CE2 3.66Å; W10-F12 HydrophobicContact CE3-CE2 3.66Å; W10-F12 AromaticContact CZ3-CE2 3.85Å; W10-F12 HydrophobicContact CZ3-CE2 3.85Å; W10-F12 HydrophobicContact CZ3-CZ 4.41Å
13	V	33.9	Very low	32.6	Very low	133 Å²	133	139.4 Å²	139.4	81%	0.806	76%	0.759	S	S	*	*			trans	-97	108.9	165.8	177.9	0	0	0	0	107.6	A11 S15	A11-V13 PolarHBondContact O-N 3.5Å; V13-S15 PolarHBondContact O-N 2.52Å
14	F	29.5	Very low	32.5	Very low	187 Å²	187	141.4 Å²	141.4	82%	0.82	76%	0.755	S	S	*	*			trans	-61.2	113.7	171.7	-108.3	-100.9	0	0	0	109.8	L16	F14-L16 PolarHBondContact O-N 3.29Å
15	S	33.3	Very low	32.1	Very low	94 Å²	94	142.4 Å²	142.4	66%	0.657	75%	0.753	S	S	*	*			trans	-76.6	108.7	164.5	54.2	0	0	0	0	109.1	V13 N17	V13-S15 PolarHBondContact O-N 2.52Å; S15-N17 PolarHBondContact O-N 2.91Å; S15-N17 VanDerWaalsContact O-N 3.09Å
16	L	30.7	Very low	32	Very low	151 Å²	151	142.1 Å²	142.1	79%	0.791	75%	0.747	S	S	*	*			trans	-69.1	96.9	167.3	-94.1	135.9	0	0	0	109.1	F14 F18	F14-L16 PolarHBondContact O-N 3.29Å; L16-F18 PolarHBondContact O-N 2.76Å
17	N	30.6	Very low	32	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	74%	0.738	S	S	*	*			trans	-76.8	109.2	163.4	-86.8	-55.2	0	0	0	108.5	S15 G19	S15-N17 PolarHBondContact O-N 2.91Å; S15-N17 VanDerWaalsContact O-N 3.09Å; N17-G19 VanDerWaalsContact C-N 3.29Å; N17-G19 PolarHBondContact O-N 3.41Å
18	F	33.8	Very low	32.1	Very low	198 Å²	198	136.4 Å²	136.4	87%	0.868	73%	0.731	S	S	*	*			trans	-72.5	90.6	160	-88	-88.6	0	0	0	107.9	L16 A20	L16-F18 PolarHBondContact O-N 2.76Å; F18-A20 PolarHBondContact O-N 3.01Å; F18-A20 VanDerWaalsContact O-N 3.15Å
19	G	29.4	Very low	32.1	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	72%	0.715	S	S	*	*			trans	-69.3	103.2	166.3	0	0	0	0	0	109.1	N17 T21	N17-G19 VanDerWaalsContact C-N 3.29Å; N17-G19 PolarHBondContact O-N 3.41Å; G19-T21 PolarHBondContact O-N 3.23Å; G19-T21 VanDerWaalsContact O-N 3.1Å
20	A	33.5	Very low	32.1	Very low	73 Å²	73	134.7 Å²	134.7	60%	0.603	71%	0.709	S	S	*	*			trans	-67.6	102.6	160.8	0	0	0	0	0	107.4	F18 Y22	F18-A20 PolarHBondContact O-N 3.01Å; F18-A20 VanDerWaalsContact O-N 3.15Å; A20-Y22 HydrophobicContact CB-CE2 4.1Å; A20-Y22 PolarHBondContact O-N 3.01Å
21	T	29.4	Very low	32.1	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	70%	0.695	S	S	*	*			trans	-66.9	97.7	168.8	38.6	0	0	0	0	108.5	G19 C23	G19-T21 PolarHBondContact O-N 3.23Å; G19-T21 VanDerWaalsContact O-N 3.1Å; T21-C23 PolarHBondContact O-N 3.27Å
22	Y	34.7	Very low	32.2	Very low	179 Å²	179	132.1 Å²	132.1	70%	0.702	69%	0.688	S	S	*	*			trans	-73.7	110.3	160.5	-69.5	-82.8	0	0	0	107.3	A20 Y24	A20-Y22 HydrophobicContact CB-CE2 4.1Å; A20-Y22 PolarHBondContact O-N 3.01Å; Y22-Y24 WeakPolarHBondContact O-CD2 3.34Å; Y22-Y24 PolarHBondContact O-N 2.94Å
23	C	26.7	Very low	32	Very low	113 Å²	113	130.5 Å²	130.5	76%	0.764	69%	0.694	S	S	*	*			trans	-65.8	99	165.6	-84.7	0	0	0	0	108.1	T21 F25	T21-C23 PolarHBondContact O-N 3.27Å; C23-F25 PolarHBondContact O-N 2.96Å
24	Y	31.8	Very low	31.8	Very low	204 Å²	204	126.9 Å²	126.9	80%	0.8	68%	0.684	S	S	*	*			trans	-74	106.9	166.1	-72.6	-87.1	0	0	0	108.1	Y22	Y22-Y24 WeakPolarHBondContact O-CD2 3.34Å; Y22-Y24 PolarHBondContact O-N 2.94Å
25	F	29.3	Very low	31.8	Very low	195 Å²	195	128.3 Å²	128.3	86%	0.855	69%	0.69	S	S	*	*			trans	-81	113	162.4	-96	-90.3	0	0	0	107.6	C23	C23-F25 PolarHBondContact O-N 2.96Å
26	S	32.2	Very low	31.9	Very low	70 Å²	70	131.6 Å²	131.6	49%	0.49	69%	0.689	S	S	.	*			trans	-94.6	133.5	173.4	49.6	0	0	0	0	110.2	E325	S26-E325 WeakPolarHBondContact CB-OE1 3.4Å
27	I	34.4	Very low	31.6	Very low	120 Å²	120	132.7 Å²	132.7	62%	0.615	70%	0.695	S	S	*	*			trans	-111.6	110	178	-56	175.4	0	0	0	108.2	L29	I27-L29 PolarHBondContact O-N 3.3Å
28	P	33	Very low	31.4	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-75.4	124	177.3	27.6	-31.4	0	0	0	111.3
29	L	35.1	Very low	30.9	Very low	60 Å²	60	131 Å²	131	31%	0.314	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-71.1	125.9	171.6	-100.6	140.7	0	0	0	110.8	I27 I324 A338 C339 W340	I27-L29 PolarHBondContact O-N 3.3Å; L29-I324 HydrophobicContact CD1-CG2 4.02Å; L29-A338 HydrophobicContact CD2-CB 4.36Å; L29-C339 WeakPolarHBondContact CD2-O 3.3Å; L29-W340 HydrophobicContact CD1-CZ2 3.95Å; L29-W340 HydrophobicContact CD2-CH2 4.5Å; L29-W340 HydrophobicContact CD2-CZ2 4.18Å; L29-W340 HydrophobicContact CG-CZ2 4.46Å
30	K	34.2	Very low	30.9	Very low	145 Å²	145	132.9 Å²	132.9	63%	0.63	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-97.1	126.2	171.2	-72.9	-177	177.3	178.8	0	109.7	Y32	K30-Y32 HydrophobicContact CB-CE2 3.87Å
31	I	33.7	Very low	30.6	Very low	94 Å²	94	139 Å²	139	48%	0.482	71%	0.708	S	S	.	*			trans	-110.1	130.8	-179.5	-57.9	171.7	0	0	0	108.6
32	Y	34.5	Very low	30.4	Very low	143 Å²	143	137.9 Å²	137.9	56%	0.561	71%	0.713	S	S	*	*			trans	-124.1	140.4	177.9	-66.9	-85.1	0	0	0	111.7	K30	K30-Y32 HydrophobicContact CB-CE2 3.87Å
33	P	28.9	Very low	29.9	Very low	130 Å²	130	137.5 Å²	137.5	84%	0.844	72%	0.723	S	S	*	*			trans	-99.2	122.5	172.5	33.4	-26.7	0	0	0	111.7
34	G	30	Very low	29.9	Very low	58 Å²	58	138.9 Å²	138.9	60%	0.598	72%	0.722	S	S	*	*			trans	-135	140.4	178	0	0	0	0	0	114.1
35	K	28.6	Very low	29.6	Very low	217 Å²	217	135.1 Å²	135.1	94%	0.943	73%	0.725	S	S	*	*			trans	-108.4	144	171.6	-79.3	-176.8	174.6	-178.5	0	109.5
36	Y	35.5	Very low	29.6	Very low	163 Å²	163	131 Å²	131	64%	0.639	72%	0.721	S	S	*	*			trans	-117.4	149.1	-167.1	-71.4	-94.4	0	0	0	114.5	D381	Y36-D381 PolarHBondContact OH-O 3.37Å
37	N	24.3	Very low	29.3	Very low	173 Å²	173	135.1 Å²	135.1	93%	0.925	74%	0.738	S	S	*	*			trans	-137.1	144.8	164.6	-99.4	-9.4	0	0	0	109.1
38	F	25.5	Very low	28.8	Very low	160 Å²	160	140.4 Å²	140.4	70%	0.702	75%	0.75	S	S	*	*			trans	-107	144.8	-162.6	-147.1	-98.4	0	0	0	112.8	T40	F38-T40 HydrophobicContact CD1-CG2 4.24Å; F38-T40 HydrophobicContact CE1-CG2 3.45Å; F38-T40 VanDerWaalsContact CE1-CG2 3.45Å; F38-T40 HydrophobicContact CZ-CG2 4.05Å
39	T	23.3	Very low	28.5	Very low	148 Å²	148	142.2 Å²	142.2	91%	0.908	76%	0.758	S	S	*	*			trans	-162	138.1	150.6	30.5	0	0	0	0	110.4
40	T	31.1	Very low	28	Very low	106 Å²	106	145.5 Å²	145.5	65%	0.65	78%	0.78	S	S	*	*			trans	-121.7	145.6	-171.9	33.4	0	0	0	0	111.3	F38	F38-T40 HydrophobicContact CD1-CG2 4.24Å; F38-T40 HydrophobicContact CE1-CG2 3.45Å; F38-T40 VanDerWaalsContact CE1-CG2 3.45Å; F38-T40 HydrophobicContact CZ-CG2 4.05Å
41	E	25.5	Very low	27.6	Very low	200 Å²	200	143.1 Å²	143.1	94%	0.935	79%	0.788	S	S	*	*			trans	-173.2	125.6	142.6	-108.1	174	-151.2	0	0	111
42	A	25.2	Very low	27.4	Very low	112 Å²	112	146.8 Å²	146.8	93%	0.926	81%	0.808	S	S	*	*			trans	-164.1	151.5	153.2	0	0	0	0	0	113.2
43	N	24.5	Very low	27	Very low	170 Å²	170	150 Å²	150	91%	0.909	83%	0.825	S	S	*	*			trans	-90	157.3	-159.1	-122.3	-27.8	0	0	0	115.3
44	L	26.7	Very low	27.2	Very low	142 Å²	142	149.3 Å²	149.3	74%	0.743	82%	0.823	S	S	*	*			trans	-95.8	147.5	-176.7	-83.1	142	0	0	0	114.6
45	S	26.1	Very low	27	Very low	125 Å²	125	154.2 Å²	154.2	87%	0.874	84%	0.835	S	S	*	*			trans	-148.2	146.2	148.3	58.9	0	0	0	0	111.3
46	S	29.5	Very low	27.5	Very low	108 Å²	108	147.6 Å²	147.6	76%	0.755	83%	0.829	S	S	*	*			trans	-98.2	151.5	-160.4	112.8	0	0	0	0	113.3
47	D	25.1	Very low	27.6	Very low	158 Å²	158	149.5 Å²	149.5	85%	0.845	84%	0.843	S	S	*	*			trans	-146.1	158.1	154.5	-105.4	-29.8	0	0	0	116.1
48	R	25.7	Very low	27.8	Very low	231 Å²	231	144.6 Å²	144.6	87%	0.872	83%	0.834	S	S	*	*			trans	-79.5	150.7	-152	-68.6	167.6	167.4	-179.3	-3.6	117.2
49	V	26.2	Very low	28.3	Very low	143 Å²	143	143.2 Å²	143.2	87%	0.867	83%	0.833	S	S	*	*			trans	-85.2	134.9	175.9	178.6	0	0	0	0	112
50	V	24.2	Very low	28.8	Very low	129 Å²	129	141.4 Å²	141.4	78%	0.782	83%	0.826	S	S	*	*			trans	-108.9	127.6	172.1	177.2	0	0	0	0	109.6
51	A	25.9	Very low	29.3	Very low	95 Å²	95	141.8 Å²	141.8	79%	0.785	82%	0.824	S	S	*	*			trans	-82.6	138.5	177.9	0	0	0	0	0	112
52	L	29.2	Very low	30.3	Very low	172 Å²	172	134.3 Å²	134.3	90%	0.901	80%	0.796	S	S	*	*			trans	-117.4	134.8	171.3	-79.4	164.9	0	0	0	110.7
53	K	26.3	Very low	31.3	Very low	211 Å²	211	132.5 Å²	132.5	92%	0.917	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-84.8	147.1	180	-80.4	178.9	172.6	179.6	0	111.3
54	S	32.4	Very low	32.3	Very low	114 Å²	114	127.1 Å²	127.1	80%	0.797	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-93.1	136.6	178.8	165.9	0	0	0	0	111.6
55	D	27.3	Very low	33	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-90	123.2	170	-76.3	-26.4	0	0	0	109.6	E57	D55-E57 PolarHBondContact O-N 3.02Å
56	G	38.6	Very low	34.3	Very low	78 Å²	78	124.4 Å²	124.4	80%	0.804	74%	0.738	S	S	*	*	S	Bend	trans	-74	109.3	-172.2	0	0	0	0	0	113.4
57	E	36.6	Very low	35.7	Very low	202 Å²	202	121.8 Å²	121.8	94%	0.944	73%	0.728	S	S	*	*			trans	-169.2	102.7	138.9	-104.6	-169.4	-175.7	0	0	108.6	D55	D55-E57 PolarHBondContact O-N 3.02Å
58	G	29.4	Very low	37.5	Very low	70 Å²	70	116.1 Å²	116.1	72%	0.722	70%	0.699	S	S	*	*	S	Bend	trans	157	105.3	175	0	0	0	0	0	113.4
59	L	36.5	Very low	39.6	Very low	131 Å²	131	105.3 Å²	105.3	69%	0.686	66%	0.659	S	S	*	*			trans	51.5	105.9	167.3	-72.2	154.3	0	0	0	116.3	L61 P251	L59-L61 PolarHBondContact O-N 3.28Å; L59-P251 HydrophobicContact CB-CB 4.37Å; L59-P251 HydrophobicContact CB-CG 3.91Å; L59-P251 HydrophobicContact CD1-CB 4.46Å; L59-P251 HydrophobicContact CD1-CG 4.3Å
60	S	33.4	Very low	42.2	Very low	110 Å²	110	101.2 Å²	101.2	77%	0.769	63%	0.632	S	S	*	*			trans	-33.4	123.9	168.9	-174.9	0	0	0	0	112.1	A62	S60-A62 PolarHBondContact O-N 3.24Å
61	L	41.8	Very low	45.1	Very low	114 Å²	114	95.8 Å²	95.8	60%	0.597	60%	0.598	S	S	*	*			trans	-42.1	109.1	163.6	-69.8	159.6	0	0	0	107.9	L59 S63 L72	L59-L61 PolarHBondContact O-N 3.28Å; L61-S63 PolarHBondContact O-N 3.41Å; L61-L72 HydrophobicContact CD2-CD1 4.28Å
62	A	44.9	Very low	47.9	Very low	44 Å²	44	95.8 Å²	95.8	36%	0.364	58%	0.584	S	S	.	*			trans	-83.7	67.6	-177.1	0	0	0	0	0	109.1	S60 F71	S60-A62 PolarHBondContact O-N 3.24Å; A62-F71 HydrophobicContact CB-CD2 3.74Å; A62-F71 HydrophobicContact CB-CE2 3.41Å; A62-F71 VanDerWaalsContact CB-CE2 3.41Å; A62-F71 HydrophobicContact CB-CZ 4.32Å; A62-F71 WeakPolarHBondContact O-CD2 3.44Å
63	S	46.2	Very low	50.7	Low	73 Å²	73	92 Å²	92	51%	0.51	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-81.2	125.7	154.5	29.4	0	0	0	0	107.8	L61	L61-S63 PolarHBondContact O-N 3.41Å
64	D	47.2	Very low	53.9	Low	58 Å²	58	82 Å²	82	31%	0.31	52%	0.521	S	S	.	.			trans	-58.1	132.3	172	172.6	7.1	0	0	0	109.1	S66 G67 V69	D64-S66 PolarHBondContact O-N 2.81Å; D64-S66 PolarHBondContact OD1-N 2.94Å; D64-S66 PolarHBondContact OD1-OG 3.47Å; D64-S66 WeakPolarHBondContact OD2-CB 3.47Å; D64-S66 PolarHBondContact OD2-OG 2.93Å; D64-G67 PolarHBondContact O-N 3.24Å; D64-V69 HydrophobicContact CB-CB 4.34Å; D64-V69 PolarHBondContact N-O 2.81Å
65	P	41.5	Very low	56.9	Low	137 Å²	137	78.2 Å²	78.2	89%	0.89	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-19.2	172.9	19.6	-32.1	0	0	0	114.4
66	S	52.7	Low	60.1	Low	73 Å²	73	74 Å²	74	51%	0.51	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.9	174	88.6	0	0	0	0	114.7	D64 T68	D64-S66 PolarHBondContact O-N 2.81Å; D64-S66 PolarHBondContact OD1-N 2.94Å; D64-S66 PolarHBondContact OD1-OG 3.47Å; D64-S66 WeakPolarHBondContact OD2-CB 3.47Å; D64-S66 PolarHBondContact OD2-OG 2.93Å; S66-T68 PolarHBondContact O-N 2.75Å; S66-T68 WeakPolarHBondContact OG-CB 3.35Å; S66-T68 PolarHBondContact OG-N 3.42Å; S66-T68 PolarHBondContact OG-OG1 2.89Å
67	G	58.7	Low	62.8	Low	53 Å²	53	70.7 Å²	70.7	55%	0.546	44%	0.435	S	S	.	.	S	Bend	trans	75.5	4	-175.2	0	0	0	0	0	115.1	D64 V69	D64-G67 PolarHBondContact O-N 3.24Å; G67-V69 VanDerWaalsContact C-N 3.34Å
68	T	62.3	Low	65.6	Low	38 Å²	38	61.1 Å²	61.1	23%	0.233	39%	0.39	C	S	.	.	S	Bend	trans	-72.5	-27.9	-179.3	-53.4	0	0	0	0	112.5	S66 N164 L216 I218	S66-T68 PolarHBondContact O-N 2.75Å; S66-T68 WeakPolarHBondContact OG-CB 3.35Å; S66-T68 PolarHBondContact OG-N 3.42Å; S66-T68 PolarHBondContact OG-OG1 2.89Å; T68-N164 PolarHBondContact O-N 2.89Å; T68-L216 HydrophobicContact CG2-CB 4.35Å; T68-I218 HydrophobicContact CG2-CG2 4.37Å
69	V	69.6	Low	68.7	Low	5 Å²	5	60.4 Å²	60.4	3%	0.03	37%	0.368	C	S	.	.			trans	-130.3	121.5	-177.1	-167.9	0	0	0	0	110.9	D64 G67 F71 M74 I218	D64-V69 HydrophobicContact CB-CB 4.34Å; D64-V69 PolarHBondContact N-O 2.81Å; G67-V69 VanDerWaalsContact C-N 3.34Å; V69-F71 HydrophobicContact CG1-CD1 3.56Å; V69-F71 HydrophobicContact CG1-CE1 3.38Å; V69-M74 HydrophobicContact CG1-CE 3.64Å; V69-I218 HydrophobicContact CG2-CB 4.12Å; V69-I218 HydrophobicContact CG2-CG2 3.32Å
70	N	81.6	Confident	71.3	Confident	56 Å²	56	54.9 Å²	54.9	30%	0.299	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-122.1	105	170.4	-179.6	7	0	0	0	108.8	L72 D73	N70-L72 PolarHBondContact O-N 3.14Å; N70-L72 WeakPolarHBondContact OD1-CB 3.3Å; N70-L72 PolarHBondContact OD1-N 3.23Å; N70-D73 HydrophobicContact CB-CB 4.47Å; N70-D73 WeakPolarHBondContact CB-OD2 3.48Å; N70-D73 PolarHBondContact ND2-OD1 2.74Å; N70-D73 PolarHBondContact ND2-OD2 3.08Å; N70-D73 PolarHBondContact O-N 3.39Å; N70-D73 VanDerWaalsContact O-N 3.14Å
71	F	85.2	Confident	74	Confident	16 Å²	16	51.7 Å²	51.7	7%	0.07	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-61.3	-29.4	-177.6	-65.5	-16.4	0	0	0	113.1	A62 V69 D73 M74 V75 I245 E250	A62-F71 HydrophobicContact CB-CD2 3.74Å; A62-F71 HydrophobicContact CB-CE2 3.41Å; A62-F71 VanDerWaalsContact CB-CE2 3.41Å; A62-F71 HydrophobicContact CB-CZ 4.32Å; A62-F71 WeakPolarHBondContact O-CD2 3.44Å; V69-F71 HydrophobicContact CG1-CD1 3.56Å; V69-F71 HydrophobicContact CG1-CE1 3.38Å; F71-D73 VanDerWaalsContact C-N 3.25Å; F71-D73 PolarHBondContact O-N 3.27Å; F71-M74 HydrophobicContact CD1-CE 3.59Å; F71-M74 HydrophobicContact CE1-CE 4.25Å; F71-M74 PolarHBondContact O-N 3.32Å; F71-V75 PolarHBondContact O-N 3.04Å; F71-I245 HydrophobicContact CB-CG2 4.28Å; F71-I245 HydrophobicContact CD1-CG2 3.51Å; F71-I245 HydrophobicContact CD2-CG2 4.34Å; F71-I245 HydrophobicContact CE1-CG2 3.83Å; F71-I245 HydrophobicContact CG-CG2 3.81Å; F71-I245 HydrophobicContact CZ-CG2 4.43Å; F71-E250 HydrophobicContact CB-CB 4.42Å; F71-E250 WeakPolarHBondContact CB-OE2 3.22Å
72	L	84.8	Confident	76.3	Confident	94 Å²	94	46.7 Å²	46.7	49%	0.492	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-64.3	-30.5	178.4	-63	177.1	0	0	0	112.6	L61 N70 M74 V75	L61-L72 HydrophobicContact CD2-CD1 4.28Å; N70-L72 PolarHBondContact O-N 3.14Å; N70-L72 WeakPolarHBondContact OD1-CB 3.3Å; N70-L72 PolarHBondContact OD1-N 3.23Å; L72-M74 PolarHBondContact O-N 2.94Å; L72-V75 PolarHBondContact O-N 2.89Å
73	D	87.9	Confident	78.2	Confident	93 Å²	93	46.3 Å²	46.3	50%	0.497	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-74.3	-16.2	177.4	-63.1	-24.6	0	0	0	112.2	N70 F71 K161	N70-D73 HydrophobicContact CB-CB 4.47Å; N70-D73 WeakPolarHBondContact CB-OD2 3.48Å; N70-D73 PolarHBondContact ND2-OD1 2.74Å; N70-D73 PolarHBondContact ND2-OD2 3.08Å; N70-D73 PolarHBondContact O-N 3.39Å; N70-D73 VanDerWaalsContact O-N 3.14Å; F71-D73 VanDerWaalsContact C-N 3.25Å; F71-D73 PolarHBondContact O-N 3.27Å; D73-K161 WeakPolarHBondContact O-CB 3.45Å
74	M	94.4	Very high	80.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-99.5	-4.2	178.2	-67.5	-174.1	-77.3	0	0	113.3	V69 F71 L72 N77 P163 I245 M246	V69-M74 HydrophobicContact CG1-CE 3.64Å; F71-M74 HydrophobicContact CD1-CE 3.59Å; F71-M74 HydrophobicContact CE1-CE 4.25Å; F71-M74 PolarHBondContact O-N 3.32Å; L72-M74 PolarHBondContact O-N 2.94Å; M74-N77 PolarHBondContact O-ND2 2.61Å; M74-N77 PolarHBondContact O-OD1 3.27Å; M74-N77 VanDerWaalsContact O-OD1 3.12Å; M74-P163 HydrophobicContact SD-CG 4.27Å; M74-I245 HydrophobicContact CB-CD1 3.56Å; M74-I245 HydrophobicContact CE-CG2 4.13Å; M74-M246 WeakPolarHBondContact CE-O 3.4Å; M74-M246 HydrophobicContact SD-CB 4.17Å; M74-M246 PolarHBondContact SD-N 2.72Å; M74-M246 VanDerWaalsContact SD-N 3.42Å
75	V	94.2	Very high	82.4	Confident	35 Å²	35	45.1 Å²	45.1	21%	0.212	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	135	170.6	175.7	0	0	0	0	109	F71 L72 N77 E250 L253	F71-V75 PolarHBondContact O-N 3.04Å; L72-V75 PolarHBondContact O-N 2.89Å; V75-N77 VanDerWaalsContact C-N 3.27Å; V75-N77 PolarHBondContact O-N 3.3Å; V75-E250 HydrophobicContact CG2-CG 4.18Å; V75-L253 HydrophobicContact CG1-CD2 4.17Å; V75-L253 HydrophobicContact CG2-CD2 4.24Å
76	N	93.9	Very high	85	Confident	73 Å²	73	38.8 Å²	38.8	39%	0.39	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	37.3	178	-66.6	-30	0	0	0	112.8	P240 G242 S243	N76-P240 HydrophobicContact CB-CB 3.59Å; N76-P240 HydrophobicContact CB-CG 4.22Å; N76-G242 CarbonylContact C-O 3.53Å; N76-G242 WeakPolarHBondContact CA-O 3.46Å; N76-S243 PolarHBondContact N-OG 2.89Å
77	N	95.7	Very high	87.2	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.053	21%	0.209	C	C	.	.			trans	-94.8	-3.9	177.2	71.9	-6.6	0	0	0	114	M74 V75 K161 G242 S243 L244	M74-N77 PolarHBondContact O-ND2 2.61Å; M74-N77 PolarHBondContact O-OD1 3.27Å; M74-N77 VanDerWaalsContact O-OD1 3.12Å; V75-N77 VanDerWaalsContact C-N 3.27Å; V75-N77 PolarHBondContact O-N 3.3Å; N77-K161 HydrophobicContact CB-CB 3.6Å; N77-K161 HydrophobicContact CB-CD 4Å; N77-K161 PolarHBondContact ND2-O 2.79Å; N77-G242 PolarHBondContact N-O 3.32Å; N77-S243 WeakPolarHBondContact OD1-CA 3.3Å; N77-L244 PolarHBondContact ND2-O 2.74Å; N77-L244 PolarHBondContact OD1-N 3.42Å
78	L	96.6	Very high	89	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	150.5	173.1	-55.5	-178.8	0	0	0	111.8	Y87 I88 V103 L224 A241 G242 L244	L78-Y87 WeakPolarHBondContact CA-O 3.39Å; L78-I88 HydrophobicContact CD2-CB 3.83Å; L78-I88 HydrophobicContact CD2-CD1 4.45Å; L78-I88 HydrophobicContact CD2-CG1 4.45Å; L78-V103 HydrophobicContact CD2-CG2 3.86Å; L78-L224 HydrophobicContact CD1-CD2 4.13Å; L78-A241 PolarHBondContact O-N 2.79Å; L78-G242 WeakPolarHBondContact CB-O 3.41Å; L78-G242 PolarHBondContact N-O 2.77Å; L78-L244 HydrophobicContact CD1-CB 4.22Å; L78-L244 HydrophobicContact CD2-CB 3.88Å; L78-L244 HydrophobicContact CG-CB 4.23Å
79	Q	93.6	Very high	90.7	Very high	55 Å²	55	34.4 Å²	34.4	26%	0.257	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	169.6	168.1	-70.1	170.9	69.3	0	0	109.1	Y86 Y87	Q79-Y86 CarbonylContact O-C 3.59Å; Q79-Y86 VanDerWaalsContact O-CA 3.28Å; Q79-Y86 WeakPolarHBondContact O-CA 3.47Å; Q79-Y87 HydrophobicContact CB-CD2 4.17Å; Q79-Y87 HydrophobicContact CB-CE1 3.93Å; Q79-Y87 HydrophobicContact CB-CE2 3.52Å; Q79-Y87 WeakPolarHBondContact CB-OH 3.31Å; Q79-Y87 HydrophobicContact CG-CE2 4.3Å; Q79-Y87 PolarHBondContact N-O 2.63Å; Q79-Y87 PolarHBondContact O-N 3.43Å; Q79-Y87 PolarHBondContact OE1-OH 3.29Å
80	G	91.4	Very high	92	Very high	15 Å²	15	34.1 Å²	34.1	16%	0.155	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.3	-160.7	178.6	0	0	0	0	0	113.5	A241	G80-A241 WeakPolarHBondContact O-CB 3.25Å
81	D	90.4	Very high	92.8	Very high	42 Å²	42	32.5 Å²	32.5	23%	0.225	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	170.7	-177.2	55.6	66.9	0	0	0	109.5	G83 R84 G85	D81-G83 PolarHBondContact O-N 3.39Å; D81-G83 VanDerWaalsContact OD1-CA 3.29Å; D81-G83 WeakPolarHBondContact OD1-CA 3.35Å; D81-G83 PolarHBondContact OD1-N 3.38Å; D81-R84 PolarHBondContact O-N 3.39Å; D81-R84 PolarHBondContact OD1-N 3.42Å; D81-R84 IonicContact OD1-NE 3.29Å; D81-R84 IonicContact OD2-CZ 3.74Å; D81-R84 VanDerWaalsContact OD2-CZ 3.27Å; D81-R84 IonicContact OD2-NE 2.67Å; D81-R84 PolarHBondContact OD2-NE 3.27Å; D81-R84 IonicContact OD2-NH2 2.84Å; D81-R84 PolarHBondContact OD2-NH2 3.1Å; D81-G85 CarbonylContact O-C 3.58Å; D81-G85 VanDerWaalsContact O-CA 3.26Å; D81-G85 WeakPolarHBondContact O-CA 3.49Å; D81-G85 PolarHBondContact O-N 2.81Å
82	S	88.8	Confident	93.5	Very high	9 Å²	9	31.7 Å²	31.7	6%	0.063	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.3	179.6	49.3	0	0	0	0	113.7	Y86 T302 Q377 E408	S82-Y86 VanDerWaalsContact N-CE2 3.32Å; S82-T302 VanDerWaalsContact O-CB 3.23Å; S82-T302 WeakPolarHBondContact O-CB 3.12Å; S82-T302 WeakPolarHBondContact O-CG2 3.42Å; S82-T302 PolarHBondContact O-OG1 3.28Å; S82-Q377 PolarHBondContact OG-NE2 3.27Å; S82-E408 VanDerWaalsContact CB-CD 3.48Å; S82-E408 WeakPolarHBondContact CB-OE1 3.39Å; S82-E408 PolarHBondContact N-OE1 3.41Å; S82-E408 PolarHBondContact OG-OE1 3.47Å; S82-E408 PolarHBondContact OG-OE2 3.37Å; S82-E408 VanDerWaalsContact OG-OE2 3.07Å
83	G	86.6	Confident	94.1	Very high	36 Å²	36	27.7 Å²	27.7	37%	0.371	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-45.7	-178.8	0	0	0	0	0	113.2	D81	D81-G83 PolarHBondContact O-N 3.39Å; D81-G83 VanDerWaalsContact OD1-CA 3.29Å; D81-G83 WeakPolarHBondContact OD1-CA 3.35Å; D81-G83 PolarHBondContact OD1-N 3.38Å
84	R	88.4	Confident	94.6	Very high	98 Å²	98	25.9 Å²	25.9	37%	0.37	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.5	-177.5	-65	-178.4	-71.1	158.8	1.5	113.5	D81 G184 D186 W187	D81-R84 PolarHBondContact O-N 3.39Å; D81-R84 PolarHBondContact OD1-N 3.42Å; D81-R84 IonicContact OD1-NE 3.29Å; D81-R84 IonicContact OD2-CZ 3.74Å; D81-R84 VanDerWaalsContact OD2-CZ 3.27Å; D81-R84 IonicContact OD2-NE 2.67Å; D81-R84 PolarHBondContact OD2-NE 3.27Å; D81-R84 IonicContact OD2-NH2 2.84Å; D81-R84 PolarHBondContact OD2-NH2 3.1Å; R84-G184 WeakPolarHBondContact CD-O 3.26Å; R84-D186 IonicContact NH1-OD2 3.52Å; R84-D186 PolarHBondContact NH1-OD2 2.9Å; R84-D186 VanDerWaalsContact NH1-OD2 3.1Å; R84-W187 PolarHBondContact O-NE1 3.35Å
85	G	92.7	Very high	94.8	Very high	9 Å²	9	30.6 Å²	30.6	9%	0.093	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.8	146.6	-176.2	0	0	0	0	0	112.5	D81	D81-G85 CarbonylContact O-C 3.58Å; D81-G85 VanDerWaalsContact O-CA 3.26Å; D81-G85 WeakPolarHBondContact O-CA 3.49Å; D81-G85 PolarHBondContact O-N 2.81Å
86	Y	96.7	Very high	94.9	Very high	3 Å²	3	31 Å²	31	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	130.9	177.3	-71.1	-97.2	0	0	0	110.4	Q79 S82 V103 M226 C227 G228 A241 E408	Q79-Y86 CarbonylContact O-C 3.59Å; Q79-Y86 VanDerWaalsContact O-CA 3.28Å; Q79-Y86 WeakPolarHBondContact O-CA 3.47Å; S82-Y86 VanDerWaalsContact N-CE2 3.32Å; Y86-V103 PolarHBondContact O-N 3.07Å; Y86-M226 HydrophobicContact CD1-CB 4.49Å; Y86-M226 HydrophobicContact CD1-CG 4.39Å; Y86-M226 HydrophobicContact CD2-CB 4.45Å; Y86-M226 HydrophobicContact CD2-CE 3.14Å; Y86-M226 HydrophobicContact CD2-CG 4.16Å; Y86-M226 HydrophobicContact CD2-SD 4.48Å; Y86-M226 HydrophobicContact CE1-CB 4.01Å; Y86-M226 HydrophobicContact CE1-CG 4.39Å; Y86-M226 HydrophobicContact CE2-CB 3.94Å; Y86-M226 HydrophobicContact CE2-CE 3.34Å; Y86-M226 HydrophobicContact CE2-CG 4.14Å; Y86-M226 HydrophobicContact CG-CE 3.97Å; Y86-M226 HydrophobicContact CG-CG 4.25Å; Y86-C227 PolarHBondContact OH-N 2.96Å; Y86-G228 WeakPolarHBondContact OH-CA 3.44Å; Y86-G228 PolarHBondContact OH-N 2.8Å; Y86-A241 HydrophobicContact CD1-CB 4.04Å; Y86-A241 HydrophobicContact CE1-CB 3.76Å; Y86-A241 WeakPolarHBondContact CE1-O 3.35Å; Y86-E408 HydrophobicContact CE2-CG 4.39Å; Y86-E408 VanDerWaalsContact OH-CD 3.32Å; Y86-E408 VanDerWaalsContact OH-CG 3.31Å; Y86-E408 WeakPolarHBondContact OH-CG 3.37Å; Y86-E408 PolarHBondContact OH-OE1 2.76Å
87	Y	97.3	Very high	95.2	Very high	5 Å²	5	29 Å²	29	2%	0.02	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	156.6	-175.5	63.2	-93.2	0	0	0	112.6	L78 Q79 N100 I101 D186 W187	L78-Y87 WeakPolarHBondContact CA-O 3.39Å; Q79-Y87 HydrophobicContact CB-CD2 4.17Å; Q79-Y87 HydrophobicContact CB-CE1 3.93Å; Q79-Y87 HydrophobicContact CB-CE2 3.52Å; Q79-Y87 WeakPolarHBondContact CB-OH 3.31Å; Q79-Y87 HydrophobicContact CG-CE2 4.3Å; Q79-Y87 PolarHBondContact N-O 2.63Å; Q79-Y87 PolarHBondContact O-N 3.43Å; Q79-Y87 PolarHBondContact OE1-OH 3.29Å; Y87-N100 HydrophobicContact CD2-CB 3.46Å; Y87-N100 VanDerWaalsContact CD2-CB 3.46Å; Y87-N100 HydrophobicContact CE2-CB 3.81Å; Y87-N100 WeakPolarHBondContact CE2-ND2 3.43Å; Y87-N100 HydrophobicContact CG-CB 4.21Å; Y87-I101 CarbonylContact C-O 3.55Å; Y87-I101 WeakPolarHBondContact CA-O 3.4Å; Y87-I101 VanDerWaalsContact CB-O 3.27Å; Y87-I101 WeakPolarHBondContact CB-O 3.48Å; Y87-D186 HydrophobicContact CE1-CB 3.78Å; Y87-D186 WeakPolarHBondContact OH-CB 3.36Å; Y87-W187 HydrophobicContact CD1-CB 4.39Å; Y87-W187 HydrophobicContact CG-CB 4.11Å
88	I	97.3	Very high	95.3	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	142.5	179.1	-172.5	162.2	0	0	0	110.2	L78 M90 I101 V103 L159 L191 L244	L78-I88 HydrophobicContact CD2-CB 3.83Å; L78-I88 HydrophobicContact CD2-CD1 4.45Å; L78-I88 HydrophobicContact CD2-CG1 4.45Å; I88-M90 HydrophobicContact CG2-CG 4.1Å; I88-M90 HydrophobicContact CG2-SD 4.09Å; I88-I101 HydrophobicContact CG2-CB 4.44Å; I88-I101 PolarHBondContact N-O 3.41Å; I88-I101 PolarHBondContact O-N 2.99Å; I88-V103 HydrophobicContact CB-CG2 4.36Å; I88-V103 HydrophobicContact CG2-CG2 3.98Å; I88-L159 HydrophobicContact CD1-CD2 3.94Å; I88-L191 HydrophobicContact CG2-CD2 4.45Å; I88-L244 HydrophobicContact CD1-CD2 4.38Å
89	E	97.3	Very high	95.3	Very high	64 Å²	64	34.8 Å²	34.8	30%	0.299	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130	171.6	-175.3	-178.4	101	0	0	109.6	K98 P160	E89-K98 WeakPolarHBondContact OE1-CE 3.46Å; E89-K98 IonicContact OE1-NZ 2.76Å; E89-K98 PolarHBondContact OE1-NZ 3.21Å; E89-K98 IonicContact OE2-NZ 3.81Å; E89-P160 WeakPolarHBondContact O-CD 3.48Å
90	M	98.1	Very high	95.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.8	175.5	-61.6	179.8	64.2	0	0	110	I88 K98 L99 I101 F110 V157 L159 L191 F208	I88-M90 HydrophobicContact CG2-CG 4.1Å; I88-M90 HydrophobicContact CG2-SD 4.09Å; M90-K98 WeakPolarHBondContact O-CA 3.33Å; M90-L99 PolarHBondContact N-O 2.98Å; M90-L99 PolarHBondContact O-N 3.28Å; M90-I101 HydrophobicContact CB-CG1 3.97Å; M90-I101 HydrophobicContact CG-CB 4.46Å; M90-I101 HydrophobicContact CG-CG1 3.93Å; M90-I101 HydrophobicContact SD-CB 3.89Å; M90-I101 HydrophobicContact SD-CG1 3.66Å; M90-I101 HydrophobicContact SD-CG2 4.23Å; M90-F110 HydrophobicContact CE-CE2 3.92Å; M90-F110 HydrophobicContact CE-CZ 4.17Å; M90-F110 HydrophobicContact SD-CE2 3.99Å; M90-V157 HydrophobicContact CE-CG1 3.36Å; M90-L159 HydrophobicContact CE-CD1 4.46Å; M90-L159 HydrophobicContact CE-CG 4.35Å; M90-L159 HydrophobicContact CG-CD2 4.42Å; M90-L159 HydrophobicContact CG-CG 4.35Å; M90-L191 HydrophobicContact CE-CD1 4.33Å; M90-L191 HydrophobicContact SD-CD1 4.26Å; M90-L191 HydrophobicContact SD-CD2 4.37Å; M90-F208 HydrophobicContact CE-CD2 4.24Å; M90-F208 HydrophobicContact CE-CE2 3.52Å; M90-F208 HydrophobicContact CE-CZ 3.88Å
91	S	98.3	Very high	95.9	Very high	21 Å²	21	32.9 Å²	32.9	15%	0.147	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.7	176.2	178.8	0	0	0	0	109.7	G96 Q97 V157 S158	S91-G96 WeakPolarHBondContact OG-CA 3.36Å; S91-Q97 WeakPolarHBondContact CA-O 3.42Å; S91-V157 WeakPolarHBondContact O-CA 3.28Å; S91-S158 PolarHBondContact N-O 3.47Å; S91-S158 PolarHBondContact O-N 2.85Å
92	I	98.6	Very high	96.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.7	-170.5	-48	176.3	0	0	0	110.5	Q97 L99 F110 V112 F124 D155 V157 I171	I92-Q97 PolarHBondContact N-O 3.31Å; I92-Q97 WeakPolarHBondContact O-CB 3.26Å; I92-Q97 PolarHBondContact O-N 2.92Å; I92-L99 HydrophobicContact CD1-CD1 4.08Å; I92-F110 HydrophobicContact CD1-CE1 4.1Å; I92-F110 HydrophobicContact CD1-CZ 3.64Å; I92-F110 HydrophobicContact CG1-CZ 4.36Å; I92-V112 HydrophobicContact CD1-CG1 3.73Å; I92-F124 HydrophobicContact CB-CD2 4.16Å; I92-F124 HydrophobicContact CB-CE2 4.14Å; I92-F124 HydrophobicContact CG2-CD2 3.94Å; I92-F124 HydrophobicContact CG2-CE1 4.4Å; I92-F124 HydrophobicContact CG2-CE2 3.63Å; I92-F124 HydrophobicContact CG2-CG 4.48Å; I92-F124 HydrophobicContact CG2-CZ 3.9Å; I92-D155 HydrophobicContact CG2-CB 4.41Å; I92-V157 HydrophobicContact CB-CG2 4.26Å; I92-V157 HydrophobicContact CG1-CG2 4.02Å; I92-V157 HydrophobicContact CG2-CG2 3.96Å; I92-I171 HydrophobicContact CD1-CD1 4.31Å; I92-I171 HydrophobicContact CG2-CD1 3.82Å
93	G	98.4	Very high	96.7	Very high	10 Å²	10	31.1 Å²	31.1	10%	0.103	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-175.3	175	0	0	0	0	0	115.7	P95 G96 S129 D155 L156	G93-P95 CarbonylContact C-O 3.6Å; G93-P95 CarbonylContact O-C 3.57Å; G93-G96 VanDerWaalsContact O-CA 3.26Å; G93-G96 WeakPolarHBondContact O-CA 3.27Å; G93-G96 PolarHBondContact O-N 3.47Å; G93-S129 WeakPolarHBondContact CA-OG 3.46Å; G93-D155 VanDerWaalsContact CA-CG 3.5Å; G93-D155 WeakPolarHBondContact CA-OD1 3.47Å; G93-D155 VanDerWaalsContact CA-OD2 3.22Å; G93-D155 WeakPolarHBondContact CA-OD2 3.32Å; G93-L156 PolarHBondContact N-O 3.22Å
94	T	98.2	Very high	97.3	Very high	54 Å²	54	29.7 Å²	29.7	33%	0.331	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.5	109.7	-177.8	-54.8	0	0	0	0	111.7	S129 S130 T131	T94-S129 PolarHBondContact N-OG 2.61Å; T94-S129 VanDerWaalsContact N-OG 3.08Å; T94-S129 WeakPolarHBondContact O-CA 3.33Å; T94-S130 WeakPolarHBondContact CB-OG 3.44Å; T94-S130 WeakPolarHBondContact CG2-OG 3.37Å; T94-S130 PolarHBondContact O-N 3.31Å; T94-S130 PolarHBondContact O-OG 3.38Å; T94-T131 WeakPolarHBondContact CB-OG1 3.27Å; T94-T131 HydrophobicContact CG2-CG2 4.46Å; T94-T131 PolarHBondContact N-OG1 3.14Å; T94-T131 VanDerWaalsContact OG1-CG2 3.27Å; T94-T131 WeakPolarHBondContact OG1-CG2 3.32Å; T94-T131 PolarHBondContact OG1-OG1 2.93Å
95	P	97.9	Very high	97.8	Very high	99 Å²	99	25 Å²	25	64%	0.643	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	cis	-65.6	153.8	-2	29.2	-36.3	0	0	0	112.8	G93 Q97	G93-P95 CarbonylContact C-O 3.6Å; G93-P95 CarbonylContact O-C 3.57Å; P95-Q97 PolarHBondContact O-N 3.31Å
96	G	97.9	Very high	98	Very high	45 Å²	45	25.1 Å²	25.1	46%	0.464	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	126.8	-175.8	0	0	0	0	0	113.4	S91 G93	S91-G96 WeakPolarHBondContact OG-CA 3.36Å; G93-G96 VanDerWaalsContact O-CA 3.26Å; G93-G96 WeakPolarHBondContact O-CA 3.27Å; G93-G96 PolarHBondContact O-N 3.47Å
97	Q	98.3	Very high	98.1	Very high	31 Å²	31	25.4 Å²	25.4	15%	0.145	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118.3	174.8	-62.2	175.7	60.6	0	0	108.7	S91 I92 P95 F124 N125	S91-Q97 WeakPolarHBondContact CA-O 3.42Å; I92-Q97 PolarHBondContact N-O 3.31Å; I92-Q97 WeakPolarHBondContact O-CB 3.26Å; I92-Q97 PolarHBondContact O-N 2.92Å; P95-Q97 PolarHBondContact O-N 3.31Å; Q97-F124 HydrophobicContact CB-CD2 4.31Å; Q97-N125 PolarHBondContact NE2-O 2.64Å
98	K	98.1	Very high	98.2	Very high	127 Å²	127	25.2 Å²	25.2	55%	0.552	15%	0.151	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.5	-179.1	-69	-175.2	169.2	-144.7	0	110.9	E89 M90	E89-K98 WeakPolarHBondContact OE1-CE 3.46Å; E89-K98 IonicContact OE1-NZ 2.76Å; E89-K98 PolarHBondContact OE1-NZ 3.21Å; E89-K98 IonicContact OE2-NZ 3.81Å; M90-K98 WeakPolarHBondContact O-CA 3.33Å
99	L	98.2	Very high	98.2	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.5	173.6	-66.2	179	0	0	0	110.3	M90 I92 I101 V112 S122 F124 Q188	M90-L99 PolarHBondContact N-O 2.98Å; M90-L99 PolarHBondContact O-N 3.28Å; I92-L99 HydrophobicContact CD1-CD1 4.08Å; L99-I101 HydrophobicContact CB-CD1 3.85Å; L99-V112 HydrophobicContact CD1-CB 4.12Å; L99-V112 HydrophobicContact CD1-CG1 4.37Å; L99-S122 WeakPolarHBondContact CD2-OG 3.25Å; L99-F124 HydrophobicContact CD1-CB 3.76Å; L99-Q188 HydrophobicContact CB-CB 4.49Å; L99-Q188 HydrophobicContact CD2-CB 3.95Å; L99-Q188 HydrophobicContact CD2-CG 4.09Å
100	N	97.9	Very high	98.3	Very high	30 Å²	30	22.6 Å²	22.6	16%	0.16	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.7	170.5	-73.6	-23	0	0	0	109.2	Y87 D186 W187 Q188 G189	Y87-N100 HydrophobicContact CD2-CB 3.46Å; Y87-N100 VanDerWaalsContact CD2-CB 3.46Å; Y87-N100 HydrophobicContact CE2-CB 3.81Å; Y87-N100 WeakPolarHBondContact CE2-ND2 3.43Å; Y87-N100 HydrophobicContact CG-CB 4.21Å; N100-D186 WeakPolarHBondContact CB-O 3.36Å; N100-D186 PolarHBondContact ND2-O 2.76Å; N100-W187 HydrophobicContact CB-CB 4.18Å; N100-W187 CarbonylContact O-C 3.5Å; N100-W187 WeakPolarHBondContact O-CA 3.26Å; N100-W187 WeakPolarHBondContact O-CB 3.18Å; N100-Q188 PolarHBondContact O-N 3.35Å; N100-G189 PolarHBondContact O-N 3.15Å
101	I	98.4	Very high	98.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.5	-172.2	-49.6	-60.4	0	0	0	109.6	Y87 I88 M90 L99 V103 F110 V112 I190 L191	Y87-I101 CarbonylContact C-O 3.55Å; Y87-I101 WeakPolarHBondContact CA-O 3.4Å; Y87-I101 VanDerWaalsContact CB-O 3.27Å; Y87-I101 WeakPolarHBondContact CB-O 3.48Å; I88-I101 HydrophobicContact CG2-CB 4.44Å; I88-I101 PolarHBondContact N-O 3.41Å; I88-I101 PolarHBondContact O-N 2.99Å; M90-I101 HydrophobicContact CB-CG1 3.97Å; M90-I101 HydrophobicContact CG-CB 4.46Å; M90-I101 HydrophobicContact CG-CG1 3.93Å; M90-I101 HydrophobicContact SD-CB 3.89Å; M90-I101 HydrophobicContact SD-CG1 3.66Å; M90-I101 HydrophobicContact SD-CG2 4.23Å; L99-I101 HydrophobicContact CB-CD1 3.85Å; I101-V103 PolarHBondContact O-N 3.37Å; I101-F110 HydrophobicContact CD1-CE2 4.31Å; I101-F110 HydrophobicContact CG1-CE2 4.19Å; I101-F110 HydrophobicContact CG2-CD2 4.34Å; I101-F110 HydrophobicContact CG2-CE2 3.88Å; I101-V112 HydrophobicContact CD1-CG1 3.72Å; I101-I190 VanDerWaalsContact CG2-C 3.43Å; I101-L191 HydrophobicContact CG2-CB 3.64Å
102	L	98.3	Very high	98.4	Very high	13 Å²	13	21.6 Å²	21.6	7%	0.068	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	130.4	174.2	175.3	68.3	0	0	0	110.3	W187 G189 I190 L191	L102-W187 HydrophobicContact CB-CD2 3.89Å; L102-W187 HydrophobicContact CB-CE3 4.16Å; L102-W187 HydrophobicContact CB-CG 4.06Å; L102-W187 HydrophobicContact CD2-CH2 4.26Å; L102-W187 HydrophobicContact CD2-CZ2 4.07Å; L102-G189 WeakPolarHBondContact CB-O 3.46Å; L102-G189 PolarHBondContact N-O 3.48Å; L102-I190 HydrophobicContact CB-CB 4.45Å; L102-I190 HydrophobicContact CB-CG1 4.32Å; L102-I190 HydrophobicContact CD2-CD1 3.94Å; L102-I190 HydrophobicContact CD2-CG1 4.08Å; L102-I190 HydrophobicContact CG-CG1 4.36Å; L102-I190 CarbonylContact O-C 3.4Å; L102-I190 WeakPolarHBondContact O-CA 3.05Å; L102-L191 WeakPolarHBondContact O-CB 3.39Å; L102-L191 PolarHBondContact O-N 2.79Å
103	V	98.6	Very high	98.4	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.2	175.3	179.1	0	0	0	0	109.3	L78 Y86 I88 I101 L193 L224 L244 S299	L78-V103 HydrophobicContact CD2-CG2 3.86Å; Y86-V103 PolarHBondContact O-N 3.07Å; I88-V103 HydrophobicContact CB-CG2 4.36Å; I88-V103 HydrophobicContact CG2-CG2 3.98Å; I101-V103 PolarHBondContact O-N 3.37Å; V103-L193 HydrophobicContact CG1-CD1 3.66Å; V103-L224 HydrophobicContact CG1-CD1 4.29Å; V103-L224 HydrophobicContact CG1-CD2 4.07Å; V103-L244 HydrophobicContact CG1-CD2 4.23Å; V103-L244 HydrophobicContact CG2-CD2 4.09Å; V103-S299 PolarHBondContact O-OG 2.87Å
104	D	98.6	Very high	98.4	Very high	6 Å²	6	22.2 Å²	22.2	3%	0.032	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	105.5	-172.6	178.1	18.7	0	0	0	112	G106 S107 I190 L191 G192 L193 D298 S299	D104-G106 VanDerWaalsContact C-N 3.27Å; D104-G106 VanDerWaalsContact OD1-CA 3.31Å; D104-G106 WeakPolarHBondContact OD1-CA 3.35Å; D104-G106 PolarHBondContact OD1-N 2.98Å; D104-S107 WeakPolarHBondContact OD2-CB 3.46Å; D104-S107 PolarHBondContact OD2-N 3.09Å; D104-S107 PolarHBondContact OD2-OG 3.04Å; D104-I190 HydrophobicContact CB-CD1 3.71Å; D104-I190 HydrophobicContact CB-CG1 3.59Å; D104-I190 WeakPolarHBondContact OD2-CD1 3.45Å; D104-L191 PolarHBondContact N-O 2.97Å; D104-G192 CarbonylContact O-C 3.48Å; D104-G192 WeakPolarHBondContact O-CA 3.42Å; D104-L193 PolarHBondContact O-N 2.9Å; D104-D298 VanDerWaalsContact OD1-OD1 3.13Å; D104-S299 WeakPolarHBondContact CA-OG 3.19Å
105	T	98.8	Very high	98.3	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.4	173.5	66.1	0	0	0	0	113.5	L193 A194 F222 L224 Y269 V297 D298 S299 F414	T105-L193 HydrophobicContact CG2-CB 4.26Å; T105-L193 HydrophobicContact CG2-CD1 4.35Å; T105-A194 WeakPolarHBondContact O-CB 2.98Å; T105-F222 HydrophobicContact CG2-CE2 3.98Å; T105-F222 HydrophobicContact CG2-CZ 4.11Å; T105-L224 HydrophobicContact CG2-CD1 3.8Å; T105-Y269 HydrophobicContact CG2-CE2 4.41Å; T105-Y269 WeakPolarHBondContact O-CD2 3.49Å; T105-V297 PolarHBondContact OG1-O 3.45Å; T105-V297 VanDerWaalsContact OG1-O 3.06Å; T105-D298 VanDerWaalsContact OG1-CA 3.28Å; T105-D298 WeakPolarHBondContact OG1-CA 3.42Å; T105-S299 PolarHBondContact N-OG 3.31Å; T105-S299 PolarHBondContact OG1-N 3.48Å; T105-F414 HydrophobicContact CG2-CE1 3.85Å; T105-F414 HydrophobicContact CG2-CE2 4.35Å; T105-F414 HydrophobicContact CG2-CZ 3.76Å
