A0A087YA94_POEFO Loading...

GTP binding protein 2

AlphaFold DB , UniProt , Accession A0A087YA94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 610 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	48	Very low	51	Low	78 Å²	78	51.4 Å²	51.4	38%	0.384	29%	0.285	S	S	.	.				0	132.7	0	-71.5	172.5	176.4	0	0	108.7	V516 K557 I587	M1-V516 HydrophobicContact CB-CG2 4.45Å; M1-K557 VanDerWaalsContact O-CE 3.26Å; M1-K557 WeakPolarHBondContact O-CE 3.25Å; M1-K557 PolarHBondContact O-NZ 2.87Å; M1-I587 HydrophobicContact SD-CD1 4.48Å
2	D	49.2	Very low	49.5	Very low	54 Å²	54	55.3 Å²	55.3	29%	0.289	33%	0.329	S	S	.	.			trans	-81.7	127.1	-175.7	-164.4	-27.3	0	0	0	109.8	R4 V5	D2-R4 PolarHBondContact O-N 3.08Å; D2-R4 VanDerWaalsContact O-N 3.11Å; D2-R4 WeakPolarHBondContact OD1-CB 3.34Å; D2-R4 WeakPolarHBondContact OD1-CG 3.41Å; D2-R4 IonicContact OD1-CZ 3.87Å; D2-R4 PolarHBondContact OD1-N 3.11Å; D2-R4 VanDerWaalsContact OD1-N 3.11Å; D2-R4 IonicContact OD1-NE 3.74Å; D2-R4 PolarHBondContact OD1-NE 3.14Å; D2-R4 IonicContact OD1-NH2 3.44Å; D2-R4 IonicContact OD2-CZ 2.87Å; D2-R4 IonicContact OD2-NE 2.66Å; D2-R4 PolarHBondContact OD2-NE 2.62Å; D2-R4 IonicContact OD2-NH2 2.67Å; D2-R4 PolarHBondContact OD2-NH2 3.2Å; D2-V5 WeakPolarHBondContact O-CG2 3.2Å; D2-V5 PolarHBondContact O-N 3.23Å
3	A	47.7	Very low	47.9	Very low	27 Å²	27	60.1 Å²	60.1	22%	0.223	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-60.3	-19	179.1	0	0	0	0	0	113.2	V5 S6 V516 G555	A3-V5 VanDerWaalsContact C-N 3.29Å; A3-V5 PolarHBondContact O-N 3.16Å; A3-S6 WeakPolarHBondContact O-CB 3.37Å; A3-S6 PolarHBondContact O-N 3.42Å; A3-S6 PolarHBondContact O-OG 3.39Å; A3-V516 HydrophobicContact CB-CG1 4.28Å; A3-G555 VanDerWaalsContact CB-O 3.25Å; A3-G555 WeakPolarHBondContact CB-O 3.18Å
4	R	56.5	Low	46.6	Very low	125 Å²	125	61.4 Å²	61.4	47%	0.472	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-79.7	-5	-175.8	-64.5	176.4	-74.2	-174.4	-2.7	114.5	D2 S6 E7	D2-R4 PolarHBondContact O-N 3.08Å; D2-R4 VanDerWaalsContact O-N 3.11Å; D2-R4 WeakPolarHBondContact OD1-CB 3.34Å; D2-R4 WeakPolarHBondContact OD1-CG 3.41Å; D2-R4 IonicContact OD1-CZ 3.87Å; D2-R4 PolarHBondContact OD1-N 3.11Å; D2-R4 VanDerWaalsContact OD1-N 3.11Å; D2-R4 IonicContact OD1-NE 3.74Å; D2-R4 PolarHBondContact OD1-NE 3.14Å; D2-R4 IonicContact OD1-NH2 3.44Å; D2-R4 IonicContact OD2-CZ 2.87Å; D2-R4 IonicContact OD2-NE 2.66Å; D2-R4 PolarHBondContact OD2-NE 2.62Å; D2-R4 IonicContact OD2-NH2 2.67Å; D2-R4 PolarHBondContact OD2-NH2 3.2Å; R4-S6 PolarHBondContact O-N 3.42Å; R4-S6 VanDerWaalsContact O-N 3.14Å; R4-E7 PolarHBondContact O-N 2.84Å; R4-E7 VanDerWaalsContact O-N 3.16Å
5	V	56	Low	45.4	Very low	12 Å²	12	71.1 Å²	71.1	7%	0.073	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-58.2	-23.4	167.1	174.4	0	0	0	0	111.6	D2 A3 E7 L8 F9 L518	D2-V5 WeakPolarHBondContact O-CG2 3.2Å; D2-V5 PolarHBondContact O-N 3.23Å; A3-V5 VanDerWaalsContact C-N 3.29Å; A3-V5 PolarHBondContact O-N 3.16Å; V5-E7 VanDerWaalsContact C-N 3.26Å; V5-E7 PolarHBondContact O-N 3.12Å; V5-L8 WeakPolarHBondContact O-CB 3.29Å; V5-L8 PolarHBondContact O-N 3.26Å; V5-F9 HydrophobicContact CG1-CE2 3.9Å; V5-F9 WeakPolarHBondContact O-CD2 3.26Å; V5-L518 HydrophobicContact CB-CD2 4.06Å; V5-L518 HydrophobicContact CG1-CD2 4.08Å
6	S	52.4	Low	44.3	Very low	22 Å²	22	71.4 Å²	71.4	15%	0.154	46%	0.458	C	S	.	.	H	α-helix	trans	-53.9	-34.6	173	50.5	0	0	0	0	114.2	A3 R4 L8 F9 G10 L518	A3-S6 WeakPolarHBondContact O-CB 3.37Å; A3-S6 PolarHBondContact O-N 3.42Å; A3-S6 PolarHBondContact O-OG 3.39Å; R4-S6 PolarHBondContact O-N 3.42Å; R4-S6 VanDerWaalsContact O-N 3.14Å; S6-L8 PolarHBondContact O-N 3.43Å; S6-F9 PolarHBondContact O-N 3.47Å; S6-G10 PolarHBondContact O-N 2.99Å; S6-L518 WeakPolarHBondContact CB-O 3.24Å
7	E	57.1	Low	43.3	Very low	94 Å²	94	74.6 Å²	74.6	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-27.5	-178	-66.5	-174.8	-168.4	0	0	112.7	R4 V5 F9 G10	R4-E7 PolarHBondContact O-N 2.84Å; R4-E7 VanDerWaalsContact O-N 3.16Å; V5-E7 VanDerWaalsContact C-N 3.26Å; V5-E7 PolarHBondContact O-N 3.12Å; E7-F9 VanDerWaalsContact C-N 3.27Å; E7-F9 PolarHBondContact O-N 2.96Å; E7-G10 PolarHBondContact O-N 3.16Å
8	L	56.9	Low	42.3	Very low	7 Å²	7	75.1 Å²	75.1	4%	0.037	50%	0.503	C	S	.	.	H	α-helix	trans	-68.1	-29	176.4	-63.1	172.5	0	0	0	112.1	V5 S6 R303 L306 M310 V341 C347	V5-L8 WeakPolarHBondContact O-CB 3.29Å; V5-L8 PolarHBondContact O-N 3.26Å; S6-L8 PolarHBondContact O-N 3.43Å; L8-R303 WeakPolarHBondContact O-CB 3.42Å; L8-L306 HydrophobicContact CD2-CD2 4.27Å; L8-M310 HydrophobicContact CD1-CG 4.46Å; L8-V341 HydrophobicContact CD2-CG1 4.02Å; L8-C347 VanDerWaalsContact CD1-SG 3.52Å
9	F	56.5	Low	41.5	Very low	37 Å²	37	75.6 Å²	75.6	16%	0.162	52%	0.522	C	S	.	.	H	α-helix	trans	-90.9	-10.7	-178.8	-63.3	-85.5	0	0	0	113.1	V5 S6 E7 E304 G307 L518 T584	V5-F9 HydrophobicContact CG1-CE2 3.9Å; V5-F9 WeakPolarHBondContact O-CD2 3.26Å; S6-F9 PolarHBondContact O-N 3.47Å; E7-F9 VanDerWaalsContact C-N 3.27Å; E7-F9 PolarHBondContact O-N 2.96Å; F9-E304 HydrophobicContact CD1-CG 4.17Å; F9-E304 HydrophobicContact CE1-CG 4.02Å; F9-G307 VanDerWaalsContact CZ-CA 3.43Å; F9-L518 HydrophobicContact CD2-CB 4.4Å; F9-L518 HydrophobicContact CD2-CD1 4.02Å; F9-L518 HydrophobicContact CE2-CD1 3.63Å; F9-L518 HydrophobicContact CZ-CD1 4.15Å; F9-T584 HydrophobicContact CE1-CG2 4.49Å
10	G	43.4	Very low	40.8	Very low	42 Å²	42	77.6 Å²	77.6	43%	0.433	54%	0.537	S	S	.	.			trans	-102.5	3.5	-158.6	0	0	0	0	0	119.3	S6 E7	S6-G10 PolarHBondContact O-N 2.99Å; E7-G10 PolarHBondContact O-N 3.16Å
11	S	37.6	Very low	40.3	Very low	67 Å²	67	83.8 Å²	83.8	47%	0.469	56%	0.557	S	S	.	*			trans	-116.7	73.8	-174	45.9	0	0	0	0	113.8	R303	S11-R303 PolarHBondContact O-NH1 3.01Å; S11-R303 VanDerWaalsContact O-NH1 3.14Å; S11-R303 VanDerWaalsContact OG-CZ 3.32Å; S11-R303 PolarHBondContact OG-NH1 3.33Å
12	A	32.5	Very low	39.3	Very low	99 Å²	99	83.5 Å²	83.5	82%	0.818	58%	0.575	S	S	*	*	S	Bend	trans	-146.8	51.4	167	0	0	0	0	0	112.1
13	S	29.3	Very low	38.2	Very low	117 Å²	117	86 Å²	86	82%	0.818	60%	0.596	S	S	*	*	S	Bend	trans	-176.3	128.8	161.2	48.8	0	0	0	0	112.5
14	G	29.3	Very low	37.2	Very low	78 Å²	78	90.8 Å²	90.8	80%	0.804	62%	0.623	S	S	*	*			trans	108.9	90.3	154.7	0	0	0	0	0	117
15	H	28.7	Very low	35.8	Very low	208 Å²	208	89.4 Å²	89.4	96%	0.963	63%	0.632	S	S	*	*			trans	-78.4	127.5	151.2	-87.2	44.1	0	0	0	108.3
16	G	27.1	Very low	34.5	Very low	76 Å²	76	96.7 Å²	96.7	78%	0.784	67%	0.671	S	S	*	*			trans	-159.9	118.3	175.1	0	0	0	0	0	110
17	S	27.6	Very low	33.4	Very low	125 Å²	125	103.8 Å²	103.8	87%	0.874	70%	0.701	S	S	*	*			trans	-57.9	150.5	-173.4	47.9	0	0	0	0	117.8
18	G	25.7	Very low	31.9	Very low	84 Å²	84	108 Å²	108	87%	0.866	72%	0.718	S	S	*	*			trans	118.7	129.4	130.5	0	0	0	0	0	117.4
19	G	26.9	Very low	31.1	Very low	84 Å²	84	113.6 Å²	113.6	87%	0.866	76%	0.755	S	S	*	*			trans	132.5	81	150.4	0	0	0	0	0	117.3
20	S	27.2	Very low	29.8	Very low	115 Å²	115	115.7 Å²	115.7	80%	0.804	79%	0.787	S	S	*	*			trans	-78.1	140.9	166	51.5	0	0	0	0	112.8
21	Q	29.9	Very low	29	Very low	208 Å²	208	121.5 Å²	121.5	97%	0.972	81%	0.808	S	S	*	*			trans	178.5	142.4	150.3	-99.2	170.8	26.1	0	0	105.6
22	G	27.1	Very low	28.5	Very low	73 Å²	73	121.9 Å²	121.9	75%	0.753	82%	0.823	S	S	*	*			cis	154.1	124.7	14.4	0	0	0	0	0	105.2
23	S	26.7	Very low	28.2	Very low	106 Å²	106	125 Å²	125	74%	0.741	83%	0.825	S	S	*	*			trans	-58.3	159.6	-176	51.8	0	0	0	0	116.7
24	T	26.9	Very low	28.1	Very low	128 Å²	128	122.7 Å²	122.7	79%	0.785	82%	0.821	S	S	*	*				159	122.6	118.7	47.7	0	0	0	0	110.6
25	S	27.8	Very low	28	Very low	95 Å²	95	126.1 Å²	126.1	66%	0.664	83%	0.826	S	S	*	*				102.6	123.1	90	66.9	0	0	0	0	113.2
26	N	28.6	Very low	28	Very low	166 Å²	166	122.1 Å²	122.1	89%	0.888	82%	0.815	S	S	*	*				-172.5	136.1	113.7	-103.9	-13.1	0	0	0	114.4
27	H	28.3	Very low	28	Very low	170 Å²	170	124.4 Å²	124.4	79%	0.787	82%	0.82	S	S	*	*			trans	-78.7	143.1	173.3	-99.4	-50.7	0	0	0	111.6
28	K	25.9	Very low	28	Very low	183 Å²	183	127.6 Å²	127.6	80%	0.796	82%	0.818	S	S	*	*				35.8	170.9	122.8	-87.1	-173.2	-178.3	-177.2	0	120.3
29	P	40.7	Very low	28.1	Very low	125 Å²	125	133.7 Å²	133.7	81%	0.812	82%	0.821	S	S	*	*			cis	-137.6	-173.1	-6.5	24	1.8	0	0	0	113.1
30	G	27.8	Very low	28	Very low	81 Å²	81	136.5 Å²	136.5	84%	0.835	82%	0.821	S	S	*	*			trans	172.3	103.8	159.2	0	0	0	0	0	114.6
31	N	27.6	Very low	28	Very low	164 Å²	164	134.9 Å²	134.9	88%	0.877	82%	0.822	S	S	*	*			trans	-92.5	157.5	-172	-153.1	13.9	0	0	0	111.6
32	G	27.3	Very low	27.8	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	81%	0.813	S	S	*	*			trans	-175.9	87.1	173.1	0	0	0	0	0	114.9
33	N	26.3	Very low	27.8	Very low	163 Å²	163	135 Å²	135	87%	0.872	82%	0.816	S	S	*	*			trans	-68.2	153.8	169.5	-87.7	-23.2	0	0	0	112.6
34	G	25.8	Very low	27.8	Very low	70 Å²	70	138 Å²	138	72%	0.722	82%	0.824	S	S	*	*			trans	170.9	82.9	157.7	0	0	0	0	0	120.4
35	V	28.2	Very low	27.8	Very low	150 Å²	150	141.2 Å²	141.2	91%	0.909	83%	0.827	S	S	*	*			trans	76.3	136.7	134.7	-170.9	0	0	0	0	121.8
36	V	29	Very low	27.9	Very low	123 Å²	123	146.8 Å²	146.8	75%	0.745	84%	0.839	S	S	*	*			trans	-85.1	149.3	-176	171.5	0	0	0	0	112.9
37	S	27.9	Very low	27.8	Very low	125 Å²	125	143.9 Å²	143.9	87%	0.874	84%	0.839	S	S	*	*			trans	-152	133	145.2	-102.1	0	0	0	0	114.2
38	K	27.6	Very low	27.8	Very low	191 Å²	191	147.1 Å²	147.1	83%	0.83	84%	0.844	S	S	*	*			trans	-72	151.8	175.8	-76.1	170.5	170.3	171.5	0	111.6
39	K	27.4	Very low	28.1	Very low	213 Å²	213	145.3 Å²	145.3	93%	0.926	85%	0.849	S	S	*	*			trans	-152.5	132.2	138.9	-108.8	174.1	-172.2	-179.4	0	111.9
40	T	24.8	Very low	27.5	Very low	142 Å²	142	150.9 Å²	150.9	87%	0.871	85%	0.853	S	S	*	*			trans	-90.5	151.1	178.8	36.2	0	0	0	0	111.1
41	G	26.1	Very low	27.6	Very low	81 Å²	81	155.8 Å²	155.8	84%	0.835	85%	0.852	S	S	*	*			trans	-178.7	135.2	170.3	0	0	0	0	0	111.5
42	A	26.5	Very low	27.7	Very low	93 Å²	93	154.3 Å²	154.3	77%	0.769	85%	0.851	S	S	*	*			trans	-106.4	151.9	-148.1	0	0	0	0	0	116.1
43	K	25.8	Very low	28.2	Very low	191 Å²	191	161.9 Å²	161.9	83%	0.83	86%	0.857	S	S	*	*			trans	51.8	122.7	143.9	-69.3	177.2	-178.9	173.7	0	120.6
44	N	27.5	Very low	28.4	Very low	169 Å²	169	161 Å²	161	90%	0.904	85%	0.852	S	S	*	*				-149.5	127.8	122.2	-124.9	-11.9	0	0	0	112.5
45	K	26.9	Very low	28.7	Very low	195 Å²	195	167.1 Å²	167.1	85%	0.848	86%	0.859	S	S	*	*			trans	-89.1	131	-178.9	-80	178.4	172.5	-179.3	0	110
46	K	29.1	Very low	28.7	Very low	212 Å²	212	168.5 Å²	168.5	92%	0.922	85%	0.853	S	S	*	*			trans	-136.5	129.9	149	-86.3	-172	177.9	179	0	109.4
47	A	27.9	Very low	28.8	Very low	106 Å²	106	167.8 Å²	167.8	88%	0.876	85%	0.851	S	S	*	*			trans	-74	131.4	-167.1	0	0	0	0	0	112.6
48	R	28.5	Very low	28.9	Very low	237 Å²	237	166 Å²	166	89%	0.894	84%	0.838	S	S	*	*			trans	-133.1	123	159.3	-98.9	179.9	152	175.3	-8.4	107.1	R50	R48-R50 PolarHBondContact O-N 2.7Å
49	T	30.7	Very low	29.4	Very low	146 Å²	146	164.8 Å²	164.8	90%	0.896	84%	0.841	S	S	*	*			trans	-52.8	112.7	175.5	32.1	0	0	0	0	110
50	R	28.4	Very low	30.2	Very low	241 Å²	241	162.1 Å²	162.1	91%	0.909	84%	0.837	S	S	*	*			trans	-93.7	119.9	178.1	-84.7	-176.5	171.3	-179.3	-3	109.4	R48	R48-R50 PolarHBondContact O-N 2.7Å
51	F	31.3	Very low	31.3	Very low	185 Å²	185	158.2 Å²	158.2	81%	0.811	81%	0.813	S	S	*	*			trans	-49	146	153.3	-70.6	-92.1	0	0	0	110.2	R53	F51-R53 VanDerWaalsContact C-N 3.33Å; F51-R53 PolarHBondContact O-N 3.27Å
52	P	29.7	Very low	32.9	Very low	133 Å²	133	158 Å²	158	86%	0.864	80%	0.797	S	S	*	*			trans	-69.8	91.9	176	28.8	-31.3	0	0	0	109.7	N54	P52-N54 PolarHBondContact O-N 3.24Å
53	R	37.4	Very low	35.1	Very low	234 Å²	234	160 Å²	160	88%	0.883	79%	0.785	S	S	*	*			trans	-80.1	103.9	159.3	-86.3	-175.7	174.5	168.1	-1.5	108.2	F51	F51-R53 VanDerWaalsContact C-N 3.33Å; F51-R53 PolarHBondContact O-N 3.27Å
54	N	29.6	Very low	37.5	Very low	144 Å²	144	153 Å²	153	77%	0.77	76%	0.757	S	S	*	*			trans	172.7	74.6	137.9	-89.5	-9.4	0	0	0	109.1	P52	P52-N54 PolarHBondContact O-N 3.24Å
55	F	32.7	Very low	39.9	Very low	199 Å²	199	149.1 Å²	149.1	87%	0.873	74%	0.741	S	S	*	*			trans	-86.2	105.5	147.6	-122.1	-96.4	0	0	0	105.6
56	K	27.4	Very low	42.4	Very low	178 Å²	178	143.9 Å²	143.9	77%	0.774	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-73.2	121.2	162.6	-75.1	-179.5	176.4	179.7	0	105.3	S58	K56-S58 PolarHBondContact O-N 3.32Å; K56-S58 VanDerWaalsContact O-N 3.14Å
57	P	31.4	Very low	44.9	Very low	108 Å²	108	135.5 Å²	135.5	70%	0.701	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-62.1	121.8	175.5	25.4	-30.3	0	0	0	107.5
58	S	29.6	Very low	47.3	Very low	88 Å²	88	133.3 Å²	133.3	62%	0.615	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-58.1	141.8	158.2	51.1	0	0	0	0	106.9	K56 N60	K56-S58 PolarHBondContact O-N 3.32Å; K56-S58 VanDerWaalsContact O-N 3.14Å; S58-N60 PolarHBondContact O-N 2.9Å
59	N	37.7	Very low	49.5	Very low	165 Å²	165	130.9 Å²	130.9	88%	0.882	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	29.3	-163.4	-131.4	14.4	0	0	0	114
60	N	44.6	Very low	51.6	Low	158 Å²	158	129.8 Å²	129.8	85%	0.845	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.5	25.5	-169.8	-116.1	17.6	0	0	0	115.9	S58 P62	S58-N60 PolarHBondContact O-N 2.9Å; N60-P62 WeakPolarHBondContact O-CD 3.35Å
61	T	47.5	Very low	54	Low	60 Å²	60	119.6 Å²	119.6	37%	0.368	63%	0.626	S	S	.	*			trans	-90.2	115.8	169.6	-15.1	0	0	0	0	109.5	Y63 Y153	T61-Y63 PolarHBondContact O-N 3.21Å; T61-Y153 HydrophobicContact CG2-CE2 4.04Å
62	P	60.8	Low	56.6	Low	76 Å²	76	112.4 Å²	112.4	49%	0.494	60%	0.596	S	S	.	*			trans	-65.5	120.8	177.9	25.3	-30.9	0	0	0	109.3	N60 L117	N60-P62 WeakPolarHBondContact O-CD 3.35Å; P62-L117 HydrophobicContact CB-CD1 3.82Å; P62-L117 HydrophobicContact CG-CD1 3.91Å; P62-L117 WeakPolarHBondContact O-CD1 3.32Å; P62-L117 VanDerWaalsContact O-CG 3.3Å; P62-L117 WeakPolarHBondContact O-CG 3.28Å
63	Y	72.1	Confident	59.3	Low	135 Å²	135	107.7 Å²	107.7	53%	0.529	56%	0.563	S	S	.	*	B	Isolated β-bridge	trans	-121.1	131.7	-175.6	-167.6	-94.7	0	0	0	109	T61 N114 M116	T61-Y63 PolarHBondContact O-N 3.21Å; Y63-N114 WeakPolarHBondContact CE1-O 3.46Å; Y63-N114 PolarHBondContact OH-O 2.99Å; Y63-M116 HydrophobicContact CD2-CB 4.37Å; Y63-M116 HydrophobicContact CE2-CB 4.17Å
64	L	77	Confident	61.9	Low	44 Å²	44	96.6 Å²	96.6	23%	0.23	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-90.1	155.7	171.9	-68.3	179	0	0	0	110.2	V111 G115 L117	L64-V111 HydrophobicContact CD1-CG1 4.38Å; L64-G115 PolarHBondContact N-O 2.79Å; L64-G115 WeakPolarHBondContact O-CA 3.46Å; L64-L117 HydrophobicContact CD1-CD2 3.76Å; L64-L117 HydrophobicContact CG-CD2 4.04Å
65	P	77.8	Confident	64.7	Low	88 Å²	88	90.4 Å²	90.4	57%	0.571	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-56.2	146.9	169.3	25.8	-34.2	0	0	0	109.7	Y75	P65-Y75 VanDerWaalsContact O-CE2 3.25Å; P65-Y75 WeakPolarHBondContact O-CE2 3.34Å; P65-Y75 PolarHBondContact O-OH 3.39Å; P65-Y75 VanDerWaalsContact O-OH 3.06Å
66	P	78.9	Confident	67.5	Low	84 Å²	84	82.1 Å²	82.1	55%	0.545	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-51.9	148.6	176	-24.5	32.9	0	0	0	111.9	A68 N114	P66-A68 PolarHBondContact O-N 2.97Å; P66-N114 WeakPolarHBondContact CA-O 3.31Å
67	E	81.8	Confident	70.3	Confident	36 Å²	36	76.5 Å²	76.5	17%	0.168	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-56.1	131.6	177.3	-172.4	177.8	165.5	0	0	110.4	Y75 R97 D113	E67-Y75 HydrophobicContact CB-CD2 3.68Å; E67-Y75 HydrophobicContact CB-CE2 4.05Å; E67-Y75 HydrophobicContact CB-CG 4.13Å; E67-Y75 HydrophobicContact CG-CD2 4.36Å; E67-Y75 HydrophobicContact CG-CG 4.34Å; E67-Y75 WeakPolarHBondContact OE2-CB 3.36Å; E67-Y75 PolarHBondContact OE2-N 3.5Å; E67-R97 IonicContact OE1-CZ 3.12Å; E67-R97 IonicContact OE1-NH2 2.83Å; E67-R97 PolarHBondContact OE1-NH2 3.09Å; E67-D113 WeakPolarHBondContact CB-O 3.19Å; E67-D113 PolarHBondContact N-O 3.04Å
68	A	79.1	Confident	73	Confident	61 Å²	61	75.3 Å²	75.3	50%	0.504	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-78.5	131.9	172.2	0	0	0	0	0	109.6	P66 E70 R97	P66-A68 PolarHBondContact O-N 2.97Å; A68-E70 VanDerWaalsContact CB-O 3.27Å; A68-E70 WeakPolarHBondContact CB-O 2.98Å; A68-E70 PolarHBondContact O-N 3.11Å; A68-R97 PolarHBondContact O-NH1 3.16Å; A68-R97 PolarHBondContact O-NH2 2.75Å
69	E	74.6	Confident	75.8	Confident	185 Å²	185	71.4 Å²	71.4	86%	0.864	39%	0.385	S	S	*	.	S	Bend	trans	-61.7	-30.9	175.7	-65.6	-174.3	172.4	0	0	112
70	E	75.3	Confident	78.1	Confident	123 Å²	123	65.7 Å²	65.7	58%	0.575	36%	0.356	S	S	*	.	S	Bend	trans	-107	153	174.6	-57.5	-163.2	158.4	0	0	111.1	A68 K404	A68-E70 VanDerWaalsContact CB-O 3.27Å; A68-E70 WeakPolarHBondContact CB-O 2.98Å; A68-E70 PolarHBondContact O-N 3.11Å; E70-K404 IonicContact OE1-NZ 3.59Å; E70-K404 PolarHBondContact OE1-NZ 3.32Å; E70-K404 IonicContact OE2-NZ 3.53Å; E70-K404 PolarHBondContact OE2-NZ 2.8Å
71	G	78.9	Confident	79.9	Confident	27 Å²	27	64.8 Å²	64.8	28%	0.278	35%	0.351	S	S	.	.	S	Bend	trans	110.8	-172.6	175.1	0	0	0	0	0	113.6	R97 E100	G71-R97 WeakPolarHBondContact O-CD 3.38Å; G71-R97 PolarHBondContact O-NH1 2.75Å; G71-E100 VanDerWaalsContact N-CD 3.28Å; G71-E100 PolarHBondContact N-OE1 3.21Å; G71-E100 VanDerWaalsContact N-OE1 3.09Å; G71-E100 PolarHBondContact N-OE2 3.31Å; G71-E100 VanDerWaalsContact N-OE2 3.11Å
72	N	85.1	Confident	81.9	Confident	35 Å²	35	63.2 Å²	63.2	19%	0.187	34%	0.342	C	S	.	.	S	Bend	trans	-105	13.3	-170.3	72.6	-38.5	0	0	0	114.4	G101 E104 A105 V106	N72-G101 VanDerWaalsContact CB-CA 3.5Å; N72-E104 WeakPolarHBondContact CB-O 3.49Å; N72-E104 PolarHBondContact ND2-O 2.84Å; N72-A105 CarbonylContact O-C 3.54Å; N72-A105 VanDerWaalsContact O-CA 3.25Å; N72-A105 WeakPolarHBondContact O-CA 3.46Å; N72-V106 PolarHBondContact O-N 2.89Å
73	I	87.3	Confident	83.3	Confident	33 Å²	33	64.3 Å²	64.3	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.7	179	-57.4	178.3	0	0	0	108.9	Y75 R97 V106 Q369	I73-Y75 HydrophobicContact CG2-CD1 4.11Å; I73-Y75 HydrophobicContact CG2-CE1 3.58Å; I73-R97 PolarHBondContact O-NH1 3.05Å; I73-R97 PolarHBondContact O-NH2 2.78Å; I73-V106 VanDerWaalsContact CA-O 3.32Å; I73-V106 WeakPolarHBondContact CA-O 3.41Å; I73-V106 HydrophobicContact CG1-CB 4.42Å; I73-Q369 VanDerWaalsContact CD1-NE2 3.32Å
74	E	90.1	Very high	84.1	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.4	-179	-177	75.4	-157.8	0	0	110.3	K76 Q93 R97 V106 Y107 Q108	E74-K76 HydrophobicContact CG-CG 4.25Å; E74-K76 WeakPolarHBondContact OE1-CE 3.47Å; E74-K76 IonicContact OE1-NZ 3.24Å; E74-K76 PolarHBondContact OE1-NZ 2.82Å; E74-Q93 VanDerWaalsContact CD-NE2 3.28Å; E74-Q93 PolarHBondContact OE1-NE2 2.85Å; E74-Q93 PolarHBondContact OE1-OE1 3Å; E74-Q93 PolarHBondContact OE2-NE2 3.34Å; E74-R97 HydrophobicContact CB-CG 4.43Å; E74-R97 IonicContact OE2-CZ 3.9Å; E74-R97 IonicContact OE2-NE 3.37Å; E74-R97 PolarHBondContact OE2-NE 2.95Å; E74-R97 IonicContact OE2-NH2 2.8Å; E74-R97 PolarHBondContact OE2-NH2 2.96Å; E74-V106 PolarHBondContact N-O 3.16Å; E74-Y107 HydrophobicContact CB-CD1 4.02Å; E74-Y107 HydrophobicContact CB-CD2 4.28Å; E74-Y107 HydrophobicContact CB-CE1 3.83Å; E74-Y107 HydrophobicContact CB-CE2 4.09Å; E74-Y107 HydrophobicContact CB-CG 4.24Å; E74-Y107 HydrophobicContact CG-CD1 4.01Å; E74-Y107 HydrophobicContact CG-CE1 3.57Å; E74-Y107 WeakPolarHBondContact O-CA 3.38Å; E74-Q108 PolarHBondContact O-N 3.44Å
75	Y	90.3	Very high	84.7	Confident	15 Å²	15	67.3 Å²	67.3	6%	0.059	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.1	175	-60.2	-11.9	0	0	0	110.2	P65 E67 I73 Q108 V111	P65-Y75 VanDerWaalsContact O-CE2 3.25Å; P65-Y75 WeakPolarHBondContact O-CE2 3.34Å; P65-Y75 PolarHBondContact O-OH 3.39Å; P65-Y75 VanDerWaalsContact O-OH 3.06Å; E67-Y75 HydrophobicContact CB-CD2 3.68Å; E67-Y75 HydrophobicContact CB-CE2 4.05Å; E67-Y75 HydrophobicContact CB-CG 4.13Å; E67-Y75 HydrophobicContact CG-CD2 4.36Å; E67-Y75 HydrophobicContact CG-CG 4.34Å; E67-Y75 WeakPolarHBondContact OE2-CB 3.36Å; E67-Y75 PolarHBondContact OE2-N 3.5Å; I73-Y75 HydrophobicContact CG2-CD1 4.11Å; I73-Y75 HydrophobicContact CG2-CE1 3.58Å; Y75-Q108 HydrophobicContact CD1-CB 3.77Å; Y75-Q108 HydrophobicContact CD1-CG 3.82Å; Y75-Q108 HydrophobicContact CE1-CB 4.28Å; Y75-Q108 HydrophobicContact CE1-CG 3.87Å; Y75-V111 HydrophobicContact CD2-CG1 3.84Å; Y75-V111 HydrophobicContact CE2-CG1 4.32Å; Y75-V111 HydrophobicContact CG-CB 4.4Å; Y75-V111 HydrophobicContact CG-CG1 3.96Å
76	K	90.3	Very high	85.2	Confident	25 Å²	25	69.6 Å²	69.6	11%	0.109	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	122.1	174.5	-69	-69.1	155.8	-100.9	0	110.6	E74 L79 Q108 I109 G110 V111 D113	E74-K76 HydrophobicContact CG-CG 4.25Å; E74-K76 WeakPolarHBondContact OE1-CE 3.47Å; E74-K76 IonicContact OE1-NZ 3.24Å; E74-K76 PolarHBondContact OE1-NZ 2.82Å; K76-L79 HydrophobicContact CB-CD1 4.36Å; K76-L79 HydrophobicContact CB-CD2 4.28Å; K76-L79 HydrophobicContact CB-CG 4.19Å; K76-L79 HydrophobicContact CD-CD2 4.24Å; K76-L79 HydrophobicContact CG-CD1 4.49Å; K76-L79 HydrophobicContact CG-CD2 4.21Å; K76-Q108 PolarHBondContact N-O 3.09Å; K76-I109 HydrophobicContact CB-CD1 4.11Å; K76-I109 CarbonylContact O-C 3.6Å; K76-I109 VanDerWaalsContact O-CA 3.31Å; K76-I109 WeakPolarHBondContact O-CA 3.46Å; K76-G110 PolarHBondContact O-N 2.81Å; K76-V111 CarbonylContact C-O 3.51Å; K76-V111 PolarHBondContact N-O 2.86Å; K76-D113 IonicContact NZ-OD1 2.86Å
77	L	86.3	Confident	85.9	Confident	59 Å²	59	66.3 Å²	66.3	31%	0.309	34%	0.344	S	S	.	.	S	Bend	trans	-63.5	-51.2	177.2	179.1	62.1	0	0	0	111.2	G110 V111 E112 V118 L120	L77-G110 WeakPolarHBondContact O-CA 3.46Å; L77-G110 PolarHBondContact O-N 2.87Å; L77-V111 WeakPolarHBondContact CA-O 3.4Å; L77-V111 PolarHBondContact N-O 2.83Å; L77-E112 HydrophobicContact CB-CG 4.42Å; L77-E112 HydrophobicContact CD1-CG 4.24Å; L77-E112 HydrophobicContact CD2-CG 4.16Å; L77-V118 HydrophobicContact CD1-CB 3.58Å; L77-V118 HydrophobicContact CD1-CG1 3.92Å; L77-V118 HydrophobicContact CD1-CG2 4.02Å; L77-L120 WeakPolarHBondContact O-CD1 3.38Å; L77-L120 WeakPolarHBondContact O-CD2 3.47Å; L77-L120 WeakPolarHBondContact O-CG 3.25Å
78	K	88.8	Confident	86.3	Confident	84 Å²	84	68.6 Å²	68.6	37%	0.365	35%	0.354	S	S	.	.			trans	-153.8	137.1	-173.7	-170.6	170.1	176.3	167.4	0	111.9	V80 L120 D124	K78-V80 HydrophobicContact CD-CG2 4.15Å; K78-V80 HydrophobicContact CG-CB 4.28Å; K78-V80 HydrophobicContact CG-CG2 3.75Å; K78-L120 HydrophobicContact CB-CD2 4.05Å; K78-L120 HydrophobicContact CD-CD2 4.19Å; K78-L120 HydrophobicContact CG-CD2 4.11Å; K78-D124 WeakPolarHBondContact CE-OD1 3.49Å; K78-D124 WeakPolarHBondContact CE-OD2 3.24Å; K78-D124 IonicContact NZ-OD1 3.88Å; K78-D124 PolarHBondContact NZ-OD1 2.99Å; K78-D124 IonicContact NZ-OD2 2.71Å; K78-D124 PolarHBondContact NZ-OD2 3.49Å
79	L	86.9	Confident	86.9	Confident	5 Å²	5	71.9 Å²	71.9	3%	0.026	36%	0.359	C	S	.	.			trans	-125.4	46.6	-179.7	-64.3	176.8	0	0	0	112.2	K76 L90 I109 S128 T131 L132	K76-L79 HydrophobicContact CB-CD1 4.36Å; K76-L79 HydrophobicContact CB-CD2 4.28Å; K76-L79 HydrophobicContact CB-CG 4.19Å; K76-L79 HydrophobicContact CD-CD2 4.24Å; K76-L79 HydrophobicContact CG-CD1 4.49Å; K76-L79 HydrophobicContact CG-CD2 4.21Å; L79-L90 HydrophobicContact CD2-CD1 3.91Å; L79-L90 HydrophobicContact CD2-CD2 4.19Å; L79-I109 HydrophobicContact CD1-CD1 3.91Å; L79-S128 PolarHBondContact N-OG 3.03Å; L79-T131 HydrophobicContact CB-CG2 4.31Å; L79-T131 WeakPolarHBondContact O-CB 3.38Å; L79-T131 WeakPolarHBondContact O-CG2 3.45Å; L79-T131 PolarHBondContact O-OG1 2.65Å; L79-L132 HydrophobicContact CD1-CD1 3.95Å
80	V	87.6	Confident	87.7	Confident	46 Å²	46	63.5 Å²	63.5	28%	0.279	32%	0.32	S	S	.	.	S	Bend	trans	-91.3	125.6	-179.2	179.9	0	0	0	0	110.9	K78 A127	K78-V80 HydrophobicContact CD-CG2 4.15Å; K78-V80 HydrophobicContact CG-CB 4.28Å; K78-V80 HydrophobicContact CG-CG2 3.75Å; V80-A127 HydrophobicContact CG1-CB 4.22Å; V80-A127 HydrophobicContact CG2-CB 3.8Å
81	N	82.8	Confident	88.5	Confident	139 Å²	139	58 Å²	58	74%	0.743	30%	0.295	S	S	*	.	S	Bend	trans	42.4	60	173.1	-64.2	-25.1	0	0	0	114.9
82	P	87.8	Confident	89.1	Confident	27 Å²	27	61.3 Å²	61.3	18%	0.175	31%	0.31	C	S	.	.			trans	-63.7	147.2	176.2	29.3	-35.7	0	0	0	111.2	R86 F87 L90 T131	P82-R86 HydrophobicContact CB-CB 4.11Å; P82-R86 HydrophobicContact CB-CG 3.97Å; P82-F87 HydrophobicContact CB-CB 4.48Å; P82-F87 HydrophobicContact CG-CB 4.22Å; P82-F87 HydrophobicContact CG-CD2 3.94Å; P82-L90 HydrophobicContact CB-CD1 4.31Å; P82-T131 HydrophobicContact CG-CG2 3.66Å
83	T	90.3	Very high	89.4	Confident	98 Å²	98	61.9 Å²	61.9	60%	0.601	31%	0.312	S	S	*	.			trans	-61.7	159.6	168.2	58.8	0	0	0	0	110.7	N85 R86 F87	T83-N85 VanDerWaalsContact C-N 3.33Å; T83-N85 PolarHBondContact O-N 3.35Å; T83-R86 PolarHBondContact O-N 3Å; T83-R86 WeakPolarHBondContact OG1-CB 3.36Å; T83-R86 PolarHBondContact OG1-N 2.77Å; T83-F87 WeakPolarHBondContact O-CB 2.87Å; T83-F87 PolarHBondContact O-N 2.97Å
84	Q	88.9	Confident	89.7	Confident	115 Å²	115	60.3 Å²	60.3	54%	0.537	30%	0.304	S	S	.	.	H	α-helix	trans	-54.8	-46.3	-179.1	-172.9	63.7	22.5	0	0	112.4	R86 F87 E88	Q84-R86 VanDerWaalsContact C-N 3.35Å; Q84-R86 PolarHBondContact O-N 3Å; Q84-F87 WeakPolarHBondContact O-CB 3.5Å; Q84-F87 PolarHBondContact O-N 3.09Å; Q84-E88 PolarHBondContact NE2-OE1 3.18Å; Q84-E88 VanDerWaalsContact NE2-OE1 3.07Å; Q84-E88 PolarHBondContact O-N 3.49Å
85	N	89.9	Confident	89.8	Confident	128 Å²	128	66.1 Å²	66.1	68%	0.684	33%	0.329	S	S	*	.	H	α-helix	trans	-62.4	-40.7	177.3	-64.1	4	0	0	0	112	T83 E88 H89	T83-N85 VanDerWaalsContact C-N 3.33Å; T83-N85 PolarHBondContact O-N 3.35Å; N85-E88 PolarHBondContact O-N 2.84Å; N85-H89 PolarHBondContact O-N 2.82Å
86	R	89.6	Confident	89.7	Confident	136 Å²	136	72.4 Å²	72.4	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-67.5	-39	176.7	-178	172.9	-179.7	161.4	0.3	111.1	P82 T83 Q84 E88 H89 L90	P82-R86 HydrophobicContact CB-CB 4.11Å; P82-R86 HydrophobicContact CB-CG 3.97Å; T83-R86 PolarHBondContact O-N 3Å; T83-R86 WeakPolarHBondContact OG1-CB 3.36Å; T83-R86 PolarHBondContact OG1-N 2.77Å; Q84-R86 VanDerWaalsContact C-N 3.35Å; Q84-R86 PolarHBondContact O-N 3Å; R86-E88 VanDerWaalsContact C-N 3.34Å; R86-H89 PolarHBondContact O-N 3.11Å; R86-L90 HydrophobicContact CG-CD1 4.01Å; R86-L90 HydrophobicContact CG-CG 4.35Å; R86-L90 WeakPolarHBondContact O-CB 3.34Å; R86-L90 VanDerWaalsContact O-CG 3.24Å; R86-L90 WeakPolarHBondContact O-CG 3.37Å; R86-L90 PolarHBondContact O-N 2.87Å
87	F	92.1	Very high	89.7	Confident	14 Å²	14	71.7 Å²	71.7	6%	0.061	35%	0.35	C	S	.	.	H	α-helix	trans	-63.1	-40.7	176.7	-174	-92.6	0	0	0	111.5	P82 T83 Q84 L90 A91 T131 R134 L135 K138	P82-F87 HydrophobicContact CB-CB 4.48Å; P82-F87 HydrophobicContact CG-CB 4.22Å; P82-F87 HydrophobicContact CG-CD2 3.94Å; T83-F87 WeakPolarHBondContact O-CB 2.87Å; T83-F87 PolarHBondContact O-N 2.97Å; Q84-F87 WeakPolarHBondContact O-CB 3.5Å; Q84-F87 PolarHBondContact O-N 3.09Å; F87-L90 PolarHBondContact O-N 2.87Å; F87-A91 WeakPolarHBondContact O-CB 3.32Å; F87-A91 PolarHBondContact O-N 2.92Å; F87-T131 HydrophobicContact CD2-CG2 4.46Å; F87-T131 HydrophobicContact CE2-CG2 4.49Å; F87-R134 HydrophobicContact CE2-CB 4.02Å; F87-R134 HydrophobicContact CZ-CB 3.97Å; F87-L135 HydrophobicContact CD1-CD2 4.2Å; F87-L135 HydrophobicContact CD2-CD2 3.58Å; F87-L135 HydrophobicContact CD2-CG 4.12Å; F87-L135 HydrophobicContact CE1-CD2 4.07Å; F87-L135 HydrophobicContact CE2-CD2 3.42Å; F87-L135 VanDerWaalsContact CE2-CD2 3.42Å; F87-L135 HydrophobicContact CE2-CG 3.65Å; F87-L135 HydrophobicContact CG-CD2 3.97Å; F87-L135 HydrophobicContact CZ-CD2 3.68Å; F87-L135 HydrophobicContact CZ-CG 4.12Å; F87-L135 WeakPolarHBondContact O-CD2 3.1Å; F87-K138 HydrophobicContact CD1-CD 4.41Å; F87-K138 HydrophobicContact CE1-CD 3.69Å