106	G	97.6	Very high	98.2	Very high	10 Å²	10	21.1 Å²	21.1	10%	0.103	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3	176.1	0	0	0	0	0	115.1	D104 Y268 D298	D104-G106 VanDerWaalsContact C-N 3.27Å; D104-G106 VanDerWaalsContact OD1-CA 3.31Å; D104-G106 WeakPolarHBondContact OD1-CA 3.35Å; D104-G106 PolarHBondContact OD1-N 2.98Å; G106-Y268 WeakPolarHBondContact O-CE1 3.48Å; G106-D298 VanDerWaalsContact CA-OD1 3.29Å; G106-D298 WeakPolarHBondContact CA-OD1 3.29Å; G106-D298 PolarHBondContact N-OD1 2.93Å; G106-D298 VanDerWaalsContact N-OD1 3.1Å
107	S	98.1	Very high	98.2	Very high	10 Å²	10	21.1 Å²	21.1	7%	0.07	12%	0.12	C	C	.	.			trans	-140.7	178.6	174.6	79	0	0	0	0	113	D104 G192 L193 A194	D104-S107 WeakPolarHBondContact OD2-CB 3.46Å; D104-S107 PolarHBondContact OD2-N 3.09Å; D104-S107 PolarHBondContact OD2-OG 3.04Å; S107-G192 VanDerWaalsContact C-CA 3.45Å; S107-G192 CarbonylContact O-C 3.5Å; S107-G192 WeakPolarHBondContact O-CA 3.49Å; S107-L193 PolarHBondContact O-N 3.28Å; S107-A194 WeakPolarHBondContact O-CB 2.99Å; S107-A194 PolarHBondContact O-N 3.34Å
108	S	98.5	Very high	98.1	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	15%	0.149	C	C	.	.			trans	-132.4	1.5	-171.9	-59.4	0	0	0	0	115.4	A194 Y195 P207	S108-A194 WeakPolarHBondContact OG-CB 3.44Å; S108-A194 PolarHBondContact OG-O 3.36Å; S108-Y195 PolarHBondContact OG-N 2.76Å; S108-Y195 PolarHBondContact OG-O 3.06Å; S108-P207 WeakPolarHBondContact O-CB 3.43Å
109	N	98.7	Very high	98	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.027	14%	0.142	C	C	.	.			trans	-94	136.2	175.8	-75	85.3	0	0	0	110	W148 G192 R200	N109-W148 HydrophobicContact CB-CH2 4.37Å; N109-W148 HydrophobicContact CB-CZ2 4.15Å; N109-G192 PolarHBondContact O-N 2.82Å; N109-R200 PolarHBondContact ND2-O 3.1Å; N109-R200 PolarHBondContact OD1-N 2.69Å
110	F	98.8	Very high	97.8	Very high	6 Å²	6	24.2 Å²	24.2	3%	0.026	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118	159.5	178.1	-111.7	0	0	0	108.6	M90 I92 I101 V112 V157 I169 I171 A172 I190 L191 F208	M90-F110 HydrophobicContact CE-CE2 3.92Å; M90-F110 HydrophobicContact CE-CZ 4.17Å; M90-F110 HydrophobicContact SD-CE2 3.99Å; I92-F110 HydrophobicContact CD1-CE1 4.1Å; I92-F110 HydrophobicContact CD1-CZ 3.64Å; I92-F110 HydrophobicContact CG1-CZ 4.36Å; I101-F110 HydrophobicContact CD1-CE2 4.31Å; I101-F110 HydrophobicContact CG1-CE2 4.19Å; I101-F110 HydrophobicContact CG2-CD2 4.34Å; I101-F110 HydrophobicContact CG2-CE2 3.88Å; F110-V112 HydrophobicContact CE1-CG1 4.08Å; F110-V112 HydrophobicContact CE2-CG1 4.21Å; F110-V112 HydrophobicContact CZ-CG1 3.76Å; F110-V157 HydrophobicContact CE1-CG2 4.4Å; F110-I169 HydrophobicContact CD1-CD1 3.29Å; F110-I169 HydrophobicContact CD1-CG1 4.28Å; F110-I169 HydrophobicContact CE1-CD1 3.41Å; F110-I169 VanDerWaalsContact CE1-CD1 3.41Å; F110-I169 HydrophobicContact CE1-CG1 4.47Å; F110-I169 HydrophobicContact CG-CD1 3.94Å; F110-I169 HydrophobicContact CZ-CD1 4.11Å; F110-I171 HydrophobicContact CD1-CB 3.86Å; F110-I171 HydrophobicContact CD1-CD1 4.19Å; F110-I171 HydrophobicContact CD1-CG1 3.7Å; F110-I171 HydrophobicContact CE1-CB 4.1Å; F110-I171 HydrophobicContact CE1-CD1 3.6Å; F110-I171 HydrophobicContact CE1-CG1 3.65Å; F110-A172 PolarHBondContact O-N 2.84Å; F110-I190 WeakPolarHBondContact CA-O 3.31Å; F110-L191 HydrophobicContact CD2-CD1 3.55Å; F110-L191 HydrophobicContact CE2-CD1 4.08Å; F110-L191 HydrophobicContact CG-CD1 4.43Å; F110-F208 HydrophobicContact CB-CB 4.31Å
111	A	98.8	Very high	97.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.4	-175.2	0	0	0	0	0	110.9	W148 A172 I174 G189 I190	A111-W148 HydrophobicContact CB-CD2 4.45Å; A111-W148 HydrophobicContact CB-CH2 3.79Å; A111-W148 HydrophobicContact CB-CZ2 3.39Å; A111-W148 HydrophobicContact CB-CZ3 4.45Å; A111-A172 CarbonylContact C-O 3.57Å; A111-A172 VanDerWaalsContact CA-O 3.29Å; A111-A172 WeakPolarHBondContact CA-O 3.38Å; A111-A172 HydrophobicContact CB-CB 3.76Å; A111-I174 HydrophobicContact CB-CD1 3.82Å; A111-I174 HydrophobicContact CB-CG1 4.02Å; A111-G189 CarbonylContact O-C 3.58Å; A111-G189 WeakPolarHBondContact O-CA 3.24Å; A111-I190 HydrophobicContact CB-CG2 3.96Å; A111-I190 PolarHBondContact N-O 2.92Å; A111-I190 PolarHBondContact O-N 3.48Å
112	V	98.8	Very high	97.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.2	-177.8	-57.5	0	0	0	0	110.5	I92 L99 I101 F110 A114 F124 I171 A172 I174	I92-V112 HydrophobicContact CD1-CG1 3.73Å; L99-V112 HydrophobicContact CD1-CB 4.12Å; L99-V112 HydrophobicContact CD1-CG1 4.37Å; I101-V112 HydrophobicContact CD1-CG1 3.72Å; F110-V112 HydrophobicContact CE1-CG1 4.08Å; F110-V112 HydrophobicContact CE2-CG1 4.21Å; F110-V112 HydrophobicContact CZ-CG1 3.76Å; V112-A114 PolarHBondContact O-N 2.76Å; V112-F124 HydrophobicContact CB-CB 4.42Å; V112-F124 HydrophobicContact CG2-CB 3.56Å; V112-F124 HydrophobicContact CG2-CD1 3.9Å; V112-F124 HydrophobicContact CG2-CG 4.02Å; V112-I171 HydrophobicContact CG1-CD1 4.32Å; V112-I171 HydrophobicContact CG2-CD1 3.53Å; V112-I171 HydrophobicContact CG2-CG1 3.99Å; V112-A172 PolarHBondContact N-O 2.64Å; V112-I174 VanDerWaalsContact O-CB 3.3Å; V112-I174 WeakPolarHBondContact O-CB 3.33Å; V112-I174 WeakPolarHBondContact O-CG1 3.43Å; V112-I174 PolarHBondContact O-N 2.82Å
113	A	98.7	Very high	97.3	Very high	1 Å²	1	35 Å²	35	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	128.9	167.6	0	0	0	0	0	109.5	I120 Y123 F124 F181 Q188	A113-I120 HydrophobicContact CB-CD1 3.31Å; A113-Y123 WeakPolarHBondContact O-CB 3.37Å; A113-F124 WeakPolarHBondContact O-CB 3.41Å; A113-F124 PolarHBondContact O-N 2.89Å; A113-F181 HydrophobicContact CB-CE2 4.02Å; A113-F181 HydrophobicContact CB-CZ 3.72Å; A113-Q188 WeakPolarHBondContact CB-O 3.44Å; A113-Q188 PolarHBondContact N-O 3.08Å
114	A	98.3	Very high	97.3	Very high	22 Å²	22	34.9 Å²	34.9	18%	0.182	21%	0.205	C	C	.	.			trans	-126.3	13.8	174.8	0	0	0	0	0	112.2	V112 F124 A173 I174	V112-A114 PolarHBondContact O-N 2.76Å; A114-F124 WeakPolarHBondContact CA-O 3.19Å; A114-A173 HydrophobicContact CB-CB 3.57Å; A114-I174 WeakPolarHBondContact CA-O 3.25Å; A114-I174 WeakPolarHBondContact CB-O 3.28Å; A114-I174 PolarHBondContact N-O 2.87Å
115	A	97.3	Very high	97.3	Very high	30 Å²	30	37 Å²	37	25%	0.248	22%	0.216	C	C	.	.	S	Bend	trans	-143.7	156.6	173.7	0	0	0	0	0	109.9
116	P	96.6	Very high	97.3	Very high	101 Å²	101	39.1 Å²	39.1	66%	0.656	23%	0.229	S	C	*	.			trans	-58.3	140.3	173.7	-21.4	31.8	0	0	0	112.1	Y123	P116-Y123 HydrophobicContact CB-CE1 4.34Å; P116-Y123 HydrophobicContact CG-CD1 4.46Å; P116-Y123 HydrophobicContact CG-CE1 3.77Å
117	H	96.8	Very high	97.3	Very high	45 Å²	45	42.9 Å²	42.9	21%	0.208	26%	0.26	C	S	.	.			trans	-141.6	143.8	174.3	-175.6	-88	0	0	0	110.3	F119 I120 F181	H117-F119 AromaticContact CE1-CD2 3.55Å; H117-F119 PolarHBondContact ND1-N 3.2Å; H117-F119 PolarHBondContact O-N 3.42Å; H117-I120 HydrophobicContact CB-CD1 3.74Å; H117-I120 HydrophobicContact CB-CG1 3.85Å; H117-I120 PolarHBondContact O-N 2.95Å; H117-F181 HydrophobicContact CB-CD2 4.47Å
118	P	95.8	Very high	97.3	Very high	115 Å²	115	47.5 Å²	47.5	75%	0.747	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	-173.1	-27.6	35.9	0	0	0	116
119	F	95.6	Very high	97.3	Very high	91 Å²	91	48 Å²	48	40%	0.399	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	9.1	-174	-51.3	-37.3	0	0	0	114.3	H117 F181 P183	H117-F119 AromaticContact CE1-CD2 3.55Å; H117-F119 PolarHBondContact ND1-N 3.2Å; H117-F119 PolarHBondContact O-N 3.42Å; F119-F181 WeakPolarHBondContact CD2-O 3.4Å; F119-P183 HydrophobicContact CD1-CB 4.33Å; F119-P183 HydrophobicContact CD1-CG 4.07Å; F119-P183 HydrophobicContact CD2-CG 4.09Å; F119-P183 HydrophobicContact CE1-CB 4.44Å; F119-P183 HydrophobicContact CE1-CG 3.83Å; F119-P183 HydrophobicContact CE2-CG 3.86Å; F119-P183 HydrophobicContact CG-CG 4.22Å; F119-P183 HydrophobicContact CZ-CG 3.73Å
120	I	94.8	Very high	97.3	Very high	21 Å²	21	52.5 Å²	52.5	11%	0.108	32%	0.318	C	S	.	.			trans	-125.1	148	174.6	69.1	-174	0	0	0	110.2	A113 H117 S122 F181 Q188	A113-I120 HydrophobicContact CB-CD1 3.31Å; H117-I120 HydrophobicContact CB-CD1 3.74Å; H117-I120 HydrophobicContact CB-CG1 3.85Å; H117-I120 PolarHBondContact O-N 2.95Å; I120-S122 WeakPolarHBondContact CD1-O 3.12Å; I120-F181 HydrophobicContact CG2-CB 4.17Å; I120-F181 HydrophobicContact CG2-CD1 3.68Å; I120-F181 HydrophobicContact CG2-CD2 4.4Å; I120-F181 HydrophobicContact CG2-CE1 4.15Å; I120-F181 HydrophobicContact CG2-CG 3.83Å; I120-Q188 HydrophobicContact CB-CG 4.13Å; I120-Q188 HydrophobicContact CG2-CG 4.44Å
121	T	91.4	Very high	97.3	Very high	136 Å²	136	54.1 Å²	54.1	83%	0.834	33%	0.329	S	S	*	.	S	Bend	trans	-91.8	-20.3	-176.9	53.9	0	0	0	0	113.4
122	S	95.9	Very high	97.3	Very high	44 Å²	44	55.9 Å²	55.9	31%	0.308	34%	0.337	S	S	.	.			trans	-148.8	166.2	-179	58.8	0	0	0	0	110.6	L99 I120 Q188	L99-S122 WeakPolarHBondContact CD2-OG 3.25Å; I120-S122 WeakPolarHBondContact CD1-O 3.12Å; S122-Q188 VanDerWaalsContact O-CG 3.22Å; S122-Q188 WeakPolarHBondContact O-CG 3.48Å
123	Y	98	Very high	97.3	Very high	89 Å²	89	62.3 Å²	62.3	35%	0.349	37%	0.367	S	S	.	.			trans	-152.5	160.1	176.2	62.8	-90	0	0	0	109.3	A113 P116 N125	A113-Y123 WeakPolarHBondContact O-CB 3.37Å; P116-Y123 HydrophobicContact CB-CE1 4.34Å; P116-Y123 HydrophobicContact CG-CD1 4.46Å; P116-Y123 HydrophobicContact CG-CE1 3.77Å; Y123-N125 HydrophobicContact CE2-CB 4.4Å; Y123-N125 PolarHBondContact O-N 3.32Å
124	F	98.6	Very high	97.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	39%	0.39	C	S	.	.			trans	-74.4	112.3	176.6	178	-125	0	0	0	110.4	I92 Q97 L99 V112 A113 A114 T126 F132 D155 I171	I92-F124 HydrophobicContact CB-CD2 4.16Å; I92-F124 HydrophobicContact CB-CE2 4.14Å; I92-F124 HydrophobicContact CG2-CD2 3.94Å; I92-F124 HydrophobicContact CG2-CE1 4.4Å; I92-F124 HydrophobicContact CG2-CE2 3.63Å; I92-F124 HydrophobicContact CG2-CG 4.48Å; I92-F124 HydrophobicContact CG2-CZ 3.9Å; Q97-F124 HydrophobicContact CB-CD2 4.31Å; L99-F124 HydrophobicContact CD1-CB 3.76Å; V112-F124 HydrophobicContact CB-CB 4.42Å; V112-F124 HydrophobicContact CG2-CB 3.56Å; V112-F124 HydrophobicContact CG2-CD1 3.9Å; V112-F124 HydrophobicContact CG2-CG 4.02Å; A113-F124 WeakPolarHBondContact O-CB 3.41Å; A113-F124 PolarHBondContact O-N 2.89Å; A114-F124 WeakPolarHBondContact CA-O 3.19Å; F124-T126 HydrophobicContact CD1-CG2 3.8Å; F124-T126 HydrophobicContact CE1-CG2 3.61Å; F124-T126 HydrophobicContact CZ-CG2 4.5Å; F124-T126 PolarHBondContact O-N 2.84Å; F124-F132 AromaticContact CE1-CD2 3.75Å; F124-F132 HydrophobicContact CE1-CD2 3.75Å; F124-F132 HydrophobicContact CE1-CE2 4.03Å; F124-F132 HydrophobicContact CE1-CG 4.45Å; F124-F132 HydrophobicContact CZ-CB 4.49Å; F124-F132 HydrophobicContact CZ-CD2 4.03Å; F124-F132 HydrophobicContact CZ-CG 4.48Å; F124-D155 VanDerWaalsContact CZ-OD2 3.27Å; F124-D155 WeakPolarHBondContact CZ-OD2 3.43Å; F124-I171 HydrophobicContact CD1-CD1 4.02Å; F124-I171 HydrophobicContact CE1-CD1 4.03Å
125	N	98.3	Very high	97	Very high	49 Å²	49	68 Å²	68	26%	0.262	40%	0.402	S	S	.	.			trans	-87.6	100.2	173.5	-171.2	-26.6	0	0	0	109.8	Q97 Y123 A127 L128	Q97-N125 PolarHBondContact NE2-O 2.64Å; Y123-N125 HydrophobicContact CE2-CB 4.4Å; Y123-N125 PolarHBondContact O-N 3.32Å; N125-A127 PolarHBondContact O-N 3.1Å; N125-A127 WeakPolarHBondContact OD1-CB 3.05Å; N125-A127 PolarHBondContact OD1-N 3.14Å; N125-L128 HydrophobicContact CB-CB 4.31Å; N125-L128 HydrophobicContact CB-CD1 3.9Å; N125-L128 HydrophobicContact CB-CG 4.02Å; N125-L128 PolarHBondContact O-N 2.92Å; N125-L128 VanDerWaalsContact O-N 3.1Å
126	T	97.9	Very high	96.8	Very high	45 Å²	45	69.4 Å²	69.4	28%	0.276	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-57.9	-31	-179.4	58.9	0	0	0	0	112.9	F124 L128 S129 F132 A173	F124-T126 HydrophobicContact CD1-CG2 3.8Å; F124-T126 HydrophobicContact CE1-CG2 3.61Å; F124-T126 HydrophobicContact CZ-CG2 4.5Å; F124-T126 PolarHBondContact O-N 2.84Å; T126-L128 VanDerWaalsContact C-N 3.3Å; T126-L128 PolarHBondContact O-N 2.99Å; T126-S129 PolarHBondContact O-N 2.81Å; T126-F132 HydrophobicContact CG2-CD1 4.08Å; T126-F132 HydrophobicContact CG2-CD2 4.28Å; T126-F132 HydrophobicContact CG2-CE1 3.68Å; T126-F132 HydrophobicContact CG2-CE2 3.92Å; T126-F132 HydrophobicContact CG2-CG 4.35Å; T126-F132 HydrophobicContact CG2-CZ 3.6Å; T126-A173 HydrophobicContact CG2-CB 4.06Å
127	A	97.9	Very high	96.8	Very high	89 Å²	89	69.9 Å²	69.9	74%	0.736	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-75.8	-17.7	-178.5	0	0	0	0	0	113.3	N125	N125-A127 PolarHBondContact O-N 3.1Å; N125-A127 WeakPolarHBondContact OD1-CB 3.05Å; N125-A127 PolarHBondContact OD1-N 3.14Å
128	L	98.2	Very high	96.8	Very high	108 Å²	108	72.5 Å²	72.5	57%	0.565	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-89	-11.3	176.2	-63.8	-178.8	0	0	0	112.9	N125 T126	N125-L128 HydrophobicContact CB-CB 4.31Å; N125-L128 HydrophobicContact CB-CD1 3.9Å; N125-L128 HydrophobicContact CB-CG 4.02Å; N125-L128 PolarHBondContact O-N 2.92Å; N125-L128 VanDerWaalsContact O-N 3.1Å; T126-L128 VanDerWaalsContact C-N 3.3Å; T126-L128 PolarHBondContact O-N 2.99Å
129	S	98.5	Very high	96.9	Very high	10 Å²	10	67.5 Å²	67.5	7%	0.07	40%	0.399	C	S	.	.			trans	-92.6	116.1	175.2	-179.6	0	0	0	0	110.6	G93 T94 T126 T131 F132 D155	G93-S129 WeakPolarHBondContact CA-OG 3.46Å; T94-S129 PolarHBondContact N-OG 2.61Å; T94-S129 VanDerWaalsContact N-OG 3.08Å; T94-S129 WeakPolarHBondContact O-CA 3.33Å; T126-S129 PolarHBondContact O-N 2.81Å; S129-T131 PolarHBondContact O-N 3.08Å; S129-T131 PolarHBondContact OG-N 3.23Å; S129-T131 PolarHBondContact OG-OG1 3.35Å; S129-F132 PolarHBondContact O-N 3.3Å; S129-F132 PolarHBondContact OG-N 3.49Å; S129-D155 VanDerWaalsContact CB-OD2 3.28Å; S129-D155 WeakPolarHBondContact CB-OD2 3.29Å; S129-D155 PolarHBondContact OG-OD1 3.47Å; S129-D155 PolarHBondContact OG-OD2 2.77Å
130	S	98.5	Very high	96.9	Very high	100 Å²	100	65 Å²	65	70%	0.699	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.8	173.1	56.8	0	0	0	0	113.5	T94	T94-S130 WeakPolarHBondContact CB-OG 3.44Å; T94-S130 WeakPolarHBondContact CG2-OG 3.37Å; T94-S130 PolarHBondContact O-N 3.31Å; T94-S130 PolarHBondContact O-OG 3.38Å
131	T	98.6	Very high	96.9	Very high	40 Å²	40	64.7 Å²	64.7	25%	0.245	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.2	-178.2	48.2	0	0	0	0	113.3	T94 S129 Q133 D155 L156	T94-T131 WeakPolarHBondContact CB-OG1 3.27Å; T94-T131 HydrophobicContact CG2-CG2 4.46Å; T94-T131 PolarHBondContact N-OG1 3.14Å; T94-T131 VanDerWaalsContact OG1-CG2 3.27Å; T94-T131 WeakPolarHBondContact OG1-CG2 3.32Å; T94-T131 PolarHBondContact OG1-OG1 2.93Å; S129-T131 PolarHBondContact O-N 3.08Å; S129-T131 PolarHBondContact OG-N 3.23Å; S129-T131 PolarHBondContact OG-OG1 3.35Å; T131-Q133 PolarHBondContact O-N 3.5Å; T131-D155 VanDerWaalsContact CB-OD1 3.26Å; T131-D155 WeakPolarHBondContact CB-OD1 3.41Å; T131-D155 PolarHBondContact OG1-OD1 3.12Å; T131-L156 HydrophobicContact CG2-CD1 3.87Å; T131-L156 HydrophobicContact CG2-CG 4.33Å
132	F	98.6	Very high	96.9	Very high	38 Å²	38	68.6 Å²	68.6	17%	0.167	40%	0.397	C	S	.	.			trans	-67.4	126.3	176.4	-179.1	-105.5	0	0	0	111.2	F124 T126 S129 D155 I171	F124-F132 AromaticContact CE1-CD2 3.75Å; F124-F132 HydrophobicContact CE1-CD2 3.75Å; F124-F132 HydrophobicContact CE1-CE2 4.03Å; F124-F132 HydrophobicContact CE1-CG 4.45Å; F124-F132 HydrophobicContact CZ-CB 4.49Å; F124-F132 HydrophobicContact CZ-CD2 4.03Å; F124-F132 HydrophobicContact CZ-CG 4.48Å; T126-F132 HydrophobicContact CG2-CD1 4.08Å; T126-F132 HydrophobicContact CG2-CD2 4.28Å; T126-F132 HydrophobicContact CG2-CE1 3.68Å; T126-F132 HydrophobicContact CG2-CE2 3.92Å; T126-F132 HydrophobicContact CG2-CG 4.35Å; T126-F132 HydrophobicContact CG2-CZ 3.6Å; S129-F132 PolarHBondContact O-N 3.3Å; S129-F132 PolarHBondContact OG-N 3.49Å; F132-D155 WeakPolarHBondContact CA-OD2 3.37Å; F132-D155 WeakPolarHBondContact CB-OD2 3.46Å; F132-D155 HydrophobicContact CD2-CB 4.19Å; F132-D155 PolarHBondContact N-OD1 3.15Å; F132-D155 PolarHBondContact N-OD2 3.18Å; F132-I171 HydrophobicContact CD2-CG2 4.42Å; F132-I171 HydrophobicContact CE2-CG2 3.98Å
133	Q	98.4	Very high	96.6	Very high	135 Å²	135	69.1 Å²	69.1	63%	0.631	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	109.2	173.6	-61.2	-174.2	19.1	0	0	109.5	T131 G153 T154	T131-Q133 PolarHBondContact O-N 3.5Å; Q133-G153 CarbonylContact O-C 3.49Å; Q133-G153 WeakPolarHBondContact O-CA 3.22Å; Q133-T154 PolarHBondContact N-O 3.43Å; Q133-T154 PolarHBondContact O-N 3.05Å
134	S	97.2	Very high	95.9	Very high	71 Å²	71	69.7 Å²	69.7	50%	0.497	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.4	173.2	-176.2	0	0	0	0	110.4	G136	S134-G136 VanDerWaalsContact C-N 3.33Å; S134-G136 PolarHBondContact OG-N 2.87Å; S134-G136 VanDerWaalsContact OG-N 3.12Å
135	T	94.8	Very high	95.1	Very high	70 Å²	70	76.4 Å²	76.4	43%	0.429	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-11.2	169.5	69.3	0	0	0	0	112.3	R137 L152	T135-R137 PolarHBondContact O-N 3.19Å; T135-R137 VanDerWaalsContact O-N 3.15Å; T135-R137 PolarHBondContact OG1-N 2.91Å; T135-L152 WeakPolarHBondContact CB-O 3.28Å; T135-L152 PolarHBondContact N-O 2.88Å; T135-L152 VanDerWaalsContact OG1-CB 3.31Å; T135-L152 WeakPolarHBondContact OG1-CB 3.35Å; T135-L152 PolarHBondContact OG1-O 2.92Å
136	G	92	Very high	94.8	Very high	60 Å²	60	74.7 Å²	74.7	62%	0.619	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	68.5	-0.3	-172.5	0	0	0	0	0	114.8	S134	S134-G136 VanDerWaalsContact C-N 3.33Å; S134-G136 PolarHBondContact OG-N 2.87Å; S134-G136 VanDerWaalsContact OG-N 3.12Å
137	R	96.4	Very high	94.7	Very high	112 Å²	112	74.7 Å²	74.7	42%	0.423	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.9	179.8	-63.8	174.7	66.2	-170.1	0.5	110.3	T135 L152 D202	T135-R137 PolarHBondContact O-N 3.19Å; T135-R137 VanDerWaalsContact O-N 3.15Å; T135-R137 PolarHBondContact OG1-N 2.91Å; R137-L152 HydrophobicContact CB-CB 4.44Å; R137-L152 HydrophobicContact CB-CD1 4.4Å; R137-L152 PolarHBondContact O-N 2.9Å; R137-D202 IonicContact NH2-OD2 3.64Å; R137-D202 PolarHBondContact NH2-OD2 3.09Å
138	S	96.8	Very high	94.7	Very high	100 Å²	100	70.5 Å²	70.5	70%	0.699	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	146.1	169.6	-58.1	0	0	0	0	111.3	G150	S138-G150 WeakPolarHBondContact CA-O 3.47Å
139	V	97.6	Very high	94.7	Very high	9 Å²	9	70.5 Å²	70.5	6%	0.055	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	143.9	176.2	54.5	0	0	0	0	108.9	W148 E149 G150 L152 A172 R200	V139-W148 HydrophobicContact CG1-CZ3 4Å; V139-W148 HydrophobicContact CG2-CH2 4.19Å; V139-W148 HydrophobicContact CG2-CZ3 4.17Å; V139-E149 CarbonylContact O-C 3.6Å; V139-E149 WeakPolarHBondContact O-CA 3.31Å; V139-G150 PolarHBondContact N-O 2.82Å; V139-G150 PolarHBondContact O-N 3.35Å; V139-L152 HydrophobicContact CB-CD1 4.3Å; V139-L152 HydrophobicContact CB-CD2 4.18Å; V139-L152 HydrophobicContact CB-CG 3.84Å; V139-L152 HydrophobicContact CG1-CD2 3.7Å; V139-L152 HydrophobicContact CG1-CG 3.55Å; V139-L152 HydrophobicContact CG2-CD2 4.42Å; V139-A172 HydrophobicContact CG1-CB 3.79Å; V139-R200 HydrophobicContact CG2-CB 4.01Å
140	G	95.6	Very high	94.7	Very high	38 Å²	38	70.2 Å²	70.2	39%	0.392	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.5	173.4	0	0	0	0	0	110.8	W148	G140-W148 CarbonylContact C-O 3.53Å; G140-W148 WeakPolarHBondContact CA-O 3.42Å
141	V	95.1	Very high	94.7	Very high	16 Å²	16	66.6 Å²	66.6	10%	0.097	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135	-178.5	-177.3	0	0	0	0	108.9	Y143 N147 W148 R200	V141-Y143 HydrophobicContact CB-CE2 4.09Å; V141-Y143 HydrophobicContact CG1-CD2 4.28Å; V141-Y143 HydrophobicContact CG1-CE1 4.02Å; V141-Y143 HydrophobicContact CG1-CE2 3.7Å; V141-N147 VanDerWaalsContact O-CA 3.25Å; V141-N147 WeakPolarHBondContact O-CA 3.12Å; V141-N147 WeakPolarHBondContact O-CB 3.37Å; V141-W148 HydrophobicContact CB-CD2 4.29Å; V141-W148 HydrophobicContact CB-CH2 4.08Å; V141-W148 HydrophobicContact CB-CZ2 3.6Å; V141-W148 HydrophobicContact CG2-CH2 3.35Å; V141-W148 HydrophobicContact CG2-CZ2 3.23Å; V141-W148 HydrophobicContact CG2-CZ3 4.09Å; V141-W148 PolarHBondContact N-O 2.89Å; V141-W148 PolarHBondContact O-N 3.42Å; V141-R200 HydrophobicContact CG2-CB 3.8Å; V141-R200 HydrophobicContact CG2-CG 3.86Å
142	R	93	Very high	94.7	Very high	217 Å²	217	65 Å²	65	82%	0.819	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.8	172.9	-64.3	-177.3	177.4	175	-0.5	108.6	N147	R142-N147 HydrophobicContact CB-CB 4.36Å; R142-N147 HydrophobicContact CG-CB 3.87Å
143	Y	89.5	Confident	94.7	Very high	55 Å²	55	63.2 Å²	63.2	22%	0.216	35%	0.347	C	S	.	.			trans	-103	-179.7	175.8	-58	-91	0	0	0	110	V141 Q145 G146 W148 F180 I190	V141-Y143 HydrophobicContact CB-CE2 4.09Å; V141-Y143 HydrophobicContact CG1-CD2 4.28Å; V141-Y143 HydrophobicContact CG1-CE1 4.02Å; V141-Y143 HydrophobicContact CG1-CE2 3.7Å; Y143-Q145 PolarHBondContact O-N 3.1Å; Y143-G146 PolarHBondContact N-O 3.46Å; Y143-W148 AromaticContact CE2-CD1 3.55Å; Y143-W148 AromaticContact CE2-NE1 3.29Å; Y143-W148 VanDerWaalsContact CE2-NE1 3.29Å; Y143-W148 AromaticContact CZ-NE1 3.54Å; Y143-W148 PolarHBondContact OH-NE1 3.19Å; Y143-F180 HydrophobicContact CD2-CD2 4.17Å; Y143-F180 HydrophobicContact CD2-CE2 4.35Å; Y143-F180 AromaticContact CE2-CD2 3.97Å; Y143-F180 HydrophobicContact CE2-CD2 3.97Å; Y143-F180 AromaticContact CE2-CE2 3.81Å; Y143-F180 HydrophobicContact CE2-CE2 3.81Å; Y143-I190 HydrophobicContact CE1-CD1 3.95Å
144	T	82.3	Confident	94.7	Very high	102 Å²	102	59 Å²	59	63%	0.626	33%	0.33	S	S	*	.	S	Bend	trans	-55.5	-40.2	169.7	-55.6	0	0	0	0	111
145	Q	82.8	Confident	94.7	Very high	140 Å²	140	55.7 Å²	55.7	65%	0.654	31%	0.306	S	S	*	.	S	Bend	trans	-129.9	120.9	174.2	-174.7	174.4	34.9	0	0	108.8	Y143	Y143-Q145 PolarHBondContact O-N 3.1Å
146	G	91.3	Very high	94.9	Very high	14 Å²	14	55.1 Å²	55.1	14%	0.144	30%	0.3	C	S	.	.			trans	83	167.8	177.8	0	0	0	0	0	115.3	Y143 D178 S179	Y143-G146 PolarHBondContact N-O 3.46Å; G146-D178 CarbonylContact C-O 3.5Å; G146-D178 WeakPolarHBondContact CA-O 3.34Å; G146-S179 WeakPolarHBondContact CA-O 3.49Å
147	N	96	Very high	95.2	Very high	45 Å²	45	52.2 Å²	52.2	24%	0.241	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	162	179	63.7	78	0	0	0	110.7	V141 R142 S177 D178	V141-N147 VanDerWaalsContact O-CA 3.25Å; V141-N147 WeakPolarHBondContact O-CA 3.12Å; V141-N147 WeakPolarHBondContact O-CB 3.37Å; R142-N147 HydrophobicContact CB-CB 4.36Å; R142-N147 HydrophobicContact CG-CB 3.87Å; N147-S177 WeakPolarHBondContact O-CA 3.48Å; N147-D178 PolarHBondContact N-O 2.98Å; N147-D178 PolarHBondContact O-N 3.46Å
148	W	98.3	Very high	95.2	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.7	170.6	57.6	-108.1	0	0	0	111.6	N109 A111 V139 G140 V141 Y143 A172 I174 L176 F180	N109-W148 HydrophobicContact CB-CH2 4.37Å; N109-W148 HydrophobicContact CB-CZ2 4.15Å; A111-W148 HydrophobicContact CB-CD2 4.45Å; A111-W148 HydrophobicContact CB-CH2 3.79Å; A111-W148 HydrophobicContact CB-CZ2 3.39Å; A111-W148 HydrophobicContact CB-CZ3 4.45Å; V139-W148 HydrophobicContact CG1-CZ3 4Å; V139-W148 HydrophobicContact CG2-CH2 4.19Å; V139-W148 HydrophobicContact CG2-CZ3 4.17Å; G140-W148 CarbonylContact C-O 3.53Å; G140-W148 WeakPolarHBondContact CA-O 3.42Å; V141-W148 HydrophobicContact CB-CD2 4.29Å; V141-W148 HydrophobicContact CB-CH2 4.08Å; V141-W148 HydrophobicContact CB-CZ2 3.6Å; V141-W148 HydrophobicContact CG2-CH2 3.35Å; V141-W148 HydrophobicContact CG2-CZ2 3.23Å; V141-W148 HydrophobicContact CG2-CZ3 4.09Å; V141-W148 PolarHBondContact N-O 2.89Å; V141-W148 PolarHBondContact O-N 3.42Å; Y143-W148 AromaticContact CE2-CD1 3.55Å; Y143-W148 AromaticContact CE2-NE1 3.29Å; Y143-W148 VanDerWaalsContact CE2-NE1 3.29Å; Y143-W148 AromaticContact CZ-NE1 3.54Å; Y143-W148 PolarHBondContact OH-NE1 3.19Å; W148-A172 HydrophobicContact CH2-CB 3.6Å; W148-A172 HydrophobicContact CZ3-CB 3.76Å; W148-I174 HydrophobicContact CB-CD1 4.09Å; W148-I174 HydrophobicContact CB-CG1 4.17Å; W148-I174 HydrophobicContact CB-CG2 3.76Å; W148-I174 HydrophobicContact CD2-CD1 3.94Å; W148-I174 HydrophobicContact CD2-CG1 3.83Å; W148-I174 HydrophobicContact CE3-CG1 3.9Å; W148-I174 HydrophobicContact CG-CD1 3.72Å; W148-I174 HydrophobicContact CG-CG1 3.96Å; W148-I174 HydrophobicContact CG-CG2 4.47Å; W148-L176 CarbonylContact C-O 3.3Å; W148-L176 VanDerWaalsContact CA-O 3.3Å; W148-L176 WeakPolarHBondContact CA-O 3.33Å; W148-F180 AromaticContact CD1-CD2 3.77Å; W148-F180 AromaticContact CD1-CE1 3.94Å; W148-F180 AromaticContact CD1-CE2 3.69Å; W148-F180 AromaticContact CD1-CG 3.93Å; W148-F180 AromaticContact CD1-CZ 3.77Å
149	E	98.3	Very high	95.1	Very high	107 Å²	107	44.6 Å²	44.6	50%	0.5	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.5	172	-62.6	-175.9	175.1	0	0	109.7	V139 Q175 L176	V139-E149 CarbonylContact O-C 3.6Å; V139-E149 WeakPolarHBondContact O-CA 3.31Å; E149-Q175 PolarHBondContact O-N 2.83Å; E149-L176 HydrophobicContact CB-CB 4.39Å; E149-L176 PolarHBondContact N-O 3.12Å; E149-L176 PolarHBondContact O-N 2.85Å
150	G	97.9	Very high	94.8	Very high	5 Å²	5	47.5 Å²	47.5	5%	0.052	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	-167.1	-175.6	0	0	0	0	0	113.2	S138 V139 A173	S138-G150 WeakPolarHBondContact CA-O 3.47Å; V139-G150 PolarHBondContact N-O 2.82Å; V139-G150 PolarHBondContact O-N 3.35Å; G150-A173 CarbonylContact C-O 3.55Å; G150-A173 WeakPolarHBondContact CA-O 3.31Å
151	V	98.2	Very high	94.7	Very high	23 Å²	23	51 Å²	51	14%	0.139	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.1	-179.9	-178.2	0	0	0	0	109.7	A173	V151-A173 PolarHBondContact N-O 2.69Å; V151-A173 PolarHBondContact O-N 3.01Å
152	L	98.3	Very high	94.6	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	136.9	173.8	-74.7	176.5	0	0	0	111	T135 R137 V139 A172 P201 V205	T135-L152 WeakPolarHBondContact CB-O 3.28Å; T135-L152 PolarHBondContact N-O 2.88Å; T135-L152 VanDerWaalsContact OG1-CB 3.31Å; T135-L152 WeakPolarHBondContact OG1-CB 3.35Å; T135-L152 PolarHBondContact OG1-O 2.92Å; R137-L152 HydrophobicContact CB-CB 4.44Å; R137-L152 HydrophobicContact CB-CD1 4.4Å; R137-L152 PolarHBondContact O-N 2.9Å; V139-L152 HydrophobicContact CB-CD1 4.3Å; V139-L152 HydrophobicContact CB-CD2 4.18Å; V139-L152 HydrophobicContact CB-CG 3.84Å; V139-L152 HydrophobicContact CG1-CD2 3.7Å; V139-L152 HydrophobicContact CG1-CG 3.55Å; V139-L152 HydrophobicContact CG2-CD2 4.42Å; L152-A172 HydrophobicContact CD2-CB 4.19Å; L152-P201 HydrophobicContact CD1-CG 4.41Å; L152-V205 HydrophobicContact CD1-CG2 3.89Å
153	G	98.2	Very high	94.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	-174.6	167.9	0	0	0	0	0	110.9	Q133 I171	Q133-G153 CarbonylContact O-C 3.49Å; Q133-G153 WeakPolarHBondContact O-CA 3.22Å; G153-I171 PolarHBondContact N-O 2.88Å; G153-I171 PolarHBondContact O-N 3.15Å
154	T	98.6	Very high	94.5	Very high	45 Å²	45	43.9 Å²	43.9	28%	0.276	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.4	166.5	58.4	0	0	0	0	109.5	Q133 I169	Q133-T154 PolarHBondContact N-O 3.43Å; Q133-T154 PolarHBondContact O-N 3.05Å; T154-I169 WeakPolarHBondContact CA-O 3.47Å
155	D	98.7	Very high	94.9	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.011	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	170.6	169.3	-148	-19.5	0	0	0	111	I92 G93 F124 S129 T131 F132 A168 I169 I171	I92-D155 HydrophobicContact CG2-CB 4.41Å; G93-D155 VanDerWaalsContact CA-CG 3.5Å; G93-D155 WeakPolarHBondContact CA-OD1 3.47Å; G93-D155 VanDerWaalsContact CA-OD2 3.22Å; G93-D155 WeakPolarHBondContact CA-OD2 3.32Å; F124-D155 VanDerWaalsContact CZ-OD2 3.27Å; F124-D155 WeakPolarHBondContact CZ-OD2 3.43Å; S129-D155 VanDerWaalsContact CB-OD2 3.28Å; S129-D155 WeakPolarHBondContact CB-OD2 3.29Å; S129-D155 PolarHBondContact OG-OD1 3.47Å; S129-D155 PolarHBondContact OG-OD2 2.77Å; T131-D155 VanDerWaalsContact CB-OD1 3.26Å; T131-D155 WeakPolarHBondContact CB-OD1 3.41Å; T131-D155 PolarHBondContact OG1-OD1 3.12Å; F132-D155 WeakPolarHBondContact CA-OD2 3.37Å; F132-D155 WeakPolarHBondContact CB-OD2 3.46Å; F132-D155 HydrophobicContact CD2-CB 4.19Å; F132-D155 PolarHBondContact N-OD1 3.15Å; F132-D155 PolarHBondContact N-OD2 3.18Å; D155-A168 WeakPolarHBondContact O-CA 3.24Å; D155-I169 PolarHBondContact N-O 2.71Å; D155-I169 PolarHBondContact O-N 3.28Å; D155-I171 HydrophobicContact CB-CG2 4.45Å
156	L	98.6	Very high	95.5	Very high	58 Å²	58	37.9 Å²	37.9	30%	0.304	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.3	172.8	-63.8	-172	0	0	0	110.4	G93 T131 T166 I167 A168	G93-L156 PolarHBondContact N-O 3.22Å; T131-L156 HydrophobicContact CG2-CD1 3.87Å; T131-L156 HydrophobicContact CG2-CG 4.33Å; L156-T166 HydrophobicContact CB-CG2 3.67Å; L156-T166 HydrophobicContact CD1-CG2 4.13Å; L156-T166 HydrophobicContact CD2-CG2 4.29Å; L156-T166 HydrophobicContact CG-CG2 4.25Å; L156-I167 CarbonylContact C-O 3.58Å; L156-I167 WeakPolarHBondContact CA-O 3.44Å; L156-A168 HydrophobicContact CD2-CB 3.93Å
157	V	98.2	Very high	95.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142	177.8	169.2	0	0	0	0	110.2	M90 S91 I92 F110 T166 I167 I169 F208	M90-V157 HydrophobicContact CE-CG1 3.36Å; S91-V157 WeakPolarHBondContact O-CA 3.28Å; I92-V157 HydrophobicContact CB-CG2 4.26Å; I92-V157 HydrophobicContact CG1-CG2 4.02Å; I92-V157 HydrophobicContact CG2-CG2 3.96Å; F110-V157 HydrophobicContact CE1-CG2 4.4Å; V157-T166 CarbonylContact O-C 3.52Å; V157-T166 WeakPolarHBondContact O-CA 3.33Å; V157-I167 PolarHBondContact N-O 3.12Å; V157-I167 PolarHBondContact O-N 3.01Å; V157-I169 HydrophobicContact CB-CD1 3.91Å; V157-I169 HydrophobicContact CB-CG1 4.26Å; V157-I169 HydrophobicContact CG1-CD1 4.33Å; V157-I169 HydrophobicContact CG2-CD1 3.42Å; V157-I169 VanDerWaalsContact CG2-CD1 3.42Å; V157-I169 HydrophobicContact CG2-CG1 3.76Å; V157-F208 HydrophobicContact CG1-CE2 4.35Å
158	S	96.4	Very high	95.9	Very high	35 Å²	35	37.3 Å²	37.3	25%	0.245	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.4	169.3	54.4	0	0	0	0	110	S91	S91-S158 PolarHBondContact N-O 3.47Å; S91-S158 PolarHBondContact O-N 2.85Å
159	L	94.8	Very high	95.9	Very high	17 Å²	17	37.4 Å²	37.4	9%	0.089	22%	0.221	C	C	.	.			trans	-108.8	110.3	176.9	-67.5	93.7	0	0	0	108	I88 M90 K161 G162 F208 M246	I88-L159 HydrophobicContact CD1-CD2 3.94Å; M90-L159 HydrophobicContact CE-CD1 4.46Å; M90-L159 HydrophobicContact CE-CG 4.35Å; M90-L159 HydrophobicContact CG-CD2 4.42Å; M90-L159 HydrophobicContact CG-CG 4.35Å; L159-K161 PolarHBondContact O-N 2.77Å; L159-K161 VanDerWaalsContact O-N 3.1Å; L159-G162 PolarHBondContact O-N 3.2Å; L159-F208 HydrophobicContact CD1-CE2 4.4Å; L159-F208 HydrophobicContact CD1-CZ 3.86Å; L159-F208 HydrophobicContact CD2-CZ 4.39Å; L159-M246 HydrophobicContact CD2-CE 3.62Å; L159-M246 HydrophobicContact CD2-SD 4.29Å
160	P	91.5	Very high	95.9	Very high	69 Å²	69	34.4 Å²	34.4	45%	0.448	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.4	179.4	-28	36	0	0	0	113.7	E89	E89-P160 WeakPolarHBondContact O-CD 3.48Å
161	K	93.6	Very high	95.9	Very high	111 Å²	111	34.2 Å²	34.2	48%	0.483	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	61.6	175.7	-67.6	-173.9	176.9	-174.1	0	110.5	D73 N77 L159	D73-K161 WeakPolarHBondContact O-CB 3.45Å; N77-K161 HydrophobicContact CB-CB 3.6Å; N77-K161 HydrophobicContact CB-CD 4Å; N77-K161 PolarHBondContact ND2-O 2.79Å; L159-K161 PolarHBondContact O-N 2.77Å; L159-K161 VanDerWaalsContact O-N 3.1Å
162	G	93.4	Very high	95.9	Very high	13 Å²	13	33.1 Å²	33.1	13%	0.134	20%	0.199	C	C	.	.	S	Bend	trans	-147	-165.7	-177.5	0	0	0	0	0	112.1	L159	L159-G162 PolarHBondContact O-N 3.2Å
163	P	91.5	Very high	95.9	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.019	20%	0.198	C	C	.	.	S	Bend	trans	-54.5	141	167.8	-24	35.4	0	0	0	110.9	M74 G165 L216 I218 M246	M74-P163 HydrophobicContact SD-CG 4.27Å; P163-G165 PolarHBondContact O-N 3.19Å; P163-L216 HydrophobicContact CB-CD1 3.68Å; P163-I218 HydrophobicContact CG-CD1 4.13Å; P163-M246 HydrophobicContact CG-CB 3.67Å; P163-M246 HydrophobicContact CG-CG 4.44Å; P163-M246 HydrophobicContact CG-SD 4.15Å
164	N	88.9	Confident	96	Very high	124 Å²	124	33.1 Å²	33.1	66%	0.663	20%	0.199	S	C	*	.	S	Bend	trans	-73.1	126.1	-178.6	-174	14.2	0	0	0	110.2	T68	T68-N164 PolarHBondContact O-N 2.89Å
165	G	89.4	Confident	95.9	Very high	29 Å²	29	36.5 Å²	36.5	30%	0.299	21%	0.212	S	C	.	.	S	Bend	trans	141.5	172.8	175.7	0	0	0	0	0	113.4	P163	P163-G165 PolarHBondContact O-N 3.19Å
166	T	95.4	Very high	95.9	Very high	87 Å²	87	41.9 Å²	41.9	53%	0.534	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.3	172.7	-58.9	0	0	0	0	107.8	L156 V157	L156-T166 HydrophobicContact CB-CG2 3.67Å; L156-T166 HydrophobicContact CD1-CG2 4.13Å; L156-T166 HydrophobicContact CD2-CG2 4.29Å; L156-T166 HydrophobicContact CG-CG2 4.25Å; V157-T166 CarbonylContact O-C 3.52Å; V157-T166 WeakPolarHBondContact O-CA 3.33Å
167	I	97.1	Very high	95.8	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	143.8	-177.5	54.4	173.1	0	0	0	110.9	L156 V157 I169 F208 V212 Q215 L216	L156-I167 CarbonylContact C-O 3.58Å; L156-I167 WeakPolarHBondContact CA-O 3.44Å; V157-I167 PolarHBondContact N-O 3.12Å; V157-I167 PolarHBondContact O-N 3.01Å; I167-I169 HydrophobicContact CB-CG2 4.43Å; I167-I169 HydrophobicContact CD1-CG2 3.7Å; I167-I169 HydrophobicContact CG1-CG2 3.85Å; I167-F208 HydrophobicContact CD1-CD2 4.38Å; I167-F208 HydrophobicContact CD1-CE2 3.76Å; I167-F208 HydrophobicContact CD1-CZ 4.2Å; I167-V212 HydrophobicContact CD1-CB 4.25Å; I167-V212 HydrophobicContact CD1-CG2 3.36Å; I167-Q215 HydrophobicContact CG2-CB 3.97Å; I167-L216 HydrophobicContact CG2-CD1 3.95Å; I167-L216 HydrophobicContact CG2-CD2 3.61Å; I167-L216 HydrophobicContact CG2-CG 3.58Å
168	A	98.3	Very high	95.7	Very high	44 Å²	44	45 Å²	45	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.2	170.2	0	0	0	0	0	109.2	D155 L156 Q215	D155-A168 WeakPolarHBondContact O-CA 3.24Å; L156-A168 HydrophobicContact CD2-CB 3.93Å; A168-Q215 PolarHBondContact O-NE2 3.06Å
169	I	98.3	Very high	95.6	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	159	-177.5	64.2	170.1	0	0	0	111.6	F110 T154 D155 V157 I167 F208	F110-I169 HydrophobicContact CD1-CD1 3.29Å; F110-I169 HydrophobicContact CD1-CG1 4.28Å; F110-I169 HydrophobicContact CE1-CD1 3.41Å; F110-I169 VanDerWaalsContact CE1-CD1 3.41Å; F110-I169 HydrophobicContact CE1-CG1 4.47Å; F110-I169 HydrophobicContact CG-CD1 3.94Å; F110-I169 HydrophobicContact CZ-CD1 4.11Å; T154-I169 WeakPolarHBondContact CA-O 3.47Å; D155-I169 PolarHBondContact N-O 2.71Å; D155-I169 PolarHBondContact O-N 3.28Å; V157-I169 HydrophobicContact CB-CD1 3.91Å; V157-I169 HydrophobicContact CB-CG1 4.26Å; V157-I169 HydrophobicContact CG1-CD1 4.33Å; V157-I169 HydrophobicContact CG2-CD1 3.42Å; V157-I169 VanDerWaalsContact CG2-CD1 3.42Å; V157-I169 HydrophobicContact CG2-CG1 3.76Å; I167-I169 HydrophobicContact CB-CG2 4.43Å; I167-I169 HydrophobicContact CD1-CG2 3.7Å; I167-I169 HydrophobicContact CG1-CG2 3.85Å; I169-F208 HydrophobicContact CD1-CD2 3.71Å; I169-F208 HydrophobicContact CD1-CE2 4.26Å; I169-F208 HydrophobicContact CG2-CD2 3.96Å; I169-F208 HydrophobicContact CG2-CE2 4.42Å
170	N	98.5	Very high	95.7	Very high	44 Å²	44	46.1 Å²	46.1	24%	0.235	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.9	163.6	-63.8	-65.5	0	0	0	109.7	V205 E206	N170-V205 HydrophobicContact CB-CG1 3.81Å; N170-E206 PolarHBondContact ND2-N 3.09Å; N170-E206 PolarHBondContact ND2-O 3.04Å
171	I	98.4	Very high	95.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.9	178.9	-174.9	172.5	0	0	0	109.9	I92 F110 V112 F124 F132 G153 D155	I92-I171 HydrophobicContact CD1-CD1 4.31Å; I92-I171 HydrophobicContact CG2-CD1 3.82Å; F110-I171 HydrophobicContact CD1-CB 3.86Å; F110-I171 HydrophobicContact CD1-CD1 4.19Å; F110-I171 HydrophobicContact CD1-CG1 3.7Å; F110-I171 HydrophobicContact CE1-CB 4.1Å; F110-I171 HydrophobicContact CE1-CD1 3.6Å; F110-I171 HydrophobicContact CE1-CG1 3.65Å; V112-I171 HydrophobicContact CG1-CD1 4.32Å; V112-I171 HydrophobicContact CG2-CD1 3.53Å; V112-I171 HydrophobicContact CG2-CG1 3.99Å; F124-I171 HydrophobicContact CD1-CD1 4.02Å; F124-I171 HydrophobicContact CE1-CD1 4.03Å; F132-I171 HydrophobicContact CD2-CG2 4.42Å; F132-I171 HydrophobicContact CE2-CG2 3.98Å; G153-I171 PolarHBondContact N-O 2.88Å; G153-I171 PolarHBondContact O-N 3.15Å; D155-I171 HydrophobicContact CB-CG2 4.45Å