88	E	91.2	Very high	89.8	Confident	85 Å²	85	69.3 Å²	69.3	40%	0.397	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-40	174.3	-76.6	170.8	-165.1	0	0	113.2	Q84 N85 R86 A91 T92	Q84-E88 PolarHBondContact NE2-OE1 3.18Å; Q84-E88 VanDerWaalsContact NE2-OE1 3.07Å; Q84-E88 PolarHBondContact O-N 3.49Å; N85-E88 PolarHBondContact O-N 2.84Å; R86-E88 VanDerWaalsContact C-N 3.34Å; E88-A91 PolarHBondContact O-N 2.97Å; E88-T92 PolarHBondContact O-N 2.89Å; E88-T92 PolarHBondContact O-OG1 3.41Å
89	H	90.8	Very high	89.7	Confident	129 Å²	129	70.7 Å²	70.7	60%	0.597	35%	0.345	S	S	*	.	H	α-helix	trans	-63.6	-46.8	174.6	-172.5	68.4	0	0	0	111.6	N85 R86 A91 T92 Q93	N85-H89 PolarHBondContact O-N 2.82Å; R86-H89 PolarHBondContact O-N 3.11Å; H89-A91 VanDerWaalsContact C-N 3.31Å; H89-A91 PolarHBondContact O-N 2.88Å; H89-T92 PolarHBondContact O-N 3Å; H89-Q93 WeakPolarHBondContact O-CB 3.44Å; H89-Q93 PolarHBondContact O-N 2.65Å
90	L	92	Very high	89.5	Confident	10 Å²	10	71.6 Å²	71.6	5%	0.052	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-37.4	176.5	-71	168.7	0	0	0	112.4	L79 P82 R86 F87 Q93 M94 L135	L79-L90 HydrophobicContact CD2-CD1 3.91Å; L79-L90 HydrophobicContact CD2-CD2 4.19Å; P82-L90 HydrophobicContact CB-CD1 4.31Å; R86-L90 HydrophobicContact CG-CD1 4.01Å; R86-L90 HydrophobicContact CG-CG 4.35Å; R86-L90 WeakPolarHBondContact O-CB 3.34Å; R86-L90 VanDerWaalsContact O-CG 3.24Å; R86-L90 WeakPolarHBondContact O-CG 3.37Å; R86-L90 PolarHBondContact O-N 2.87Å; F87-L90 PolarHBondContact O-N 2.87Å; L90-Q93 PolarHBondContact O-N 3.07Å; L90-M94 WeakPolarHBondContact O-CB 3.41Å; L90-M94 PolarHBondContact O-N 3.34Å; L90-L135 HydrophobicContact CB-CD1 3.83Å; L90-L135 HydrophobicContact CB-CD2 3.9Å; L90-L135 HydrophobicContact CD1-CD1 4.29Å
91	A	92.2	Very high	89.1	Confident	6 Å²	6	69.6 Å²	69.6	5%	0.05	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-40.4	176.1	0	0	0	0	0	111.6	F87 E88 H89 M94 K95 L135 K138 V139	F87-A91 WeakPolarHBondContact O-CB 3.32Å; F87-A91 PolarHBondContact O-N 2.92Å; E88-A91 PolarHBondContact O-N 2.97Å; H89-A91 VanDerWaalsContact C-N 3.31Å; H89-A91 PolarHBondContact O-N 2.88Å; A91-M94 PolarHBondContact O-N 2.84Å; A91-K95 PolarHBondContact O-N 2.79Å; A91-L135 HydrophobicContact CB-CD2 3.95Å; A91-K138 HydrophobicContact CB-CD 4.17Å; A91-V139 HydrophobicContact CB-CG1 4.36Å
92	T	92.1	Very high	89	Confident	97 Å²	97	66.4 Å²	66.4	60%	0.595	32%	0.315	S	S	*	.	H	α-helix	trans	-64.6	-43.6	175.3	-53.8	0	0	0	0	111.2	E88 H89 K95 W96	E88-T92 PolarHBondContact O-N 2.89Å; E88-T92 PolarHBondContact O-OG1 3.41Å; H89-T92 PolarHBondContact O-N 3Å; T92-K95 WeakPolarHBondContact O-CB 3.41Å; T92-K95 PolarHBondContact O-N 2.74Å; T92-W96 PolarHBondContact O-N 2.92Å
93	Q	91.4	Very high	88.9	Confident	48 Å²	48	65.9 Å²	65.9	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-60.4	-45	175.4	-174.2	-175.1	46.7	0	0	111.7	E74 H89 L90 K95 W96 R97	E74-Q93 VanDerWaalsContact CD-NE2 3.28Å; E74-Q93 PolarHBondContact OE1-NE2 2.85Å; E74-Q93 PolarHBondContact OE1-OE1 3Å; E74-Q93 PolarHBondContact OE2-NE2 3.34Å; H89-Q93 WeakPolarHBondContact O-CB 3.44Å; H89-Q93 PolarHBondContact O-N 2.65Å; L90-Q93 PolarHBondContact O-N 3.07Å; Q93-K95 VanDerWaalsContact C-N 3.33Å; Q93-K95 PolarHBondContact O-N 2.72Å; Q93-W96 WeakPolarHBondContact O-CB 3.42Å; Q93-W96 PolarHBondContact O-N 3.27Å; Q93-W96 VanDerWaalsContact O-N 3.15Å; Q93-R97 PolarHBondContact O-N 2.86Å
94	M	93.4	Very high	88.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-42.5	176.6	-175.7	-178.9	-67.3	0	0	112.1	L90 A91 W96 R97 L98 Y107 L132 L135 A136 V139 I166	L90-M94 WeakPolarHBondContact O-CB 3.41Å; L90-M94 PolarHBondContact O-N 3.34Å; A91-M94 PolarHBondContact O-N 2.84Å; M94-W96 VanDerWaalsContact C-N 3.28Å; M94-W96 PolarHBondContact O-N 2.9Å; M94-R97 PolarHBondContact O-N 3.09Å; M94-L98 HydrophobicContact CG-CD1 4.09Å; M94-L98 HydrophobicContact CG-CG 4.47Å; M94-L98 WeakPolarHBondContact O-CB 3.23Å; M94-L98 VanDerWaalsContact O-CG 3.29Å; M94-L98 WeakPolarHBondContact O-CG 3.44Å; M94-L98 PolarHBondContact O-N 3.36Å; M94-Y107 WeakPolarHBondContact CA-OH 3.42Å; M94-Y107 WeakPolarHBondContact CB-OH 3.44Å; M94-Y107 HydrophobicContact CG-CE2 4.36Å; M94-L132 HydrophobicContact CE-CD1 3.55Å; M94-L132 HydrophobicContact CE-CG 4.32Å; M94-L135 HydrophobicContact CE-CB 3.48Å; M94-L135 VanDerWaalsContact CE-CB 3.48Å; M94-L135 HydrophobicContact CE-CD1 4.17Å; M94-L135 HydrophobicContact CE-CG 4.46Å; M94-L135 HydrophobicContact SD-CB 4.12Å; M94-A136 HydrophobicContact SD-CB 4.23Å; M94-V139 HydrophobicContact CG-CG2 4.22Å; M94-V139 HydrophobicContact SD-CG2 3.71Å; M94-I166 HydrophobicContact CE-CD1 3.4Å; M94-I166 VanDerWaalsContact CE-CD1 3.4Å; M94-I166 HydrophobicContact CG-CD1 4.23Å; M94-I166 HydrophobicContact SD-CD1 3.83Å; M94-I166 HydrophobicContact SD-CG2 4.08Å
95	K	90.9	Very high	88.9	Confident	122 Å²	122	56 Å²	56	53%	0.53	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-40.6	174.9	-172	177.5	-179.2	179	0	111.7	A91 T92 Q93 Q99 V139	A91-K95 PolarHBondContact O-N 2.79Å; T92-K95 WeakPolarHBondContact O-CB 3.41Å; T92-K95 PolarHBondContact O-N 2.74Å; Q93-K95 VanDerWaalsContact C-N 3.33Å; Q93-K95 PolarHBondContact O-N 2.72Å; K95-Q99 WeakPolarHBondContact O-CG 3.06Å; K95-Q99 PolarHBondContact O-N 3.49Å; K95-V139 HydrophobicContact CB-CG1 4.38Å
96	W	89.4	Confident	89	Confident	148 Å²	148	50.5 Å²	50.5	56%	0.561	23%	0.233	S	C	*	.	H	α-helix	trans	-63.6	-51.6	176	-177.8	-89.1	0	0	0	112.1	T92 Q93 M94 L98 Q99 E100	T92-W96 PolarHBondContact O-N 2.92Å; Q93-W96 WeakPolarHBondContact O-CB 3.42Å; Q93-W96 PolarHBondContact O-N 3.27Å; Q93-W96 VanDerWaalsContact O-N 3.15Å; M94-W96 VanDerWaalsContact C-N 3.28Å; M94-W96 PolarHBondContact O-N 2.9Å; W96-L98 VanDerWaalsContact C-N 3.29Å; W96-L98 PolarHBondContact O-N 2.76Å; W96-Q99 WeakPolarHBondContact O-CA 3.25Å; W96-Q99 WeakPolarHBondContact O-CB 3.49Å; W96-Q99 PolarHBondContact O-N 2.94Å; W96-E100 VanDerWaalsContact CD1-OE2 3.29Å; W96-E100 VanDerWaalsContact NE1-CD 3.31Å; W96-E100 PolarHBondContact NE1-OE2 3.49Å; W96-E100 PolarHBondContact O-N 2.94Å
97	R	89.3	Confident	89.1	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.038	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-39.3	177.9	-68.1	-65.1	-167	178.8	5.4	112.4	E67 A68 G71 I73 E74 Q93 M94 Q99 E100 G101 A105	E67-R97 IonicContact OE1-CZ 3.12Å; E67-R97 IonicContact OE1-NH2 2.83Å; E67-R97 PolarHBondContact OE1-NH2 3.09Å; A68-R97 PolarHBondContact O-NH1 3.16Å; A68-R97 PolarHBondContact O-NH2 2.75Å; G71-R97 WeakPolarHBondContact O-CD 3.38Å; G71-R97 PolarHBondContact O-NH1 2.75Å; I73-R97 PolarHBondContact O-NH1 3.05Å; I73-R97 PolarHBondContact O-NH2 2.78Å; E74-R97 HydrophobicContact CB-CG 4.43Å; E74-R97 IonicContact OE2-CZ 3.9Å; E74-R97 IonicContact OE2-NE 3.37Å; E74-R97 PolarHBondContact OE2-NE 2.95Å; E74-R97 IonicContact OE2-NH2 2.8Å; E74-R97 PolarHBondContact OE2-NH2 2.96Å; Q93-R97 PolarHBondContact O-N 2.86Å; M94-R97 PolarHBondContact O-N 3.09Å; R97-Q99 VanDerWaalsContact C-N 3.35Å; R97-E100 IonicContact NH1-OE2 3.92Å; R97-E100 PolarHBondContact O-N 3.1Å; R97-G101 PolarHBondContact O-N 2.96Å; R97-A105 HydrophobicContact CB-CB 3.97Å
98	L	89	Confident	89.1	Confident	9 Å²	9	44 Å²	44	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-39.3	173.6	-75.6	169.5	0	0	0	112	M94 W96 G101 R102 G103 A105 V139 A141 I166	M94-L98 HydrophobicContact CG-CD1 4.09Å; M94-L98 HydrophobicContact CG-CG 4.47Å; M94-L98 WeakPolarHBondContact O-CB 3.23Å; M94-L98 VanDerWaalsContact O-CG 3.29Å; M94-L98 WeakPolarHBondContact O-CG 3.44Å; M94-L98 PolarHBondContact O-N 3.36Å; W96-L98 VanDerWaalsContact C-N 3.29Å; W96-L98 PolarHBondContact O-N 2.76Å; L98-G101 CarbonylContact O-C 3.45Å; L98-G101 PolarHBondContact O-N 2.78Å; L98-R102 PolarHBondContact O-N 3.29Å; L98-G103 WeakPolarHBondContact CD2-O 3.43Å; L98-G103 WeakPolarHBondContact O-CA 3.36Å; L98-G103 PolarHBondContact O-N 3.29Å; L98-A105 HydrophobicContact CD2-CB 4Å; L98-A105 HydrophobicContact CG-CB 4.27Å; L98-V139 HydrophobicContact CD1-CG2 3.91Å; L98-A141 HydrophobicContact CD1-CB 4.06Å; L98-I166 HydrophobicContact CD1-CG2 4.38Å; L98-I166 HydrophobicContact CD2-CB 4.42Å; L98-I166 HydrophobicContact CD2-CG2 4.09Å; L98-I166 WeakPolarHBondContact CD2-O 3.45Å
99	Q	85.9	Confident	89.2	Confident	112 Å²	112	40 Å²	40	52%	0.523	19%	0.19	S	C	.	.	H	α-helix	trans	-66.5	-43.1	175.9	-75.2	175.1	-24.3	0	0	111.8	K95 W96 R97 G101 R102 S403	K95-Q99 WeakPolarHBondContact O-CG 3.06Å; K95-Q99 PolarHBondContact O-N 3.49Å; W96-Q99 WeakPolarHBondContact O-CA 3.25Å; W96-Q99 WeakPolarHBondContact O-CB 3.49Å; W96-Q99 PolarHBondContact O-N 2.94Å; R97-Q99 VanDerWaalsContact C-N 3.35Å; Q99-G101 VanDerWaalsContact C-N 3.29Å; Q99-G101 PolarHBondContact O-N 3.18Å; Q99-R102 PolarHBondContact O-N 3.33Å; Q99-S403 WeakPolarHBondContact O-CB 3.37Å
100	E	83.8	Confident	89.1	Confident	24 Å²	24	33.9 Å²	33.9	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-37	176.9	-68.9	-163.1	98.6	0	0	112.7	G71 W96 R97	G71-E100 VanDerWaalsContact N-CD 3.28Å; G71-E100 PolarHBondContact N-OE1 3.21Å; G71-E100 VanDerWaalsContact N-OE1 3.09Å; G71-E100 PolarHBondContact N-OE2 3.31Å; G71-E100 VanDerWaalsContact N-OE2 3.11Å; W96-E100 VanDerWaalsContact CD1-OE2 3.29Å; W96-E100 VanDerWaalsContact NE1-CD 3.31Å; W96-E100 PolarHBondContact NE1-OE2 3.49Å; W96-E100 PolarHBondContact O-N 2.94Å; R97-E100 IonicContact NH1-OE2 3.92Å; R97-E100 PolarHBondContact O-N 3.1Å
101	G	78.4	Confident	88.9	Confident	4 Å²	4	33.5 Å²	33.5	4%	0.041	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	19.1	177.3	0	0	0	0	0	115.7	N72 R97 L98 Q99 G103 E104	N72-G101 VanDerWaalsContact CB-CA 3.5Å; R97-G101 PolarHBondContact O-N 2.96Å; L98-G101 CarbonylContact O-C 3.45Å; L98-G101 PolarHBondContact O-N 2.78Å; Q99-G101 VanDerWaalsContact C-N 3.29Å; Q99-G101 PolarHBondContact O-N 3.18Å; G101-G103 VanDerWaalsContact C-N 3.25Å; G101-G103 PolarHBondContact O-N 3.17Å; G101-E104 VanDerWaalsContact CA-O 3.3Å; G101-E104 WeakPolarHBondContact CA-O 3.49Å; G101-E104 PolarHBondContact O-N 3.3Å; G101-E104 VanDerWaalsContact O-N 3.1Å
102	R	81.1	Confident	88.6	Confident	72 Å²	72	36 Å²	36	27%	0.272	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	38.3	178.4	-53.1	-171.7	-173.4	-159.5	-5.8	114.3	L98 Q99 L176 P399 S401 N402 Q406	L98-R102 PolarHBondContact O-N 3.29Å; Q99-R102 PolarHBondContact O-N 3.33Å; R102-L176 HydrophobicContact CB-CD1 4.37Å; R102-P399 HydrophobicContact CG-CG 4.31Å; R102-S401 PolarHBondContact NE-O 3.18Å; R102-S401 VanDerWaalsContact NE-O 3.17Å; R102-S401 PolarHBondContact NH2-O 2.84Å; R102-N402 PolarHBondContact NH2-O 2.9Å; R102-Q406 VanDerWaalsContact CZ-OE1 3.32Å; R102-Q406 VanDerWaalsContact NH2-CB 3.35Å
103	G	85.2	Confident	88.2	Confident	17 Å²	17	36 Å²	36	18%	0.175	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	-1.4	-179.3	0	0	0	0	0	114.6	L98 G101 R167 K168	L98-G103 WeakPolarHBondContact CD2-O 3.43Å; L98-G103 WeakPolarHBondContact O-CA 3.36Å; L98-G103 PolarHBondContact O-N 3.29Å; G101-G103 VanDerWaalsContact C-N 3.25Å; G101-G103 PolarHBondContact O-N 3.17Å; G103-R167 CarbonylContact O-C 3.5Å; G103-R167 WeakPolarHBondContact O-CA 3.11Å; G103-K168 PolarHBondContact O-N 2.84Å
104	E	89.3	Confident	87.8	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.023	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.1	177.1	-56.2	-164.6	125.2	0	0	111.8	N72 G101 L165 I166 R167 L176 K259	N72-E104 WeakPolarHBondContact CB-O 3.49Å; N72-E104 PolarHBondContact ND2-O 2.84Å; G101-E104 VanDerWaalsContact CA-O 3.3Å; G101-E104 WeakPolarHBondContact CA-O 3.49Å; G101-E104 PolarHBondContact O-N 3.3Å; G101-E104 VanDerWaalsContact O-N 3.1Å; E104-L165 HydrophobicContact CB-CD1 4.37Å; E104-I166 CarbonylContact C-O 3.58Å; E104-I166 WeakPolarHBondContact CA-O 3.37Å; E104-R167 HydrophobicContact CG-CG 4.43Å; E104-R167 IonicContact OE1-CZ 3.28Å; E104-R167 IonicContact OE1-NE 2.8Å; E104-R167 PolarHBondContact OE1-NE 2.89Å; E104-R167 IonicContact OE1-NH2 2.59Å; E104-R167 PolarHBondContact OE1-NH2 2.99Å; E104-L176 HydrophobicContact CG-CD2 4.23Å; E104-L176 WeakPolarHBondContact OE2-CD2 3.22Å; E104-K259 WeakPolarHBondContact OE1-CD 3.29Å; E104-K259 IonicContact OE1-NZ 3.81Å; E104-K259 PolarHBondContact OE1-NZ 2.89Å; E104-K259 IonicContact OE2-NZ 3.89Å; E104-K259 PolarHBondContact OE2-NZ 2.76Å
105	A	90.7	Very high	87.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	144.7	171.4	0	0	0	0	0	110.7	N72 R97 L98 Y107 I166	N72-A105 CarbonylContact O-C 3.54Å; N72-A105 VanDerWaalsContact O-CA 3.25Å; N72-A105 WeakPolarHBondContact O-CA 3.46Å; R97-A105 HydrophobicContact CB-CB 3.97Å; L98-A105 HydrophobicContact CD2-CB 4Å; L98-A105 HydrophobicContact CG-CB 4.27Å; A105-Y107 HydrophobicContact CB-CD2 4.36Å; A105-Y107 HydrophobicContact CB-CE2 4.03Å; A105-I166 HydrophobicContact CB-CB 4.49Å; A105-I166 PolarHBondContact N-O 3.46Å; A105-I166 PolarHBondContact O-N 2.95Å
106	V	90.8	Very high	86.9	Confident	12 Å²	12	33.3 Å²	33.3	7%	0.073	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	118.1	177.8	-179.1	0	0	0	0	109.3	N72 I73 E74 V164 L165	N72-V106 PolarHBondContact O-N 2.89Å; I73-V106 VanDerWaalsContact CA-O 3.32Å; I73-V106 WeakPolarHBondContact CA-O 3.41Å; I73-V106 HydrophobicContact CG1-CB 4.42Å; E74-V106 PolarHBondContact N-O 3.16Å; V106-V164 WeakPolarHBondContact CA-O 3.48Å; V106-L165 HydrophobicContact CG2-CD1 4.1Å
107	Y	92.8	Very high	86.7	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.016	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.9	178	-84.3	-111.6	0	0	0	110.2	E74 M94 A105 L132 E163 V164 I166	E74-Y107 HydrophobicContact CB-CD1 4.02Å; E74-Y107 HydrophobicContact CB-CD2 4.28Å; E74-Y107 HydrophobicContact CB-CE1 3.83Å; E74-Y107 HydrophobicContact CB-CE2 4.09Å; E74-Y107 HydrophobicContact CB-CG 4.24Å; E74-Y107 HydrophobicContact CG-CD1 4.01Å; E74-Y107 HydrophobicContact CG-CE1 3.57Å; E74-Y107 WeakPolarHBondContact O-CA 3.38Å; M94-Y107 WeakPolarHBondContact CA-OH 3.42Å; M94-Y107 WeakPolarHBondContact CB-OH 3.44Å; M94-Y107 HydrophobicContact CG-CE2 4.36Å; A105-Y107 HydrophobicContact CB-CD2 4.36Å; A105-Y107 HydrophobicContact CB-CE2 4.03Å; Y107-L132 HydrophobicContact CD1-CD1 3.79Å; Y107-L132 HydrophobicContact CE1-CD1 4.11Å; Y107-L132 HydrophobicContact CG-CD1 4.22Å; Y107-E163 WeakPolarHBondContact O-CA 3.5Å; Y107-V164 PolarHBondContact N-O 2.92Å; Y107-V164 PolarHBondContact O-N 3.22Å; Y107-I166 HydrophobicContact CD1-CD1 4.5Å; Y107-I166 HydrophobicContact CD2-CD1 3.28Å; Y107-I166 HydrophobicContact CD2-CG1 3.85Å; Y107-I166 HydrophobicContact CE2-CD1 3.48Å; Y107-I166 VanDerWaalsContact CE2-CD1 3.48Å; Y107-I166 HydrophobicContact CE2-CG1 4.34Å; Y107-I166 HydrophobicContact CG-CD1 3.85Å
108	Q	91.1	Very high	86.5	Confident	11 Å²	11	27.8 Å²	27.8	5%	0.051	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.4	173.9	-53.4	-166.7	-4	0	0	109.7	E74 Y75 K76 V111 E163	E74-Q108 PolarHBondContact O-N 3.44Å; Y75-Q108 HydrophobicContact CD1-CB 3.77Å; Y75-Q108 HydrophobicContact CD1-CG 3.82Å; Y75-Q108 HydrophobicContact CE1-CB 4.28Å; Y75-Q108 HydrophobicContact CE1-CG 3.87Å; K76-Q108 PolarHBondContact N-O 3.09Å; Q108-V111 HydrophobicContact CB-CB 4.26Å; Q108-V111 HydrophobicContact CB-CG2 3.84Å; Q108-E163 HydrophobicContact CG-CG 4.23Å
109	I	93.1	Very high	86.3	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.6	-177.2	-52.6	-57	0	0	0	109.9	K76 L79 L120 M125 L132 I161 A162 V164	K76-I109 HydrophobicContact CB-CD1 4.11Å; K76-I109 CarbonylContact O-C 3.6Å; K76-I109 VanDerWaalsContact O-CA 3.31Å; K76-I109 WeakPolarHBondContact O-CA 3.46Å; L79-I109 HydrophobicContact CD1-CD1 3.91Å; I109-L120 HydrophobicContact CG2-CD1 3.77Å; I109-M125 HydrophobicContact CB-CE 4.49Å; I109-M125 HydrophobicContact CB-SD 4.21Å; I109-M125 HydrophobicContact CG2-CE 4.2Å; I109-M125 HydrophobicContact CG2-SD 3.77Å; I109-L132 HydrophobicContact CD1-CD2 4.44Å; I109-I161 VanDerWaalsContact O-CA 3.28Å; I109-I161 WeakPolarHBondContact O-CA 3.37Å; I109-I161 WeakPolarHBondContact O-CB 3.47Å; I109-A162 HydrophobicContact CB-CB 4.45Å; I109-A162 PolarHBondContact N-O 2.89Å; I109-A162 PolarHBondContact O-N 2.93Å; I109-V164 HydrophobicContact CG1-CG2 4.39Å
110	G	88.4	Confident	86.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	14.3	-174.1	0	0	0	0	0	113.8	K76 L77 V118 G119	K76-G110 PolarHBondContact O-N 2.81Å; L77-G110 WeakPolarHBondContact O-CA 3.46Å; L77-G110 PolarHBondContact O-N 2.87Å; G110-V118 PolarHBondContact O-N 3.23Å; G110-G119 PolarHBondContact O-N 3.03Å
111	V	87.9	Confident	86.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.012	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-116.7	132.8	179.3	-173	0	0	0	0	109.3	L64 Y75 K76 L77 Q108 M116 L117 I161	L64-V111 HydrophobicContact CD1-CG1 4.38Å; Y75-V111 HydrophobicContact CD2-CG1 3.84Å; Y75-V111 HydrophobicContact CE2-CG1 4.32Å; Y75-V111 HydrophobicContact CG-CB 4.4Å; Y75-V111 HydrophobicContact CG-CG1 3.96Å; K76-V111 CarbonylContact C-O 3.51Å; K76-V111 PolarHBondContact N-O 2.86Å; L77-V111 WeakPolarHBondContact CA-O 3.4Å; L77-V111 PolarHBondContact N-O 2.83Å; Q108-V111 HydrophobicContact CB-CB 4.26Å; Q108-V111 HydrophobicContact CB-CG2 3.84Å; V111-M116 WeakPolarHBondContact CA-O 3.4Å; V111-L117 HydrophobicContact CB-CD2 4.28Å; V111-L117 HydrophobicContact CG1-CD2 3.96Å; V111-L117 HydrophobicContact CG2-CD2 3.49Å; V111-L117 VanDerWaalsContact CG2-CD2 3.49Å; V111-I161 HydrophobicContact CG2-CG2 4.4Å
112	E	86.9	Confident	87.2	Confident	59 Å²	59	30.3 Å²	30.3	28%	0.276	16%	0.156	S	C	.	.			trans	-77	155.9	171.4	-72.9	-169.7	178.2	0	0	111.6	L77 N114 G115 M116 V118	L77-E112 HydrophobicContact CB-CG 4.42Å; L77-E112 HydrophobicContact CD1-CG 4.24Å; L77-E112 HydrophobicContact CD2-CG 4.16Å; E112-N114 VanDerWaalsContact CB-OD1 3.29Å; E112-N114 WeakPolarHBondContact CB-OD1 3.46Å; E112-N114 PolarHBondContact O-N 3.38Å; E112-N114 PolarHBondContact OE2-ND2 3.36Å; E112-G115 WeakPolarHBondContact O-CA 3.02Å; E112-G115 PolarHBondContact O-N 2.88Å; E112-M116 HydrophobicContact CB-CB 4.29Å; E112-M116 PolarHBondContact N-O 3.23Å; E112-M116 WeakPolarHBondContact OE2-CE 3.46Å; E112-V118 HydrophobicContact CG-CG2 3.93Å
113	D	83.8	Confident	87.5	Confident	97 Å²	97	34.7 Å²	34.7	52%	0.519	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.5	179.9	-51.2	-5.3	0	0	0	112.8	E67 K76 G115	E67-D113 WeakPolarHBondContact CB-O 3.19Å; E67-D113 PolarHBondContact N-O 3.04Å; K76-D113 IonicContact NZ-OD1 2.86Å; D113-G115 VanDerWaalsContact C-N 3.25Å; D113-G115 PolarHBondContact O-N 3.09Å
114	N	82.4	Confident	87.8	Confident	57 Å²	57	36 Å²	36	31%	0.305	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-14.8	174.2	60.7	25.6	0	0	0	113.1	Y63 P66 E112 M116	Y63-N114 WeakPolarHBondContact CE1-O 3.46Å; Y63-N114 PolarHBondContact OH-O 2.99Å; P66-N114 WeakPolarHBondContact CA-O 3.31Å; E112-N114 VanDerWaalsContact CB-OD1 3.29Å; E112-N114 WeakPolarHBondContact CB-OD1 3.46Å; E112-N114 PolarHBondContact O-N 3.38Å; E112-N114 PolarHBondContact OE2-ND2 3.36Å; N114-M116 WeakPolarHBondContact ND2-CE 3.34Å; N114-M116 WeakPolarHBondContact OD1-CB 3.35Å; N114-M116 PolarHBondContact OD1-N 3.24Å
115	G	81.3	Confident	87.9	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	99.7	6.3	-176.3	0	0	0	0	0	114.6	L64 E112 D113	L64-G115 PolarHBondContact N-O 2.79Å; L64-G115 WeakPolarHBondContact O-CA 3.46Å; E112-G115 WeakPolarHBondContact O-CA 3.02Å; E112-G115 PolarHBondContact O-N 2.88Å; D113-G115 VanDerWaalsContact C-N 3.25Å; D113-G115 PolarHBondContact O-N 3.09Å
116	M	83.3	Confident	88	Confident	57 Å²	57	45.6 Å²	45.6	28%	0.281	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-74.9	125.4	178.4	-166.5	-177.7	-23	0	0	111.3	Y63 V111 E112 N114 V118	Y63-M116 HydrophobicContact CD2-CB 4.37Å; Y63-M116 HydrophobicContact CE2-CB 4.17Å; V111-M116 WeakPolarHBondContact CA-O 3.4Å; E112-M116 HydrophobicContact CB-CB 4.29Å; E112-M116 PolarHBondContact N-O 3.23Å; E112-M116 WeakPolarHBondContact OE2-CE 3.46Å; N114-M116 WeakPolarHBondContact ND2-CE 3.34Å; N114-M116 WeakPolarHBondContact OD1-CB 3.35Å; N114-M116 PolarHBondContact OD1-N 3.24Å; M116-V118 HydrophobicContact CG-CG2 4.24Å; M116-V118 PolarHBondContact O-N 2.54Å; M116-V118 HydrophobicContact SD-CG2 4.31Å
117	L	85.3	Confident	88	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.068	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-83.6	95.1	177	-57.4	-176.7	0	0	0	109.8	P62 L64 V111 V151 I161	P62-L117 HydrophobicContact CB-CD1 3.82Å; P62-L117 HydrophobicContact CG-CD1 3.91Å; P62-L117 WeakPolarHBondContact O-CD1 3.32Å; P62-L117 VanDerWaalsContact O-CG 3.3Å; P62-L117 WeakPolarHBondContact O-CG 3.28Å; L64-L117 HydrophobicContact CD1-CD2 3.76Å; L64-L117 HydrophobicContact CG-CD2 4.04Å; V111-L117 HydrophobicContact CB-CD2 4.28Å; V111-L117 HydrophobicContact CG1-CD2 3.96Å; V111-L117 HydrophobicContact CG2-CD2 3.49Å; V111-L117 VanDerWaalsContact CG2-CD2 3.49Å; L117-V151 HydrophobicContact CB-CG2 4.35Å; L117-I161 HydrophobicContact CD1-CD1 4.08Å; L117-I161 HydrophobicContact CD2-CD1 3.92Å
118	V	85.3	Confident	88.1	Confident	28 Å²	28	46.4 Å²	46.4	17%	0.17	23%	0.228	C	C	.	.			trans	-90.9	-34.4	-179.4	178.1	0	0	0	0	111.4	L77 G110 E112 M116 R159	L77-V118 HydrophobicContact CD1-CB 3.58Å; L77-V118 HydrophobicContact CD1-CG1 3.92Å; L77-V118 HydrophobicContact CD1-CG2 4.02Å; G110-V118 PolarHBondContact O-N 3.23Å; E112-V118 HydrophobicContact CG-CG2 3.93Å; M116-V118 HydrophobicContact CG-CG2 4.24Å; M116-V118 PolarHBondContact O-N 2.54Å; M116-V118 HydrophobicContact SD-CG2 4.31Å; V118-R159 WeakPolarHBondContact O-CD 3.49Å
119	G	85.8	Confident	88.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	23%	0.232	C	C	.	.			trans	69.2	159.8	-175.9	0	0	0	0	0	114	G110 K160	G110-G119 PolarHBondContact O-N 3.03Å; G119-K160 CarbonylContact C-O 3.57Å; G119-K160 WeakPolarHBondContact CA-O 3.26Å
120	L	88	Confident	88.2	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.058	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-119	156.3	178.1	-65.9	178.3	0	0	0	111.2	L77 K78 I109 D124 M125 R159 K160	L77-L120 WeakPolarHBondContact O-CD1 3.38Å; L77-L120 WeakPolarHBondContact O-CD2 3.47Å; L77-L120 WeakPolarHBondContact O-CG 3.25Å; K78-L120 HydrophobicContact CB-CD2 4.05Å; K78-L120 HydrophobicContact CD-CD2 4.19Å; K78-L120 HydrophobicContact CG-CD2 4.11Å; I109-L120 HydrophobicContact CG2-CD1 3.77Å; L120-D124 HydrophobicContact CB-CB 4.11Å; L120-D124 HydrophobicContact CD1-CB 4.47Å; L120-D124 HydrophobicContact CD2-CB 4.28Å; L120-M125 HydrophobicContact CB-CB 4.36Å; L120-M125 HydrophobicContact CB-CE 4.3Å; L120-M125 HydrophobicContact CD1-CE 4.37Å; L120-R159 CarbonylContact O-C 3.59Å; L120-R159 VanDerWaalsContact O-CA 3.3Å; L120-R159 WeakPolarHBondContact O-CA 3.34Å; L120-K160 PolarHBondContact N-O 2.73Å; L120-K160 PolarHBondContact O-N 3Å
121	S	90	Very high	88.5	Confident	37 Å²	37	54.7 Å²	54.7	26%	0.259	27%	0.265	S	S	.	.			trans	-66.7	161.8	165.2	65.9	0	0	0	0	110.7	E123 D124 M125	S121-E123 VanDerWaalsContact C-N 3.29Å; S121-E123 PolarHBondContact O-N 2.83Å; S121-D124 PolarHBondContact O-N 3.38Å; S121-D124 WeakPolarHBondContact OG-CB 3.38Å; S121-D124 PolarHBondContact OG-N 3.25Å; S121-M125 WeakPolarHBondContact O-CB 3.19Å; S121-M125 PolarHBondContact O-N 3.29Å
122	E	88.1	Confident	88.7	Confident	154 Å²	154	54.6 Å²	54.6	72%	0.72	27%	0.265	S	S	*	.	H	α-helix	trans	-58.4	-40.3	179.5	-169.7	177.5	171.8	0	0	112.7	M125 R126	E122-M125 PolarHBondContact O-N 3.37Å; E122-R126 WeakPolarHBondContact O-CB 3.49Å; E122-R126 PolarHBondContact O-N 3.38Å
123	E	89.1	Confident	89	Confident	164 Å²	164	55.3 Å²	55.3	77%	0.766	27%	0.268	S	S	*	.	H	α-helix	trans	-63.9	-46.5	177.1	-63.1	-177.2	173.2	0	0	112	S121 R126 A127	S121-E123 VanDerWaalsContact C-N 3.29Å; S121-E123 PolarHBondContact O-N 2.83Å; E123-R126 PolarHBondContact O-N 2.84Å; E123-A127 WeakPolarHBondContact O-CB 3.34Å; E123-A127 PolarHBondContact O-N 3.5Å
124	D	90.8	Very high	89.5	Confident	43 Å²	43	56.5 Å²	56.5	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-36.5	179.4	-80.6	-26.8	0	0	0	112	K78 L120 S121 S128	K78-D124 WeakPolarHBondContact CE-OD1 3.49Å; K78-D124 WeakPolarHBondContact CE-OD2 3.24Å; K78-D124 IonicContact NZ-OD1 3.88Å; K78-D124 PolarHBondContact NZ-OD1 2.99Å; K78-D124 IonicContact NZ-OD2 2.71Å; K78-D124 PolarHBondContact NZ-OD2 3.49Å; L120-D124 HydrophobicContact CB-CB 4.11Å; L120-D124 HydrophobicContact CD1-CB 4.47Å; L120-D124 HydrophobicContact CD2-CB 4.28Å; S121-D124 PolarHBondContact O-N 3.38Å; S121-D124 WeakPolarHBondContact OG-CB 3.38Å; S121-D124 PolarHBondContact OG-N 3.25Å; D124-S128 VanDerWaalsContact O-CB 3.25Å; D124-S128 WeakPolarHBondContact O-CB 3.47Å; D124-S128 PolarHBondContact O-N 3.05Å; D124-S128 PolarHBondContact O-OG 3.13Å
125	M	91.6	Very high	90.1	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.034	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-50.4	175.2	-177.3	59	78.1	0	0	110.2	I109 L120 S121 E122 A127 S128 L129 K160 A162	I109-M125 HydrophobicContact CB-CE 4.49Å; I109-M125 HydrophobicContact CB-SD 4.21Å; I109-M125 HydrophobicContact CG2-CE 4.2Å; I109-M125 HydrophobicContact CG2-SD 3.77Å; L120-M125 HydrophobicContact CB-CB 4.36Å; L120-M125 HydrophobicContact CB-CE 4.3Å; L120-M125 HydrophobicContact CD1-CE 4.37Å; S121-M125 WeakPolarHBondContact O-CB 3.19Å; S121-M125 PolarHBondContact O-N 3.29Å; E122-M125 PolarHBondContact O-N 3.37Å; M125-A127 VanDerWaalsContact C-N 3.32Å; M125-A127 PolarHBondContact O-N 2.92Å; M125-S128 PolarHBondContact O-N 2.82Å; M125-S128 VanDerWaalsContact O-N 3.11Å; M125-L129 HydrophobicContact CG-CD1 4.14Å; M125-L129 HydrophobicContact CG-CG 4.43Å; M125-L129 WeakPolarHBondContact O-CG 3.35Å; M125-L129 PolarHBondContact O-N 2.65Å; M125-L129 HydrophobicContact SD-CD1 4.37Å; M125-L129 HydrophobicContact SD-CG 4.2Å; M125-K160 HydrophobicContact CE-CB 4.38Å; M125-K160 WeakPolarHBondContact CE-O 3.47Å; M125-A162 HydrophobicContact CE-CB 3.73Å; M125-A162 HydrophobicContact SD-CB 3.65Å
126	R	91.6	Very high	90.6	Very high	201 Å²	201	53.9 Å²	53.9	76%	0.758	25%	0.251	S	S	*	.	H	α-helix	trans	-60.1	-42.4	178.6	-169	177.8	-170.8	173.3	4.3	112.1	E122 E123 K130	E122-R126 WeakPolarHBondContact O-CB 3.49Å; E122-R126 PolarHBondContact O-N 3.38Å; E123-R126 PolarHBondContact O-N 2.84Å; R126-K130 WeakPolarHBondContact O-CB 3.37Å; R126-K130 PolarHBondContact O-N 3.25Å
127	A	92.7	Very high	91	Very high	32 Å²	32	57 Å²	57	26%	0.264	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-40	175.5	0	0	0	0	0	112.1	V80 E123 M125 K130 T131	V80-A127 HydrophobicContact CG1-CB 4.22Å; V80-A127 HydrophobicContact CG2-CB 3.8Å; E123-A127 WeakPolarHBondContact O-CB 3.34Å; E123-A127 PolarHBondContact O-N 3.5Å; M125-A127 VanDerWaalsContact C-N 3.32Å; M125-A127 PolarHBondContact O-N 2.92Å; A127-K130 PolarHBondContact O-N 3.27Å; A127-T131 PolarHBondContact O-N 3.41Å; A127-T131 PolarHBondContact O-OG1 3.07Å
128	S	93.8	Very high	91.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-44.5	177.2	-62.1	0	0	0	0	112.2	L79 D124 M125 K130 T131 L132	L79-S128 PolarHBondContact N-OG 3.03Å; D124-S128 VanDerWaalsContact O-CB 3.25Å; D124-S128 WeakPolarHBondContact O-CB 3.47Å; D124-S128 PolarHBondContact O-N 3.05Å; D124-S128 PolarHBondContact O-OG 3.13Å; M125-S128 PolarHBondContact O-N 2.82Å; M125-S128 VanDerWaalsContact O-N 3.11Å; S128-K130 VanDerWaalsContact C-N 3.34Å; S128-K130 PolarHBondContact O-N 2.95Å; S128-T131 WeakPolarHBondContact O-CB 3.49Å; S128-T131 PolarHBondContact O-N 2.94Å; S128-L132 WeakPolarHBondContact O-CB 3.29Å; S128-L132 PolarHBondContact O-N 2.69Å
129	L	93	Very high	91.6	Very high	29 Å²	29	61.6 Å²	61.6	15%	0.152	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-38.8	175.4	-68.9	176.9	0	0	0	111.9	M125 T131 L132 H133 V145 V164	M125-L129 HydrophobicContact CG-CD1 4.14Å; M125-L129 HydrophobicContact CG-CG 4.43Å; M125-L129 WeakPolarHBondContact O-CG 3.35Å; M125-L129 PolarHBondContact O-N 2.65Å; M125-L129 HydrophobicContact SD-CD1 4.37Å; M125-L129 HydrophobicContact SD-CG 4.2Å; L129-T131 PolarHBondContact O-N 3.23Å; L129-L132 PolarHBondContact O-N 3.18Å; L129-H133 WeakPolarHBondContact O-CB 3.29Å; L129-H133 PolarHBondContact O-N 2.9Å; L129-V145 HydrophobicContact CD1-CG2 4.47Å; L129-V145 HydrophobicContact CD2-CG2 4.47Å; L129-V164 HydrophobicContact CD2-CG2 3.6Å
130	K	93.8	Very high	91.8	Very high	151 Å²	151	63.1 Å²	63.1	66%	0.657	30%	0.301	S	S	*	.	H	α-helix	trans	-63.2	-40.8	174.6	-171.7	177.5	-177.8	178.8	0	112.1	R126 A127 S128 R134	R126-K130 WeakPolarHBondContact O-CB 3.37Å; R126-K130 PolarHBondContact O-N 3.25Å; A127-K130 PolarHBondContact O-N 3.27Å; S128-K130 VanDerWaalsContact C-N 3.34Å; S128-K130 PolarHBondContact O-N 2.95Å; K130-R134 WeakPolarHBondContact O-CG 3.43Å; K130-R134 PolarHBondContact O-N 3.38Å
131	T	93.6	Very high	91.9	Very high	5 Å²	5	62.8 Å²	62.8	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-44.1	173.4	-60.2	0	0	0	0	111	L79 P82 F87 A127 S128 L129 H133 R134 L135	L79-T131 HydrophobicContact CB-CG2 4.31Å; L79-T131 WeakPolarHBondContact O-CB 3.38Å; L79-T131 WeakPolarHBondContact O-CG2 3.45Å; L79-T131 PolarHBondContact O-OG1 2.65Å; P82-T131 HydrophobicContact CG-CG2 3.66Å; F87-T131 HydrophobicContact CD2-CG2 4.46Å; F87-T131 HydrophobicContact CE2-CG2 4.49Å; A127-T131 PolarHBondContact O-N 3.41Å; A127-T131 PolarHBondContact O-OG1 3.07Å; S128-T131 WeakPolarHBondContact O-CB 3.49Å; S128-T131 PolarHBondContact O-N 2.94Å; L129-T131 PolarHBondContact O-N 3.23Å; T131-H133 VanDerWaalsContact C-N 3.31Å; T131-H133 PolarHBondContact O-N 2.78Å; T131-R134 PolarHBondContact O-N 2.93Å; T131-L135 HydrophobicContact CG2-CD1 4.33Å; T131-L135 WeakPolarHBondContact O-CG 3.44Å; T131-L135 PolarHBondContact O-N 3.41Å
132	L	93.3	Very high	92	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-40.4	178.6	-165	69.8	0	0	0	111.8	L79 M94 Y107 I109 S128 L129 L135 A136 V164 I166	L79-L132 HydrophobicContact CD1-CD1 3.95Å; M94-L132 HydrophobicContact CE-CD1 3.55Å; M94-L132 HydrophobicContact CE-CG 4.32Å; Y107-L132 HydrophobicContact CD1-CD1 3.79Å; Y107-L132 HydrophobicContact CE1-CD1 4.11Å; Y107-L132 HydrophobicContact CG-CD1 4.22Å; I109-L132 HydrophobicContact CD1-CD2 4.44Å; S128-L132 WeakPolarHBondContact O-CB 3.29Å; S128-L132 PolarHBondContact O-N 2.69Å; L129-L132 PolarHBondContact O-N 3.18Å; L132-L135 WeakPolarHBondContact O-CB 3.42Å; L132-L135 PolarHBondContact O-N 3.06Å; L132-A136 WeakPolarHBondContact O-CB 3.09Å; L132-A136 PolarHBondContact O-N 2.93Å; L132-V164 HydrophobicContact CD2-CB 3.97Å; L132-V164 HydrophobicContact CD2-CG1 3.83Å; L132-V164 HydrophobicContact CD2-CG2 4.15Å; L132-I166 HydrophobicContact CD1-CD1 3.93Å; L132-I166 HydrophobicContact CD2-CD1 4.24Å; L132-I166 HydrophobicContact CG-CD1 4.07Å
133	H	93.6	Very high	92.3	Very high	75 Å²	75	57.4 Å²	57.4	35%	0.347	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-47.6	174.6	-167	51.9	0	0	0	112	L129 T131 L135 A136 E137 I143	L129-H133 WeakPolarHBondContact O-CB 3.29Å; L129-H133 PolarHBondContact O-N 2.9Å; T131-H133 VanDerWaalsContact C-N 3.31Å; T131-H133 PolarHBondContact O-N 2.78Å; H133-L135 VanDerWaalsContact C-N 3.28Å; H133-L135 PolarHBondContact O-N 3.4Å; H133-A136 WeakPolarHBondContact O-CB 3.47Å; H133-A136 PolarHBondContact O-N 3.49Å; H133-A136 VanDerWaalsContact O-N 3.15Å; H133-E137 IonicContact CD2-OE1 3.05Å; H133-E137 IonicContact NE2-OE1 3.61Å; H133-E137 WeakPolarHBondContact O-CG 3.37Å; H133-E137 PolarHBondContact O-N 2.7Å; H133-I143 HydrophobicContact CB-CD1 3.63Å
134	R	93.8	Very high	92.4	Very high	121 Å²	121	50.3 Å²	50.3	46%	0.457	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-34.2	176.1	-69	172.5	62.6	-154	-1.9	112.9	F87 K130 T131 K138	F87-R134 HydrophobicContact CE2-CB 4.02Å; F87-R134 HydrophobicContact CZ-CB 3.97Å; K130-R134 WeakPolarHBondContact O-CG 3.43Å; K130-R134 PolarHBondContact O-N 3.38Å; T131-R134 PolarHBondContact O-N 2.93Å; R134-K138 WeakPolarHBondContact O-CB 3.43Å; R134-K138 PolarHBondContact O-N 3.08Å
135	L	93.5	Very high	92.4	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-45.4	174.4	-71.2	169.6	0	0	0	110.7	F87 L90 A91 M94 T131 L132 H133 K138 V139	F87-L135 HydrophobicContact CD1-CD2 4.2Å; F87-L135 HydrophobicContact CD2-CD2 3.58Å; F87-L135 HydrophobicContact CD2-CG 4.12Å; F87-L135 HydrophobicContact CE1-CD2 4.07Å; F87-L135 HydrophobicContact CE2-CD2 3.42Å; F87-L135 VanDerWaalsContact CE2-CD2 3.42Å; F87-L135 HydrophobicContact CE2-CG 3.65Å; F87-L135 HydrophobicContact CG-CD2 3.97Å; F87-L135 HydrophobicContact CZ-CD2 3.68Å; F87-L135 HydrophobicContact CZ-CG 4.12Å; F87-L135 WeakPolarHBondContact O-CD2 3.1Å; L90-L135 HydrophobicContact CB-CD1 3.83Å; L90-L135 HydrophobicContact CB-CD2 3.9Å; L90-L135 HydrophobicContact CD1-CD1 4.29Å; A91-L135 HydrophobicContact CB-CD2 3.95Å; M94-L135 HydrophobicContact CE-CB 3.48Å; M94-L135 VanDerWaalsContact CE-CB 3.48Å; M94-L135 HydrophobicContact CE-CD1 4.17Å; M94-L135 HydrophobicContact CE-CG 4.46Å; M94-L135 HydrophobicContact SD-CB 4.12Å; T131-L135 HydrophobicContact CG2-CD1 4.33Å; T131-L135 WeakPolarHBondContact O-CG 3.44Å; T131-L135 PolarHBondContact O-N 3.41Å; L132-L135 WeakPolarHBondContact O-CB 3.42Å; L132-L135 PolarHBondContact O-N 3.06Å; H133-L135 VanDerWaalsContact C-N 3.28Å; H133-L135 PolarHBondContact O-N 3.4Å; L135-K138 WeakPolarHBondContact O-CB 3.43Å; L135-K138 PolarHBondContact O-N 3.48Å; L135-V139 PolarHBondContact O-N 3.44Å
136	A	92.3	Very high	92.2	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-47.5	179	0	0	0	0	0	111.6	M94 L132 H133 K138 V139 G140 A141 I143 I166	M94-A136 HydrophobicContact SD-CB 4.23Å; L132-A136 WeakPolarHBondContact O-CB 3.09Å; L132-A136 PolarHBondContact O-N 2.93Å; H133-A136 WeakPolarHBondContact O-CB 3.47Å; H133-A136 PolarHBondContact O-N 3.49Å; H133-A136 VanDerWaalsContact O-N 3.15Å; A136-K138 VanDerWaalsContact C-N 3.27Å; A136-K138 PolarHBondContact O-N 2.96Å; A136-V139 CarbonylContact O-C 3.56Å; A136-V139 VanDerWaalsContact O-CG2 3.23Å; A136-V139 WeakPolarHBondContact O-CG2 3.27Å; A136-V139 PolarHBondContact O-N 2.56Å; A136-G140 PolarHBondContact O-N 3.4Å; A136-A141 CarbonylContact C-O 3.45Å; A136-A141 HydrophobicContact CB-CB 4.25Å; A136-A141 VanDerWaalsContact CB-O 3.3Å; A136-A141 WeakPolarHBondContact CB-O 3.43Å; A136-A141 PolarHBondContact O-N 2.69Å; A136-I143 HydrophobicContact CB-CG2 3.47Å; A136-I143 VanDerWaalsContact CB-CG2 3.47Å; A136-I166 HydrophobicContact CB-CG2 4.3Å
137	E	92.4	Very high	92	Very high	122 Å²	122	44.2 Å²	44.2	57%	0.57	23%	0.225	S	C	*	.	H	α-helix	trans	-55.7	-42.3	174.7	-73.3	178.9	151.8	0	0	111.9	H133 V139 G140	H133-E137 IonicContact CD2-OE1 3.05Å; H133-E137 IonicContact NE2-OE1 3.61Å; H133-E137 WeakPolarHBondContact O-CG 3.37Å; H133-E137 PolarHBondContact O-N 2.7Å; E137-V139 VanDerWaalsContact C-N 3.27Å; E137-V139 PolarHBondContact O-N 3.42Å; E137-G140 PolarHBondContact O-N 3.23Å
138	K	91.7	Very high	91.8	Very high	108 Å²	108	47 Å²	47	47%	0.47	23%	0.233	S	C	.	.	H	α-helix	trans	-64.2	-30.2	178.9	179.5	170.7	176.2	179.8	0	113	F87 A91 R134 L135 A136	F87-K138 HydrophobicContact CD1-CD 4.41Å; F87-K138 HydrophobicContact CE1-CD 3.69Å; A91-K138 HydrophobicContact CB-CD 4.17Å; R134-K138 WeakPolarHBondContact O-CB 3.43Å; R134-K138 PolarHBondContact O-N 3.08Å; L135-K138 WeakPolarHBondContact O-CB 3.43Å; L135-K138 PolarHBondContact O-N 3.48Å; A136-K138 VanDerWaalsContact C-N 3.27Å; A136-K138 PolarHBondContact O-N 2.96Å
139	V	91.2	Very high	91.5	Very high	31 Å²	31	51 Å²	51	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-96.2	3.2	178.4	-58.6	0	0	0	0	113.3	A91 M94 K95 L98 L135 A136 E137 A141	A91-V139 HydrophobicContact CB-CG1 4.36Å; M94-V139 HydrophobicContact CG-CG2 4.22Å; M94-V139 HydrophobicContact SD-CG2 3.71Å; K95-V139 HydrophobicContact CB-CG1 4.38Å; L98-V139 HydrophobicContact CD1-CG2 3.91Å; L135-V139 PolarHBondContact O-N 3.44Å; A136-V139 CarbonylContact O-C 3.56Å; A136-V139 VanDerWaalsContact O-CG2 3.23Å; A136-V139 WeakPolarHBondContact O-CG2 3.27Å; A136-V139 PolarHBondContact O-N 2.56Å; E137-V139 VanDerWaalsContact C-N 3.27Å; E137-V139 PolarHBondContact O-N 3.42Å; V139-A141 HydrophobicContact CG2-CB 3.87Å
140	G	89.8	Confident	91.1	Very high	33 Å²	33	55.9 Å²	55.9	34%	0.34	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	41.8	-176.8	0	0	0	0	0	112.9	A136 E137 V169	A136-G140 PolarHBondContact O-N 3.4Å; E137-G140 PolarHBondContact O-N 3.23Å; G140-V169 WeakPolarHBondContact O-CB 3.24Å; G140-V169 PolarHBondContact O-N 3.42Å
141	A	91.3	Very high	90.6	Very high	3 Å²	3	49.3 Å²	49.3	3%	0.025	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.4	179.8	0	0	0	0	0	111.6	L98 A136 V139 I166 R167	L98-A141 HydrophobicContact CD1-CB 4.06Å; A136-A141 CarbonylContact C-O 3.45Å; A136-A141 HydrophobicContact CB-CB 4.25Å; A136-A141 VanDerWaalsContact CB-O 3.3Å; A136-A141 WeakPolarHBondContact CB-O 3.43Å; A136-A141 PolarHBondContact O-N 2.69Å; V139-A141 HydrophobicContact CG2-CB 3.87Å; A141-I166 HydrophobicContact CB-CG2 3.75Å; A141-R167 CarbonylContact C-O 3.53Å; A141-R167 VanDerWaalsContact CA-O 3.31Å; A141-R167 WeakPolarHBondContact CA-O 3.44Å; A141-R167 WeakPolarHBondContact CB-O 3.43Å
142	D	91.9	Very high	89.4	Confident	42 Å²	42	58.5 Å²	58.5	23%	0.225	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	161.3	169.7	-77.4	-44.3	0	0	0	111.1	I166 R167 S237	D142-I166 WeakPolarHBondContact O-CA 2.97Å; D142-R167 PolarHBondContact N-O 2.69Å; D142-R167 PolarHBondContact O-N 3.04Å; D142-S237 WeakPolarHBondContact OD2-CB 3.39Å; D142-S237 PolarHBondContact OD2-OG 3.01Å
143	I	93.1	Very high	88	Confident	36 Å²	36	63.7 Å²	63.7	19%	0.185	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.3	176	67.5	172.2	0	0	0	110.6	H133 A136 V164 L165 I166	H133-I143 HydrophobicContact CB-CD1 3.63Å; A136-I143 HydrophobicContact CB-CG2 3.47Å; A136-I143 VanDerWaalsContact CB-CG2 3.47Å; I143-V164 HydrophobicContact CB-CG1 4.04Å; I143-L165 CarbonylContact C-O 3.05Å; I143-L165 WeakPolarHBondContact CA-O 3.4Å; I143-I166 HydrophobicContact CG2-CG1 4.28Å
144	A	91.2	Very high	86.3	Confident	16 Å²	16	68.5 Å²	68.5	13%	0.132	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	122.1	170.8	0	0	0	0	0	109.2	L146 V164 L165 K238	A144-L146 PolarHBondContact O-N 3.29Å; A144-V164 CarbonylContact O-C 3.56Å; A144-V164 WeakPolarHBondContact O-CA 3.47Å; A144-L165 PolarHBondContact N-O 3.09Å; A144-L165 PolarHBondContact O-N 3.21Å; A144-K238 WeakPolarHBondContact CB-O 3.5Å
145	V	90.9	Very high	84.8	Confident	72 Å²	72	65 Å²	65	44%	0.436	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	116.8	174.4	-177.1	0	0	0	0	107.9	L129 E148 V164	L129-V145 HydrophobicContact CD1-CG2 4.47Å; L129-V145 HydrophobicContact CD2-CG2 4.47Å; V145-E148 HydrophobicContact CG1-CG 4.17Å; V145-V164 HydrophobicContact CG2-CG2 4.39Å
146	L	87.1	Confident	83.5	Confident	35 Å²	35	73.4 Å²	73.4	18%	0.183	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-43.6	-179	-62.8	-177.5	0	0	0	111.4	A144 E163 L165 V361 I396	A144-L146 PolarHBondContact O-N 3.29Å; L146-E163 HydrophobicContact CB-CB 4.42Å; L146-E163 WeakPolarHBondContact CB-O 3.45Å; L146-E163 PolarHBondContact N-O 3.02Å; L146-L165 HydrophobicContact CD1-CB 4.02Å; L146-L165 HydrophobicContact CD2-CB 3.77Å; L146-L165 HydrophobicContact CD2-CD2 4.25Å; L146-L165 HydrophobicContact CG-CB 3.84Å; L146-V361 HydrophobicContact CD1-CG1 4.35Å; L146-I396 HydrophobicContact CD1-CD1 4.11Å; L146-I396 HydrophobicContact CD1-CG1 4.27Å; L146-I396 HydrophobicContact CD1-CG2 4.47Å; L146-I396 HydrophobicContact CD2-CD1 3.89Å; L146-I396 HydrophobicContact CD2-CG1 3.97Å; L146-I396 HydrophobicContact CG-CD1 4.5Å
147	R	87.2	Confident	82.6	Confident	16 Å²	16	77.6 Å²	77.6	6%	0.06	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	158.6	177	60.6	178.1	176.8	-146.6	-3.2	112	A162 E163 D358 T362	R147-A162 WeakPolarHBondContact O-CA 3.34Å; R147-E163 HydrophobicContact CG-CB 4.06Å; R147-E163 HydrophobicContact CG-CG 4.44Å; R147-E163 IonicContact CZ-OE1 3.1Å; R147-E163 IonicContact CZ-OE2 2.75Å; R147-E163 PolarHBondContact N-O 2.88Å; R147-E163 IonicContact NE-OE1 2.95Å; R147-E163 PolarHBondContact NE-OE1 3.32Å; R147-E163 IonicContact NE-OE2 2.94Å; R147-E163 PolarHBondContact NE-OE2 3.18Å; R147-E163 VanDerWaalsContact NH2-CD 3.26Å; R147-E163 IonicContact NH2-OE1 3.93Å; R147-E163 PolarHBondContact NH2-OE1 3.33Å; R147-E163 IonicContact NH2-OE2 2.66Å; R147-E163 PolarHBondContact NH2-OE2 3.2Å; R147-E163 VanDerWaalsContact NH2-OE2 3.1Å; R147-E163 PolarHBondContact O-N 3.01Å; R147-D358 PolarHBondContact NH1-O 2.97Å; R147-T362 PolarHBondContact NH1-OG1 2.92Å
148	E	89.9	Confident	82	Confident	89 Å²	89	76 Å²	76	42%	0.416	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.4	166.5	-63.8	-174.7	176.3	0	0	109.1	V145 K160 I161 A162	V145-E148 HydrophobicContact CG1-CG 4.17Å; E148-K160 IonicContact OE2-NZ 3.3Å; E148-I161 CarbonylContact C-O 3.53Å; E148-I161 VanDerWaalsContact CA-O 3.27Å; E148-I161 WeakPolarHBondContact CA-O 3.43Å; E148-A162 HydrophobicContact CG-CB 4.2Å
149	R	86.3	Confident	81.8	Confident	85 Å²	85	75.1 Å²	75.1	32%	0.321	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139	176.4	-64.8	172.7	166.8	178.1	-9.9	109.9	K160 I161 D358	R149-K160 CarbonylContact O-C 3.59Å; R149-K160 VanDerWaalsContact O-CA 3.26Å; R149-K160 WeakPolarHBondContact O-CA 2.96Å; R149-I161 HydrophobicContact CB-CD1 4.01Å; R149-I161 HydrophobicContact CB-CG1 3.66Å; R149-I161 PolarHBondContact N-O 3.3Å; R149-I161 WeakPolarHBondContact O-CG1 3.47Å; R149-I161 PolarHBondContact O-N 2.61Å; R149-D358 IonicContact NE-OD2 3.99Å
150	E	85.7	Confident	81.7	Confident	131 Å²	131	76.3 Å²	76.3	61%	0.612	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	136.9	171.8	-70.9	179.2	-178.6	0	0	109.9	R159 K160	E150-R159 CarbonylContact C-O 3.6Å; E150-R159 WeakPolarHBondContact CA-O 3.29Å; E150-K160 HydrophobicContact CG-CD 4.45Å; E150-K160 HydrophobicContact CG-CG 3.82Å; E150-K160 WeakPolarHBondContact OE1-CE 3.17Å; E150-K160 IonicContact OE1-NZ 3.37Å
151	V	82.1	Confident	81.7	Confident	13 Å²	13	75.3 Å²	75.3	8%	0.079	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.8	175.6	-176.8	0	0	0	0	107.3	L117 Y153 R159 I161	L117-V151 HydrophobicContact CB-CG2 4.35Å; V151-Y153 VanDerWaalsContact C-N 3.34Å; V151-Y153 HydrophobicContact CG1-CD2 4.21Å; V151-Y153 PolarHBondContact O-N 3.32Å; V151-R159 PolarHBondContact N-O 3.3Å; V151-I161 HydrophobicContact CG2-CD1 4.45Å; V151-I161 HydrophobicContact CG2-CG1 4.27Å; V151-I161 HydrophobicContact CG2-CG2 3.7Å
152	E	68.4	Low	81.7	Confident	199 Å²	199	75.2 Å²	75.2	93%	0.93	38%	0.38	S	S	*	.			trans	-72.5	91.1	171	-68.4	-177.8	-177.5	0	0	108.9
153	Y	64.7	Low	81.7	Confident	108 Å²	108	73.6 Å²	73.6	42%	0.424	37%	0.371	S	S	.	.			trans	-101.4	155.9	164.8	-128.3	-96.3	0	0	0	108.9	T61 V151 S155	T61-Y153 HydrophobicContact CG2-CE2 4.04Å; V151-Y153 VanDerWaalsContact C-N 3.34Å; V151-Y153 HydrophobicContact CG1-CD2 4.21Å; V151-Y153 PolarHBondContact O-N 3.32Å; Y153-S155 PolarHBondContact O-N 2.75Å
154	D	58.6	Low	81.6	Confident	177 Å²	177	71.9 Å²	71.9	95%	0.947	36%	0.362	S	S	*	.	S	Bend	trans	-68.9	37.9	-177.8	-146.2	14.9	0	0	0	112.8
155	S	60.6	Low	81.6	Confident	46 Å²	46	71.3 Å²	71.3	32%	0.322	36%	0.357	S	S	.	.	S	Bend	trans	-127	136.8	-175	59.4	0	0	0	0	110.4	Y153 V157	Y153-S155 PolarHBondContact O-N 2.75Å; S155-V157 PolarHBondContact O-N 3.49Å
156	D	66.3	Low	81.7	Confident	179 Å²	179	67.9 Å²	67.9	96%	0.957	34%	0.336	S	S	*	.	S	Bend	trans	-61.8	-2.5	-175.3	-63	-44.6	0	0	0	115.8
157	V	74.8	Confident	81.9	Confident	89 Å²	89	66.3 Å²	66.3	54%	0.539	33%	0.328	S	S	.	.	S	Bend	trans	-116.5	124.6	-176.6	-174.5	0	0	0	0	109.9	S155 R159	S155-V157 PolarHBondContact O-N 3.49Å; V157-R159 PolarHBondContact O-N 3.19Å
158	P	79.2	Confident	81.9	Confident	87 Å²	87	69.6 Å²	69.6	57%	0.565	34%	0.343	S	S	*	.			trans	-63.6	127.8	178	26.7	-33.6	0	0	0	109.9
159	R	87.2	Confident	81.6	Confident	91 Å²	91	68.1 Å²	68.1	34%	0.343	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.5	176.6	-66.4	-171.5	176.7	-164	-0.3	109.8	V118 L120 E150 V151 V157	V118-R159 WeakPolarHBondContact O-CD 3.49Å; L120-R159 CarbonylContact O-C 3.59Å; L120-R159 VanDerWaalsContact O-CA 3.3Å; L120-R159 WeakPolarHBondContact O-CA 3.34Å; E150-R159 CarbonylContact C-O 3.6Å; E150-R159 WeakPolarHBondContact CA-O 3.29Å; V151-R159 PolarHBondContact N-O 3.3Å; V157-R159 PolarHBondContact O-N 3.19Å
160	K	89.3	Confident	81	Confident	56 Å²	56	65.9 Å²	65.9	24%	0.243	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.2	-178.6	-68.6	-179.6	178	-174.2	0	111.7	G119 L120 M125 E148 R149 E150	G119-K160 CarbonylContact C-O 3.57Å; G119-K160 WeakPolarHBondContact CA-O 3.26Å; L120-K160 PolarHBondContact N-O 2.73Å; L120-K160 PolarHBondContact O-N 3Å; M125-K160 HydrophobicContact CE-CB 4.38Å; M125-K160 WeakPolarHBondContact CE-O 3.47Å; E148-K160 IonicContact OE2-NZ 3.3Å; R149-K160 CarbonylContact O-C 3.59Å; R149-K160 VanDerWaalsContact O-CA 3.26Å; R149-K160 WeakPolarHBondContact O-CA 2.96Å; E150-K160 HydrophobicContact CG-CD 4.45Å; E150-K160 HydrophobicContact CG-CG 3.82Å; E150-K160 WeakPolarHBondContact OE1-CE 3.17Å; E150-K160 IonicContact OE1-NZ 3.37Å
161	I	91.1	Very high	80	Confident	11 Å²	11	65.4 Å²	65.4	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.7	162.5	59.7	173.7	0	0	0	108.3	I109 V111 L117 E148 R149 V151	I109-I161 VanDerWaalsContact O-CA 3.28Å; I109-I161 WeakPolarHBondContact O-CA 3.37Å; I109-I161 WeakPolarHBondContact O-CB 3.47Å; V111-I161 HydrophobicContact CG2-CG2 4.4Å; L117-I161 HydrophobicContact CD1-CD1 4.08Å; L117-I161 HydrophobicContact CD2-CD1 3.92Å; E148-I161 CarbonylContact C-O 3.53Å; E148-I161 VanDerWaalsContact CA-O 3.27Å; E148-I161 WeakPolarHBondContact CA-O 3.43Å; R149-I161 HydrophobicContact CB-CD1 4.01Å; R149-I161 HydrophobicContact CB-CG1 3.66Å; R149-I161 PolarHBondContact N-O 3.3Å; R149-I161 WeakPolarHBondContact O-CG1 3.47Å; R149-I161 PolarHBondContact O-N 2.61Å; V151-I161 HydrophobicContact CG2-CD1 4.45Å; V151-I161 HydrophobicContact CG2-CG1 4.27Å; V151-I161 HydrophobicContact CG2-CG2 3.7Å
162	A	90.8	Very high	79	Confident	1 Å²	1	70 Å²	70	1%	0.008	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.7	178.3	0	0	0	0	0	110.2	I109 M125 R147 E148 V164	I109-A162 HydrophobicContact CB-CB 4.45Å; I109-A162 PolarHBondContact N-O 2.89Å; I109-A162 PolarHBondContact O-N 2.93Å; M125-A162 HydrophobicContact CE-CB 3.73Å; M125-A162 HydrophobicContact SD-CB 3.65Å; R147-A162 WeakPolarHBondContact O-CA 3.34Å; E148-A162 HydrophobicContact CG-CB 4.2Å; A162-V164 HydrophobicContact CB-CG2 4.42Å
163	E	90.8	Very high	78.7	Confident	8 Å²	8	63.2 Å²	63.2	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123	168.3	-73	179.3	-141.7	0	0	108.9	Y107 Q108 L146 R147 Q365	Y107-E163 WeakPolarHBondContact O-CA 3.5Å; Q108-E163 HydrophobicContact CG-CG 4.23Å; L146-E163 HydrophobicContact CB-CB 4.42Å; L146-E163 WeakPolarHBondContact CB-O 3.45Å; L146-E163 PolarHBondContact N-O 3.02Å; R147-E163 HydrophobicContact CG-CB 4.06Å; R147-E163 HydrophobicContact CG-CG 4.44Å; R147-E163 IonicContact CZ-OE1 3.1Å; R147-E163 IonicContact CZ-OE2 2.75Å; R147-E163 PolarHBondContact N-O 2.88Å; R147-E163 IonicContact NE-OE1 2.95Å; R147-E163 PolarHBondContact NE-OE1 3.32Å; R147-E163 IonicContact NE-OE2 2.94Å; R147-E163 PolarHBondContact NE-OE2 3.18Å; R147-E163 VanDerWaalsContact NH2-CD 3.26Å; R147-E163 IonicContact NH2-OE1 3.93Å; R147-E163 PolarHBondContact NH2-OE1 3.33Å; R147-E163 IonicContact NH2-OE2 2.66Å; R147-E163 PolarHBondContact NH2-OE2 3.2Å; R147-E163 VanDerWaalsContact NH2-OE2 3.1Å; R147-E163 PolarHBondContact O-N 3.01Å; E163-Q365 PolarHBondContact OE2-NE2 3.41Å
164	V	92.3	Very high	78.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.9	-174	-171	0	0	0	0	109.2	V106 Y107 I109 L129 L132 I143 A144 V145 A162	V106-V164 WeakPolarHBondContact CA-O 3.48Å; Y107-V164 PolarHBondContact N-O 2.92Å; Y107-V164 PolarHBondContact O-N 3.22Å; I109-V164 HydrophobicContact CG1-CG2 4.39Å; L129-V164 HydrophobicContact CD2-CG2 3.6Å; L132-V164 HydrophobicContact CD2-CB 3.97Å; L132-V164 HydrophobicContact CD2-CG1 3.83Å; L132-V164 HydrophobicContact CD2-CG2 4.15Å; I143-V164 HydrophobicContact CB-CG1 4.04Å; A144-V164 CarbonylContact O-C 3.56Å; A144-V164 WeakPolarHBondContact O-CA 3.47Å; V145-V164 HydrophobicContact CG2-CG2 4.39Å; A162-V164 HydrophobicContact CB-CG2 4.42Å
165	L	91.3	Very high	79.7	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	128.3	169.1	-179.2	65.7	0	0	0	108.9	E104 V106 I143 A144 L146	E104-L165 HydrophobicContact CB-CD1 4.37Å; V106-L165 HydrophobicContact CG2-CD1 4.1Å; I143-L165 CarbonylContact C-O 3.05Å; I143-L165 WeakPolarHBondContact CA-O 3.4Å; A144-L165 PolarHBondContact N-O 3.09Å; A144-L165 PolarHBondContact O-N 3.21Å; L146-L165 HydrophobicContact CD1-CB 4.02Å; L146-L165 HydrophobicContact CD2-CB 3.77Å; L146-L165 HydrophobicContact CD2-CD2 4.25Å; L146-L165 HydrophobicContact CG-CB 3.84Å
166	I	92.3	Very high	80.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.1	171.3	-50.3	-169.7	0	0	0	106.8	M94 L98 E104 A105 Y107 L132 A136 A141 D142 I143	M94-I166 HydrophobicContact CE-CD1 3.4Å; M94-I166 VanDerWaalsContact CE-CD1 3.4Å; M94-I166 HydrophobicContact CG-CD1 4.23Å; M94-I166 HydrophobicContact SD-CD1 3.83Å; M94-I166 HydrophobicContact SD-CG2 4.08Å; L98-I166 HydrophobicContact CD1-CG2 4.38Å; L98-I166 HydrophobicContact CD2-CB 4.42Å; L98-I166 HydrophobicContact CD2-CG2 4.09Å; L98-I166 WeakPolarHBondContact CD2-O 3.45Å; E104-I166 CarbonylContact C-O 3.58Å; E104-I166 WeakPolarHBondContact CA-O 3.37Å; A105-I166 HydrophobicContact CB-CB 4.49Å; A105-I166 PolarHBondContact N-O 3.46Å; A105-I166 PolarHBondContact O-N 2.95Å; Y107-I166 HydrophobicContact CD1-CD1 4.5Å; Y107-I166 HydrophobicContact CD2-CD1 3.28Å; Y107-I166 HydrophobicContact CD2-CG1 3.85Å; Y107-I166 HydrophobicContact CE2-CD1 3.48Å; Y107-I166 VanDerWaalsContact CE2-CD1 3.48Å; Y107-I166 HydrophobicContact CE2-CG1 4.34Å; Y107-I166 HydrophobicContact CG-CD1 3.85Å; L132-I166 HydrophobicContact CD1-CD1 3.93Å; L132-I166 HydrophobicContact CD2-CD1 4.24Å; L132-I166 HydrophobicContact CG-CD1 4.07Å; A136-I166 HydrophobicContact CB-CG2 4.3Å; A141-I166 HydrophobicContact CB-CG2 3.75Å; D142-I166 WeakPolarHBondContact O-CA 2.97Å; I143-I166 HydrophobicContact CG2-CG1 4.28Å
167	R	90.5	Very high	81.6	Confident	3 Å²	3	46.5 Å²	46.5	1%	0.011	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.8	-179.3	-171.6	174.2	-71.2	155.9	-1.6	109.6	G103 E104 A141 D142 V169 N236 N395	G103-R167 CarbonylContact O-C 3.5Å; G103-R167 WeakPolarHBondContact O-CA 3.11Å; E104-R167 HydrophobicContact CG-CG 4.43Å; E104-R167 IonicContact OE1-CZ 3.28Å; E104-R167 IonicContact OE1-NE 2.8Å; E104-R167 PolarHBondContact OE1-NE 2.89Å; E104-R167 IonicContact OE1-NH2 2.59Å; E104-R167 PolarHBondContact OE1-NH2 2.99Å; A141-R167 CarbonylContact C-O 3.53Å; A141-R167 VanDerWaalsContact CA-O 3.31Å; A141-R167 WeakPolarHBondContact CA-O 3.44Å; A141-R167 WeakPolarHBondContact CB-O 3.43Å; D142-R167 PolarHBondContact N-O 2.69Å; D142-R167 PolarHBondContact O-N 3.04Å; R167-V169 PolarHBondContact O-N 2.71Å; R167-N236 PolarHBondContact NH1-O 3.05Å; R167-N395 PolarHBondContact NH1-OD1 3.09Å; R167-N395 PolarHBondContact NH2-O 2.99Å; R167-N395 PolarHBondContact NH2-OD1 2.75Å
168	K	87.8	Confident	82.3	Confident	85 Å²	85	42.3 Å²	42.3	37%	0.37	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	132.7	175.6	-166	-172	171.9	-165.9	0	109.1	G103 D171	G103-K168 PolarHBondContact O-N 2.84Å; K168-D171 VanDerWaalsContact CE-OD2 3.28Å; K168-D171 WeakPolarHBondContact CE-OD2 3.41Å; K168-D171 IonicContact NZ-OD2 2.71Å; K168-D171 PolarHBondContact NZ-OD2 2.89Å
169	V	83.7	Confident	82.9	Confident	57 Å²	57	39.4 Å²	39.4	35%	0.345	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-71.2	126	169.8	-177.4	0	0	0	0	107.1	G140 R167 D171	G140-V169 WeakPolarHBondContact O-CB 3.24Å; G140-V169 PolarHBondContact O-N 3.42Å; R167-V169 PolarHBondContact O-N 2.71Å; V169-D171 PolarHBondContact O-N 3.06Å
170	P	73.4	Confident	83.3	Confident	38 Å²	38	35.1 Å²	35.1	25%	0.247	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-65.4	124.3	-177	22.9	-31.1	0	0	0	110.6	D172 S258	P170-D172 VanDerWaalsContact C-N 3.31Å; P170-D172 WeakPolarHBondContact CB-O 3.11Å; P170-S258 VanDerWaalsContact CD-OG 3.29Å; P170-S258 WeakPolarHBondContact CD-OG 3.48Å
171	D	64.9	Low	83.6	Confident	121 Å²	121	32.5 Å²	32.5	65%	0.647	17%	0.166	S	C	*	.	S	Bend	trans	-77.2	-19.7	174.9	-59.8	-49.8	0	0	0	112	K168 V169	K168-D171 VanDerWaalsContact CE-OD2 3.28Å; K168-D171 WeakPolarHBondContact CE-OD2 3.41Å; K168-D171 IonicContact NZ-OD2 2.71Å; K168-D171 PolarHBondContact NZ-OD2 2.89Å; V169-D171 PolarHBondContact O-N 3.06Å
172	D	62.1	Low	83.8	Confident	109 Å²	109	32 Å²	32	58%	0.583	16%	0.163	S	C	*	.	S	Bend	trans	-146.6	-176.2	-177.2	-76.7	-38.6	0	0	0	109.4	P170 Q174	P170-D172 VanDerWaalsContact C-N 3.31Å; P170-D172 WeakPolarHBondContact CB-O 3.11Å; D172-Q174 HydrophobicContact CB-CB 4.48Å; D172-Q174 HydrophobicContact CB-CG 3.93Å; D172-Q174 PolarHBondContact O-N 3.48Å; D172-Q174 PolarHBondContact OD2-NE2 2.88Å
173	Q	62.2	Low	84.1	Confident	58 Å²	58	32 Å²	32	27%	0.271	16%	0.163	S	C	.	.	S	Bend	trans	-61.8	32.1	164.4	-64.2	177.6	-3.2	0	0	113.8	F175 R466 A470	Q173-F175 PolarHBondContact O-N 3.32Å; Q173-R466 PolarHBondContact O-NH1 3.46Å; Q173-R466 PolarHBondContact O-NH2 2.71Å; Q173-A470 PolarHBondContact NE2-O 2.94Å; Q173-A470 PolarHBondContact OE1-O 3.36Å
174	Q	68.9	Low	84.2	Confident	96 Å²	96	31.6 Å²	31.6	45%	0.449	16%	0.161	S	C	.	.			trans	-97.7	71.5	177.3	-63.3	-179	44.3	0	0	109.2	D172 R475	D172-Q174 HydrophobicContact CB-CB 4.48Å; D172-Q174 HydrophobicContact CB-CG 3.93Å; D172-Q174 PolarHBondContact O-N 3.48Å; D172-Q174 PolarHBondContact OD2-NE2 2.88Å; Q174-R475 VanDerWaalsContact OE1-CZ 3.26Å