172	A	98.6	Very high	95.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	113.4	167	0	0	0	0	0	109.7	F110 A111 V112 V139 W148 L152 I174	F110-A172 PolarHBondContact O-N 2.84Å; A111-A172 CarbonylContact C-O 3.57Å; A111-A172 VanDerWaalsContact CA-O 3.29Å; A111-A172 WeakPolarHBondContact CA-O 3.38Å; A111-A172 HydrophobicContact CB-CB 3.76Å; V112-A172 PolarHBondContact N-O 2.64Å; V139-A172 HydrophobicContact CG1-CB 3.79Å; W148-A172 HydrophobicContact CH2-CB 3.6Å; W148-A172 HydrophobicContact CZ3-CB 3.76Å; L152-A172 HydrophobicContact CD2-CB 4.19Å; A172-I174 PolarHBondContact O-N 2.87Å
173	A	98.5	Very high	95.8	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.033	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	96.7	175	0	0	0	0	0	109.2	A114 T126 G150 V151 Q175	A114-A173 HydrophobicContact CB-CB 3.57Å; T126-A173 HydrophobicContact CG2-CB 4.06Å; G150-A173 CarbonylContact C-O 3.55Å; G150-A173 WeakPolarHBondContact CA-O 3.31Å; V151-A173 PolarHBondContact N-O 2.69Å; V151-A173 PolarHBondContact O-N 3.01Å; A173-Q175 PolarHBondContact O-N 2.84Å
174	I	98.6	Very high	95.6	Very high	4 Å²	4	47 Å²	47	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.7	-176.4	-61.3	170.3	0	0	0	109.7	A111 V112 A114 W148 A172 L176 F180 F181	A111-I174 HydrophobicContact CB-CD1 3.82Å; A111-I174 HydrophobicContact CB-CG1 4.02Å; V112-I174 VanDerWaalsContact O-CB 3.3Å; V112-I174 WeakPolarHBondContact O-CB 3.33Å; V112-I174 WeakPolarHBondContact O-CG1 3.43Å; V112-I174 PolarHBondContact O-N 2.82Å; A114-I174 WeakPolarHBondContact CA-O 3.25Å; A114-I174 WeakPolarHBondContact CB-O 3.28Å; A114-I174 PolarHBondContact N-O 2.87Å; W148-I174 HydrophobicContact CB-CD1 4.09Å; W148-I174 HydrophobicContact CB-CG1 4.17Å; W148-I174 HydrophobicContact CB-CG2 3.76Å; W148-I174 HydrophobicContact CD2-CD1 3.94Å; W148-I174 HydrophobicContact CD2-CG1 3.83Å; W148-I174 HydrophobicContact CE3-CG1 3.9Å; W148-I174 HydrophobicContact CG-CD1 3.72Å; W148-I174 HydrophobicContact CG-CG1 3.96Å; W148-I174 HydrophobicContact CG-CG2 4.47Å; A172-I174 PolarHBondContact O-N 2.87Å; I174-L176 WeakPolarHBondContact CG2-O 3.47Å; I174-F180 HydrophobicContact CD1-CD1 4.45Å; I174-F180 HydrophobicContact CD1-CE1 3.87Å; I174-F181 HydrophobicContact CD1-CZ 4.29Å; I174-F181 HydrophobicContact CG2-CE2 4.47Å
175	Q	97.8	Very high	95.7	Very high	116 Å²	116	41.9 Å²	41.9	54%	0.542	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-28.6	178.1	-66.5	179.4	-26.7	0	0	111.8	E149 A173	E149-Q175 PolarHBondContact O-N 2.83Å; A173-Q175 PolarHBondContact O-N 2.84Å
176	L	97.5	Very high	95.8	Very high	115 Å²	115	43.1 Å²	43.1	60%	0.602	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.3	-178.7	-62.5	171.5	0	0	0	109.3	W148 E149 I174	W148-L176 CarbonylContact C-O 3.3Å; W148-L176 VanDerWaalsContact CA-O 3.3Å; W148-L176 WeakPolarHBondContact CA-O 3.33Å; E149-L176 HydrophobicContact CB-CB 4.39Å; E149-L176 PolarHBondContact N-O 3.12Å; E149-L176 PolarHBondContact O-N 2.85Å; I174-L176 WeakPolarHBondContact CG2-O 3.47Å
177	S	97.5	Very high	95.9	Very high	32 Å²	32	39.7 Å²	39.7	22%	0.224	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	148.4	174	62.1	0	0	0	0	111.1	N147	N147-S177 WeakPolarHBondContact O-CA 3.48Å
178	D	96.4	Very high	95.9	Very high	93 Å²	93	39.9 Å²	39.9	50%	0.497	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.4	170.1	174	20.3	0	0	0	108.9	G146 N147 F180	G146-D178 CarbonylContact C-O 3.5Å; G146-D178 WeakPolarHBondContact CA-O 3.34Å; N147-D178 PolarHBondContact N-O 2.98Å; N147-D178 PolarHBondContact O-N 3.46Å; D178-F180 PolarHBondContact O-N 2.95Å
179	S	94.3	Very high	95.9	Very high	60 Å²	60	37.8 Å²	37.8	42%	0.42	22%	0.22	S	C	.	.	S	Bend	trans	54	21.9	176.1	-54.3	0	0	0	0	115	G146	G146-S179 WeakPolarHBondContact CA-O 3.49Å
180	F	96.4	Very high	96	Very high	15 Å²	15	37.8 Å²	37.8	7%	0.066	22%	0.22	C	C	.	.	S	Bend	trans	-90.5	-58.6	175	176.7	-108.5	0	0	0	110.6	Y143 W148 I174 D178 W187 I190	Y143-F180 HydrophobicContact CD2-CD2 4.17Å; Y143-F180 HydrophobicContact CD2-CE2 4.35Å; Y143-F180 AromaticContact CE2-CD2 3.97Å; Y143-F180 HydrophobicContact CE2-CD2 3.97Å; Y143-F180 AromaticContact CE2-CE2 3.81Å; Y143-F180 HydrophobicContact CE2-CE2 3.81Å; W148-F180 AromaticContact CD1-CD2 3.77Å; W148-F180 AromaticContact CD1-CE1 3.94Å; W148-F180 AromaticContact CD1-CE2 3.69Å; W148-F180 AromaticContact CD1-CG 3.93Å; W148-F180 AromaticContact CD1-CZ 3.77Å; I174-F180 HydrophobicContact CD1-CD1 4.45Å; I174-F180 HydrophobicContact CD1-CE1 3.87Å; D178-F180 PolarHBondContact O-N 2.95Å; F180-W187 HydrophobicContact CD1-CZ3 4.36Å; F180-W187 AromaticContact CE1-CZ3 3.84Å; F180-W187 HydrophobicContact CE1-CZ3 3.84Å; F180-W187 HydrophobicContact CE2-CZ3 4.47Å; F180-W187 HydrophobicContact CZ-CH2 4.42Å; F180-W187 AromaticContact CZ-CZ3 3.9Å; F180-W187 HydrophobicContact CZ-CZ3 3.9Å; F180-W187 WeakPolarHBondContact O-CH2 3.3Å; F180-I190 HydrophobicContact CE2-CD1 4.19Å; F180-I190 HydrophobicContact CE2-CG2 4.36Å; F180-I190 HydrophobicContact CZ-CB 3.96Å; F180-I190 HydrophobicContact CZ-CD1 4.44Å; F180-I190 HydrophobicContact CZ-CG2 3.79Å
181	F	96.4	Very high	96	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.022	21%	0.209	C	C	.	.	S	Bend	trans	-79.7	123.4	167.8	-59.7	-60.6	0	0	0	108.7	A113 H117 F119 I120 I174 I185 W187	A113-F181 HydrophobicContact CB-CE2 4.02Å; A113-F181 HydrophobicContact CB-CZ 3.72Å; H117-F181 HydrophobicContact CB-CD2 4.47Å; F119-F181 WeakPolarHBondContact CD2-O 3.4Å; I120-F181 HydrophobicContact CG2-CB 4.17Å; I120-F181 HydrophobicContact CG2-CD1 3.68Å; I120-F181 HydrophobicContact CG2-CD2 4.4Å; I120-F181 HydrophobicContact CG2-CE1 4.15Å; I120-F181 HydrophobicContact CG2-CG 3.83Å; I174-F181 HydrophobicContact CD1-CZ 4.29Å; I174-F181 HydrophobicContact CG2-CE2 4.47Å; F181-I185 HydrophobicContact CB-CD1 3.9Å; F181-I185 HydrophobicContact CD1-CD1 3.72Å; F181-I185 HydrophobicContact CG-CD1 4.31Å; F181-W187 HydrophobicContact CD1-CE3 4.08Å; F181-W187 HydrophobicContact CD1-CH2 4.39Å; F181-W187 AromaticContact CD1-CZ3 3.62Å; F181-W187 HydrophobicContact CD1-CZ3 3.62Å; F181-W187 HydrophobicContact CE1-CE3 4.02Å; F181-W187 AromaticContact CE1-CZ3 3.74Å; F181-W187 HydrophobicContact CE1-CZ3 3.74Å
182	L	92.9	Very high	96	Very high	65 Å²	65	35.7 Å²	35.7	34%	0.34	21%	0.209	S	C	.	.			trans	-112.6	156.6	-178.7	-61.8	178.1	0	0	0	110.9	G184 I185	L182-G184 PolarHBondContact O-N 3Å; L182-I185 HydrophobicContact CB-CG2 4.17Å; L182-I185 VanDerWaalsContact O-CG1 3.26Å; L182-I185 WeakPolarHBondContact O-CG1 3.19Å; L182-I185 PolarHBondContact O-N 2.8Å
183	P	90.7	Very high	96	Very high	92 Å²	92	35.7 Å²	35.7	60%	0.597	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	136.7	174.6	-22.1	32.1	0	0	0	112.3	F119 I185	F119-P183 HydrophobicContact CD1-CB 4.33Å; F119-P183 HydrophobicContact CD1-CG 4.07Å; F119-P183 HydrophobicContact CD2-CG 4.09Å; F119-P183 HydrophobicContact CE1-CB 4.44Å; F119-P183 HydrophobicContact CE1-CG 3.83Å; F119-P183 HydrophobicContact CE2-CG 3.86Å; F119-P183 HydrophobicContact CG-CG 4.22Å; F119-P183 HydrophobicContact CZ-CG 3.73Å; P183-I185 VanDerWaalsContact C-N 3.34Å
184	G	86.8	Confident	96	Very high	52 Å²	52	35.5 Å²	35.5	54%	0.536	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	2	174.4	0	0	0	0	0	115.6	R84 L182	R84-G184 WeakPolarHBondContact CD-O 3.26Å; L182-G184 PolarHBondContact O-N 3Å
185	I	91.3	Very high	96	Very high	16 Å²	16	35.8 Å²	35.8	8%	0.082	21%	0.208	C	C	.	.			trans	-75.3	151.4	168	72.6	-178.9	0	0	0	110.6	F181 L182 P183 W187	F181-I185 HydrophobicContact CB-CD1 3.9Å; F181-I185 HydrophobicContact CD1-CD1 3.72Å; F181-I185 HydrophobicContact CG-CD1 4.31Å; L182-I185 HydrophobicContact CB-CG2 4.17Å; L182-I185 VanDerWaalsContact O-CG1 3.26Å; L182-I185 WeakPolarHBondContact O-CG1 3.19Å; L182-I185 PolarHBondContact O-N 2.8Å; P183-I185 VanDerWaalsContact C-N 3.34Å; I185-W187 HydrophobicContact CB-CD2 4.4Å; I185-W187 HydrophobicContact CB-CZ2 4.31Å; I185-W187 HydrophobicContact CD1-CD2 3.95Å; I185-W187 HydrophobicContact CD1-CE3 3.98Å; I185-W187 HydrophobicContact CD1-CH2 3.82Å; I185-W187 HydrophobicContact CD1-CZ2 3.78Å; I185-W187 HydrophobicContact CD1-CZ3 3.92Å; I185-W187 HydrophobicContact CG2-CZ2 3.99Å
186	D	92.6	Very high	96	Very high	56 Å²	56	32 Å²	32	30%	0.299	19%	0.194	S	C	.	.			trans	-112.5	7.2	179.3	-69.2	-54.1	0	0	0	113.1	R84 Y87 N100 Q188	R84-D186 IonicContact NH1-OD2 3.52Å; R84-D186 PolarHBondContact NH1-OD2 2.9Å; R84-D186 VanDerWaalsContact NH1-OD2 3.1Å; Y87-D186 HydrophobicContact CE1-CB 3.78Å; Y87-D186 WeakPolarHBondContact OH-CB 3.36Å; N100-D186 WeakPolarHBondContact CB-O 3.36Å; N100-D186 PolarHBondContact ND2-O 2.76Å; D186-Q188 VanDerWaalsContact C-NE2 3.33Å; D186-Q188 PolarHBondContact O-NE2 2.03Å
187	W	96.5	Very high	96	Very high	15 Å²	15	32.1 Å²	32.1	6%	0.057	19%	0.193	C	C	.	.			trans	-108.7	151.4	178.9	52.1	-98.4	0	0	0	113.1	R84 Y87 N100 L102 F180 F181 I185	R84-W187 PolarHBondContact O-NE1 3.35Å; Y87-W187 HydrophobicContact CD1-CB 4.39Å; Y87-W187 HydrophobicContact CG-CB 4.11Å; N100-W187 HydrophobicContact CB-CB 4.18Å; N100-W187 CarbonylContact O-C 3.5Å; N100-W187 WeakPolarHBondContact O-CA 3.26Å; N100-W187 WeakPolarHBondContact O-CB 3.18Å; L102-W187 HydrophobicContact CB-CD2 3.89Å; L102-W187 HydrophobicContact CB-CE3 4.16Å; L102-W187 HydrophobicContact CB-CG 4.06Å; L102-W187 HydrophobicContact CD2-CH2 4.26Å; L102-W187 HydrophobicContact CD2-CZ2 4.07Å; F180-W187 HydrophobicContact CD1-CZ3 4.36Å; F180-W187 AromaticContact CE1-CZ3 3.84Å; F180-W187 HydrophobicContact CE1-CZ3 3.84Å; F180-W187 HydrophobicContact CE2-CZ3 4.47Å; F180-W187 HydrophobicContact CZ-CH2 4.42Å; F180-W187 AromaticContact CZ-CZ3 3.9Å; F180-W187 HydrophobicContact CZ-CZ3 3.9Å; F180-W187 WeakPolarHBondContact O-CH2 3.3Å; F181-W187 HydrophobicContact CD1-CE3 4.08Å; F181-W187 HydrophobicContact CD1-CH2 4.39Å; F181-W187 AromaticContact CD1-CZ3 3.62Å; F181-W187 HydrophobicContact CD1-CZ3 3.62Å; F181-W187 HydrophobicContact CE1-CE3 4.02Å; F181-W187 AromaticContact CE1-CZ3 3.74Å; F181-W187 HydrophobicContact CE1-CZ3 3.74Å; I185-W187 HydrophobicContact CB-CD2 4.4Å; I185-W187 HydrophobicContact CB-CZ2 4.31Å; I185-W187 HydrophobicContact CD1-CD2 3.95Å; I185-W187 HydrophobicContact CD1-CE3 3.98Å; I185-W187 HydrophobicContact CD1-CH2 3.82Å; I185-W187 HydrophobicContact CD1-CZ2 3.78Å; I185-W187 HydrophobicContact CD1-CZ3 3.92Å; I185-W187 HydrophobicContact CG2-CZ2 3.99Å
188	Q	98.4	Very high	95.9	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.028	19%	0.19	C	C	.	.	S	Bend	trans	-120.8	6.1	-174.1	-61	77.7	53.2	0	0	112.3	L99 N100 A113 I120 S122 D186	L99-Q188 HydrophobicContact CB-CB 4.49Å; L99-Q188 HydrophobicContact CD2-CB 3.95Å; L99-Q188 HydrophobicContact CD2-CG 4.09Å; N100-Q188 PolarHBondContact O-N 3.35Å; A113-Q188 WeakPolarHBondContact CB-O 3.44Å; A113-Q188 PolarHBondContact N-O 3.08Å; I120-Q188 HydrophobicContact CB-CG 4.13Å; I120-Q188 HydrophobicContact CG2-CG 4.44Å; S122-Q188 VanDerWaalsContact O-CG 3.22Å; S122-Q188 WeakPolarHBondContact O-CG 3.48Å; D186-Q188 VanDerWaalsContact C-NE2 3.33Å; D186-Q188 PolarHBondContact O-NE2 2.03Å
189	G	98.3	Very high	96	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	-178.3	178.9	0	0	0	0	0	111.7	N100 L102 A111	N100-G189 PolarHBondContact O-N 3.15Å; L102-G189 WeakPolarHBondContact CB-O 3.46Å; L102-G189 PolarHBondContact N-O 3.48Å; A111-G189 CarbonylContact O-C 3.58Å; A111-G189 WeakPolarHBondContact O-CA 3.24Å
190	I	98.7	Very high	96.1	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.5	-179.1	-169.5	167.8	0	0	0	110.7	I101 L102 D104 F110 A111 Y143 F180	I101-I190 VanDerWaalsContact CG2-C 3.43Å; L102-I190 HydrophobicContact CB-CB 4.45Å; L102-I190 HydrophobicContact CB-CG1 4.32Å; L102-I190 HydrophobicContact CD2-CD1 3.94Å; L102-I190 HydrophobicContact CD2-CG1 4.08Å; L102-I190 HydrophobicContact CG-CG1 4.36Å; L102-I190 CarbonylContact O-C 3.4Å; L102-I190 WeakPolarHBondContact O-CA 3.05Å; D104-I190 HydrophobicContact CB-CD1 3.71Å; D104-I190 HydrophobicContact CB-CG1 3.59Å; D104-I190 WeakPolarHBondContact OD2-CD1 3.45Å; F110-I190 WeakPolarHBondContact CA-O 3.31Å; A111-I190 HydrophobicContact CB-CG2 3.96Å; A111-I190 PolarHBondContact N-O 2.92Å; A111-I190 PolarHBondContact O-N 3.48Å; Y143-I190 HydrophobicContact CE1-CD1 3.95Å; F180-I190 HydrophobicContact CE2-CD1 4.19Å; F180-I190 HydrophobicContact CE2-CG2 4.36Å; F180-I190 HydrophobicContact CZ-CB 3.96Å; F180-I190 HydrophobicContact CZ-CD1 4.44Å; F180-I190 HydrophobicContact CZ-CG2 3.79Å
191	L	98.8	Very high	96.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	89.5	179.2	-172.5	67	0	0	0	108.7	I88 M90 I101 L102 D104 F110 L193 F208 L244	I88-L191 HydrophobicContact CG2-CD2 4.45Å; M90-L191 HydrophobicContact CE-CD1 4.33Å; M90-L191 HydrophobicContact SD-CD1 4.26Å; M90-L191 HydrophobicContact SD-CD2 4.37Å; I101-L191 HydrophobicContact CG2-CB 3.64Å; L102-L191 WeakPolarHBondContact O-CB 3.39Å; L102-L191 PolarHBondContact O-N 2.79Å; D104-L191 PolarHBondContact N-O 2.97Å; F110-L191 HydrophobicContact CD2-CD1 3.55Å; F110-L191 HydrophobicContact CE2-CD1 4.08Å; F110-L191 HydrophobicContact CG-CD1 4.43Å; L191-L193 HydrophobicContact CD2-CD2 3.97Å; L191-L193 HydrophobicContact CD2-CG 4.32Å; L191-L193 HydrophobicContact CG-CD2 3.94Å; L191-L193 HydrophobicContact CG-CG 4.19Å; L191-L193 PolarHBondContact O-N 2.97Å; L191-F208 HydrophobicContact CD1-CB 3.78Å; L191-F208 HydrophobicContact CD1-CD1 3.44Å; L191-F208 VanDerWaalsContact CD1-CD1 3.44Å; L191-F208 HydrophobicContact CD1-CD2 3.84Å; L191-F208 HydrophobicContact CD1-CE1 3.9Å; L191-F208 HydrophobicContact CD1-CE2 4.28Å; L191-F208 HydrophobicContact CD1-CG 3.39Å; L191-F208 HydrophobicContact CD1-CZ 4.3Å; L191-F208 HydrophobicContact CD2-CD1 4.27Å; L191-F208 HydrophobicContact CD2-CE1 4.14Å; L191-F208 HydrophobicContact CG-CD1 4.14Å; L191-F208 HydrophobicContact CG-CE1 4.5Å; L191-L244 HydrophobicContact CD2-CD2 4.42Å
192	G	98.6	Very high	96	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	114.1	172.1	0	0	0	0	0	111.7	D104 S107 N109	D104-G192 CarbonylContact O-C 3.48Å; D104-G192 WeakPolarHBondContact O-CA 3.42Å; S107-G192 VanDerWaalsContact C-CA 3.45Å; S107-G192 CarbonylContact O-C 3.5Å; S107-G192 WeakPolarHBondContact O-CA 3.49Å; N109-G192 PolarHBondContact O-N 2.82Å
193	L	98.8	Very high	96.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.209	C	C	.	.			trans	-104	-1.5	-178.4	-68.8	179.7	0	0	0	114.1	V103 D104 T105 S107 L191 F208 F209 F222 L244 Y269 R416	V103-L193 HydrophobicContact CG1-CD1 3.66Å; D104-L193 PolarHBondContact O-N 2.9Å; T105-L193 HydrophobicContact CG2-CB 4.26Å; T105-L193 HydrophobicContact CG2-CD1 4.35Å; S107-L193 PolarHBondContact O-N 3.28Å; L191-L193 HydrophobicContact CD2-CD2 3.97Å; L191-L193 HydrophobicContact CD2-CG 4.32Å; L191-L193 HydrophobicContact CG-CD2 3.94Å; L191-L193 HydrophobicContact CG-CG 4.19Å; L191-L193 PolarHBondContact O-N 2.97Å; L193-F208 HydrophobicContact CD2-CD1 4.15Å; L193-F209 HydrophobicContact CD2-CB 4.01Å; L193-F209 HydrophobicContact CD2-CD2 4.25Å; L193-F209 HydrophobicContact CD2-CG 4.44Å; L193-F222 HydrophobicContact CB-CE1 4.28Å; L193-F222 HydrophobicContact CB-CE2 4.48Å; L193-F222 HydrophobicContact CB-CZ 3.87Å; L193-F222 HydrophobicContact CD1-CD2 4.3Å; L193-F222 HydrophobicContact CD1-CE2 3.87Å; L193-F222 HydrophobicContact CD1-CZ 4.07Å; L193-L244 HydrophobicContact CD1-CD1 4.39Å; L193-L244 HydrophobicContact CD1-CD2 4.34Å; L193-Y269 PolarHBondContact O-OH 3.12Å; L193-R416 PolarHBondContact O-NH1 3.43Å
194	A	98.6	Very high	96.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-73.6	-170.7	176.4	0	0	0	0	0	112.5	T105 S107 S108 L198 Y269	T105-A194 WeakPolarHBondContact O-CB 2.98Å; S107-A194 WeakPolarHBondContact O-CB 2.99Å; S107-A194 PolarHBondContact O-N 3.34Å; S108-A194 WeakPolarHBondContact OG-CB 3.44Å; S108-A194 PolarHBondContact OG-O 3.36Å; A194-L198 HydrophobicContact CB-CD1 3.98Å; A194-Y269 HydrophobicContact CB-CE2 4.25Å
195	Y	98.4	Very high	96.8	Very high	10 Å²	10	34.1 Å²	34.1	4%	0.039	19%	0.186	C	C	.	.			trans	-86.2	157.3	-171.2	-64.7	-87.8	0	0	0	113.6	S108 M197 L198 I263 E266 W267 Y269 R416	S108-Y195 PolarHBondContact OG-N 2.76Å; S108-Y195 PolarHBondContact OG-O 3.06Å; Y195-M197 PolarHBondContact O-N 3.17Å; Y195-L198 PolarHBondContact O-N 2.85Å; Y195-L198 VanDerWaalsContact O-N 3.09Å; Y195-I263 WeakPolarHBondContact OH-CD1 3.14Å; Y195-E266 WeakPolarHBondContact CB-O 3.39Å; Y195-E266 HydrophobicContact CD1-CB 3.8Å; Y195-E266 HydrophobicContact CD1-CG 4.29Å; Y195-E266 HydrophobicContact CD2-CB 4.15Å; Y195-E266 HydrophobicContact CE1-CB 3.93Å; Y195-E266 HydrophobicContact CE1-CG 3.9Å; Y195-E266 HydrophobicContact CE2-CB 4.27Å; Y195-E266 HydrophobicContact CE2-CG 4.43Å; Y195-E266 HydrophobicContact CG-CB 3.92Å; Y195-W267 WeakPolarHBondContact CB-O 3.18Å; Y195-W267 WeakPolarHBondContact CD2-O 3.47Å; Y195-W267 PolarHBondContact N-O 3.41Å; Y195-W267 VanDerWaalsContact N-O 3.13Å; Y195-Y269 HydrophobicContact CD2-CE1 4.43Å; Y195-Y269 AromaticContact CE2-CD1 3.77Å; Y195-Y269 HydrophobicContact CE2-CD1 3.77Å; Y195-Y269 AromaticContact CE2-CE1 3.54Å; Y195-Y269 HydrophobicContact CE2-CE1 3.54Å; Y195-Y269 AromaticContact CZ-CE1 3.81Å; Y195-R416 HydrophobicContact CE1-CB 4.4Å; Y195-R416 HydrophobicContact CE1-CG 4.21Å
196	P	97.9	Very high	97.1	Very high	37 Å²	37	36.4 Å²	36.4	24%	0.24	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-51.9	-23.7	-177.8	-27.8	33.8	0	0	0	116	L198 A199 S203 P207	P196-L198 PolarHBondContact O-N 2.88Å; P196-A199 VanDerWaalsContact O-CB 3.27Å; P196-A199 WeakPolarHBondContact O-CB 3.39Å; P196-A199 PolarHBondContact O-N 2.94Å; P196-S203 WeakPolarHBondContact O-CA 3.11Å; P196-S203 VanDerWaalsContact O-CB 3.29Å; P196-S203 WeakPolarHBondContact O-CB 3.44Å; P196-P207 HydrophobicContact CB-CG 4.15Å; P196-P207 HydrophobicContact CG-CG 3.93Å
197	M	97.1	Very high	97.4	Very high	117 Å²	117	33.8 Å²	33.8	58%	0.576	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-60.3	-26.6	179.1	-167.1	169	-171.5	0	0	113.8	Y195 W267	Y195-M197 PolarHBondContact O-N 3.17Å; M197-W267 HydrophobicContact CB-CB 3.89Å; M197-W267 HydrophobicContact CG-CB 4.03Å; M197-W267 HydrophobicContact SD-CB 3.68Å
198	L	96.2	Very high	97.5	Very high	31 Å²	31	33.2 Å²	33.2	16%	0.162	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-92.2	-6	176.6	-59.1	178	0	0	0	113.4	A194 Y195 P196 W267 Y268	A194-L198 HydrophobicContact CB-CD1 3.98Å; Y195-L198 PolarHBondContact O-N 2.85Å; Y195-L198 VanDerWaalsContact O-N 3.09Å; P196-L198 PolarHBondContact O-N 2.88Å; L198-W267 VanDerWaalsContact CD1-O 3.29Å; L198-W267 WeakPolarHBondContact CD1-O 3.34Å; L198-W267 HydrophobicContact CD2-CB 4.32Å; L198-W267 HydrophobicContact CD2-CE3 4.15Å; L198-W267 HydrophobicContact CG-CB 4.35Å; L198-Y268 HydrophobicContact CD1-CD1 3.52Å; L198-Y268 HydrophobicContact CD1-CD2 3.95Å; L198-Y268 HydrophobicContact CD1-CE1 3.5Å; L198-Y268 VanDerWaalsContact CD1-CE1 3.5Å; L198-Y268 HydrophobicContact CD1-CE2 3.9Å; L198-Y268 HydrophobicContact CD1-CG 3.74Å; L198-Y268 HydrophobicContact CD2-CD2 4.11Å; L198-Y268 HydrophobicContact CD2-CE1 4.49Å; L198-Y268 HydrophobicContact CD2-CE2 3.58Å; L198-Y268 HydrophobicContact CG-CE2 4.37Å
199	A	97.5	Very high	97.5	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.017	18%	0.179	C	C	.	.			trans	-64.8	141.3	-177.9	0	0	0	0	0	111.1	P196 D202 V205	P196-A199 VanDerWaalsContact O-CB 3.27Å; P196-A199 WeakPolarHBondContact O-CB 3.39Å; P196-A199 PolarHBondContact O-N 2.94Å; A199-D202 CarbonylContact O-C 3.59Å; A199-D202 VanDerWaalsContact O-C 3.3Å; A199-D202 WeakPolarHBondContact O-CA 3.34Å; A199-D202 PolarHBondContact O-N 3.17Å; A199-V205 HydrophobicContact CB-CB 4.36Å; A199-V205 WeakPolarHBondContact CB-O 3.43Å
200	R	97.5	Very high	97.5	Very high	135 Å²	135	34.6 Å²	34.6	51%	0.509	19%	0.188	S	C	.	.	S	Bend	trans	-111	146.6	177.1	-64.7	-57.4	-172.6	174	-2	112.1	N109 V139 V141 D202	N109-R200 PolarHBondContact ND2-O 3.1Å; N109-R200 PolarHBondContact OD1-N 2.69Å; V139-R200 HydrophobicContact CG2-CB 4.01Å; V141-R200 HydrophobicContact CG2-CB 3.8Å; V141-R200 HydrophobicContact CG2-CG 3.86Å; R200-D202 VanDerWaalsContact C-N 3.3Å
201	P	96.4	Very high	97.5	Very high	49 Å²	49	34.4 Å²	34.4	32%	0.318	19%	0.187	S	C	.	.	S	Bend	cis	-70.6	-20.5	1.4	28.7	-35.6	0	0	0	114.1	L152	L152-P201 HydrophobicContact CD1-CG 4.41Å
202	D	95.1	Very high	97.4	Very high	65 Å²	65	34.5 Å²	34.5	35%	0.348	19%	0.187	S	C	.	.			trans	-155.5	173	-179.5	61.4	75	0	0	0	110.7	R137 A199 R200 S204 V205	R137-D202 IonicContact NH2-OD2 3.64Å; R137-D202 PolarHBondContact NH2-OD2 3.09Å; A199-D202 CarbonylContact O-C 3.59Å; A199-D202 VanDerWaalsContact O-C 3.3Å; A199-D202 WeakPolarHBondContact O-CA 3.34Å; A199-D202 PolarHBondContact O-N 3.17Å; R200-D202 VanDerWaalsContact C-N 3.3Å; D202-S204 PolarHBondContact O-N 2.83Å; D202-S204 VanDerWaalsContact O-N 3.07Å; D202-S204 WeakPolarHBondContact OD1-CB 3.44Å; D202-S204 PolarHBondContact OD1-N 2.81Å; D202-S204 PolarHBondContact OD1-OG 2.86Å; D202-V205 PolarHBondContact O-N 2.77Å
203	S	93.6	Very high	97.3	Very high	81 Å²	81	35.6 Å²	35.6	57%	0.566	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-3.3	-175.2	58.3	0	0	0	0	115.4	P196	P196-S203 WeakPolarHBondContact O-CA 3.11Å; P196-S203 VanDerWaalsContact O-CB 3.29Å; P196-S203 WeakPolarHBondContact O-CB 3.44Å
204	S	94.6	Very high	97.2	Very high	83 Å²	83	40.8 Å²	40.8	58%	0.58	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.4	170.6	72.4	0	0	0	0	113	D202 E206	D202-S204 PolarHBondContact O-N 2.83Å; D202-S204 VanDerWaalsContact O-N 3.07Å; D202-S204 WeakPolarHBondContact OD1-CB 3.44Å; D202-S204 PolarHBondContact OD1-N 2.81Å; D202-S204 PolarHBondContact OD1-OG 2.86Å; S204-E206 PolarHBondContact O-N 2.88Å
205	V	97.4	Very high	97.1	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.055	24%	0.242	C	C	.	.	S	Bend	trans	-77.1	101.8	171.9	-178.4	0	0	0	0	108.5	L152 N170 A199 D202 P207	L152-V205 HydrophobicContact CD1-CG2 3.89Å; N170-V205 HydrophobicContact CB-CG1 3.81Å; A199-V205 HydrophobicContact CB-CB 4.36Å; A199-V205 WeakPolarHBondContact CB-O 3.43Å; D202-V205 PolarHBondContact O-N 2.77Å; V205-P207 VanDerWaalsContact O-CD 3.29Å; V205-P207 WeakPolarHBondContact O-CD 3.29Å
206	E	98.2	Very high	97	Very high	65 Å²	65	46.3 Å²	46.3	30%	0.304	25%	0.249	S	C	.	.			trans	-60.7	121.8	178.1	-174.4	177	70.3	0	0	110.4	N170 S204 N210 S211 N214	N170-E206 PolarHBondContact ND2-N 3.09Å; N170-E206 PolarHBondContact ND2-O 3.04Å; S204-E206 PolarHBondContact O-N 2.88Å; E206-N210 HydrophobicContact CG-CB 3.59Å; E206-S211 WeakPolarHBondContact OE1-CA 3.37Å; E206-S211 WeakPolarHBondContact OE1-CB 3.18Å; E206-S211 PolarHBondContact OE1-OG 3.21Å; E206-N214 PolarHBondContact OE2-ND2 3.02Å
207	P	98.6	Very high	96.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	27%	0.269	C	S	.	.			trans	-65	152.7	175.5	-23.3	34.8	0	0	0	112.6	S108 P196 V205 F209 N210 S211	S108-P207 WeakPolarHBondContact O-CB 3.43Å; P196-P207 HydrophobicContact CB-CG 4.15Å; P196-P207 HydrophobicContact CG-CG 3.93Å; V205-P207 VanDerWaalsContact O-CD 3.29Å; V205-P207 WeakPolarHBondContact O-CD 3.29Å; P207-F209 VanDerWaalsContact C-N 3.33Å; P207-F209 PolarHBondContact O-N 3.18Å; P207-N210 WeakPolarHBondContact O-CB 3.41Å; P207-N210 PolarHBondContact O-N 2.93Å; P207-S211 PolarHBondContact O-N 3.3Å
208	F	98.6	Very high	96.5	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-46.9	-51.1	-179	168.4	-93.5	0	0	0	113.8	M90 F110 V157 L159 I167 I169 L191 L193 N210 S211 V212 M246	M90-F208 HydrophobicContact CE-CD2 4.24Å; M90-F208 HydrophobicContact CE-CE2 3.52Å; M90-F208 HydrophobicContact CE-CZ 3.88Å; F110-F208 HydrophobicContact CB-CB 4.31Å; V157-F208 HydrophobicContact CG1-CE2 4.35Å; L159-F208 HydrophobicContact CD1-CE2 4.4Å; L159-F208 HydrophobicContact CD1-CZ 3.86Å; L159-F208 HydrophobicContact CD2-CZ 4.39Å; I167-F208 HydrophobicContact CD1-CD2 4.38Å; I167-F208 HydrophobicContact CD1-CE2 3.76Å; I167-F208 HydrophobicContact CD1-CZ 4.2Å; I169-F208 HydrophobicContact CD1-CD2 3.71Å; I169-F208 HydrophobicContact CD1-CE2 4.26Å; I169-F208 HydrophobicContact CG2-CD2 3.96Å; I169-F208 HydrophobicContact CG2-CE2 4.42Å; L191-F208 HydrophobicContact CD1-CB 3.78Å; L191-F208 HydrophobicContact CD1-CD1 3.44Å; L191-F208 VanDerWaalsContact CD1-CD1 3.44Å; L191-F208 HydrophobicContact CD1-CD2 3.84Å; L191-F208 HydrophobicContact CD1-CE1 3.9Å; L191-F208 HydrophobicContact CD1-CE2 4.28Å; L191-F208 HydrophobicContact CD1-CG 3.39Å; L191-F208 HydrophobicContact CD1-CZ 4.3Å; L191-F208 HydrophobicContact CD2-CD1 4.27Å; L191-F208 HydrophobicContact CD2-CE1 4.14Å; L191-F208 HydrophobicContact CG-CD1 4.14Å; L191-F208 HydrophobicContact CG-CE1 4.5Å; L193-F208 HydrophobicContact CD2-CD1 4.15Å; F208-N210 VanDerWaalsContact C-N 3.26Å; F208-N210 PolarHBondContact O-N 2.5Å; F208-S211 WeakPolarHBondContact O-CB 3.46Å; F208-S211 PolarHBondContact O-N 2.82Å; F208-S211 VanDerWaalsContact O-N 3.09Å; F208-V212 HydrophobicContact CD1-CG2 3.87Å; F208-V212 HydrophobicContact CD2-CG2 4.38Å; F208-V212 HydrophobicContact CE1-CG2 3.39Å; F208-V212 HydrophobicContact CE2-CG2 3.95Å; F208-V212 HydrophobicContact CG-CG2 4.34Å; F208-V212 HydrophobicContact CZ-CG2 3.43Å; F208-V212 VanDerWaalsContact CZ-CG2 3.43Å; F208-V212 WeakPolarHBondContact O-CG2 3.1Å; F208-V212 PolarHBondContact O-N 2.64Å; F208-M246 HydrophobicContact CE1-CE 3.79Å; F208-M246 HydrophobicContact CE1-SD 4.18Å; F208-M246 HydrophobicContact CZ-CE 4.26Å
209	F	98.4	Very high	96.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-27.8	-173.6	-163.7	-100.5	0	0	0	112.5	L193 P207 V212 V213 M221 F222 M246	L193-F209 HydrophobicContact CD2-CB 4.01Å; L193-F209 HydrophobicContact CD2-CD2 4.25Å; L193-F209 HydrophobicContact CD2-CG 4.44Å; P207-F209 VanDerWaalsContact C-N 3.33Å; P207-F209 PolarHBondContact O-N 3.18Å; F209-V212 PolarHBondContact O-N 3.07Å; F209-V213 HydrophobicContact CD1-CG2 3.99Å; F209-V213 HydrophobicContact CE1-CG2 3.64Å; F209-V213 HydrophobicContact CZ-CG2 4.12Å; F209-V213 WeakPolarHBondContact O-CG2 3.27Å; F209-V213 PolarHBondContact O-N 3.39Å; F209-M221 WeakPolarHBondContact CZ-O 3.47Å; F209-F222 HydrophobicContact CD1-CD1 4.08Å; F209-F222 HydrophobicContact CD1-CE1 4.47Å; F209-F222 HydrophobicContact CD2-CD1 4.14Å; F209-F222 AromaticContact CE1-CD1 3.8Å; F209-F222 HydrophobicContact CE1-CD1 3.8Å; F209-F222 HydrophobicContact CE2-CB 3.84Å; F209-F222 AromaticContact CE2-CD1 3.87Å; F209-F222 HydrophobicContact CE2-CD1 3.87Å; F209-F222 HydrophobicContact CE2-CG 4.22Å; F209-F222 HydrophobicContact CG-CD1 4.25Å; F209-F222 HydrophobicContact CZ-CB 3.85Å; F209-F222 AromaticContact CZ-CD1 3.7Å; F209-F222 HydrophobicContact CZ-CD1 3.7Å; F209-F222 HydrophobicContact CZ-CG 4.25Å; F209-M246 HydrophobicContact CE2-CB 4.1Å; F209-M246 HydrophobicContact CE2-CG 4Å; F209-M246 HydrophobicContact CE2-SD 4.36Å
210	N	98.5	Very high	96.5	Very high	35 Å²	35	46.9 Å²	46.9	19%	0.187	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-45.5	171.7	-70	61.3	0	0	0	110.4	E206 P207 F208 V212 V213 N214 R416	E206-N210 HydrophobicContact CG-CB 3.59Å; P207-N210 WeakPolarHBondContact O-CB 3.41Å; P207-N210 PolarHBondContact O-N 2.93Å; F208-N210 VanDerWaalsContact C-N 3.26Å; F208-N210 PolarHBondContact O-N 2.5Å; N210-V212 PolarHBondContact O-N 3.43Å; N210-V213 PolarHBondContact O-N 2.85Å; N210-N214 VanDerWaalsContact O-CB 3.3Å; N210-N214 WeakPolarHBondContact O-CB 3.31Å; N210-N214 PolarHBondContact O-N 3.05Å; N210-N214 PolarHBondContact O-ND2 2.93Å; N210-R416 PolarHBondContact OD1-NH2 3.3Å
211	S	98.3	Very high	96.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-40.3	176.4	-52.7	0	0	0	0	112.2	E206 P207 F208 N214 Q215	E206-S211 WeakPolarHBondContact OE1-CA 3.37Å; E206-S211 WeakPolarHBondContact OE1-CB 3.18Å; E206-S211 PolarHBondContact OE1-OG 3.21Å; P207-S211 PolarHBondContact O-N 3.3Å; F208-S211 WeakPolarHBondContact O-CB 3.46Å; F208-S211 PolarHBondContact O-N 2.82Å; F208-S211 VanDerWaalsContact O-N 3.09Å; S211-N214 PolarHBondContact O-N 2.87Å; S211-Q215 VanDerWaalsContact O-CB 3.26Å; S211-Q215 WeakPolarHBondContact O-CB 3.34Å; S211-Q215 WeakPolarHBondContact O-CG 3.27Å; S211-Q215 PolarHBondContact O-N 2.95Å
212	V	96.9	Very high	96.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-57.6	-53.3	174.7	177	0	0	0	0	110.9	I167 F208 F209 N210 N214 L216 I218 M246	I167-V212 HydrophobicContact CD1-CB 4.25Å; I167-V212 HydrophobicContact CD1-CG2 3.36Å; F208-V212 HydrophobicContact CD1-CG2 3.87Å; F208-V212 HydrophobicContact CD2-CG2 4.38Å; F208-V212 HydrophobicContact CE1-CG2 3.39Å; F208-V212 HydrophobicContact CE2-CG2 3.95Å; F208-V212 HydrophobicContact CG-CG2 4.34Å; F208-V212 HydrophobicContact CZ-CG2 3.43Å; F208-V212 VanDerWaalsContact CZ-CG2 3.43Å; F208-V212 WeakPolarHBondContact O-CG2 3.1Å; F208-V212 PolarHBondContact O-N 2.64Å; F209-V212 PolarHBondContact O-N 3.07Å; N210-V212 PolarHBondContact O-N 3.43Å; V212-N214 VanDerWaalsContact C-N 3.35Å; V212-N214 PolarHBondContact O-N 2.84Å; V212-L216 HydrophobicContact CG1-CD1 4.15Å; V212-L216 VanDerWaalsContact O-CB 3.31Å; V212-L216 WeakPolarHBondContact O-CB 3.49Å; V212-L216 PolarHBondContact O-N 3.03Å; V212-I218 HydrophobicContact CG1-CD1 3.4Å; V212-I218 VanDerWaalsContact CG1-CD1 3.4Å; V212-I218 HydrophobicContact CG1-CG1 4.02Å; V212-M246 HydrophobicContact CG1-SD 4.5Å
213	V	96.8	Very high	96.8	Very high	23 Å²	23	36.3 Å²	36.3	14%	0.139	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-46.1	179.9	169.3	0	0	0	0	110.8	F209 N210 G217 I218 N220	F209-V213 HydrophobicContact CD1-CG2 3.99Å; F209-V213 HydrophobicContact CE1-CG2 3.64Å; F209-V213 HydrophobicContact CZ-CG2 4.12Å; F209-V213 WeakPolarHBondContact O-CG2 3.27Å; F209-V213 PolarHBondContact O-N 3.39Å; N210-V213 PolarHBondContact O-N 2.85Å; V213-G217 VanDerWaalsContact O-CA 3.3Å; V213-G217 WeakPolarHBondContact O-CA 3.13Å; V213-G217 PolarHBondContact O-N 2.83Å; V213-I218 HydrophobicContact CG2-CG1 4.28Å; V213-N220 HydrophobicContact CG1-CB 4.03Å; V213-N220 HydrophobicContact CG2-CB 4.13Å
214	N	97	Very high	97	Very high	109 Å²	109	32.6 Å²	32.6	58%	0.583	20%	0.196	S	C	*	.	H	α-helix	trans	-68.8	-39.2	-176.2	-72.5	-18.6	0	0	0	113.1	E206 N210 S211 V212	E206-N214 PolarHBondContact OE2-ND2 3.02Å; N210-N214 VanDerWaalsContact O-CB 3.3Å; N210-N214 WeakPolarHBondContact O-CB 3.31Å; N210-N214 PolarHBondContact O-N 3.05Å; N210-N214 PolarHBondContact O-ND2 2.93Å; S211-N214 PolarHBondContact O-N 2.87Å; V212-N214 VanDerWaalsContact C-N 3.35Å; V212-N214 PolarHBondContact O-N 2.84Å
215	Q	97.2	Very high	97.2	Very high	92 Å²	92	28.9 Å²	28.9	43%	0.43	17%	0.169	S	C	.	.	H	α-helix	trans	-91.9	-32.7	-173.2	-66.2	176.1	42.4	0	0	113.3	I167 A168 S211	I167-Q215 HydrophobicContact CG2-CB 3.97Å; A168-Q215 PolarHBondContact O-NE2 3.06Å; S211-Q215 VanDerWaalsContact O-CB 3.26Å; S211-Q215 WeakPolarHBondContact O-CB 3.34Å; S211-Q215 WeakPolarHBondContact O-CG 3.27Å; S211-Q215 PolarHBondContact O-N 2.95Å
216	L	94.5	Very high	97.1	Very high	35 Å²	35	28.6 Å²	28.6	18%	0.183	17%	0.167	C	C	.	.	H	α-helix	trans	-98	-9.8	179.4	-56.4	-175.9	0	0	0	113.1	T68 P163 I167 V212 I218	T68-L216 HydrophobicContact CG2-CB 4.35Å; P163-L216 HydrophobicContact CB-CD1 3.68Å; I167-L216 HydrophobicContact CG2-CD1 3.95Å; I167-L216 HydrophobicContact CG2-CD2 3.61Å; I167-L216 HydrophobicContact CG2-CG 3.58Å; V212-L216 HydrophobicContact CG1-CD1 4.15Å; V212-L216 VanDerWaalsContact O-CB 3.31Å; V212-L216 WeakPolarHBondContact O-CB 3.49Å; V212-L216 PolarHBondContact O-N 3.03Å; L216-I218 HydrophobicContact CB-CG2 3.9Å; L216-I218 PolarHBondContact O-N 3.23Å
217	G	93.4	Very high	96.8	Very high	65 Å²	65	26.1 Å²	26.1	67%	0.67	16%	0.157	S	C	*	.			trans	66.5	18.9	179.1	0	0	0	0	0	114.1	V213	V213-G217 VanDerWaalsContact O-CA 3.3Å; V213-G217 WeakPolarHBondContact O-CA 3.13Å; V213-G217 PolarHBondContact O-N 2.83Å
218	I	92.8	Very high	96	Very high	6 Å²	6	27 Å²	27	3%	0.031	17%	0.166	C	C	.	.			trans	-74	155.3	178.6	71.5	169.1	0	0	0	110.7	T68 V69 P163 V212 V213 L216 N220 M246	T68-I218 HydrophobicContact CG2-CG2 4.37Å; V69-I218 HydrophobicContact CG2-CB 4.12Å; V69-I218 HydrophobicContact CG2-CG2 3.32Å; P163-I218 HydrophobicContact CG-CD1 4.13Å; V212-I218 HydrophobicContact CG1-CD1 3.4Å; V212-I218 VanDerWaalsContact CG1-CD1 3.4Å; V212-I218 HydrophobicContact CG1-CG1 4.02Å; V213-I218 HydrophobicContact CG2-CG1 4.28Å; L216-I218 HydrophobicContact CB-CG2 3.9Å; L216-I218 PolarHBondContact O-N 3.23Å; I218-N220 PolarHBondContact O-N 3.04Å; I218-M246 HydrophobicContact CD1-CB 3.93Å
219	P	95.6	Very high	94.4	Very high	76 Å²	76	27.4 Å²	27.4	49%	0.494	17%	0.17	S	C	.	.			trans	-54.8	141.1	174	-25.9	35.3	0	0	0	112.2	M221 G247	P219-M221 PolarHBondContact O-N 2.86Å; P219-G247 WeakPolarHBondContact CB-O 3.5Å; P219-G247 VanDerWaalsContact CG-O 3.3Å; P219-G247 WeakPolarHBondContact CG-O 3.06Å
220	N	97.6	Very high	92.2	Very high	52 Å²	52	29.3 Å²	29.3	28%	0.278	19%	0.19	S	C	.	.	S	Bend	trans	-76.4	65.7	178.5	-171.2	15.3	0	0	0	111.3	V213 I218 R416 S417	V213-N220 HydrophobicContact CG1-CB 4.03Å; V213-N220 HydrophobicContact CG2-CB 4.13Å; I218-N220 PolarHBondContact O-N 3.04Å; N220-R416 WeakPolarHBondContact O-CB 3.42Å; N220-R416 PolarHBondContact O-N 2.99Å; N220-R416 WeakPolarHBondContact OD1-CB 3.35Å; N220-R416 WeakPolarHBondContact OD1-CD 3.47Å; N220-R416 PolarHBondContact OD1-NE 2.9Å; N220-S417 PolarHBondContact O-N 2.89Å
221	M	97.4	Very high	90	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.133	20%	0.199	C	C	.	.			trans	-153	143.9	-179.8	167.5	-175.4	-79.8	0	0	108.7	F209 P219 G247 G248 V413 F414 D415	F209-M221 WeakPolarHBondContact CZ-O 3.47Å; P219-M221 PolarHBondContact O-N 2.86Å; M221-G247 CarbonylContact O-C 3.55Å; M221-G247 VanDerWaalsContact O-CA 3.24Å; M221-G247 WeakPolarHBondContact O-CA 3.27Å; M221-G247 PolarHBondContact O-N 3.01Å; M221-G248 PolarHBondContact O-N 3.3Å; M221-V413 HydrophobicContact CE-CG1 3.68Å; M221-V413 HydrophobicContact CG-CG1 4.11Å; M221-V413 HydrophobicContact SD-CG1 3.78Å; M221-F414 VanDerWaalsContact CA-O 3.31Å; M221-F414 WeakPolarHBondContact CA-O 3.13Å; M221-D415 HydrophobicContact CE-CB 3.38Å; M221-D415 WeakPolarHBondContact CE-OD2 3.15Å
222	F	98.7	Very high	87.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	169	162.4	63.7	-88.4	0	0	0	110	T105 L193 F209 L224 L244 I245 Y269 F414	T105-F222 HydrophobicContact CG2-CE2 3.98Å; T105-F222 HydrophobicContact CG2-CZ 4.11Å; L193-F222 HydrophobicContact CB-CE1 4.28Å; L193-F222 HydrophobicContact CB-CE2 4.48Å; L193-F222 HydrophobicContact CB-CZ 3.87Å; L193-F222 HydrophobicContact CD1-CD2 4.3Å; L193-F222 HydrophobicContact CD1-CE2 3.87Å; L193-F222 HydrophobicContact CD1-CZ 4.07Å; F209-F222 HydrophobicContact CD1-CD1 4.08Å; F209-F222 HydrophobicContact CD1-CE1 4.47Å; F209-F222 HydrophobicContact CD2-CD1 4.14Å; F209-F222 AromaticContact CE1-CD1 3.8Å; F209-F222 HydrophobicContact CE1-CD1 3.8Å; F209-F222 HydrophobicContact CE2-CB 3.84Å; F209-F222 AromaticContact CE2-CD1 3.87Å; F209-F222 HydrophobicContact CE2-CD1 3.87Å; F209-F222 HydrophobicContact CE2-CG 4.22Å; F209-F222 HydrophobicContact CG-CD1 4.25Å; F209-F222 HydrophobicContact CZ-CB 3.85Å; F209-F222 AromaticContact CZ-CD1 3.7Å; F209-F222 HydrophobicContact CZ-CD1 3.7Å; F209-F222 HydrophobicContact CZ-CG 4.25Å; F222-L224 HydrophobicContact CD2-CG 4.45Å; F222-L224 HydrophobicContact CE2-CD1 4.35Å; F222-L224 HydrophobicContact CE2-CG 4.47Å; F222-L244 HydrophobicContact CB-CD1 4.16Å; F222-L244 HydrophobicContact CD2-CD1 3.8Å; F222-L244 HydrophobicContact CG-CD1 4.3Å; F222-I245 CarbonylContact C-O 3.54Å; F222-I245 WeakPolarHBondContact CA-O 3.4Å; F222-I245 VanDerWaalsContact CB-O 3.25Å; F222-I245 WeakPolarHBondContact CB-O 3.25Å; F222-Y269 VanDerWaalsContact CE1-OH 3.24Å; F222-Y269 WeakPolarHBondContact CE1-OH 3.35Å; F222-Y269 HydrophobicContact CZ-CE2 4.07Å; F222-Y269 AromaticContact CZ-CZ 3.85Å; F222-Y269 WeakPolarHBondContact CZ-OH 3.42Å; F222-F414 HydrophobicContact CD1-CB 4.03Å; F222-F414 HydrophobicContact CD2-CB 4Å; F222-F414 AromaticContact CD2-CD2 3.76Å; F222-F414 HydrophobicContact CD2-CD2 3.76Å; F222-F414 HydrophobicContact CD2-CG 4.03Å; F222-F414 HydrophobicContact CE1-CB 3.7Å; F222-F414 HydrophobicContact CE1-CG 4.18Å; F222-F414 HydrophobicContact CE2-CB 3.66Å; F222-F414 AromaticContact CE2-CD1 3.96Å; F222-F414 HydrophobicContact CE2-CD1 3.96Å; F222-F414 AromaticContact CE2-CD2 3.28Å; F222-F414 HydrophobicContact CE2-CD2 3.28Å; F222-F414 HydrophobicContact CE2-CE1 4.48Å; F222-F414 AromaticContact CE2-CE2 3.88Å; F222-F414 HydrophobicContact CE2-CE2 3.88Å; F222-F414 AromaticContact CE2-CG 3.35Å; F222-F414 HydrophobicContact CE2-CG 3.35Å; F222-F414 HydrophobicContact CE2-CZ 4.44Å; F222-F414 HydrophobicContact CG-CB 4.18Å; F222-F414 HydrophobicContact CZ-CB 3.49Å; F222-F414 VanDerWaalsContact CZ-CB 3.49Å; F222-F414 AromaticContact CZ-CD1 3.74Å; F222-F414 HydrophobicContact CZ-CD1 3.74Å; F222-F414 AromaticContact CZ-CD2 3.9Å; F222-F414 HydrophobicContact CZ-CD2 3.9Å; F222-F414 HydrophobicContact CZ-CE1 4.47Å; F222-F414 AromaticContact CZ-CG 3.43Å; F222-F414 HydrophobicContact CZ-CG 3.43Å; F222-F414 VanDerWaalsContact CZ-CG 3.43Å; F222-F414 PolarHBondContact N-O 2.83Å; F222-F414 WeakPolarHBondContact O-CA 3.31Å; F222-F414 WeakPolarHBondContact O-CB 3.06Å; F222-F414 PolarHBondContact O-N 2.84Å