175	F	74.3	Confident	84.2	Confident	12 Å²	12	32.9 Å²	32.9	5%	0.053	17%	0.168	C	C	.	.			trans	-91.5	156.5	171.1	53.1	-107.6	0	0	0	111.6	Q173 D177 C254 M260 R466	Q173-F175 PolarHBondContact O-N 3.32Å; F175-D177 HydrophobicContact CD2-CB 4.01Å; F175-D177 HydrophobicContact CE2-CB 3.86Å; F175-D177 PolarHBondContact O-N 3.13Å; F175-C254 WeakPolarHBondContact CD1-O 3.47Å; F175-C254 HydrophobicContact CE1-CB 3.76Å; F175-C254 WeakPolarHBondContact CE1-O 3.4Å; F175-C254 HydrophobicContact CZ-CB 4.33Å; F175-M260 HydrophobicContact CB-CG 4.45Å; F175-M260 HydrophobicContact CD1-CG 4.17Å; F175-M260 HydrophobicContact CD2-CB 3.62Å; F175-M260 HydrophobicContact CD2-CG 3.39Å; F175-M260 HydrophobicContact CE1-CG 4.17Å; F175-M260 HydrophobicContact CE2-CB 3.64Å; F175-M260 HydrophobicContact CE2-CG 3.44Å; F175-M260 VanDerWaalsContact CE2-CG 3.44Å; F175-M260 HydrophobicContact CG-CB 4.44Å; F175-M260 HydrophobicContact CG-CG 3.77Å; F175-M260 HydrophobicContact CZ-CB 4.44Å; F175-M260 HydrophobicContact CZ-CG 3.84Å; F175-R466 VanDerWaalsContact CZ-CZ 3.46Å
176	L	81.1	Confident	84.1	Confident	17 Å²	17	34 Å²	34	9%	0.089	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	120.4	166.8	176.1	66	0	0	0	108.7	R102 E104 L178 S258 K259 M260 P399	R102-L176 HydrophobicContact CB-CD1 4.37Å; E104-L176 HydrophobicContact CG-CD2 4.23Å; E104-L176 WeakPolarHBondContact OE2-CD2 3.22Å; L176-L178 HydrophobicContact CD1-CD2 4.28Å; L176-L178 HydrophobicContact CG-CD2 4.49Å; L176-L178 HydrophobicContact CG-CG 4.4Å; L176-S258 PolarHBondContact N-O 3.17Å; L176-K259 HydrophobicContact CB-CG 4.37Å; L176-K259 HydrophobicContact CD2-CD 4.05Å; L176-K259 HydrophobicContact CD2-CG 4.12Å; L176-K259 HydrophobicContact CG-CG 4.4Å; L176-K259 CarbonylContact O-C 3.52Å; L176-K259 WeakPolarHBondContact O-CA 3.44Å; L176-M260 PolarHBondContact O-N 3.41Å; L176-P399 HydrophobicContact CD1-CB 4.11Å; L176-P399 HydrophobicContact CD1-CG 3.91Å
177	D	85.4	Confident	83.9	Confident	33 Å²	33	38.4 Å²	38.4	18%	0.176	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.4	177.9	-169.1	8.3	0	0	0	109.8	F175 M260 T262	F175-D177 HydrophobicContact CD2-CB 4.01Å; F175-D177 HydrophobicContact CE2-CB 3.86Å; F175-D177 PolarHBondContact O-N 3.13Å; D177-M260 WeakPolarHBondContact CA-O 3.3Å; D177-T262 PolarHBondContact OD1-OG1 2.82Å
178	L	89.9	Confident	84	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.9	177.3	-59.1	176.8	0	0	0	109.8	L176 M260 I261 T262 F287 I397 P399	L176-L178 HydrophobicContact CD1-CD2 4.28Å; L176-L178 HydrophobicContact CG-CD2 4.49Å; L176-L178 HydrophobicContact CG-CG 4.4Å; L178-M260 PolarHBondContact N-O 2.9Å; L178-I261 HydrophobicContact CB-CD1 3.85Å; L178-I261 HydrophobicContact CD1-CD1 3.94Å; L178-I261 HydrophobicContact CG-CD1 4.3Å; L178-I261 CarbonylContact O-C 3.58Å; L178-I261 WeakPolarHBondContact O-CA 3.16Å; L178-T262 PolarHBondContact O-N 3.35Å; L178-F287 HydrophobicContact CD1-CE2 4.27Å; L178-F287 HydrophobicContact CD2-CE2 4.45Å; L178-I397 HydrophobicContact CD1-CG2 3.86Å; L178-I397 VanDerWaalsContact CD1-O 3.27Å; L178-I397 WeakPolarHBondContact CD1-O 3.31Å; L178-P399 HydrophobicContact CD2-CB 3.87Å
179	R	91.4	Very high	84.1	Confident	25 Å²	25	34.9 Å²	34.9	9%	0.094	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.6	-178.5	-64.7	171	-63.8	-178.6	-3.5	110.9	T262 I264 Y283 C284 D286 F287 G477	R179-T262 CarbonylContact C-O 3.57Å; R179-T262 VanDerWaalsContact CA-O 3.32Å; R179-T262 WeakPolarHBondContact CA-O 3.43Å; R179-I264 HydrophobicContact CB-CD1 4.47Å; R179-Y283 PolarHBondContact NH1-O 2.81Å; R179-C284 VanDerWaalsContact CZ-O 3.25Å; R179-C284 PolarHBondContact NH2-O 2.86Å; R179-D286 WeakPolarHBondContact CB-OD2 3.29Å; R179-D286 PolarHBondContact N-OD2 2.81Å; R179-D286 IonicContact NE-OD2 3.76Å; R179-D286 PolarHBondContact O-N 3.03Å; R179-F287 PolarHBondContact O-N 3.47Å; R179-F287 VanDerWaalsContact O-N 3.09Å; R179-G477 PolarHBondContact NH1-O 3.2Å
180	V	95.3	Very high	84.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	112.6	-179.3	-177.7	0	0	0	0	109.8	I261 T262 F263 I264 F287 M289 F317 F394	V180-I261 HydrophobicContact CB-CG2 4.29Å; V180-I261 HydrophobicContact CG2-CG2 3.65Å; V180-T262 PolarHBondContact N-O 3.33Å; V180-F263 HydrophobicContact CB-CD1 3.87Å; V180-F263 HydrophobicContact CB-CE1 4.09Å; V180-F263 HydrophobicContact CG1-CD1 4.15Å; V180-F263 HydrophobicContact CG1-CE1 4.21Å; V180-F263 CarbonylContact O-C 3.54Å; V180-F263 WeakPolarHBondContact O-CA 3.34Å; V180-I264 PolarHBondContact O-N 3.27Å; V180-F287 CarbonylContact C-O 3.49Å; V180-F287 WeakPolarHBondContact CA-O 3.36Å; V180-F287 HydrophobicContact CG2-CB 4.33Å; V180-F287 HydrophobicContact CG2-CD2 4.46Å; V180-M289 HydrophobicContact CG1-CB 3.85Å; V180-F317 HydrophobicContact CG1-CE1 4.12Å; V180-F317 HydrophobicContact CG1-CZ 4.07Å; V180-F394 HydrophobicContact CG1-CE1 4.48Å; V180-F394 HydrophobicContact CG2-CE1 4.2Å
181	A	95.9	Very high	85.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.8	173.3	0	0	0	0	0	111.3	L266 L280 P285 F287 A288 M289	A181-L266 HydrophobicContact CB-CD1 3.93Å; A181-L280 HydrophobicContact CB-CD2 3.56Å; A181-P285 HydrophobicContact CB-CB 3.71Å; A181-P285 HydrophobicContact CB-CG 3.72Å; A181-F287 PolarHBondContact N-O 2.93Å; A181-A288 CarbonylContact O-C 3.46Å; A181-A288 WeakPolarHBondContact O-CA 3.41Å; A181-M289 PolarHBondContact O-N 3.37Å
182	V	96.6	Very high	86.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.5	-179.4	-172.7	0	0	0	0	110.4	K190 L194 F263 I264 L266 M289 V291	V182-K190 HydrophobicContact CG1-CB 3.78Å; V182-K190 HydrophobicContact CG1-CD 4.15Å; V182-K190 HydrophobicContact CG1-CG 3.83Å; V182-L194 HydrophobicContact CB-CD1 4.3Å; V182-L194 HydrophobicContact CG1-CD1 4.47Å; V182-L194 HydrophobicContact CG2-CD1 3.87Å; V182-L194 HydrophobicContact CG2-CD2 3.92Å; V182-L194 HydrophobicContact CG2-CG 4.18Å; V182-F263 HydrophobicContact CG2-CB 4.33Å; V182-F263 HydrophobicContact CG2-CD1 4.07Å; V182-I264 PolarHBondContact N-O 3.4Å; V182-L266 WeakPolarHBondContact O-CB 3.02Å; V182-L266 PolarHBondContact O-N 2.91Å; V182-M289 HydrophobicContact CB-CE 4.29Å; V182-M289 HydrophobicContact CG1-CE 3.7Å; V182-M289 HydrophobicContact CG2-CE 3.68Å; V182-V291 HydrophobicContact CG1-CG2 3.92Å
183	L	95.3	Very high	88.4	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	151.9	-174.6	-65.4	177.9	0	0	0	111.3	L266 T276 L280 A288 M289 L290 V291 H305 A309	L183-L266 HydrophobicContact CD2-CB 4.34Å; L183-L266 HydrophobicContact CD2-CD1 3.59Å; L183-T276 HydrophobicContact CD2-CG2 3.61Å; L183-L280 HydrophobicContact CD1-CD1 4.29Å; L183-L280 HydrophobicContact CD1-CD2 4.25Å; L183-L280 HydrophobicContact CD2-CD1 4.15Å; L183-L280 HydrophobicContact CD2-CD2 4.25Å; L183-L280 HydrophobicContact CD2-CG 4.44Å; L183-A288 HydrophobicContact CD1-CB 3.96Å; L183-M289 PolarHBondContact N-O 3.32Å; L183-L290 HydrophobicContact CB-CD1 3.94Å; L183-L290 CarbonylContact O-C 3.57Å; L183-L290 WeakPolarHBondContact O-CA 3.43Å; L183-V291 PolarHBondContact O-N 3.21Å; L183-H305 HydrophobicContact CB-CB 4.11Å; L183-H305 HydrophobicContact CD1-CB 4.34Å; L183-H305 HydrophobicContact CD2-CB 4.38Å; L183-A309 HydrophobicContact CD1-CB 3.93Å
184	G	93.3	Very high	89.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.			trans	151.9	168.1	169.6	0	0	0	0	0	113.2	K190 G268 V291 H305	G184-K190 WeakPolarHBondContact O-CE 3.32Å; G184-K190 PolarHBondContact O-NZ 2.84Å; G184-G268 WeakPolarHBondContact O-CA 3.46Å; G184-V291 WeakPolarHBondContact CA-O 3.41Å; G184-H305 PolarHBondContact N-ND1 3.2Å
185	N	92.8	Very high	90.9	Very high	28 Å²	28	13.9 Å²	13.9	15%	0.15	8%	0.077	C	C	.	.			trans	-60.6	166.3	-177.2	-167.3	37.2	0	0	0	113.8	S188 K190 A299 T301 T302	N185-S188 WeakPolarHBondContact O-CB 3.23Å; N185-S188 PolarHBondContact O-N 3.3Å; N185-S188 PolarHBondContact O-OG 3.44Å; N185-K190 PolarHBondContact O-NZ 3.34Å; N185-A299 WeakPolarHBondContact CB-O 3.29Å; N185-A299 VanDerWaalsContact CG-O 3.28Å; N185-T301 WeakPolarHBondContact CA-OG1 3.23Å; N185-T301 PolarHBondContact OD1-N 3.08Å; N185-T301 PolarHBondContact OD1-OG1 2.89Å; N185-T302 WeakPolarHBondContact CB-OG1 3.49Å
186	V	89.3	Confident	91.8	Very high	27 Å²	27	13.5 Å²	13.5	16%	0.164	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	141.2	165.9	-168.5	0	0	0	0	109.4	S188 R224 H269	V186-S188 PolarHBondContact O-N 3.49Å; V186-S188 VanDerWaalsContact O-N 3.07Å; V186-R224 HydrophobicContact CG1-CG 4.44Å; V186-H269 VanDerWaalsContact CG2-CA 3.47Å; V186-H269 HydrophobicContact CG2-CB 3.67Å
187	D	87.9	Confident	92.3	Very high	92 Å²	92	12.7 Å²	12.7	49%	0.492	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	10.7	179.9	-54.4	-40.4	0	0	0	116.3	G189 K322	D187-G189 PolarHBondContact O-N 3.44Å; D187-G189 VanDerWaalsContact O-N 3.15Å; D187-K322 WeakPolarHBondContact O-CE 3.37Å; D187-K322 PolarHBondContact O-NZ 3.06Å
188	S	91.9	Very high	92.5	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.014	7%	0.066	C	C	.	.	S	Bend	trans	-70.2	-4.6	173	71.3	0	0	0	0	114.2	N185 V186 K190 V291 S321	N185-S188 WeakPolarHBondContact O-CB 3.23Å; N185-S188 PolarHBondContact O-N 3.3Å; N185-S188 PolarHBondContact O-OG 3.44Å; V186-S188 PolarHBondContact O-N 3.49Å; V186-S188 VanDerWaalsContact O-N 3.07Å; S188-K190 WeakPolarHBondContact OG-CG 3.3Å; S188-V291 WeakPolarHBondContact CB-O 3.16Å; S188-V291 WeakPolarHBondContact O-CG1 3.44Å; S188-V291 PolarHBondContact OG-O 2.91Å; S188-V291 VanDerWaalsContact OG-O 3.07Å; S188-S321 PolarHBondContact O-OG 2.85Å
189	G	90.8	Very high	92.3	Very high	13 Å²	13	15.1 Å²	15.1	13%	0.134	8%	0.082	C	C	.	.			trans	83	21.2	177.4	0	0	0	0	0	115	D187 T192 L193	D187-G189 PolarHBondContact O-N 3.44Å; D187-G189 VanDerWaalsContact O-N 3.15Å; G189-T192 PolarHBondContact O-N 2.91Å; G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.26Å; G189-L193 PolarHBondContact O-N 2.8Å
190	K	93.1	Very high	92	Very high	13 Å²	13	15.7 Å²	15.7	6%	0.057	10%	0.095	C	C	.	.	H	α-helix	trans	-50.7	-65.9	176.5	-66.6	179.2	-59.5	-61.7	0	113.3	V182 G184 N185 S188 T192 L193 L194 L266 V291	V182-K190 HydrophobicContact CG1-CB 3.78Å; V182-K190 HydrophobicContact CG1-CD 4.15Å; V182-K190 HydrophobicContact CG1-CG 3.83Å; G184-K190 WeakPolarHBondContact O-CE 3.32Å; G184-K190 PolarHBondContact O-NZ 2.84Å; N185-K190 PolarHBondContact O-NZ 3.34Å; S188-K190 WeakPolarHBondContact OG-CG 3.3Å; K190-T192 PolarHBondContact O-N 2.82Å; K190-L193 PolarHBondContact O-N 3.28Å; K190-L194 PolarHBondContact O-N 3.43Å; K190-L266 VanDerWaalsContact CE-O 3.31Å; K190-L266 WeakPolarHBondContact CE-O 3.45Å; K190-V291 HydrophobicContact CG-CB 3.89Å; K190-V291 HydrophobicContact CG-CG2 4.04Å
191	S	92.9	Very high	91.7	Very high	8 Å²	8	20.7 Å²	20.7	6%	0.056	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-28.2	-178.4	-45.1	0	0	0	0	111.8	G195 L213 T225 D265	S191-G195 PolarHBondContact O-N 2.87Å; S191-L213 WeakPolarHBondContact O-CD1 3.28Å; S191-T225 PolarHBondContact OG-OG1 3.14Å; S191-D265 WeakPolarHBondContact CB-OD2 3.45Å; S191-D265 PolarHBondContact OG-OD1 3.24Å; S191-D265 PolarHBondContact OG-OD2 2.84Å
192	T	93.4	Very high	91.5	Very high	17 Å²	17	24.2 Å²	24.2	10%	0.104	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-48.6	172.8	-55	0	0	0	0	110.9	G189 K190 L194 G195 V196 D203 A209	G189-T192 PolarHBondContact O-N 2.91Å; K190-T192 PolarHBondContact O-N 2.82Å; T192-L194 VanDerWaalsContact C-N 3.33Å; T192-L194 PolarHBondContact O-N 3.44Å; T192-G195 PolarHBondContact O-N 2.69Å; T192-V196 WeakPolarHBondContact O-CG2 3.48Å; T192-V196 PolarHBondContact O-N 3.29Å; T192-D203 HydrophobicContact CG2-CB 3.63Å; T192-D203 VanDerWaalsContact CG2-CG 3.46Å; T192-A209 HydrophobicContact CG2-CB 4.34Å
193	L	94.5	Very high	91.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-43.5	177.3	175.9	60.2	0	0	0	111.2	G189 K190 V196 L197 M289 V291 V319 L379 L387 L390	G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.26Å; G189-L193 PolarHBondContact O-N 2.8Å; K190-L193 PolarHBondContact O-N 3.28Å; L193-V196 PolarHBondContact O-N 2.97Å; L193-L197 HydrophobicContact CD1-CD1 3.99Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.41Å; L193-L197 WeakPolarHBondContact O-CB 3.37Å; L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 3.18Å; L193-M289 HydrophobicContact CD2-CE 3.96Å; L193-M289 HydrophobicContact CD2-SD 4.12Å; L193-V291 HydrophobicContact CD2-CG2 4.26Å; L193-V319 HydrophobicContact CD2-CG1 3.83Å; L193-L379 HydrophobicContact CD1-CD1 3.72Å; L193-L379 HydrophobicContact CD1-CD2 4.09Å; L193-L379 HydrophobicContact CD2-CD1 4.5Å; L193-L379 HydrophobicContact CD2-CD2 4.47Å; L193-L387 HydrophobicContact CD1-CD2 3.87Å; L193-L390 HydrophobicContact CD2-CD2 4.43Å
194	L	93.3	Very high	91.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-47.2	176	-74.3	-178.6	0	0	0	112	V182 K190 T192 V196 L197 T198 L213 F263 D265 M289	V182-L194 HydrophobicContact CB-CD1 4.3Å; V182-L194 HydrophobicContact CG1-CD1 4.47Å; V182-L194 HydrophobicContact CG2-CD1 3.87Å; V182-L194 HydrophobicContact CG2-CD2 3.92Å; V182-L194 HydrophobicContact CG2-CG 4.18Å; K190-L194 PolarHBondContact O-N 3.43Å; T192-L194 VanDerWaalsContact C-N 3.33Å; T192-L194 PolarHBondContact O-N 3.44Å; L194-V196 VanDerWaalsContact C-N 3.32Å; L194-V196 PolarHBondContact O-N 3.26Å; L194-L197 PolarHBondContact O-N 3.14Å; L194-T198 WeakPolarHBondContact O-CG2 3.13Å; L194-T198 PolarHBondContact O-N 2.86Å; L194-T198 PolarHBondContact O-OG1 3.42Å; L194-T198 VanDerWaalsContact O-OG1 3.04Å; L194-L213 HydrophobicContact CB-CD1 3.65Å; L194-F263 HydrophobicContact CD1-CB 4.33Å; L194-F263 HydrophobicContact CD2-CB 3.59Å; L194-F263 HydrophobicContact CD2-CD1 3.64Å; L194-F263 HydrophobicContact CD2-CD2 3.7Å; L194-F263 HydrophobicContact CD2-CE1 4.23Å; L194-F263 HydrophobicContact CD2-CE2 4.25Å; L194-F263 HydrophobicContact CD2-CG 3.35Å; L194-D265 HydrophobicContact CD1-CB 3.64Å; L194-M289 HydrophobicContact CD2-CE 4.45Å
195	G	91	Very high	90.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-41.9	177.9	0	0	0	0	0	112.3	S191 T192 Q199	S191-G195 PolarHBondContact O-N 2.87Å; T192-G195 PolarHBondContact O-N 2.69Å; G195-Q199 WeakPolarHBondContact O-CB 3.42Å; G195-Q199 VanDerWaalsContact O-CG 3.32Å; G195-Q199 WeakPolarHBondContact O-CG 3.49Å; G195-Q199 PolarHBondContact O-N 3.48Å
196	V	92.9	Very high	90.5	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-42.6	175.8	175.6	0	0	0	0	111.6	T192 L193 L194 G200 E201 L202 D203 A209 L387	T192-V196 WeakPolarHBondContact O-CG2 3.48Å; T192-V196 PolarHBondContact O-N 3.29Å; L193-V196 PolarHBondContact O-N 2.97Å; L194-V196 VanDerWaalsContact C-N 3.32Å; L194-V196 PolarHBondContact O-N 3.26Å; V196-G200 WeakPolarHBondContact O-CA 3.48Å; V196-G200 PolarHBondContact O-N 3.43Å; V196-E201 WeakPolarHBondContact CA-O 3.13Å; V196-E201 WeakPolarHBondContact CG2-O 3.38Å; V196-L202 HydrophobicContact CG1-CD2 4.03Å; V196-D203 HydrophobicContact CG2-CB 4.12Å; V196-A209 HydrophobicContact CG2-CB 3.81Å; V196-L387 HydrophobicContact CG1-CD1 3.69Å
197	L	92.3	Very high	90.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-39.5	-179.9	-74.7	173.6	0	0	0	112.5	L193 L194 L233 Y244 F263 L390 K391 F394	L193-L197 HydrophobicContact CD1-CD1 3.99Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CG-CD1 3.94Å; L193-L197 HydrophobicContact CG-CG 4.41Å; L193-L197 WeakPolarHBondContact O-CB 3.37Å; L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 3.18Å; L194-L197 PolarHBondContact O-N 3.14Å; L197-L233 WeakPolarHBondContact O-CD1 3.36Å; L197-Y244 WeakPolarHBondContact O-CE1 3.21Å; L197-Y244 PolarHBondContact O-OH 3.31Å; L197-F263 HydrophobicContact CD1-CZ 4.38Å; L197-L390 HydrophobicContact CD1-CD2 4.1Å; L197-K391 HydrophobicContact CD2-CG 4.33Å; L197-F394 HydrophobicContact CD1-CE2 4.18Å
198	T	89.4	Confident	90.3	Very high	12 Å²	12	40 Å²	40	7%	0.074	21%	0.21	C	C	.	.	H	α-helix	trans	-86.7	-29	-174.5	62.1	0	0	0	0	113.2	L194 E231 N243 F263	L194-T198 WeakPolarHBondContact O-CG2 3.13Å; L194-T198 PolarHBondContact O-N 2.86Å; L194-T198 PolarHBondContact O-OG1 3.42Å; L194-T198 VanDerWaalsContact O-OG1 3.04Å; T198-E231 HydrophobicContact CG2-CB 3.8Å; T198-N243 VanDerWaalsContact O-CB 3.31Å; T198-N243 WeakPolarHBondContact O-CB 3.44Å; T198-N243 PolarHBondContact O-ND2 2.8Å; T198-F263 HydrophobicContact CG2-CD2 4.4Å
199	Q	85.6	Confident	90.2	Very high	74 Å²	74	40.1 Å²	40.1	35%	0.346	21%	0.21	S	C	.	.	H	α-helix	trans	-101.4	-20.8	-177.6	-55.6	-172.7	-41.3	0	0	113.7	G195 E201 N212	G195-Q199 WeakPolarHBondContact O-CB 3.42Å; G195-Q199 VanDerWaalsContact O-CG 3.32Å; G195-Q199 WeakPolarHBondContact O-CG 3.49Å; G195-Q199 PolarHBondContact O-N 3.48Å; Q199-E201 PolarHBondContact O-N 3.36Å; Q199-N212 VanDerWaalsContact CD-ND2 3.3Å; Q199-N212 VanDerWaalsContact NE2-CG 3.33Å; Q199-N212 PolarHBondContact NE2-ND2 3.25Å; Q199-N212 PolarHBondContact OE1-ND2 2.76Å
200	G	84.5	Confident	90	Very high	36 Å²	36	42.4 Å²	42.4	37%	0.371	22%	0.215	S	C	.	.			trans	81	-5.1	178.7	0	0	0	0	0	114.8	V196	V196-G200 WeakPolarHBondContact O-CA 3.48Å; V196-G200 PolarHBondContact O-N 3.43Å
201	E	88.9	Confident	89.7	Confident	107 Å²	107	45.9 Å²	45.9	50%	0.5	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-89.6	136.5	173.4	-68.4	-167	-162.3	0	0	111.8	V196 Q199 R208	V196-E201 WeakPolarHBondContact CA-O 3.13Å; V196-E201 WeakPolarHBondContact CG2-O 3.38Å; Q199-E201 PolarHBondContact O-N 3.36Å; E201-R208 IonicContact OE2-CZ 2.56Å; E201-R208 VanDerWaalsContact OE2-CZ 3.28Å; E201-R208 IonicContact OE2-NH1 3.45Å; E201-R208 PolarHBondContact OE2-NH1 3.5Å; E201-R208 IonicContact OE2-NH2 2.69Å; E201-R208 PolarHBondContact OE2-NH2 3.18Å
202	L	92.3	Very high	89.2	Confident	75 Å²	75	50.3 Å²	50.3	39%	0.393	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-68.5	150.9	172.3	-61	178	0	0	0	111.5	V196 R208 L387	V196-L202 HydrophobicContact CG1-CD2 4.03Å; L202-R208 PolarHBondContact O-NH2 3.33Å; L202-L387 HydrophobicContact CD2-CD1 3.8Å
203	D	92.8	Very high	88.9	Confident	11 Å²	11	49.8 Å²	49.8	6%	0.059	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-74.6	144.1	175.3	-168.3	55	0	0	0	110.6	T192 V196 G205 G207 R208 A209 S381 V382	T192-D203 HydrophobicContact CG2-CB 3.63Å; T192-D203 VanDerWaalsContact CG2-CG 3.46Å; V196-D203 HydrophobicContact CG2-CB 4.12Å; D203-G205 PolarHBondContact O-N 2.99Å; D203-G205 WeakPolarHBondContact OD2-CA 3.47Å; D203-G205 PolarHBondContact OD2-N 2.94Å; D203-G205 VanDerWaalsContact OD2-N 3.17Å; D203-G207 VanDerWaalsContact OD1-C 3.24Å; D203-G207 WeakPolarHBondContact OD1-CA 3.38Å; D203-G207 PolarHBondContact OD1-N 2.73Å; D203-G207 WeakPolarHBondContact OD2-CA 3.39Å; D203-G207 PolarHBondContact OD2-N 3.32Å; D203-R208 PolarHBondContact OD1-N 2.98Å; D203-A209 HydrophobicContact CB-CB 4.15Å; D203-A209 PolarHBondContact OD1-N 2.87Å; D203-S381 PolarHBondContact N-O 3.07Å; D203-V382 HydrophobicContact CB-CG2 4.48Å
204	N	91.9	Very high	88.5	Confident	83 Å²	83	50.8 Å²	50.8	44%	0.444	26%	0.258	S	S	.	.			trans	-82.4	14.1	178.2	67.9	-9.2	0	0	0	113.4	R206 G207 R208	N204-R206 PolarHBondContact O-N 3.48Å; N204-R206 VanDerWaalsContact O-N 3.14Å; N204-R206 WeakPolarHBondContact OD1-CA 3.48Å; N204-R206 WeakPolarHBondContact OD1-CB 3.47Å; N204-R206 PolarHBondContact OD1-N 2.71Å; N204-G207 PolarHBondContact OD1-N 3.45Å; N204-R208 HydrophobicContact CB-CB 4.45Å; N204-R208 WeakPolarHBondContact OD1-CB 3.32Å; N204-R208 PolarHBondContact OD1-N 2.73Å
205	G	86.8	Confident	88	Confident	52 Å²	52	56.2 Å²	56.2	54%	0.536	28%	0.278	S	S	.	.	S	Bend	trans	72.2	-3.5	-173.8	0	0	0	0	0	114.7	D203	D203-G205 PolarHBondContact O-N 2.99Å; D203-G205 WeakPolarHBondContact OD2-CA 3.47Å; D203-G205 PolarHBondContact OD2-N 2.94Å; D203-G205 VanDerWaalsContact OD2-N 3.17Å
206	R	85.7	Confident	87.7	Confident	217 Å²	217	60.2 Å²	60.2	82%	0.819	30%	0.297	S	S	*	.	S	Bend	trans	-108	6.2	175.9	-60.8	-174.3	178.1	-176.3	0	112.4	N204	N204-R206 PolarHBondContact O-N 3.48Å; N204-R206 VanDerWaalsContact O-N 3.14Å; N204-R206 WeakPolarHBondContact OD1-CA 3.48Å; N204-R206 WeakPolarHBondContact OD1-CB 3.47Å; N204-R206 PolarHBondContact OD1-N 2.71Å
207	G	84.1	Confident	87.3	Confident	5 Å²	5	65.6 Å²	65.6	5%	0.052	33%	0.325	C	S	.	.	S	Bend	trans	75.8	37	179.6	0	0	0	0	0	113.2	D203 N204 A209 R210	D203-G207 VanDerWaalsContact OD1-C 3.24Å; D203-G207 WeakPolarHBondContact OD1-CA 3.38Å; D203-G207 PolarHBondContact OD1-N 2.73Å; D203-G207 WeakPolarHBondContact OD2-CA 3.39Å; D203-G207 PolarHBondContact OD2-N 3.32Å; N204-G207 PolarHBondContact OD1-N 3.45Å; G207-A209 VanDerWaalsContact C-N 3.3Å; G207-R210 WeakPolarHBondContact O-CG 3.3Å
208	R	88.9	Confident	87	Confident	111 Å²	111	69.3 Å²	69.3	42%	0.419	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-42.8	169.3	-180	176.3	69.9	138.2	13.7	111.1	E201 L202 D203 N204 R210 L211	E201-R208 IonicContact OE2-CZ 2.56Å; E201-R208 VanDerWaalsContact OE2-CZ 3.28Å; E201-R208 IonicContact OE2-NH1 3.45Å; E201-R208 PolarHBondContact OE2-NH1 3.5Å; E201-R208 IonicContact OE2-NH2 2.69Å; E201-R208 PolarHBondContact OE2-NH2 3.18Å; L202-R208 PolarHBondContact O-NH2 3.33Å; D203-R208 PolarHBondContact OD1-N 2.98Å; N204-R208 HydrophobicContact CB-CB 4.45Å; N204-R208 WeakPolarHBondContact OD1-CB 3.32Å; N204-R208 PolarHBondContact OD1-N 2.73Å; R208-R210 VanDerWaalsContact C-N 3.32Å; R208-R210 PolarHBondContact O-N 3.4Å; R208-L211 WeakPolarHBondContact O-CB 3.18Å; R208-L211 PolarHBondContact O-N 3.01Å
209	A	88.4	Confident	86.9	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-36.4	-176.1	0	0	0	0	0	112.8	T192 V196 D203 G207 L211	T192-A209 HydrophobicContact CG2-CB 4.34Å; V196-A209 HydrophobicContact CG2-CB 3.81Å; D203-A209 HydrophobicContact CB-CB 4.15Å; D203-A209 PolarHBondContact OD1-N 2.87Å; G207-A209 VanDerWaalsContact C-N 3.3Å; A209-L211 PolarHBondContact O-N 3.07Å
210	R	87.5	Confident	86.9	Confident	61 Å²	61	69.5 Å²	69.5	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-75.5	-20	179.9	62.2	171.8	-176.9	-172.1	-2.5	114.2	G207 R208 N212 L213 F214 G223	G207-R210 WeakPolarHBondContact O-CG 3.3Å; R208-R210 VanDerWaalsContact C-N 3.32Å; R208-R210 PolarHBondContact O-N 3.4Å; R210-N212 PolarHBondContact O-N 2.9Å; R210-L213 PolarHBondContact O-N 3.38Å; R210-F214 HydrophobicContact CB-CZ 4.45Å; R210-F214 HydrophobicContact CG-CE2 4.31Å; R210-F214 HydrophobicContact CG-CZ 4.21Å; R210-F214 PolarHBondContact O-N 2.81Å; R210-G223 PolarHBondContact NH1-O 3.35Å; R210-G223 VanDerWaalsContact NH1-O 3.08Å
211	L	86.9	Confident	87	Confident	87 Å²	87	74.5 Å²	74.5	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-62.2	-32	180	-71.1	174.6	0	0	0	111.4	R208 A209 L213 F214 I220	R208-L211 WeakPolarHBondContact O-CB 3.18Å; R208-L211 PolarHBondContact O-N 3.01Å; A209-L211 PolarHBondContact O-N 3.07Å; L211-L213 PolarHBondContact O-N 2.92Å; L211-F214 HydrophobicContact CD2-CD2 4.12Å; L211-F214 HydrophobicContact CD2-CE2 4.34Å; L211-F214 PolarHBondContact O-N 2.83Å; L211-I220 HydrophobicContact CD2-CG2 4.41Å
212	N	83.2	Confident	86.8	Confident	100 Å²	100	73.1 Å²	73.1	54%	0.535	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.7	178.4	-63.2	-30.7	0	0	0	113.4	Q199 R210	Q199-N212 VanDerWaalsContact CD-ND2 3.3Å; Q199-N212 VanDerWaalsContact NE2-CG 3.33Å; Q199-N212 PolarHBondContact NE2-ND2 3.25Å; Q199-N212 PolarHBondContact OE1-ND2 2.76Å; R210-N212 PolarHBondContact O-N 2.9Å
213	L	85.4	Confident	86.3	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.037	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-19.1	178.9	-55.9	-169.6	0	0	0	113.1	S191 L194 R210 L211 R215 E231	S191-L213 WeakPolarHBondContact O-CD1 3.28Å; L194-L213 HydrophobicContact CB-CD1 3.65Å; R210-L213 PolarHBondContact O-N 3.38Å; L211-L213 PolarHBondContact O-N 2.92Å; L213-R215 PolarHBondContact O-N 3.2Å; L213-E231 HydrophobicContact CD1-CG 4.42Å; L213-E231 HydrophobicContact CD2-CG 3.66Å; L213-E231 WeakPolarHBondContact CD2-OE1 3.37Å
214	F	86	Confident	86	Confident	20 Å²	20	74.7 Å²	74.7	9%	0.088	36%	0.361	C	S	.	.			trans	-72.9	130.8	-177.2	-69.7	-25.4	0	0	0	111.3	R210 L211 E219 I220	R210-F214 HydrophobicContact CB-CZ 4.45Å; R210-F214 HydrophobicContact CG-CE2 4.31Å; R210-F214 HydrophobicContact CG-CZ 4.21Å; R210-F214 PolarHBondContact O-N 2.81Å; L211-F214 HydrophobicContact CD2-CD2 4.12Å; L211-F214 HydrophobicContact CD2-CE2 4.34Å; L211-F214 PolarHBondContact O-N 2.83Å; F214-E219 HydrophobicContact CB-CB 3.93Å; F214-E219 HydrophobicContact CD1-CB 3.76Å; F214-E219 HydrophobicContact CD2-CB 4.29Å; F214-E219 HydrophobicContact CE1-CB 4.31Å; F214-E219 WeakPolarHBondContact CE2-O 3.09Å; F214-E219 HydrophobicContact CG-CB 3.75Å; F214-I220 HydrophobicContact CB-CG1 3.88Å; F214-I220 HydrophobicContact CD2-CG1 4.19Å
215	R	82.9	Confident	85.7	Confident	114 Å²	114	71.4 Å²	71.4	43%	0.43	34%	0.344	S	S	.	.			trans	-103.9	-24.1	-176.3	-65.5	-178.8	177.8	-178.5	-3.4	112.6	L213 E219 I228 S229	L213-R215 PolarHBondContact O-N 3.2Å; R215-E219 PolarHBondContact N-OE2 2.86Å; R215-I228 PolarHBondContact NH1-O 3.31Å; R215-S229 VanDerWaalsContact CZ-CB 3.46Å
216	H	85.3	Confident	85.6	Confident	84 Å²	84	69.5 Å²	69.5	39%	0.389	32%	0.323	S	S	.	.	S	Bend	trans	-118.5	147.6	-175.4	-55.4	-63.2	0	0	0	112.4	H218 E219 I220	H216-H218 VanDerWaalsContact C-N 3.27Å; H216-H218 WeakPolarHBondContact CB-CE1 3.3Å; H216-H218 AromaticContact CD2-CE1 3.9Å; H216-H218 AromaticContact CG-CE1 3.65Å; H216-H218 PolarHBondContact O-N 2.85Å; H216-E219 HydrophobicContact CB-CG 4.09Å; H216-E219 IonicContact CD2-OE1 3.23Å; H216-E219 PolarHBondContact N-OE2 3.2Å; H216-E219 WeakPolarHBondContact O-CB 3.29Å; H216-E219 PolarHBondContact O-N 3.32Å; H216-I220 PolarHBondContact O-N 2.98Å
217	L	84.5	Confident	85.6	Confident	118 Å²	118	60.2 Å²	60.2	62%	0.618	29%	0.291	S	S	*	.	H	α-helix	trans	-56.3	-39.7	-179.2	-177.7	61.4	0	0	0	112.7	E219 I220 Q221	L217-E219 VanDerWaalsContact C-N 3.29Å; L217-E219 PolarHBondContact O-N 2.98Å; L217-I220 WeakPolarHBondContact O-CB 3.49Å; L217-I220 PolarHBondContact O-N 3.04Å; L217-Q221 HydrophobicContact CD1-CG 4.47Å; L217-Q221 HydrophobicContact CG-CG 4.45Å; L217-Q221 WeakPolarHBondContact O-CG 3.22Å; L217-Q221 PolarHBondContact O-N 2.87Å
218	H	85.3	Confident	85.8	Confident	77 Å²	77	61 Å²	61	36%	0.356	29%	0.294	S	S	.	.	H	α-helix	trans	-69.3	-25.6	177.8	63.4	-88.9	0	0	0	112.9	H216 T222 S226	H216-H218 VanDerWaalsContact C-N 3.27Å; H216-H218 WeakPolarHBondContact CB-CE1 3.3Å; H216-H218 AromaticContact CD2-CE1 3.9Å; H216-H218 AromaticContact CG-CE1 3.65Å; H216-H218 PolarHBondContact O-N 2.85Å; H218-T222 VanDerWaalsContact O-CB 3.29Å; H218-T222 WeakPolarHBondContact O-CB 3.39Å; H218-T222 VanDerWaalsContact O-CG2 3.29Å; H218-T222 WeakPolarHBondContact O-CG2 3.5Å; H218-T222 PolarHBondContact O-N 3.39Å; H218-T222 PolarHBondContact O-OG1 2.74Å; H218-S226 PolarHBondContact NE2-OG 2.87Å