223	S	98.8	Very high	84.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	151.3	176.9	52.6	0	0	0	0	111.7	L244 I245 G248 Y411 V412	S223-L244 WeakPolarHBondContact O-CA 3.41Å; S223-I245 PolarHBondContact N-O 2.54Å; S223-I245 PolarHBondContact O-N 3.48Å; S223-I245 WeakPolarHBondContact OG-CB 3.22Å; S223-G248 PolarHBondContact OG-O 2.83Å; S223-Y411 VanDerWaalsContact CB-OH 3.28Å; S223-Y411 WeakPolarHBondContact CB-OH 3.32Å; S223-Y411 PolarHBondContact OG-OH 2.9Å; S223-V412 CarbonylContact C-O 3.42Å; S223-V412 WeakPolarHBondContact CA-O 3.2Å; S223-V412 WeakPolarHBondContact CB-O 3.22Å
224	L	98.6	Very high	81.7	Confident	3 Å²	3	45 Å²	45	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.7	-174.3	-74.2	175.6	0	0	0	110.6	L78 V103 T105 F222 S243 L244 M407 Y411 V412 F414	L78-L224 HydrophobicContact CD1-CD2 4.13Å; V103-L224 HydrophobicContact CG1-CD1 4.29Å; V103-L224 HydrophobicContact CG1-CD2 4.07Å; T105-L224 HydrophobicContact CG2-CD1 3.8Å; F222-L224 HydrophobicContact CD2-CG 4.45Å; F222-L224 HydrophobicContact CE2-CD1 4.35Å; F222-L224 HydrophobicContact CE2-CG 4.47Å; L224-S243 WeakPolarHBondContact CA-O 3.46Å; L224-L244 HydrophobicContact CD2-CB 3.78Å; L224-L244 HydrophobicContact CD2-CD1 3.6Å; L224-L244 HydrophobicContact CD2-CG 4.17Å; L224-L244 HydrophobicContact CG-CD1 4.24Å; L224-M407 HydrophobicContact CD1-CE 3.96Å; L224-Y411 VanDerWaalsContact O-CD2 3.3Å; L224-Y411 WeakPolarHBondContact O-CD2 3.4Å; L224-V412 PolarHBondContact N-O 2.86Å; L224-V412 PolarHBondContact O-N 2.79Å; L224-F414 HydrophobicContact CB-CE2 4.26Å; L224-F414 HydrophobicContact CD1-CE2 3.8Å; L224-F414 HydrophobicContact CD1-CZ 4.25Å; L224-F414 HydrophobicContact CG-CE2 4.15Å
225	Q	97.9	Very high	78.8	Confident	5 Å²	5	45.7 Å²	45.7	2%	0.023	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.4	164.6	-167.3	-165.6	35.5	0	0	107.8	G242 S243 L253 Y411 S426 S427	Q225-G242 CarbonylContact O-C 3.56Å; Q225-G242 WeakPolarHBondContact O-CA 3.42Å; Q225-S243 PolarHBondContact N-O 3.28Å; Q225-S243 PolarHBondContact O-N 3.37Å; Q225-L253 HydrophobicContact CB-CB 4.48Å; Q225-L253 HydrophobicContact CB-CD1 4.22Å; Q225-L253 HydrophobicContact CG-CB 4.45Å; Q225-L253 PolarHBondContact NE2-O 2.87Å; Q225-Y411 HydrophobicContact CB-CD2 3.84Å; Q225-Y411 HydrophobicContact CB-CE2 4.21Å; Q225-Y411 HydrophobicContact CG-CD2 4.38Å; Q225-S426 WeakPolarHBondContact CG-OG 3.46Å; Q225-S426 PolarHBondContact NE2-OG 2.59Å; Q225-S427 PolarHBondContact NE2-OG 3.42Å; Q225-S427 VanDerWaalsContact NE2-OG 3.08Å
226	M	96.4	Very high	76.1	Confident	3 Å²	3	44 Å²	44	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122	-179.6	-65.2	163.8	83.5	0	0	108	Y86 A404 M407 E408	Y86-M226 HydrophobicContact CD1-CB 4.49Å; Y86-M226 HydrophobicContact CD1-CG 4.39Å; Y86-M226 HydrophobicContact CD2-CB 4.45Å; Y86-M226 HydrophobicContact CD2-CE 3.14Å; Y86-M226 HydrophobicContact CD2-CG 4.16Å; Y86-M226 HydrophobicContact CD2-SD 4.48Å; Y86-M226 HydrophobicContact CE1-CB 4.01Å; Y86-M226 HydrophobicContact CE1-CG 4.39Å; Y86-M226 HydrophobicContact CE2-CB 3.94Å; Y86-M226 HydrophobicContact CE2-CE 3.34Å; Y86-M226 HydrophobicContact CE2-CG 4.14Å; Y86-M226 HydrophobicContact CG-CE 3.97Å; Y86-M226 HydrophobicContact CG-CG 4.25Å; M226-A404 HydrophobicContact CE-CB 3.46Å; M226-A404 VanDerWaalsContact CE-CB 3.46Å; M226-M407 HydrophobicContact SD-CB 3.56Å; M226-M407 VanDerWaalsContact SD-CB 3.56Å; M226-M407 HydrophobicContact SD-CE 3.85Å; M226-M407 HydrophobicContact SD-CG 4.48Å; M226-M407 HydrophobicContact SD-SD 4.21Å; M226-E408 HydrophobicContact CB-CG 3.93Å; M226-E408 WeakPolarHBondContact O-CA 3.33Å
227	C	91.7	Very high	73.5	Confident	12 Å²	12	47.9 Å²	47.9	8%	0.081	33%	0.325	C	S	.	.			trans	-119.4	22.2	-164.6	-56.5	0	0	0	0	114.1	Y86 A229 L231 A241 C428	Y86-C227 PolarHBondContact OH-N 2.96Å; C227-A229 VanDerWaalsContact C-N 3.32Å; C227-L231 WeakPolarHBondContact O-CD1 3.46Å; C227-L231 VanDerWaalsContact O-CG 3.29Å; C227-L231 WeakPolarHBondContact O-CG 3.18Å; C227-A241 WeakPolarHBondContact CA-O 3.43Å; C227-A241 WeakPolarHBondContact CB-O 3.28Å; C227-A241 PolarHBondContact N-O 3.28Å; C227-C428 WeakPolarHBondContact CA-SG 3.41Å; C227-C428 HydrophobicContact CB-CB 3.67Å; C227-C428 WeakPolarHBondContact CB-SG 3.37Å; C227-C428 WeakPolarHBondContact SG-CB 3.29Å; C227-C428 CovalentContact SG-SG 2.03Å; C227-C428 PolarHBondContact SG-SG 2.94Å
228	G	79.9	Confident	71.7	Confident	20 Å²	20	48.4 Å²	48.4	21%	0.206	31%	0.312	C	S	.	.			trans	-72.3	-24.2	-179.5	0	0	0	0	0	113.7	Y86 G230	Y86-G228 WeakPolarHBondContact OH-CA 3.44Å; Y86-G228 PolarHBondContact OH-N 2.8Å; G228-G230 PolarHBondContact O-N 3.16Å
229	A	66.9	Low	70.1	Confident	11 Å²	11	49.7 Å²	49.7	9%	0.091	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	119.5	174.7	0	0	0	0	0	110.9	C227 L374 E408 L436	C227-A229 VanDerWaalsContact C-N 3.32Å; A229-L374 HydrophobicContact CB-CD2 3.38Å; A229-E408 HydrophobicContact CB-CB 4.02Å; A229-L436 HydrophobicContact CB-CD1 3.67Å
230	G	51.6	Low	68.5	Low	40 Å²	40	49.5 Å²	49.5	41%	0.412	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-0.4	179.9	0	0	0	0	0	115.4	G228 S232	G228-G230 PolarHBondContact O-N 3.16Å; G230-S232 PolarHBondContact O-N 2.73Å; G230-S232 VanDerWaalsContact O-N 3.11Å
231	L	51.7	Low	68	Low	73 Å²	73	47 Å²	47	38%	0.382	31%	0.307	S	S	.	.			trans	-84.4	42.5	175	-66	177.4	0	0	0	113.1	C227 D233 P239	C227-L231 WeakPolarHBondContact O-CD1 3.46Å; C227-L231 VanDerWaalsContact O-CG 3.29Å; C227-L231 WeakPolarHBondContact O-CG 3.18Å; L231-D233 PolarHBondContact O-N 3.44Å; L231-P239 HydrophobicContact CD1-CG 4.2Å
232	S	42.5	Very low	67.9	Low	113 Å²	113	45.8 Å²	45.8	79%	0.79	30%	0.301	S	S	*	.	S	Bend	trans	-77.9	-4.7	173.9	53.3	0	0	0	0	113.8	G230	G230-S232 PolarHBondContact O-N 2.73Å; G230-S232 VanDerWaalsContact O-N 3.11Å
233	D	37.8	Very low	67.8	Low	152 Å²	152	45.8 Å²	45.8	81%	0.813	30%	0.301	S	S	*	.	S	Bend	trans	-134.9	10.3	-168.4	-142.2	14.7	0	0	0	115.7	L231 S235	L231-D233 PolarHBondContact O-N 3.44Å; D233-S235 PolarHBondContact O-N 2.82Å
234	S	37.7	Very low	67.8	Low	50 Å²	50	45.8 Å²	45.8	35%	0.35	30%	0.301	S	S	.	.			trans	-88.9	106.8	173.8	62.1	0	0	0	0	110.8	A236 P239	S234-A236 PolarHBondContact O-N 2.74Å; S234-P239 WeakPolarHBondContact OG-CG 3.03Å
235	S	35.7	Very low	67.8	Low	125 Å²	125	45.7 Å²	45.7	87%	0.874	30%	0.3	S	S	*	.			trans	-64.4	13.8	168.6	41.1	0	0	0	0	114.6	D233	D233-S235 PolarHBondContact O-N 2.82Å
236	A	40	Very low	67.8	Low	55 Å²	55	45.5 Å²	45.5	46%	0.455	30%	0.299	S	S	.	.	S	Bend	trans	-85.7	131.9	175.5	0	0	0	0	0	110.3	S234 N238 P239	S234-A236 PolarHBondContact O-N 2.74Å; A236-N238 PolarHBondContact O-N 3.01Å; A236-N238 VanDerWaalsContact O-N 3.12Å; A236-P239 HydrophobicContact CB-CB 4.21Å; A236-P239 WeakPolarHBondContact O-CD 3.49Å
237	V	41.1	Very low	67.7	Low	118 Å²	118	45.7 Å²	45.7	72%	0.715	30%	0.302	S	S	*	.	S	Bend	trans	-68.2	107.4	163.2	-179.5	0	0	0	0	106.5
238	N	54.4	Low	67.8	Low	75 Å²	75	45.4 Å²	45.4	40%	0.401	30%	0.302	S	S	.	.	S	Bend	trans	61.8	66.5	179.4	-53.6	-28	0	0	0	114.7	A236	A236-N238 PolarHBondContact O-N 3.01Å; A236-N238 VanDerWaalsContact O-N 3.12Å
239	P	59.7	Low	68.4	Low	33 Å²	33	45.7 Å²	45.7	21%	0.214	30%	0.302	C	S	.	.			trans	-58	148	169.5	30.5	-37.8	0	0	0	109.9	L231 S234 A236 A241	L231-P239 HydrophobicContact CD1-CG 4.2Å; S234-P239 WeakPolarHBondContact OG-CG 3.03Å; A236-P239 HydrophobicContact CB-CB 4.21Å; A236-P239 WeakPolarHBondContact O-CD 3.49Å; P239-A241 PolarHBondContact O-N 2.92Å
240	P	62.9	Low	69.7	Low	72 Å²	72	45.5 Å²	45.5	47%	0.468	30%	0.299	S	S	.	.			trans	-52.3	127.1	168.1	-21.8	31.2	0	0	0	110	N76	N76-P240 HydrophobicContact CB-CB 3.59Å; N76-P240 HydrophobicContact CB-CG 4.22Å
241	A	86.6	Confident	71.7	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	29%	0.291	C	S	.	.			trans	-106.5	-0.7	-169.5	0	0	0	0	0	112.4	L78 G80 Y86 C227 P239	L78-A241 PolarHBondContact O-N 2.79Å; G80-A241 WeakPolarHBondContact O-CB 3.25Å; Y86-A241 HydrophobicContact CD1-CB 4.04Å; Y86-A241 HydrophobicContact CE1-CB 3.76Å; Y86-A241 WeakPolarHBondContact CE1-O 3.35Å; C227-A241 WeakPolarHBondContact CA-O 3.43Å; C227-A241 WeakPolarHBondContact CB-O 3.28Å; C227-A241 PolarHBondContact N-O 3.28Å; P239-A241 PolarHBondContact O-N 2.92Å
242	G	94.8	Very high	73.7	Confident	0 Å²	0	46 Å²	46	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-169.6	179.8	0	0	0	0	0	113.8	N76 N77 L78 Q225	N76-G242 CarbonylContact C-O 3.53Å; N76-G242 WeakPolarHBondContact CA-O 3.46Å; N77-G242 PolarHBondContact N-O 3.32Å; L78-G242 WeakPolarHBondContact CB-O 3.41Å; L78-G242 PolarHBondContact N-O 2.77Å; Q225-G242 CarbonylContact O-C 3.56Å; Q225-G242 WeakPolarHBondContact O-CA 3.42Å
243	S	97.8	Very high	76.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	134.1	-176.7	-49.4	0	0	0	0	111	N76 N77 L224 Q225	N76-S243 PolarHBondContact N-OG 2.89Å; N77-S243 WeakPolarHBondContact OD1-CA 3.3Å; L224-S243 WeakPolarHBondContact CA-O 3.46Å; Q225-S243 PolarHBondContact N-O 3.28Å; Q225-S243 PolarHBondContact O-N 3.37Å
244	L	98.4	Very high	78.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	105.8	163.4	168.8	56.8	0	0	0	108.1	N77 L78 I88 V103 L191 L193 F222 S223 L224 M246	N77-L244 PolarHBondContact ND2-O 2.74Å; N77-L244 PolarHBondContact OD1-N 3.42Å; L78-L244 HydrophobicContact CD1-CB 4.22Å; L78-L244 HydrophobicContact CD2-CB 3.88Å; L78-L244 HydrophobicContact CG-CB 4.23Å; I88-L244 HydrophobicContact CD1-CD2 4.38Å; V103-L244 HydrophobicContact CG1-CD2 4.23Å; V103-L244 HydrophobicContact CG2-CD2 4.09Å; L191-L244 HydrophobicContact CD2-CD2 4.42Å; L193-L244 HydrophobicContact CD1-CD1 4.39Å; L193-L244 HydrophobicContact CD1-CD2 4.34Å; F222-L244 HydrophobicContact CB-CD1 4.16Å; F222-L244 HydrophobicContact CD2-CD1 3.8Å; F222-L244 HydrophobicContact CG-CD1 4.3Å; S223-L244 WeakPolarHBondContact O-CA 3.41Å; L224-L244 HydrophobicContact CD2-CB 3.78Å; L224-L244 HydrophobicContact CD2-CD1 3.6Å; L224-L244 HydrophobicContact CD2-CG 4.17Å; L224-L244 HydrophobicContact CG-CD1 4.24Å; L244-M246 HydrophobicContact CD1-CG 4.42Å; L244-M246 HydrophobicContact CD2-CE 3.5Å; L244-M246 HydrophobicContact CG-CE 3.97Å; L244-M246 HydrophobicContact CG-CG 4.27Å
245	I	97.9	Very high	81.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.8	177.9	-48.6	-57.3	0	0	0	108	F71 M74 F222 S223 E250 L253	F71-I245 HydrophobicContact CB-CG2 4.28Å; F71-I245 HydrophobicContact CD1-CG2 3.51Å; F71-I245 HydrophobicContact CD2-CG2 4.34Å; F71-I245 HydrophobicContact CE1-CG2 3.83Å; F71-I245 HydrophobicContact CG-CG2 3.81Å; F71-I245 HydrophobicContact CZ-CG2 4.43Å; M74-I245 HydrophobicContact CB-CD1 3.56Å; M74-I245 HydrophobicContact CE-CG2 4.13Å; F222-I245 CarbonylContact C-O 3.54Å; F222-I245 WeakPolarHBondContact CA-O 3.4Å; F222-I245 VanDerWaalsContact CB-O 3.25Å; F222-I245 WeakPolarHBondContact CB-O 3.25Å; S223-I245 PolarHBondContact N-O 2.54Å; S223-I245 PolarHBondContact O-N 3.48Å; S223-I245 WeakPolarHBondContact OG-CB 3.22Å; I245-E250 HydrophobicContact CD1-CB 4.33Å; I245-E250 HydrophobicContact CG1-CB 4.06Å; I245-L253 HydrophobicContact CD1-CD1 4.05Å; I245-L253 HydrophobicContact CG1-CD1 3.89Å
246	M	97.4	Very high	84.4	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.3	176.1	-61.6	-175.6	-172.1	0	0	110.1	M74 L159 P163 F208 F209 V212 I218 L244	M74-M246 WeakPolarHBondContact CE-O 3.4Å; M74-M246 HydrophobicContact SD-CB 4.17Å; M74-M246 PolarHBondContact SD-N 2.72Å; M74-M246 VanDerWaalsContact SD-N 3.42Å; L159-M246 HydrophobicContact CD2-CE 3.62Å; L159-M246 HydrophobicContact CD2-SD 4.29Å; P163-M246 HydrophobicContact CG-CB 3.67Å; P163-M246 HydrophobicContact CG-CG 4.44Å; P163-M246 HydrophobicContact CG-SD 4.15Å; F208-M246 HydrophobicContact CE1-CE 3.79Å; F208-M246 HydrophobicContact CE1-SD 4.18Å; F208-M246 HydrophobicContact CZ-CE 4.26Å; F209-M246 HydrophobicContact CE2-CB 4.1Å; F209-M246 HydrophobicContact CE2-CG 4Å; F209-M246 HydrophobicContact CE2-SD 4.36Å; V212-M246 HydrophobicContact CG1-SD 4.5Å; I218-M246 HydrophobicContact CD1-CB 3.93Å; L244-M246 HydrophobicContact CD1-CG 4.42Å; L244-M246 HydrophobicContact CD2-CE 3.5Å; L244-M246 HydrophobicContact CG-CE 3.97Å; L244-M246 HydrophobicContact CG-CG 4.27Å
247	G	95.4	Very high	87	Confident	7 Å²	7	38.1 Å²	38.1	7%	0.072	24%	0.236	C	C	.	.	S	Bend	trans	96.9	0.8	-179.8	0	0	0	0	0	114.9	P219 M221	P219-G247 WeakPolarHBondContact CB-O 3.5Å; P219-G247 VanDerWaalsContact CG-O 3.3Å; P219-G247 WeakPolarHBondContact CG-O 3.06Å; M221-G247 CarbonylContact O-C 3.55Å; M221-G247 VanDerWaalsContact O-CA 3.24Å; M221-G247 WeakPolarHBondContact O-CA 3.27Å; M221-G247 PolarHBondContact O-N 3.01Å
248	G	93.8	Very high	89.7	Confident	7 Å²	7	34.1 Å²	34.1	7%	0.072	21%	0.21	C	C	.	.	S	Bend	trans	172.9	-155	178.9	0	0	0	0	0	115.7	M221 S223	M221-G248 PolarHBondContact O-N 3.3Å; S223-G248 PolarHBondContact OG-O 2.83Å
249	A	93.2	Very high	91.8	Very high	26 Å²	26	33.7 Å²	33.7	22%	0.215	20%	0.203	C	C	.	.			trans	-132.9	131.9	178.9	0	0	0	0	0	110	P251 Y411 V413	A249-P251 WeakPolarHBondContact O-CD 3.29Å; A249-Y411 VanDerWaalsContact CA-OH 3.25Å; A249-Y411 WeakPolarHBondContact CA-OH 3.49Å; A249-Y411 HydrophobicContact CB-CE1 4.03Å; A249-V413 HydrophobicContact CB-CG1 4.44Å; A249-V413 HydrophobicContact CB-CG2 4.04Å
250	E	94.3	Very high	93.7	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.028	20%	0.203	C	C	.	.			trans	-97.8	113	-175.9	174.2	44.5	-125.1	0	0	110.3	F71 V75 I245 T252 L253 Y254 Y411	F71-E250 HydrophobicContact CB-CB 4.42Å; F71-E250 WeakPolarHBondContact CB-OE2 3.22Å; V75-E250 HydrophobicContact CG2-CG 4.18Å; I245-E250 HydrophobicContact CD1-CB 4.33Å; I245-E250 HydrophobicContact CG1-CB 4.06Å; E250-T252 WeakPolarHBondContact CG-OG1 3.07Å; E250-T252 PolarHBondContact O-N 2.76Å; E250-T252 VanDerWaalsContact O-N 3.14Å; E250-T252 WeakPolarHBondContact OE1-CB 3.3Å; E250-T252 WeakPolarHBondContact OE1-CG2 3.46Å; E250-T252 PolarHBondContact OE1-N 2.89Å; E250-T252 VanDerWaalsContact OE1-N 3.08Å; E250-T252 PolarHBondContact OE1-OG1 3.46Å; E250-L253 HydrophobicContact CB-CD1 4Å; E250-L253 HydrophobicContact CB-CG 3.97Å; E250-L253 HydrophobicContact CG-CD1 4.25Å; E250-L253 HydrophobicContact CG-CD2 4.49Å; E250-L253 HydrophobicContact CG-CG 3.84Å; E250-L253 PolarHBondContact O-N 2.79Å; E250-L253 VanDerWaalsContact O-N 3.1Å; E250-Y254 WeakPolarHBondContact O-CD1 3.4Å; E250-Y411 PolarHBondContact N-OH 3.43Å
251	P	91.8	Very high	95.4	Very high	36 Å²	36	31.3 Å²	31.3	23%	0.234	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-56.4	-28.6	-175.3	-27.8	36.4	0	0	0	115.4	L59 A249 L253 Y254	L59-P251 HydrophobicContact CB-CB 4.37Å; L59-P251 HydrophobicContact CB-CG 3.91Å; L59-P251 HydrophobicContact CD1-CB 4.46Å; L59-P251 HydrophobicContact CD1-CG 4.3Å; A249-P251 WeakPolarHBondContact O-CD 3.29Å; P251-L253 PolarHBondContact O-N 2.9Å; P251-Y254 VanDerWaalsContact CA-CE1 3.48Å
252	T	94	Very high	95.9	Very high	87 Å²	87	33.1 Å²	33.1	53%	0.534	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-71.8	-14.3	-179.7	57.8	0	0	0	0	113.9	E250 S427	E250-T252 WeakPolarHBondContact CG-OG1 3.07Å; E250-T252 PolarHBondContact O-N 2.76Å; E250-T252 VanDerWaalsContact O-N 3.14Å; E250-T252 WeakPolarHBondContact OE1-CB 3.3Å; E250-T252 WeakPolarHBondContact OE1-CG2 3.46Å; E250-T252 PolarHBondContact OE1-N 2.89Å; E250-T252 VanDerWaalsContact OE1-N 3.08Å; E250-T252 PolarHBondContact OE1-OG1 3.46Å; T252-S427 PolarHBondContact O-OG 2.79Å
253	L	95.3	Very high	96	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.037	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-89.9	-6.7	-176.3	-56	-171.1	0	0	0	114.2	V75 Q225 I245 E250 P251 Y411 S427	V75-L253 HydrophobicContact CG1-CD2 4.17Å; V75-L253 HydrophobicContact CG2-CD2 4.24Å; Q225-L253 HydrophobicContact CB-CB 4.48Å; Q225-L253 HydrophobicContact CB-CD1 4.22Å; Q225-L253 HydrophobicContact CG-CB 4.45Å; Q225-L253 PolarHBondContact NE2-O 2.87Å; I245-L253 HydrophobicContact CD1-CD1 4.05Å; I245-L253 HydrophobicContact CG1-CD1 3.89Å; E250-L253 HydrophobicContact CB-CD1 4Å; E250-L253 HydrophobicContact CB-CG 3.97Å; E250-L253 HydrophobicContact CG-CD1 4.25Å; E250-L253 HydrophobicContact CG-CD2 4.49Å; E250-L253 HydrophobicContact CG-CG 3.84Å; E250-L253 PolarHBondContact O-N 2.79Å; E250-L253 VanDerWaalsContact O-N 3.1Å; P251-L253 PolarHBondContact O-N 2.9Å; L253-Y411 HydrophobicContact CB-CD2 3.98Å; L253-Y411 HydrophobicContact CB-CE2 3.82Å; L253-Y411 HydrophobicContact CD1-CE2 3.88Å; L253-Y411 HydrophobicContact CG-CE2 4.48Å; L253-S427 VanDerWaalsContact C-OG 3.25Å; L253-S427 WeakPolarHBondContact CA-OG 3.36Å; L253-S427 PolarHBondContact O-N 3.19Å; L253-S427 PolarHBondContact O-OG 2.89Å; L253-S427 VanDerWaalsContact O-OG 3.12Å
254	Y	95.5	Very high	95.9	Very high	40 Å²	40	36.7 Å²	36.7	16%	0.157	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	167.1	-178.9	68.5	-89.2	0	0	0	113.3	E250 P251 I258 Y411 A424 L425	E250-Y254 WeakPolarHBondContact O-CD1 3.4Å; P251-Y254 VanDerWaalsContact CA-CE1 3.48Å; Y254-I258 HydrophobicContact CD2-CG1 4.21Å; Y254-I258 HydrophobicContact CE1-CD1 4.09Å; Y254-I258 HydrophobicContact CE2-CD1 4.08Å; Y254-I258 HydrophobicContact CE2-CG1 3.78Å; Y254-Y411 AromaticContact CD1-CD1 3.29Å; Y254-Y411 HydrophobicContact CD1-CD1 3.29Å; Y254-Y411 AromaticContact CD1-CE1 3.39Å; Y254-Y411 HydrophobicContact CD1-CE1 3.39Å; Y254-Y411 HydrophobicContact CD1-CG 4.18Å; Y254-Y411 HydrophobicContact CE1-CD1 4.11Å; Y254-Y411 AromaticContact CE1-CE1 3.85Å; Y254-Y411 HydrophobicContact CE1-CE1 3.85Å; Y254-Y411 AromaticContact CG-CD1 3.74Å; Y254-Y411 HydrophobicContact CG-CD1 3.74Å; Y254-Y411 HydrophobicContact CG-CE1 4.29Å; Y254-Y411 HydrophobicContact CG-CG 4.41Å; Y254-A424 HydrophobicContact CD2-CB 3.72Å; Y254-A424 HydrophobicContact CG-CB 3.97Å; Y254-L425 CarbonylContact C-O 3.6Å; Y254-L425 WeakPolarHBondContact CA-O 3.48Å; Y254-L425 WeakPolarHBondContact CB-O 3.44Å
255	R	93.9	Very high	95.7	Very high	130 Å²	130	41 Å²	41	49%	0.491	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.8	176.2	-59.7	-179.8	-173.7	169.1	5.6	110.2	L425	R255-L425 HydrophobicContact CB-CB 4.47Å; R255-L425 PolarHBondContact N-O 3.33Å
256	G	93.7	Very high	95.7	Very high	67 Å²	67	44.6 Å²	44.6	69%	0.691	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	73	-156.5	179.4	0	0	0	0	0	113
257	S	94.8	Very high	95.6	Very high	86 Å²	86	47.5 Å²	47.5	60%	0.601	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	148.5	-178.1	-57.3	0	0	0	0	112.1
258	I	98.2	Very high	95.7	Very high	34 Å²	34	49.7 Å²	49.7	17%	0.174	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.7	170.1	-53.3	171.3	0	0	0	109.1	Y254 Y260 V413 F423 A424	Y254-I258 HydrophobicContact CD2-CG1 4.21Å; Y254-I258 HydrophobicContact CE1-CD1 4.09Å; Y254-I258 HydrophobicContact CE2-CD1 4.08Å; Y254-I258 HydrophobicContact CE2-CG1 3.78Å; I258-Y260 HydrophobicContact CB-CE2 3.97Å; I258-Y260 HydrophobicContact CG2-CD2 4.17Å; I258-Y260 HydrophobicContact CG2-CE1 4.03Å; I258-Y260 HydrophobicContact CG2-CE2 3.63Å; I258-V413 HydrophobicContact CD1-CG2 4.2Å; I258-F423 WeakPolarHBondContact CA-O 3.17Å; I258-A424 HydrophobicContact CB-CB 4.5Å; I258-A424 HydrophobicContact CG1-CB 3.95Å
259	W	98.5	Very high	95.9	Very high	66 Å²	66	49.4 Å²	49.4	25%	0.25	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	131.6	173.8	-68	82.4	0	0	0	110.4	F366 G422 F423 I439 G441 P442	W259-F366 HydrophobicContact CB-CB 4.37Å; W259-F366 HydrophobicContact CB-CD1 4.03Å; W259-F366 HydrophobicContact CB-CD2 3.46Å; W259-F366 VanDerWaalsContact CB-CD2 3.46Å; W259-F366 HydrophobicContact CB-CE1 4.15Å; W259-F366 HydrophobicContact CB-CE2 3.59Å; W259-F366 HydrophobicContact CB-CG 3.69Å; W259-F366 HydrophobicContact CB-CZ 3.94Å; W259-F366 HydrophobicContact CD2-CB 3.94Å; W259-F366 HydrophobicContact CD2-CG 4.21Å; W259-F366 HydrophobicContact CE3-CB 3.62Å; W259-F366 HydrophobicContact CE3-CD1 4.33Å; W259-F366 HydrophobicContact CE3-CG 4.04Å; W259-F366 HydrophobicContact CG-CB 4.27Å; W259-F366 HydrophobicContact CG-CD2 4.02Å; W259-F366 HydrophobicContact CG-CG 4.11Å; W259-F366 HydrophobicContact CZ3-CB 4.3Å; W259-G422 CarbonylContact O-C 3.56Å; W259-G422 VanDerWaalsContact O-CA 3.28Å; W259-G422 WeakPolarHBondContact O-CA 3.22Å; W259-F423 PolarHBondContact N-O 3.21Å; W259-F423 PolarHBondContact O-N 3.26Å; W259-I439 HydrophobicContact CB-CD1 4Å; W259-I439 VanDerWaalsContact CD1-CD1 3.49Å; W259-I439 HydrophobicContact CG-CD1 3.98Å; W259-I439 HydrophobicContact CG-CG1 4.24Å; W259-G441 VanDerWaalsContact CH2-O 3.22Å; W259-G441 WeakPolarHBondContact CH2-O 3.38Å; W259-G441 WeakPolarHBondContact CZ2-O 3.37Å; W259-P442 HydrophobicContact CH2-CB 4.45Å; W259-P442 VanDerWaalsContact CH2-N 3.34Å; W259-P442 HydrophobicContact CZ3-CB 4.18Å
260	Y	98.6	Very high	96.1	Very high	55 Å²	55	48.8 Å²	48.8	22%	0.216	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133	-174.8	-69.9	-84.6	0	0	0	112.9	I258 A359 T360 F366 K420 L421 G422	I258-Y260 HydrophobicContact CB-CE2 3.97Å; I258-Y260 HydrophobicContact CG2-CD2 4.17Å; I258-Y260 HydrophobicContact CG2-CE1 4.03Å; I258-Y260 HydrophobicContact CG2-CE2 3.63Å; Y260-A359 WeakPolarHBondContact O-CA 3.33Å; Y260-T360 PolarHBondContact O-N 2.81Å; Y260-T360 VanDerWaalsContact O-N 3.09Å; Y260-F366 WeakPolarHBondContact O-CE1 3.31Å; Y260-K420 HydrophobicContact CD1-CB 4.21Å; Y260-K420 HydrophobicContact CD1-CD 3.64Å; Y260-K420 HydrophobicContact CD1-CG 3.65Å; Y260-K420 HydrophobicContact CE1-CD 4.19Å; Y260-K420 HydrophobicContact CE1-CG 4.2Å; Y260-K420 HydrophobicContact CG-CD 3.9Å; Y260-K420 HydrophobicContact CG-CG 4.34Å; Y260-L421 CarbonylContact C-O 3.55Å; Y260-L421 VanDerWaalsContact CA-O 3.27Å; Y260-L421 WeakPolarHBondContact CA-O 3.2Å; Y260-G422 VanDerWaalsContact CD1-CA 3.45Å
261	T	98.5	Very high	96.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	141.1	167.7	-173.5	0	0	0	0	109.9	V271 L357 R358 F366 K420 L421 F423	T261-V271 HydrophobicContact CG2-CB 4.28Å; T261-V271 HydrophobicContact CG2-CG1 3.62Å; T261-L357 HydrophobicContact CG2-CD1 4.19Å; T261-R358 VanDerWaalsContact CA-O 3.27Å; T261-R358 WeakPolarHBondContact CA-O 3.12Å; T261-R358 WeakPolarHBondContact CB-O 3.35Å; T261-R358 PolarHBondContact OG1-O 2.89Å; T261-F366 HydrophobicContact CG2-CZ 4.39Å; T261-K420 CarbonylContact O-C 3.51Å; T261-K420 VanDerWaalsContact O-CA 3.31Å; T261-K420 WeakPolarHBondContact O-CA 3.49Å; T261-K420 WeakPolarHBondContact O-CB 3.43Å; T261-L421 HydrophobicContact CG2-CB 3.87Å; T261-L421 PolarHBondContact N-O 2.84Å; T261-L421 PolarHBondContact O-N 2.7Å; T261-F423 HydrophobicContact CG2-CE2 4.07Å
262	P	98	Very high	96.5	Very high	40 Å²	40	47.3 Å²	47.3	26%	0.26	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	149.5	177.9	29.1	-34.7	0	0	0	111.7	R358	P262-R358 WeakPolarHBondContact CD-O 3.28Å
263	I	97.8	Very high	96.7	Very high	15 Å²	15	43.1 Å²	43.1	8%	0.077	22%	0.221	C	C	.	.			trans	-82.2	119.7	167	-64.8	175.2	0	0	0	107.7	Y195 E265 E266 Y269 Q270 K419 L421	Y195-I263 WeakPolarHBondContact OH-CD1 3.14Å; I263-E265 WeakPolarHBondContact CG2-O 3.27Å; I263-E266 HydrophobicContact CG2-CG 4.44Å; I263-Y269 HydrophobicContact CD1-CD1 3.96Å; I263-Y269 HydrophobicContact CD1-CE1 4.39Å; I263-Q270 CarbonylContact C-O 3.59Å; I263-Q270 WeakPolarHBondContact CA-O 3.38Å; I263-K419 HydrophobicContact CB-CB 4.5Å; I263-K419 PolarHBondContact N-O 3.41Å; I263-L421 HydrophobicContact CD1-CD1 4.38Å; I263-L421 HydrophobicContact CD1-CG 4.12Å; I263-L421 HydrophobicContact CG1-CD1 3.85Å; I263-L421 HydrophobicContact CG1-CG 3.91Å
264	V	94.7	Very high	96.8	Very high	59 Å²	59	43.2 Å²	43.2	36%	0.358	22%	0.222	S	C	.	.	S	Bend	trans	-71.7	-45.1	-175	179.9	0	0	0	0	111.2	Q270 E272	V264-Q270 HydrophobicContact CB-CB 4.41Å; V264-Q270 HydrophobicContact CB-CG 4.01Å; V264-Q270 HydrophobicContact CG2-CG 4.44Å; V264-Q270 PolarHBondContact N-O 3.11Å; V264-E272 HydrophobicContact CG2-CB 4.11Å
265	E	95.1	Very high	96.7	Very high	93 Å²	93	44.2 Å²	44.2	44%	0.435	23%	0.227	S	C	.	.	S	Bend	trans	-145.9	141.2	179.4	-173.9	168	-166.6	0	0	110.3	I263 W267 Y268	I263-E265 WeakPolarHBondContact CG2-O 3.27Å; E265-W267 HydrophobicContact CG-CG 4.28Å; E265-W267 PolarHBondContact O-N 3.1Å; E265-Y268 VanDerWaalsContact O-O 3.05Å
266	E	96.6	Very high	96.9	Very high	75 Å²	75	38 Å²	38	35%	0.35	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-91	66.1	-174	-67.7	171.1	110	0	0	111.9	Y195 I263 K419	Y195-E266 WeakPolarHBondContact CB-O 3.39Å; Y195-E266 HydrophobicContact CD1-CB 3.8Å; Y195-E266 HydrophobicContact CD1-CG 4.29Å; Y195-E266 HydrophobicContact CD2-CB 4.15Å; Y195-E266 HydrophobicContact CE1-CB 3.93Å; Y195-E266 HydrophobicContact CE1-CG 3.9Å; Y195-E266 HydrophobicContact CE2-CB 4.27Å; Y195-E266 HydrophobicContact CE2-CG 4.43Å; Y195-E266 HydrophobicContact CG-CB 3.92Å; I263-E266 HydrophobicContact CG2-CG 4.44Å; E266-K419 WeakPolarHBondContact OE1-CE 3.46Å; E266-K419 IonicContact OE1-NZ 3.85Å; E266-K419 VanDerWaalsContact OE2-CE 3.31Å; E266-K419 WeakPolarHBondContact OE2-CE 3.45Å; E266-K419 IonicContact OE2-NZ 3.63Å; E266-K419 PolarHBondContact OE2-NZ 3.3Å
267	W	95.1	Very high	97.1	Very high	61 Å²	61	35.8 Å²	35.8	23%	0.231	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-72.7	174.2	61.7	-38.2	0	0	0	108.6	Y195 M197 L198 E265 K294	Y195-W267 WeakPolarHBondContact CB-O 3.18Å; Y195-W267 WeakPolarHBondContact CD2-O 3.47Å; Y195-W267 PolarHBondContact N-O 3.41Å; Y195-W267 VanDerWaalsContact N-O 3.13Å; M197-W267 HydrophobicContact CB-CB 3.89Å; M197-W267 HydrophobicContact CG-CB 4.03Å; M197-W267 HydrophobicContact SD-CB 3.68Å; L198-W267 VanDerWaalsContact CD1-O 3.29Å; L198-W267 WeakPolarHBondContact CD1-O 3.34Å; L198-W267 HydrophobicContact CD2-CB 4.32Å; L198-W267 HydrophobicContact CD2-CE3 4.15Å; L198-W267 HydrophobicContact CG-CB 4.35Å; E265-W267 HydrophobicContact CG-CG 4.28Å; E265-W267 PolarHBondContact O-N 3.1Å; W267-K294 HydrophobicContact CH2-CD 3.72Å; W267-K294 HydrophobicContact CZ2-CB 4.23Å; W267-K294 HydrophobicContact CZ2-CD 3.62Å
268	Y	97.7	Very high	97.3	Very high	54 Å²	54	31.9 Å²	31.9	21%	0.212	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	175.2	156.3	-66.1	-84	0	0	0	110.7	G106 L198 E265 Q270 K294 I296	G106-Y268 WeakPolarHBondContact O-CE1 3.48Å; L198-Y268 HydrophobicContact CD1-CD1 3.52Å; L198-Y268 HydrophobicContact CD1-CD2 3.95Å; L198-Y268 HydrophobicContact CD1-CE1 3.5Å; L198-Y268 VanDerWaalsContact CD1-CE1 3.5Å; L198-Y268 HydrophobicContact CD1-CE2 3.9Å; L198-Y268 HydrophobicContact CD1-CG 3.74Å; L198-Y268 HydrophobicContact CD2-CD2 4.11Å; L198-Y268 HydrophobicContact CD2-CE1 4.49Å; L198-Y268 HydrophobicContact CD2-CE2 3.58Å; L198-Y268 HydrophobicContact CG-CE2 4.37Å; E265-Y268 VanDerWaalsContact O-O 3.05Å; Y268-Q270 PolarHBondContact O-N 3.06Å; Y268-K294 HydrophobicContact CD2-CD 3.92Å; Y268-K294 HydrophobicContact CE2-CD 4.09Å; Y268-I296 VanDerWaalsContact CB-CG2 3.47Å; Y268-I296 HydrophobicContact CD1-CD1 3.6Å; Y268-I296 HydrophobicContact CD1-CG2 4.37Å; Y268-I296 HydrophobicContact CD2-CG2 4.35Å; Y268-I296 HydrophobicContact CE1-CD1 3.97Å; Y268-I296 HydrophobicContact CG-CD1 4.14Å; Y268-I296 HydrophobicContact CG-CG2 3.83Å
269	Y	98.6	Very high	97.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-78.1	68.9	160.6	-69	-68.8	0	0	0	110.1	T105 L193 A194 Y195 F222 I263 I296 V297 F414 R416 L421	T105-Y269 HydrophobicContact CG2-CE2 4.41Å; T105-Y269 WeakPolarHBondContact O-CD2 3.49Å; L193-Y269 PolarHBondContact O-OH 3.12Å; A194-Y269 HydrophobicContact CB-CE2 4.25Å; Y195-Y269 HydrophobicContact CD2-CE1 4.43Å; Y195-Y269 AromaticContact CE2-CD1 3.77Å; Y195-Y269 HydrophobicContact CE2-CD1 3.77Å; Y195-Y269 AromaticContact CE2-CE1 3.54Å; Y195-Y269 HydrophobicContact CE2-CE1 3.54Å; Y195-Y269 AromaticContact CZ-CE1 3.81Å; F222-Y269 VanDerWaalsContact CE1-OH 3.24Å; F222-Y269 WeakPolarHBondContact CE1-OH 3.35Å; F222-Y269 HydrophobicContact CZ-CE2 4.07Å; F222-Y269 AromaticContact CZ-CZ 3.85Å; F222-Y269 WeakPolarHBondContact CZ-OH 3.42Å; I263-Y269 HydrophobicContact CD1-CD1 3.96Å; I263-Y269 HydrophobicContact CD1-CE1 4.39Å; Y269-I296 WeakPolarHBondContact O-CA 3.4Å; Y269-V297 PolarHBondContact O-N 3.39Å; Y269-F414 AromaticContact CD1-CD1 3.56Å; Y269-F414 HydrophobicContact CD1-CD1 3.56Å; Y269-F414 HydrophobicContact CD1-CE1 4.17Å; Y269-F414 AromaticContact CD2-CD1 3.68Å; Y269-F414 HydrophobicContact CD2-CD1 3.68Å; Y269-F414 AromaticContact CD2-CE1 3.65Å; Y269-F414 HydrophobicContact CD2-CE1 3.65Å; Y269-F414 HydrophobicContact CE1-CB 4.25Å; Y269-F414 AromaticContact CE1-CD1 3.63Å; Y269-F414 HydrophobicContact CE1-CD1 3.63Å; Y269-F414 HydrophobicContact CE1-CG 4.42Å; Y269-F414 AromaticContact CE2-CD1 3.75Å; Y269-F414 HydrophobicContact CE2-CD1 3.75Å; Y269-F414 HydrophobicContact CE2-CE1 4.06Å; Y269-F414 AromaticContact CG-CD1 3.59Å; Y269-F414 HydrophobicContact CG-CD1 3.59Å; Y269-F414 AromaticContact CG-CE1 3.71Å; Y269-F414 HydrophobicContact CG-CE1 3.71Å; Y269-F414 AromaticContact CZ-CD1 3.74Å; Y269-R416 HydrophobicContact CE1-CG 4.09Å; Y269-R416 WeakPolarHBondContact OH-CD 3.37Å; Y269-L421 HydrophobicContact CD1-CD1 4.47Å; Y269-L421 HydrophobicContact CD1-CD2 4.07Å; Y269-L421 HydrophobicContact CG-CD2 4.39Å
270	Q	98.4	Very high	96.9	Very high	13 Å²	13	34 Å²	34	6%	0.061	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128.4	-177.2	-174.5	178.5	-12.4	0	0	111.2	I263 V264 Y268 K294 A295 I296	I263-Q270 CarbonylContact C-O 3.59Å; I263-Q270 WeakPolarHBondContact CA-O 3.38Å; V264-Q270 HydrophobicContact CB-CB 4.41Å; V264-Q270 HydrophobicContact CB-CG 4.01Å; V264-Q270 HydrophobicContact CG2-CG 4.44Å; V264-Q270 PolarHBondContact N-O 3.11Å; Y268-Q270 PolarHBondContact O-N 3.06Å; Q270-K294 HydrophobicContact CG-CB 4.45Å; Q270-A295 CarbonylContact C-O 3.47Å; Q270-A295 VanDerWaalsContact CA-O 3.29Å; Q270-A295 WeakPolarHBondContact CA-O 3.44Å; Q270-A295 WeakPolarHBondContact CG-O 3.16Å; Q270-I296 HydrophobicContact CB-CG2 4.38Å
271	V	97.6	Very high	96.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	171.1	176	-64.4	0	0	0	0	110.3	T261 V273 A295 V297 L357 I402 L421	T261-V271 HydrophobicContact CG2-CB 4.28Å; T261-V271 HydrophobicContact CG2-CG1 3.62Å; V271-V273 HydrophobicContact CG2-CG2 4.47Å; V271-A295 HydrophobicContact CG2-CB 4.29Å; V271-A295 PolarHBondContact N-O 2.95Å; V271-V297 HydrophobicContact CG1-CG2 4.18Å; V271-L357 HydrophobicContact CB-CD2 4.5Å; V271-L357 HydrophobicContact CG2-CD2 4.12Å; V271-I402 HydrophobicContact CG2-CD1 4.34Å; V271-L421 HydrophobicContact CG1-CB 4.5Å; V271-L421 HydrophobicContact CG1-CD1 3.37Å
272	E	97	Very high	96.5	Very high	11 Å²	11	36.7 Å²	36.7	5%	0.051	19%	0.187	C	C	.	.			trans	-111.3	116.1	174	-169	-171.6	175.2	0	0	110.6	V264 L274 R358 C452	V264-E272 HydrophobicContact CG2-CB 4.11Å; E272-L274 HydrophobicContact CG-CD2 4.01Å; E272-R358 HydrophobicContact CB-CB 4.38Å; E272-R358 VanDerWaalsContact CD-NE 3.29Å; E272-R358 PolarHBondContact O-N 3.31Å; E272-R358 IonicContact OE1-CZ 3.3Å; E272-R358 IonicContact OE1-NE 2.84Å; E272-R358 PolarHBondContact OE1-NE 2.94Å; E272-R358 IonicContact OE1-NH2 3.27Å; E272-R358 PolarHBondContact OE1-NH2 3.08Å; E272-R358 WeakPolarHBondContact OE2-CD 3.3Å; E272-R358 IonicContact OE2-CZ 2.69Å; E272-R358 IonicContact OE2-NE 2.82Å; E272-R358 PolarHBondContact OE2-NE 2.85Å; E272-R358 IonicContact OE2-NH2 3.1Å; E272-C452 HydrophobicContact CG-CB 4.02Å; E272-C452 VanDerWaalsContact OE1-CB 3.32Å; E272-C452 WeakPolarHBondContact OE1-CB 3.46Å; E272-C452 PolarHBondContact OE1-N 2.99Å
273	V	97.6	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.4	177.4	179	0	0	0	0	109.5	V271 L276 Y290 N291 A295 I355 L357 L400	V271-V273 HydrophobicContact CG2-CG2 4.47Å; V273-L276 HydrophobicContact CG1-CD1 3.39Å; V273-Y290 HydrophobicContact CG1-CD2 4.27Å; V273-Y290 HydrophobicContact CG1-CG 3.99Å; V273-N291 PolarHBondContact N-OD1 3.1Å; V273-N291 PolarHBondContact O-ND2 3.44Å; V273-A295 HydrophobicContact CG2-CB 3.73Å; V273-I355 HydrophobicContact CG1-CG2 3.83Å; V273-I355 HydrophobicContact CG2-CG2 4.14Å; V273-L357 HydrophobicContact CG2-CD2 3.87Å; V273-L400 HydrophobicContact CG2-CD1 4.32Å; V273-L400 HydrophobicContact CG2-CD2 4.33Å
274	L	96.4	Very high	96.1	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-35.7	-174.6	-58.1	-175.1	0	0	0	112.9	E272 C287 Y356 R358 A445 V448 C452	E272-L274 HydrophobicContact CG-CD2 4.01Å; L274-C287 VanDerWaalsContact O-CB 3.26Å; L274-C287 WeakPolarHBondContact O-CB 3.43Å; L274-Y356 PolarHBondContact N-O 3.45Å; L274-R358 HydrophobicContact CD1-CB 4.04Å; L274-R358 HydrophobicContact CD1-CG 4.46Å; L274-R358 HydrophobicContact CD2-CB 4.26Å; L274-R358 HydrophobicContact CG-CB 4.27Å; L274-A445 HydrophobicContact CD1-CB 3.97Å; L274-V448 HydrophobicContact CB-CG1 4.23Å; L274-V448 HydrophobicContact CD2-CG1 4.03Å; L274-C452 HydrophobicContact CD2-CB 4.12Å
275	K	95.1	Very high	96	Very high	61 Å²	61	41.6 Å²	41.6	27%	0.265	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	143.8	-172.2	-179.1	177.9	60.9	160.6	0	110.4	E277 Y356	K275-E277 HydrophobicContact CD-CG 4.31Å; K275-E277 WeakPolarHBondContact CE-OE1 2.99Å; K275-E277 HydrophobicContact CG-CG 4.46Å; K275-E277 IonicContact NZ-OE1 2.69Å; K275-E277 PolarHBondContact NZ-OE1 2.92Å; K275-Y356 HydrophobicContact CB-CD2 4.1Å; K275-Y356 HydrophobicContact CB-CG 4.16Å; K275-Y356 HydrophobicContact CD-CD2 4.5Å; K275-Y356 VanDerWaalsContact CE-CD2 3.47Å; K275-Y356 VanDerWaalsContact CE-CE2 3.41Å; K275-Y356 HydrophobicContact CG-CD2 4.29Å; K275-Y356 WeakPolarHBondContact O-CB 3.25Å; K275-Y356 PolarHBondContact O-N 3.34Å
276	L	98.1	Very high	95.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.4	163.9	-90.9	62.9	0	0	0	110.4	V273 L283 Y290 L306 V310 V314 S354 I355	V273-L276 HydrophobicContact CG1-CD1 3.39Å; L276-L283 HydrophobicContact CB-CD1 3.58Å; L276-L283 HydrophobicContact CB-CG 4.09Å; L276-L283 HydrophobicContact CD2-CD1 4.2Å; L276-L283 PolarHBondContact O-N 2.86Å; L276-Y290 HydrophobicContact CB-CE1 4.15Å; L276-Y290 HydrophobicContact CD1-CD1 3.92Å; L276-Y290 HydrophobicContact CD1-CE1 4.16Å; L276-Y290 HydrophobicContact CD1-CG 4.27Å; L276-L306 HydrophobicContact CD2-CD2 4.05Å; L276-V310 HydrophobicContact CD2-CG1 3.8Å; L276-V314 HydrophobicContact CD2-CG2 4.26Å; L276-S354 CarbonylContact C-O 3.55Å; L276-S354 VanDerWaalsContact CA-O 3.31Å; L276-S354 WeakPolarHBondContact CA-O 3.31Å; L276-I355 HydrophobicContact CD1-CG1 4.37Å; L276-I355 HydrophobicContact CD1-CG2 4.1Å; L276-I355 HydrophobicContact CG-CG1 4.3Å
277	E	98	Very high	95.8	Very high	21 Å²	21	38.7 Å²	38.7	10%	0.098	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.5	171.3	-67.4	177	166.1	0	0	110.7	K275 Q281 L353 S354 Y356 R367	K275-E277 HydrophobicContact CD-CG 4.31Å; K275-E277 WeakPolarHBondContact CE-OE1 2.99Å; K275-E277 HydrophobicContact CG-CG 4.46Å; K275-E277 IonicContact NZ-OE1 2.69Å; K275-E277 PolarHBondContact NZ-OE1 2.92Å; E277-Q281 CarbonylContact C-O 3.56Å; E277-Q281 VanDerWaalsContact CA-O 3.23Å; E277-Q281 WeakPolarHBondContact CA-O 3.29Å; E277-L353 CarbonylContact O-C 3.54Å; E277-L353 WeakPolarHBondContact O-CA 3.17Å; E277-S354 PolarHBondContact N-O 2.86Å; E277-S354 PolarHBondContact O-N 2.75Å; E277-Y356 HydrophobicContact CB-CE2 4.45Å; E277-Y356 VanDerWaalsContact CD-CE2 3.41Å; E277-Y356 HydrophobicContact CG-CE2 3.82Å; E277-Y356 PolarHBondContact OE1-OH 3.11Å; E277-Y356 WeakPolarHBondContact OE2-CE2 3.17Å; E277-Y356 VanDerWaalsContact OE2-CZ 3.31Å; E277-Y356 PolarHBondContact OE2-OH 2.72Å; E277-R367 IonicContact OE2-NH1 3.85Å