219	E	88.1	Confident	85.7	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-68.7	-40.8	173.3	-61.2	-178.8	156.4	0	0	110.1	F214 R215 H216 L217 G223 R224 S226 S227	F214-E219 HydrophobicContact CB-CB 3.93Å; F214-E219 HydrophobicContact CD1-CB 3.76Å; F214-E219 HydrophobicContact CD2-CB 4.29Å; F214-E219 HydrophobicContact CE1-CB 4.31Å; F214-E219 WeakPolarHBondContact CE2-O 3.09Å; F214-E219 HydrophobicContact CG-CB 3.75Å; R215-E219 PolarHBondContact N-OE2 2.86Å; H216-E219 HydrophobicContact CB-CG 4.09Å; H216-E219 IonicContact CD2-OE1 3.23Å; H216-E219 PolarHBondContact N-OE2 3.2Å; H216-E219 WeakPolarHBondContact O-CB 3.29Å; H216-E219 PolarHBondContact O-N 3.32Å; L217-E219 VanDerWaalsContact C-N 3.29Å; L217-E219 PolarHBondContact O-N 2.98Å; E219-G223 CarbonylContact O-C 3.55Å; E219-G223 WeakPolarHBondContact O-CA 3.36Å; E219-G223 PolarHBondContact O-N 2.88Å; E219-R224 WeakPolarHBondContact CA-O 3.4Å; E219-R224 WeakPolarHBondContact CB-O 3.48Å; E219-R224 WeakPolarHBondContact CG-O 3.45Å; E219-R224 PolarHBondContact O-N 2.88Å; E219-S226 WeakPolarHBondContact CG-OG 3.34Å; E219-S226 WeakPolarHBondContact OE1-CA 3.43Å; E219-S226 WeakPolarHBondContact OE1-CB 3.31Å; E219-S226 PolarHBondContact OE1-N 3.18Å; E219-S226 PolarHBondContact OE1-OG 2.96Å; E219-S227 PolarHBondContact OE1-N 2.86Å; E219-S227 PolarHBondContact OE1-OG 2.98Å; E219-S227 VanDerWaalsContact OE1-OG 3.05Å
220	I	86.2	Confident	85.7	Confident	89 Å²	89	58.4 Å²	58.4	46%	0.456	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-47.9	174.7	-58.5	170.6	0	0	0	110.6	L211 F214 H216 L217	L211-I220 HydrophobicContact CD2-CG2 4.41Å; F214-I220 HydrophobicContact CB-CG1 3.88Å; F214-I220 HydrophobicContact CD2-CG1 4.19Å; H216-I220 PolarHBondContact O-N 2.98Å; L217-I220 WeakPolarHBondContact O-CB 3.49Å; L217-I220 PolarHBondContact O-N 3.04Å
221	Q	85.8	Confident	85.8	Confident	142 Å²	142	57.4 Å²	57.4	66%	0.664	28%	0.283	S	S	*	.	H	α-helix	trans	-66.8	-40.9	-178.5	-71.2	173.2	-18.3	0	0	113.1	L217	L217-Q221 HydrophobicContact CD1-CG 4.47Å; L217-Q221 HydrophobicContact CG-CG 4.45Å; L217-Q221 WeakPolarHBondContact O-CG 3.22Å; L217-Q221 PolarHBondContact O-N 2.87Å
222	T	85.1	Confident	86	Confident	77 Å²	77	54.3 Å²	54.3	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-90.9	-14.9	-177.2	64.3	0	0	0	0	113.4	H218 R224	H218-T222 VanDerWaalsContact O-CB 3.29Å; H218-T222 WeakPolarHBondContact O-CB 3.39Å; H218-T222 VanDerWaalsContact O-CG2 3.29Å; H218-T222 WeakPolarHBondContact O-CG2 3.5Å; H218-T222 PolarHBondContact O-N 3.39Å; H218-T222 PolarHBondContact O-OG1 2.74Å; T222-R224 PolarHBondContact O-N 3.04Å; T222-R224 PolarHBondContact OG1-N 3.29Å
223	G	82.8	Confident	86.4	Confident	14 Å²	14	49.5 Å²	49.5	14%	0.144	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	21.6	-171.9	0	0	0	0	0	113.9	R210 E219	R210-G223 PolarHBondContact NH1-O 3.35Å; R210-G223 VanDerWaalsContact NH1-O 3.08Å; E219-G223 CarbonylContact O-C 3.55Å; E219-G223 WeakPolarHBondContact O-CA 3.36Å; E219-G223 PolarHBondContact O-N 2.88Å
224	R	84.9	Confident	86.7	Confident	105 Å²	105	49.2 Å²	49.2	40%	0.396	24%	0.239	S	C	.	.			trans	-126.4	126.9	-172.4	-65.6	174.3	177.7	173.9	0.9	112.1	V186 E219 T222	V186-R224 HydrophobicContact CG1-CG 4.44Å; E219-R224 WeakPolarHBondContact CA-O 3.4Å; E219-R224 WeakPolarHBondContact CB-O 3.48Å; E219-R224 WeakPolarHBondContact CG-O 3.45Å; E219-R224 PolarHBondContact O-N 2.88Å; T222-R224 PolarHBondContact O-N 3.04Å; T222-R224 PolarHBondContact OG1-N 3.29Å
225	T	85.4	Confident	87	Confident	14 Å²	14	48.3 Å²	48.3	9%	0.086	24%	0.235	C	C	.	.			trans	-64	133.3	171.3	-38.7	0	0	0	0	111.1	S191 S227 A267	S191-T225 PolarHBondContact OG-OG1 3.14Å; T225-S227 WeakPolarHBondContact CG2-O 3.17Å; T225-A267 WeakPolarHBondContact O-CB 3.02Å
226	S	86.4	Confident	87.2	Confident	13 Å²	13	44.4 Å²	44.4	9%	0.091	22%	0.223	C	C	.	.			trans	-127.3	-24.1	-177.2	70.5	0	0	0	0	113.4	H218 E219	H218-S226 PolarHBondContact NE2-OG 2.87Å; E219-S226 WeakPolarHBondContact CG-OG 3.34Å; E219-S226 WeakPolarHBondContact OE1-CA 3.43Å; E219-S226 WeakPolarHBondContact OE1-CB 3.31Å; E219-S226 PolarHBondContact OE1-N 3.18Å; E219-S226 PolarHBondContact OE1-OG 2.96Å
227	S	85.8	Confident	87.2	Confident	21 Å²	21	41.2 Å²	41.2	15%	0.147	21%	0.21	C	C	.	.	S	Bend	trans	-108.3	165.2	179.9	62.5	0	0	0	0	111.2	E219 T225	E219-S227 PolarHBondContact OE1-N 2.86Å; E219-S227 PolarHBondContact OE1-OG 2.98Å; E219-S227 VanDerWaalsContact OE1-OG 3.05Å; T225-S227 WeakPolarHBondContact CG2-O 3.17Å
228	I	88.3	Confident	87.3	Confident	22 Å²	22	41.5 Å²	41.5	11%	0.113	21%	0.206	C	C	.	.			trans	-83.5	127.1	169.2	-55.6	178	0	0	0	106.9	R215 F230 I264 L266 T275 F278 Y283	R215-I228 PolarHBondContact NH1-O 3.31Å; I228-F230 HydrophobicContact CG2-CE2 4.22Å; I228-F230 HydrophobicContact CG2-CZ 3.99Å; I228-I264 HydrophobicContact CG2-CG2 3.51Å; I228-L266 HydrophobicContact CD1-CD2 4.37Å; I228-L266 HydrophobicContact CG1-CD2 4.13Å; I228-L266 HydrophobicContact CG2-CD2 4.25Å; I228-T275 HydrophobicContact CD1-CG2 4Å; I228-T275 HydrophobicContact CG1-CG2 3.4Å; I228-F278 HydrophobicContact CD1-CD1 3.81Å; I228-Y283 HydrophobicContact CD1-CD2 4.41Å; I228-Y283 HydrophobicContact CD1-CE2 3.94Å; I228-Y283 HydrophobicContact CG2-CE2 4.45Å
229	S	86	Confident	87.2	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.007	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156	169	62.2	0	0	0	0	110.9	R215 D265	R215-S229 VanDerWaalsContact CZ-CB 3.46Å; S229-D265 PolarHBondContact N-O 3.18Å; S229-D265 PolarHBondContact O-N 3.27Å; S229-D265 VanDerWaalsContact OG-CB 3.26Å; S229-D265 WeakPolarHBondContact OG-CB 3.48Å
230	F	87.4	Confident	87.2	Confident	60 Å²	60	44.5 Å²	44.5	26%	0.263	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.4	177.9	-64.6	-77.8	0	0	0	108	I228 T262 F263 I264 Y283	I228-F230 HydrophobicContact CG2-CE2 4.22Å; I228-F230 HydrophobicContact CG2-CZ 3.99Å; F230-T262 HydrophobicContact CD1-CG2 4.09Å; F230-F263 VanDerWaalsContact CA-O 3.3Å; F230-F263 WeakPolarHBondContact CA-O 3.5Å; F230-I264 HydrophobicContact CD1-CG1 4.2Å; F230-I264 HydrophobicContact CE1-CB 4.33Å; F230-I264 HydrophobicContact CE1-CD1 4.24Å; F230-I264 HydrophobicContact CE1-CG1 3.87Å; F230-I264 HydrophobicContact CE1-CG2 3.92Å; F230-I264 HydrophobicContact CZ-CG2 4.42Å; F230-Y283 HydrophobicContact CE1-CD1 4.01Å; F230-Y283 HydrophobicContact CE1-CE1 4.19Å; F230-Y283 HydrophobicContact CE1-CG 4.27Å; F230-Y283 AromaticContact CE2-CE1 3.99Å; F230-Y283 HydrophobicContact CE2-CE1 3.99Å; F230-Y283 AromaticContact CE2-CZ 3.96Å; F230-Y283 AromaticContact CZ-CD1 3.57Å; F230-Y283 HydrophobicContact CZ-CD1 3.57Å; F230-Y283 HydrophobicContact CZ-CD2 4.11Å; F230-Y283 AromaticContact CZ-CE1 3.32Å; F230-Y283 HydrophobicContact CZ-CE1 3.32Å; F230-Y283 AromaticContact CZ-CE2 3.87Å; F230-Y283 HydrophobicContact CZ-CE2 3.87Å; F230-Y283 AromaticContact CZ-CG 3.95Å; F230-Y283 HydrophobicContact CZ-CG 3.95Å; F230-Y283 AromaticContact CZ-CZ 3.46Å; F230-Y283 VanDerWaalsContact CZ-CZ 3.46Å
231	E	89.8	Confident	87.4	Confident	40 Å²	40	41.7 Å²	41.7	19%	0.187	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.1	176.2	-63.9	-56.2	142.4	0	0	109.1	T198 L213 T262 F263	T198-E231 HydrophobicContact CG2-CB 3.8Å; L213-E231 HydrophobicContact CD1-CG 4.42Å; L213-E231 HydrophobicContact CD2-CG 3.66Å; L213-E231 WeakPolarHBondContact CD2-OE1 3.37Å; E231-T262 CarbonylContact O-C 3.58Å; E231-F263 HydrophobicContact CB-CB 4.3Å; E231-F263 PolarHBondContact N-O 3.41Å; E231-F263 PolarHBondContact O-N 2.89Å
232	I	90.8	Very high	87.5	Confident	21 Å²	21	35.4 Å²	35.4	11%	0.108	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140	-173	59.6	177	0	0	0	111.4	N243 A250 I253 M260 I261	I232-N243 PolarHBondContact O-ND2 3.22Å; I232-A250 HydrophobicContact CD1-CB 3.71Å; I232-I253 HydrophobicContact CD1-CB 4.13Å; I232-I253 HydrophobicContact CD1-CD1 4.1Å; I232-I253 HydrophobicContact CD1-CG2 3.99Å; I232-I253 HydrophobicContact CG1-CD1 4.31Å; I232-I253 HydrophobicContact CG1-CG2 4.42Å; I232-M260 HydrophobicContact CB-CE 3.62Å; I232-M260 HydrophobicContact CD1-CE 3.9Å; I232-M260 HydrophobicContact CG1-CE 4.19Å; I232-M260 HydrophobicContact CG2-CE 4.02Å; I232-I261 WeakPolarHBondContact CA-O 3.15Å
233	L	92.4	Very high	87.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	115.6	171.4	176.9	69	0	0	0	109	L197 F235 V241 I261 F263 F394	L197-L233 WeakPolarHBondContact O-CD1 3.36Å; L233-F235 HydrophobicContact CD2-CE2 3.92Å; L233-F235 HydrophobicContact CD2-CZ 3.82Å; L233-F235 HydrophobicContact CG-CE2 4.03Å; L233-F235 HydrophobicContact CG-CZ 4.2Å; L233-V241 HydrophobicContact CD1-CG1 3.49Å; L233-V241 VanDerWaalsContact CD1-CG1 3.49Å; L233-V241 HydrophobicContact CD1-CG2 4.31Å; L233-I261 HydrophobicContact CB-CB 4.36Å; L233-I261 PolarHBondContact N-O 3.01Å; L233-I261 PolarHBondContact O-N 3.09Å; L233-F263 HydrophobicContact CB-CE2 3.71Å; L233-F263 HydrophobicContact CD2-CE2 4.15Å; L233-F263 HydrophobicContact CD2-CZ 4.29Å; L233-F394 HydrophobicContact CD2-CD2 4.39Å
234	G	91.7	Very high	87.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	143.6	-179.5	0	0	0	0	0	113.1	V241 V242 N243 K259 M260	G234-V241 WeakPolarHBondContact O-CA 3.36Å; G234-V242 PolarHBondContact O-N 2.88Å; G234-N243 PolarHBondContact N-OD1 3.34Å; G234-K259 CarbonylContact C-O 3.57Å; G234-K259 WeakPolarHBondContact CA-O 3.19Å; G234-M260 WeakPolarHBondContact CA-SD 3.44Å
235	F	91.4	Very high	86.6	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.3	171.3	-63.1	-87.2	0	0	0	109.6	L233 E240 V241 A257 S258 K259 I261 F394 N395	L233-F235 HydrophobicContact CD2-CE2 3.92Å; L233-F235 HydrophobicContact CD2-CZ 3.82Å; L233-F235 HydrophobicContact CG-CE2 4.03Å; L233-F235 HydrophobicContact CG-CZ 4.2Å; F235-E240 VanDerWaalsContact CA-O 3.3Å; F235-E240 WeakPolarHBondContact CA-O 3.41Å; F235-V241 HydrophobicContact CD1-CG2 4.08Å; F235-V241 HydrophobicContact CE1-CG2 3.65Å; F235-V241 HydrophobicContact CZ-CG2 4.34Å; F235-A257 CarbonylContact O-C 3.56Å; F235-A257 WeakPolarHBondContact O-CA 3.27Å; F235-S258 PolarHBondContact O-N 2.79Å; F235-K259 HydrophobicContact CB-CB 4.37Å; F235-K259 PolarHBondContact N-O 2.88Å; F235-K259 PolarHBondContact O-N 2.88Å; F235-K259 VanDerWaalsContact O-N 3.11Å; F235-I261 HydrophobicContact CD2-CG1 4.47Å; F235-I261 HydrophobicContact CE2-CG1 3.92Å; F235-F394 HydrophobicContact CE2-CB 3.93Å; F235-F394 HydrophobicContact CZ-CB 3.83Å; F235-N395 HydrophobicContact CD1-CB 3.88Å; F235-N395 HydrophobicContact CE1-CB 3.79Å; F235-N395 HydrophobicContact CG-CB 4.35Å; F235-N395 HydrophobicContact CZ-CB 4.19Å
236	N	88.9	Confident	85.2	Confident	32 Å²	32	41.4 Å²	41.4	17%	0.171	21%	0.209	C	C	.	.			trans	-73.5	179.5	172.3	69.4	10.8	0	0	0	111.2	R167 K238 G239 E240 V242	R167-N236 PolarHBondContact NH1-O 3.05Å; N236-K238 PolarHBondContact O-N 3.03Å; N236-K238 WeakPolarHBondContact OD1-CA 3.4Å; N236-K238 WeakPolarHBondContact OD1-CB 3.48Å; N236-K238 PolarHBondContact OD1-N 3.05Å; N236-G239 PolarHBondContact O-N 3.35Å; N236-G239 VanDerWaalsContact O-N 3.09Å; N236-G239 PolarHBondContact OD1-N 3.23Å; N236-E240 PolarHBondContact N-O 2.76Å; N236-E240 PolarHBondContact ND2-OE2 2.85Å; N236-E240 PolarHBondContact OD1-N 3.19Å; N236-V242 HydrophobicContact CB-CG1 3.81Å
237	S	85.3	Confident	83.8	Confident	17 Å²	17	46.5 Å²	46.5	12%	0.119	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.2	178.2	57.1	0	0	0	0	113.5	D142 S258	D142-S237 WeakPolarHBondContact OD2-CB 3.39Å; D142-S237 PolarHBondContact OD2-OG 3.01Å; S237-S258 WeakPolarHBondContact CA-OG 3.36Å; S237-S258 PolarHBondContact N-OG 2.92Å; S237-S258 VanDerWaalsContact N-OG 3.09Å
238	K	84.8	Confident	83	Confident	124 Å²	124	49.9 Å²	49.9	54%	0.539	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.9	177.6	-60.6	-178.5	-179.7	177.8	0	114.2	A144 N236	A144-K238 WeakPolarHBondContact CB-O 3.5Å; N236-K238 PolarHBondContact O-N 3.03Å; N236-K238 WeakPolarHBondContact OD1-CA 3.4Å; N236-K238 WeakPolarHBondContact OD1-CB 3.48Å; N236-K238 PolarHBondContact OD1-N 3.05Å
239	G	84.4	Confident	82.6	Confident	19 Å²	19	52 Å²	52	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	87.9	12.5	-179.7	0	0	0	0	0	115.5	N236 N395	N236-G239 PolarHBondContact O-N 3.35Å; N236-G239 VanDerWaalsContact O-N 3.09Å; N236-G239 PolarHBondContact OD1-N 3.23Å; G239-N395 WeakPolarHBondContact CA-OD1 3.45Å
240	E	88.2	Confident	82.2	Confident	122 Å²	122	53.1 Å²	53.1	57%	0.57	28%	0.277	S	S	*	.			trans	-85.5	147.5	173.9	-55.1	166.6	145.9	0	0	110.5	F235 N236	F235-E240 VanDerWaalsContact CA-O 3.3Å; F235-E240 WeakPolarHBondContact CA-O 3.41Å; N236-E240 PolarHBondContact N-O 2.76Å; N236-E240 PolarHBondContact ND2-OE2 2.85Å; N236-E240 PolarHBondContact OD1-N 3.19Å
241	V	89.8	Confident	81.9	Confident	31 Å²	31	54.8 Å²	54.8	19%	0.188	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-74.6	126.7	178.3	177.7	0	0	0	0	110.3	L233 G234 F235 N243 Y244 K391	L233-V241 HydrophobicContact CD1-CG1 3.49Å; L233-V241 VanDerWaalsContact CD1-CG1 3.49Å; L233-V241 HydrophobicContact CD1-CG2 4.31Å; G234-V241 WeakPolarHBondContact O-CA 3.36Å; F235-V241 HydrophobicContact CD1-CG2 4.08Å; F235-V241 HydrophobicContact CE1-CG2 3.65Å; F235-V241 HydrophobicContact CZ-CG2 4.34Å; V241-N243 HydrophobicContact CG1-CB 3.95Å; V241-Y244 HydrophobicContact CB-CD2 4.01Å; V241-Y244 HydrophobicContact CB-CE2 3.75Å; V241-Y244 HydrophobicContact CG1-CD1 4.16Å; V241-Y244 HydrophobicContact CG1-CD2 3.86Å; V241-Y244 HydrophobicContact CG1-CE1 3.87Å; V241-Y244 HydrophobicContact CG1-CE2 3.58Å; V241-Y244 HydrophobicContact CG1-CG 4.14Å; V241-Y244 HydrophobicContact CG2-CE2 4.12Å; V241-K391 HydrophobicContact CG2-CD 4.22Å
242	V	87.9	Confident	81.6	Confident	10 Å²	10	56.8 Å²	56.8	6%	0.061	30%	0.295	C	S	.	.	S	Bend	trans	-86.9	-19.2	-176.4	-54.7	0	0	0	0	113.6	G234 N236 Y244 S245 R248 I253 A257	G234-V242 PolarHBondContact O-N 2.88Å; N236-V242 HydrophobicContact CB-CG1 3.81Å; V242-Y244 VanDerWaalsContact C-N 3.33Å; V242-Y244 PolarHBondContact O-N 2.93Å; V242-S245 PolarHBondContact O-OG 3.49Å; V242-R248 PolarHBondContact O-NH1 2.92Å; V242-I253 HydrophobicContact CG2-CB 4.43Å; V242-I253 HydrophobicContact CG2-CG2 3.84Å; V242-A257 HydrophobicContact CG2-CB 4.36Å
243	N	84.3	Confident	81.3	Confident	16 Å²	16	56.3 Å²	56.3	9%	0.086	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29	-173.6	-71.2	50.9	0	0	0	114.8	T198 I232 G234 V241 S245	T198-N243 VanDerWaalsContact O-CB 3.31Å; T198-N243 WeakPolarHBondContact O-CB 3.44Å; T198-N243 PolarHBondContact O-ND2 2.8Å; I232-N243 PolarHBondContact O-ND2 3.22Å; G234-N243 PolarHBondContact N-OD1 3.34Å; V241-N243 HydrophobicContact CG1-CB 3.95Å; N243-S245 PolarHBondContact O-N 3.37Å
244	Y	79.1	Confident	80.8	Confident	79 Å²	79	56.3 Å²	56.3	31%	0.31	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	13.8	-162.8	-54.7	-27.6	0	0	0	115.1	L197 V241 V242 K391	L197-Y244 WeakPolarHBondContact O-CE1 3.21Å; L197-Y244 PolarHBondContact O-OH 3.31Å; V241-Y244 HydrophobicContact CB-CD2 4.01Å; V241-Y244 HydrophobicContact CB-CE2 3.75Å; V241-Y244 HydrophobicContact CG1-CD1 4.16Å; V241-Y244 HydrophobicContact CG1-CD2 3.86Å; V241-Y244 HydrophobicContact CG1-CE1 3.87Å; V241-Y244 HydrophobicContact CG1-CE2 3.58Å; V241-Y244 HydrophobicContact CG1-CG 4.14Å; V241-Y244 HydrophobicContact CG2-CE2 4.12Å; V242-Y244 VanDerWaalsContact C-N 3.33Å; V242-Y244 PolarHBondContact O-N 2.93Å; Y244-K391 WeakPolarHBondContact OH-CE 3.1Å
245	S	70.2	Confident	80.3	Confident	47 Å²	47	62.4 Å²	62.4	33%	0.329	32%	0.321	S	S	.	.	S	Bend	trans	-90.8	146.7	170.3	44	0	0	0	0	109.7	V242 N243 S247 R248	V242-S245 PolarHBondContact O-OG 3.49Å; N243-S245 PolarHBondContact O-N 3.37Å; S245-S247 PolarHBondContact O-N 2.66Å; S245-R248 WeakPolarHBondContact OG-CD 3.46Å; S245-R248 WeakPolarHBondContact OG-CG 3.37Å; S245-R248 PolarHBondContact OG-NE 3.45Å; S245-R248 PolarHBondContact OG-NH2 3.45Å
246	E	56.3	Low	79.9	Confident	194 Å²	194	64.4 Å²	64.4	91%	0.907	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	123.5	-173.3	-65.1	-176.4	170	0	0	110.8
247	S	56.4	Low	79.9	Confident	119 Å²	119	63 Å²	63	83%	0.832	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	38.8	170.1	-63.4	0	0	0	0	117.8	S245 T249	S245-S247 PolarHBondContact O-N 2.66Å; S247-T249 PolarHBondContact O-N 2.88Å
248	R	69.9	Low	80	Confident	93 Å²	93	62.8 Å²	62.8	35%	0.351	33%	0.327	S	S	.	.			trans	-71.6	127.8	169.5	-67.4	-152.4	-177.6	165.4	17.1	113.5	V242 S245 E252 I253 S256	V242-R248 PolarHBondContact O-NH1 2.92Å; S245-R248 WeakPolarHBondContact OG-CD 3.46Å; S245-R248 WeakPolarHBondContact OG-CG 3.37Å; S245-R248 PolarHBondContact OG-NE 3.45Å; S245-R248 PolarHBondContact OG-NH2 3.45Å; R248-E252 WeakPolarHBondContact CA-OE2 3.48Å; R248-E252 HydrophobicContact CB-CB 4.34Å; R248-E252 HydrophobicContact CG-CB 4.45Å; R248-E252 WeakPolarHBondContact CG-OE2 3.44Å; R248-I253 HydrophobicContact CB-CD1 4.44Å; R248-I253 HydrophobicContact CB-CG1 4.01Å; R248-S256 PolarHBondContact NH1-OG 2.72Å
249	T	79.4	Confident	80.2	Confident	65 Å²	65	56.9 Å²	56.9	40%	0.399	30%	0.301	S	S	.	.			trans	-71.3	161.9	165.9	63.5	0	0	0	0	110.6	S247 E251 E252 I253	S247-T249 PolarHBondContact O-N 2.88Å; T249-E251 PolarHBondContact O-N 2.85Å; T249-E252 PolarHBondContact O-N 2.74Å; T249-E252 WeakPolarHBondContact OG1-CG 3.26Å; T249-E252 PolarHBondContact OG1-N 3.35Å; T249-E252 PolarHBondContact OG1-OE1 2.8Å; T249-I253 WeakPolarHBondContact O-CG1 3.31Å; T249-I253 PolarHBondContact O-N 2.96Å
250	A	78.6	Confident	80.4	Confident	25 Å²	25	56 Å²	56	21%	0.207	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-27.3	174.5	0	0	0	0	0	112.4	I232 C254 N467	I232-A250 HydrophobicContact CD1-CB 3.71Å; A250-C254 WeakPolarHBondContact O-CB 3.46Å; A250-C254 PolarHBondContact O-N 3.38Å; A250-C254 VanDerWaalsContact O-N 3.09Å; A250-C254 PolarHBondContact O-SG 3.23Å; A250-N467 WeakPolarHBondContact CB-O 3.43Å
251	E	80.4	Confident	80.7	Confident	96 Å²	96	50.2 Å²	50.2	45%	0.449	27%	0.265	S	S	.	.	H	α-helix	trans	-68.6	-49.7	177.6	-58.5	175.8	-175.6	0	0	111.9	T249 I253 C254 E255 S469	T249-E251 PolarHBondContact O-N 2.85Å; E251-I253 VanDerWaalsContact C-N 3.25Å; E251-I253 PolarHBondContact O-N 3.46Å; E251-C254 WeakPolarHBondContact O-CA 3.47Å; E251-C254 WeakPolarHBondContact O-CB 3.45Å; E251-C254 PolarHBondContact O-N 3.06Å; E251-E255 WeakPolarHBondContact O-CG 3.24Å; E251-E255 PolarHBondContact O-N 3.08Å; E251-S469 VanDerWaalsContact CA-OG 3.29Å; E251-S469 WeakPolarHBondContact CA-OG 3.47Å; E251-S469 WeakPolarHBondContact CG-OG 3.04Å
252	E	82.6	Confident	80.8	Confident	81 Å²	81	49.1 Å²	49.1	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-34.9	177.1	-69.5	163.6	-139.6	0	0	112.5	R248 T249 E255 S256	R248-E252 WeakPolarHBondContact CA-OE2 3.48Å; R248-E252 HydrophobicContact CB-CB 4.34Å; R248-E252 HydrophobicContact CG-CB 4.45Å; R248-E252 WeakPolarHBondContact CG-OE2 3.44Å; T249-E252 PolarHBondContact O-N 2.74Å; T249-E252 WeakPolarHBondContact OG1-CG 3.26Å; T249-E252 PolarHBondContact OG1-N 3.35Å; T249-E252 PolarHBondContact OG1-OE1 2.8Å; E252-E255 PolarHBondContact O-N 3.09Å; E252-S256 WeakPolarHBondContact O-CB 3.09Å; E252-S256 PolarHBondContact O-N 3.1Å; E252-S256 PolarHBondContact O-OG 3.26Å
253	I	85.1	Confident	81.1	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-46.2	173.2	-64.8	169.7	0	0	0	109.7	I232 V242 R248 T249 E251 E255 S256 A257 M260	I232-I253 HydrophobicContact CD1-CB 4.13Å; I232-I253 HydrophobicContact CD1-CD1 4.1Å; I232-I253 HydrophobicContact CD1-CG2 3.99Å; I232-I253 HydrophobicContact CG1-CD1 4.31Å; I232-I253 HydrophobicContact CG1-CG2 4.42Å; V242-I253 HydrophobicContact CG2-CB 4.43Å; V242-I253 HydrophobicContact CG2-CG2 3.84Å; R248-I253 HydrophobicContact CB-CD1 4.44Å; R248-I253 HydrophobicContact CB-CG1 4.01Å; T249-I253 WeakPolarHBondContact O-CG1 3.31Å; T249-I253 PolarHBondContact O-N 2.96Å; E251-I253 VanDerWaalsContact C-N 3.25Å; E251-I253 PolarHBondContact O-N 3.46Å; I253-E255 VanDerWaalsContact C-N 3.31Å; I253-E255 PolarHBondContact O-N 3.5Å; I253-S256 PolarHBondContact O-N 3.17Å; I253-A257 WeakPolarHBondContact O-CB 3.35Å; I253-A257 PolarHBondContact O-N 3.15Å; I253-M260 HydrophobicContact CG2-CE 3.72Å; I253-M260 HydrophobicContact CG2-SD 3.73Å
254	C	82.1	Confident	81.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-31.4	179.4	-73.6	0	0	0	0	113.6	F175 A250 E251 N467	F175-C254 WeakPolarHBondContact CD1-O 3.47Å; F175-C254 HydrophobicContact CE1-CB 3.76Å; F175-C254 WeakPolarHBondContact CE1-O 3.4Å; F175-C254 HydrophobicContact CZ-CB 4.33Å; A250-C254 WeakPolarHBondContact O-CB 3.46Å; A250-C254 PolarHBondContact O-N 3.38Å; A250-C254 VanDerWaalsContact O-N 3.09Å; A250-C254 PolarHBondContact O-SG 3.23Å; E251-C254 WeakPolarHBondContact O-CA 3.47Å; E251-C254 WeakPolarHBondContact O-CB 3.45Å; E251-C254 PolarHBondContact O-N 3.06Å; C254-N467 VanDerWaalsContact SG-CB 3.59Å
255	E	81.6	Confident	82.2	Confident	127 Å²	127	44.2 Å²	44.2	59%	0.593	24%	0.237	S	C	*	.	H	α-helix	trans	-77.7	-37	177.5	-70.9	179.9	172.3	0	0	112.8	E251 E252 I253	E251-E255 WeakPolarHBondContact O-CG 3.24Å; E251-E255 PolarHBondContact O-N 3.08Å; E252-E255 PolarHBondContact O-N 3.09Å; I253-E255 VanDerWaalsContact C-N 3.31Å; I253-E255 PolarHBondContact O-N 3.5Å
256	S	83.1	Confident	83.2	Confident	44 Å²	44	42 Å²	42	31%	0.308	22%	0.222	S	C	.	.	H	α-helix	trans	-90.6	-15	-176	59.3	0	0	0	0	114.4	R248 E252 I253	R248-S256 PolarHBondContact NH1-OG 2.72Å; E252-S256 WeakPolarHBondContact O-CB 3.09Å; E252-S256 PolarHBondContact O-N 3.1Å; E252-S256 PolarHBondContact O-OG 3.26Å; I253-S256 PolarHBondContact O-N 3.17Å
257	A	87.8	Confident	84.8	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	18%	0.178	C	C	.	.			trans	-86.3	133.4	-178.8	0	0	0	0	0	112.2	F235 V242 I253 M260	F235-A257 CarbonylContact O-C 3.56Å; F235-A257 WeakPolarHBondContact O-CA 3.27Å; V242-A257 HydrophobicContact CG2-CB 4.36Å; I253-A257 WeakPolarHBondContact O-CB 3.35Å; I253-A257 PolarHBondContact O-N 3.15Å; A257-M260 HydrophobicContact CB-CG 3.78Å; A257-M260 HydrophobicContact CB-SD 3.36Å; A257-M260 WeakPolarHBondContact CB-SD 3.45Å
258	S	87.3	Confident	86.1	Confident	14 Å²	14	27.3 Å²	27.3	10%	0.098	14%	0.141	C	C	.	.	S	Bend	trans	-90	-24	168	-49.9	0	0	0	0	111.7	P170 L176 F235 S237	P170-S258 VanDerWaalsContact CD-OG 3.29Å; P170-S258 WeakPolarHBondContact CD-OG 3.48Å; L176-S258 PolarHBondContact N-O 3.17Å; F235-S258 PolarHBondContact O-N 2.79Å; S237-S258 WeakPolarHBondContact CA-OG 3.36Å; S237-S258 PolarHBondContact N-OG 2.92Å; S237-S258 VanDerWaalsContact N-OG 3.09Å
259	K	89.6	Confident	86.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.5	174.2	179.2	175.2	-167.9	158.5	0	110.2	E104 L176 G234 F235 N395 I397	E104-K259 WeakPolarHBondContact OE1-CD 3.29Å; E104-K259 IonicContact OE1-NZ 3.81Å; E104-K259 PolarHBondContact OE1-NZ 2.89Å; E104-K259 IonicContact OE2-NZ 3.89Å; E104-K259 PolarHBondContact OE2-NZ 2.76Å; L176-K259 HydrophobicContact CB-CG 4.37Å; L176-K259 HydrophobicContact CD2-CD 4.05Å; L176-K259 HydrophobicContact CD2-CG 4.12Å; L176-K259 HydrophobicContact CG-CG 4.4Å; L176-K259 CarbonylContact O-C 3.52Å; L176-K259 WeakPolarHBondContact O-CA 3.44Å; G234-K259 CarbonylContact C-O 3.57Å; G234-K259 WeakPolarHBondContact CA-O 3.19Å; F235-K259 HydrophobicContact CB-CB 4.37Å; F235-K259 PolarHBondContact N-O 2.88Å; F235-K259 PolarHBondContact O-N 2.88Å; F235-K259 VanDerWaalsContact O-N 3.11Å; K259-N395 WeakPolarHBondContact CD-O 3.32Å; K259-N395 WeakPolarHBondContact CE-O 3.21Å; K259-N395 PolarHBondContact NZ-O 3.11Å; K259-I397 WeakPolarHBondContact CE-O 3.06Å; K259-I397 PolarHBondContact NZ-O 2.52Å
260	M	89.8	Confident	87	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.4	-176.7	-72.3	-69.6	-74.8	0	0	110	F175 L176 D177 L178 I232 G234 I253 A257	F175-M260 HydrophobicContact CB-CG 4.45Å; F175-M260 HydrophobicContact CD1-CG 4.17Å; F175-M260 HydrophobicContact CD2-CB 3.62Å; F175-M260 HydrophobicContact CD2-CG 3.39Å; F175-M260 HydrophobicContact CE1-CG 4.17Å; F175-M260 HydrophobicContact CE2-CB 3.64Å; F175-M260 HydrophobicContact CE2-CG 3.44Å; F175-M260 VanDerWaalsContact CE2-CG 3.44Å; F175-M260 HydrophobicContact CG-CB 4.44Å; F175-M260 HydrophobicContact CG-CG 3.77Å; F175-M260 HydrophobicContact CZ-CB 4.44Å; F175-M260 HydrophobicContact CZ-CG 3.84Å; L176-M260 PolarHBondContact O-N 3.41Å; D177-M260 WeakPolarHBondContact CA-O 3.3Å; L178-M260 PolarHBondContact N-O 2.9Å; I232-M260 HydrophobicContact CB-CE 3.62Å; I232-M260 HydrophobicContact CD1-CE 3.9Å; I232-M260 HydrophobicContact CG1-CE 4.19Å; I232-M260 HydrophobicContact CG2-CE 4.02Å; G234-M260 WeakPolarHBondContact CA-SD 3.44Å; I253-M260 HydrophobicContact CG2-CE 3.72Å; I253-M260 HydrophobicContact CG2-SD 3.73Å; A257-M260 HydrophobicContact CB-CG 3.78Å; A257-M260 HydrophobicContact CB-SD 3.36Å; A257-M260 WeakPolarHBondContact CB-SD 3.45Å
261	I	93.3	Very high	87.3	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	113.7	168.4	-51.8	-60.2	0	0	0	107.5	L178 V180 I232 L233 F235 F263 F394	L178-I261 HydrophobicContact CB-CD1 3.85Å; L178-I261 HydrophobicContact CD1-CD1 3.94Å; L178-I261 HydrophobicContact CG-CD1 4.3Å; L178-I261 CarbonylContact O-C 3.58Å; L178-I261 WeakPolarHBondContact O-CA 3.16Å; V180-I261 HydrophobicContact CB-CG2 4.29Å; V180-I261 HydrophobicContact CG2-CG2 3.65Å; I232-I261 WeakPolarHBondContact CA-O 3.15Å; L233-I261 HydrophobicContact CB-CB 4.36Å; L233-I261 PolarHBondContact N-O 3.01Å; L233-I261 PolarHBondContact O-N 3.09Å; F235-I261 HydrophobicContact CD2-CG1 4.47Å; F235-I261 HydrophobicContact CE2-CG1 3.92Å; I261-F263 HydrophobicContact CB-CE2 4.39Å; I261-F263 HydrophobicContact CB-CZ 4.31Å; I261-F263 HydrophobicContact CG2-CD1 4.2Å; I261-F263 HydrophobicContact CG2-CD2 4.45Å; I261-F263 HydrophobicContact CG2-CE1 3.7Å; I261-F263 HydrophobicContact CG2-CE2 4Å; I261-F263 HydrophobicContact CG2-CZ 3.58Å; I261-F394 HydrophobicContact CG1-CB 4.13Å; I261-F394 HydrophobicContact CG1-CD1 4.4Å; I261-F394 HydrophobicContact CG1-CG 4.44Å; I261-F394 HydrophobicContact CG2-CD1 4.27Å; I261-F394 HydrophobicContact CG2-CE1 4.46Å
262	T	92.1	Very high	87.6	Confident	8 Å²	8	30.6 Å²	30.6	5%	0.049	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	107.3	175.1	-61	0	0	0	0	109	D177 L178 R179 V180 F230 E231	D177-T262 PolarHBondContact OD1-OG1 2.82Å; L178-T262 PolarHBondContact O-N 3.35Å; R179-T262 CarbonylContact C-O 3.57Å; R179-T262 VanDerWaalsContact CA-O 3.32Å; R179-T262 WeakPolarHBondContact CA-O 3.43Å; V180-T262 PolarHBondContact N-O 3.33Å; F230-T262 HydrophobicContact CD1-CG2 4.09Å; E231-T262 CarbonylContact O-C 3.58Å
263	F	94.1	Very high	87.7	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.6	175.6	-63.5	-71.3	0	0	0	111.1	V180 V182 L194 L197 T198 F230 E231 L233 I261 F394	V180-F263 HydrophobicContact CB-CD1 3.87Å; V180-F263 HydrophobicContact CB-CE1 4.09Å; V180-F263 HydrophobicContact CG1-CD1 4.15Å; V180-F263 HydrophobicContact CG1-CE1 4.21Å; V180-F263 CarbonylContact O-C 3.54Å; V180-F263 WeakPolarHBondContact O-CA 3.34Å; V182-F263 HydrophobicContact CG2-CB 4.33Å; V182-F263 HydrophobicContact CG2-CD1 4.07Å; L194-F263 HydrophobicContact CD1-CB 4.33Å; L194-F263 HydrophobicContact CD2-CB 3.59Å; L194-F263 HydrophobicContact CD2-CD1 3.64Å; L194-F263 HydrophobicContact CD2-CD2 3.7Å; L194-F263 HydrophobicContact CD2-CE1 4.23Å; L194-F263 HydrophobicContact CD2-CE2 4.25Å; L194-F263 HydrophobicContact CD2-CG 3.35Å; L197-F263 HydrophobicContact CD1-CZ 4.38Å; T198-F263 HydrophobicContact CG2-CD2 4.4Å; F230-F263 VanDerWaalsContact CA-O 3.3Å; F230-F263 WeakPolarHBondContact CA-O 3.5Å; E231-F263 HydrophobicContact CB-CB 4.3Å; E231-F263 PolarHBondContact N-O 3.41Å; E231-F263 PolarHBondContact O-N 2.89Å; L233-F263 HydrophobicContact CB-CE2 3.71Å; L233-F263 HydrophobicContact CD2-CE2 4.15Å; L233-F263 HydrophobicContact CD2-CZ 4.29Å; I261-F263 HydrophobicContact CB-CE2 4.39Å; I261-F263 HydrophobicContact CB-CZ 4.31Å; I261-F263 HydrophobicContact CG2-CD1 4.2Å; I261-F263 HydrophobicContact CG2-CD2 4.45Å; I261-F263 HydrophobicContact CG2-CE1 3.7Å; I261-F263 HydrophobicContact CG2-CE2 4Å; I261-F263 HydrophobicContact CG2-CZ 3.58Å; F263-F394 HydrophobicContact CE1-CE1 4Å; F263-F394 HydrophobicContact CE1-CE2 4.01Å; F263-F394 AromaticContact CE1-CZ 3.58Å; F263-F394 HydrophobicContact CE1-CZ 3.58Å; F263-F394 HydrophobicContact CZ-CD2 4.26Å; F263-F394 HydrophobicContact CZ-CE1 4.3Å; F263-F394 AromaticContact CZ-CE2 3.77Å; F263-F394 HydrophobicContact CZ-CE2 3.77Å; F263-F394 AromaticContact CZ-CZ 3.82Å; F263-F394 HydrophobicContact CZ-CZ 3.82Å
264	I	93.1	Very high	87.8	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	100.2	171.4	-43	-176.5	0	0	0	106.9	R179 V180 V182 I228 F230 L266 Y283 P285	R179-I264 HydrophobicContact CB-CD1 4.47Å; V180-I264 PolarHBondContact O-N 3.27Å; V182-I264 PolarHBondContact N-O 3.4Å; I228-I264 HydrophobicContact CG2-CG2 3.51Å; F230-I264 HydrophobicContact CD1-CG1 4.2Å; F230-I264 HydrophobicContact CE1-CB 4.33Å; F230-I264 HydrophobicContact CE1-CD1 4.24Å; F230-I264 HydrophobicContact CE1-CG1 3.87Å; F230-I264 HydrophobicContact CE1-CG2 3.92Å; F230-I264 HydrophobicContact CZ-CG2 4.42Å; I264-L266 HydrophobicContact CG2-CD2 3.69Å; I264-L266 HydrophobicContact CG2-CG 4.27Å; I264-L266 PolarHBondContact O-N 3.09Å; I264-Y283 HydrophobicContact CD1-CG 4.46Å; I264-P285 HydrophobicContact CD1-CB 4.18Å
265	D	92.8	Very high	88	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	115.6	177.5	-166.8	17.9	0	0	0	109	S191 L194 S229	S191-D265 WeakPolarHBondContact CB-OD2 3.45Å; S191-D265 PolarHBondContact OG-OD1 3.24Å; S191-D265 PolarHBondContact OG-OD2 2.84Å; L194-D265 HydrophobicContact CD1-CB 3.64Å; S229-D265 PolarHBondContact N-O 3.18Å; S229-D265 PolarHBondContact O-N 3.27Å; S229-D265 VanDerWaalsContact OG-CB 3.26Å; S229-D265 WeakPolarHBondContact OG-CB 3.48Å
266	L	92.6	Very high	88.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.			trans	-109.3	143.4	-179.3	-55.3	176	0	0	0	111.1	A181 V182 L183 K190 I228 I264 G268 T276 L280	A181-L266 HydrophobicContact CB-CD1 3.93Å; V182-L266 WeakPolarHBondContact O-CB 3.02Å; V182-L266 PolarHBondContact O-N 2.91Å; L183-L266 HydrophobicContact CD2-CB 4.34Å; L183-L266 HydrophobicContact CD2-CD1 3.59Å; K190-L266 VanDerWaalsContact CE-O 3.31Å; K190-L266 WeakPolarHBondContact CE-O 3.45Å; I228-L266 HydrophobicContact CD1-CD2 4.37Å; I228-L266 HydrophobicContact CG1-CD2 4.13Å; I228-L266 HydrophobicContact CG2-CD2 4.25Å; I264-L266 HydrophobicContact CG2-CD2 3.69Å; I264-L266 HydrophobicContact CG2-CG 4.27Å; I264-L266 PolarHBondContact O-N 3.09Å; L266-G268 PolarHBondContact O-N 2.82Å; L266-T276 HydrophobicContact CB-CG2 3.99Å; L266-T276 HydrophobicContact CD1-CG2 4.02Å; L266-L280 HydrophobicContact CD1-CD2 3.85Å; L266-L280 HydrophobicContact CD1-CG 3.95Å
267	A	88.4	Confident	88.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.119	C	C	.	.			trans	-62.5	136.7	-178	0	0	0	0	0	111.9	T225 Y272 T276 H305	T225-A267 WeakPolarHBondContact O-CB 3.02Å; A267-Y272 HydrophobicContact CB-CD2 4.25Å; A267-Y272 HydrophobicContact CB-CG 4.2Å; A267-T276 PolarHBondContact O-OG1 2.76Å; A267-H305 PolarHBondContact O-CE1 3.21Å
268	G	84.3	Confident	88.8	Confident	5 Å²	5	26.5 Å²	26.5	5%	0.052	12%	0.123	C	C	.	.			trans	-87.5	-18.1	179.1	0	0	0	0	0	114.9	G184 L266 T301	G184-G268 WeakPolarHBondContact O-CA 3.46Å; L266-G268 PolarHBondContact O-N 2.82Å; G268-T301 PolarHBondContact O-OG1 3.17Å
269	H	86.8	Confident	88.9	Confident	33 Å²	33	25.8 Å²	25.8	15%	0.153	12%	0.118	C	C	.	.	S	Bend	trans	-89.1	137.3	-172.4	-165.7	-77.7	0	0	0	111.3	V186 K271 Y272 L273	V186-H269 VanDerWaalsContact CG2-CA 3.47Å; V186-H269 HydrophobicContact CG2-CB 3.67Å; H269-K271 VanDerWaalsContact ND1-CB 3.3Å; H269-K271 WeakPolarHBondContact ND1-CB 3.48Å; H269-K271 PolarHBondContact ND1-N 3.32Å; H269-K271 VanDerWaalsContact ND1-N 3.17Å; H269-K271 PolarHBondContact O-N 3.09Å; H269-K271 VanDerWaalsContact O-N 3.1Å; H269-Y272 HydrophobicContact CB-CD2 4.04Å; H269-Y272 PolarHBondContact O-N 3.05Å; H269-L273 PolarHBondContact O-N 2.87Å
270	H	82.3	Confident	88.9	Confident	128 Å²	128	26 Å²	26	59%	0.593	12%	0.119	S	C	*	.	G	3₁₀ helix	trans	-53.5	-36.4	-178.2	65.6	-91.6	0	0	0	113.4	Y272 L273 T301	H270-Y272 PolarHBondContact O-N 2.88Å; H270-Y272 VanDerWaalsContact O-N 3.14Å; H270-L273 WeakPolarHBondContact O-CB 3.49Å; H270-L273 PolarHBondContact O-N 2.95Å; H270-L273 VanDerWaalsContact O-N 3.09Å; H270-T301 HydrophobicContact CB-CG2 3.95Å
271	K	85	Confident	88.9	Confident	142 Å²	142	26.6 Å²	26.6	62%	0.617	12%	0.123	S	C	*	.	G	3₁₀ helix	trans	-51.8	-32.8	173.4	-173.2	179.2	179.1	-176.7	0	113.8	H269	H269-K271 VanDerWaalsContact ND1-CB 3.3Å; H269-K271 WeakPolarHBondContact ND1-CB 3.48Å; H269-K271 PolarHBondContact ND1-N 3.32Å; H269-K271 VanDerWaalsContact ND1-N 3.17Å; H269-K271 PolarHBondContact O-N 3.09Å; H269-K271 VanDerWaalsContact O-N 3.1Å
272	Y	86.5	Confident	88.5	Confident	46 Å²	46	26.6 Å²	26.6	18%	0.18	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-106.1	12.8	-176.7	-55.9	-56.3	0	0	0	112.8	A267 H269 H270 K274 T275 T276	A267-Y272 HydrophobicContact CB-CD2 4.25Å; A267-Y272 HydrophobicContact CB-CG 4.2Å; H269-Y272 HydrophobicContact CB-CD2 4.04Å; H269-Y272 PolarHBondContact O-N 3.05Å; H270-Y272 PolarHBondContact O-N 2.88Å; H270-Y272 VanDerWaalsContact O-N 3.14Å; Y272-K274 PolarHBondContact O-N 2.85Å; Y272-K274 VanDerWaalsContact O-N 3.14Å; Y272-T275 WeakPolarHBondContact O-CA 3.43Å; Y272-T275 WeakPolarHBondContact O-CB 3.44Å; Y272-T275 PolarHBondContact O-N 2.91Å; Y272-T275 PolarHBondContact O-OG1 2.95Å; Y272-T276 PolarHBondContact O-N 3.17Å
273	L	85.1	Confident	88.2	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-27	-178	-172.2	68.8	0	0	0	113.2	H269 H270 T275 T276 I277 E304 H305 L308 R580	H269-L273 PolarHBondContact O-N 2.87Å; H270-L273 WeakPolarHBondContact O-CB 3.49Å; H270-L273 PolarHBondContact O-N 2.95Å; H270-L273 VanDerWaalsContact O-N 3.09Å; L273-T275 PolarHBondContact O-N 2.78Å; L273-T276 WeakPolarHBondContact O-CB 3.3Å; L273-T276 PolarHBondContact O-N 2.83Å; L273-I277 WeakPolarHBondContact O-CG1 3.15Å; L273-I277 PolarHBondContact O-N 2.8Å; L273-E304 HydrophobicContact CD1-CG 4.5Å; L273-E304 HydrophobicContact CD2-CG 4.18Å; L273-E304 WeakPolarHBondContact CD2-OE1 3.4Å; L273-E304 WeakPolarHBondContact CD2-OE2 3.26Å; L273-H305 WeakPolarHBondContact CD1-NE2 3.29Å; L273-L308 HydrophobicContact CD1-CD1 3.96Å; L273-R580 VanDerWaalsContact CG-NH1 3.28Å
274	K	85.6	Confident	87.7	Confident	128 Å²	128	29.3 Å²	29.3	56%	0.557	14%	0.14	S	C	*	.	H	α-helix	trans	-58.7	-34.3	170.4	65.2	178.2	-178.6	178.2	0	112.5	Y272 F278	Y272-K274 PolarHBondContact O-N 2.85Å; Y272-K274 VanDerWaalsContact O-N 3.14Å; K274-F278 WeakPolarHBondContact O-CB 3.41Å; K274-F278 PolarHBondContact O-N 2.94Å
275	T	88	Confident	87.6	Confident	27 Å²	27	29.7 Å²	29.7	17%	0.166	14%	0.142	C	C	.	.	H	α-helix	trans	-73.3	-43.6	177	-51.7	0	0	0	0	109.6	I228 Y272 L273 I277 F278 G279	I228-T275 HydrophobicContact CD1-CG2 4Å; I228-T275 HydrophobicContact CG1-CG2 3.4Å; Y272-T275 WeakPolarHBondContact O-CA 3.43Å; Y272-T275 WeakPolarHBondContact O-CB 3.44Å; Y272-T275 PolarHBondContact O-N 2.91Å; Y272-T275 PolarHBondContact O-OG1 2.95Å; L273-T275 PolarHBondContact O-N 2.78Å; T275-I277 PolarHBondContact O-N 3.11Å; T275-F278 PolarHBondContact O-N 2.93Å; T275-G279 PolarHBondContact O-N 2.74Å
276	T	90.1	Very high	87.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-45.5	174.9	-50	0	0	0	0	112.2	L183 L266 A267 Y272 L273 G279 L280	L183-T276 HydrophobicContact CD2-CG2 3.61Å; L266-T276 HydrophobicContact CB-CG2 3.99Å; L266-T276 HydrophobicContact CD1-CG2 4.02Å; A267-T276 PolarHBondContact O-OG1 2.76Å; Y272-T276 PolarHBondContact O-N 3.17Å; L273-T276 WeakPolarHBondContact O-CB 3.3Å; L273-T276 PolarHBondContact O-N 2.83Å; T276-G279 PolarHBondContact O-N 3.44Å; T276-L280 WeakPolarHBondContact O-CG 3.48Å; T276-L280 PolarHBondContact O-N 2.77Å
277	I	89.4	Confident	87.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.6	-45.6	178	-69.4	-169.1	0	0	0	111.3	L273 T275 G279 L280 T281 L308 H533 L578 R580	L273-I277 WeakPolarHBondContact O-CG1 3.15Å; L273-I277 PolarHBondContact O-N 2.8Å; T275-I277 PolarHBondContact O-N 3.11Å; I277-G279 PolarHBondContact O-N 2.92Å; I277-L280 PolarHBondContact O-N 3.45Å; I277-T281 HydrophobicContact CG2-CG2 4.02Å; I277-T281 WeakPolarHBondContact O-CG2 3.39Å; I277-T281 PolarHBondContact O-N 2.7Å; I277-T281 PolarHBondContact O-OG1 2.85Å; I277-L308 HydrophobicContact CD1-CD1 4.15Å; I277-L308 HydrophobicContact CD1-CD2 3.73Å; I277-L308 HydrophobicContact CG1-CD1 3.76Å; I277-L308 HydrophobicContact CG1-CD2 4.01Å; I277-H533 HydrophobicContact CG2-CB 4.14Å; I277-L578 HydrophobicContact CD1-CD1 4.15Å; I277-L578 HydrophobicContact CD1-CD2 3.65Å; I277-L578 HydrophobicContact CG2-CD2 4.17Å; I277-R580 VanDerWaalsContact CD1-CD 3.42Å
278	F	88.8	Confident	88	Confident	18 Å²	18	31.2 Å²	31.2	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-56.9	-42.7	175	-175.9	-99.2	0	0	0	110.9	I228 K274 T275 L280 T281 S282 Y283 D419	I228-F278 HydrophobicContact CD1-CD1 3.81Å; K274-F278 WeakPolarHBondContact O-CB 3.41Å; K274-F278 PolarHBondContact O-N 2.94Å; T275-F278 PolarHBondContact O-N 2.93Å; F278-L280 VanDerWaalsContact C-N 3.31Å; F278-L280 PolarHBondContact O-N 3.09Å; F278-T281 PolarHBondContact O-N 2.72Å; F278-S282 WeakPolarHBondContact CZ-OG 3.4Å; F278-S282 VanDerWaalsContact O-CB 3.29Å; F278-S282 WeakPolarHBondContact O-CB 3.41Å; F278-S282 PolarHBondContact O-N 3.4Å; F278-Y283 HydrophobicContact CD1-CE2 4.24Å; F278-Y283 AromaticContact CE1-CE2 3.9Å; F278-Y283 HydrophobicContact CE1-CE2 3.9Å; F278-D419 HydrophobicContact CE1-CB 4.46Å; F278-D419 HydrophobicContact CZ-CB 4.07Å
279	G	89.8	Confident	88.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-54.1	-42.1	172.6	0	0	0	0	0	114.6	T275 T276 I277	T275-G279 PolarHBondContact O-N 2.74Å; T276-G279 PolarHBondContact O-N 3.44Å; I277-G279 PolarHBondContact O-N 2.92Å
280	L	90.1	Very high	89.1	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-81.3	-28.6	-179.3	-65.5	175.9	0	0	0	113.9	A181 L183 L266 T276 I277 F278 P285 L308 L312	A181-L280 HydrophobicContact CB-CD2 3.56Å; L183-L280 HydrophobicContact CD1-CD1 4.29Å; L183-L280 HydrophobicContact CD1-CD2 4.25Å; L183-L280 HydrophobicContact CD2-CD1 4.15Å; L183-L280 HydrophobicContact CD2-CD2 4.25Å; L183-L280 HydrophobicContact CD2-CG 4.44Å; L266-L280 HydrophobicContact CD1-CD2 3.85Å; L266-L280 HydrophobicContact CD1-CG 3.95Å; T276-L280 WeakPolarHBondContact O-CG 3.48Å; T276-L280 PolarHBondContact O-N 2.77Å; I277-L280 PolarHBondContact O-N 3.45Å; F278-L280 VanDerWaalsContact C-N 3.31Å; F278-L280 PolarHBondContact O-N 3.09Å; L280-P285 HydrophobicContact CD2-CG 3.95Å; L280-P285 WeakPolarHBondContact O-CD 3.45Å; L280-L308 HydrophobicContact CD1-CB 3.97Å; L280-L312 HydrophobicContact CB-CD1 3.47Å; L280-L312 VanDerWaalsContact CB-CD1 3.47Å; L280-L312 HydrophobicContact CD1-CD1 4.22Å; L280-L312 HydrophobicContact CG-CD1 4.47Å
281	T	88.2	Confident	89.8	Confident	11 Å²	11	23.4 Å²	23.4	7%	0.067	11%	0.113	C	C	.	.	H	α-helix	trans	-93.7	-38.8	-176.8	63	0	0	0	0	113.5	I277 F278 C284 L312 H533 G535	I277-T281 HydrophobicContact CG2-CG2 4.02Å; I277-T281 WeakPolarHBondContact O-CG2 3.39Å; I277-T281 PolarHBondContact O-N 2.7Å; I277-T281 PolarHBondContact O-OG1 2.85Å; F278-T281 PolarHBondContact O-N 2.72Å; T281-C284 PolarHBondContact O-SG 3.01Å; T281-C284 VanDerWaalsContact O-SG 3.38Å; T281-L312 HydrophobicContact CG2-CD1 3.97Å; T281-L312 HydrophobicContact CG2-CD2 4Å; T281-H533 HydrophobicContact CG2-CB 4.5Å; T281-G535 CarbonylContact C-O 3.6Å; T281-G535 WeakPolarHBondContact CB-O 3.38Å; T281-G535 WeakPolarHBondContact O-CA 3.48Å; T281-G535 PolarHBondContact OG1-O 3.02Å
282	S	85.7	Confident	90.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-49.4	-174.4	135	0	0	0	0	111.3	F278 C284 D419 G535	F278-S282 WeakPolarHBondContact CZ-OG 3.4Å; F278-S282 VanDerWaalsContact O-CB 3.29Å; F278-S282 WeakPolarHBondContact O-CB 3.41Å; F278-S282 PolarHBondContact O-N 3.4Å; S282-C284 VanDerWaalsContact C-N 3.25Å; S282-C284 PolarHBondContact O-N 2.85Å; S282-D419 WeakPolarHBondContact CB-OD1 3.5Å; S282-D419 PolarHBondContact OG-OD1 2.76Å; S282-D419 PolarHBondContact OG-OD2 3.24Å; S282-G535 PolarHBondContact N-O 3.18Å
283	Y	85.8	Confident	90.7	Very high	10 Å²	10	14.5 Å²	14.5	4%	0.039	8%	0.075	C	C	.	.	S	Bend	trans	-82.4	1.6	-179	-63.4	-78.7	0	0	0	114.4	R179 I228 F230 I264 F278 D419 E420	R179-Y283 PolarHBondContact NH1-O 2.81Å; I228-Y283 HydrophobicContact CD1-CD2 4.41Å; I228-Y283 HydrophobicContact CD1-CE2 3.94Å; I228-Y283 HydrophobicContact CG2-CE2 4.45Å; F230-Y283 HydrophobicContact CE1-CD1 4.01Å; F230-Y283 HydrophobicContact CE1-CE1 4.19Å; F230-Y283 HydrophobicContact CE1-CG 4.27Å; F230-Y283 AromaticContact CE2-CE1 3.99Å; F230-Y283 HydrophobicContact CE2-CE1 3.99Å; F230-Y283 AromaticContact CE2-CZ 3.96Å; F230-Y283 AromaticContact CZ-CD1 3.57Å; F230-Y283 HydrophobicContact CZ-CD1 3.57Å; F230-Y283 HydrophobicContact CZ-CD2 4.11Å; F230-Y283 AromaticContact CZ-CE1 3.32Å; F230-Y283 HydrophobicContact CZ-CE1 3.32Å; F230-Y283 AromaticContact CZ-CE2 3.87Å; F230-Y283 HydrophobicContact CZ-CE2 3.87Å; F230-Y283 AromaticContact CZ-CG 3.95Å; F230-Y283 HydrophobicContact CZ-CG 3.95Å; F230-Y283 AromaticContact CZ-CZ 3.46Å; F230-Y283 VanDerWaalsContact CZ-CZ 3.46Å; I264-Y283 HydrophobicContact CD1-CG 4.46Å; F278-Y283 HydrophobicContact CD1-CE2 4.24Å; F278-Y283 AromaticContact CE1-CE2 3.9Å; F278-Y283 HydrophobicContact CE1-CE2 3.9Å; Y283-D419 HydrophobicContact CE1-CB 4.36Å; Y283-E420 WeakPolarHBondContact OH-CG 3.39Å
284	C	84.1	Confident	91.2	Very high	55 Å²	55	14.2 Å²	14.2	37%	0.372	7%	0.074	S	C	.	.			trans	38	62.7	173.2	-70.6	0	0	0	0	114.2	R179 T281 S282	R179-C284 VanDerWaalsContact CZ-O 3.25Å; R179-C284 PolarHBondContact NH2-O 2.86Å; T281-C284 PolarHBondContact O-SG 3.01Å; T281-C284 VanDerWaalsContact O-SG 3.38Å; S282-C284 VanDerWaalsContact C-N 3.25Å; S282-C284 PolarHBondContact O-N 2.85Å
285	P	91.1	Very high	91.4	Very high	9 Å²	9	12 Å²	12	6%	0.058	7%	0.069	C	C	.	.			trans	-62.3	143.1	-176.7	28	-36.2	0	0	0	111.6	A181 I264 L280 V314	A181-P285 HydrophobicContact CB-CB 3.71Å; A181-P285 HydrophobicContact CB-CG 3.72Å; I264-P285 HydrophobicContact CD1-CB 4.18Å; L280-P285 HydrophobicContact CD2-CG 3.95Å; L280-P285 WeakPolarHBondContact O-CD 3.45Å; P285-V314 HydrophobicContact CG-CG1 4.37Å; P285-V314 HydrophobicContact CG-CG2 4.47Å
286	D	91	Very high	91.5	Very high	33 Å²	33	14.4 Å²	14.4	18%	0.176	8%	0.083	C	C	.	.	S	Bend	trans	-71.2	-40.4	176.8	-55.3	-67.7	0	0	0	110.4	R179 P315 L400	R179-D286 WeakPolarHBondContact CB-OD2 3.29Å; R179-D286 PolarHBondContact N-OD2 2.81Å; R179-D286 IonicContact NE-OD2 3.76Å; R179-D286 PolarHBondContact O-N 3.03Å; D286-P315 WeakPolarHBondContact O-CD 3.32Å; D286-L400 WeakPolarHBondContact O-CD1 3.29Å
287	F	94.3	Very high	91.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	159.7	179.8	-52.6	-74.8	0	0	0	111.8	L178 R179 V180 A181 P315 F317 F367 I397 P398 L400	L178-F287 HydrophobicContact CD1-CE2 4.27Å; L178-F287 HydrophobicContact CD2-CE2 4.45Å; R179-F287 PolarHBondContact O-N 3.47Å; R179-F287 VanDerWaalsContact O-N 3.09Å; V180-F287 CarbonylContact C-O 3.49Å; V180-F287 WeakPolarHBondContact CA-O 3.36Å; V180-F287 HydrophobicContact CG2-CB 4.33Å; V180-F287 HydrophobicContact CG2-CD2 4.46Å; A181-F287 PolarHBondContact N-O 2.93Å; F287-P315 HydrophobicContact CD1-CB 4.16Å; F287-F317 HydrophobicContact CB-CE1 4.31Å; F287-F367 HydrophobicContact CD1-CD1 4.21Å; F287-F367 AromaticContact CD1-CE1 3.32Å; F287-F367 HydrophobicContact CD1-CE1 3.32Å; F287-F367 AromaticContact CD1-CZ 3.9Å; F287-F367 HydrophobicContact CD1-CZ 3.9Å; F287-F367 HydrophobicContact CE1-CD1 4.13Å; F287-F367 AromaticContact CE1-CE1 3.68Å; F287-F367 HydrophobicContact CE1-CE1 3.68Å; F287-F367 HydrophobicContact CE1-CZ 4.48Å; F287-F367 HydrophobicContact CG-CE1 4.12Å; F287-I397 HydrophobicContact CD1-CD1 3.92Å; F287-I397 HydrophobicContact CD2-CD1 3.77Å; F287-I397 HydrophobicContact CE1-CD1 3.67Å; F287-I397 HydrophobicContact CE1-CG1 4.25Å; F287-I397 HydrophobicContact CE2-CD1 3.54Å; F287-I397 HydrophobicContact CE2-CG1 3.95Å; F287-I397 HydrophobicContact CG-CD1 3.95Å; F287-I397 HydrophobicContact CZ-CD1 3.48Å; F287-I397 VanDerWaalsContact CZ-CD1 3.48Å; F287-I397 HydrophobicContact CZ-CG1 3.72Å; F287-P398 WeakPolarHBondContact CZ-O 3.5Å; F287-L400 HydrophobicContact CD1-CD1 4.18Å; F287-L400 HydrophobicContact CD1-CG 4.45Å; F287-L400 HydrophobicContact CE1-CD1 3.75Å; F287-L400 HydrophobicContact CE1-CD2 3.61Å; F287-L400 HydrophobicContact CE1-CG 3.55Å; F287-L400 HydrophobicContact CZ-CD1 4.16Å; F287-L400 HydrophobicContact CZ-CD2 3.97Å; F287-L400 HydrophobicContact CZ-CG 3.63Å
288	A	95.5	Very high	91.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.4	170.9	0	0	0	0	0	111.1	A181 L183 A309 V314 P315 I316 F317	A181-A288 CarbonylContact O-C 3.46Å; A181-A288 WeakPolarHBondContact O-CA 3.41Å; L183-A288 HydrophobicContact CD1-CB 3.96Å; A288-A309 HydrophobicContact CB-CB 4.19Å; A288-V314 HydrophobicContact CB-CG1 3.84Å; A288-P315 PolarHBondContact N-O 3.28Å; A288-I316 HydrophobicContact CB-CG1 4.15Å; A288-I316 VanDerWaalsContact O-CA 3.29Å; A288-I316 WeakPolarHBondContact O-CA 3.22Å; A288-F317 PolarHBondContact O-N 3.4Å
289	M	97.1	Very high	91.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.9	172	-177.9	168.9	67.1	0	0	109.2	V180 A181 V182 L183 L193 L194 V291 F317 V319 L390 F394	V180-M289 HydrophobicContact CG1-CB 3.85Å; A181-M289 PolarHBondContact O-N 3.37Å; V182-M289 HydrophobicContact CB-CE 4.29Å; V182-M289 HydrophobicContact CG1-CE 3.7Å; V182-M289 HydrophobicContact CG2-CE 3.68Å; L183-M289 PolarHBondContact N-O 3.32Å; L193-M289 HydrophobicContact CD2-CE 3.96Å; L193-M289 HydrophobicContact CD2-SD 4.12Å; L194-M289 HydrophobicContact CD2-CE 4.45Å; M289-V291 HydrophobicContact CE-CG2 4Å; M289-V291 HydrophobicContact CG-CG2 4.08Å; M289-V291 HydrophobicContact SD-CG2 4.45Å; M289-F317 HydrophobicContact CB-CE1 4.06Å; M289-F317 HydrophobicContact CB-CE2 3.73Å; M289-F317 HydrophobicContact CB-CZ 3.44Å; M289-F317 VanDerWaalsContact CB-CZ 3.44Å; M289-F317 HydrophobicContact CG-CD2 4.23Å; M289-F317 HydrophobicContact CG-CE2 3.43Å; M289-F317 VanDerWaalsContact CG-CE2 3.43Å; M289-F317 HydrophobicContact CG-CZ 3.7Å; M289-F317 HydrophobicContact SD-CE2 3.74Å; M289-F317 HydrophobicContact SD-CZ 4Å; M289-V319 HydrophobicContact CG-CB 4.42Å; M289-V319 HydrophobicContact CG-CG2 3.79Å; M289-V319 HydrophobicContact SD-CG2 3.73Å; M289-L390 HydrophobicContact SD-CD2 4.48Å; M289-F394 HydrophobicContact SD-CZ 4.13Å
290	L	96.9	Very high	91.3	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	104.2	175.4	-175.1	65.7	0	0	0	110.5	L183 V292 T302 H305 L306 I316 F317 I318 V319	L183-L290 HydrophobicContact CB-CD1 3.94Å; L183-L290 CarbonylContact O-C 3.57Å; L183-L290 WeakPolarHBondContact O-CA 3.43Å; L290-V292 HydrophobicContact CD2-CG2 4.4Å; L290-V292 HydrophobicContact CG-CG2 4.09Å; L290-T302 HydrophobicContact CD1-CG2 4.26Å; L290-T302 HydrophobicContact CD2-CG2 4.11Å; L290-T302 HydrophobicContact CG-CG2 4.42Å; L290-H305 HydrophobicContact CD1-CB 4.3Å; L290-L306 HydrophobicContact CD2-CB 4.13Å; L290-L306 HydrophobicContact CD2-CD1 4.28Å; L290-I316 HydrophobicContact CB-CG2 3.97Å; L290-F317 PolarHBondContact N-O 2.88Å; L290-I318 HydrophobicContact CB-CG1 4.35Å; L290-I318 HydrophobicContact CD2-CD1 4.39Å; L290-I318 WeakPolarHBondContact O-CA 3.24Å; L290-I318 WeakPolarHBondContact O-CG2 3.39Å; L290-V319 PolarHBondContact O-N 3.33Å
291	V	96.8	Very high	91.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.1	177.9	-169.3	0	0	0	0	110.5	V182 L183 G184 S188 K190 L193 M289 V319	V182-V291 HydrophobicContact CG1-CG2 3.92Å; L183-V291 PolarHBondContact O-N 3.21Å; G184-V291 WeakPolarHBondContact CA-O 3.41Å; S188-V291 WeakPolarHBondContact CB-O 3.16Å; S188-V291 WeakPolarHBondContact O-CG1 3.44Å; S188-V291 PolarHBondContact OG-O 2.91Å; S188-V291 VanDerWaalsContact OG-O 3.07Å; K190-V291 HydrophobicContact CG-CB 3.89Å; K190-V291 HydrophobicContact CG-CG2 4.04Å; L193-V291 HydrophobicContact CD2-CG2 4.26Å; M289-V291 HydrophobicContact CE-CG2 4Å; M289-V291 HydrophobicContact CG-CG2 4.08Å; M289-V291 HydrophobicContact SD-CG2 4.45Å; V291-V319 CarbonylContact C-O 3.58Å; V291-V319 WeakPolarHBondContact CA-O 3.48Å
292	V	96.5	Very high	91.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136	-179.7	-176.5	0	0	0	0	108.7	L290 G297 T302 I318 V319 I320 S321 T334 L338	L290-V292 HydrophobicContact CD2-CG2 4.4Å; L290-V292 HydrophobicContact CG-CG2 4.09Å; V292-G297 VanDerWaalsContact CG1-O 3.27Å; V292-G297 WeakPolarHBondContact CG1-O 3.36Å; V292-T302 HydrophobicContact CG2-CG2 3.87Å; V292-I318 HydrophobicContact CG2-CG2 4.25Å; V292-V319 PolarHBondContact N-O 3.22Å; V292-I320 CarbonylContact O-C 3.54Å; V292-I320 VanDerWaalsContact O-CA 3.23Å; V292-I320 WeakPolarHBondContact O-CA 3.14Å; V292-S321 PolarHBondContact O-N 3.04Å; V292-S321 PolarHBondContact O-OG 3.07Å; V292-T334 HydrophobicContact CG1-CG2 4.5Å; V292-L338 HydrophobicContact CG2-CD2 4.18Å
293	S	95.3	Very high	91.4	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.007	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.2	177	-153.2	0	0	0	0	111.3	N295 T296 G297 K322	S293-N295 WeakPolarHBondContact CB-OD1 3.35Å; S293-N295 PolarHBondContact O-N 2.96Å; S293-N295 PolarHBondContact OG-OD1 2.8Å; S293-T296 WeakPolarHBondContact CB-OG1 3.35Å; S293-T296 PolarHBondContact O-N 3.46Å; S293-G297 WeakPolarHBondContact O-CA 3.43Å; S293-G297 PolarHBondContact O-N 2.82Å; S293-K322 WeakPolarHBondContact OG-CD 3.46Å
294	A	94.7	Very high	91.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34	177.6	0	0	0	0	0	112.7	I320 S321 V323 C326 V331 T334	A294-I320 HydrophobicContact CB-CG2 3.77Å; A294-S321 WeakPolarHBondContact CB-O 3.42Å; A294-S321 PolarHBondContact N-O 2.91Å; A294-V323 HydrophobicContact CB-CG1 4.27Å; A294-C326 HydrophobicContact CB-CB 4.26Å; A294-V331 HydrophobicContact CB-CG2 4.24Å; A294-T334 PolarHBondContact O-OG1 2.93Å; A294-T334 VanDerWaalsContact O-OG1 3.04Å
295	N	90.3	Very high	91.7	Very high	82 Å²	82	21.5 Å²	21.5	44%	0.439	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-43.8	-176.8	67.9	-16.5	0	0	0	113.2	S293	S293-N295 WeakPolarHBondContact CB-OD1 3.35Å; S293-N295 PolarHBondContact O-N 2.96Å; S293-N295 PolarHBondContact OG-OD1 2.8Å
296	T	90.8	Very high	91.7	Very high	76 Å²	76	21.4 Å²	21.4	47%	0.466	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-26.7	-177.6	58.7	0	0	0	0	112.7	S293	S293-T296 WeakPolarHBondContact CB-OG1 3.35Å; S293-T296 PolarHBondContact O-N 3.46Å
297	G	91.3	Very high	91.5	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.01	12%	0.123	C	C	.	.			trans	60.1	-144.5	-169.6	0	0	0	0	0	112.2	V292 S293 A299	V292-G297 VanDerWaalsContact CG1-O 3.27Å; V292-G297 WeakPolarHBondContact CG1-O 3.36Å; S293-G297 WeakPolarHBondContact O-CA 3.43Å; S293-G297 PolarHBondContact O-N 2.82Å; G297-A299 PolarHBondContact O-N 2.81Å; G297-A299 VanDerWaalsContact O-N 3.1Å
298	I	89.9	Confident	91.2	Very high	22 Å²	22	19.9 Å²	19.9	11%	0.113	12%	0.123	C	C	.	.	S	Bend	trans	-75.8	99.5	-179.7	-50.5	179.9	0	0	0	109.5	T302 R303 Q337 L338 V341	I298-T302 HydrophobicContact CG2-CG2 4.03Å; I298-R303 HydrophobicContact CG2-CG 3.66Å; I298-Q337 HydrophobicContact CD1-CG 3.8Å; I298-Q337 HydrophobicContact CG1-CG 4.2Å; I298-L338 HydrophobicContact CD1-CD2 3.72Å; I298-L338 HydrophobicContact CD1-CG 4.24Å; I298-L338 HydrophobicContact CG1-CD2 3.65Å; I298-L338 HydrophobicContact CG1-CG 4.21Å; I298-V341 HydrophobicContact CD1-CB 4.04Å; I298-V341 HydrophobicContact CD1-CG2 3.49Å; I298-V341 VanDerWaalsContact CD1-CG2 3.49Å
299	A	86.8	Confident	90.9	Very high	33 Å²	33	19.9 Å²	19.9	27%	0.273	12%	0.123	S	C	.	.			trans	-133.3	156.8	-178.6	0	0	0	0	0	112.2	N185 G297 T301 T302	N185-A299 WeakPolarHBondContact CB-O 3.29Å; N185-A299 VanDerWaalsContact CG-O 3.28Å; G297-A299 PolarHBondContact O-N 2.81Å; G297-A299 VanDerWaalsContact O-N 3.1Å; A299-T301 PolarHBondContact O-N 2.88Å; A299-T302 WeakPolarHBondContact O-CB 3.01Å; A299-T302 PolarHBondContact O-N 2.82Å; A299-T302 PolarHBondContact O-OG1 3.09Å; A299-T302 VanDerWaalsContact O-OG1 3.08Å
300	G	84.3	Confident	90.4	Very high	69 Å²	69	21.4 Å²	21.4	71%	0.711	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	-122.2	172.2	0	0	0	0	0	113.4	T302	G300-T302 VanDerWaalsContact C-N 3.29Å; G300-T302 PolarHBondContact O-N 2.74Å
301	T	88.1	Confident	89.8	Confident	8 Å²	8	21.6 Å²	21.6	5%	0.049	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-1.9	-174.6	54.8	0	0	0	0	114.2	N185 G268 H270 A299 R303 E304 H305	N185-T301 WeakPolarHBondContact CA-OG1 3.23Å; N185-T301 PolarHBondContact OD1-N 3.08Å; N185-T301 PolarHBondContact OD1-OG1 2.89Å; G268-T301 PolarHBondContact O-OG1 3.17Å; H270-T301 HydrophobicContact CB-CG2 3.95Å; A299-T301 PolarHBondContact O-N 2.88Å; T301-R303 VanDerWaalsContact C-N 3.34Å; T301-R303 PolarHBondContact O-N 3.44Å; T301-E304 PolarHBondContact O-N 3.4Å; T301-E304 VanDerWaalsContact O-N 3.17Å; T301-H305 WeakPolarHBondContact O-CB 3.33Å; T301-H305 PolarHBondContact O-CD2 3.17Å; T301-H305 PolarHBondContact O-N 3.13Å
302	T	91.2	Very high	89.2	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.018	14%	0.136	C	C	.	.	H	α-helix	trans	-56.5	-45	-178.2	-63.8	0	0	0	0	112.5	N185 L290 V292 I298 A299 G300 L306	N185-T302 WeakPolarHBondContact CB-OG1 3.49Å; L290-T302 HydrophobicContact CD1-CG2 4.26Å; L290-T302 HydrophobicContact CD2-CG2 4.11Å; L290-T302 HydrophobicContact CG-CG2 4.42Å; V292-T302 HydrophobicContact CG2-CG2 3.87Å; I298-T302 HydrophobicContact CG2-CG2 4.03Å; A299-T302 WeakPolarHBondContact O-CB 3.01Å; A299-T302 PolarHBondContact O-N 2.82Å; A299-T302 PolarHBondContact O-OG1 3.09Å; A299-T302 VanDerWaalsContact O-OG1 3.08Å; G300-T302 VanDerWaalsContact C-N 3.29Å; G300-T302 PolarHBondContact O-N 2.74Å; T302-L306 WeakPolarHBondContact O-CB 3.33Å; T302-L306 PolarHBondContact O-N 3.14Å
303	R	87.1	Confident	88.8	Confident	77 Å²	77	28.7 Å²	28.7	29%	0.291	16%	0.164	S	C	.	.	H	α-helix	trans	-67.8	-39.8	178.5	-73.6	-172.3	174.6	144.8	-4.4	112.6	L8 S11 I298 T301 L306 G307	L8-R303 WeakPolarHBondContact O-CB 3.42Å; S11-R303 PolarHBondContact O-NH1 3.01Å; S11-R303 VanDerWaalsContact O-NH1 3.14Å; S11-R303 VanDerWaalsContact OG-CZ 3.32Å; S11-R303 PolarHBondContact OG-NH1 3.33Å; I298-R303 HydrophobicContact CG2-CG 3.66Å; T301-R303 VanDerWaalsContact C-N 3.34Å; T301-R303 PolarHBondContact O-N 3.44Å; R303-L306 PolarHBondContact O-N 3.15Å; R303-G307 PolarHBondContact O-N 2.73Å