278	V	97.7	Very high	95.7	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.5	171.2	175	0	0	0	0	107.4	D280 Q281 L283 V314 T317 I318 P351 L353	V278-D280 PolarHBondContact O-N 2.81Å; V278-Q281 PolarHBondContact N-O 2.91Å; V278-Q281 PolarHBondContact O-N 3.12Å; V278-L283 HydrophobicContact CG2-CD2 3.92Å; V278-V314 HydrophobicContact CG2-CB 4.48Å; V278-V314 HydrophobicContact CG2-CG1 4.16Å; V278-V314 HydrophobicContact CG2-CG2 4.29Å; V278-T317 HydrophobicContact CB-CG2 3.65Å; V278-T317 HydrophobicContact CG1-CG2 3.82Å; V278-T317 HydrophobicContact CG2-CG2 4.34Å; V278-I318 HydrophobicContact CG1-CG1 3.63Å; V278-P351 HydrophobicContact CG1-CB 4Å; V278-P351 HydrophobicContact CG1-CG 3.42Å; V278-P351 VanDerWaalsContact CG1-CG 3.42Å; V278-L353 HydrophobicContact CG2-CD1 3.72Å
279	G	95.4	Very high	95.6	Very high	17 Å²	17	41.1 Å²	41.1	18%	0.175	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	-119.8	-165.7	0	0	0	0	0	109.4	K352	G279-K352 PolarHBondContact N-O 3.07Å; G279-K352 WeakPolarHBondContact O-CE 3.49Å
280	D	92.8	Very high	95.5	Very high	129 Å²	129	41.2 Å²	41.2	69%	0.69	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110	15.9	172.6	-57.2	-50	0	0	0	112	V278 K352	V278-D280 PolarHBondContact O-N 2.81Å; D280-K352 WeakPolarHBondContact OD1-CE 3.22Å; D280-K352 IonicContact OD1-NZ 2.79Å; D280-K352 PolarHBondContact OD1-NZ 2.86Å
281	Q	95.2	Very high	95.4	Very high	75 Å²	75	40.9 Å²	40.9	35%	0.35	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.7	-177.6	-63.1	178.4	4.2	0	0	111.1	E277 V278 T317	E277-Q281 CarbonylContact C-O 3.56Å; E277-Q281 VanDerWaalsContact CA-O 3.23Å; E277-Q281 WeakPolarHBondContact CA-O 3.29Å; V278-Q281 PolarHBondContact N-O 2.91Å; V278-Q281 PolarHBondContact O-N 3.12Å; Q281-T317 HydrophobicContact CB-CG2 4.35Å
282	S	94.6	Very high	95.2	Very high	36 Å²	36	44.6 Å²	44.6	25%	0.252	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143.9	169.6	-174.1	0	0	0	0	111.1	N284	S282-N284 PolarHBondContact O-N 3.37Å; S282-N284 PolarHBondContact OG-N 2.7Å
283	L	95.5	Very high	94.9	Very high	17 Å²	17	48.9 Å²	48.9	9%	0.089	26%	0.258	C	S	.	.			trans	-68.6	-14.8	175.1	-59.2	-176.9	0	0	0	113.5	L276 V278 L285 Y290 V310 A313 V314	L276-L283 HydrophobicContact CB-CD1 3.58Å; L276-L283 HydrophobicContact CB-CG 4.09Å; L276-L283 HydrophobicContact CD2-CD1 4.2Å; L276-L283 PolarHBondContact O-N 2.86Å; V278-L283 HydrophobicContact CG2-CD2 3.92Å; L283-L285 HydrophobicContact CB-CD1 4.38Å; L283-L285 HydrophobicContact CB-CG 4.16Å; L283-L285 PolarHBondContact O-N 3.2Å; L283-Y290 HydrophobicContact CD1-CE1 4.25Å; L283-V310 HydrophobicContact CD1-CG1 4.29Å; L283-A313 HydrophobicContact CD1-CB 4.4Å; L283-A313 HydrophobicContact CD2-CB 4.4Å; L283-V314 HydrophobicContact CD1-CG2 3.59Å; L283-V314 HydrophobicContact CD2-CG2 4.3Å
284	N	90.4	Very high	94.8	Very high	143 Å²	143	50.1 Å²	50.1	77%	0.765	26%	0.264	S	S	*	.			trans	52.9	35.3	-179.6	-57.5	-39.9	0	0	0	114.3	S282	S282-N284 PolarHBondContact O-N 3.37Å; S282-N284 PolarHBondContact OG-N 2.7Å
285	L	94	Very high	94.9	Very high	57 Å²	57	49.7 Å²	49.7	30%	0.298	26%	0.262	S	S	.	.			trans	-91.5	157.6	172	-57.7	177.5	0	0	0	110.1	L283 C287 E289 Y290 V310 A313	L283-L285 HydrophobicContact CB-CD1 4.38Å; L283-L285 HydrophobicContact CB-CG 4.16Å; L283-L285 PolarHBondContact O-N 3.2Å; L285-C287 PolarHBondContact O-N 2.86Å; L285-E289 HydrophobicContact CB-CB 4.42Å; L285-Y290 HydrophobicContact CB-CE1 4.29Å; L285-Y290 HydrophobicContact CD1-CE1 4.08Å; L285-V310 HydrophobicContact CD1-CB 4.44Å; L285-V310 HydrophobicContact CD1-CG2 4.02Å; L285-A313 HydrophobicContact CD1-CB 3.94Å
286	D	93.4	Very high	95	Very high	94 Å²	94	47.1 Å²	47.1	50%	0.503	25%	0.25	S	S	.	.			trans	-58.5	132.8	166.3	-172.2	-44.6	0	0	0	108.5	K288 E289	D286-K288 PolarHBondContact O-N 3.18Å; D286-K288 WeakPolarHBondContact OD1-CB 3.48Å; D286-K288 WeakPolarHBondContact OD1-CG 3.48Å; D286-K288 PolarHBondContact OD1-N 3.13Å; D286-E289 HydrophobicContact CB-CG 4.39Å; D286-E289 VanDerWaalsContact O-CB 3.31Å; D286-E289 WeakPolarHBondContact O-CB 3.27Å; D286-E289 PolarHBondContact O-N 2.88Å
287	C	93.4	Very high	95.1	Very high	13 Å²	13	47.1 Å²	47.1	9%	0.088	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-59.9	-21.8	-177.3	68	0	0	0	0	113.2	L274 L285 E289 Y290 N291 V448 C452	L274-C287 VanDerWaalsContact O-CB 3.26Å; L274-C287 WeakPolarHBondContact O-CB 3.43Å; L285-C287 PolarHBondContact O-N 2.86Å; C287-E289 VanDerWaalsContact C-N 3.29Å; C287-E289 PolarHBondContact O-N 3Å; C287-Y290 HydrophobicContact CB-CD2 4.27Å; C287-Y290 HydrophobicContact CB-CE2 4.46Å; C287-Y290 WeakPolarHBondContact O-CD2 3.16Å; C287-Y290 PolarHBondContact O-N 2.83Å; C287-N291 PolarHBondContact O-ND2 2.84Å; C287-V448 HydrophobicContact CB-CG1 4.17Å; C287-C452 HydrophobicContact CB-CB 3.7Å; C287-C452 WeakPolarHBondContact CB-SG 3.3Å; C287-C452 WeakPolarHBondContact SG-CB 3.4Å; C287-C452 CovalentContact SG-SG 2.03Å; C287-C452 PolarHBondContact SG-SG 3.05Å
288	K	93.9	Very high	95.1	Very high	99 Å²	99	46.8 Å²	46.8	43%	0.43	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-60.9	-36.8	172.7	-68.8	174.5	-179	174.8	0	112.6	D286 Y290 N291 V292 C452	D286-K288 PolarHBondContact O-N 3.18Å; D286-K288 WeakPolarHBondContact OD1-CB 3.48Å; D286-K288 WeakPolarHBondContact OD1-CG 3.48Å; D286-K288 PolarHBondContact OD1-N 3.13Å; K288-Y290 PolarHBondContact O-N 3.11Å; K288-Y290 VanDerWaalsContact O-N 3.1Å; K288-N291 CarbonylContact O-C 3.49Å; K288-N291 PolarHBondContact O-N 3.42Å; K288-V292 WeakPolarHBondContact O-CG2 3.38Å; K288-V292 PolarHBondContact O-N 2.87Å; K288-C452 WeakPolarHBondContact CA-O 3.36Å
289	E	95.4	Very high	95.1	Very high	67 Å²	67	46.9 Å²	46.9	31%	0.313	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-57.1	-29.3	-180	-66.6	-78.7	164.2	0	0	112.3	L285 D286 C287 N291 P307 N309 V310	L285-E289 HydrophobicContact CB-CB 4.42Å; D286-E289 HydrophobicContact CB-CG 4.39Å; D286-E289 VanDerWaalsContact O-CB 3.31Å; D286-E289 WeakPolarHBondContact O-CB 3.27Å; D286-E289 PolarHBondContact O-N 2.88Å; C287-E289 VanDerWaalsContact C-N 3.29Å; C287-E289 PolarHBondContact O-N 3Å; E289-N291 VanDerWaalsContact C-N 3.28Å; E289-N291 PolarHBondContact O-N 2.83Å; E289-P307 WeakPolarHBondContact O-CG 3.19Å; E289-N309 PolarHBondContact OE2-ND2 3.07Å; E289-V310 HydrophobicContact CB-CG2 4.14Å; E289-V310 WeakPolarHBondContact O-CG2 3.21Å
290	Y	96.8	Very high	95.1	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.008	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-74.2	-19.2	177.1	-51	-54.2	0	0	0	113.7	V273 L276 L283 L285 C287 K288 V310 L400	V273-Y290 HydrophobicContact CG1-CD2 4.27Å; V273-Y290 HydrophobicContact CG1-CG 3.99Å; L276-Y290 HydrophobicContact CB-CE1 4.15Å; L276-Y290 HydrophobicContact CD1-CD1 3.92Å; L276-Y290 HydrophobicContact CD1-CE1 4.16Å; L276-Y290 HydrophobicContact CD1-CG 4.27Å; L283-Y290 HydrophobicContact CD1-CE1 4.25Å; L285-Y290 HydrophobicContact CB-CE1 4.29Å; L285-Y290 HydrophobicContact CD1-CE1 4.08Å; C287-Y290 HydrophobicContact CB-CD2 4.27Å; C287-Y290 HydrophobicContact CB-CE2 4.46Å; C287-Y290 WeakPolarHBondContact O-CD2 3.16Å; C287-Y290 PolarHBondContact O-N 2.83Å; K288-Y290 PolarHBondContact O-N 3.11Å; K288-Y290 VanDerWaalsContact O-N 3.1Å; Y290-V310 HydrophobicContact CD1-CB 4.42Å; Y290-V310 HydrophobicContact CD1-CG1 3.81Å; Y290-V310 HydrophobicContact CD1-CG2 3.66Å; Y290-V310 HydrophobicContact CE1-CG1 3.97Å; Y290-V310 HydrophobicContact CE1-CG2 4.07Å; Y290-L400 WeakPolarHBondContact O-CB 3.27Å
291	N	96.3	Very high	95.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.032	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-117.5	11.4	-172.4	-54.8	-79.9	0	0	0	112.5	V273 C287 K288 E289 D293 K294 C452	V273-N291 PolarHBondContact N-OD1 3.1Å; V273-N291 PolarHBondContact O-ND2 3.44Å; C287-N291 PolarHBondContact O-ND2 2.84Å; K288-N291 CarbonylContact O-C 3.49Å; K288-N291 PolarHBondContact O-N 3.42Å; E289-N291 VanDerWaalsContact C-N 3.28Å; E289-N291 PolarHBondContact O-N 2.83Å; N291-D293 CarbonylContact O-C 3.59Å; N291-K294 WeakPolarHBondContact O-CA 3.29Å; N291-K294 PolarHBondContact O-N 2.98Å; N291-C452 WeakPolarHBondContact CB-O 3.28Å; N291-C452 PolarHBondContact ND2-O 2.94Å
292	V	91.9	Very high	95.2	Very high	77 Å²	77	40.6 Å²	40.6	47%	0.467	23%	0.225	S	C	.	.	S	Bend	trans	-87.5	118.8	175	173.8	0	0	0	0	110.4	K288 G399	K288-V292 WeakPolarHBondContact O-CG2 3.38Å; K288-V292 PolarHBondContact O-N 2.87Å; V292-G399 VanDerWaalsContact O-CA 3.26Å; V292-G399 WeakPolarHBondContact O-CA 3.29Å
293	D	90.5	Very high	95.3	Very high	101 Å²	101	40.6 Å²	40.6	54%	0.54	22%	0.222	S	C	.	.	S	Bend	cis	-85.3	-9.6	-10.8	-62.7	-37.7	0	0	0	112.8	N291	N291-D293 CarbonylContact O-C 3.59Å
294	K	95.8	Very high	95.4	Very high	26 Å²	26	39.8 Å²	39.8	11%	0.113	22%	0.218	C	C	.	.			trans	-160.2	162	177.9	60.1	-170.2	-177.3	-64	0	111.1	W267 Y268 Q270 N291 I296 S398 G399 L400	W267-K294 HydrophobicContact CH2-CD 3.72Å; W267-K294 HydrophobicContact CZ2-CB 4.23Å; W267-K294 HydrophobicContact CZ2-CD 3.62Å; Y268-K294 HydrophobicContact CD2-CD 3.92Å; Y268-K294 HydrophobicContact CE2-CD 4.09Å; Q270-K294 HydrophobicContact CG-CB 4.45Å; N291-K294 WeakPolarHBondContact O-CA 3.29Å; N291-K294 PolarHBondContact O-N 2.98Å; K294-I296 HydrophobicContact CB-CG2 4.28Å; K294-I296 HydrophobicContact CD-CG2 3.87Å; K294-I296 HydrophobicContact CG-CG2 3.97Å; K294-S398 PolarHBondContact NZ-O 2.49Å; K294-G399 CarbonylContact O-C 3.11Å; K294-G399 VanDerWaalsContact O-CA 3.28Å; K294-G399 WeakPolarHBondContact O-CA 3.43Å; K294-L400 PolarHBondContact O-N 3.42Å
295	A	98.2	Very high	95.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	121.6	164.9	0	0	0	0	0	109.3	Q270 V271 V273 L400	Q270-A295 CarbonylContact C-O 3.47Å; Q270-A295 VanDerWaalsContact CA-O 3.29Å; Q270-A295 WeakPolarHBondContact CA-O 3.44Å; Q270-A295 WeakPolarHBondContact CG-O 3.16Å; V271-A295 HydrophobicContact CG2-CB 4.29Å; V271-A295 PolarHBondContact N-O 2.95Å; V273-A295 HydrophobicContact CG2-CB 3.73Å; A295-L400 CarbonylContact C-O 3.55Å; A295-L400 WeakPolarHBondContact CA-O 3.47Å; A295-L400 HydrophobicContact CB-CB 3.99Å; A295-L400 HydrophobicContact CB-CD2 4.13Å
296	I	98.6	Very high	96	Very high	6 Å²	6	32 Å²	32	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.5	-172.1	66.9	170.4	0	0	0	112.4	Y268 Y269 Q270 K294 D298 L400 V401 I402	Y268-I296 VanDerWaalsContact CB-CG2 3.47Å; Y268-I296 HydrophobicContact CD1-CD1 3.6Å; Y268-I296 HydrophobicContact CD1-CG2 4.37Å; Y268-I296 HydrophobicContact CD2-CG2 4.35Å; Y268-I296 HydrophobicContact CE1-CD1 3.97Å; Y268-I296 HydrophobicContact CG-CD1 4.14Å; Y268-I296 HydrophobicContact CG-CG2 3.83Å; Y269-I296 WeakPolarHBondContact O-CA 3.4Å; Q270-I296 HydrophobicContact CB-CG2 4.38Å; K294-I296 HydrophobicContact CB-CG2 4.28Å; K294-I296 HydrophobicContact CD-CG2 3.87Å; K294-I296 HydrophobicContact CG-CG2 3.97Å; I296-D298 HydrophobicContact CD1-CB 4.19Å; I296-D298 HydrophobicContact CG1-CB 4.45Å; I296-L400 PolarHBondContact N-O 3.5Å; I296-V401 HydrophobicContact CD1-CG1 4.3Å; I296-V401 HydrophobicContact CD1-CG2 4.16Å; I296-V401 HydrophobicContact CG1-CB 4.3Å; I296-V401 HydrophobicContact CG1-CG1 4.06Å; I296-V401 HydrophobicContact CG1-CG2 4.01Å; I296-I402 WeakPolarHBondContact O-CB 3.41Å; I296-I402 PolarHBondContact O-N 3.41Å
297	V	98.8	Very high	96.2	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.9	169.5	-174.2	0	0	0	0	109.7	T105 Y269 V271 I402 M407 V412 F414 L421 F423	T105-V297 PolarHBondContact OG1-O 3.45Å; T105-V297 VanDerWaalsContact OG1-O 3.06Å; Y269-V297 PolarHBondContact O-N 3.39Å; V271-V297 HydrophobicContact CG1-CG2 4.18Å; V297-I402 HydrophobicContact CG2-CB 4.33Å; V297-I402 HydrophobicContact CG2-CD1 4.26Å; V297-M407 HydrophobicContact CG1-CE 4.11Å; V297-M407 HydrophobicContact CG1-CG 4.2Å; V297-M407 HydrophobicContact CG1-SD 3.79Å; V297-V412 HydrophobicContact CG1-CG1 4.35Å; V297-F414 HydrophobicContact CG1-CE1 4.32Å; V297-F414 HydrophobicContact CG1-CZ 4.06Å; V297-L421 HydrophobicContact CG2-CD1 4.23Å; V297-F423 HydrophobicContact CG2-CZ 3.98Å
298	D	98.6	Very high	96.3	Very high	14 Å²	14	31.6 Å²	31.6	8%	0.075	17%	0.17	C	C	.	.			trans	-139.6	105.3	-166.9	-179.3	8.3	0	0	0	112.3	D104 T105 G106 I296 G300 T301 V401 I402 G403	D104-D298 VanDerWaalsContact OD1-OD1 3.13Å; T105-D298 VanDerWaalsContact OG1-CA 3.28Å; T105-D298 WeakPolarHBondContact OG1-CA 3.42Å; G106-D298 VanDerWaalsContact CA-OD1 3.29Å; G106-D298 WeakPolarHBondContact CA-OD1 3.29Å; G106-D298 PolarHBondContact N-OD1 2.93Å; G106-D298 VanDerWaalsContact N-OD1 3.1Å; I296-D298 HydrophobicContact CD1-CB 4.19Å; I296-D298 HydrophobicContact CG1-CB 4.45Å; D298-G300 VanDerWaalsContact C-N 3.26Å; D298-G300 PolarHBondContact O-N 2.79Å; D298-G300 WeakPolarHBondContact OD1-CA 3.41Å; D298-G300 PolarHBondContact OD1-N 2.83Å; D298-T301 PolarHBondContact O-N 2.53Å; D298-T301 PolarHBondContact OD1-N 2.92Å; D298-T301 WeakPolarHBondContact OD2-CB 3.4Å; D298-T301 PolarHBondContact OD2-OG1 3Å; D298-V401 HydrophobicContact CB-CG1 3.54Å; D298-I402 PolarHBondContact N-O 3.06Å; D298-G403 WeakPolarHBondContact O-CA 3.36Å
299	S	98.3	Very high	96.4	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.028	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.2	175.8	65.5	0	0	0	0	114.1	V103 D104 T105	V103-S299 PolarHBondContact O-OG 2.87Å; D104-S299 WeakPolarHBondContact CA-OG 3.19Å; T105-S299 PolarHBondContact N-OG 3.31Å; T105-S299 PolarHBondContact OG1-N 3.48Å
300	G	95.8	Very high	96.6	Very high	32 Å²	32	28 Å²	28	33%	0.33	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.9	178.2	0	0	0	0	0	113.5	D298	D298-G300 VanDerWaalsContact C-N 3.26Å; D298-G300 PolarHBondContact O-N 2.79Å; D298-G300 WeakPolarHBondContact OD1-CA 3.41Å; D298-G300 PolarHBondContact OD1-N 2.83Å
301	T	96.1	Very high	96.6	Very high	21 Å²	21	28.5 Å²	28.5	13%	0.129	16%	0.16	C	C	.	.			trans	-96.3	124.6	172.7	-69.2	0	0	0	0	110.2	D298 L303 R305 V401 G403 A404	D298-T301 PolarHBondContact O-N 2.53Å; D298-T301 PolarHBondContact OD1-N 2.92Å; D298-T301 WeakPolarHBondContact OD2-CB 3.4Å; D298-T301 PolarHBondContact OD2-OG1 3Å; T301-L303 WeakPolarHBondContact CG2-O 3.43Å; T301-R305 HydrophobicContact CG2-CG 3.83Å; T301-V401 HydrophobicContact CG2-CB 4.44Å; T301-V401 HydrophobicContact CG2-CG1 3.83Å; T301-G403 CarbonylContact O-C 2.93Å; T301-G403 WeakPolarHBondContact O-CA 3.14Å; T301-A404 PolarHBondContact O-N 2.87Å
302	T	93.3	Very high	96.7	Very high	37 Å²	37	32.3 Å²	32.3	23%	0.227	18%	0.18	C	C	.	.			trans	-61.4	-63.8	177.8	-60.5	0	0	0	0	112.8	S82 A404 T405	S82-T302 VanDerWaalsContact O-CB 3.23Å; S82-T302 WeakPolarHBondContact O-CB 3.12Å; S82-T302 WeakPolarHBondContact O-CG2 3.42Å; S82-T302 PolarHBondContact O-OG1 3.28Å; T302-A404 PolarHBondContact O-N 2.78Å; T302-T405 HydrophobicContact CG2-CG2 4.46Å; T302-T405 WeakPolarHBondContact O-CG2 3.39Å; T302-T405 PolarHBondContact O-N 2.94Å; T302-T405 PolarHBondContact O-OG1 3.13Å
303	L	95.8	Very high	96.9	Very high	36 Å²	36	29.4 Å²	29.4	19%	0.188	16%	0.164	C	C	.	.	S	Bend	trans	-85.9	159.9	-165.9	-54.7	177	0	0	0	112.4	T301 R305	T301-L303 WeakPolarHBondContact CG2-O 3.43Å; L303-R305 PolarHBondContact O-N 3.19Å
304	L	98.3	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	113	161	173.3	57.6	0	0	0	108.6	L306 L353 I355 G392 M393 S394 V401 T405 V406	L304-L306 HydrophobicContact CD1-CD2 3.96Å; L304-L306 HydrophobicContact CD2-CD2 4.28Å; L304-L306 HydrophobicContact CG-CD2 4.01Å; L304-L306 HydrophobicContact CG-CG 4.12Å; L304-L353 HydrophobicContact CD2-CD2 3.45Å; L304-L353 VanDerWaalsContact CD2-CD2 3.45Å; L304-I355 HydrophobicContact CD1-CD1 4.46Å; L304-G392 PolarHBondContact N-O 3.17Å; L304-M393 HydrophobicContact CB-CG 4.17Å; L304-M393 HydrophobicContact CD2-CE 4.34Å; L304-M393 HydrophobicContact CD2-CG 4.26Å; L304-M393 HydrophobicContact CD2-SD 4.02Å; L304-M393 HydrophobicContact CG-CG 4.47Å; L304-M393 CarbonylContact O-C 3.53Å; L304-M393 WeakPolarHBondContact O-CA 3.2Å; L304-M393 WeakPolarHBondContact O-CB 3.14Å; L304-S394 PolarHBondContact O-N 2.81Å; L304-V401 WeakPolarHBondContact CD1-O 3.29Å; L304-T405 PolarHBondContact N-OG1 2.81Å; L304-V406 HydrophobicContact CB-CG2 3.9Å; L304-V406 HydrophobicContact CD1-CG2 4.16Å; L304-V406 HydrophobicContact CD2-CG2 4.28Å; L304-V406 HydrophobicContact CG-CG2 4.33Å
305	R	98.1	Very high	97.3	Very high	35 Å²	35	24.2 Å²	24.2	13%	0.132	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	131.6	177	-49.4	-168.5	63.3	-142.7	-3.2	109.9	T301 L303 S394 P395 L400 V401	T301-R305 HydrophobicContact CG2-CG 3.83Å; L303-R305 PolarHBondContact O-N 3.19Å; R305-S394 WeakPolarHBondContact CA-O 3.4Å; R305-P395 PolarHBondContact NH2-O 3.05Å; R305-L400 CarbonylContact O-C 3.53Å; R305-L400 VanDerWaalsContact O-CA 3.29Å; R305-L400 WeakPolarHBondContact O-CA 3.33Å; R305-V401 HydrophobicContact CB-CB 3.89Å; R305-V401 HydrophobicContact CB-CG2 4.11Å; R305-V401 HydrophobicContact CG-CB 4.15Å; R305-V401 PolarHBondContact N-O 3.3Å; R305-V401 PolarHBondContact O-N 3.18Å
306	L	98.3	Very high	97.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.2	-176.1	-63.1	173.8	0	0	0	110.1	L276 L304 I308 V310 F311 V314 M393 S394 P395 S396 L400	L276-L306 HydrophobicContact CD2-CD2 4.05Å; L304-L306 HydrophobicContact CD1-CD2 3.96Å; L304-L306 HydrophobicContact CD2-CD2 4.28Å; L304-L306 HydrophobicContact CG-CD2 4.01Å; L304-L306 HydrophobicContact CG-CG 4.12Å; L306-I308 PolarHBondContact O-N 3.02Å; L306-V310 HydrophobicContact CB-CB 4.36Å; L306-V310 HydrophobicContact CB-CG1 4.26Å; L306-V310 HydrophobicContact CD1-CG1 4.38Å; L306-V310 HydrophobicContact CD2-CG1 4.14Å; L306-V310 HydrophobicContact CG-CG1 4.5Å; L306-F311 HydrophobicContact CB-CB 3.93Å; L306-V314 HydrophobicContact CD1-CB 4.28Å; L306-V314 HydrophobicContact CD1-CG2 3.88Å; L306-M393 HydrophobicContact CD1-SD 4.18Å; L306-S394 PolarHBondContact N-O 3.32Å; L306-P395 CarbonylContact O-C 3.41Å; L306-P395 WeakPolarHBondContact O-CA 3.42Å; L306-S396 WeakPolarHBondContact O-CB 3.31Å; L306-S396 PolarHBondContact O-N 3.22Å; L306-L400 HydrophobicContact CD2-CD1 3.69Å; L306-L400 HydrophobicContact CD2-CG 4Å
307	P	97.7	Very high	97	Very high	11 Å²	11	31.2 Å²	31.2	7%	0.071	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	141.7	167.8	-27.5	36.4	0	0	0	110.5	E289 N309 V310 F311 S396 L400	E289-P307 WeakPolarHBondContact O-CG 3.19Å; P307-N309 PolarHBondContact O-N 2.8Å; P307-N309 VanDerWaalsContact O-N 3.09Å; P307-V310 HydrophobicContact CB-CB 4.38Å; P307-V310 HydrophobicContact CB-CG2 4.07Å; P307-V310 HydrophobicContact CG-CG2 4.27Å; P307-V310 CarbonylContact O-C 3.58Å; P307-V310 WeakPolarHBondContact O-CA 3.12Å; P307-V310 WeakPolarHBondContact O-CB 3.44Å; P307-V310 PolarHBondContact O-N 3.07Å; P307-F311 PolarHBondContact O-N 3.2Å; P307-S396 WeakPolarHBondContact CA-O 3.19Å; P307-L400 HydrophobicContact CG-CB 4.35Å
308	I	96.2	Very high	96.7	Very high	88 Å²	88	31.2 Å²	31.2	45%	0.451	17%	0.172	S	C	.	.	H	α-helix	trans	-50.2	-43.7	-169.8	-66.3	166	0	0	0	112.4	L306 F311 N312 P395 S396	L306-I308 PolarHBondContact O-N 3.02Å; I308-F311 PolarHBondContact O-N 3.38Å; I308-N312 WeakPolarHBondContact O-CB 3.34Å; I308-N312 PolarHBondContact O-N 3.19Å; I308-N312 PolarHBondContact O-ND2 3.16Å; I308-P395 HydrophobicContact CG1-CB 4.23Å; I308-S396 PolarHBondContact N-O 3.04Å
309	N	96.4	Very high	96.4	Very high	90 Å²	90	33.4 Å²	33.4	48%	0.481	19%	0.186	S	C	.	.	H	α-helix	trans	-63.1	-43.8	178	-65.2	-16.3	0	0	0	112.3	E289 P307 N312 A313	E289-N309 PolarHBondContact OE2-ND2 3.07Å; P307-N309 PolarHBondContact O-N 2.8Å; P307-N309 VanDerWaalsContact O-N 3.09Å; N309-N312 PolarHBondContact O-N 2.88Å; N309-A313 WeakPolarHBondContact O-CB 3.22Å; N309-A313 PolarHBondContact O-N 3.05Å
310	V	98.3	Very high	96	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-44.1	178	-179.1	0	0	0	0	110.6	L276 L283 L285 E289 Y290 L306 P307 N312 A313 V314	L276-V310 HydrophobicContact CD2-CG1 3.8Å; L283-V310 HydrophobicContact CD1-CG1 4.29Å; L285-V310 HydrophobicContact CD1-CB 4.44Å; L285-V310 HydrophobicContact CD1-CG2 4.02Å; E289-V310 HydrophobicContact CB-CG2 4.14Å; E289-V310 WeakPolarHBondContact O-CG2 3.21Å; Y290-V310 HydrophobicContact CD1-CB 4.42Å; Y290-V310 HydrophobicContact CD1-CG1 3.81Å; Y290-V310 HydrophobicContact CD1-CG2 3.66Å; Y290-V310 HydrophobicContact CE1-CG1 3.97Å; Y290-V310 HydrophobicContact CE1-CG2 4.07Å; L306-V310 HydrophobicContact CB-CB 4.36Å; L306-V310 HydrophobicContact CB-CG1 4.26Å; L306-V310 HydrophobicContact CD1-CG1 4.38Å; L306-V310 HydrophobicContact CD2-CG1 4.14Å; L306-V310 HydrophobicContact CG-CG1 4.5Å; P307-V310 HydrophobicContact CB-CB 4.38Å; P307-V310 HydrophobicContact CB-CG2 4.07Å; P307-V310 HydrophobicContact CG-CG2 4.27Å; P307-V310 CarbonylContact O-C 3.58Å; P307-V310 WeakPolarHBondContact O-CA 3.12Å; P307-V310 WeakPolarHBondContact O-CB 3.44Å; P307-V310 PolarHBondContact O-N 3.07Å; V310-N312 PolarHBondContact O-N 3.01Å; V310-A313 PolarHBondContact O-N 3.03Å; V310-V314 WeakPolarHBondContact O-CG2 3.43Å; V310-V314 PolarHBondContact O-N 2.82Å
311	F	98.1	Very high	95.5	Very high	13 Å²	13	41.9 Å²	41.9	6%	0.057	22%	0.216	C	C	.	.	H	α-helix	trans	-56.7	-49.7	176.2	179.4	-96	0	0	0	111.2	L306 P307 I308 A313 V314 V315 W332 F391 M393 P395	L306-F311 HydrophobicContact CB-CB 3.93Å; P307-F311 PolarHBondContact O-N 3.2Å; I308-F311 PolarHBondContact O-N 3.38Å; F311-A313 PolarHBondContact O-N 3.42Å; F311-V314 PolarHBondContact O-N 2.82Å; F311-V315 HydrophobicContact CD1-CG2 4.23Å; F311-V315 HydrophobicContact CE1-CG2 3.76Å; F311-V315 HydrophobicContact CE2-CG2 4.2Å; F311-V315 HydrophobicContact CZ-CG2 3.73Å; F311-V315 WeakPolarHBondContact O-CG2 3.16Å; F311-V315 PolarHBondContact O-N 2.79Å; F311-W332 WeakPolarHBondContact CZ-O 3.17Å; F311-F391 HydrophobicContact CE2-CD1 4.3Å; F311-F391 AromaticContact CE2-CE1 3.78Å; F311-F391 HydrophobicContact CE2-CE1 3.78Å; F311-F391 HydrophobicContact CZ-CD1 4.43Å; F311-F391 HydrophobicContact CZ-CE1 4.09Å; F311-M393 HydrophobicContact CE2-CB 4.21Å; F311-P395 HydrophobicContact CB-CB 4.31Å; F311-P395 HydrophobicContact CD1-CB 4.01Å; F311-P395 HydrophobicContact CD1-CG 4.43Å; F311-P395 HydrophobicContact CD2-CB 4.49Å; F311-P395 HydrophobicContact CE1-CG 4.44Å; F311-P395 HydrophobicContact CG-CB 4.01Å
312	N	97.1	Very high	94.9	Very high	86 Å²	86	41.6 Å²	41.6	46%	0.46	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-43.8	179.2	-69.4	-19.8	0	0	0	111.6	I308 N309 V310 V314 V315 E316	I308-N312 WeakPolarHBondContact O-CB 3.34Å; I308-N312 PolarHBondContact O-N 3.19Å; I308-N312 PolarHBondContact O-ND2 3.16Å; N309-N312 PolarHBondContact O-N 2.88Å; V310-N312 PolarHBondContact O-N 3.01Å; N312-V314 PolarHBondContact O-N 2.84Å; N312-V315 PolarHBondContact O-N 3.43Å; N312-E316 WeakPolarHBondContact O-CB 3.33Å; N312-E316 PolarHBondContact O-N 2.78Å
313	A	97.8	Very high	94.2	Very high	16 Å²	16	48.1 Å²	48.1	13%	0.132	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-38.3	177.4	0	0	0	0	0	112.8	L283 L285 N309 V310 F311 T317	L283-A313 HydrophobicContact CD1-CB 4.4Å; L283-A313 HydrophobicContact CD2-CB 4.4Å; L285-A313 HydrophobicContact CD1-CB 3.94Å; N309-A313 WeakPolarHBondContact O-CB 3.22Å; N309-A313 PolarHBondContact O-N 3.05Å; V310-A313 PolarHBondContact O-N 3.03Å; F311-A313 PolarHBondContact O-N 3.42Å; A313-T317 WeakPolarHBondContact O-CB 3.48Å; A313-T317 PolarHBondContact O-N 3.27Å; A313-T317 PolarHBondContact O-OG1 3.43Å
314	V	97.6	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-52	173.2	168.6	0	0	0	0	110.4	L276 V278 L283 L306 V310 F311 N312 E316 T317 I318 L353 M393	L276-V314 HydrophobicContact CD2-CG2 4.26Å; V278-V314 HydrophobicContact CG2-CB 4.48Å; V278-V314 HydrophobicContact CG2-CG1 4.16Å; V278-V314 HydrophobicContact CG2-CG2 4.29Å; L283-V314 HydrophobicContact CD1-CG2 3.59Å; L283-V314 HydrophobicContact CD2-CG2 4.3Å; L306-V314 HydrophobicContact CD1-CB 4.28Å; L306-V314 HydrophobicContact CD1-CG2 3.88Å; V310-V314 WeakPolarHBondContact O-CG2 3.43Å; V310-V314 PolarHBondContact O-N 2.82Å; F311-V314 PolarHBondContact O-N 2.82Å; N312-V314 PolarHBondContact O-N 2.84Å; V314-E316 VanDerWaalsContact C-N 3.34Å; V314-E316 PolarHBondContact O-N 2.91Å; V314-T317 PolarHBondContact O-N 3.06Å; V314-I318 HydrophobicContact CG1-CD1 3.68Å; V314-I318 HydrophobicContact CG1-CG1 4.3Å; V314-I318 WeakPolarHBondContact O-CG1 3.38Å; V314-I318 PolarHBondContact O-N 3.48Å; V314-L353 HydrophobicContact CG1-CD1 4.48Å; V314-L353 HydrophobicContact CG2-CD1 4.45Å; V314-M393 HydrophobicContact CG1-SD 3.97Å
315	V	95.9	Very high	92.1	Very high	19 Å²	19	53.8 Å²	53.8	12%	0.115	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-43.6	-179.7	167.5	0	0	0	0	111.7	F311 N312 I318 T319 W332 F391	F311-V315 HydrophobicContact CD1-CG2 4.23Å; F311-V315 HydrophobicContact CE1-CG2 3.76Å; F311-V315 HydrophobicContact CE2-CG2 4.2Å; F311-V315 HydrophobicContact CZ-CG2 3.73Å; F311-V315 WeakPolarHBondContact O-CG2 3.16Å; F311-V315 PolarHBondContact O-N 2.79Å; N312-V315 PolarHBondContact O-N 3.43Å; V315-I318 PolarHBondContact O-N 3.37Å; V315-T319 VanDerWaalsContact O-CB 3.32Å; V315-T319 WeakPolarHBondContact O-CB 3.27Å; V315-T319 PolarHBondContact O-N 3.36Å; V315-T319 PolarHBondContact O-OG1 2.87Å; V315-W332 HydrophobicContact CB-CD2 4.5Å; V315-W332 HydrophobicContact CG1-CB 4.26Å; V315-W332 HydrophobicContact CG1-CD2 3.65Å; V315-W332 HydrophobicContact CG1-CE3 4.28Å; V315-W332 HydrophobicContact CG1-CG 3.62Å; V315-W332 HydrophobicContact CG1-CZ2 4.39Å; V315-W332 HydrophobicContact CG2-CB 4.27Å; V315-W332 HydrophobicContact CG2-CD2 4.14Å; V315-W332 HydrophobicContact CG2-CE3 4.05Å; V315-W332 HydrophobicContact CG2-CG 4.27Å; V315-F391 HydrophobicContact CG2-CE1 4.08Å; V315-F391 HydrophobicContact CG2-CZ 4.46Å
316	E	94.8	Very high	91.1	Very high	137 Å²	137	58.8 Å²	58.8	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-61.3	-44.9	176.4	-176	179.9	178	0	0	111.3	N312 V314 T319 R320	N312-E316 WeakPolarHBondContact O-CB 3.33Å; N312-E316 PolarHBondContact O-N 2.78Å; V314-E316 VanDerWaalsContact C-N 3.34Å; V314-E316 PolarHBondContact O-N 2.91Å; E316-T319 PolarHBondContact O-N 3.43Å; E316-R320 WeakPolarHBondContact O-CB 3.38Å; E316-R320 PolarHBondContact O-N 2.96Å
317	T	95.4	Very high	90.1	Very high	15 Å²	15	60.1 Å²	60.1	9%	0.092	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-40	-179.9	-53.6	0	0	0	0	111.8	V278 Q281 A313 V314 S321	V278-T317 HydrophobicContact CB-CG2 3.65Å; V278-T317 HydrophobicContact CG1-CG2 3.82Å; V278-T317 HydrophobicContact CG2-CG2 4.34Å; Q281-T317 HydrophobicContact CB-CG2 4.35Å; A313-T317 WeakPolarHBondContact O-CB 3.48Å; A313-T317 PolarHBondContact O-N 3.27Å; A313-T317 PolarHBondContact O-OG1 3.43Å; V314-T317 PolarHBondContact O-N 3.06Å; T317-S321 VanDerWaalsContact O-CB 3.32Å; T317-S321 WeakPolarHBondContact O-CB 3.3Å; T317-S321 PolarHBondContact O-N 2.58Å; T317-S321 PolarHBondContact O-OG 3.35Å
318	I	94.1	Very high	89.5	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-48.2	173.2	-65.3	171.9	0	0	0	109.9	V278 V314 V315 R320 S321 S322 W332 F350 P351 Y375 F391	V278-I318 HydrophobicContact CG1-CG1 3.63Å; V314-I318 HydrophobicContact CG1-CD1 3.68Å; V314-I318 HydrophobicContact CG1-CG1 4.3Å; V314-I318 WeakPolarHBondContact O-CG1 3.38Å; V314-I318 PolarHBondContact O-N 3.48Å; V315-I318 PolarHBondContact O-N 3.37Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.01Å; I318-S321 PolarHBondContact O-N 3.41Å; I318-S321 PolarHBondContact O-OG 3.43Å; I318-S322 VanDerWaalsContact O-CB 3.22Å; I318-S322 WeakPolarHBondContact O-CB 3.07Å; I318-S322 PolarHBondContact O-N 2.84Å; I318-W332 HydrophobicContact CB-CH2 4.23Å; I318-W332 HydrophobicContact CG2-CH2 3.61Å; I318-W332 HydrophobicContact CG2-CZ2 4.5Å; I318-W332 HydrophobicContact CG2-CZ3 4.26Å; I318-F350 HydrophobicContact CG2-CD1 4.25Å; I318-P351 HydrophobicContact CG1-CG 3.92Å; I318-P351 HydrophobicContact CG2-CG 4.41Å; I318-Y375 HydrophobicContact CD1-CE2 4.46Å; I318-F391 HydrophobicContact CD1-CE2 4.14Å; I318-F391 HydrophobicContact CD1-CZ 4.07Å
319	T	91.6	Very high	89	Confident	59 Å²	59	61.2 Å²	61.2	36%	0.362	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-39.8	-178.4	-57.6	0	0	0	0	111.7	V315 E316 F327 W332	V315-T319 VanDerWaalsContact O-CB 3.32Å; V315-T319 WeakPolarHBondContact O-CB 3.27Å; V315-T319 PolarHBondContact O-N 3.36Å; V315-T319 PolarHBondContact O-OG1 2.87Å; E316-T319 PolarHBondContact O-N 3.43Å; T319-F327 HydrophobicContact CG2-CD2 4.4Å; T319-W332 WeakPolarHBondContact OG1-CZ2 3.28Å
320	R	88.9	Confident	88.6	Confident	161 Å²	161	57 Å²	57	61%	0.608	30%	0.298	S	S	*	.	H	α-helix	trans	-73.7	-29.7	178.2	-176.1	174.2	59.5	81.1	1.3	113.6	E316 I318	E316-R320 WeakPolarHBondContact O-CB 3.38Å; E316-R320 PolarHBondContact O-N 2.96Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.01Å
321	S	86.1	Confident	88.3	Confident	53 Å²	53	57.3 Å²	57.3	37%	0.371	30%	0.299	S	S	.	.	H	α-helix	trans	-93.3	-22.2	-176.8	58.4	0	0	0	0	113.7	T317 I318	T317-S321 VanDerWaalsContact O-CB 3.32Å; T317-S321 WeakPolarHBondContact O-CB 3.3Å; T317-S321 PolarHBondContact O-N 2.58Å; T317-S321 PolarHBondContact O-OG 3.35Å; I318-S321 PolarHBondContact O-N 3.41Å; I318-S321 PolarHBondContact O-OG 3.43Å
322	S	82.8	Confident	88.1	Confident	16 Å²	16	57.8 Å²	57.8	11%	0.112	30%	0.3	C	S	.	.	S	Bend	trans	-75	149.2	178.7	-172	0	0	0	0	111.9	I318 I324 L349	I318-S322 VanDerWaalsContact O-CB 3.22Å; I318-S322 WeakPolarHBondContact O-CB 3.07Å; I318-S322 PolarHBondContact O-N 2.84Å; S322-I324 PolarHBondContact O-N 2.67Å; S322-I324 PolarHBondContact OG-N 3.29Å; S322-L349 WeakPolarHBondContact CB-O 3.44Å; S322-L349 PolarHBondContact OG-O 3Å
323	Q	79.7	Confident	87.6	Confident	174 Å²	174	58 Å²	58	81%	0.813	30%	0.302	S	S	*	.	S	Bend	trans	-82.1	1	174.4	-62	179.7	1.6	0	0	112.9	E325 L349	Q323-E325 PolarHBondContact O-N 2.82Å; Q323-L349 HydrophobicContact CB-CD2 4.42Å
324	I	81.5	Confident	87.1	Confident	20 Å²	20	59.5 Å²	59.5	10%	0.103	32%	0.319	C	S	.	.			trans	-78	119	-179.9	-67.2	165.9	0	0	0	109.5	L29 S322 N326 F327 W340 L349 F350	L29-I324 HydrophobicContact CD1-CG2 4.02Å; S322-I324 PolarHBondContact O-N 2.67Å; S322-I324 PolarHBondContact OG-N 3.29Å; I324-N326 PolarHBondContact O-N 2.84Å; I324-F327 HydrophobicContact CB-CD2 4.3Å; I324-F327 HydrophobicContact CB-CE1 4.42Å; I324-F327 HydrophobicContact CB-CE2 3.66Å; I324-F327 HydrophobicContact CB-CZ 3.75Å; I324-F327 HydrophobicContact CD1-CE1 3.75Å; I324-F327 HydrophobicContact CD1-CE2 4.19Å; I324-F327 HydrophobicContact CD1-CZ 3.36Å; I324-F327 HydrophobicContact CG1-CE2 4.48Å; I324-F327 HydrophobicContact CG1-CZ 4.1Å; I324-F327 HydrophobicContact CG2-CD1 4.31Å; I324-F327 HydrophobicContact CG2-CD2 4.02Å; I324-F327 HydrophobicContact CG2-CE1 4.12Å; I324-F327 HydrophobicContact CG2-CE2 3.83Å; I324-F327 HydrophobicContact CG2-CG 4.29Å; I324-F327 HydrophobicContact CG2-CZ 3.9Å; I324-W340 HydrophobicContact CD1-CZ2 4.1Å; I324-L349 HydrophobicContact CD1-CB 3.88Å; I324-L349 HydrophobicContact CD1-CD1 3.95Å; I324-L349 HydrophobicContact CG1-CB 4.21Å; I324-L349 HydrophobicContact CG1-CD1 3.95Å; I324-F350 HydrophobicContact CD1-CE2 4.15Å; I324-F350 HydrophobicContact CD1-CZ 3.99Å
325	E	68.6	Low	86.7	Confident	134 Å²	134	64.6 Å²	64.6	63%	0.626	35%	0.35	S	S	*	.	S	Bend	trans	-59.4	-40.3	-171.6	-72.5	-172.2	161.8	0	0	114.3	S26 Q323	S26-E325 WeakPolarHBondContact CB-OE1 3.4Å; Q323-E325 PolarHBondContact O-N 2.82Å
326	N	75.8	Confident	86.4	Confident	140 Å²	140	68.1 Å²	68.1	75%	0.749	36%	0.364	S	S	*	.			trans	-151.6	111.6	-179.2	-80.2	-53.7	0	0	0	111	I324	I324-N326 PolarHBondContact O-N 2.84Å
327	F	78.7	Confident	86.2	Confident	28 Å²	28	64.8 Å²	64.8	12%	0.123	35%	0.35	C	S	.	.			trans	-78.8	128.1	163	-70.5	-86.4	0	0	0	109.6	T319 I324 S329 F331 W332 F350	T319-F327 HydrophobicContact CG2-CD2 4.4Å; I324-F327 HydrophobicContact CB-CD2 4.3Å; I324-F327 HydrophobicContact CB-CE1 4.42Å; I324-F327 HydrophobicContact CB-CE2 3.66Å; I324-F327 HydrophobicContact CB-CZ 3.75Å; I324-F327 HydrophobicContact CD1-CE1 3.75Å; I324-F327 HydrophobicContact CD1-CE2 4.19Å; I324-F327 HydrophobicContact CD1-CZ 3.36Å; I324-F327 HydrophobicContact CG1-CE2 4.48Å; I324-F327 HydrophobicContact CG1-CZ 4.1Å; I324-F327 HydrophobicContact CG2-CD1 4.31Å; I324-F327 HydrophobicContact CG2-CD2 4.02Å; I324-F327 HydrophobicContact CG2-CE1 4.12Å; I324-F327 HydrophobicContact CG2-CE2 3.83Å; I324-F327 HydrophobicContact CG2-CG 4.29Å; I324-F327 HydrophobicContact CG2-CZ 3.9Å; F327-S329 PolarHBondContact O-N 3.24Å; F327-F331 AromaticContact CD1-CD1 3.68Å; F327-F331 HydrophobicContact CD1-CD1 3.68Å; F327-F331 HydrophobicContact CD1-CE1 4.07Å; F327-F331 HydrophobicContact CD1-CG 4.49Å; F327-F331 HydrophobicContact CE1-CD1 4.08Å; F327-F331 AromaticContact CE1-CE1 3.97Å; F327-F331 HydrophobicContact CE1-CE1 3.97Å; F327-W332 HydrophobicContact CB-CZ2 3.66Å; F327-W332 AromaticContact CD1-CH2 3.87Å; F327-W332 HydrophobicContact CD1-CH2 3.87Å; F327-W332 AromaticContact CD1-CZ2 3.53Å; F327-W332 HydrophobicContact CD1-CZ2 3.53Å; F327-W332 HydrophobicContact CD2-CH2 4.14Å; F327-W332 AromaticContact CD2-CZ2 3.42Å; F327-W332 HydrophobicContact CD2-CZ2 3.42Å; F327-W332 VanDerWaalsContact CD2-CZ2 3.42Å; F327-W332 AromaticContact CE1-CH2 3.79Å; F327-W332 HydrophobicContact CE1-CH2 3.79Å; F327-W332 AromaticContact CE1-CZ2 3.9Å; F327-W332 HydrophobicContact CE1-CZ2 3.9Å; F327-W332 HydrophobicContact CE2-CH2 4.05Å; F327-W332 AromaticContact CE2-CZ2 3.78Å; F327-W332 HydrophobicContact CE2-CZ2 3.78Å; F327-W332 AromaticContact CG-CE2 3.78Å; F327-W332 HydrophobicContact CG-CH2 4.02Å; F327-W332 AromaticContact CG-CZ2 3.24Å; F327-W332 HydrophobicContact CG-CZ2 3.24Å; F327-W332 AromaticContact CZ-CH2 3.86Å; F327-W332 HydrophobicContact CZ-CH2 3.86Å; F327-W332 AromaticContact CZ-CZ2 3.99Å; F327-W332 HydrophobicContact CZ-CZ2 3.99Å; F327-F350 AromaticContact CE1-CE1 3.7Å; F327-F350 HydrophobicContact CE1-CE1 3.7Å; F327-F350 AromaticContact CE1-CZ 3.75Å; F327-F350 HydrophobicContact CE1-CZ 3.75Å; F327-F350 AromaticContact CZ-CE1 3.7Å; F327-F350 HydrophobicContact CZ-CE1 3.7Å; F327-F350 HydrophobicContact CZ-CZ 4.01Å
328	S	84.4	Confident	85.9	Confident	33 Å²	33	64.5 Å²	64.5	23%	0.231	35%	0.349	C	S	.	.			trans	-62.8	134.2	164.4	170.2	0	0	0	0	108.3	G330 F331 K336	S328-G330 PolarHBondContact O-N 2.9Å; S328-G330 PolarHBondContact OG-N 2.84Å; S328-F331 WeakPolarHBondContact O-CB 3.26Å; S328-F331 PolarHBondContact O-N 2.61Å; S328-K336 WeakPolarHBondContact OG-CD 3.26Å; S328-K336 PolarHBondContact OG-NZ 3.04Å
329	S	84.9	Confident	85.6	Confident	90 Å²	90	65.6 Å²	65.6	63%	0.629	36%	0.356	S	S	*	.	H	α-helix	trans	-50	-36.8	173.9	54.8	0	0	0	0	112.6	F327 F331 W332 D333	F327-S329 PolarHBondContact O-N 3.24Å; S329-F331 PolarHBondContact O-N 3.13Å; S329-F331 VanDerWaalsContact O-N 3.14Å; S329-W332 PolarHBondContact O-N 2.78Å; S329-D333 PolarHBondContact O-N 2.82Å
330	G	88.3	Confident	85.5	Confident	2 Å²	2	63.6 Å²	63.6	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-58.1	-21	175.4	0	0	0	0	0	116.2	S328 D333 G334 T335 K336	S328-G330 PolarHBondContact O-N 2.9Å; S328-G330 PolarHBondContact OG-N 2.84Å; G330-D333 VanDerWaalsContact C-OD1 3.31Å; G330-D333 WeakPolarHBondContact CA-OD1 3.49Å; G330-G334 PolarHBondContact O-N 2.62Å; G330-T335 WeakPolarHBondContact CA-OG1 3.4Å; G330-T335 CarbonylContact O-C 3.57Å; G330-T335 PolarHBondContact O-N 2.95Å; G330-T335 PolarHBondContact O-OG1 2.93Å; G330-K336 PolarHBondContact O-N 2.96Å