304	E	85.9	Confident	88.6	Confident	35 Å²	35	29.2 Å²	29.2	16%	0.164	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-44.1	178.3	-172.6	166.9	-158.5	0	0	110.6	F9 L273 T301 G307 L308 R580	F9-E304 HydrophobicContact CD1-CG 4.17Å; F9-E304 HydrophobicContact CE1-CG 4.02Å; L273-E304 HydrophobicContact CD1-CG 4.5Å; L273-E304 HydrophobicContact CD2-CG 4.18Å; L273-E304 WeakPolarHBondContact CD2-OE1 3.4Å; L273-E304 WeakPolarHBondContact CD2-OE2 3.26Å; T301-E304 PolarHBondContact O-N 3.4Å; T301-E304 VanDerWaalsContact O-N 3.17Å; E304-G307 PolarHBondContact O-N 3.05Å; E304-L308 HydrophobicContact CG-CD1 4.46Å; E304-L308 VanDerWaalsContact O-CG 3.24Å; E304-L308 WeakPolarHBondContact O-CG 3.47Å; E304-L308 PolarHBondContact O-N 2.78Å; E304-R580 IonicContact OE1-NH2 3.64Å
305	H	90.8	Very high	88.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-42.4	175.6	-70.6	-170	0	0	0	112.8	L183 G184 A267 L273 L290 T301 G307 L308 A309	L183-H305 HydrophobicContact CB-CB 4.11Å; L183-H305 HydrophobicContact CD1-CB 4.34Å; L183-H305 HydrophobicContact CD2-CB 4.38Å; G184-H305 PolarHBondContact N-ND1 3.2Å; A267-H305 PolarHBondContact O-CE1 3.21Å; L273-H305 WeakPolarHBondContact CD1-NE2 3.29Å; L290-H305 HydrophobicContact CD1-CB 4.3Å; T301-H305 WeakPolarHBondContact O-CB 3.33Å; T301-H305 PolarHBondContact O-CD2 3.17Å; T301-H305 PolarHBondContact O-N 3.13Å; H305-G307 VanDerWaalsContact C-N 3.33Å; H305-L308 PolarHBondContact O-N 2.87Å; H305-A309 PolarHBondContact O-N 3Å
306	L	90.8	Very high	88.6	Confident	8 Å²	8	26.3 Å²	26.3	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-47.8	172.7	176.7	60.4	0	0	0	110.7	L8 L290 T302 R303 L308 A309 M310 I316 V341	L8-L306 HydrophobicContact CD2-CD2 4.27Å; L290-L306 HydrophobicContact CD2-CB 4.13Å; L290-L306 HydrophobicContact CD2-CD1 4.28Å; T302-L306 WeakPolarHBondContact O-CB 3.33Å; T302-L306 PolarHBondContact O-N 3.14Å; R303-L306 PolarHBondContact O-N 3.15Å; L306-L308 VanDerWaalsContact C-N 3.34Å; L306-L308 PolarHBondContact O-N 2.7Å; L306-A309 PolarHBondContact O-N 3.31Å; L306-M310 HydrophobicContact CD1-CG 4.21Å; L306-M310 WeakPolarHBondContact O-CB 3.39Å; L306-M310 VanDerWaalsContact O-CG 3.24Å; L306-M310 WeakPolarHBondContact O-CG 3.43Å; L306-M310 PolarHBondContact O-N 3.42Å; L306-I316 HydrophobicContact CD1-CD1 3.56Å; L306-V341 HydrophobicContact CD2-CG1 3.77Å
307	G	86.8	Confident	88.9	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-40.1	177.6	0	0	0	0	0	112.9	F9 R303 E304 H305 A311	F9-G307 VanDerWaalsContact CZ-CA 3.43Å; R303-G307 PolarHBondContact O-N 2.73Å; E304-G307 PolarHBondContact O-N 3.05Å; H305-G307 VanDerWaalsContact C-N 3.33Å; G307-A311 WeakPolarHBondContact O-CB 3.31Å; G307-A311 PolarHBondContact O-N 3.25Å
308	L	88.2	Confident	89.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.5	-48.4	176.9	-72.8	171.5	0	0	0	112	L273 I277 L280 E304 H305 L306 M310 A311 L312 L578 T584	L273-L308 HydrophobicContact CD1-CD1 3.96Å; I277-L308 HydrophobicContact CD1-CD1 4.15Å; I277-L308 HydrophobicContact CD1-CD2 3.73Å; I277-L308 HydrophobicContact CG1-CD1 3.76Å; I277-L308 HydrophobicContact CG1-CD2 4.01Å; L280-L308 HydrophobicContact CD1-CB 3.97Å; E304-L308 HydrophobicContact CG-CD1 4.46Å; E304-L308 VanDerWaalsContact O-CG 3.24Å; E304-L308 WeakPolarHBondContact O-CG 3.47Å; E304-L308 PolarHBondContact O-N 2.78Å; H305-L308 PolarHBondContact O-N 2.87Å; L306-L308 VanDerWaalsContact C-N 3.34Å; L306-L308 PolarHBondContact O-N 2.7Å; L308-M310 PolarHBondContact O-N 3.27Å; L308-A311 PolarHBondContact O-N 3.32Å; L308-L312 WeakPolarHBondContact O-CB 3.47Å; L308-L312 WeakPolarHBondContact O-CG 3.5Å; L308-L312 PolarHBondContact O-N 3.2Å; L308-L578 HydrophobicContact CD2-CD1 3.35Å; L308-T584 HydrophobicContact CD2-CG2 4.33Å
309	A	89.9	Confident	89.5	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.6	-40.5	178.5	0	0	0	0	0	111.6	L183 A288 H305 L306 L312 K313 V314 I316	L183-A309 HydrophobicContact CD1-CB 3.93Å; A288-A309 HydrophobicContact CB-CB 4.19Å; H305-A309 PolarHBondContact O-N 3Å; L306-A309 PolarHBondContact O-N 3.31Å; A309-L312 CarbonylContact O-C 3.59Å; A309-L312 PolarHBondContact O-N 3.07Å; A309-K313 PolarHBondContact O-N 2.72Å; A309-V314 HydrophobicContact CB-CB 4.46Å; A309-V314 PolarHBondContact O-N 3.25Å; A309-I316 HydrophobicContact CB-CD1 3.35Å; A309-I316 HydrophobicContact CB-CG1 3.74Å
310	M	86.8	Confident	90	Very high	32 Å²	32	20 Å²	20	16%	0.158	11%	0.112	C	C	.	.	H	α-helix	trans	-62.3	-44	173.4	-72.2	-61	-56.1	0	0	112.5	L8 L306 L308 K313 I316 C347 K349	L8-M310 HydrophobicContact CD1-CG 4.46Å; L306-M310 HydrophobicContact CD1-CG 4.21Å; L306-M310 WeakPolarHBondContact O-CB 3.39Å; L306-M310 VanDerWaalsContact O-CG 3.24Å; L306-M310 WeakPolarHBondContact O-CG 3.43Å; L306-M310 PolarHBondContact O-N 3.42Å; L308-M310 PolarHBondContact O-N 3.27Å; M310-K313 PolarHBondContact O-N 2.89Å; M310-I316 HydrophobicContact CG-CD1 4.03Å; M310-I316 HydrophobicContact SD-CD1 4.06Å; M310-C347 WeakPolarHBondContact CE-O 3.39Å; M310-K349 WeakPolarHBondContact SD-CE 3.3Å
311	A	83	Confident	90.6	Very high	6 Å²	6	16.8 Å²	16.8	5%	0.05	8%	0.078	C	C	.	.	H	α-helix	trans	-62.5	-43	177.9	0	0	0	0	0	112.5	G307 L308 K313 I587	G307-A311 WeakPolarHBondContact O-CB 3.31Å; G307-A311 PolarHBondContact O-N 3.25Å; L308-A311 PolarHBondContact O-N 3.32Å; A311-K313 PolarHBondContact O-N 2.82Å; A311-I587 HydrophobicContact CB-CB 4.36Å; A311-I587 HydrophobicContact CB-CD1 3.59Å; A311-I587 HydrophobicContact CB-CG2 3.7Å
312	L	85.8	Confident	90.9	Very high	13 Å²	13	19.3 Å²	19.3	7%	0.068	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-0	176.2	-64.9	173	0	0	0	112.5	L280 T281 L308 A309 V314 K576	L280-L312 HydrophobicContact CB-CD1 3.47Å; L280-L312 VanDerWaalsContact CB-CD1 3.47Å; L280-L312 HydrophobicContact CD1-CD1 4.22Å; L280-L312 HydrophobicContact CG-CD1 4.47Å; T281-L312 HydrophobicContact CG2-CD1 3.97Å; T281-L312 HydrophobicContact CG2-CD2 4Å; L308-L312 WeakPolarHBondContact O-CB 3.47Å; L308-L312 WeakPolarHBondContact O-CG 3.5Å; L308-L312 PolarHBondContact O-N 3.2Å; A309-L312 CarbonylContact O-C 3.59Å; A309-L312 PolarHBondContact O-N 3.07Å; L312-V314 HydrophobicContact CB-CG2 3.99Å; L312-V314 PolarHBondContact O-N 3.25Å; L312-K576 HydrophobicContact CD2-CB 4.43Å; L312-K576 WeakPolarHBondContact O-CE 3.13Å; L312-K576 PolarHBondContact O-NZ 2.66Å
313	K	87	Confident	91.1	Very high	136 Å²	136	19.8 Å²	19.8	59%	0.591	9%	0.091	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	33.9	-177.6	-54	179.4	179	176.7	0	113.1	A309 M310 A311	A309-K313 PolarHBondContact O-N 2.72Å; M310-K313 PolarHBondContact O-N 2.89Å; A311-K313 PolarHBondContact O-N 2.82Å
314	V	90.1	Very high	91.4	Very high	13 Å²	13	18.8 Å²	18.8	8%	0.079	9%	0.092	C	C	.	.			trans	-84.2	124.1	173.4	-177.5	0	0	0	0	107.6	P285 A288 A309 L312 I316	P285-V314 HydrophobicContact CG-CG1 4.37Å; P285-V314 HydrophobicContact CG-CG2 4.47Å; A288-V314 HydrophobicContact CB-CG1 3.84Å; A309-V314 HydrophobicContact CB-CB 4.46Å; A309-V314 PolarHBondContact O-N 3.25Å; L312-V314 HydrophobicContact CB-CG2 3.99Å; L312-V314 PolarHBondContact O-N 3.25Å; V314-I316 WeakPolarHBondContact O-CG1 3.44Å
315	P	92.5	Very high	91.7	Very high	18 Å²	18	22.6 Å²	22.6	12%	0.117	11%	0.113	C	C	.	.			trans	-61.6	141.6	175	-24.4	36	0	0	0	112.1	D286 F287 A288 F367 L400	D286-P315 WeakPolarHBondContact O-CD 3.32Å; F287-P315 HydrophobicContact CD1-CB 4.16Å; A288-P315 PolarHBondContact N-O 3.28Å; P315-F367 HydrophobicContact CB-CE1 4.45Å; P315-F367 HydrophobicContact CB-CE2 3.96Å; P315-F367 HydrophobicContact CB-CZ 3.68Å; P315-L400 HydrophobicContact CG-CD1 3.71Å; P315-L400 HydrophobicContact CG-CD2 4.4Å
316	I	94	Very high	91.8	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.7	-170.2	-52.1	169.8	0	0	0	110	A288 L290 L306 A309 M310 V314 F367 T374	A288-I316 HydrophobicContact CB-CG1 4.15Å; A288-I316 VanDerWaalsContact O-CA 3.29Å; A288-I316 WeakPolarHBondContact O-CA 3.22Å; L290-I316 HydrophobicContact CB-CG2 3.97Å; L306-I316 HydrophobicContact CD1-CD1 3.56Å; A309-I316 HydrophobicContact CB-CD1 3.35Å; A309-I316 HydrophobicContact CB-CG1 3.74Å; M310-I316 HydrophobicContact CG-CD1 4.03Å; M310-I316 HydrophobicContact SD-CD1 4.06Å; V314-I316 WeakPolarHBondContact O-CG1 3.44Å; I316-F367 VanDerWaalsContact O-CE2 3.24Å; I316-F367 WeakPolarHBondContact O-CE2 3.41Å; I316-T374 WeakPolarHBondContact O-CG2 3.47Å; I316-T374 PolarHBondContact O-OG1 3.19Å
317	F	96.3	Very high	92	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.8	161.3	65.9	-85.3	0	0	0	109.6	V180 F287 A288 M289 L290 V319 F367 P375 F377 L390 F393 F394	V180-F317 HydrophobicContact CG1-CE1 4.12Å; V180-F317 HydrophobicContact CG1-CZ 4.07Å; F287-F317 HydrophobicContact CB-CE1 4.31Å; A288-F317 PolarHBondContact O-N 3.4Å; M289-F317 HydrophobicContact CB-CE1 4.06Å; M289-F317 HydrophobicContact CB-CE2 3.73Å; M289-F317 HydrophobicContact CB-CZ 3.44Å; M289-F317 VanDerWaalsContact CB-CZ 3.44Å; M289-F317 HydrophobicContact CG-CD2 4.23Å; M289-F317 HydrophobicContact CG-CE2 3.43Å; M289-F317 VanDerWaalsContact CG-CE2 3.43Å; M289-F317 HydrophobicContact CG-CZ 3.7Å; M289-F317 HydrophobicContact SD-CE2 3.74Å; M289-F317 HydrophobicContact SD-CZ 4Å; L290-F317 PolarHBondContact N-O 2.88Å; F317-V319 HydrophobicContact CD2-CG2 4.19Å; F317-V319 HydrophobicContact CE2-CG2 4.04Å; F317-F367 HydrophobicContact CB-CE2 4.48Å; F317-F367 HydrophobicContact CB-CZ 4.26Å; F317-F367 AromaticContact CD1-CE1 3.97Å; F317-F367 HydrophobicContact CD1-CE1 3.97Å; F317-F367 HydrophobicContact CD1-CZ 4.04Å; F317-P375 HydrophobicContact CB-CB 4.22Å; F317-P375 HydrophobicContact CB-CG 4.35Å; F317-F377 HydrophobicContact CD2-CD2 4.24Å; F317-F377 HydrophobicContact CD2-CE2 4.12Å; F317-L390 HydrophobicContact CE2-CD1 4.02Å; F317-F393 HydrophobicContact CB-CZ 4.38Å; F317-F393 AromaticContact CD1-CE1 3.91Å; F317-F393 HydrophobicContact CD1-CE1 3.91Å; F317-F393 HydrophobicContact CD1-CZ 4.18Å; F317-F393 HydrophobicContact CD2-CE1 4.1Å; F317-F393 AromaticContact CE1-CE1 4Å; F317-F393 HydrophobicContact CE1-CE1 4Å; F317-F393 HydrophobicContact CE2-CE1 4.18Å; F317-F393 AromaticContact CG-CE1 3.96Å; F317-F393 HydrophobicContact CG-CE1 3.96Å; F317-F393 HydrophobicContact CG-CZ 4.16Å; F317-F393 HydrophobicContact CZ-CE1 4.13Å; F317-F394 HydrophobicContact CE1-CE1 4.3Å; F317-F394 HydrophobicContact CE2-CE1 4.32Å; F317-F394 HydrophobicContact CE2-CZ 4.13Å; F317-F394 AromaticContact CZ-CE1 3.57Å; F317-F394 HydrophobicContact CZ-CE1 3.57Å; F317-F394 AromaticContact CZ-CZ 3.71Å; F317-F394 HydrophobicContact CZ-CZ 3.71Å
318	I	96.9	Very high	92.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138	-172	-55.7	-170.7	0	0	0	110	L290 V292 I320 L338 L342 T374 P375 I376 F377	L290-I318 HydrophobicContact CB-CG1 4.35Å; L290-I318 HydrophobicContact CD2-CD1 4.39Å; L290-I318 WeakPolarHBondContact O-CA 3.24Å; L290-I318 WeakPolarHBondContact O-CG2 3.39Å; V292-I318 HydrophobicContact CG2-CG2 4.25Å; I318-I320 HydrophobicContact CG2-CG1 4.46Å; I318-L338 HydrophobicContact CD1-CD2 4.12Å; I318-L338 HydrophobicContact CG2-CD1 4.04Å; I318-L342 HydrophobicContact CD1-CD1 3.73Å; I318-L342 HydrophobicContact CD1-CD2 4.17Å; I318-L342 HydrophobicContact CD1-CG 4.2Å; I318-T374 HydrophobicContact CD1-CG2 4.22Å; I318-T374 HydrophobicContact CG1-CG2 3.93Å; I318-P375 PolarHBondContact N-O 2.81Å; I318-I376 HydrophobicContact CB-CG1 4.28Å; I318-I376 HydrophobicContact CB-CG2 4.49Å; I318-I376 WeakPolarHBondContact O-CA 3.41Å; I318-F377 PolarHBondContact O-N 3.39Å
319	V	97.7	Very high	92.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	118.1	173.2	176.4	0	0	0	0	109.1	L193 M289 L290 V291 V292 F317 F377 L379 L390	L193-V319 HydrophobicContact CD2-CG1 3.83Å; M289-V319 HydrophobicContact CG-CB 4.42Å; M289-V319 HydrophobicContact CG-CG2 3.79Å; M289-V319 HydrophobicContact SD-CG2 3.73Å; L290-V319 PolarHBondContact O-N 3.33Å; V291-V319 CarbonylContact C-O 3.58Å; V291-V319 WeakPolarHBondContact CA-O 3.48Å; V292-V319 PolarHBondContact N-O 3.22Å; F317-V319 HydrophobicContact CD2-CG2 4.19Å; F317-V319 HydrophobicContact CE2-CG2 4.04Å; V319-F377 HydrophobicContact CG2-CB 4.36Å; V319-F377 HydrophobicContact CG2-CD2 4.44Å; V319-L379 HydrophobicContact CG1-CD1 4.14Å; V319-L379 HydrophobicContact CG1-CD2 3.36Å; V319-L379 HydrophobicContact CG1-CG 3.62Å; V319-L390 HydrophobicContact CG2-CD1 4.25Å; V319-L390 HydrophobicContact CG2-CD2 4.26Å
320	I	97.3	Very high	92.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	110.6	173.6	-57.3	175.8	0	0	0	108.2	V292 A294 I318 V323 T334 V335 L338 I376 F377 T378 L379	V292-I320 CarbonylContact O-C 3.54Å; V292-I320 VanDerWaalsContact O-CA 3.23Å; V292-I320 WeakPolarHBondContact O-CA 3.14Å; A294-I320 HydrophobicContact CB-CG2 3.77Å; I318-I320 HydrophobicContact CG2-CG1 4.46Å; I320-V323 HydrophobicContact CG2-CG1 4.38Å; I320-T334 HydrophobicContact CD1-CG2 4.39Å; I320-V335 HydrophobicContact CD1-CB 4.4Å; I320-V335 HydrophobicContact CD1-CG2 3.41Å; I320-V335 VanDerWaalsContact CD1-CG2 3.41Å; I320-L338 HydrophobicContact CD1-CD1 3.64Å; I320-L338 HydrophobicContact CG1-CD1 3.81Å; I320-I376 HydrophobicContact CD1-CG2 3.79Å; I320-I376 HydrophobicContact CG1-CG2 4.16Å; I320-F377 PolarHBondContact N-O 3.17Å; I320-T378 HydrophobicContact CB-CG2 4.15Å; I320-T378 HydrophobicContact CD1-CG2 4.13Å; I320-L379 PolarHBondContact O-N 3.31Å
321	S	95.7	Very high	93.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	169.3	-177.9	72.1	0	0	0	0	112.5	S188 V292 A294 V323 L379	S188-S321 PolarHBondContact O-OG 2.85Å; V292-S321 PolarHBondContact O-N 3.04Å; V292-S321 PolarHBondContact O-OG 3.07Å; A294-S321 WeakPolarHBondContact CB-O 3.42Å; A294-S321 PolarHBondContact N-O 2.91Å; S321-V323 VanDerWaalsContact C-N 3.3Å; S321-V323 PolarHBondContact O-N 3Å; S321-L379 CarbonylContact C-O 3.58Å; S321-L379 WeakPolarHBondContact CA-O 3.46Å
322	K	94.5	Very high	93.7	Very high	60 Å²	60	46.3 Å²	46.3	26%	0.261	24%	0.236	S	C	.	.			trans	59.3	35.8	175.8	-49	-167.9	-166.3	173.9	0	114	D187 S293 D324 L325 L379	D187-K322 WeakPolarHBondContact O-CE 3.37Å; D187-K322 PolarHBondContact O-NZ 3.06Å; S293-K322 WeakPolarHBondContact OG-CD 3.46Å; K322-D324 VanDerWaalsContact CA-OD1 3.29Å; K322-D324 WeakPolarHBondContact CA-OD1 3.4Å; K322-D324 PolarHBondContact O-N 2.95Å; K322-L325 HydrophobicContact CB-CD1 4.19Å; K322-L325 HydrophobicContact CB-CG 4.45Å; K322-L325 HydrophobicContact CD-CD1 4.03Å; K322-L325 PolarHBondContact O-N 3.06Å; K322-L379 PolarHBondContact N-O 3.14Å
323	V	95	Very high	94.1	Very high	13 Å²	13	52.5 Å²	52.5	8%	0.079	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-63.8	-25.1	176.3	-59.6	0	0	0	0	112	A294 I320 S321 L325 C326 V331 L379	A294-V323 HydrophobicContact CB-CG1 4.27Å; I320-V323 HydrophobicContact CG2-CG1 4.38Å; S321-V323 VanDerWaalsContact C-N 3.3Å; S321-V323 PolarHBondContact O-N 3Å; V323-L325 PolarHBondContact O-N 2.86Å; V323-C326 PolarHBondContact O-N 2.84Å; V323-C326 VanDerWaalsContact O-N 3.08Å; V323-V331 HydrophobicContact CB-CG2 4.22Å; V323-V331 HydrophobicContact CG1-CG1 4.31Å; V323-V331 HydrophobicContact CG1-CG2 4.17Å; V323-L379 WeakPolarHBondContact CG2-O 3.18Å
324	D	93.8	Very high	94.5	Very high	57 Å²	57	46.3 Å²	46.3	31%	0.305	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.6	-25.5	175.4	57.3	-71.6	0	0	0	114	K322 S380 T383	K322-D324 VanDerWaalsContact CA-OD1 3.29Å; K322-D324 WeakPolarHBondContact CA-OD1 3.4Å; K322-D324 PolarHBondContact O-N 2.95Å; D324-S380 WeakPolarHBondContact CB-OG 3.34Å; D324-S380 WeakPolarHBondContact OD1-CB 3.47Å; D324-S380 PolarHBondContact OD1-OG 3.1Å; D324-T383 HydrophobicContact CB-CG2 3.82Å
325	L	92.9	Very high	94.7	Very high	114 Å²	114	46.4 Å²	46.4	60%	0.597	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-88.6	-4.3	178.9	-58.7	-178.5	0	0	0	113.2	K322 V323	K322-L325 HydrophobicContact CB-CD1 4.19Å; K322-L325 HydrophobicContact CB-CG 4.45Å; K322-L325 HydrophobicContact CD-CD1 4.03Å; K322-L325 PolarHBondContact O-N 3.06Å; V323-L325 PolarHBondContact O-N 2.86Å
326	C	93.3	Very high	94.9	Very high	28 Å²	28	52.4 Å²	52.4	19%	0.189	25%	0.253	C	S	.	.	S	Bend	trans	-124.6	150.1	-166.8	-66.7	0	0	0	0	112.3	A294 V323 T330 V331	A294-C326 HydrophobicContact CB-CB 4.26Å; V323-C326 PolarHBondContact O-N 2.84Å; V323-C326 VanDerWaalsContact O-N 3.08Å; C326-T330 HydrophobicContact CB-CG2 4.27Å; C326-V331 HydrophobicContact CB-CG2 4.02Å
327	T	94.5	Very high	94.9	Very high	93 Å²	93	54.7 Å²	54.7	57%	0.571	26%	0.263	S	S	*	.			trans	-73	153	166.6	59.3	0	0	0	0	110.6	A329 T330 V331	T327-A329 PolarHBondContact O-N 2.86Å; T327-T330 WeakPolarHBondContact O-CA 3.47Å; T327-T330 WeakPolarHBondContact O-CB 3.19Å; T327-T330 PolarHBondContact O-N 3.1Å; T327-T330 PolarHBondContact OG1-OG1 2.75Å; T327-V331 PolarHBondContact O-N 3.22Å
328	R	92.4	Very high	94.7	Very high	218 Å²	218	54.9 Å²	54.9	82%	0.823	27%	0.265	S	S	*	.	H	α-helix	trans	-50.8	-42.2	176.7	-69	-175.4	179	175.6	-0.7	112.9	T330 V331 E332	R328-T330 VanDerWaalsContact C-N 3.25Å; R328-T330 PolarHBondContact O-N 3.21Å; R328-V331 PolarHBondContact O-N 3.38Å; R328-E332 WeakPolarHBondContact O-CG 3.26Å; R328-E332 PolarHBondContact O-N 3.23Å
329	A	94.1	Very high	94.6	Very high	59 Å²	59	57.2 Å²	57.2	49%	0.488	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-32.5	176.9	0	0	0	0	0	113.5	T327 R333	T327-A329 PolarHBondContact O-N 2.86Å; A329-R333 WeakPolarHBondContact O-CB 3.49Å; A329-R333 PolarHBondContact O-N 3.45Å; A329-R333 VanDerWaalsContact O-N 3.09Å
330	T	94.3	Very high	94.4	Very high	32 Å²	32	64.7 Å²	64.7	20%	0.196	30%	0.304	C	S	.	.	H	α-helix	trans	-74	-41.8	176.8	-58.5	0	0	0	0	111	C326 T327 R328 R333 T334	C326-T330 HydrophobicContact CB-CG2 4.27Å; T327-T330 WeakPolarHBondContact O-CA 3.47Å; T327-T330 WeakPolarHBondContact O-CB 3.19Å; T327-T330 PolarHBondContact O-N 3.1Å; T327-T330 PolarHBondContact OG1-OG1 2.75Å; R328-T330 VanDerWaalsContact C-N 3.25Å; R328-T330 PolarHBondContact O-N 3.21Å; T330-R333 WeakPolarHBondContact O-CB 3.49Å; T330-R333 PolarHBondContact O-N 3.02Å; T330-T334 PolarHBondContact O-N 3.37Å; T330-T334 PolarHBondContact O-OG1 2.91Å
331	V	94.6	Very high	94.1	Very high	21 Å²	21	65.2 Å²	65.2	13%	0.127	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-49.5	174.8	-179.2	0	0	0	0	110.4	A294 V323 C326 T327 R328 R333 T334 V335 T378	A294-V331 HydrophobicContact CB-CG2 4.24Å; V323-V331 HydrophobicContact CB-CG2 4.22Å; V323-V331 HydrophobicContact CG1-CG1 4.31Å; V323-V331 HydrophobicContact CG1-CG2 4.17Å; C326-V331 HydrophobicContact CB-CG2 4.02Å; T327-V331 PolarHBondContact O-N 3.22Å; R328-V331 PolarHBondContact O-N 3.38Å; V331-R333 VanDerWaalsContact C-N 3.3Å; V331-R333 PolarHBondContact O-N 3.49Å; V331-T334 WeakPolarHBondContact O-CB 3.5Å; V331-T334 PolarHBondContact O-N 3.04Å; V331-T334 VanDerWaalsContact O-N 3.08Å; V331-V335 HydrophobicContact CG1-CG2 4.46Å; V331-V335 WeakPolarHBondContact O-CG2 3.31Å; V331-V335 PolarHBondContact O-N 3.39Å; V331-T378 HydrophobicContact CG1-CG2 3.87Å
332	E	94.9	Very high	93.9	Very high	94 Å²	94	65.3 Å²	65.3	44%	0.439	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-39.7	176.8	-73.8	176.8	-158.9	0	0	112.8	R328 T334 V335 R336	R328-E332 WeakPolarHBondContact O-CG 3.26Å; R328-E332 PolarHBondContact O-N 3.23Å; E332-T334 VanDerWaalsContact C-N 3.32Å; E332-T334 PolarHBondContact O-N 2.66Å; E332-V335 PolarHBondContact O-N 2.84Å; E332-R336 WeakPolarHBondContact O-CB 3.23Å; E332-R336 VanDerWaalsContact O-CG 3.32Å; E332-R336 WeakPolarHBondContact O-CG 3.29Å; E332-R336 PolarHBondContact O-N 3.27Å; E332-R336 IonicContact OE2-CZ 3.89Å; E332-R336 IonicContact OE2-NH2 2.72Å; E332-R336 PolarHBondContact OE2-NH2 2.77Å
333	R	94.6	Very high	93.7	Very high	142 Å²	142	68.7 Å²	68.7	54%	0.536	32%	0.322	S	S	.	.	H	α-helix	trans	-59.9	-45.3	175.2	-174.6	-167.4	-61.8	118.6	-0.6	110.8	A329 T330 V331 R336 Q337	A329-R333 WeakPolarHBondContact O-CB 3.49Å; A329-R333 PolarHBondContact O-N 3.45Å; A329-R333 VanDerWaalsContact O-N 3.09Å; T330-R333 WeakPolarHBondContact O-CB 3.49Å; T330-R333 PolarHBondContact O-N 3.02Å; V331-R333 VanDerWaalsContact C-N 3.3Å; V331-R333 PolarHBondContact O-N 3.49Å; R333-R336 PolarHBondContact O-N 2.8Å; R333-Q337 WeakPolarHBondContact O-CB 3.48Å; R333-Q337 PolarHBondContact O-N 2.83Å
334	T	94.7	Very high	93.3	Very high	7 Å²	7	71.8 Å²	71.8	4%	0.043	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-42.6	178.5	-64.6	0	0	0	0	111.3	V292 A294 I320 T330 V331 E332 Q337 L338	V292-T334 HydrophobicContact CG1-CG2 4.5Å; A294-T334 PolarHBondContact O-OG1 2.93Å; A294-T334 VanDerWaalsContact O-OG1 3.04Å; I320-T334 HydrophobicContact CD1-CG2 4.39Å; T330-T334 PolarHBondContact O-N 3.37Å; T330-T334 PolarHBondContact O-OG1 2.91Å; V331-T334 WeakPolarHBondContact O-CB 3.5Å; V331-T334 PolarHBondContact O-N 3.04Å; V331-T334 VanDerWaalsContact O-N 3.08Å; E332-T334 VanDerWaalsContact C-N 3.32Å; E332-T334 PolarHBondContact O-N 2.66Å; T334-Q337 WeakPolarHBondContact O-CB 3.3Å; T334-Q337 PolarHBondContact O-N 3.26Å; T334-L338 HydrophobicContact CG2-CD1 4.12Å; T334-L338 WeakPolarHBondContact O-CG 3.39Å; T334-L338 PolarHBondContact O-N 2.81Å
335	V	95.6	Very high	92.2	Very high	15 Å²	15	71.6 Å²	71.6	9%	0.091	34%	0.337	C	S	.	.	H	α-helix	trans	-57	-54.1	172.6	173.6	0	0	0	0	110.3	I320 V331 E332 Q337 L338 E339 V353 T378	I320-V335 HydrophobicContact CD1-CB 4.4Å; I320-V335 HydrophobicContact CD1-CG2 3.41Å; I320-V335 VanDerWaalsContact CD1-CG2 3.41Å; V331-V335 HydrophobicContact CG1-CG2 4.46Å; V331-V335 WeakPolarHBondContact O-CG2 3.31Å; V331-V335 PolarHBondContact O-N 3.39Å; E332-V335 PolarHBondContact O-N 2.84Å; V335-Q337 PolarHBondContact O-N 2.73Å; V335-Q337 VanDerWaalsContact O-N 3.16Å; V335-L338 WeakPolarHBondContact O-CB 3.46Å; V335-L338 PolarHBondContact O-N 3.45Å; V335-E339 HydrophobicContact CG1-CG 4.26Å; V335-E339 WeakPolarHBondContact O-CG 3.39Å; V335-E339 PolarHBondContact O-N 2.88Å; V335-V353 HydrophobicContact CG1-CG2 3.71Å; V335-T378 HydrophobicContact CG2-CG2 4.35Å
336	R	95.1	Very high	91.2	Very high	144 Å²	144	66.4 Å²	66.4	54%	0.543	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-30.5	178.3	-70.3	178.1	-164.3	145.3	16	113	E332 R333 R340	E332-R336 WeakPolarHBondContact O-CB 3.23Å; E332-R336 VanDerWaalsContact O-CG 3.32Å; E332-R336 WeakPolarHBondContact O-CG 3.29Å; E332-R336 PolarHBondContact O-N 3.27Å; E332-R336 IonicContact OE2-CZ 3.89Å; E332-R336 IonicContact OE2-NH2 2.72Å; E332-R336 PolarHBondContact OE2-NH2 2.77Å; R333-R336 PolarHBondContact O-N 2.8Å; R336-R340 WeakPolarHBondContact O-CG 3.41Å; R336-R340 PolarHBondContact O-N 3.24Å; R336-R340 PolarHBondContact O-NE 3.09Å
337	Q	93.9	Very high	90.6	Very high	49 Å²	49	65.3 Å²	65.3	23%	0.229	30%	0.304	C	S	.	.	H	α-helix	trans	-69.9	-44	174.6	-173.5	-177.8	-13.8	0	0	111.5	I298 R333 T334 V335 R340 V341	I298-Q337 HydrophobicContact CD1-CG 3.8Å; I298-Q337 HydrophobicContact CG1-CG 4.2Å; R333-Q337 WeakPolarHBondContact O-CB 3.48Å; R333-Q337 PolarHBondContact O-N 2.83Å; T334-Q337 WeakPolarHBondContact O-CB 3.3Å; T334-Q337 PolarHBondContact O-N 3.26Å; V335-Q337 PolarHBondContact O-N 2.73Å; V335-Q337 VanDerWaalsContact O-N 3.16Å; Q337-R340 PolarHBondContact O-N 2.86Å; Q337-V341 PolarHBondContact O-N 3.19Å; Q337-V341 VanDerWaalsContact O-N 3.16Å
338	L	93.9	Very high	90.1	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-44.2	176.1	-71	162.2	0	0	0	111.6	V292 I298 I318 I320 T334 V335 R340 V341 L342	V292-L338 HydrophobicContact CG2-CD2 4.18Å; I298-L338 HydrophobicContact CD1-CD2 3.72Å; I298-L338 HydrophobicContact CD1-CG 4.24Å; I298-L338 HydrophobicContact CG1-CD2 3.65Å; I298-L338 HydrophobicContact CG1-CG 4.21Å; I318-L338 HydrophobicContact CD1-CD2 4.12Å; I318-L338 HydrophobicContact CG2-CD1 4.04Å; I320-L338 HydrophobicContact CD1-CD1 3.64Å; I320-L338 HydrophobicContact CG1-CD1 3.81Å; T334-L338 HydrophobicContact CG2-CD1 4.12Å; T334-L338 WeakPolarHBondContact O-CG 3.39Å; T334-L338 PolarHBondContact O-N 2.81Å; V335-L338 WeakPolarHBondContact O-CB 3.46Å; V335-L338 PolarHBondContact O-N 3.45Å; L338-R340 VanDerWaalsContact C-N 3.28Å; L338-R340 PolarHBondContact O-N 3.43Å; L338-V341 PolarHBondContact O-N 3.27Å; L338-V341 VanDerWaalsContact O-N 3.13Å; L338-L342 WeakPolarHBondContact O-CB 3.39Å; L338-L342 WeakPolarHBondContact O-CG 3.37Å; L338-L342 PolarHBondContact O-N 3.5Å
339	E	94.4	Very high	90.1	Very high	50 Å²	50	56.2 Å²	56.2	23%	0.234	27%	0.267	C	S	.	.	H	α-helix	trans	-56.5	-42.7	175.5	-69.7	-176.9	143.1	0	0	112.2	V335 L342 K343 P351 I376	V335-E339 HydrophobicContact CG1-CG 4.26Å; V335-E339 WeakPolarHBondContact O-CG 3.39Å; V335-E339 PolarHBondContact O-N 2.88Å; E339-L342 PolarHBondContact O-N 2.85Å; E339-K343 WeakPolarHBondContact O-CB 3.34Å; E339-K343 VanDerWaalsContact O-CG 3.26Å; E339-K343 WeakPolarHBondContact O-CG 3.5Å; E339-K343 PolarHBondContact O-N 2.98Å; E339-P351 HydrophobicContact CB-CB 4.44Å; E339-P351 HydrophobicContact CB-CG 3.96Å; E339-P351 HydrophobicContact CG-CB 3.88Å; E339-P351 HydrophobicContact CG-CG 3.76Å; E339-I376 HydrophobicContact CG-CD1 4.4Å
340	R	92.1	Very high	90	Very high	157 Å²	157	57.3 Å²	57.3	59%	0.592	27%	0.268	S	S	*	.	H	α-helix	trans	-61.7	-47	176.1	-78.2	-178.2	-68.5	138.1	-6.8	111.4	R336 Q337 L338 L342 K343 Q344	R336-R340 WeakPolarHBondContact O-CG 3.41Å; R336-R340 PolarHBondContact O-N 3.24Å; R336-R340 PolarHBondContact O-NE 3.09Å; Q337-R340 PolarHBondContact O-N 2.86Å; L338-R340 VanDerWaalsContact C-N 3.28Å; L338-R340 PolarHBondContact O-N 3.43Å; R340-L342 PolarHBondContact O-N 3.06Å; R340-K343 PolarHBondContact O-N 3.33Å; R340-Q344 WeakPolarHBondContact O-CG 3.42Å; R340-Q344 PolarHBondContact O-N 3.06Å; R340-Q344 VanDerWaalsContact O-N 3.11Å
341	V	91.8	Very high	90	Very high	10 Å²	10	56.6 Å²	56.6	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-39.3	179.6	172.9	0	0	0	0	111.9	L8 I298 L306 Q337 L338 K343 Q344	L8-V341 HydrophobicContact CD2-CG1 4.02Å; I298-V341 HydrophobicContact CD1-CB 4.04Å; I298-V341 HydrophobicContact CD1-CG2 3.49Å; I298-V341 VanDerWaalsContact CD1-CG2 3.49Å; L306-V341 HydrophobicContact CD2-CG1 3.77Å; Q337-V341 PolarHBondContact O-N 3.19Å; Q337-V341 VanDerWaalsContact O-N 3.16Å; L338-V341 PolarHBondContact O-N 3.27Å; L338-V341 VanDerWaalsContact O-N 3.13Å; V341-K343 VanDerWaalsContact C-N 3.33Å; V341-K343 PolarHBondContact O-N 3.16Å; V341-Q344 WeakPolarHBondContact O-CB 3.49Å; V341-Q344 PolarHBondContact O-N 3.42Å
342	L	91.3	Very high	90	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-34.7	177.4	-74.4	175.9	0	0	0	113	I318 L338 E339 R340 Q344 C347 N348 K349 P351 T374 I376	I318-L342 HydrophobicContact CD1-CD1 3.73Å; I318-L342 HydrophobicContact CD1-CD2 4.17Å; I318-L342 HydrophobicContact CD1-CG 4.2Å; L338-L342 WeakPolarHBondContact O-CB 3.39Å; L338-L342 WeakPolarHBondContact O-CG 3.37Å; L338-L342 PolarHBondContact O-N 3.5Å; E339-L342 PolarHBondContact O-N 2.85Å; R340-L342 PolarHBondContact O-N 3.06Å; L342-Q344 VanDerWaalsContact C-N 3.33Å; L342-C347 WeakPolarHBondContact O-CB 3.4Å; L342-N348 PolarHBondContact O-N 2.89Å; L342-K349 HydrophobicContact CB-CB 4.05Å; L342-K349 HydrophobicContact CD2-CB 4.06Å; L342-K349 HydrophobicContact CD2-CG 4.14Å; L342-K349 PolarHBondContact O-N 2.94Å; L342-P351 HydrophobicContact CD1-CB 3.93Å; L342-T374 HydrophobicContact CD1-CG2 3.71Å; L342-T374 HydrophobicContact CD2-CG2 4.07Å; L342-I376 HydrophobicContact CD1-CD1 4.08Å