331	F	92.4	Very high	85.4	Confident	6 Å²	6	61 Å²	61	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-71.8	-41.9	173.9	174.8	-109.7	0	0	0	110.9	F327 S328 S329 G334 A338 F350 I376 F391	F327-F331 AromaticContact CD1-CD1 3.68Å; F327-F331 HydrophobicContact CD1-CD1 3.68Å; F327-F331 HydrophobicContact CD1-CE1 4.07Å; F327-F331 HydrophobicContact CD1-CG 4.49Å; F327-F331 HydrophobicContact CE1-CD1 4.08Å; F327-F331 AromaticContact CE1-CE1 3.97Å; F327-F331 HydrophobicContact CE1-CE1 3.97Å; S328-F331 WeakPolarHBondContact O-CB 3.26Å; S328-F331 PolarHBondContact O-N 2.61Å; S329-F331 PolarHBondContact O-N 3.13Å; S329-F331 VanDerWaalsContact O-N 3.14Å; F331-G334 PolarHBondContact O-N 2.8Å; F331-A338 HydrophobicContact CD2-CB 3.68Å; F331-A338 HydrophobicContact CE2-CB 3.64Å; F331-A338 HydrophobicContact CG-CB 4.44Å; F331-A338 HydrophobicContact CZ-CB 4.39Å; F331-F350 HydrophobicContact CE1-CE1 4.18Å; F331-F350 HydrophobicContact CE1-CZ 4.26Å; F331-F350 HydrophobicContact CZ-CE1 4.47Å; F331-F350 HydrophobicContact CZ-CZ 4.22Å; F331-I376 HydrophobicContact CZ-CD1 4.12Å; F331-F391 HydrophobicContact CD1-CB 4.39Å; F331-F391 HydrophobicContact CE1-CB 4.02Å; F331-F391 HydrophobicContact CE1-CD2 4.11Å; F331-F391 HydrophobicContact CE1-CG 4.3Å; F331-F391 HydrophobicContact CE2-CB 4.24Å; F331-F391 HydrophobicContact CZ-CB 3.94Å; F331-F391 HydrophobicContact CZ-CD2 4.35Å; F331-F391 WeakPolarHBondContact O-CB 3.12Å
332	W	93.2	Very high	85.1	Confident	22 Å²	22	65 Å²	65	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-70.7	-39.7	-178.1	-55.7	126.1	0	0	0	112.4	F311 V315 I318 T319 F327 S329 G334 F391	F311-W332 WeakPolarHBondContact CZ-O 3.17Å; V315-W332 HydrophobicContact CB-CD2 4.5Å; V315-W332 HydrophobicContact CG1-CB 4.26Å; V315-W332 HydrophobicContact CG1-CD2 3.65Å; V315-W332 HydrophobicContact CG1-CE3 4.28Å; V315-W332 HydrophobicContact CG1-CG 3.62Å; V315-W332 HydrophobicContact CG1-CZ2 4.39Å; V315-W332 HydrophobicContact CG2-CB 4.27Å; V315-W332 HydrophobicContact CG2-CD2 4.14Å; V315-W332 HydrophobicContact CG2-CE3 4.05Å; V315-W332 HydrophobicContact CG2-CG 4.27Å; I318-W332 HydrophobicContact CB-CH2 4.23Å; I318-W332 HydrophobicContact CG2-CH2 3.61Å; I318-W332 HydrophobicContact CG2-CZ2 4.5Å; I318-W332 HydrophobicContact CG2-CZ3 4.26Å; T319-W332 WeakPolarHBondContact OG1-CZ2 3.28Å; F327-W332 HydrophobicContact CB-CZ2 3.66Å; F327-W332 AromaticContact CD1-CH2 3.87Å; F327-W332 HydrophobicContact CD1-CH2 3.87Å; F327-W332 AromaticContact CD1-CZ2 3.53Å; F327-W332 HydrophobicContact CD1-CZ2 3.53Å; F327-W332 HydrophobicContact CD2-CH2 4.14Å; F327-W332 AromaticContact CD2-CZ2 3.42Å; F327-W332 HydrophobicContact CD2-CZ2 3.42Å; F327-W332 VanDerWaalsContact CD2-CZ2 3.42Å; F327-W332 AromaticContact CE1-CH2 3.79Å; F327-W332 HydrophobicContact CE1-CH2 3.79Å; F327-W332 AromaticContact CE1-CZ2 3.9Å; F327-W332 HydrophobicContact CE1-CZ2 3.9Å; F327-W332 HydrophobicContact CE2-CH2 4.05Å; F327-W332 AromaticContact CE2-CZ2 3.78Å; F327-W332 HydrophobicContact CE2-CZ2 3.78Å; F327-W332 AromaticContact CG-CE2 3.78Å; F327-W332 HydrophobicContact CG-CH2 4.02Å; F327-W332 AromaticContact CG-CZ2 3.24Å; F327-W332 HydrophobicContact CG-CZ2 3.24Å; F327-W332 AromaticContact CZ-CH2 3.86Å; F327-W332 HydrophobicContact CZ-CH2 3.86Å; F327-W332 AromaticContact CZ-CZ2 3.99Å; F327-W332 HydrophobicContact CZ-CZ2 3.99Å; S329-W332 PolarHBondContact O-N 2.78Å; W332-G334 PolarHBondContact O-N 2.85Å; W332-F391 AromaticContact CE3-CD1 3.78Å; W332-F391 HydrophobicContact CE3-CD1 3.78Å; W332-F391 AromaticContact CE3-CD2 3.97Å; W332-F391 HydrophobicContact CE3-CD2 3.97Å; W332-F391 AromaticContact CE3-CE1 3.73Å; W332-F391 HydrophobicContact CE3-CE1 3.73Å; W332-F391 AromaticContact CE3-CE2 3.98Å; W332-F391 HydrophobicContact CE3-CE2 3.98Å; W332-F391 AromaticContact CE3-CG 3.88Å; W332-F391 HydrophobicContact CE3-CG 3.88Å; W332-F391 AromaticContact CE3-CZ 3.85Å; W332-F391 HydrophobicContact CE3-CZ 3.85Å; W332-F391 HydrophobicContact CZ3-CD1 4.4Å; W332-F391 AromaticContact CZ3-CD2 3.8Å; W332-F391 HydrophobicContact CZ3-CD2 3.8Å; W332-F391 HydrophobicContact CZ3-CE1 4.2Å; W332-F391 AromaticContact CZ3-CE2 3.62Å; W332-F391 HydrophobicContact CZ3-CE2 3.62Å; W332-F391 HydrophobicContact CZ3-CG 4.21Å; W332-F391 AromaticContact CZ3-CZ 3.82Å; W332-F391 HydrophobicContact CZ3-CZ 3.82Å
333	D	87.8	Confident	85	Confident	91 Å²	91	70.5 Å²	70.5	49%	0.487	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-1.4	176.5	66.9	25.7	0	0	0	113.8	S329 G330 T335	S329-D333 PolarHBondContact O-N 2.82Å; G330-D333 VanDerWaalsContact C-OD1 3.31Å; G330-D333 WeakPolarHBondContact CA-OD1 3.49Å; D333-T335 VanDerWaalsContact C-N 3.32Å; D333-T335 PolarHBondContact O-N 3.07Å; D333-T335 VanDerWaalsContact OD1-CB 3.23Å; D333-T335 WeakPolarHBondContact OD1-CB 3.29Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.17Å; D333-T335 PolarHBondContact OD1-N 2.95Å; D333-T335 PolarHBondContact OD1-OG1 2.84Å
334	G	87.4	Confident	85.3	Confident	48 Å²	48	65.5 Å²	65.5	50%	0.495	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	6.5	177.9	0	0	0	0	0	115.2	G330 F331 W332 K336	G330-G334 PolarHBondContact O-N 2.62Å; F331-G334 PolarHBondContact O-N 2.8Å; W332-G334 PolarHBondContact O-N 2.85Å; G334-K336 VanDerWaalsContact C-N 3.33Å
335	T	88.2	Confident	85.3	Confident	107 Å²	107	69.3 Å²	69.3	66%	0.656	37%	0.372	S	S	*	.	S	Bend	trans	-79.2	-13.9	177.4	61.6	0	0	0	0	114	G330 D333	G330-T335 WeakPolarHBondContact CA-OG1 3.4Å; G330-T335 CarbonylContact O-C 3.57Å; G330-T335 PolarHBondContact O-N 2.95Å; G330-T335 PolarHBondContact O-OG1 2.93Å; D333-T335 VanDerWaalsContact C-N 3.32Å; D333-T335 PolarHBondContact O-N 3.07Å; D333-T335 VanDerWaalsContact OD1-CB 3.23Å; D333-T335 WeakPolarHBondContact OD1-CB 3.29Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.17Å; D333-T335 PolarHBondContact OD1-N 2.95Å; D333-T335 PolarHBondContact OD1-OG1 2.84Å
336	K	89.9	Confident	86.2	Confident	93 Å²	93	63 Å²	63	40%	0.404	34%	0.342	S	S	.	.	S	Bend	trans	-133.8	151.3	177.8	-62.5	-175.7	-172.6	173.7	0	111.5	S328 G330 G334	S328-K336 WeakPolarHBondContact OG-CD 3.26Å; S328-K336 PolarHBondContact OG-NZ 3.04Å; G330-K336 PolarHBondContact O-N 2.96Å; G334-K336 VanDerWaalsContact C-N 3.33Å
337	L	89.7	Confident	86.8	Confident	67 Å²	67	57.3 Å²	57.3	35%	0.351	31%	0.312	S	S	.	.			trans	-97.5	148.9	171.8	-54.6	179.7	0	0	0	110.2	I379 C388 F389 R390	L337-I379 HydrophobicContact CD1-CB 4.33Å; L337-I379 HydrophobicContact CD1-CG1 4.1Å; L337-I379 HydrophobicContact CD1-CG2 4.39Å; L337-I379 HydrophobicContact CD2-CG1 3.87Å; L337-C388 HydrophobicContact CB-CB 4.15Å; L337-C388 HydrophobicContact CD1-CB 4.05Å; L337-F389 WeakPolarHBondContact CA-O 3.38Å; L337-R390 HydrophobicContact CD2-CB 3.7Å
338	A	89.5	Confident	87.3	Confident	8 Å²	8	64.6 Å²	64.6	7%	0.066	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.6	167.8	0	0	0	0	0	108.7	L29 F331 W340 C388 F389	L29-A338 HydrophobicContact CD2-CB 4.36Å; F331-A338 HydrophobicContact CD2-CB 3.68Å; F331-A338 HydrophobicContact CE2-CB 3.64Å; F331-A338 HydrophobicContact CG-CB 4.44Å; F331-A338 HydrophobicContact CZ-CB 4.39Å; A338-W340 VanDerWaalsContact C-CZ3 3.45Å; A338-W340 HydrophobicContact CB-CE3 4.35Å; A338-W340 HydrophobicContact CB-CH2 3.38Å; A338-W340 HydrophobicContact CB-CZ2 4.44Å; A338-W340 HydrophobicContact CB-CZ3 3.32Å; A338-W340 WeakPolarHBondContact O-CZ3 3.36Å; A338-C388 CarbonylContact O-C 3.47Å; A338-C388 WeakPolarHBondContact O-CA 3.26Å; A338-F389 PolarHBondContact N-O 3.2Å; A338-F389 PolarHBondContact O-N 3.19Å
339	C	88.9	Confident	87.5	Confident	25 Å²	25	65.4 Å²	65.4	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.9	-171.3	-54.5	0	0	0	0	111.1	L29 L386 G387 C388	L29-C339 WeakPolarHBondContact CD2-O 3.3Å; C339-L386 HydrophobicContact CB-CB 4.43Å; C339-L386 HydrophobicContact CB-CD1 4.32Å; C339-G387 WeakPolarHBondContact CA-O 3.45Å; C339-C388 HydrophobicContact CB-CB 4.1Å; C339-C388 WeakPolarHBondContact CB-SG 3.41Å; C339-C388 WeakPolarHBondContact SG-CB 3.38Å; C339-C388 CovalentContact SG-SG 2.04Å; C339-C388 PolarHBondContact SG-SG 2.97Å
340	W	88.4	Confident	87.9	Confident	17 Å²	17	61.7 Å²	61.7	6%	0.064	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	164	174.5	-70.1	-98.9	0	0	0	109.4	L29 I324 A338 E344 P346 F350 L386 G387 F389	L29-W340 HydrophobicContact CD1-CZ2 3.95Å; L29-W340 HydrophobicContact CD2-CH2 4.5Å; L29-W340 HydrophobicContact CD2-CZ2 4.18Å; L29-W340 HydrophobicContact CG-CZ2 4.46Å; I324-W340 HydrophobicContact CD1-CZ2 4.1Å; A338-W340 VanDerWaalsContact C-CZ3 3.45Å; A338-W340 HydrophobicContact CB-CE3 4.35Å; A338-W340 HydrophobicContact CB-CH2 3.38Å; A338-W340 HydrophobicContact CB-CZ2 4.44Å; A338-W340 HydrophobicContact CB-CZ3 3.32Å; A338-W340 WeakPolarHBondContact O-CZ3 3.36Å; W340-E344 HydrophobicContact CB-CB 4.15Å; W340-P346 HydrophobicContact CD2-CB 3.69Å; W340-P346 HydrophobicContact CD2-CG 4.01Å; W340-P346 HydrophobicContact CE3-CB 3.91Å; W340-P346 HydrophobicContact CE3-CG 3.87Å; W340-P346 HydrophobicContact CG-CB 4.18Å; W340-P346 HydrophobicContact CG-CG 4.44Å; W340-P346 HydrophobicContact CH2-CB 4.1Å; W340-P346 HydrophobicContact CZ2-CB 3.9Å; W340-P346 HydrophobicContact CZ3-CB 4.1Å; W340-P346 HydrophobicContact CZ3-CG 4.2Å; W340-F350 HydrophobicContact CH2-CE2 4.18Å; W340-F350 HydrophobicContact CH2-CZ 4.31Å; W340-L386 CarbonylContact O-C 3.57Å; W340-L386 VanDerWaalsContact O-CA 3.31Å; W340-L386 WeakPolarHBondContact O-CA 3.32Å; W340-L386 WeakPolarHBondContact O-CD2 3.42Å; W340-G387 PolarHBondContact N-O 2.97Å; W340-G387 PolarHBondContact O-N 2.9Å; W340-F389 AromaticContact CE3-CD2 3.65Å; W340-F389 HydrophobicContact CE3-CD2 3.65Å; W340-F389 HydrophobicContact CE3-CE2 4Å; W340-F389 AromaticContact CZ3-CD2 3.8Å; W340-F389 HydrophobicContact CZ3-CD2 3.8Å
341	K	87	Confident	88.3	Confident	108 Å²	108	62.6 Å²	62.6	47%	0.47	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	150.2	169.2	-63.2	177.9	-178	167.7	0	109.3	D343 E344 L386	K341-D343 WeakPolarHBondContact CB-OD1 3.2Å; K341-D343 PolarHBondContact O-N 2.84Å; K341-D343 VanDerWaalsContact O-N 3.13Å; K341-E344 HydrophobicContact CB-CG 4.43Å; K341-E344 WeakPolarHBondContact O-CB 3.34Å; K341-E344 PolarHBondContact O-N 3.39Å; K341-L386 HydrophobicContact CG-CD2 4.42Å
342	K	79.9	Confident	88.5	Confident	135 Å²	135	64.7 Å²	64.7	59%	0.587	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.3	-174.6	-72.2	-177.6	175.9	172.3	0	114.5	E344 N384	K342-E344 VanDerWaalsContact C-N 3.34Å; K342-N384 PolarHBondContact NZ-O 2.79Å; K342-N384 VanDerWaalsContact NZ-O 3.11Å
343	D	81.4	Confident	88.7	Confident	133 Å²	133	63.8 Å²	63.8	71%	0.711	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.7	174.6	58.2	-42.6	0	0	0	113.6	K341	K341-D343 WeakPolarHBondContact CB-OD1 3.2Å; K341-D343 PolarHBondContact O-N 2.84Å; K341-D343 VanDerWaalsContact O-N 3.13Å
344	E	85.3	Confident	89.3	Confident	69 Å²	69	59.5 Å²	59.5	32%	0.322	31%	0.308	S	S	.	.			trans	-96	130.2	176	-66.1	172.2	-175.1	0	0	110.1	W340 K341 K342 P346	W340-E344 HydrophobicContact CB-CB 4.15Å; K341-E344 HydrophobicContact CB-CG 4.43Å; K341-E344 WeakPolarHBondContact O-CB 3.34Å; K341-E344 PolarHBondContact O-N 3.39Å; K342-E344 VanDerWaalsContact C-N 3.34Å; E344-P346 WeakPolarHBondContact O-CD 3.48Å
345	N	82.3	Confident	89.8	Confident	100 Å²	100	57.3 Å²	57.3	54%	0.535	29%	0.285	S	S	.	.			trans	-103.1	103.5	175.1	-175.6	-2.9	0	0	0	110.1	M347	N345-M347 PolarHBondContact O-N 2.97Å; N345-M347 VanDerWaalsContact OD1-CB 3.22Å; N345-M347 WeakPolarHBondContact OD1-CB 3.43Å; N345-M347 WeakPolarHBondContact OD1-CG 3.25Å; N345-M347 PolarHBondContact OD1-N 2.94Å
346	P	87.4	Confident	90.3	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.013	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74.3	-7.5	-177.4	31.7	-36.2	0	0	0	113.2	W340 E344 E348 L349 F350 F389	W340-P346 HydrophobicContact CD2-CB 3.69Å; W340-P346 HydrophobicContact CD2-CG 4.01Å; W340-P346 HydrophobicContact CE3-CB 3.91Å; W340-P346 HydrophobicContact CE3-CG 3.87Å; W340-P346 HydrophobicContact CG-CB 4.18Å; W340-P346 HydrophobicContact CG-CG 4.44Å; W340-P346 HydrophobicContact CH2-CB 4.1Å; W340-P346 HydrophobicContact CZ2-CB 3.9Å; W340-P346 HydrophobicContact CZ3-CB 4.1Å; W340-P346 HydrophobicContact CZ3-CG 4.2Å; E344-P346 WeakPolarHBondContact O-CD 3.48Å; P346-E348 PolarHBondContact O-N 2.82Å; P346-L349 HydrophobicContact CB-CD1 4.44Å; P346-L349 VanDerWaalsContact O-CB 3.28Å; P346-L349 WeakPolarHBondContact O-CB 3.49Å; P346-L349 PolarHBondContact O-N 3.36Å; P346-F350 HydrophobicContact CB-CE2 4.38Å; P346-F350 VanDerWaalsContact O-CD2 3.31Å; P346-F350 WeakPolarHBondContact O-CD2 3.32Å; P346-F389 HydrophobicContact CG-CD2 4.12Å; P346-F389 HydrophobicContact CG-CE2 3.68Å; P346-F389 HydrophobicContact CG-CZ 3.95Å
347	M	88.7	Confident	90.7	Very high	20 Å²	20	48.2 Å²	48.2	10%	0.099	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-60.9	-31	-172.2	-62.5	-61.3	153	0	0	113.1	N345 L349 F350 P372 Q373 I376 F389	N345-M347 PolarHBondContact O-N 2.97Å; N345-M347 VanDerWaalsContact OD1-CB 3.22Å; N345-M347 WeakPolarHBondContact OD1-CB 3.43Å; N345-M347 WeakPolarHBondContact OD1-CG 3.25Å; N345-M347 PolarHBondContact OD1-N 2.94Å; M347-L349 PolarHBondContact O-N 2.85Å; M347-F350 PolarHBondContact O-N 3.07Å; M347-P372 HydrophobicContact CB-CB 4.22Å; M347-P372 WeakPolarHBondContact O-CG 2.97Å; M347-P372 VanDerWaalsContact SD-C 3.56Å; M347-P372 HydrophobicContact SD-CB 3.69Å; M347-Q373 HydrophobicContact CG-CG 4.06Å; M347-Q373 HydrophobicContact SD-CB 4.48Å; M347-Q373 HydrophobicContact SD-CG 4.09Å; M347-I376 HydrophobicContact CE-CB 4.05Å; M347-I376 HydrophobicContact CE-CG2 3.94Å; M347-I376 HydrophobicContact SD-CB 4.1Å; M347-I376 HydrophobicContact SD-CG2 4.43Å; M347-F389 HydrophobicContact CE-CD1 3.9Å; M347-F389 HydrophobicContact CE-CE1 3.55Å; M347-F389 HydrophobicContact CE-CZ 4.3Å
348	E	87.6	Confident	91	Very high	180 Å²	180	45.8 Å²	45.8	84%	0.841	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-70.2	-15.9	177.4	-61.4	-172.7	168.7	0	0	113.3	P346 F350	P346-E348 PolarHBondContact O-N 2.82Å; E348-F350 VanDerWaalsContact C-N 3.3Å
349	L	90.1	Very high	91.4	Very high	51 Å²	51	45.7 Å²	45.7	27%	0.267	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-84.4	-8.1	179.4	-54.4	175.8	0	0	0	113	S322 Q323 I324 P346 M347	S322-L349 WeakPolarHBondContact CB-O 3.44Å; S322-L349 PolarHBondContact OG-O 3Å; Q323-L349 HydrophobicContact CB-CD2 4.42Å; I324-L349 HydrophobicContact CD1-CB 3.88Å; I324-L349 HydrophobicContact CD1-CD1 3.95Å; I324-L349 HydrophobicContact CG1-CB 4.21Å; I324-L349 HydrophobicContact CG1-CD1 3.95Å; P346-L349 HydrophobicContact CB-CD1 4.44Å; P346-L349 VanDerWaalsContact O-CB 3.28Å; P346-L349 WeakPolarHBondContact O-CB 3.49Å; P346-L349 PolarHBondContact O-N 3.36Å; M347-L349 PolarHBondContact O-N 2.85Å
350	F	93.1	Very high	91.6	Very high	11 Å²	11	49 Å²	49	5%	0.048	24%	0.241	C	C	.	.	S	Bend	trans	-115.3	138.3	-175.4	-72.6	-80.1	0	0	0	110.2	I318 I324 F327 F331 W340 P346 M347 E348 P372 Y375 I376	I318-F350 HydrophobicContact CG2-CD1 4.25Å; I324-F350 HydrophobicContact CD1-CE2 4.15Å; I324-F350 HydrophobicContact CD1-CZ 3.99Å; F327-F350 AromaticContact CE1-CE1 3.7Å; F327-F350 HydrophobicContact CE1-CE1 3.7Å; F327-F350 AromaticContact CE1-CZ 3.75Å; F327-F350 HydrophobicContact CE1-CZ 3.75Å; F327-F350 AromaticContact CZ-CE1 3.7Å; F327-F350 HydrophobicContact CZ-CE1 3.7Å; F327-F350 HydrophobicContact CZ-CZ 4.01Å; F331-F350 HydrophobicContact CE1-CE1 4.18Å; F331-F350 HydrophobicContact CE1-CZ 4.26Å; F331-F350 HydrophobicContact CZ-CE1 4.47Å; F331-F350 HydrophobicContact CZ-CZ 4.22Å; W340-F350 HydrophobicContact CH2-CE2 4.18Å; W340-F350 HydrophobicContact CH2-CZ 4.31Å; P346-F350 HydrophobicContact CB-CE2 4.38Å; P346-F350 VanDerWaalsContact O-CD2 3.31Å; P346-F350 WeakPolarHBondContact O-CD2 3.32Å; M347-F350 PolarHBondContact O-N 3.07Å; E348-F350 VanDerWaalsContact C-N 3.3Å; F350-P372 HydrophobicContact CB-CB 3.74Å; F350-P372 HydrophobicContact CB-CG 3.68Å; F350-P372 WeakPolarHBondContact O-CG 3.02Å; F350-Y375 WeakPolarHBondContact CB-OH 3.37Å; F350-Y375 HydrophobicContact CD1-CE2 4.4Å; F350-I376 HydrophobicContact CB-CG1 4.24Å; F350-I376 HydrophobicContact CD1-CD1 3.57Å; F350-I376 HydrophobicContact CD1-CG1 3.98Å; F350-I376 HydrophobicContact CD2-CD1 4.11Å; F350-I376 HydrophobicContact CD2-CG1 3.81Å; F350-I376 HydrophobicContact CD2-CG2 4.46Å; F350-I376 HydrophobicContact CE1-CD1 3.48Å; F350-I376 VanDerWaalsContact CE1-CD1 3.48Å; F350-I376 HydrophobicContact CE1-CG1 4.25Å; F350-I376 HydrophobicContact CE2-CD1 4.04Å; F350-I376 HydrophobicContact CE2-CG1 4.09Å; F350-I376 HydrophobicContact CE2-CG2 4.16Å; F350-I376 HydrophobicContact CG-CD1 3.88Å; F350-I376 HydrophobicContact CG-CG1 3.75Å; F350-I376 HydrophobicContact CZ-CD1 3.73Å; F350-I376 HydrophobicContact CZ-CG1 4.3Å
351	P	95.9	Very high	91.9	Very high	22 Å²	22	51.7 Å²	51.7	14%	0.143	26%	0.257	C	S	.	.			trans	-76.8	162.5	-178.1	30.5	-35.4	0	0	0	112.6	V278 I318 Y375	V278-P351 HydrophobicContact CG1-CB 4Å; V278-P351 HydrophobicContact CG1-CG 3.42Å; V278-P351 VanDerWaalsContact CG1-CG 3.42Å; I318-P351 HydrophobicContact CG1-CG 3.92Å; I318-P351 HydrophobicContact CG2-CG 4.41Å; P351-Y375 WeakPolarHBondContact CD-OH 3.48Å; P351-Y375 WeakPolarHBondContact O-CE1 3.39Å; P351-Y375 VanDerWaalsContact O-CZ 3.3Å; P351-Y375 PolarHBondContact O-OH 3.04Å
352	K	96.9	Very high	92	Very high	50 Å²	50	49.5 Å²	49.5	22%	0.217	26%	0.259	C	S	.	.			trans	-67.6	152	162.8	66.9	-169.9	179.1	-169.3	0	110.5	G279 D280 T369 L371	G279-K352 PolarHBondContact N-O 3.07Å; G279-K352 WeakPolarHBondContact O-CE 3.49Å; D280-K352 WeakPolarHBondContact OD1-CE 3.22Å; D280-K352 IonicContact OD1-NZ 2.79Å; D280-K352 PolarHBondContact OD1-NZ 2.86Å; K352-T369 HydrophobicContact CB-CG2 3.81Å; K352-T369 HydrophobicContact CD-CG2 4.08Å; K352-T369 HydrophobicContact CG-CG2 4.11Å; K352-L371 HydrophobicContact CB-CD2 3.95Å
353	L	98.3	Very high	92.5	Very high	3 Å²	3	46 Å²	46	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.8	171.2	-179.8	80.8	0	0	0	109.2	E277 V278 L304 V314 T369 I370 M393	E277-L353 CarbonylContact O-C 3.54Å; E277-L353 WeakPolarHBondContact O-CA 3.17Å; V278-L353 HydrophobicContact CG2-CD1 3.72Å; L304-L353 HydrophobicContact CD2-CD2 3.45Å; L304-L353 VanDerWaalsContact CD2-CD2 3.45Å; V314-L353 HydrophobicContact CG1-CD1 4.48Å; V314-L353 HydrophobicContact CG2-CD1 4.45Å; L353-T369 CarbonylContact O-C 3.55Å; L353-T369 VanDerWaalsContact O-CA 3.25Å; L353-T369 WeakPolarHBondContact O-CA 3.38Å; L353-I370 HydrophobicContact CB-CD1 4.34Å; L353-I370 HydrophobicContact CB-CG1 3.83Å; L353-I370 HydrophobicContact CD2-CD1 3.97Å; L353-I370 HydrophobicContact CD2-CG1 4.28Å; L353-I370 PolarHBondContact N-O 2.85Å; L353-I370 PolarHBondContact O-N 3.43Å; L353-M393 HydrophobicContact CD2-CE 3.69Å; L353-M393 HydrophobicContact CD2-SD 4.31Å
354	S	98.7	Very high	93.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.3	176.6	-50.3	0	0	0	0	111.7	L276 E277 I368 T369	L276-S354 CarbonylContact C-O 3.55Å; L276-S354 VanDerWaalsContact CA-O 3.31Å; L276-S354 WeakPolarHBondContact CA-O 3.31Å; E277-S354 PolarHBondContact N-O 2.86Å; E277-S354 PolarHBondContact O-N 2.75Å; S354-I368 CarbonylContact C-O 3.54Å; S354-I368 WeakPolarHBondContact CA-O 3.35Å; S354-T369 WeakPolarHBondContact CB-OG1 3.46Å; S354-T369 WeakPolarHBondContact OG-CG2 3.37Å; S354-T369 PolarHBondContact OG-OG1 2.87Å
355	I	98.7	Very high	93.8	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119	175	-54.6	172.7	0	0	0	107.4	V273 L276 L304 L357 R367 I368	V273-I355 HydrophobicContact CG1-CG2 3.83Å; V273-I355 HydrophobicContact CG2-CG2 4.14Å; L276-I355 HydrophobicContact CD1-CG1 4.37Å; L276-I355 HydrophobicContact CD1-CG2 4.1Å; L276-I355 HydrophobicContact CG-CG1 4.3Å; L304-I355 HydrophobicContact CD1-CD1 4.46Å; I355-L357 HydrophobicContact CG2-CD2 4.02Å; I355-L357 HydrophobicContact CG2-CG 4.49Å; I355-R367 VanDerWaalsContact O-CA 3.29Å; I355-R367 WeakPolarHBondContact O-CA 3.33Å; I355-I368 HydrophobicContact CB-CD1 4.48Å; I355-I368 HydrophobicContact CB-CG1 3.93Å; I355-I368 PolarHBondContact N-O 3.23Å; I355-I368 PolarHBondContact O-N 3.45Å
356	Y	98.2	Very high	94.6	Very high	10 Å²	10	35.1 Å²	35.1	4%	0.039	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.7	176.7	-70.8	-110.6	0	0	0	109.2	L274 K275 E277 F366 R367 F443	L274-Y356 PolarHBondContact N-O 3.45Å; K275-Y356 HydrophobicContact CB-CD2 4.1Å; K275-Y356 HydrophobicContact CB-CG 4.16Å; K275-Y356 HydrophobicContact CD-CD2 4.5Å; K275-Y356 VanDerWaalsContact CE-CD2 3.47Å; K275-Y356 VanDerWaalsContact CE-CE2 3.41Å; K275-Y356 HydrophobicContact CG-CD2 4.29Å; K275-Y356 WeakPolarHBondContact O-CB 3.25Å; K275-Y356 PolarHBondContact O-N 3.34Å; E277-Y356 HydrophobicContact CB-CE2 4.45Å; E277-Y356 VanDerWaalsContact CD-CE2 3.41Å; E277-Y356 HydrophobicContact CG-CE2 3.82Å; E277-Y356 PolarHBondContact OE1-OH 3.11Å; E277-Y356 WeakPolarHBondContact OE2-CE2 3.17Å; E277-Y356 VanDerWaalsContact OE2-CZ 3.31Å; E277-Y356 PolarHBondContact OE2-OH 2.72Å; Y356-F366 WeakPolarHBondContact CA-O 3.05Å; Y356-R367 HydrophobicContact CD1-CB 3.88Å; Y356-R367 HydrophobicContact CD2-CB 3.94Å; Y356-R367 HydrophobicContact CE1-CB 3.85Å; Y356-R367 HydrophobicContact CE2-CB 3.89Å; Y356-R367 HydrophobicContact CG-CB 3.93Å; Y356-R367 VanDerWaalsContact CZ-CD 3.5Å; Y356-R367 WeakPolarHBondContact OH-CD 3.44Å; Y356-R367 PolarHBondContact OH-NH1 3.26Å; Y356-R367 VanDerWaalsContact OH-NH1 3.13Å; Y356-F443 AromaticContact CD1-CD2 4Å; Y356-F443 HydrophobicContact CD1-CD2 4Å; Y356-F443 HydrophobicContact CD1-CE2 4.41Å; Y356-F443 AromaticContact CE1-CD2 3.62Å; Y356-F443 HydrophobicContact CE1-CD2 3.62Å; Y356-F443 AromaticContact CE1-CE2 3.78Å; Y356-F443 HydrophobicContact CE1-CE2 3.78Å; Y356-F443 HydrophobicContact CE1-CG 4.05Å; Y356-F443 HydrophobicContact CE1-CZ 4.36Å
357	L	98.2	Very high	95.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.2	178.6	-59.3	175.2	0	0	0	109.2	T261 V271 V273 I355 A359 S365 F366 I368 F423	T261-L357 HydrophobicContact CG2-CD1 4.19Å; V271-L357 HydrophobicContact CB-CD2 4.5Å; V271-L357 HydrophobicContact CG2-CD2 4.12Å; V273-L357 HydrophobicContact CG2-CD2 3.87Å; I355-L357 HydrophobicContact CG2-CD2 4.02Å; I355-L357 HydrophobicContact CG2-CG 4.49Å; L357-A359 PolarHBondContact O-N 2.72Å; L357-S365 VanDerWaalsContact O-CA 3.27Å; L357-S365 WeakPolarHBondContact O-CA 3.23Å; L357-S365 WeakPolarHBondContact O-CB 3.37Å; L357-F366 HydrophobicContact CB-CE1 4.04Å; L357-F366 HydrophobicContact CB-CE2 4.43Å; L357-F366 HydrophobicContact CB-CZ 3.96Å; L357-F366 HydrophobicContact CD1-CE2 4.08Å; L357-F366 HydrophobicContact CD1-CZ 3.92Å; L357-F366 PolarHBondContact N-O 3.32Å; L357-F366 PolarHBondContact O-N 3.1Å; L357-F366 VanDerWaalsContact O-N 3.12Å; L357-I368 HydrophobicContact CD1-CD1 4.07Å; L357-I368 HydrophobicContact CD1-CG1 4.39Å; L357-F423 HydrophobicContact CD1-CD2 4.07Å; L357-F423 HydrophobicContact CD1-CE2 3.68Å; L357-F423 HydrophobicContact CD1-CZ 4.22Å
358	R	96.9	Very high	95.6	Very high	15 Å²	15	36.3 Å²	36.3	6%	0.057	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	132.5	171.4	-167.3	174.3	-62.9	-98.9	5	109.4	T261 P262 E272 L274 A362 A449 A450	T261-R358 VanDerWaalsContact CA-O 3.27Å; T261-R358 WeakPolarHBondContact CA-O 3.12Å; T261-R358 WeakPolarHBondContact CB-O 3.35Å; T261-R358 PolarHBondContact OG1-O 2.89Å; P262-R358 WeakPolarHBondContact CD-O 3.28Å; E272-R358 HydrophobicContact CB-CB 4.38Å; E272-R358 VanDerWaalsContact CD-NE 3.29Å; E272-R358 PolarHBondContact O-N 3.31Å; E272-R358 IonicContact OE1-CZ 3.3Å; E272-R358 IonicContact OE1-NE 2.84Å; E272-R358 PolarHBondContact OE1-NE 2.94Å; E272-R358 IonicContact OE1-NH2 3.27Å; E272-R358 PolarHBondContact OE1-NH2 3.08Å; E272-R358 WeakPolarHBondContact OE2-CD 3.3Å; E272-R358 IonicContact OE2-CZ 2.69Å; E272-R358 IonicContact OE2-NE 2.82Å; E272-R358 PolarHBondContact OE2-NE 2.85Å; E272-R358 IonicContact OE2-NH2 3.1Å; L274-R358 HydrophobicContact CD1-CB 4.04Å; L274-R358 HydrophobicContact CD1-CG 4.46Å; L274-R358 HydrophobicContact CD2-CB 4.26Å; L274-R358 HydrophobicContact CG-CB 4.27Å; R358-A362 PolarHBondContact NH1-O 2.94Å; R358-A449 PolarHBondContact NH2-O 3.02Å; R358-A450 PolarHBondContact NH2-O 3.45Å
359	A	96.9	Very high	96.1	Very high	7 Å²	7	27.7 Å²	27.7	6%	0.058	16%	0.157	C	C	.	.			trans	-78.5	164.4	174	0	0	0	0	0	110.5	Y260 L357 N361 Q364 F366	Y260-A359 WeakPolarHBondContact O-CA 3.33Å; L357-A359 PolarHBondContact O-N 2.72Å; A359-N361 CarbonylContact O-C 3.59Å; A359-N361 PolarHBondContact O-N 3.09Å; A359-Q364 HydrophobicContact CB-CB 3.99Å; A359-Q364 WeakPolarHBondContact CB-O 3.04Å; A359-Q364 PolarHBondContact N-O 2.79Å; A359-F366 HydrophobicContact CB-CD1 4.2Å
360	T	94.8	Very high	96.5	Very high	93 Å²	93	25.4 Å²	25.4	57%	0.571	15%	0.145	S	C	*	.	S	Bend	trans	-55.9	-29.7	171.9	48.9	0	0	0	0	113.3	Y260 K420	Y260-T360 PolarHBondContact O-N 2.81Å; Y260-T360 VanDerWaalsContact O-N 3.09Å; T360-K420 HydrophobicContact CG2-CB 4.4Å; T360-K420 HydrophobicContact CG2-CD 4.39Å
361	N	93	Very high	96.6	Very high	75 Å²	75	26.5 Å²	26.5	40%	0.401	15%	0.151	S	C	.	.	S	Bend	trans	-80.8	111.5	161.3	-179.4	-15.3	0	0	0	109.2	A359 S363 Q364	A359-N361 CarbonylContact O-C 3.59Å; A359-N361 PolarHBondContact O-N 3.09Å; N361-S363 PolarHBondContact O-N 2.88Å; N361-S363 PolarHBondContact OD1-N 2.03Å; N361-S363 VanDerWaalsContact OD1-N 3.1Å; N361-S363 PolarHBondContact OD1-OG 3.27Å; N361-Q364 HydrophobicContact CB-CB 4.29Å; N361-Q364 HydrophobicContact CB-CG 4.37Å; N361-Q364 WeakPolarHBondContact O-CA 3.49Å; N361-Q364 PolarHBondContact O-N 2.87Å
362	A	89.4	Confident	96.5	Very high	61 Å²	61	25.9 Å²	25.9	50%	0.504	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.6	-174.2	0	0	0	0	0	115	R358 Q364	R358-A362 PolarHBondContact NH1-O 2.94Å; A362-Q364 VanDerWaalsContact C-N 3.26Å
363	S	91.8	Very high	96.3	Very high	61 Å²	61	26.6 Å²	26.6	43%	0.427	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.1	174.6	66.6	0	0	0	0	113.7	N361 A445	N361-S363 PolarHBondContact O-N 2.88Å; N361-S363 PolarHBondContact OD1-N 2.03Å; N361-S363 VanDerWaalsContact OD1-N 3.1Å; N361-S363 PolarHBondContact OD1-OG 3.27Å; S363-A445 PolarHBondContact O-N 3.04Å
364	Q	95.7	Very high	96.1	Very high	69 Å²	69	26.6 Å²	26.6	32%	0.322	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	156.7	-175.6	-65.8	179.9	-24.8	0	0	111.4	A359 N361 A362 P442 F443	A359-Q364 HydrophobicContact CB-CB 3.99Å; A359-Q364 WeakPolarHBondContact CB-O 3.04Å; A359-Q364 PolarHBondContact N-O 2.79Å; N361-Q364 HydrophobicContact CB-CB 4.29Å; N361-Q364 HydrophobicContact CB-CG 4.37Å; N361-Q364 WeakPolarHBondContact O-CA 3.49Å; N361-Q364 PolarHBondContact O-N 2.87Å; A362-Q364 VanDerWaalsContact C-N 3.26Å; Q364-P442 HydrophobicContact CB-CB 4.22Å; Q364-P442 HydrophobicContact CG-CB 4.15Å; Q364-F443 CarbonylContact C-O 3.55Å; Q364-F443 VanDerWaalsContact CA-O 3.27Å; Q364-F443 WeakPolarHBondContact CA-O 3.48Å
365	S	97.3	Very high	95.8	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.042	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	165.3	168.3	60.6	0	0	0	0	110.1	L357 P442 F443	L357-S365 VanDerWaalsContact O-CA 3.27Å; L357-S365 WeakPolarHBondContact O-CA 3.23Å; L357-S365 WeakPolarHBondContact O-CB 3.37Å; S365-P442 CarbonylContact O-C 3.51Å; S365-P442 WeakPolarHBondContact O-CA 3.08Å; S365-F443 PolarHBondContact N-O 3.48Å; S365-F443 PolarHBondContact O-N 2.91Å
366	F	98.5	Very high	95.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.4	166.1	66.1	-80.8	0	0	0	107.7	W259 Y260 T261 Y356 L357 A359 I368 F423 I439 A440	W259-F366 HydrophobicContact CB-CB 4.37Å; W259-F366 HydrophobicContact CB-CD1 4.03Å; W259-F366 HydrophobicContact CB-CD2 3.46Å; W259-F366 VanDerWaalsContact CB-CD2 3.46Å; W259-F366 HydrophobicContact CB-CE1 4.15Å; W259-F366 HydrophobicContact CB-CE2 3.59Å; W259-F366 HydrophobicContact CB-CG 3.69Å; W259-F366 HydrophobicContact CB-CZ 3.94Å; W259-F366 HydrophobicContact CD2-CB 3.94Å; W259-F366 HydrophobicContact CD2-CG 4.21Å; W259-F366 HydrophobicContact CE3-CB 3.62Å; W259-F366 HydrophobicContact CE3-CD1 4.33Å; W259-F366 HydrophobicContact CE3-CG 4.04Å; W259-F366 HydrophobicContact CG-CB 4.27Å; W259-F366 HydrophobicContact CG-CD2 4.02Å; W259-F366 HydrophobicContact CG-CG 4.11Å; W259-F366 HydrophobicContact CZ3-CB 4.3Å; Y260-F366 WeakPolarHBondContact O-CE1 3.31Å; T261-F366 HydrophobicContact CG2-CZ 4.39Å; Y356-F366 WeakPolarHBondContact CA-O 3.05Å; L357-F366 HydrophobicContact CB-CE1 4.04Å; L357-F366 HydrophobicContact CB-CE2 4.43Å; L357-F366 HydrophobicContact CB-CZ 3.96Å; L357-F366 HydrophobicContact CD1-CE2 4.08Å; L357-F366 HydrophobicContact CD1-CZ 3.92Å; L357-F366 PolarHBondContact N-O 3.32Å; L357-F366 PolarHBondContact O-N 3.1Å; L357-F366 VanDerWaalsContact O-N 3.12Å; A359-F366 HydrophobicContact CB-CD1 4.2Å; F366-I368 HydrophobicContact CD2-CG2 4.31Å; F366-I368 HydrophobicContact CE2-CG2 3.97Å; F366-F423 HydrophobicContact CE2-CB 4.32Å; F366-F423 HydrophobicContact CE2-CD2 4.17Å; F366-F423 HydrophobicContact CZ-CD2 4.14Å; F366-I439 HydrophobicContact CD2-CD1 4.27Å; F366-I439 HydrophobicContact CD2-CG1 4.32Å; F366-I439 HydrophobicContact CE2-CD1 4.41Å; F366-A440 CarbonylContact C-O 3.35Å; F366-A440 WeakPolarHBondContact CA-O 3.41Å; F366-A440 WeakPolarHBondContact CB-O 3.33Å
367	R	98.4	Very high	95.1	Very high	44 Å²	44	26.8 Å²	26.8	17%	0.166	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.2	176.3	81.6	-171.2	-176.2	-165.3	-1.5	110.5	E277 I355 Y356 I439 A440 F443	E277-R367 IonicContact OE2-NH1 3.85Å; I355-R367 VanDerWaalsContact O-CA 3.29Å; I355-R367 WeakPolarHBondContact O-CA 3.33Å; Y356-R367 HydrophobicContact CD1-CB 3.88Å; Y356-R367 HydrophobicContact CD2-CB 3.94Å; Y356-R367 HydrophobicContact CE1-CB 3.85Å; Y356-R367 HydrophobicContact CE2-CB 3.89Å; Y356-R367 HydrophobicContact CG-CB 3.93Å; Y356-R367 VanDerWaalsContact CZ-CD 3.5Å; Y356-R367 WeakPolarHBondContact OH-CD 3.44Å; Y356-R367 PolarHBondContact OH-NH1 3.26Å; Y356-R367 VanDerWaalsContact OH-NH1 3.13Å; R367-I439 WeakPolarHBondContact O-CA 3.4Å; R367-I439 WeakPolarHBondContact O-CG1 3.49Å; R367-A440 HydrophobicContact CG-CB 4.26Å; R367-A440 PolarHBondContact N-O 3.29Å; R367-A440 PolarHBondContact O-N 3.5Å; R367-A440 VanDerWaalsContact O-N 3.11Å; R367-F443 HydrophobicContact CB-CE2 4.02Å; R367-F443 HydrophobicContact CG-CE2 3.81Å; R367-F443 HydrophobicContact CG-CZ 4.26Å
368	I	98.8	Very high	94.4	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.5	162.5	58.3	173.7	0	0	0	107.4	S354 I355 L357 F366 V406 F410 F423 I439	S354-I368 CarbonylContact C-O 3.54Å; S354-I368 WeakPolarHBondContact CA-O 3.35Å; I355-I368 HydrophobicContact CB-CD1 4.48Å; I355-I368 HydrophobicContact CB-CG1 3.93Å; I355-I368 PolarHBondContact N-O 3.23Å; I355-I368 PolarHBondContact O-N 3.45Å; L357-I368 HydrophobicContact CD1-CD1 4.07Å; L357-I368 HydrophobicContact CD1-CG1 4.39Å; F366-I368 HydrophobicContact CD2-CG2 4.31Å; F366-I368 HydrophobicContact CE2-CG2 3.97Å; I368-V406 HydrophobicContact CD1-CG1 4.34Å; I368-F410 HydrophobicContact CB-CE1 3.95Å; I368-F410 HydrophobicContact CB-CE2 3.97Å; I368-F410 HydrophobicContact CB-CZ 3.56Å; I368-F410 HydrophobicContact CD1-CE2 4.42Å; I368-F410 HydrophobicContact CG2-CD1 4.47Å; I368-F410 HydrophobicContact CG2-CE1 4.08Å; I368-F410 HydrophobicContact CG2-CZ 4.18Å; I368-F423 HydrophobicContact CD1-CD1 4.28Å; I368-F423 HydrophobicContact CD1-CE1 4.1Å; I368-F423 HydrophobicContact CD1-CZ 4.46Å; I368-F423 HydrophobicContact CG2-CB 3.94Å; I368-F423 HydrophobicContact CG2-CD1 4.24Å; I368-F423 HydrophobicContact CG2-CG 4.04Å; I368-I439 HydrophobicContact CG2-CD1 3.98Å; I368-I439 HydrophobicContact CG2-CG1 4.22Å
369	T	98.8	Very high	93.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.3	-177.2	-59.2	0	0	0	0	109.2	K352 L353 S354 S437 E438	K352-T369 HydrophobicContact CB-CG2 3.81Å; K352-T369 HydrophobicContact CD-CG2 4.08Å; K352-T369 HydrophobicContact CG-CG2 4.11Å; L353-T369 CarbonylContact O-C 3.55Å; L353-T369 VanDerWaalsContact O-CA 3.25Å; L353-T369 WeakPolarHBondContact O-CA 3.38Å; S354-T369 WeakPolarHBondContact CB-OG1 3.46Å; S354-T369 WeakPolarHBondContact OG-CG2 3.37Å; S354-T369 PolarHBondContact OG-OG1 2.87Å; T369-S437 CarbonylContact O-C 3.53Å; T369-S437 WeakPolarHBondContact O-CA 3.39Å; T369-S437 WeakPolarHBondContact O-CB 3.32Å; T369-E438 HydrophobicContact CG2-CB 4.49Å; T369-E438 PolarHBondContact N-O 3.33Å; T369-E438 PolarHBondContact O-N 3.33Å
370	I	97.8	Very high	92	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139	172	61.7	176.3	0	0	0	109.9	L353 L374 Y375 V406 F410	L353-I370 HydrophobicContact CB-CD1 4.34Å; L353-I370 HydrophobicContact CB-CG1 3.83Å; L353-I370 HydrophobicContact CD2-CD1 3.97Å; L353-I370 HydrophobicContact CD2-CG1 4.28Å; L353-I370 PolarHBondContact N-O 2.85Å; L353-I370 PolarHBondContact O-N 3.43Å; I370-L374 HydrophobicContact CB-CB 4.26Å; I370-L374 HydrophobicContact CB-CD1 3.8Å; I370-L374 HydrophobicContact CG2-CD1 3.71Å; I370-Y375 HydrophobicContact CD1-CD1 4.05Å; I370-Y375 HydrophobicContact CG1-CD1 4.17Å; I370-V406 HydrophobicContact CD1-CG2 4.16Å; I370-V406 HydrophobicContact CG2-CB 4.43Å; I370-V406 HydrophobicContact CG2-CG1 3.83Å; I370-F410 HydrophobicContact CG2-CE2 3.86Å; I370-F410 HydrophobicContact CG2-CZ 4.41Å
371	L	96.3	Very high	90.3	Very high	33 Å²	33	39.3 Å²	39.3	17%	0.173	22%	0.224	C	C	.	.			trans	-88.1	162.5	173.1	-57.8	-171.6	0	0	0	111	K352 Q373 L374 Y375 P435 L436	K352-L371 HydrophobicContact CB-CD2 3.95Å; L371-Q373 PolarHBondContact O-N 3.47Å; L371-L374 PolarHBondContact O-N 2.69Å; L371-Y375 WeakPolarHBondContact O-CD1 3.45Å; L371-P435 VanDerWaalsContact CD1-O 3.27Å; L371-P435 WeakPolarHBondContact CD1-O 3.42Å; L371-L436 VanDerWaalsContact CB-O 3.3Å; L371-L436 WeakPolarHBondContact CB-O 3.44Å; L371-L436 WeakPolarHBondContact CG-O 3.38Å; L371-L436 PolarHBondContact N-O 3.01Å
372	P	94.3	Very high	88.6	Confident	10 Å²	10	36.6 Å²	36.6	7%	0.065	21%	0.212	C	C	.	.	H	α-helix	trans	-48.1	-34	180	-33.5	39.6	0	0	0	115.4	M347 F350 L374 Y375 I376	M347-P372 HydrophobicContact CB-CB 4.22Å; M347-P372 WeakPolarHBondContact O-CG 2.97Å; M347-P372 VanDerWaalsContact SD-C 3.56Å; M347-P372 HydrophobicContact SD-CB 3.69Å; F350-P372 HydrophobicContact CB-CB 3.74Å; F350-P372 HydrophobicContact CB-CG 3.68Å; F350-P372 WeakPolarHBondContact O-CG 3.02Å; P372-L374 PolarHBondContact O-N 3.21Å; P372-Y375 VanDerWaalsContact CA-CE1 3.42Å; P372-Y375 HydrophobicContact CB-CE1 4.27Å; P372-Y375 HydrophobicContact CG-CE1 4.2Å; P372-Y375 PolarHBondContact O-N 2.76Å; P372-Y375 VanDerWaalsContact O-N 3.07Å; P372-I376 HydrophobicContact CB-CG1 4.3Å; P372-I376 WeakPolarHBondContact O-CA 3.02Å; P372-I376 WeakPolarHBondContact O-CB 3.36Å; P372-I376 PolarHBondContact O-N 2.93Å
373	Q	91.8	Very high	87.3	Confident	65 Å²	65	38.9 Å²	38.9	30%	0.304	21%	0.212	S	C	.	.	H	α-helix	trans	-57	-26.4	179.4	-65.2	82	-6.1	0	0	113.4	M347 L371 L436	M347-Q373 HydrophobicContact CG-CG 4.06Å; M347-Q373 HydrophobicContact SD-CB 4.48Å; M347-Q373 HydrophobicContact SD-CG 4.09Å; L371-Q373 PolarHBondContact O-N 3.47Å; Q373-L436 HydrophobicContact CB-CD1 4.36Å; Q373-L436 HydrophobicContact CB-CD2 3.63Å; Q373-L436 HydrophobicContact CB-CG 4.47Å; Q373-L436 HydrophobicContact CG-CD2 3.67Å
374	L	93.4	Very high	86.1	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-86.7	-28.9	179.5	-66.9	176.4	0	0	0	113	A229 I370 L371 P372 T405 E408 L436	A229-L374 HydrophobicContact CB-CD2 3.38Å; I370-L374 HydrophobicContact CB-CB 4.26Å; I370-L374 HydrophobicContact CB-CD1 3.8Å; I370-L374 HydrophobicContact CG2-CD1 3.71Å; L371-L374 PolarHBondContact O-N 2.69Å; P372-L374 PolarHBondContact O-N 3.21Å; L374-T405 WeakPolarHBondContact O-CB 3.26Å; L374-E408 HydrophobicContact CD2-CB 4Å; L374-L436 HydrophobicContact CD1-CB 4.34Å; L374-L436 VanDerWaalsContact CD1-O 3.28Å; L374-L436 WeakPolarHBondContact CD1-O 3.47Å; L374-L436 HydrophobicContact CD2-CB 4.31Å; L374-L436 HydrophobicContact CD2-CD1 4.36Å; L374-L436 HydrophobicContact CG-CB 4.18Å
375	Y	94	Very high	85.4	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-116.7	-1.5	-174.9	77.5	-99.6	0	0	0	114.4	I318 F350 P351 I370 L371 P372 F391 G392 M393	I318-Y375 HydrophobicContact CD1-CE2 4.46Å; F350-Y375 WeakPolarHBondContact CB-OH 3.37Å; F350-Y375 HydrophobicContact CD1-CE2 4.4Å; P351-Y375 WeakPolarHBondContact CD-OH 3.48Å; P351-Y375 WeakPolarHBondContact O-CE1 3.39Å; P351-Y375 VanDerWaalsContact O-CZ 3.3Å; P351-Y375 PolarHBondContact O-OH 3.04Å; I370-Y375 HydrophobicContact CD1-CD1 4.05Å; I370-Y375 HydrophobicContact CG1-CD1 4.17Å; L371-Y375 WeakPolarHBondContact O-CD1 3.45Å; P372-Y375 VanDerWaalsContact CA-CE1 3.42Å; P372-Y375 HydrophobicContact CB-CE1 4.27Å; P372-Y375 HydrophobicContact CG-CE1 4.2Å; P372-Y375 PolarHBondContact O-N 2.76Å; P372-Y375 VanDerWaalsContact O-N 3.07Å; Y375-F391 HydrophobicContact CD2-CD2 4.31Å; Y375-F391 AromaticContact CD2-CE2 3.86Å; Y375-F391 HydrophobicContact CD2-CE2 3.86Å; Y375-F391 HydrophobicContact CE2-CE2 4.07Å; Y375-G392 WeakPolarHBondContact O-CA 3.43Å; Y375-G392 PolarHBondContact O-N 2.79Å; Y375-M393 HydrophobicContact CD1-CE 4.07Å; Y375-M393 HydrophobicContact CD2-CE 3.51Å; Y375-M393 HydrophobicContact CE2-CE 4.05Å; Y375-M393 HydrophobicContact CG-CE 3.52Å
376	I	92.8	Very high	84.7	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	87.6	167.7	-56.4	-61.1	0	0	0	105.9	F331 M347 F350 P372 F389 F391	F331-I376 HydrophobicContact CZ-CD1 4.12Å; M347-I376 HydrophobicContact CE-CB 4.05Å; M347-I376 HydrophobicContact CE-CG2 3.94Å; M347-I376 HydrophobicContact SD-CB 4.1Å; M347-I376 HydrophobicContact SD-CG2 4.43Å; F350-I376 HydrophobicContact CB-CG1 4.24Å; F350-I376 HydrophobicContact CD1-CD1 3.57Å; F350-I376 HydrophobicContact CD1-CG1 3.98Å; F350-I376 HydrophobicContact CD2-CD1 4.11Å; F350-I376 HydrophobicContact CD2-CG1 3.81Å; F350-I376 HydrophobicContact CD2-CG2 4.46Å; F350-I376 HydrophobicContact CE1-CD1 3.48Å; F350-I376 VanDerWaalsContact CE1-CD1 3.48Å; F350-I376 HydrophobicContact CE1-CG1 4.25Å; F350-I376 HydrophobicContact CE2-CD1 4.04Å; F350-I376 HydrophobicContact CE2-CG1 4.09Å; F350-I376 HydrophobicContact CE2-CG2 4.16Å; F350-I376 HydrophobicContact CG-CD1 3.88Å; F350-I376 HydrophobicContact CG-CG1 3.75Å; F350-I376 HydrophobicContact CZ-CD1 3.73Å; F350-I376 HydrophobicContact CZ-CG1 4.3Å; P372-I376 HydrophobicContact CB-CG1 4.3Å; P372-I376 WeakPolarHBondContact O-CA 3.02Å; P372-I376 WeakPolarHBondContact O-CB 3.36Å; P372-I376 PolarHBondContact O-N 2.93Å; I376-F389 HydrophobicContact CG2-CB 3.65Å; I376-F389 HydrophobicContact CG2-CD1 3.9Å; I376-F389 HydrophobicContact CG2-CG 3.89Å; I376-F391 HydrophobicContact CD1-CD2 4.05Å
377	Q	87.6	Confident	84.1	Confident	15 Å²	15	48 Å²	48	7%	0.07	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	126.9	-163.5	-57.8	-168	-72.1	0	0	111.1	S82 F389 R390 T405	S82-Q377 PolarHBondContact OG-NE2 3.27Å; Q377-F389 CarbonylContact O-C 3.59Å; Q377-F389 WeakPolarHBondContact O-CA 3.39Å; Q377-R390 HydrophobicContact CB-CG 3.9Å; Q377-R390 PolarHBondContact N-O 3.35Å; Q377-R390 PolarHBondContact O-N 2.73Å; Q377-R390 VanDerWaalsContact OE1-CZ 3.27Å; Q377-T405 HydrophobicContact CG-CG2 4.39Å
378	P	83.9	Confident	83.6	Confident	82 Å²	82	46.4 Å²	46.4	53%	0.532	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	142.9	175.2	28.9	-33.9	0	0	0	110.7	F389	P378-F389 HydrophobicContact CB-CD1 4.1Å; P378-F389 HydrophobicContact CB-CE1 3.99Å
379	I	79.6	Confident	83.2	Confident	59 Å²	59	47.5 Å²	47.5	30%	0.303	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.3	168.1	-59.8	-59.7	0	0	0	107.2	L337 C388 R390	L337-I379 HydrophobicContact CD1-CB 4.33Å; L337-I379 HydrophobicContact CD1-CG1 4.1Å; L337-I379 HydrophobicContact CD1-CG2 4.39Å; L337-I379 HydrophobicContact CD2-CG1 3.87Å; I379-C388 PolarHBondContact N-O 2.98Å; I379-R390 HydrophobicContact CD1-CB 4.4Å; I379-R390 HydrophobicContact CD1-CG 3.95Å; I379-R390 HydrophobicContact CG1-CB 4.47Å; I379-R390 HydrophobicContact CG1-CG 4.45Å
380	V	64.4	Low	82.8	Confident	122 Å²	122	51 Å²	51	74%	0.739	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	136.4	171	-167.6	0	0	0	0	107.1
381	D	59.8	Low	82.6	Confident	116 Å²	116	51 Å²	51	62%	0.62	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	18.2	-177.9	-48.8	-31.5	0	0	0	118.2	Y36	Y36-D381 PolarHBondContact OH-O 3.37Å
382	A	56.1	Low	82.5	Confident	18 Å²	18	49.4 Å²	49.4	15%	0.149	27%	0.268	C	S	.	.			trans	-64.8	148.3	159.4	0	0	0	0	0	111.1	L386 C388	A382-L386 WeakPolarHBondContact CB-O 3.28Å; A382-C388 HydrophobicContact CB-CB 3.65Å; A382-C388 WeakPolarHBondContact CB-SG 3.41Å
383	E	61.9	Low	82.6	Confident	108 Å²	108	49.1 Å²	49.1	51%	0.505	27%	0.265	S	S	.	.			trans	-36	146.6	-178.8	-66	179.8	178.2	0	0	113.9	N385 L386	E383-N385 PolarHBondContact O-N 3.28Å; E383-L386 PolarHBondContact O-N 2.89Å
384	N	67.9	Low	82.8	Confident	160 Å²	160	47.3 Å²	47.3	86%	0.856	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-18.9	-166.3	-76.7	-12.6	0	0	0	117.1	K342	K342-N384 PolarHBondContact NZ-O 2.79Å; K342-N384 VanDerWaalsContact NZ-O 3.11Å
385	N	79.8	Confident	83	Confident	113 Å²	113	49.9 Å²	49.9	60%	0.604	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	5.8	-179.5	-153.5	32.9	0	0	0	116.2	E383	E383-N385 PolarHBondContact O-N 3.28Å
386	L	83.6	Confident	83	Confident	35 Å²	35	50 Å²	50	18%	0.183	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.7	179.3	-66.2	175.4	0	0	0	111.1	C339 W340 K341 A382 E383	C339-L386 HydrophobicContact CB-CB 4.43Å; C339-L386 HydrophobicContact CB-CD1 4.32Å; W340-L386 CarbonylContact O-C 3.57Å; W340-L386 VanDerWaalsContact O-CA 3.31Å; W340-L386 WeakPolarHBondContact O-CA 3.32Å; W340-L386 WeakPolarHBondContact O-CD2 3.42Å; K341-L386 HydrophobicContact CG-CD2 4.42Å; A382-L386 WeakPolarHBondContact CB-O 3.28Å; E383-L386 PolarHBondContact O-N 2.89Å
387	G	85.6	Confident	83.1	Confident	19 Å²	19	55 Å²	55	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	113.6	162.1	0	0	0	0	0	108.5	C339 W340 F389	C339-G387 WeakPolarHBondContact CA-O 3.45Å; W340-G387 PolarHBondContact N-O 2.97Å; W340-G387 PolarHBondContact O-N 2.9Å; G387-F389 WeakPolarHBondContact O-CD2 3.31Å; G387-F389 VanDerWaalsContact O-CE2 3.26Å; G387-F389 WeakPolarHBondContact O-CE2 3.29Å
388	C	87.4	Confident	83.2	Confident	11 Å²	11	56.2 Å²	56.2	7%	0.074	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	144	177.3	-63.9	0	0	0	0	111.1	L337 A338 C339 I379 A382	L337-C388 HydrophobicContact CB-CB 4.15Å; L337-C388 HydrophobicContact CD1-CB 4.05Å; A338-C388 CarbonylContact O-C 3.47Å; A338-C388 WeakPolarHBondContact O-CA 3.26Å; C339-C388 HydrophobicContact CB-CB 4.1Å; C339-C388 WeakPolarHBondContact CB-SG 3.41Å; C339-C388 WeakPolarHBondContact SG-CB 3.38Å; C339-C388 CovalentContact SG-SG 2.04Å; C339-C388 PolarHBondContact SG-SG 2.97Å; I379-C388 PolarHBondContact N-O 2.98Å; A382-C388 HydrophobicContact CB-CB 3.65Å; A382-C388 WeakPolarHBondContact CB-SG 3.41Å
389	F	89.5	Confident	83.8	Confident	26 Å²	26	52.3 Å²	52.3	11%	0.114	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.7	-175.2	-55	-96.3	0	0	0	110.5	L337 A338 W340 P346 M347 I376 Q377 P378 G387	L337-F389 WeakPolarHBondContact CA-O 3.38Å; A338-F389 PolarHBondContact N-O 3.2Å; A338-F389 PolarHBondContact O-N 3.19Å; W340-F389 AromaticContact CE3-CD2 3.65Å; W340-F389 HydrophobicContact CE3-CD2 3.65Å; W340-F389 HydrophobicContact CE3-CE2 4Å; W340-F389 AromaticContact CZ3-CD2 3.8Å; W340-F389 HydrophobicContact CZ3-CD2 3.8Å; P346-F389 HydrophobicContact CG-CD2 4.12Å; P346-F389 HydrophobicContact CG-CE2 3.68Å; P346-F389 HydrophobicContact CG-CZ 3.95Å; M347-F389 HydrophobicContact CE-CD1 3.9Å; M347-F389 HydrophobicContact CE-CE1 3.55Å; M347-F389 HydrophobicContact CE-CZ 4.3Å; I376-F389 HydrophobicContact CG2-CB 3.65Å; I376-F389 HydrophobicContact CG2-CD1 3.9Å; I376-F389 HydrophobicContact CG2-CG 3.89Å; Q377-F389 CarbonylContact O-C 3.59Å; Q377-F389 WeakPolarHBondContact O-CA 3.39Å; P378-F389 HydrophobicContact CB-CD1 4.1Å; P378-F389 HydrophobicContact CB-CE1 3.99Å; G387-F389 WeakPolarHBondContact O-CD2 3.31Å; G387-F389 VanDerWaalsContact O-CE2 3.26Å; G387-F389 WeakPolarHBondContact O-CE2 3.29Å
390	R	90.8	Very high	84.7	Confident	72 Å²	72	49.5 Å²	49.5	27%	0.272	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	156.6	168.2	68.4	169.6	-177.1	-162.8	1.7	110.8	L337 Q377 I379 G392	L337-R390 HydrophobicContact CD2-CB 3.7Å; Q377-R390 HydrophobicContact CB-CG 3.9Å; Q377-R390 PolarHBondContact N-O 3.35Å; Q377-R390 PolarHBondContact O-N 2.73Å; Q377-R390 VanDerWaalsContact OE1-CZ 3.27Å; I379-R390 HydrophobicContact CD1-CB 4.4Å; I379-R390 HydrophobicContact CD1-CG 3.95Å; I379-R390 HydrophobicContact CG1-CB 4.47Å; I379-R390 HydrophobicContact CG1-CG 4.45Å; R390-G392 PolarHBondContact O-N 3.25Å
391	F	94.5	Very high	86.3	Confident	4 Å²	4	44 Å²	44	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.1	171.8	-168.1	-129.2	0	0	0	110.7	F311 V315 I318 F331 W332 Y375 I376 M393	F311-F391 HydrophobicContact CE2-CD1 4.3Å; F311-F391 AromaticContact CE2-CE1 3.78Å; F311-F391 HydrophobicContact CE2-CE1 3.78Å; F311-F391 HydrophobicContact CZ-CD1 4.43Å; F311-F391 HydrophobicContact CZ-CE1 4.09Å; V315-F391 HydrophobicContact CG2-CE1 4.08Å; V315-F391 HydrophobicContact CG2-CZ 4.46Å; I318-F391 HydrophobicContact CD1-CE2 4.14Å; I318-F391 HydrophobicContact CD1-CZ 4.07Å; F331-F391 HydrophobicContact CD1-CB 4.39Å; F331-F391 HydrophobicContact CE1-CB 4.02Å; F331-F391 HydrophobicContact CE1-CD2 4.11Å; F331-F391 HydrophobicContact CE1-CG 4.3Å; F331-F391 HydrophobicContact CE2-CB 4.24Å; F331-F391 HydrophobicContact CZ-CB 3.94Å; F331-F391 HydrophobicContact CZ-CD2 4.35Å; F331-F391 WeakPolarHBondContact O-CB 3.12Å; W332-F391 AromaticContact CE3-CD1 3.78Å; W332-F391 HydrophobicContact CE3-CD1 3.78Å; W332-F391 AromaticContact CE3-CD2 3.97Å; W332-F391 HydrophobicContact CE3-CD2 3.97Å; W332-F391 AromaticContact CE3-CE1 3.73Å; W332-F391 HydrophobicContact CE3-CE1 3.73Å; W332-F391 AromaticContact CE3-CE2 3.98Å; W332-F391 HydrophobicContact CE3-CE2 3.98Å; W332-F391 AromaticContact CE3-CG 3.88Å; W332-F391 HydrophobicContact CE3-CG 3.88Å; W332-F391 AromaticContact CE3-CZ 3.85Å; W332-F391 HydrophobicContact CE3-CZ 3.85Å; W332-F391 HydrophobicContact CZ3-CD1 4.4Å; W332-F391 AromaticContact CZ3-CD2 3.8Å; W332-F391 HydrophobicContact CZ3-CD2 3.8Å; W332-F391 HydrophobicContact CZ3-CE1 4.2Å; W332-F391 AromaticContact CZ3-CE2 3.62Å; W332-F391 HydrophobicContact CZ3-CE2 3.62Å; W332-F391 HydrophobicContact CZ3-CG 4.21Å; W332-F391 AromaticContact CZ3-CZ 3.82Å; W332-F391 HydrophobicContact CZ3-CZ 3.82Å; Y375-F391 HydrophobicContact CD2-CD2 4.31Å; Y375-F391 AromaticContact CD2-CE2 3.86Å; Y375-F391 HydrophobicContact CD2-CE2 3.86Å; Y375-F391 HydrophobicContact CE2-CE2 4.07Å; I376-F391 HydrophobicContact CD1-CD2 4.05Å; F391-M393 HydrophobicContact CD1-CB 4.11Å; F391-M393 HydrophobicContact CE1-CB 3.63Å; F391-M393 HydrophobicContact CE1-CG 4.04Å; F391-M393 HydrophobicContact CE1-SD 4.31Å; F391-M393 HydrophobicContact CE2-CE 4.31Å; F391-M393 HydrophobicContact CE2-CG 4.21Å; F391-M393 HydrophobicContact CE2-SD 4.29Å; F391-M393 HydrophobicContact CZ-CB 3.92Å; F391-M393 HydrophobicContact CZ-CE 4.25Å; F391-M393 HydrophobicContact CZ-CG 3.79Å; F391-M393 HydrophobicContact CZ-SD 3.68Å; F391-M393 PolarHBondContact O-N 3Å
392	G	93.9	Very high	88.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-82.4	14.5	-172.7	0	0	0	0	0	114.6	L304 Y375 R390	L304-G392 PolarHBondContact N-O 3.17Å; Y375-G392 WeakPolarHBondContact O-CA 3.43Å; Y375-G392 PolarHBondContact O-N 2.79Å; R390-G392 PolarHBondContact O-N 3.25Å
393	M	96.5	Very high	90.1	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.02	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.5	179.1	-43.6	-176.8	-168.6	0	0	110.5	L304 L306 F311 V314 L353 Y375 F391	L304-M393 HydrophobicContact CB-CG 4.17Å; L304-M393 HydrophobicContact CD2-CE 4.34Å; L304-M393 HydrophobicContact CD2-CG 4.26Å; L304-M393 HydrophobicContact CD2-SD 4.02Å; L304-M393 HydrophobicContact CG-CG 4.47Å; L304-M393 CarbonylContact O-C 3.53Å; L304-M393 WeakPolarHBondContact O-CA 3.2Å; L304-M393 WeakPolarHBondContact O-CB 3.14Å; L306-M393 HydrophobicContact CD1-SD 4.18Å; F311-M393 HydrophobicContact CE2-CB 4.21Å; V314-M393 HydrophobicContact CG1-SD 3.97Å; L353-M393 HydrophobicContact CD2-CE 3.69Å; L353-M393 HydrophobicContact CD2-SD 4.31Å; Y375-M393 HydrophobicContact CD1-CE 4.07Å; Y375-M393 HydrophobicContact CD2-CE 3.51Å; Y375-M393 HydrophobicContact CE2-CE 4.05Å; Y375-M393 HydrophobicContact CG-CE 3.52Å; F391-M393 HydrophobicContact CD1-CB 4.11Å; F391-M393 HydrophobicContact CE1-CB 3.63Å; F391-M393 HydrophobicContact CE1-CG 4.04Å; F391-M393 HydrophobicContact CE1-SD 4.31Å; F391-M393 HydrophobicContact CE2-CE 4.31Å; F391-M393 HydrophobicContact CE2-CG 4.21Å; F391-M393 HydrophobicContact CE2-SD 4.29Å; F391-M393 HydrophobicContact CZ-CB 3.92Å; F391-M393 HydrophobicContact CZ-CE 4.25Å; F391-M393 HydrophobicContact CZ-CG 3.79Å; F391-M393 HydrophobicContact CZ-SD 3.68Å; F391-M393 PolarHBondContact O-N 3Å
394	S	96.3	Very high	91.8	Very high	27 Å²	27	32.6 Å²	32.6	19%	0.189	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.7	175.3	60.2	0	0	0	0	112.5	L304 R305 L306	L304-S394 PolarHBondContact O-N 2.81Å; R305-S394 WeakPolarHBondContact CA-O 3.4Å; L306-S394 PolarHBondContact N-O 3.32Å
395	P	96.7	Very high	93	Very high	55 Å²	55	25 Å²	25	36%	0.357	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	151.8	173.2	29	-34.3	0	0	0	111.5	R305 L306 I308 F311	R305-P395 PolarHBondContact NH2-O 3.05Å; L306-P395 CarbonylContact O-C 3.41Å; L306-P395 WeakPolarHBondContact O-CA 3.42Å; I308-P395 HydrophobicContact CG1-CB 4.23Å; F311-P395 HydrophobicContact CB-CB 4.31Å; F311-P395 HydrophobicContact CD1-CB 4.01Å; F311-P395 HydrophobicContact CD1-CG 4.43Å; F311-P395 HydrophobicContact CD2-CB 4.49Å; F311-P395 HydrophobicContact CE1-CG 4.44Å; F311-P395 HydrophobicContact CG-CB 4.01Å
396	S	95.2	Very high	93.9	Very high	4 Å²	4	19.6 Å²	19.6	3%	0.028	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.8	-177.9	-171.3	0	0	0	0	111.5	L306 P307 I308 S398 G399	L306-S396 WeakPolarHBondContact O-CB 3.31Å; L306-S396 PolarHBondContact O-N 3.22Å; P307-S396 WeakPolarHBondContact CA-O 3.19Å; I308-S396 PolarHBondContact N-O 3.04Å; S396-S398 PolarHBondContact OG-N 2.95Å; S396-S398 VanDerWaalsContact OG-N 3.17Å; S396-S398 PolarHBondContact OG-OG 2.73Å; S396-G399 WeakPolarHBondContact CB-O 3.23Å; S396-G399 PolarHBondContact OG-O 2.68Å
397	S	93.3	Very high	94.6	Very high	106 Å²	106	18 Å²	18	74%	0.741	11%	0.112	S	C	*	.	S	Bend	trans	-92.3	-3.8	167.2	54.9	0	0	0	0	112.9
398	S	91.1	Very high	95.1	Very high	39 Å²	39	17.4 Å²	17.4	27%	0.273	10%	0.104	S	C	.	.	S	Bend	trans	-118.3	19.9	-172	61.4	0	0	0	0	113.7	K294 S396	K294-S398 PolarHBondContact NZ-O 2.49Å; S396-S398 PolarHBondContact OG-N 2.95Å; S396-S398 VanDerWaalsContact OG-N 3.17Å; S396-S398 PolarHBondContact OG-OG 2.73Å
399	G	95.2	Very high	95.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.01	10%	0.101	C	C	.	.			trans	100.6	179.9	-179.7	0	0	0	0	0	115	V292 K294 S396	V292-G399 VanDerWaalsContact O-CA 3.26Å; V292-G399 WeakPolarHBondContact O-CA 3.29Å; K294-G399 CarbonylContact O-C 3.11Å; K294-G399 VanDerWaalsContact O-CA 3.28Å; K294-G399 WeakPolarHBondContact O-CA 3.43Å; S396-G399 WeakPolarHBondContact CB-O 3.23Å; S396-G399 PolarHBondContact OG-O 2.68Å
400	L	98.4	Very high	96	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	133.2	177.9	-171.6	151.7	0	0	0	110.2	V273 Y290 K294 A295 I296 R305 L306 P307 I402	V273-L400 HydrophobicContact CG2-CD1 4.32Å; V273-L400 HydrophobicContact CG2-CD2 4.33Å; Y290-L400 WeakPolarHBondContact O-CB 3.27Å; K294-L400 PolarHBondContact O-N 3.42Å; A295-L400 CarbonylContact C-O 3.55Å; A295-L400 WeakPolarHBondContact CA-O 3.47Å; A295-L400 HydrophobicContact CB-CB 3.99Å; A295-L400 HydrophobicContact CB-CD2 4.13Å; I296-L400 PolarHBondContact N-O 3.5Å; R305-L400 CarbonylContact O-C 3.53Å; R305-L400 VanDerWaalsContact O-CA 3.29Å; R305-L400 WeakPolarHBondContact O-CA 3.33Å; L306-L400 HydrophobicContact CD2-CD1 3.69Å; L306-L400 HydrophobicContact CD2-CG 4Å; P307-L400 HydrophobicContact CG-CB 4.35Å; L400-I402 HydrophobicContact CD2-CD1 4.43Å; L400-I402 HydrophobicContact CD2-CG1 3.67Å
401	V	98.6	Very high	96.3	Very high	7 Å²	7	12.2 Å²	12.2	4%	0.042	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	111	177.1	-172.7	0	0	0	0	109.2	I296 D298 T301 L304 R305 G403	I296-V401 HydrophobicContact CD1-CG1 4.3Å; I296-V401 HydrophobicContact CD1-CG2 4.16Å; I296-V401 HydrophobicContact CG1-CB 4.3Å; I296-V401 HydrophobicContact CG1-CG1 4.06Å; I296-V401 HydrophobicContact CG1-CG2 4.01Å; D298-V401 HydrophobicContact CB-CG1 3.54Å; T301-V401 HydrophobicContact CG2-CB 4.44Å; T301-V401 HydrophobicContact CG2-CG1 3.83Å; L304-V401 WeakPolarHBondContact CD1-O 3.29Å; R305-V401 HydrophobicContact CB-CB 3.89Å; R305-V401 HydrophobicContact CB-CG2 4.11Å; R305-V401 HydrophobicContact CG-CB 4.15Å; R305-V401 PolarHBondContact N-O 3.3Å; R305-V401 PolarHBondContact O-N 3.18Å; V401-G403 VanDerWaalsContact C-N 3.33Å; V401-G403 PolarHBondContact O-N 3.23Å; V401-G403 VanDerWaalsContact O-N 3.07Å
402	I	98.8	Very high	96.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	90.7	167.7	-60	179	0	0	0	106.7	V271 I296 V297 D298 L400 V406	V271-I402 HydrophobicContact CG2-CD1 4.34Å; I296-I402 WeakPolarHBondContact O-CB 3.41Å; I296-I402 PolarHBondContact O-N 3.41Å; V297-I402 HydrophobicContact CG2-CB 4.33Å; V297-I402 HydrophobicContact CG2-CD1 4.26Å; D298-I402 PolarHBondContact N-O 3.06Å; L400-I402 HydrophobicContact CD2-CD1 4.43Å; L400-I402 HydrophobicContact CD2-CG1 3.67Å; I402-V406 HydrophobicContact CG2-CB 3.68Å; I402-V406 HydrophobicContact CG2-CG1 3.61Å; I402-V406 HydrophobicContact CG2-CG2 4.32Å
403	G	98.1	Very high	96.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.082	C	C	.	.			trans	-81.2	-177.9	-177.1	0	0	0	0	0	114.5	D298 T301 V401 T405 V406 M407	D298-G403 WeakPolarHBondContact O-CA 3.36Å; T301-G403 CarbonylContact O-C 2.93Å; T301-G403 WeakPolarHBondContact O-CA 3.14Å; V401-G403 VanDerWaalsContact C-N 3.33Å; V401-G403 PolarHBondContact O-N 3.23Å; V401-G403 VanDerWaalsContact O-N 3.07Å; G403-T405 VanDerWaalsContact C-N 3.25Å; G403-T405 PolarHBondContact O-N 2.95Å; G403-V406 PolarHBondContact O-N 2.96Å; G403-M407 WeakPolarHBondContact O-CG 3.12Å; G403-M407 PolarHBondContact O-N 3.19Å
404	A	96.4	Very high	96.9	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-51.5	-38.9	179.1	0	0	0	0	0	113.3	M226 T301 T302 V406 M407 E408	M226-A404 HydrophobicContact CE-CB 3.46Å; M226-A404 VanDerWaalsContact CE-CB 3.46Å; T301-A404 PolarHBondContact O-N 2.87Å; T302-A404 PolarHBondContact O-N 2.78Å; A404-V406 VanDerWaalsContact C-N 3.27Å; A404-V406 PolarHBondContact O-N 2.84Å; A404-M407 CarbonylContact O-C 3.51Å; A404-M407 PolarHBondContact O-N 2.89Å; A404-E408 WeakPolarHBondContact O-CB 3.4Å; A404-E408 WeakPolarHBondContact O-CG 3.09Å; A404-E408 PolarHBondContact O-N 3.11Å
405	T	94	Very high	97	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-35.1	178.1	53.4	0	0	0	0	113.7	T302 L304 L374 Q377 G403	T302-T405 HydrophobicContact CG2-CG2 4.46Å; T302-T405 WeakPolarHBondContact O-CG2 3.39Å; T302-T405 PolarHBondContact O-N 2.94Å; T302-T405 PolarHBondContact O-OG1 3.13Å; L304-T405 PolarHBondContact N-OG1 2.81Å; L374-T405 WeakPolarHBondContact O-CB 3.26Å; Q377-T405 HydrophobicContact CG-CG2 4.39Å; G403-T405 VanDerWaalsContact C-N 3.25Å; G403-T405 PolarHBondContact O-N 2.95Å
406	V	98.1	Very high	97.1	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.006	6%	0.057	C	C	.	.	H	α-helix	trans	-77.5	-44.2	174.6	-176.8	0	0	0	0	109.7	L304 I368 I370 I402 G403 A404 E408 G409 F410	L304-V406 HydrophobicContact CB-CG2 3.9Å; L304-V406 HydrophobicContact CD1-CG2 4.16Å; L304-V406 HydrophobicContact CD2-CG2 4.28Å; L304-V406 HydrophobicContact CG-CG2 4.33Å; I368-V406 HydrophobicContact CD1-CG1 4.34Å; I370-V406 HydrophobicContact CD1-CG2 4.16Å; I370-V406 HydrophobicContact CG2-CB 4.43Å; I370-V406 HydrophobicContact CG2-CG1 3.83Å; I402-V406 HydrophobicContact CG2-CB 3.68Å; I402-V406 HydrophobicContact CG2-CG1 3.61Å; I402-V406 HydrophobicContact CG2-CG2 4.32Å; G403-V406 PolarHBondContact O-N 2.96Å; A404-V406 VanDerWaalsContact C-N 3.27Å; A404-V406 PolarHBondContact O-N 2.84Å; V406-E408 PolarHBondContact O-N 2.88Å; V406-G409 PolarHBondContact O-N 2.86Å; V406-F410 HydrophobicContact CG1-CD2 4.38Å; V406-F410 HydrophobicContact CG1-CE2 4.13Å; V406-F410 VanDerWaalsContact O-CD2 3.22Å; V406-F410 WeakPolarHBondContact O-CD2 3.46Å
407	M	98.4	Very high	97.2	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-61.9	-29.2	-179.5	-63.9	177.4	67.7	0	0	112.7	L224 M226 V297 G403 A404 G409 F410 V412 F414	L224-M407 HydrophobicContact CD1-CE 3.96Å; M226-M407 HydrophobicContact SD-CB 3.56Å; M226-M407 VanDerWaalsContact SD-CB 3.56Å; M226-M407 HydrophobicContact SD-CE 3.85Å; M226-M407 HydrophobicContact SD-CG 4.48Å; M226-M407 HydrophobicContact SD-SD 4.21Å; V297-M407 HydrophobicContact CG1-CE 4.11Å; V297-M407 HydrophobicContact CG1-CG 4.2Å; V297-M407 HydrophobicContact CG1-SD 3.79Å; G403-M407 WeakPolarHBondContact O-CG 3.12Å; G403-M407 PolarHBondContact O-N 3.19Å; A404-M407 CarbonylContact O-C 3.51Å; A404-M407 PolarHBondContact O-N 2.89Å; M407-G409 PolarHBondContact O-N 2.67Å; M407-G409 VanDerWaalsContact O-N 3.16Å; M407-F410 CarbonylContact O-C 3.35Å; M407-F410 PolarHBondContact O-N 3.43Å; M407-V412 HydrophobicContact CB-CG2 4.38Å; M407-V412 HydrophobicContact CE-CB 4.36Å; M407-V412 HydrophobicContact CE-CG2 4.21Å; M407-V412 HydrophobicContact CG-CG2 4.33Å; M407-F414 HydrophobicContact CE-CE2 4.25Å; M407-F414 HydrophobicContact CE-CZ 3.89Å
408	E	96.3	Very high	97.4	Very high	6 Å²	6	12.6 Å²	12.6	3%	0.028	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.3	172.5	-82.6	173.6	167.3	0	0	113.4	S82 Y86 M226 A229 L374 A404 V406 A429	S82-E408 VanDerWaalsContact CB-CD 3.48Å; S82-E408 WeakPolarHBondContact CB-OE1 3.39Å; S82-E408 PolarHBondContact N-OE1 3.41Å; S82-E408 PolarHBondContact OG-OE1 3.47Å; S82-E408 PolarHBondContact OG-OE2 3.37Å; S82-E408 VanDerWaalsContact OG-OE2 3.07Å; Y86-E408 HydrophobicContact CE2-CG 4.39Å; Y86-E408 VanDerWaalsContact OH-CD 3.32Å; Y86-E408 VanDerWaalsContact OH-CG 3.31Å; Y86-E408 WeakPolarHBondContact OH-CG 3.37Å; Y86-E408 PolarHBondContact OH-OE1 2.76Å; M226-E408 HydrophobicContact CB-CG 3.93Å; M226-E408 WeakPolarHBondContact O-CA 3.33Å; A229-E408 HydrophobicContact CB-CB 4.02Å; L374-E408 HydrophobicContact CD2-CB 4Å; A404-E408 WeakPolarHBondContact O-CB 3.4Å; A404-E408 WeakPolarHBondContact O-CG 3.09Å; A404-E408 PolarHBondContact O-N 3.11Å; V406-E408 PolarHBondContact O-N 2.88Å; E408-A429 VanDerWaalsContact O-CB 3.22Å; E408-A429 WeakPolarHBondContact O-CB 3.31Å
409	G	96.4	Very high	97.7	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.2	173.7	0	0	0	0	0	114.3	V406 M407 S437	V406-G409 PolarHBondContact O-N 2.86Å; M407-G409 PolarHBondContact O-N 2.67Å; M407-G409 VanDerWaalsContact O-N 3.16Å; G409-S437 WeakPolarHBondContact O-CB 3.35Å; G409-S437 PolarHBondContact O-OG 2.91Å
410	F	98.4	Very high	97.8	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	154.9	-165.4	-57.1	-77.3	0	0	0	112.7	I368 I370 V406 M407 V412 F423 A424 L425	I368-F410 HydrophobicContact CB-CE1 3.95Å; I368-F410 HydrophobicContact CB-CE2 3.97Å; I368-F410 HydrophobicContact CB-CZ 3.56Å; I368-F410 HydrophobicContact CD1-CE2 4.42Å; I368-F410 HydrophobicContact CG2-CD1 4.47Å; I368-F410 HydrophobicContact CG2-CE1 4.08Å; I368-F410 HydrophobicContact CG2-CZ 4.18Å; I370-F410 HydrophobicContact CG2-CE2 3.86Å; I370-F410 HydrophobicContact CG2-CZ 4.41Å; V406-F410 HydrophobicContact CG1-CD2 4.38Å; V406-F410 HydrophobicContact CG1-CE2 4.13Å; V406-F410 VanDerWaalsContact O-CD2 3.22Å; V406-F410 WeakPolarHBondContact O-CD2 3.46Å; M407-F410 CarbonylContact O-C 3.35Å; M407-F410 PolarHBondContact O-N 3.43Å; F410-V412 HydrophobicContact CB-CG2 4.2Å; F410-F423 HydrophobicContact CB-CD1 4.13Å; F410-F423 HydrophobicContact CG-CD1 4.25Å; F410-A424 CarbonylContact C-O 3.48Å; F410-A424 VanDerWaalsContact CA-O 3.25Å; F410-A424 WeakPolarHBondContact CA-O 3.41Å; F410-A424 WeakPolarHBondContact CB-O 3.39Å; F410-L425 HydrophobicContact CE1-CD2 4.25Å
411	Y	98.6	Very high	97.8	Very high	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	119.9	160.1	-178	-118.3	0	0	0	108.2	S223 L224 Q225 A249 E250 L253 Y254 V413 A424	S223-Y411 VanDerWaalsContact CB-OH 3.28Å; S223-Y411 WeakPolarHBondContact CB-OH 3.32Å; S223-Y411 PolarHBondContact OG-OH 2.9Å; L224-Y411 VanDerWaalsContact O-CD2 3.3Å; L224-Y411 WeakPolarHBondContact O-CD2 3.4Å; Q225-Y411 HydrophobicContact CB-CD2 3.84Å; Q225-Y411 HydrophobicContact CB-CE2 4.21Å; Q225-Y411 HydrophobicContact CG-CD2 4.38Å; A249-Y411 VanDerWaalsContact CA-OH 3.25Å; A249-Y411 WeakPolarHBondContact CA-OH 3.49Å; A249-Y411 HydrophobicContact CB-CE1 4.03Å; E250-Y411 PolarHBondContact N-OH 3.43Å; L253-Y411 HydrophobicContact CB-CD2 3.98Å; L253-Y411 HydrophobicContact CB-CE2 3.82Å; L253-Y411 HydrophobicContact CD1-CE2 3.88Å; L253-Y411 HydrophobicContact CG-CE2 4.48Å; Y254-Y411 AromaticContact CD1-CD1 3.29Å; Y254-Y411 HydrophobicContact CD1-CD1 3.29Å; Y254-Y411 AromaticContact CD1-CE1 3.39Å; Y254-Y411 HydrophobicContact CD1-CE1 3.39Å; Y254-Y411 HydrophobicContact CD1-CG 4.18Å; Y254-Y411 HydrophobicContact CE1-CD1 4.11Å; Y254-Y411 AromaticContact CE1-CE1 3.85Å; Y254-Y411 HydrophobicContact CE1-CE1 3.85Å; Y254-Y411 AromaticContact CG-CD1 3.74Å; Y254-Y411 HydrophobicContact CG-CD1 3.74Å; Y254-Y411 HydrophobicContact CG-CE1 4.29Å; Y254-Y411 HydrophobicContact CG-CG 4.41Å; Y411-V413 HydrophobicContact CD1-CG2 4.01Å; Y411-V413 HydrophobicContact CE1-CG2 3.76Å; Y411-A424 PolarHBondContact N-O 3.41Å; Y411-A424 PolarHBondContact O-N 2.87Å
412	V	98.9	Very high	97.8	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.9	-170.6	-170.3	0	0	0	0	109.8	S223 L224 V297 M407 F410 F414 G422 F423	S223-V412 CarbonylContact C-O 3.42Å; S223-V412 WeakPolarHBondContact CA-O 3.2Å; S223-V412 WeakPolarHBondContact CB-O 3.22Å; L224-V412 PolarHBondContact N-O 2.86Å; L224-V412 PolarHBondContact O-N 2.79Å; V297-V412 HydrophobicContact CG1-CG1 4.35Å; M407-V412 HydrophobicContact CB-CG2 4.38Å; M407-V412 HydrophobicContact CE-CB 4.36Å; M407-V412 HydrophobicContact CE-CG2 4.21Å; M407-V412 HydrophobicContact CG-CG2 4.33Å; F410-V412 HydrophobicContact CB-CG2 4.2Å; V412-F414 HydrophobicContact CB-CE2 3.9Å; V412-F414 HydrophobicContact CB-CZ 4.45Å; V412-F414 HydrophobicContact CG1-CD2 4.17Å; V412-F414 HydrophobicContact CG1-CE2 3.48Å; V412-F414 VanDerWaalsContact CG1-CE2 3.48Å; V412-F414 HydrophobicContact CG1-CZ 3.7Å; V412-G422 CarbonylContact C-O 3.52Å; V412-G422 WeakPolarHBondContact CA-O 3.19Å; V412-F423 HydrophobicContact CG1-CE1 4.17Å; V412-F423 HydrophobicContact CG1-CZ 4.42Å; V412-F423 HydrophobicContact CG2-CD1 4.14Å; V412-F423 HydrophobicContact CG2-CE1 4.08Å
413	V	98.8	Very high	97.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.8	-178.4	-177.7	0	0	0	0	109.9	M221 A249 I258 Y411 D415 L421 G422	M221-V413 HydrophobicContact CE-CG1 3.68Å; M221-V413 HydrophobicContact CG-CG1 4.11Å; M221-V413 HydrophobicContact SD-CG1 3.78Å; A249-V413 HydrophobicContact CB-CG1 4.44Å; A249-V413 HydrophobicContact CB-CG2 4.04Å; I258-V413 HydrophobicContact CD1-CG2 4.2Å; Y411-V413 HydrophobicContact CD1-CG2 4.01Å; Y411-V413 HydrophobicContact CE1-CG2 3.76Å; V413-D415 PolarHBondContact O-N 3.39Å; V413-L421 CarbonylContact O-C 3.45Å; V413-L421 WeakPolarHBondContact O-CA 3.28Å; V413-G422 PolarHBondContact N-O 3.22Å; V413-G422 PolarHBondContact O-N 3.24Å
414	F	98.8	Very high	97.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	84.4	178.4	-62.1	-102.2	0	0	0	109.1	T105 M221 F222 L224 Y269 V297 M407 V412 R416 L421	T105-F414 HydrophobicContact CG2-CE1 3.85Å; T105-F414 HydrophobicContact CG2-CE2 4.35Å; T105-F414 HydrophobicContact CG2-CZ 3.76Å; M221-F414 VanDerWaalsContact CA-O 3.31Å; M221-F414 WeakPolarHBondContact CA-O 3.13Å; F222-F414 HydrophobicContact CD1-CB 4.03Å; F222-F414 HydrophobicContact CD2-CB 4Å; F222-F414 AromaticContact CD2-CD2 3.76Å; F222-F414 HydrophobicContact CD2-CD2 3.76Å; F222-F414 HydrophobicContact CD2-CG 4.03Å; F222-F414 HydrophobicContact CE1-CB 3.7Å; F222-F414 HydrophobicContact CE1-CG 4.18Å; F222-F414 HydrophobicContact CE2-CB 3.66Å; F222-F414 AromaticContact CE2-CD1 3.96Å; F222-F414 HydrophobicContact CE2-CD1 3.96Å; F222-F414 AromaticContact CE2-CD2 3.28Å; F222-F414 HydrophobicContact CE2-CD2 3.28Å; F222-F414 HydrophobicContact CE2-CE1 4.48Å; F222-F414 AromaticContact CE2-CE2 3.88Å; F222-F414 HydrophobicContact CE2-CE2 3.88Å; F222-F414 AromaticContact CE2-CG 3.35Å; F222-F414 HydrophobicContact CE2-CG 3.35Å; F222-F414 HydrophobicContact CE2-CZ 4.44Å; F222-F414 HydrophobicContact CG-CB 4.18Å; F222-F414 HydrophobicContact CZ-CB 3.49Å; F222-F414 VanDerWaalsContact CZ-CB 3.49Å; F222-F414 AromaticContact CZ-CD1 3.74Å; F222-F414 HydrophobicContact CZ-CD1 3.74Å; F222-F414 AromaticContact CZ-CD2 3.9Å; F222-F414 HydrophobicContact CZ-CD2 3.9Å; F222-F414 HydrophobicContact CZ-CE1 4.47Å; F222-F414 AromaticContact CZ-CG 3.43Å; F222-F414 HydrophobicContact CZ-CG 3.43Å; F222-F414 VanDerWaalsContact CZ-CG 3.43Å; F222-F414 PolarHBondContact N-O 2.83Å; F222-F414 WeakPolarHBondContact O-CA 3.31Å; F222-F414 WeakPolarHBondContact O-CB 3.06Å; F222-F414 PolarHBondContact O-N 2.84Å; L224-F414 HydrophobicContact CB-CE2 4.26Å; L224-F414 HydrophobicContact CD1-CE2 3.8Å; L224-F414 HydrophobicContact CD1-CZ 4.25Å; L224-F414 HydrophobicContact CG-CE2 4.15Å; Y269-F414 AromaticContact CD1-CD1 3.56Å; Y269-F414 HydrophobicContact CD1-CD1 3.56Å; Y269-F414 HydrophobicContact CD1-CE1 4.17Å; Y269-F414 AromaticContact CD2-CD1 3.68Å; Y269-F414 HydrophobicContact CD2-CD1 3.68Å; Y269-F414 AromaticContact CD2-CE1 3.65Å; Y269-F414 HydrophobicContact CD2-CE1 3.65Å; Y269-F414 HydrophobicContact CE1-CB 4.25Å; Y269-F414 AromaticContact CE1-CD1 3.63Å; Y269-F414 HydrophobicContact CE1-CD1 3.63Å; Y269-F414 HydrophobicContact CE1-CG 4.42Å; Y269-F414 AromaticContact CE2-CD1 3.75Å; Y269-F414 HydrophobicContact CE2-CD1 3.75Å; Y269-F414 HydrophobicContact CE2-CE1 4.06Å; Y269-F414 AromaticContact CG-CD1 3.59Å; Y269-F414 HydrophobicContact CG-CD1 3.59Å; Y269-F414 AromaticContact CG-CE1 3.71Å; Y269-F414 HydrophobicContact CG-CE1 3.71Å; Y269-F414 AromaticContact CZ-CD1 3.74Å; V297-F414 HydrophobicContact CG1-CE1 4.32Å; V297-F414 HydrophobicContact CG1-CZ 4.06Å; M407-F414 HydrophobicContact CE-CE2 4.25Å; M407-F414 HydrophobicContact CE-CZ 3.89Å; V412-F414 HydrophobicContact CB-CE2 3.9Å; V412-F414 HydrophobicContact CB-CZ 4.45Å; V412-F414 HydrophobicContact CG1-CD2 4.17Å; V412-F414 HydrophobicContact CG1-CE2 3.48Å; V412-F414 VanDerWaalsContact CG1-CE2 3.48Å; V412-F414 HydrophobicContact CG1-CZ 3.7Å; F414-R416 PolarHBondContact O-N 2.95Å; F414-R416 VanDerWaalsContact O-N 3.15Å; F414-L421 HydrophobicContact CB-CD2 4.29Å; F414-L421 HydrophobicContact CD1-CD2 3.3Å; F414-L421 HydrophobicContact CE1-CD2 3.63Å; F414-L421 HydrophobicContact CG-CD2 3.81Å; F414-L421 HydrophobicContact CZ-CD2 4.39Å
415	D	98.5	Very high	97.9	Very high	2 Å²	2	19 Å²	19	1%	0.011	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	81.1	178.4	-166.3	-18	0	0	0	110.6	M221 V413 S417 Q418 K419 K420	M221-D415 HydrophobicContact CE-CB 3.38Å; M221-D415 WeakPolarHBondContact CE-OD2 3.15Å; V413-D415 PolarHBondContact O-N 3.39Å; D415-S417 PolarHBondContact O-N 3.48Å; D415-S417 PolarHBondContact OD1-N 3.38Å; D415-S417 PolarHBondContact OD1-OG 3.09Å; D415-Q418 PolarHBondContact O-N 2.81Å; D415-Q418 PolarHBondContact OD1-N 3.2Å; D415-Q418 PolarHBondContact OD2-NE2 3.46Å; D415-K419 PolarHBondContact O-N 3.26Å; D415-K420 CarbonylContact C-O 3.4Å; D415-K420 WeakPolarHBondContact CA-O 3.05Å; D415-K420 HydrophobicContact CB-CG 3.73Å; D415-K420 VanDerWaalsContact CB-O 3.32Å; D415-K420 WeakPolarHBondContact CB-O 3.34Å; D415-K420 PolarHBondContact N-O 2.76Å; D415-K420 PolarHBondContact O-N 3.47Å; D415-K420 WeakPolarHBondContact OD2-CE 3.26Å; D415-K420 IonicContact OD2-NZ 3.98Å
416	R	98.3	Very high	98	Very high	10 Å²	10	19.2 Å²	19.2	4%	0.038	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-31.1	178.1	-60.6	167.6	61.2	149.8	-6.8	111.4	L193 Y195 N210 N220 Y269 F414 Q418 K419	L193-R416 PolarHBondContact O-NH1 3.43Å; Y195-R416 HydrophobicContact CE1-CB 4.4Å; Y195-R416 HydrophobicContact CE1-CG 4.21Å; N210-R416 PolarHBondContact OD1-NH2 3.3Å; N220-R416 WeakPolarHBondContact O-CB 3.42Å; N220-R416 PolarHBondContact O-N 2.99Å; N220-R416 WeakPolarHBondContact OD1-CB 3.35Å; N220-R416 WeakPolarHBondContact OD1-CD 3.47Å; N220-R416 PolarHBondContact OD1-NE 2.9Å; Y269-R416 HydrophobicContact CE1-CG 4.09Å; Y269-R416 WeakPolarHBondContact OH-CD 3.37Å; F414-R416 PolarHBondContact O-N 2.95Å; F414-R416 VanDerWaalsContact O-N 3.15Å; R416-Q418 PolarHBondContact O-N 3.17Å; R416-K419 PolarHBondContact O-N 2.93Å
417	S	97.1	Very high	97.8	Very high	73 Å²	73	20.8 Å²	20.8	51%	0.51	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-37.5	179	77.9	0	0	0	0	113.3	N220 D415	N220-S417 PolarHBondContact O-N 2.89Å; D415-S417 PolarHBondContact O-N 3.48Å; D415-S417 PolarHBondContact OD1-N 3.38Å; D415-S417 PolarHBondContact OD1-OG 3.09Å
418	Q	97.5	Very high	97.5	Very high	122 Å²	122	22.4 Å²	22.4	57%	0.57	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.4	10	179.5	-59	-174.8	42.5	0	0	113.4	D415 R416 K420	D415-Q418 PolarHBondContact O-N 2.81Å; D415-Q418 PolarHBondContact OD1-N 3.2Å; D415-Q418 PolarHBondContact OD2-NE2 3.46Å; R416-Q418 PolarHBondContact O-N 3.17Å; Q418-K420 VanDerWaalsContact C-N 3.34Å; Q418-K420 HydrophobicContact CB-CD 3.94Å; Q418-K420 HydrophobicContact CB-CG 4.04Å; Q418-K420 PolarHBondContact O-N 3.03Å
419	K	98.1	Very high	97.3	Very high	107 Å²	107	22.2 Å²	22.2	47%	0.465	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	49.1	179	-52.8	-171.7	-177.7	-159.5	0	112.9	I263 E266 D415 R416	I263-K419 HydrophobicContact CB-CB 4.5Å; I263-K419 PolarHBondContact N-O 3.41Å; E266-K419 WeakPolarHBondContact OE1-CE 3.46Å; E266-K419 IonicContact OE1-NZ 3.85Å; E266-K419 VanDerWaalsContact OE2-CE 3.31Å; E266-K419 WeakPolarHBondContact OE2-CE 3.45Å; E266-K419 IonicContact OE2-NZ 3.63Å; E266-K419 PolarHBondContact OE2-NZ 3.3Å; D415-K419 PolarHBondContact O-N 3.26Å; R416-K419 PolarHBondContact O-N 2.93Å
420	K	98.2	Very high	96.8	Very high	33 Å²	33	24.1 Å²	24.1	14%	0.143	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152	-178.9	64.2	-174	-171.9	-174.1	0	112.1	Y260 T261 T360 D415 Q418	Y260-K420 HydrophobicContact CD1-CB 4.21Å; Y260-K420 HydrophobicContact CD1-CD 3.64Å; Y260-K420 HydrophobicContact CD1-CG 3.65Å; Y260-K420 HydrophobicContact CE1-CD 4.19Å; Y260-K420 HydrophobicContact CE1-CG 4.2Å; Y260-K420 HydrophobicContact CG-CD 3.9Å; Y260-K420 HydrophobicContact CG-CG 4.34Å; T261-K420 CarbonylContact O-C 3.51Å; T261-K420 VanDerWaalsContact O-CA 3.31Å; T261-K420 WeakPolarHBondContact O-CA 3.49Å; T261-K420 WeakPolarHBondContact O-CB 3.43Å; T360-K420 HydrophobicContact CG2-CB 4.4Å; T360-K420 HydrophobicContact CG2-CD 4.39Å; D415-K420 CarbonylContact C-O 3.4Å; D415-K420 WeakPolarHBondContact CA-O 3.05Å; D415-K420 HydrophobicContact CB-CG 3.73Å; D415-K420 VanDerWaalsContact CB-O 3.32Å; D415-K420 WeakPolarHBondContact CB-O 3.34Å; D415-K420 PolarHBondContact N-O 2.76Å; D415-K420 PolarHBondContact O-N 3.47Å; D415-K420 WeakPolarHBondContact OD2-CE 3.26Å; D415-K420 IonicContact OD2-NZ 3.98Å; Q418-K420 VanDerWaalsContact C-N 3.34Å; Q418-K420 HydrophobicContact CB-CD 3.94Å; Q418-K420 HydrophobicContact CB-CG 4.04Å; Q418-K420 PolarHBondContact O-N 3.03Å
421	L	98.3	Very high	96.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.9	174.9	-75.3	153.9	0	0	0	109.5	Y260 T261 I263 Y269 V271 V297 V413 F414 F423	Y260-L421 CarbonylContact C-O 3.55Å; Y260-L421 VanDerWaalsContact CA-O 3.27Å; Y260-L421 WeakPolarHBondContact CA-O 3.2Å; T261-L421 HydrophobicContact CG2-CB 3.87Å; T261-L421 PolarHBondContact N-O 2.84Å; T261-L421 PolarHBondContact O-N 2.7Å; I263-L421 HydrophobicContact CD1-CD1 4.38Å; I263-L421 HydrophobicContact CD1-CG 4.12Å; I263-L421 HydrophobicContact CG1-CD1 3.85Å; I263-L421 HydrophobicContact CG1-CG 3.91Å; Y269-L421 HydrophobicContact CD1-CD1 4.47Å; Y269-L421 HydrophobicContact CD1-CD2 4.07Å; Y269-L421 HydrophobicContact CG-CD2 4.39Å; V271-L421 HydrophobicContact CG1-CB 4.5Å; V271-L421 HydrophobicContact CG1-CD1 3.37Å; V297-L421 HydrophobicContact CG2-CD1 4.23Å; V413-L421 CarbonylContact O-C 3.45Å; V413-L421 WeakPolarHBondContact O-CA 3.28Å; F414-L421 HydrophobicContact CB-CD2 4.29Å; F414-L421 HydrophobicContact CD1-CD2 3.3Å; F414-L421 HydrophobicContact CE1-CD2 3.63Å; F414-L421 HydrophobicContact CG-CD2 3.81Å; F414-L421 HydrophobicContact CZ-CD2 4.39Å; L421-F423 HydrophobicContact CB-CE2 4.33Å
422	G	98.6	Very high	95.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	140.8	179.2	0	0	0	0	0	112	W259 Y260 V412 V413	W259-G422 CarbonylContact O-C 3.56Å; W259-G422 VanDerWaalsContact O-CA 3.28Å; W259-G422 WeakPolarHBondContact O-CA 3.22Å; Y260-G422 VanDerWaalsContact CD1-CA 3.45Å; V412-G422 CarbonylContact C-O 3.52Å; V412-G422 WeakPolarHBondContact CA-O 3.19Å; V413-G422 PolarHBondContact N-O 3.22Å; V413-G422 PolarHBondContact O-N 3.24Å
423	F	98.9	Very high	94.5	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.7	171.3	-66.1	-94.4	0	0	0	109.8	I258 W259 T261 V297 L357 F366 I368 F410 V412 L421 I439	I258-F423 WeakPolarHBondContact CA-O 3.17Å; W259-F423 PolarHBondContact N-O 3.21Å; W259-F423 PolarHBondContact O-N 3.26Å; T261-F423 HydrophobicContact CG2-CE2 4.07Å; V297-F423 HydrophobicContact CG2-CZ 3.98Å; L357-F423 HydrophobicContact CD1-CD2 4.07Å; L357-F423 HydrophobicContact CD1-CE2 3.68Å; L357-F423 HydrophobicContact CD1-CZ 4.22Å; F366-F423 HydrophobicContact CE2-CB 4.32Å; F366-F423 HydrophobicContact CE2-CD2 4.17Å; F366-F423 HydrophobicContact CZ-CD2 4.14Å; I368-F423 HydrophobicContact CD1-CD1 4.28Å; I368-F423 HydrophobicContact CD1-CE1 4.1Å; I368-F423 HydrophobicContact CD1-CZ 4.46Å; I368-F423 HydrophobicContact CG2-CB 3.94Å; I368-F423 HydrophobicContact CG2-CD1 4.24Å; I368-F423 HydrophobicContact CG2-CG 4.04Å; F410-F423 HydrophobicContact CB-CD1 4.13Å; F410-F423 HydrophobicContact CG-CD1 4.25Å; V412-F423 HydrophobicContact CG1-CE1 4.17Å; V412-F423 HydrophobicContact CG1-CZ 4.42Å; V412-F423 HydrophobicContact CG2-CD1 4.14Å; V412-F423 HydrophobicContact CG2-CE1 4.08Å; L421-F423 HydrophobicContact CB-CE2 4.33Å; F423-I439 HydrophobicContact CB-CD1 3.86Å; F423-I439 VanDerWaalsContact O-CD1 3.25Å; F423-I439 WeakPolarHBondContact O-CD1 3.34Å
424	A	98.6	Very high	93.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	164.6	168	0	0	0	0	0	109.9	Y254 I258 F410 Y411 S426	Y254-A424 HydrophobicContact CD2-CB 3.72Å; Y254-A424 HydrophobicContact CG-CB 3.97Å; I258-A424 HydrophobicContact CB-CB 4.5Å; I258-A424 HydrophobicContact CG1-CB 3.95Å; F410-A424 CarbonylContact C-O 3.48Å; F410-A424 VanDerWaalsContact CA-O 3.25Å; F410-A424 WeakPolarHBondContact CA-O 3.41Å; F410-A424 WeakPolarHBondContact CB-O 3.39Å; Y411-A424 PolarHBondContact N-O 3.41Å; Y411-A424 PolarHBondContact O-N 2.87Å; A424-S426 PolarHBondContact O-N 2.79Å
425	L	97.3	Very high	93.4	Very high	41 Å²	41	46.4 Å²	46.4	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	125.5	174.6	-62.4	179.5	0	0	0	109.3	Y254 R255 F410 S437 I439	Y254-L425 CarbonylContact C-O 3.6Å; Y254-L425 WeakPolarHBondContact CA-O 3.48Å; Y254-L425 WeakPolarHBondContact CB-O 3.44Å; R255-L425 HydrophobicContact CB-CB 4.47Å; R255-L425 PolarHBondContact N-O 3.33Å; F410-L425 HydrophobicContact CE1-CD2 4.25Å; L425-S437 WeakPolarHBondContact CD2-OG 3.3Å; L425-I439 HydrophobicContact CD1-CG2 4.43Å; L425-I439 HydrophobicContact CD2-CB 4.19Å; L425-I439 HydrophobicContact CD2-CG2 3.94Å; L425-I439 HydrophobicContact CG-CG2 3.81Å
426	S	96.1	Very high	93.2	Very high	5 Å²	5	46.5 Å²	46.5	4%	0.035	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	137.5	176.8	174.4	0	0	0	0	110.6	Q225 A424 C428 A429	Q225-S426 WeakPolarHBondContact CG-OG 3.46Å; Q225-S426 PolarHBondContact NE2-OG 2.59Å; A424-S426 PolarHBondContact O-N 2.79Å; S426-C428 PolarHBondContact O-N 3.34Å; S426-C428 PolarHBondContact OG-N 2.94Å; S426-C428 PolarHBondContact OG-SG 2.04Å; S426-A429 PolarHBondContact O-N 2.92Å
427	S	93.6	Very high	93.1	Very high	33 Å²	33	46.1 Å²	46.1	23%	0.231	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.5	177.5	64	0	0	0	0	113.6	Q225 T252 L253	Q225-S427 PolarHBondContact NE2-OG 3.42Å; Q225-S427 VanDerWaalsContact NE2-OG 3.08Å; T252-S427 PolarHBondContact O-OG 2.79Å; L253-S427 VanDerWaalsContact C-OG 3.25Å; L253-S427 WeakPolarHBondContact CA-OG 3.36Å; L253-S427 PolarHBondContact O-N 3.19Å; L253-S427 PolarHBondContact O-OG 2.89Å; L253-S427 VanDerWaalsContact O-OG 3.12Å
428	C	92.3	Very high	93.2	Very high	36 Å²	36	46.4 Å²	46.4	24%	0.243	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-9.5	177.9	68.3	0	0	0	0	114.3	C227 S426 V430	C227-C428 WeakPolarHBondContact CA-SG 3.41Å; C227-C428 HydrophobicContact CB-CB 3.67Å; C227-C428 WeakPolarHBondContact CB-SG 3.37Å; C227-C428 WeakPolarHBondContact SG-CB 3.29Å; C227-C428 CovalentContact SG-SG 2.03Å; C227-C428 PolarHBondContact SG-SG 2.94Å; S426-C428 PolarHBondContact O-N 3.34Å; S426-C428 PolarHBondContact OG-N 2.94Å; S426-C428 PolarHBondContact OG-SG 2.04Å; C428-V430 PolarHBondContact O-N 3.06Å
429	A	91.2	Very high	93.2	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	24%	0.237	C	C	.	.			trans	-80.5	61.6	178.9	0	0	0	0	0	111.5	E408 S426 L436	E408-A429 VanDerWaalsContact O-CB 3.22Å; E408-A429 WeakPolarHBondContact O-CB 3.31Å; S426-A429 PolarHBondContact O-N 2.92Å; A429-L436 PolarHBondContact O-N 3.37Å
430	V	86.4	Confident	93.2	Very high	39 Å²	39	38.5 Å²	38.5	24%	0.236	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.4	-173.5	-177.8	0	0	0	0	109.1	C428 G433 K434	C428-V430 PolarHBondContact O-N 3.06Å; V430-G433 VanDerWaalsContact CG1-CA 3.5Å; V430-K434 CarbonylContact C-O 3.52Å; V430-K434 VanDerWaalsContact CA-O 3.31Å; V430-K434 WeakPolarHBondContact CA-O 3.45Å; V430-K434 WeakPolarHBondContact CG1-O 3.4Å
431	S	84.2	Confident	93.1	Very high	34 Å²	34	38.3 Å²	38.3	24%	0.238	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.7	170.7	-173.6	0	0	0	0	109.4	G433 K434	S431-G433 PolarHBondContact O-N 3.3Å; S431-G433 VanDerWaalsContact O-N 3.16Å; S431-K434 PolarHBondContact N-O 3.33Å; S431-K434 WeakPolarHBondContact O-CB 3.44Å; S431-K434 PolarHBondContact O-N 3.44Å
432	D	81.2	Confident	93	Very high	154 Å²	154	41.7 Å²	41.7	82%	0.824	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	38.7	-175	-60	-36.4	0	0	0	113.7	K434	D432-K434 PolarHBondContact O-N 2.95Å
433	G	81.6	Confident	92.8	Very high	66 Å²	66	44.9 Å²	44.9	68%	0.68	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	0.4	-177.5	0	0	0	0	0	115.1	V430 S431	V430-G433 VanDerWaalsContact CG1-CA 3.5Å; S431-G433 PolarHBondContact O-N 3.3Å; S431-G433 VanDerWaalsContact O-N 3.16Å
434	K	86.1	Confident	92.6	Very high	154 Å²	154	49.1 Å²	49.1	67%	0.67	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.8	177.5	-63.4	179.8	-176.4	174.2	0	111.3	V430 S431 D432	V430-K434 CarbonylContact C-O 3.52Å; V430-K434 VanDerWaalsContact CA-O 3.31Å; V430-K434 WeakPolarHBondContact CA-O 3.45Å; V430-K434 WeakPolarHBondContact CG1-O 3.4Å; S431-K434 PolarHBondContact N-O 3.33Å; S431-K434 WeakPolarHBondContact O-CB 3.44Å; S431-K434 PolarHBondContact O-N 3.44Å; D432-K434 PolarHBondContact O-N 2.95Å
435	P	90.2	Very high	92.1	Very high	62 Å²	62	49.2 Å²	49.2	40%	0.403	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	144	172.6	-22	33	0	0	0	111.8	L371 S437	L371-P435 VanDerWaalsContact CD1-O 3.27Å; L371-P435 WeakPolarHBondContact CD1-O 3.42Å; P435-S437 VanDerWaalsContact C-N 3.31Å
436	L	93.7	Very high	91.2	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.021	32%	0.319	C	S	.	.	S	Bend	trans	-90	1.5	174.9	-61.4	-175	0	0	0	113.3	A229 L371 Q373 L374 A429	A229-L436 HydrophobicContact CB-CD1 3.67Å; L371-L436 VanDerWaalsContact CB-O 3.3Å; L371-L436 WeakPolarHBondContact CB-O 3.44Å; L371-L436 WeakPolarHBondContact CG-O 3.38Å; L371-L436 PolarHBondContact N-O 3.01Å; Q373-L436 HydrophobicContact CB-CD1 4.36Å; Q373-L436 HydrophobicContact CB-CD2 3.63Å; Q373-L436 HydrophobicContact CB-CG 4.47Å; Q373-L436 HydrophobicContact CG-CD2 3.67Å; L374-L436 HydrophobicContact CD1-CB 4.34Å; L374-L436 VanDerWaalsContact CD1-O 3.28Å; L374-L436 WeakPolarHBondContact CD1-O 3.47Å; L374-L436 HydrophobicContact CD2-CB 4.31Å; L374-L436 HydrophobicContact CD2-CD1 4.36Å; L374-L436 HydrophobicContact CG-CB 4.18Å; A429-L436 PolarHBondContact O-N 3.37Å
437	S	96.9	Very high	89.9	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.021	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	161	-176.1	62.1	0	0	0	0	111.4	T369 G409 L425 P435	T369-S437 CarbonylContact O-C 3.53Å; T369-S437 WeakPolarHBondContact O-CA 3.39Å; T369-S437 WeakPolarHBondContact O-CB 3.32Å; G409-S437 WeakPolarHBondContact O-CB 3.35Å; G409-S437 PolarHBondContact O-OG 2.91Å; L425-S437 WeakPolarHBondContact CD2-OG 3.3Å; P435-S437 VanDerWaalsContact C-N 3.31Å
438	E	98.1	Very high	89.1	Confident	79 Å²	79	58.8 Å²	58.8	37%	0.369	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.8	172.8	-48.5	172.1	177.6	0	0	109.7	T369	T369-E438 HydrophobicContact CG2-CB 4.49Å; T369-E438 PolarHBondContact N-O 3.33Å; T369-E438 PolarHBondContact O-N 3.33Å
439	I	98.2	Very high	87.9	Confident	33 Å²	33	59.4 Å²	59.4	17%	0.169	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133	172.3	-164.9	163.5	0	0	0	108.9	W259 F366 R367 I368 F423 L425	W259-I439 HydrophobicContact CB-CD1 4Å; W259-I439 VanDerWaalsContact CD1-CD1 3.49Å; W259-I439 HydrophobicContact CG-CD1 3.98Å; W259-I439 HydrophobicContact CG-CG1 4.24Å; F366-I439 HydrophobicContact CD2-CD1 4.27Å; F366-I439 HydrophobicContact CD2-CG1 4.32Å; F366-I439 HydrophobicContact CE2-CD1 4.41Å; R367-I439 WeakPolarHBondContact O-CA 3.4Å; R367-I439 WeakPolarHBondContact O-CG1 3.49Å; I368-I439 HydrophobicContact CG2-CD1 3.98Å; I368-I439 HydrophobicContact CG2-CG1 4.22Å; F423-I439 HydrophobicContact CB-CD1 3.86Å; F423-I439 VanDerWaalsContact O-CD1 3.25Å; F423-I439 WeakPolarHBondContact O-CD1 3.34Å; L425-I439 HydrophobicContact CD1-CG2 4.43Å; L425-I439 HydrophobicContact CD2-CB 4.19Å; L425-I439 HydrophobicContact CD2-CG2 3.94Å; L425-I439 HydrophobicContact CG-CG2 3.81Å
440	A	98	Very high	86.8	Confident	29 Å²	29	63.9 Å²	63.9	24%	0.24	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.1	-176.7	0	0	0	0	0	111.8	F366 R367 F443	F366-A440 CarbonylContact C-O 3.35Å; F366-A440 WeakPolarHBondContact CA-O 3.41Å; F366-A440 WeakPolarHBondContact CB-O 3.33Å; R367-A440 HydrophobicContact CG-CB 4.26Å; R367-A440 PolarHBondContact N-O 3.29Å; R367-A440 PolarHBondContact O-N 3.5Å; R367-A440 VanDerWaalsContact O-N 3.11Å; A440-F443 HydrophobicContact CB-CE2 4.2Å; A440-F443 HydrophobicContact CB-CZ 3.86Å; A440-F443 WeakPolarHBondContact O-CE2 3.42Å
441	G	95.2	Very high	86.2	Confident	29 Å²	29	65.8 Å²	65.8	30%	0.299	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	178.1	178.5	0	0	0	0	0	111.4	W259	W259-G441 VanDerWaalsContact CH2-O 3.22Å; W259-G441 WeakPolarHBondContact CH2-O 3.38Å; W259-G441 WeakPolarHBondContact CZ2-O 3.37Å
442	P	96.1	Very high	86.2	Confident	72 Å²	72	64.2 Å²	64.2	47%	0.468	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-79.7	150.1	-5.4	33.4	-31.4	0	0	0	111.1	W259 Q364 S365	W259-P442 HydrophobicContact CH2-CB 4.45Å; W259-P442 VanDerWaalsContact CH2-N 3.34Å; W259-P442 HydrophobicContact CZ3-CB 4.18Å; Q364-P442 HydrophobicContact CB-CB 4.22Å; Q364-P442 HydrophobicContact CG-CB 4.15Å; S365-P442 CarbonylContact O-C 3.51Å; S365-P442 WeakPolarHBondContact O-CA 3.08Å
443	F	95.8	Very high	85.8	Confident	67 Å²	67	57.8 Å²	57.8	29%	0.294	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	151	166.6	-53.8	-77.7	0	0	0	109.7	Y356 Q364 S365 R367 A440 A445	Y356-F443 AromaticContact CD1-CD2 4Å; Y356-F443 HydrophobicContact CD1-CD2 4Å; Y356-F443 HydrophobicContact CD1-CE2 4.41Å; Y356-F443 AromaticContact CE1-CD2 3.62Å; Y356-F443 HydrophobicContact CE1-CD2 3.62Å; Y356-F443 AromaticContact CE1-CE2 3.78Å; Y356-F443 HydrophobicContact CE1-CE2 3.78Å; Y356-F443 HydrophobicContact CE1-CG 4.05Å; Y356-F443 HydrophobicContact CE1-CZ 4.36Å; Q364-F443 CarbonylContact C-O 3.55Å; Q364-F443 VanDerWaalsContact CA-O 3.27Å; Q364-F443 WeakPolarHBondContact CA-O 3.48Å; S365-F443 PolarHBondContact N-O 3.48Å; S365-F443 PolarHBondContact O-N 2.91Å; R367-F443 HydrophobicContact CB-CE2 4.02Å; R367-F443 HydrophobicContact CG-CE2 3.81Å; R367-F443 HydrophobicContact CG-CZ 4.26Å; A440-F443 HydrophobicContact CB-CE2 4.2Å; A440-F443 HydrophobicContact CB-CZ 3.86Å; A440-F443 WeakPolarHBondContact O-CE2 3.42Å; F443-A445 PolarHBondContact O-N 2.91Å
444	S	94	Very high	84.7	Confident	89 Å²	89	56.5 Å²	56.5	62%	0.622	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	132.4	171.9	-176.9	0	0	0	0	110.2	A446	S444-A446 PolarHBondContact OG-N 3.37Å
445	A	89.1	Confident	83	Confident	2 Å²	2	52.3 Å²	52.3	2%	0.017	36%	0.357	C	S	.	.			trans	-116.9	14.5	170.8	0	0	0	0	0	111.8	L274 S363 F443 D447 V448	L274-A445 HydrophobicContact CD1-CB 3.97Å; S363-A445 PolarHBondContact O-N 3.04Å; F443-A445 PolarHBondContact O-N 2.91Å; A445-D447 VanDerWaalsContact C-N 3.28Å; A445-D447 PolarHBondContact O-N 3.49Å; A445-V448 PolarHBondContact O-N 3.06Å
446	A	77.2	Confident	80.9	Confident	72 Å²	72	54 Å²	54	60%	0.595	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-31.1	-177	0	0	0	0	0	113.3	S444	S444-A446 PolarHBondContact OG-N 3.37Å
447	D	69.8	Low	78.6	Confident	161 Å²	161	59.2 Å²	59.2	86%	0.861	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-9.6	-177.2	-55.2	-44.2	0	0	0	113.2	A445	A445-D447 VanDerWaalsContact C-N 3.28Å; A445-D447 PolarHBondContact O-N 3.49Å
448	V	75.1	Confident	76.2	Confident	47 Å²	47	66.5 Å²	66.5	29%	0.285	43%	0.425	S	S	.	.	S	Bend	trans	-82.6	140.7	172.4	-176.4	0	0	0	0	107.5	L274 C287 A445 A450 C452	L274-V448 HydrophobicContact CB-CG1 4.23Å; L274-V448 HydrophobicContact CD2-CG1 4.03Å; C287-V448 HydrophobicContact CB-CG1 4.17Å; A445-V448 PolarHBondContact O-N 3.06Å; V448-A450 PolarHBondContact O-N 2.76Å; V448-C452 WeakPolarHBondContact CG1-SG 3.34Å
449	A	68.1	Low	74.1	Confident	49 Å²	49	69.6 Å²	69.6	41%	0.405	44%	0.44	S	S	.	.			trans	-43.6	139.1	179.2	0	0	0	0	0	111	R358 D451	R358-A449 PolarHBondContact NH2-O 3.02Å; A449-D451 PolarHBondContact O-N 3.19Å
450	A	68.4	Low	72.2	Confident	97 Å²	97	72 Å²	72	80%	0.802	46%	0.457	S	S	*	.	S	Bend	trans	-56.6	-21.5	-178.1	0	0	0	0	0	112.8	R358 V448	R358-A450 PolarHBondContact NH2-O 3.45Å; V448-A450 PolarHBondContact O-N 2.76Å
451	D	72.5	Confident	70.3	Confident	79 Å²	79	73.7 Å²	73.7	42%	0.422	47%	0.465	S	S	.	.			trans	-143.9	109.6	175.5	-173.9	6.3	0	0	0	110.6	A449 S453	A449-D451 PolarHBondContact O-N 3.19Å; D451-S453 WeakPolarHBondContact OD1-CA 3.31Å; D451-S453 WeakPolarHBondContact OD1-CB 3.08Å; D451-S453 PolarHBondContact OD1-N 2.87Å; D451-S453 PolarHBondContact OD1-OG 3.32Å
452	C	85.3	Confident	68.8	Low	0 Å²	0	77.4 Å²	77.4	0%	0	48%	0.477	C	S	.	.			trans	-92.8	-16.5	172.2	-64.5	0	0	0	0	112.2	E272 L274 C287 K288 N291 V448 G454	E272-C452 HydrophobicContact CG-CB 4.02Å; E272-C452 VanDerWaalsContact OE1-CB 3.32Å; E272-C452 WeakPolarHBondContact OE1-CB 3.46Å; E272-C452 PolarHBondContact OE1-N 2.99Å; L274-C452 HydrophobicContact CD2-CB 4.12Å; C287-C452 HydrophobicContact CB-CB 3.7Å; C287-C452 WeakPolarHBondContact CB-SG 3.3Å; C287-C452 WeakPolarHBondContact SG-CB 3.4Å; C287-C452 CovalentContact SG-SG 2.03Å; C287-C452 PolarHBondContact SG-SG 3.05Å; K288-C452 WeakPolarHBondContact CA-O 3.36Å; N291-C452 WeakPolarHBondContact CB-O 3.28Å; N291-C452 PolarHBondContact ND2-O 2.94Å; V448-C452 WeakPolarHBondContact CG1-SG 3.34Å; C452-G454 PolarHBondContact O-N 3.3Å
453	S	72.7	Confident	67.3	Low	19 Å²	19	80.7 Å²	80.7	13%	0.133	48%	0.48	C	S	.	.	S	Bend	trans	-75.9	78.5	168.4	35.8	0	0	0	0	108.4	D451 G455	D451-S453 WeakPolarHBondContact OD1-CA 3.31Å; D451-S453 WeakPolarHBondContact OD1-CB 3.08Å; D451-S453 PolarHBondContact OD1-N 2.87Å; D451-S453 PolarHBondContact OD1-OG 3.32Å; S453-G455 PolarHBondContact O-N 3.19Å
454	G	59.1	Low	66.3	Low	39 Å²	39	84 Å²	84	40%	0.402	50%	0.498	S	S	.	.			trans	-43.1	110.1	179.7	0	0	0	0	0	110.3	C452 V456	C452-G454 PolarHBondContact O-N 3.3Å; G454-V456 PolarHBondContact O-N 3.34Å
455	G	49.1	Very low	65.5	Low	66 Å²	66	83.7 Å²	83.7	68%	0.68	49%	0.489	S	S	*	.			trans	-55.5	105.2	-179.7	0	0	0	0	0	108.5	S453 L457	S453-G455 PolarHBondContact O-N 3.19Å; G455-L457 PolarHBondContact O-N 2.75Å; G455-L457 VanDerWaalsContact O-N 3.08Å
456	V	47.2	Very low	65.1	Low	97 Å²	97	86.2 Å²	86.2	59%	0.588	51%	0.506	S	S	*	.			trans	-54.5	122	167.4	180	0	0	0	0	104.4	G454 K458	G454-V456 PolarHBondContact O-N 3.34Å; V456-K458 PolarHBondContact O-N 2.93Å
457	L	44.4	Very low	65.6	Low	115 Å²	115	89.7 Å²	89.7	60%	0.602	51%	0.505	S	S	*	.			trans	-48.9	101.3	164.6	-99.1	153.1	0	0	0	105.6	G455 E459 V461	G455-L457 PolarHBondContact O-N 2.75Å; G455-L457 VanDerWaalsContact O-N 3.08Å; L457-E459 PolarHBondContact O-N 3.34Å; L457-E459 VanDerWaalsContact O-N 3.09Å; L457-V461 HydrophobicContact CD2-CB 4.42Å; L457-V461 HydrophobicContact CD2-CG1 3.91Å
458	K	48.1	Very low	66.5	Low	156 Å²	156	84.7 Å²	84.7	68%	0.678	49%	0.486	S	S	*	.			trans	-45.9	125.3	-172.4	-68.2	-176.8	173.9	-175.7	0	107	V456 P460 V461 L462	V456-K458 PolarHBondContact O-N 2.93Å; K458-P460 HydrophobicContact CB-CG 3.8Å; K458-P460 WeakPolarHBondContact O-CD 3.44Å; K458-V461 HydrophobicContact CB-CG2 4.28Å; K458-V461 WeakPolarHBondContact O-CA 3.46Å; K458-V461 WeakPolarHBondContact O-CB 3.49Å; K458-V461 PolarHBondContact O-N 2.87Å; K458-L462 PolarHBondContact O-N 3.36Å
459	E	52.8	Low	67.2	Low	143 Å²	143	87.5 Å²	87.5	67%	0.668	50%	0.499	S	S	*	.	H	α-helix	trans	-37.5	-41.8	176.7	-74.9	-173.7	147.2	0	0	113.8	L457 V461 L462 W463	L457-E459 PolarHBondContact O-N 3.34Å; L457-E459 VanDerWaalsContact O-N 3.09Å; E459-V461 VanDerWaalsContact C-N 3.3Å; E459-V461 PolarHBondContact O-N 3.44Å; E459-L462 PolarHBondContact O-N 3.45Å; E459-L462 VanDerWaalsContact O-N 3.11Å; E459-W463 PolarHBondContact O-N 2.84Å
460	P	58.1	Low	68.4	Low	83 Å²	83	89.4 Å²	89.4	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-57.3	-33.8	174.2	18.3	-33.4	0	0	0	115.2	K458 M464	K458-P460 HydrophobicContact CB-CG 3.8Å; K458-P460 WeakPolarHBondContact O-CD 3.44Å; P460-M464 WeakPolarHBondContact O-CB 3.37Å; P460-M464 WeakPolarHBondContact O-CG 3.35Å; P460-M464 PolarHBondContact O-N 3.06Å
461	V	59.2	Low	69.4	Low	66 Å²	66	87.2 Å²	87.2	40%	0.4	49%	0.487	S	S	.	.	H	α-helix	trans	-70.8	-38.5	176.2	-178.6	0	0	0	0	110.8	L457 K458 E459 M464 I465	L457-V461 HydrophobicContact CD2-CB 4.42Å; L457-V461 HydrophobicContact CD2-CG1 3.91Å; K458-V461 HydrophobicContact CB-CG2 4.28Å; K458-V461 WeakPolarHBondContact O-CA 3.46Å; K458-V461 WeakPolarHBondContact O-CB 3.49Å; K458-V461 PolarHBondContact O-N 2.87Å; E459-V461 VanDerWaalsContact C-N 3.3Å; E459-V461 PolarHBondContact O-N 3.44Å; V461-M464 PolarHBondContact O-N 2.86Å; V461-I465 HydrophobicContact CG1-CD1 3.93Å; V461-I465 HydrophobicContact CG1-CG1 4.47Å; V461-I465 WeakPolarHBondContact O-CB 3.48Å; V461-I465 VanDerWaalsContact O-CG1 3.22Å; V461-I465 WeakPolarHBondContact O-CG1 3.41Å; V461-I465 PolarHBondContact O-N 2.6Å
462	L	62.7	Low	70.5	Confident	106 Å²	106	87.3 Å²	87.3	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-67.8	-40.8	176.4	-161.9	76	0	0	0	111.3	K458 E459 I465 S466	K458-L462 PolarHBondContact O-N 3.36Å; E459-L462 PolarHBondContact O-N 3.45Å; E459-L462 VanDerWaalsContact O-N 3.11Å; L462-I465 PolarHBondContact O-N 2.92Å; L462-S466 VanDerWaalsContact O-CB 3.29Å; L462-S466 WeakPolarHBondContact O-CB 3.36Å; L462-S466 PolarHBondContact O-N 3.47Å
463	W	65.8	Low	70.7	Confident	142 Å²	142	90.9 Å²	90.9	54%	0.538	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-43.2	170.7	-78.8	103.5	0	0	0	111.7	E459 I465 S466 Y467	E459-W463 PolarHBondContact O-N 2.84Å; W463-I465 PolarHBondContact O-N 3.26Å; W463-S466 PolarHBondContact O-N 3.48Å; W463-Y467 HydrophobicContact CB-CD2 4.27Å; W463-Y467 HydrophobicContact CB-CE2 4.12Å; W463-Y467 HydrophobicContact CD2-CE2 4.34Å; W463-Y467 HydrophobicContact CE3-CD2 4.39Å; W463-Y467 AromaticContact CE3-CE2 3.56Å; W463-Y467 HydrophobicContact CE3-CE2 3.56Å; W463-Y467 AromaticContact CE3-CZ 3.68Å; W463-Y467 HydrophobicContact CZ3-CE2 4.35Å; W463-Y467 WeakPolarHBondContact O-CB 3.22Å; W463-Y467 WeakPolarHBondContact O-CD2 3.38Å; W463-Y467 PolarHBondContact O-N 2.93Å
464	M	72.9	Confident	71.6	Confident	137 Å²	137	92.2 Å²	92.2	68%	0.675	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-42.5	175.5	-74.7	-77.9	-72.6	0	0	112.2	P460 V461 A468	P460-M464 WeakPolarHBondContact O-CB 3.37Å; P460-M464 WeakPolarHBondContact O-CG 3.35Å; P460-M464 PolarHBondContact O-N 3.06Å; V461-M464 PolarHBondContact O-N 2.86Å; M464-A468 WeakPolarHBondContact O-CB 3.18Å; M464-A468 PolarHBondContact O-N 3.37Å
465	I	78.7	Confident	73.1	Confident	81 Å²	81	96.2 Å²	96.2	42%	0.415	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-42.7	175	-68.9	164.4	0	0	0	110.5	V461 L462 W463 A468 L469	V461-I465 HydrophobicContact CG1-CD1 3.93Å; V461-I465 HydrophobicContact CG1-CG1 4.47Å; V461-I465 WeakPolarHBondContact O-CB 3.48Å; V461-I465 VanDerWaalsContact O-CG1 3.22Å; V461-I465 WeakPolarHBondContact O-CG1 3.41Å; V461-I465 PolarHBondContact O-N 2.6Å; L462-I465 PolarHBondContact O-N 2.92Å; W463-I465 PolarHBondContact O-N 3.26Å; I465-A468 PolarHBondContact O-N 3.05Å; I465-L469 HydrophobicContact CG2-CD1 3.85Å; I465-L469 WeakPolarHBondContact O-CB 3.43Å; I465-L469 WeakPolarHBondContact O-CG 3.32Å; I465-L469 PolarHBondContact O-N 3.14Å
466	S	80.9	Confident	75.2	Confident	55 Å²	55	97.8 Å²	97.8	39%	0.385	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-49.4	177.6	-175.4	0	0	0	0	111.9	L462 W463 A468 L469 V470	L462-S466 VanDerWaalsContact O-CB 3.29Å; L462-S466 WeakPolarHBondContact O-CB 3.36Å; L462-S466 PolarHBondContact O-N 3.47Å; W463-S466 PolarHBondContact O-N 3.48Å; S466-A468 VanDerWaalsContact C-N 3.33Å; S466-A468 PolarHBondContact O-N 2.95Å; S466-L469 PolarHBondContact O-N 2.79Å; S466-V470 VanDerWaalsContact O-CG2 3.3Å; S466-V470 WeakPolarHBondContact O-CG2 3.32Å; S466-V470 PolarHBondContact O-N 3.27Å
467	Y	87.4	Confident	77.3	Confident	146 Å²	146	98.3 Å²	98.3	57%	0.573	53%	0.529	S	S	*	.	H	α-helix	trans	-63.6	-37.9	176.2	-73.3	-57.7	0	0	0	112.2	W463 V470 A471	W463-Y467 HydrophobicContact CB-CD2 4.27Å; W463-Y467 HydrophobicContact CB-CE2 4.12Å; W463-Y467 HydrophobicContact CD2-CE2 4.34Å; W463-Y467 HydrophobicContact CE3-CD2 4.39Å; W463-Y467 AromaticContact CE3-CE2 3.56Å; W463-Y467 HydrophobicContact CE3-CE2 3.56Å; W463-Y467 AromaticContact CE3-CZ 3.68Å; W463-Y467 HydrophobicContact CZ3-CE2 4.35Å; W463-Y467 WeakPolarHBondContact O-CB 3.22Å; W463-Y467 WeakPolarHBondContact O-CD2 3.38Å; W463-Y467 PolarHBondContact O-N 2.93Å; Y467-V470 PolarHBondContact O-N 3.48Å; Y467-A471 WeakPolarHBondContact O-CB 3.2Å; Y467-A471 PolarHBondContact O-N 3.24Å
468	A	88.1	Confident	79.5	Confident	56 Å²	56	97.4 Å²	97.4	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-44.2	173.8	0	0	0	0	0	111.6	M464 I465 S466 A471 V472	M464-A468 WeakPolarHBondContact O-CB 3.18Å; M464-A468 PolarHBondContact O-N 3.37Å; I465-A468 PolarHBondContact O-N 3.05Å; S466-A468 VanDerWaalsContact C-N 3.33Å; S466-A468 PolarHBondContact O-N 2.95Å; A468-A471 PolarHBondContact O-N 3.44Å; A468-V472 VanDerWaalsContact O-CG2 3.3Å; A468-V472 WeakPolarHBondContact O-CG2 3.41Å; A468-V472 PolarHBondContact O-N 3.47Å
469	L	90.6	Very high	81.5	Confident	105 Å²	105	91.3 Å²	91.3	55%	0.55	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-44	175.2	-82.9	160.6	0	0	0	111.9	I465 S466 A471 V472 C473	I465-L469 HydrophobicContact CG2-CD1 3.85Å; I465-L469 WeakPolarHBondContact O-CB 3.43Å; I465-L469 WeakPolarHBondContact O-CG 3.32Å; I465-L469 PolarHBondContact O-N 3.14Å; S466-L469 PolarHBondContact O-N 2.79Å; L469-A471 VanDerWaalsContact C-N 3.34Å; L469-A471 PolarHBondContact O-N 2.94Å; L469-V472 PolarHBondContact O-N 3.04Å; L469-C473 WeakPolarHBondContact O-CB 3.23Å; L469-C473 PolarHBondContact O-N 3.1Å; L469-C473 PolarHBondContact O-SG 2.95Å; L469-C473 VanDerWaalsContact O-SG 3.37Å
470	V	92.2	Very high	83.1	Confident	90 Å²	90	89.2 Å²	89.2	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-42.4	176.2	171.5	0	0	0	0	110.9	S466 Y467 C473 A474	S466-V470 VanDerWaalsContact O-CG2 3.3Å; S466-V470 WeakPolarHBondContact O-CG2 3.32Å; S466-V470 PolarHBondContact O-N 3.27Å; Y467-V470 PolarHBondContact O-N 3.48Å; V470-C473 PolarHBondContact O-N 3.03Å; V470-A474 WeakPolarHBondContact O-CB 3.3Å; V470-A474 PolarHBondContact O-N 3.33Å
471	A	90.4	Very high	84.4	Confident	51 Å²	51	89.5 Å²	89.5	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-42.5	176.9	0	0	0	0	0	112.2	Y467 A468 L469 A474 L475	Y467-A471 WeakPolarHBondContact O-CB 3.2Å; Y467-A471 PolarHBondContact O-N 3.24Å; A468-A471 PolarHBondContact O-N 3.44Å; L469-A471 VanDerWaalsContact C-N 3.34Å; L469-A471 PolarHBondContact O-N 2.94Å; A471-A474 PolarHBondContact O-N 2.89Å; A471-L475 WeakPolarHBondContact O-CG 3.49Å; A471-L475 PolarHBondContact O-N 3.3Å
472	V	93.9	Very high	85.5	Confident	81 Å²	81	91.2 Å²	91.2	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-45.7	175	170.9	0	0	0	0	110.9	A468 L469 A474 L475 I476	A468-V472 VanDerWaalsContact O-CG2 3.3Å; A468-V472 WeakPolarHBondContact O-CG2 3.41Å; A468-V472 PolarHBondContact O-N 3.47Å; L469-V472 PolarHBondContact O-N 3.04Å; V472-A474 VanDerWaalsContact C-N 3.35Å; V472-A474 PolarHBondContact O-N 3.38Å; V472-L475 PolarHBondContact O-N 3.44Å; V472-I476 HydrophobicContact CG1-CD1 3.93Å; V472-I476 WeakPolarHBondContact O-CG1 3.2Å; V472-I476 PolarHBondContact O-N 3.37Å
473	C	90.8	Very high	86.3	Confident	75 Å²	75	91.8 Å²	91.8	51%	0.507	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-43.2	175.7	-75.2	0	0	0	0	112.1	L469 V470 L475 I476 L477	L469-C473 WeakPolarHBondContact O-CB 3.23Å; L469-C473 PolarHBondContact O-N 3.1Å; L469-C473 PolarHBondContact O-SG 2.95Å; L469-C473 VanDerWaalsContact O-SG 3.37Å; V470-C473 PolarHBondContact O-N 3.03Å; C473-L475 PolarHBondContact O-N 3.35Å; C473-I476 PolarHBondContact O-N 3.01Å; C473-L477 WeakPolarHBondContact O-CB 3.44Å; C473-L477 PolarHBondContact O-N 3.27Å
474	A	90.3	Very high	86.7	Confident	47 Å²	47	92 Å²	92	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.5	0	0	0	0	0	112.2	V470 A471 V472 L477 I478	V470-A474 WeakPolarHBondContact O-CB 3.3Å; V470-A474 PolarHBondContact O-N 3.33Å; A471-A474 PolarHBondContact O-N 2.89Å; V472-A474 VanDerWaalsContact C-N 3.35Å; V472-A474 PolarHBondContact O-N 3.38Å; A474-L477 PolarHBondContact O-N 3.01Å; A474-I478 VanDerWaalsContact O-CG1 3.28Å; A474-I478 WeakPolarHBondContact O-CG1 3.49Å; A474-I478 PolarHBondContact O-N 3.03Å
475	L	92.5	Very high	86.5	Confident	123 Å²	123	91.7 Å²	91.7	64%	0.644	52%	0.516	S	S	*	.	H	α-helix	trans	-64.1	-41.1	177.3	-72.7	171.6	0	0	0	112.5	A471 V472 C473 L477 I478 G479	A471-L475 WeakPolarHBondContact O-CG 3.49Å; A471-L475 PolarHBondContact O-N 3.3Å; V472-L475 PolarHBondContact O-N 3.44Å; C473-L475 PolarHBondContact O-N 3.35Å; L475-L477 VanDerWaalsContact C-N 3.33Å; L475-I478 PolarHBondContact O-N 3.29Å; L475-G479 PolarHBondContact O-N 3.08Å
476	I	92.6	Very high	86	Confident	99 Å²	99	93.2 Å²	93.2	51%	0.508	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-43.6	175.4	-67.3	166.9	0	0	0	110.3	V472 C473 G479 L480	V472-I476 HydrophobicContact CG1-CD1 3.93Å; V472-I476 WeakPolarHBondContact O-CG1 3.2Å; V472-I476 PolarHBondContact O-N 3.37Å; C473-I476 PolarHBondContact O-N 3.01Å; I476-G479 PolarHBondContact O-N 3.39Å; I476-L480 HydrophobicContact CG2-CD1 4.05Å; I476-L480 WeakPolarHBondContact O-CG 3.4Å; I476-L480 PolarHBondContact O-N 3.28Å
477	L	90.1	Very high	85.1	Confident	108 Å²	108	95.9 Å²	95.9	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-40.8	-179.6	-129.6	143.6	0	0	0	112	C473 A474 L475 L480 L481	C473-L477 WeakPolarHBondContact O-CB 3.44Å; C473-L477 PolarHBondContact O-N 3.27Å; A474-L477 PolarHBondContact O-N 3.01Å; L475-L477 VanDerWaalsContact C-N 3.33Å; L477-L480 PolarHBondContact O-N 2.95Å; L477-L481 HydrophobicContact CD2-CD1 4.03Å; L477-L481 WeakPolarHBondContact O-CB 3.37Å; L477-L481 PolarHBondContact O-N 3.42Å
478	I	90.9	Very high	83.6	Confident	95 Å²	95	94.9 Å²	94.9	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-62.8	-43.6	173.2	-68.9	165.4	0	0	0	110.5	A474 L475 L480 L481 L482	A474-I478 VanDerWaalsContact O-CG1 3.28Å; A474-I478 WeakPolarHBondContact O-CG1 3.49Å; A474-I478 PolarHBondContact O-N 3.03Å; L475-I478 PolarHBondContact O-N 3.29Å; I478-L480 PolarHBondContact O-N 2.98Å; I478-L481 PolarHBondContact O-N 3.07Å; I478-L482 HydrophobicContact CG2-CD1 3.95Å; I478-L482 HydrophobicContact CG2-CG 4.39Å; I478-L482 WeakPolarHBondContact O-CB 3.47Å; I478-L482 VanDerWaalsContact O-CG 3.3Å; I478-L482 WeakPolarHBondContact O-CG 3.33Å; I478-L482 PolarHBondContact O-N 3.28Å
479	G	90.5	Very high	81.9	Confident	29 Å²	29	103.9 Å²	103.9	30%	0.299	58%	0.575	S	S	.	*	H	α-helix	trans	-59.7	-44	176.1	0	0	0	0	0	112.9	L475 I476 L482 L483	L475-G479 PolarHBondContact O-N 3.08Å; I476-G479 PolarHBondContact O-N 3.39Å; G479-L482 PolarHBondContact O-N 3.36Å; G479-L483 WeakPolarHBondContact O-CG 3.35Å; G479-L483 PolarHBondContact O-N 2.74Å
480	L	86.8	Confident	79.8	Confident	98 Å²	98	107.1 Å²	107.1	51%	0.513	59%	0.587	S	S	.	*	H	α-helix	trans	-65.3	-40.8	176	-71.6	168.5	0	0	0	112.4	I476 L477 I478 L483 L484	I476-L480 HydrophobicContact CG2-CD1 4.05Å; I476-L480 WeakPolarHBondContact O-CG 3.4Å; I476-L480 PolarHBondContact O-N 3.28Å; L477-L480 PolarHBondContact O-N 2.95Å; I478-L480 PolarHBondContact O-N 2.98Å; L480-L483 PolarHBondContact O-N 3.16Å; L480-L484 WeakPolarHBondContact O-CG 3.34Å; L480-L484 PolarHBondContact O-N 3.38Å
481	L	84.8	Confident	77.6	Confident	90 Å²	90	114 Å²	114	47%	0.471	60%	0.603	S	S	.	*	H	α-helix	trans	-62.6	-41.6	174.2	-89	156.6	0	0	0	112	L477 I478 L483 L484 L485	L477-L481 HydrophobicContact CD2-CD1 4.03Å; L477-L481 WeakPolarHBondContact O-CB 3.37Å; L477-L481 PolarHBondContact O-N 3.42Å; I478-L481 PolarHBondContact O-N 3.07Å; L481-L483 VanDerWaalsContact C-N 3.34Å; L481-L484 PolarHBondContact O-N 3.09Å; L481-L485 WeakPolarHBondContact O-CG 2.98Å; L481-L485 PolarHBondContact O-N 3Å; L481-L485 VanDerWaalsContact O-N 3.08Å
482	L	82.8	Confident	75.4	Confident	102 Å²	102	118.5 Å²	118.5	53%	0.534	62%	0.62	S	S	.	*	H	α-helix	trans	-65.7	-36.7	175.6	-72	170.6	0	0	0	112	I478 G479 L484 L485 L486	I478-L482 HydrophobicContact CG2-CD1 3.95Å; I478-L482 HydrophobicContact CG2-CG 4.39Å; I478-L482 WeakPolarHBondContact O-CB 3.47Å; I478-L482 VanDerWaalsContact O-CG 3.3Å; I478-L482 WeakPolarHBondContact O-CG 3.33Å; I478-L482 PolarHBondContact O-N 3.28Å; G479-L482 PolarHBondContact O-N 3.36Å; L482-L484 VanDerWaalsContact C-N 3.33Å; L482-L485 PolarHBondContact O-N 3.15Å; L482-L486 WeakPolarHBondContact O-CG 3.32Å; L482-L486 PolarHBondContact O-N 3.04Å; L482-L486 VanDerWaalsContact O-N 3.07Å
483	L	79.9	Confident	72.9	Confident	118 Å²	118	126.1 Å²	126.1	62%	0.618	64%	0.64	S	S	*	*	H	α-helix	trans	-66.3	-33.2	174	-75	166.6	0	0	0	112.8	G479 L480 L481 L486	G479-L483 WeakPolarHBondContact O-CG 3.35Å; G479-L483 PolarHBondContact O-N 2.74Å; L480-L483 PolarHBondContact O-N 3.16Å; L481-L483 VanDerWaalsContact C-N 3.34Å; L483-L486 HydrophobicContact CD2-CD1 4.24Å
484	L	74.4	Confident	70.3	Confident	145 Å²	145	126.3 Å²	126.3	76%	0.759	66%	0.655	S	S	*	*	H	α-helix	trans	-73.1	-28	173.9	-74.3	164.8	0	0	0	113.1	L480 L481 L482	L480-L484 WeakPolarHBondContact O-CG 3.34Å; L480-L484 PolarHBondContact O-N 3.38Å; L481-L484 PolarHBondContact O-N 3.09Å; L482-L484 VanDerWaalsContact C-N 3.33Å
485	L	68.4	Low	67.8	Low	132 Å²	132	132.4 Å²	132.4	69%	0.691	68%	0.675	S	S	*	*	H	α-helix	trans	-88	-11.7	179	-68.9	170.4	0	0	0	113.4	L481 L482 P487	L481-L485 WeakPolarHBondContact O-CG 2.98Å; L481-L485 PolarHBondContact O-N 3Å; L481-L485 VanDerWaalsContact O-N 3.08Å; L482-L485 PolarHBondContact O-N 3.15Å; L485-P487 WeakPolarHBondContact O-CD 3.45Å
486	L	68.8	Low	65.4	Low	112 Å²	112	132.9 Å²	132.9	59%	0.586	68%	0.677	S	S	*	*	S	Bend	trans	-71.7	116.7	172	-85	160.1	0	0	0	108.9	L482 L483 C488	L482-L486 WeakPolarHBondContact O-CG 3.32Å; L482-L486 PolarHBondContact O-N 3.04Å; L482-L486 VanDerWaalsContact O-N 3.07Å; L483-L486 HydrophobicContact CD2-CD1 4.24Å; L486-C488 PolarHBondContact O-N 2.85Å; L486-C488 VanDerWaalsContact O-N 3.16Å
487	P	60.4	Low	62.8	Low	111 Å²	111	134.5 Å²	134.5	72%	0.721	69%	0.691	S	S	*	*			trans	-61.8	123.5	178.1	-14.6	27.3	0	0	0	108.4	L485 R489	L485-P487 WeakPolarHBondContact O-CD 3.45Å; P487-R489 VanDerWaalsContact C-N 3.27Å; P487-R489 PolarHBondContact O-N 3.36Å
488	C	57.4	Low	60.4	Low	126 Å²	126	136.5 Å²	136.5	85%	0.851	70%	0.703	S	S	*	*			trans	-52.3	97.5	165.4	-76.2	0	0	0	0	108	L486 H490	L486-C488 PolarHBondContact O-N 2.85Å; L486-C488 VanDerWaalsContact O-N 3.16Å; C488-H490 PolarHBondContact O-N 3.3Å
489	R	51.8	Low	57.8	Low	245 Å²	245	139.6 Å²	139.6	93%	0.925	72%	0.715	S	S	*	*			trans	-73.2	88.8	175.7	-132.1	179.2	175.1	179.5	-1.7	105.9	P487 R491	P487-R489 VanDerWaalsContact C-N 3.27Å; P487-R489 PolarHBondContact O-N 3.36Å; R489-R491 PolarHBondContact O-N 3.36Å
490	H	47.3	Very low	55.4	Low	173 Å²	173	143.2 Å²	143.2	80%	0.801	74%	0.736	S	S	*	*			trans	-48.8	111.1	168.1	-122.9	-66.1	0	0	0	107.4	C488 D492	C488-H490 PolarHBondContact O-N 3.3Å; H490-D492 VanDerWaalsContact C-N 3.35Å; H490-D492 PolarHBondContact O-N 3.37Å
491	R	44.2	Very low	53.1	Low	234 Å²	234	143.1 Å²	143.1	88%	0.883	74%	0.743	S	S	*	*			trans	-86.1	87.3	173.3	-168.2	171.8	179.8	159.6	-1.9	106.6	R489 R493	R489-R491 PolarHBondContact O-N 3.36Å; R491-R493 PolarHBondContact O-N 3.21Å
492	D	45.7	Very low	51	Low	146 Å²	146	146.1 Å²	146.1	78%	0.781	76%	0.759	S	S	*	*			trans	-59.9	121.9	166.7	-101.9	-26.2	0	0	0	109.7	H490	H490-D492 VanDerWaalsContact C-N 3.35Å; H490-D492 PolarHBondContact O-N 3.37Å
493	R	39.8	Very low	49.1	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	78%	0.776	S	S	*	*			trans	-165.5	116.7	151.9	-113.1	-177	-167.4	-164.7	2.2	110.5	R491	R491-R493 PolarHBondContact O-N 3.21Å
494	G	36.3	Very low	47.3	Very low	79 Å²	79	153.2 Å²	153.2	81%	0.814	79%	0.787	S	S	*	*			trans	118.5	92.7	142	0	0	0	0	0	116.3
495	E	38.9	Very low	45.7	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.813	79%	0.788	S	S	*	*			trans	-22.3	138.9	158.2	-85.2	172.6	137	0	0	120.6
496	I	42.5	Very low	44.4	Very low	133 Å²	133	159.8 Å²	159.8	68%	0.682	80%	0.799	S	S	*	*			trans	71.2	113	133.5	-56.2	162.8	0	0	0	118.4
497	T	38.1	Very low	43	Very low	133 Å²	133	162.2 Å²	162.2	82%	0.816	81%	0.811	S	S	*	*				-164.6	122.2	102.4	39.1	0	0	0	0	111.9
498	D	39	Very low	42	Very low	150 Å²	150	169.9 Å²	169.9	80%	0.802	83%	0.833	S	S	*	*			trans	7.7	154.6	142.8	-101	-27.9	0	0	0	124
499	E	35.8	Very low	41.3	Very low	160 Å²	160	172.1 Å²	172.1	75%	0.748	83%	0.832	S	S	*	*			trans	87.9	112	155.8	-71.2	-73.6	166.5	0	0	119.7
500	S	41.1	Very low	40.7	Very low	106 Å²	106	168.3 Å²	168.3	74%	0.741	83%	0.827	S	S	*	*			trans	129.3	77.5	142.2	62.3	0	0	0	0	113.4
501	S	37.3	Very low	40.4	Very low	95 Å²	95	168 Å²	168	66%	0.664	83%	0.829	S	S	*	*				53.1	112.6	86.9	94.5	0	0	0	0	114.8
502	L	40.8	Very low	40.1	Very low	153 Å²	153	164.1 Å²	164.1	80%	0.801	83%	0.825	S	S	*	*				153.2	88.9	124.3	-80.5	163.1	0	0	0	111.4
503	V	43.6	Very low	39.8	Very low	145 Å²	145	165.3 Å²	165.3	88%	0.879	83%	0.828	S	S	*	*			trans	-97.9	113.5	143.2	174.3	0	0	0	0	106.4
504	R	41.3	Very low	39.8	Very low	225 Å²	225	160.2 Å²	160.2	85%	0.849	82%	0.823	S	S	*	*			trans	-135	111.3	161.5	-130.1	-177.7	-153.9	-174.2	7.8	109.9
505	H	41.5	Very low	40	Very low	172 Å²	172	166 Å²	166	80%	0.796	82%	0.823	S	S	*	*			trans	-6.2	136.2	153.3	-67.6	-80.8	0	0	0	117.5
506	R	40.6	Very low	40.1	Very low	242 Å²	242	165.4 Å²	165.4	91%	0.913	82%	0.824	S	S	*	*				-179.3	139.1	99.9	-116.4	177.3	-173.7	167.9	2.5	113.4
507	I	40.4	Very low	39.9	Very low	164 Å²	164	168.1 Å²	168.1	84%	0.841	84%	0.836	S	S	*	*			trans	-56.8	129.3	153.8	-67.5	160.5	0	0	0	109.7
508	K	39.5	Very low	40.1	Very low	272 Å²	272	171.3 Å²	171.3	100%	1.183	84%	0.838	S	S	*	*			trans	-159.4	0	132.4	-115.8	-175.1	-178.3	-174.3	0	110.3

Retrieved 508 of 508 residues in 255.4 ms (Link to these results)

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