343	K	90.9	Very high	90	Very high	131 Å²	131	56 Å²	56	57%	0.57	26%	0.264	S	S	*	.	H	α-helix	trans	-80.8	-10.4	176.3	-69.4	173.5	-177.7	174	0	113.5	E339 R340 V341 P351	E339-K343 WeakPolarHBondContact O-CB 3.34Å; E339-K343 VanDerWaalsContact O-CG 3.26Å; E339-K343 WeakPolarHBondContact O-CG 3.5Å; E339-K343 PolarHBondContact O-N 2.98Å; R340-K343 PolarHBondContact O-N 3.33Å; V341-K343 VanDerWaalsContact C-N 3.33Å; V341-K343 PolarHBondContact O-N 3.16Å; K343-P351 HydrophobicContact CG-CG 4.47Å
344	Q	86.6	Confident	90	Very high	78 Å²	78	49.3 Å²	49.3	36%	0.364	24%	0.239	S	C	.	.	S	Bend	trans	-62.9	148.4	179.1	-84.3	175.2	-40.7	0	0	111.6	R340 V341 L342 G346 C347 N348	R340-Q344 WeakPolarHBondContact O-CG 3.42Å; R340-Q344 PolarHBondContact O-N 3.06Å; R340-Q344 VanDerWaalsContact O-N 3.11Å; V341-Q344 WeakPolarHBondContact O-CB 3.49Å; V341-Q344 PolarHBondContact O-N 3.42Å; L342-Q344 VanDerWaalsContact C-N 3.33Å; Q344-G346 PolarHBondContact O-N 3.42Å; Q344-C347 PolarHBondContact O-N 3.29Å; Q344-N348 PolarHBondContact O-N 3.07Å
345	P	70.2	Confident	89.8	Confident	53 Å²	53	51.6 Å²	51.6	34%	0.344	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	122.7	172.4	24.1	-32.3	0	0	0	109.6
346	G	73.1	Confident	89.7	Confident	5 Å²	5	52.9 Å²	52.9	5%	0.052	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	115.2	-31.8	-174.7	0	0	0	0	0	113.7	Q344	Q344-G346 PolarHBondContact O-N 3.42Å
347	C	79.8	Confident	89.4	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.041	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-48.9	166.8	-79	0	0	0	0	111.4	L8 M310 L342 Q344 K349	L8-C347 VanDerWaalsContact CD1-SG 3.52Å; M310-C347 WeakPolarHBondContact CE-O 3.39Å; L342-C347 WeakPolarHBondContact O-CB 3.4Å; Q344-C347 PolarHBondContact O-N 3.29Å; C347-K349 HydrophobicContact CB-CG 4.25Å; C347-K349 WeakPolarHBondContact O-CG 3.46Å; C347-K349 PolarHBondContact O-N 2.87Å
348	N	85.1	Confident	89.1	Confident	96 Å²	96	49.9 Å²	49.9	51%	0.513	27%	0.273	S	S	.	.			trans	47.7	41.2	-176.5	-60.2	-21.6	0	0	0	113	L342 Q344	L342-N348 PolarHBondContact O-N 2.89Å; Q344-N348 PolarHBondContact O-N 3.07Å
349	K	90.8	Very high	89	Confident	23 Å²	23	52.3 Å²	52.3	10%	0.1	29%	0.286	C	S	.	.			trans	-100.3	150.1	-179.4	-61.9	-63.4	-177.5	159.8	0	111.6	M310 L342 C347 P351 P371 S372	M310-K349 WeakPolarHBondContact SD-CE 3.3Å; L342-K349 HydrophobicContact CB-CB 4.05Å; L342-K349 HydrophobicContact CD2-CB 4.06Å; L342-K349 HydrophobicContact CD2-CG 4.14Å; L342-K349 PolarHBondContact O-N 2.94Å; C347-K349 HydrophobicContact CB-CG 4.25Å; C347-K349 WeakPolarHBondContact O-CG 3.46Å; C347-K349 PolarHBondContact O-N 2.87Å; K349-P351 WeakPolarHBondContact O-CD 3.41Å; K349-P371 PolarHBondContact NZ-O 3.26Å; K349-S372 CarbonylContact C-O 3.59Å; K349-S372 WeakPolarHBondContact CA-O 3.27Å; K349-S372 WeakPolarHBondContact CB-O 3.47Å; K349-S372 WeakPolarHBondContact CD-O 3.41Å
350	V	92.8	Very high	88.9	Confident	83 Å²	83	50 Å²	50	50%	0.503	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	102.5	172.9	-176.4	0	0	0	0	107.7	S372 I373 T374	V350-S372 PolarHBondContact N-O 2.61Å; V350-I373 HydrophobicContact CB-CG1 4.49Å; V350-I373 WeakPolarHBondContact O-CA 3.14Å; V350-T374 PolarHBondContact O-N 3.46Å
351	P	93.8	Very high	88.8	Confident	17 Å²	17	42.6 Å²	42.6	11%	0.11	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	138.1	177.9	27.6	-33.5	0	0	0	110.9	E339 L342 K343 K349 T374 I376	E339-P351 HydrophobicContact CB-CB 4.44Å; E339-P351 HydrophobicContact CB-CG 3.96Å; E339-P351 HydrophobicContact CG-CB 3.88Å; E339-P351 HydrophobicContact CG-CG 3.76Å; L342-P351 HydrophobicContact CD1-CB 3.93Å; K343-P351 HydrophobicContact CG-CG 4.47Å; K349-P351 WeakPolarHBondContact O-CD 3.41Å; P351-T374 WeakPolarHBondContact CA-O 3.43Å; P351-I376 HydrophobicContact CB-CD1 3.75Å
352	M	94.3	Very high	88.8	Confident	37 Å²	37	43.1 Å²	43.1	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	109.8	174.6	177.9	-177.4	-179.4	0	0	108.7	D359 T362 A363 I373 T374 P375 I376	M352-D359 HydrophobicContact CE-CB 4.46Å; M352-T362 HydrophobicContact CE-CG2 3.95Å; M352-A363 HydrophobicContact CE-CB 4.25Å; M352-A363 HydrophobicContact SD-CB 4Å; M352-I373 HydrophobicContact CB-CG2 4.24Å; M352-I373 HydrophobicContact SD-CG2 4.5Å; M352-T374 PolarHBondContact N-O 2.58Å; M352-P375 CarbonylContact O-C 3.55Å; M352-P375 WeakPolarHBondContact O-CA 3.47Å; M352-I376 PolarHBondContact O-N 3.08Å
353	V	94.8	Very high	88.8	Confident	64 Å²	64	43 Å²	43	39%	0.388	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	127.5	177	-177.4	0	0	0	0	109.1	V335	V335-V353 HydrophobicContact CG1-CG2 3.71Å
354	V	94.6	Very high	88.7	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	22%	0.223	C	C	.	.			trans	-96.7	111.6	180	-179.7	0	0	0	0	108.8	D359 A360 A363 P375 I376 F377 M389	V354-D359 HydrophobicContact CB-CB 4.37Å; V354-D359 HydrophobicContact CG1-CB 3.84Å; V354-A360 HydrophobicContact CG1-CB 3.9Å; V354-A363 HydrophobicContact CG2-CB 3.9Å; V354-P375 HydrophobicContact CG2-CB 4.23Å; V354-I376 PolarHBondContact N-O 3.18Å; V354-F377 HydrophobicContact CB-CD1 3.84Å; V354-F377 HydrophobicContact CB-CE1 3.84Å; V354-F377 HydrophobicContact CB-CG 4.46Å; V354-F377 HydrophobicContact CB-CZ 4.43Å; V354-F377 HydrophobicContact CG1-CD1 3.88Å; V354-F377 HydrophobicContact CG1-CE1 3.62Å; V354-F377 HydrophobicContact CG1-CZ 4.47Å; V354-F377 HydrophobicContact CG2-CD1 4.19Å; V354-F377 HydrophobicContact CG2-CE1 3.83Å; V354-F377 HydrophobicContact CG2-CE2 4.4Å; V354-F377 HydrophobicContact CG2-CZ 3.91Å; V354-M389 HydrophobicContact CG1-SD 4.41Å
355	G	91.3	Very high	88.7	Confident	55 Å²	55	34.3 Å²	34.3	57%	0.567	21%	0.211	S	C	*	.			trans	-112.1	-13.3	-179.5	0	0	0	0	0	114.4	D359 M389	G355-D359 PolarHBondContact N-OD2 3.44Å; G355-M389 VanDerWaalsContact O-CE 3.23Å; G355-M389 WeakPolarHBondContact O-CE 3.48Å
356	S	92.6	Very high	89.5	Confident	42 Å²	42	35.5 Å²	35.5	29%	0.294	21%	0.212	S	C	.	.	S	Bend	trans	-138.5	166	-177.4	66.8	0	0	0	0	112	D358 D359 A360	S356-D358 PolarHBondContact O-N 2.9Å; S356-D359 PolarHBondContact N-OD2 3.31Å; S356-D359 VanDerWaalsContact N-OD2 3.07Å; S356-D359 PolarHBondContact O-N 3.4Å; S356-D359 PolarHBondContact OG-N 3.04Å; S356-D359 VanDerWaalsContact OG-N 3.09Å; S356-D359 PolarHBondContact OG-OD2 2.86Å; S356-A360 PolarHBondContact O-N 2.76Å
357	T	89.6	Confident	90.3	Very high	77 Å²	77	35.4 Å²	35.4	47%	0.472	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-37.2	171.6	47.2	0	0	0	0	111.6	A360 V361	T357-A360 WeakPolarHBondContact O-CB 3.06Å; T357-A360 PolarHBondContact O-N 3.26Å; T357-A360 VanDerWaalsContact O-N 3.13Å; T357-V361 WeakPolarHBondContact O-CG2 3.4Å; T357-V361 PolarHBondContact O-N 3.41Å
358	D	88.7	Confident	90.2	Very high	54 Å²	54	36.3 Å²	36.3	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-65	-39.1	176.5	-85.6	33.1	0	0	0	112.3	R147 R149 S356 A360 V361 T362	R147-D358 PolarHBondContact NH1-O 2.97Å; R149-D358 IonicContact NE-OD2 3.99Å; S356-D358 PolarHBondContact O-N 2.9Å; D358-A360 VanDerWaalsContact C-N 3.3Å; D358-V361 PolarHBondContact O-N 3.12Å; D358-T362 PolarHBondContact O-N 3.3Å; D358-T362 PolarHBondContact O-OG1 3.5Å
359	D	91.6	Very high	90	Very high	56 Å²	56	37.8 Å²	37.8	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-64.9	-37.4	172.7	-62.2	-35.8	0	0	0	110.8	M352 V354 G355 S356 T362 A363	M352-D359 HydrophobicContact CE-CB 4.46Å; V354-D359 HydrophobicContact CB-CB 4.37Å; V354-D359 HydrophobicContact CG1-CB 3.84Å; G355-D359 PolarHBondContact N-OD2 3.44Å; S356-D359 PolarHBondContact N-OD2 3.31Å; S356-D359 VanDerWaalsContact N-OD2 3.07Å; S356-D359 PolarHBondContact O-N 3.4Å; S356-D359 PolarHBondContact OG-N 3.04Å; S356-D359 VanDerWaalsContact OG-N 3.09Å; S356-D359 PolarHBondContact OG-OD2 2.86Å; D359-T362 PolarHBondContact O-N 3.49Å; D359-A363 WeakPolarHBondContact O-CB 3.47Å; D359-A363 PolarHBondContact O-N 3.05Å
360	A	92.2	Very high	89.7	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-42.2	178.6	0	0	0	0	0	112.2	V354 S356 T357 D358 A363 A364 F377 M389 V392	V354-A360 HydrophobicContact CG1-CB 3.9Å; S356-A360 PolarHBondContact O-N 2.76Å; T357-A360 WeakPolarHBondContact O-CB 3.06Å; T357-A360 PolarHBondContact O-N 3.26Å; T357-A360 VanDerWaalsContact O-N 3.13Å; D358-A360 VanDerWaalsContact C-N 3.3Å; A360-A363 PolarHBondContact O-N 3.19Å; A360-A364 WeakPolarHBondContact O-CB 3.41Å; A360-A364 PolarHBondContact O-N 3.08Å; A360-F377 HydrophobicContact CB-CE1 4.39Å; A360-M389 HydrophobicContact CB-CB 4.22Å; A360-M389 WeakPolarHBondContact CB-O 3.32Å; A360-V392 HydrophobicContact CB-CB 4.41Å; A360-V392 HydrophobicContact CB-CG1 4.14Å
361	V	90.4	Very high	88.9	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-60	-48.6	172.9	175.6	0	0	0	0	110.2	L146 T357 D358 A363 A364 Q365 V392 I396	L146-V361 HydrophobicContact CD1-CG1 4.35Å; T357-V361 WeakPolarHBondContact O-CG2 3.4Å; T357-V361 PolarHBondContact O-N 3.41Å; D358-V361 PolarHBondContact O-N 3.12Å; V361-A363 PolarHBondContact O-N 3.47Å; V361-A364 PolarHBondContact O-N 2.84Å; V361-Q365 WeakPolarHBondContact O-CG 3.33Å; V361-Q365 PolarHBondContact O-N 3.07Å; V361-V392 HydrophobicContact CG2-CG1 3.96Å; V361-I396 HydrophobicContact CB-CD1 4.06Å; V361-I396 HydrophobicContact CG1-CD1 4.13Å; V361-I396 HydrophobicContact CG2-CD1 3.59Å
362	T	90	Very high	88.6	Confident	22 Å²	22	40 Å²	40	14%	0.135	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-43.5	179.8	-51.7	0	0	0	0	111.3	R147 M352 D358 D359 A364 Q365 Q366	R147-T362 PolarHBondContact NH1-OG1 2.92Å; M352-T362 HydrophobicContact CE-CG2 3.95Å; D358-T362 PolarHBondContact O-N 3.3Å; D358-T362 PolarHBondContact O-OG1 3.5Å; D359-T362 PolarHBondContact O-N 3.49Å; T362-A364 PolarHBondContact O-N 2.85Å; T362-Q365 PolarHBondContact O-N 3.28Å; T362-Q366 HydrophobicContact CG2-CG 4.26Å; T362-Q366 VanDerWaalsContact O-CB 3.32Å; T362-Q366 WeakPolarHBondContact O-CB 3.45Å; T362-Q366 WeakPolarHBondContact O-CG 3.37Å; T362-Q366 PolarHBondContact O-N 2.98Å
363	A	91.6	Very high	88.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-43.4	177.6	0	0	0	0	0	111.5	M352 V354 D359 A360 V361 F367 P375 F393	M352-A363 HydrophobicContact CE-CB 4.25Å; M352-A363 HydrophobicContact SD-CB 4Å; V354-A363 HydrophobicContact CG2-CB 3.9Å; D359-A363 WeakPolarHBondContact O-CB 3.47Å; D359-A363 PolarHBondContact O-N 3.05Å; A360-A363 PolarHBondContact O-N 3.19Å; V361-A363 PolarHBondContact O-N 3.47Å; A363-F367 WeakPolarHBondContact O-CB 3.49Å; A363-F367 PolarHBondContact O-N 3.32Å; A363-P375 HydrophobicContact CB-CB 3.99Å; A363-P375 HydrophobicContact CB-CG 3.87Å; A363-F393 HydrophobicContact CB-CD2 4.23Å; A363-F393 HydrophobicContact CB-CE2 4.28Å
364	A	90.4	Very high	88.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-44.5	179.2	0	0	0	0	0	112.5	A360 V361 T362 F393 I396	A360-A364 WeakPolarHBondContact O-CB 3.41Å; A360-A364 PolarHBondContact O-N 3.08Å; V361-A364 PolarHBondContact O-N 2.84Å; T362-A364 PolarHBondContact O-N 2.85Å; A364-F393 HydrophobicContact CB-CD2 3.68Å; A364-F393 HydrophobicContact CB-CE2 4.11Å; A364-F393 HydrophobicContact CB-CG 4.46Å; A364-I396 HydrophobicContact CB-CB 3.72Å; A364-I396 HydrophobicContact CB-CG2 3.67Å
365	Q	85	Confident	88.6	Confident	27 Å²	27	36.3 Å²	36.3	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-48	178.6	-68.2	169.1	-12	0	0	111.6	E163 V361 T362 Q369 I396	E163-Q365 PolarHBondContact OE2-NE2 3.41Å; V361-Q365 WeakPolarHBondContact O-CG 3.33Å; V361-Q365 PolarHBondContact O-N 3.07Å; T362-Q365 PolarHBondContact O-N 3.28Å; Q365-Q369 WeakPolarHBondContact O-CG 3.34Å; Q365-Q369 PolarHBondContact O-N 2.86Å; Q365-I396 HydrophobicContact CG-CG2 4.37Å
366	Q	87.3	Confident	88.8	Confident	78 Å²	78	33.7 Å²	33.7	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-72	-33.2	-176.6	-73.6	-173.2	-15.9	0	0	113.3	T362 A368 Q369 S370 I373	T362-Q366 HydrophobicContact CG2-CG 4.26Å; T362-Q366 VanDerWaalsContact O-CB 3.32Å; T362-Q366 WeakPolarHBondContact O-CB 3.45Å; T362-Q366 WeakPolarHBondContact O-CG 3.37Å; T362-Q366 PolarHBondContact O-N 2.98Å; Q366-A368 VanDerWaalsContact C-N 3.33Å; Q366-A368 PolarHBondContact O-N 2.86Å; Q366-Q369 PolarHBondContact O-N 2.87Å; Q366-S370 WeakPolarHBondContact O-CB 3.44Å; Q366-S370 PolarHBondContact O-N 2.74Å; Q366-I373 HydrophobicContact CB-CD1 3.82Å; Q366-I373 HydrophobicContact CG-CD1 4.42Å
367	F	89.4	Confident	89	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-37.6	-178.1	177.3	-121.8	0	0	0	112.7	F287 P315 I316 F317 A363 I373 P375 F393 I397	F287-F367 HydrophobicContact CD1-CD1 4.21Å; F287-F367 AromaticContact CD1-CE1 3.32Å; F287-F367 HydrophobicContact CD1-CE1 3.32Å; F287-F367 AromaticContact CD1-CZ 3.9Å; F287-F367 HydrophobicContact CD1-CZ 3.9Å; F287-F367 HydrophobicContact CE1-CD1 4.13Å; F287-F367 AromaticContact CE1-CE1 3.68Å; F287-F367 HydrophobicContact CE1-CE1 3.68Å; F287-F367 HydrophobicContact CE1-CZ 4.48Å; F287-F367 HydrophobicContact CG-CE1 4.12Å; P315-F367 HydrophobicContact CB-CE1 4.45Å; P315-F367 HydrophobicContact CB-CE2 3.96Å; P315-F367 HydrophobicContact CB-CZ 3.68Å; I316-F367 VanDerWaalsContact O-CE2 3.24Å; I316-F367 WeakPolarHBondContact O-CE2 3.41Å; F317-F367 HydrophobicContact CB-CE2 4.48Å; F317-F367 HydrophobicContact CB-CZ 4.26Å; F317-F367 AromaticContact CD1-CE1 3.97Å; F317-F367 HydrophobicContact CD1-CE1 3.97Å; F317-F367 HydrophobicContact CD1-CZ 4.04Å; A363-F367 WeakPolarHBondContact O-CB 3.49Å; A363-F367 PolarHBondContact O-N 3.32Å; F367-I373 WeakPolarHBondContact CD2-O 3.46Å; F367-P375 HydrophobicContact CB-CG 4.03Å; F367-P375 HydrophobicContact CD2-CG 4.17Å; F367-P375 HydrophobicContact CG-CG 4.17Å; F367-F393 HydrophobicContact CB-CE2 4.37Å; F367-F393 HydrophobicContact CD1-CE2 4.29Å; F367-F393 AromaticContact CD1-CZ 3.69Å; F367-F393 HydrophobicContact CD1-CZ 3.69Å; F367-F393 HydrophobicContact CE1-CZ 4.13Å; F367-F393 HydrophobicContact CG-CZ 4.29Å; F367-I397 HydrophobicContact CD1-CD1 3.57Å; F367-I397 HydrophobicContact CD1-CG1 4.32Å; F367-I397 HydrophobicContact CE1-CD1 3.72Å
368	A	79.2	Confident	89.3	Confident	25 Å²	25	29.7 Å²	29.7	21%	0.207	17%	0.168	C	C	.	.	H	α-helix	trans	-76	-35.7	176.5	0	0	0	0	0	112.8	Q366 P398	Q366-A368 VanDerWaalsContact C-N 3.33Å; Q366-A368 PolarHBondContact O-N 2.86Å; A368-P398 HydrophobicContact CB-CG 3.37Å
369	Q	80.3	Confident	89.7	Confident	127 Å²	127	27.1 Å²	27.1	59%	0.593	15%	0.154	S	C	*	.	H	α-helix	trans	-78	-35.4	-178.9	-67.5	174.9	11.7	0	0	113.1	I73 Q365 Q366	I73-Q369 VanDerWaalsContact CD1-NE2 3.32Å; Q365-Q369 WeakPolarHBondContact O-CG 3.34Å; Q365-Q369 PolarHBondContact O-N 2.86Å; Q366-Q369 PolarHBondContact O-N 2.87Å
370	S	83.6	Confident	89.9	Confident	35 Å²	35	24.4 Å²	24.4	25%	0.245	14%	0.14	C	C	.	.			trans	-121.2	104.3	-175.5	-175.2	0	0	0	0	110.5	Q366 S372 I373	Q366-S370 WeakPolarHBondContact O-CB 3.44Å; Q366-S370 PolarHBondContact O-N 2.74Å; S370-S372 PolarHBondContact O-N 3.06Å; S370-S372 PolarHBondContact OG-OG 3.43Å; S370-I373 PolarHBondContact O-N 3.1Å; S370-I373 VanDerWaalsContact O-N 3.12Å
371	P	77.4	Confident	90	Very high	92 Å²	92	24.9 Å²	24.9	60%	0.597	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-6.4	-178.5	28.6	-35.4	0	0	0	112.9	K349	K349-P371 PolarHBondContact NZ-O 3.26Å
372	S	86.4	Confident	90.2	Very high	44 Å²	44	27.3 Å²	27.3	31%	0.308	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-24	175.9	64.4	0	0	0	0	112.8	K349 V350 S370	K349-S372 CarbonylContact C-O 3.59Å; K349-S372 WeakPolarHBondContact CA-O 3.27Å; K349-S372 WeakPolarHBondContact CB-O 3.47Å; K349-S372 WeakPolarHBondContact CD-O 3.41Å; V350-S372 PolarHBondContact N-O 2.61Å; S370-S372 PolarHBondContact O-N 3.06Å; S370-S372 PolarHBondContact OG-OG 3.43Å
373	I	91.7	Very high	90.3	Very high	23 Å²	23	30 Å²	30	12%	0.118	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.6	-178.1	-64.6	173.5	0	0	0	109.4	V350 M352 Q366 F367 S370	V350-I373 HydrophobicContact CB-CG1 4.49Å; V350-I373 WeakPolarHBondContact O-CA 3.14Å; M352-I373 HydrophobicContact CB-CG2 4.24Å; M352-I373 HydrophobicContact SD-CG2 4.5Å; Q366-I373 HydrophobicContact CB-CD1 3.82Å; Q366-I373 HydrophobicContact CG-CD1 4.42Å; F367-I373 WeakPolarHBondContact CD2-O 3.46Å; S370-I373 PolarHBondContact O-N 3.1Å; S370-I373 VanDerWaalsContact O-N 3.12Å
374	T	94.9	Very high	90.3	Very high	1 Å²	1	31 Å²	31	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	100.8	177.4	-66.6	0	0	0	0	109.3	I316 I318 L342 V350 P351 M352	I316-T374 WeakPolarHBondContact O-CG2 3.47Å; I316-T374 PolarHBondContact O-OG1 3.19Å; I318-T374 HydrophobicContact CD1-CG2 4.22Å; I318-T374 HydrophobicContact CG1-CG2 3.93Å; L342-T374 HydrophobicContact CD1-CG2 3.71Å; L342-T374 HydrophobicContact CD2-CG2 4.07Å; V350-T374 PolarHBondContact O-N 3.46Å; P351-T374 WeakPolarHBondContact CA-O 3.43Å; M352-T374 PolarHBondContact N-O 2.58Å
375	P	96.6	Very high	90.4	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	141.6	173.7	-23.5	34.8	0	0	0	111.8	F317 I318 M352 V354 A363 F367 F377 F393	F317-P375 HydrophobicContact CB-CB 4.22Å; F317-P375 HydrophobicContact CB-CG 4.35Å; I318-P375 PolarHBondContact N-O 2.81Å; M352-P375 CarbonylContact O-C 3.55Å; M352-P375 WeakPolarHBondContact O-CA 3.47Å; V354-P375 HydrophobicContact CG2-CB 4.23Å; A363-P375 HydrophobicContact CB-CB 3.99Å; A363-P375 HydrophobicContact CB-CG 3.87Å; F367-P375 HydrophobicContact CB-CG 4.03Å; F367-P375 HydrophobicContact CD2-CG 4.17Å; F367-P375 HydrophobicContact CG-CG 4.17Å; P375-F377 HydrophobicContact CB-CD2 4.46Å; P375-F377 HydrophobicContact CB-CE2 3.71Å; P375-F377 HydrophobicContact CB-CZ 4.23Å; P375-F393 HydrophobicContact CB-CE2 4.49Å; P375-F393 HydrophobicContact CG-CE2 4.06Å; P375-F393 HydrophobicContact CG-CZ 4.39Å
376	I	96.9	Very high	90.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	113.6	176.4	-54.1	-178.9	0	0	0	108.1	I318 I320 E339 L342 P351 M352 V354	I318-I376 HydrophobicContact CB-CG1 4.28Å; I318-I376 HydrophobicContact CB-CG2 4.49Å; I318-I376 WeakPolarHBondContact O-CA 3.41Å; I320-I376 HydrophobicContact CD1-CG2 3.79Å; I320-I376 HydrophobicContact CG1-CG2 4.16Å; E339-I376 HydrophobicContact CG-CD1 4.4Å; L342-I376 HydrophobicContact CD1-CD1 4.08Å; P351-I376 HydrophobicContact CB-CD1 3.75Å; M352-I376 PolarHBondContact O-N 3.08Å; V354-I376 PolarHBondContact N-O 3.18Å
377	F	97.1	Very high	90.8	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.013	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.6	174.8	-60.3	-93.8	0	0	0	110.1	F317 I318 V319 I320 V354 A360 P375 M389 L390 F393	F317-F377 HydrophobicContact CD2-CD2 4.24Å; F317-F377 HydrophobicContact CD2-CE2 4.12Å; I318-F377 PolarHBondContact O-N 3.39Å; V319-F377 HydrophobicContact CG2-CB 4.36Å; V319-F377 HydrophobicContact CG2-CD2 4.44Å; I320-F377 PolarHBondContact N-O 3.17Å; V354-F377 HydrophobicContact CB-CD1 3.84Å; V354-F377 HydrophobicContact CB-CE1 3.84Å; V354-F377 HydrophobicContact CB-CG 4.46Å; V354-F377 HydrophobicContact CB-CZ 4.43Å; V354-F377 HydrophobicContact CG1-CD1 3.88Å; V354-F377 HydrophobicContact CG1-CE1 3.62Å; V354-F377 HydrophobicContact CG1-CZ 4.47Å; V354-F377 HydrophobicContact CG2-CD1 4.19Å; V354-F377 HydrophobicContact CG2-CE1 3.83Å; V354-F377 HydrophobicContact CG2-CE2 4.4Å; V354-F377 HydrophobicContact CG2-CZ 3.91Å; A360-F377 HydrophobicContact CB-CE1 4.39Å; P375-F377 HydrophobicContact CB-CD2 4.46Å; P375-F377 HydrophobicContact CB-CE2 3.71Å; P375-F377 HydrophobicContact CB-CZ 4.23Å; F377-M389 HydrophobicContact CD1-CB 4.42Å; F377-L390 HydrophobicContact CD2-CD1 4.19Å; F377-L390 HydrophobicContact CE2-CD1 4.3Å; F377-L390 HydrophobicContact CG-CD1 4.33Å; F377-F393 HydrophobicContact CE1-CB 4.02Å; F377-F393 HydrophobicContact CE1-CG 4.34Å; F377-F393 HydrophobicContact CE2-CD1 4.18Å; F377-F393 HydrophobicContact CE2-CD2 4.23Å; F377-F393 HydrophobicContact CE2-CE1 4.39Å; F377-F393 HydrophobicContact CE2-CE2 4.42Å; F377-F393 HydrophobicContact CE2-CG 4.1Å; F377-F393 HydrophobicContact CE2-CZ 4.49Å; F377-F393 HydrophobicContact CZ-CB 3.64Å; F377-F393 AromaticContact CZ-CD1 4Å; F377-F393 HydrophobicContact CZ-CD1 4Å; F377-F393 AromaticContact CZ-CD2 3.6Å; F377-F393 HydrophobicContact CZ-CD2 3.6Å; F377-F393 HydrophobicContact CZ-CE2 4.19Å; F377-F393 AromaticContact CZ-CG 3.47Å; F377-F393 HydrophobicContact CZ-CG 3.47Å; F377-F393 VanDerWaalsContact CZ-CG 3.47Å
378	T	95.7	Very high	90.9	Very high	32 Å²	32	37.4 Å²	37.4	20%	0.196	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.2	170.6	50.2	0	0	0	0	108.6	I320 V331 V335 S386	I320-T378 HydrophobicContact CB-CG2 4.15Å; I320-T378 HydrophobicContact CD1-CG2 4.13Å; V331-T378 HydrophobicContact CG1-CG2 3.87Å; V335-T378 HydrophobicContact CG2-CG2 4.35Å; T378-S386 WeakPolarHBondContact O-CB 3.21Å; T378-S386 PolarHBondContact O-OG 3.41Å
379	L	95.9	Very high	91.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.			trans	-147.9	164.4	-175.8	65.1	80.3	0	0	0	113.8	L193 V319 I320 S321 K322 V323 E385 L387 L390	L193-L379 HydrophobicContact CD1-CD1 3.72Å; L193-L379 HydrophobicContact CD1-CD2 4.09Å; L193-L379 HydrophobicContact CD2-CD1 4.5Å; L193-L379 HydrophobicContact CD2-CD2 4.47Å; V319-L379 HydrophobicContact CG1-CD1 4.14Å; V319-L379 HydrophobicContact CG1-CD2 3.36Å; V319-L379 HydrophobicContact CG1-CG 3.62Å; I320-L379 PolarHBondContact O-N 3.31Å; S321-L379 CarbonylContact C-O 3.58Å; S321-L379 WeakPolarHBondContact CA-O 3.46Å; K322-L379 PolarHBondContact N-O 3.14Å; V323-L379 WeakPolarHBondContact CG2-O 3.18Å; L379-E385 WeakPolarHBondContact CA-O 3.24Å; L379-E385 VanDerWaalsContact CB-O 3.26Å; L379-E385 WeakPolarHBondContact CB-O 3.41Å; L379-L387 HydrophobicContact CB-CD2 4.44Å; L379-L387 HydrophobicContact CD1-CD2 4.02Å; L379-L387 HydrophobicContact CD2-CD2 4.08Å; L379-L387 HydrophobicContact CG-CD2 4.42Å; L379-L390 HydrophobicContact CD2-CB 4.43Å; L379-L390 HydrophobicContact CD2-CD2 3.64Å
380	S	95.8	Very high	92.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.19	C	C	.	.			trans	-126.4	129.3	168.4	177.5	0	0	0	0	111.1	D324 V382 T383 G384 E385	D324-S380 WeakPolarHBondContact CB-OG 3.34Å; D324-S380 WeakPolarHBondContact OD1-CB 3.47Å; D324-S380 PolarHBondContact OD1-OG 3.1Å; S380-V382 PolarHBondContact O-N 3.43Å; S380-V382 PolarHBondContact OG-N 2.96Å; S380-V382 VanDerWaalsContact OG-N 3.08Å; S380-T383 WeakPolarHBondContact CB-OG1 3.29Å; S380-T383 PolarHBondContact OG-N 3.49Å; S380-T383 PolarHBondContact OG-OG1 3.03Å; S380-G384 VanDerWaalsContact O-CA 3.31Å; S380-G384 WeakPolarHBondContact O-CA 3.33Å; S380-G384 PolarHBondContact O-N 3.39Å; S380-E385 PolarHBondContact N-O 3.39Å; S380-E385 VanDerWaalsContact N-O 3.16Å
381	S	94.3	Very high	92.8	Very high	10 Å²	10	32.1 Å²	32.1	7%	0.07	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.7	171.5	-57.5	0	0	0	0	113.3	D203	D203-S381 PolarHBondContact N-O 3.07Å
382	V	93.9	Very high	93.5	Very high	52 Å²	52	29.8 Å²	29.8	32%	0.315	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-48.1	-178.8	-179.1	0	0	0	0	110.7	D203 S380	D203-V382 HydrophobicContact CB-CG2 4.48Å; S380-V382 PolarHBondContact O-N 3.43Å; S380-V382 PolarHBondContact OG-N 2.96Å; S380-V382 VanDerWaalsContact OG-N 3.08Å
383	T	93.3	Very high	93.9	Very high	80 Å²	80	27.7 Å²	27.7	49%	0.491	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-17.9	-179.8	64	0	0	0	0	113.1	D324 S380 E385	D324-T383 HydrophobicContact CB-CG2 3.82Å; S380-T383 WeakPolarHBondContact CB-OG1 3.29Å; S380-T383 PolarHBondContact OG-N 3.49Å; S380-T383 PolarHBondContact OG-OG1 3.03Å; T383-E385 VanDerWaalsContact C-N 3.25Å; T383-E385 PolarHBondContact O-N 2.92Å; T383-E385 WeakPolarHBondContact OG1-CB 3.46Å; T383-E385 PolarHBondContact OG1-N 3.21Å
384	G	91.1	Very high	94.1	Very high	19 Å²	19	26.7 Å²	26.7	20%	0.196	15%	0.151	C	C	.	.			trans	80.6	1.6	-173.8	0	0	0	0	0	114.5	S380 S386 L387	S380-G384 VanDerWaalsContact O-CA 3.31Å; S380-G384 WeakPolarHBondContact O-CA 3.33Å; S380-G384 PolarHBondContact O-N 3.39Å; G384-S386 PolarHBondContact O-N 3Å; G384-L387 PolarHBondContact O-N 3.34Å
385	E	92.3	Very high	94	Very high	106 Å²	106	27.2 Å²	27.2	50%	0.495	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	126.3	-179.4	-174.6	177.7	-178	0	0	111.2	L379 S380 T383 L387	L379-E385 WeakPolarHBondContact CA-O 3.24Å; L379-E385 VanDerWaalsContact CB-O 3.26Å; L379-E385 WeakPolarHBondContact CB-O 3.41Å; S380-E385 PolarHBondContact N-O 3.39Å; S380-E385 VanDerWaalsContact N-O 3.16Å; T383-E385 VanDerWaalsContact C-N 3.25Å; T383-E385 PolarHBondContact O-N 2.92Å; T383-E385 WeakPolarHBondContact OG1-CB 3.46Å; T383-E385 PolarHBondContact OG1-N 3.21Å; E385-L387 PolarHBondContact O-N 2.9Å; E385-L387 VanDerWaalsContact O-N 3.08Å
386	S	89.5	Confident	93.7	Very high	31 Å²	31	27.6 Å²	27.6	22%	0.217	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	13.8	176.3	-56.2	0	0	0	0	116.5	T378 G384 D388 M389	T378-S386 WeakPolarHBondContact O-CB 3.21Å; T378-S386 PolarHBondContact O-OG 3.41Å; G384-S386 PolarHBondContact O-N 3Å; S386-D388 VanDerWaalsContact C-N 3.26Å; S386-D388 PolarHBondContact O-N 3.28Å; S386-M389 PolarHBondContact O-N 3Å
387	L	91.9	Very high	93.4	Very high	7 Å²	7	27.7 Å²	27.7	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-36.3	173.5	-74.2	-180	0	0	0	112	L193 V196 L202 L379 G384 E385 M389 L390 K391	L193-L387 HydrophobicContact CD1-CD2 3.87Å; V196-L387 HydrophobicContact CG1-CD1 3.69Å; L202-L387 HydrophobicContact CD2-CD1 3.8Å; L379-L387 HydrophobicContact CB-CD2 4.44Å; L379-L387 HydrophobicContact CD1-CD2 4.02Å; L379-L387 HydrophobicContact CD2-CD2 4.08Å; L379-L387 HydrophobicContact CG-CD2 4.42Å; G384-L387 PolarHBondContact O-N 3.34Å; E385-L387 PolarHBondContact O-N 2.9Å; E385-L387 VanDerWaalsContact O-N 3.08Å; L387-M389 VanDerWaalsContact C-N 3.32Å; L387-M389 PolarHBondContact O-N 3.43Å; L387-L390 WeakPolarHBondContact O-CB 3.23Å; L387-L390 PolarHBondContact O-N 2.89Å; L387-L390 VanDerWaalsContact O-N 3.16Å; L387-K391 PolarHBondContact O-N 3Å; L387-K391 VanDerWaalsContact O-N 3.09Å
388	D	92.1	Very high	92.9	Very high	98 Å²	98	28.7 Å²	28.7	52%	0.524	16%	0.164	S	C	.	.	H	α-helix	trans	-68.2	-32.1	-176.9	-60.9	-37.9	0	0	0	112.4	S386 L390 K391 V392	S386-D388 VanDerWaalsContact C-N 3.26Å; S386-D388 PolarHBondContact O-N 3.28Å; D388-L390 VanDerWaalsContact C-N 3.28Å; D388-L390 PolarHBondContact O-N 3.19Å; D388-K391 PolarHBondContact O-N 3.15Å; D388-K391 IonicContact OD1-NZ 3.17Å; D388-K391 PolarHBondContact OD1-NZ 3.44Å; D388-V392 WeakPolarHBondContact O-CG2 3.33Å; D388-V392 PolarHBondContact O-N 2.92Å
389	M	93.5	Very high	92.3	Very high	33 Å²	33	28.2 Å²	28.2	16%	0.163	16%	0.161	C	C	.	.	H	α-helix	trans	-61	-39.7	173.1	-60.6	177.6	-167.3	0	0	111.3	V354 G355 A360 F377 S386 L387 V392 F393	V354-M389 HydrophobicContact CG1-SD 4.41Å; G355-M389 VanDerWaalsContact O-CE 3.23Å; G355-M389 WeakPolarHBondContact O-CE 3.48Å; A360-M389 HydrophobicContact CB-CB 4.22Å; A360-M389 WeakPolarHBondContact CB-O 3.32Å; F377-M389 HydrophobicContact CD1-CB 4.42Å; S386-M389 PolarHBondContact O-N 3Å; L387-M389 VanDerWaalsContact C-N 3.32Å; L387-M389 PolarHBondContact O-N 3.43Å; M389-V392 PolarHBondContact O-N 3.36Å; M389-F393 WeakPolarHBondContact O-CB 3.2Å; M389-F393 PolarHBondContact O-N 3.39Å
390	L	94.8	Very high	91.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.5	-37.4	176.8	-176	62	0	0	0	111.6	L193 L197 M289 F317 V319 F377 L379 L387 D388 F393 F394	L193-L390 HydrophobicContact CD2-CD2 4.43Å; L197-L390 HydrophobicContact CD1-CD2 4.1Å; M289-L390 HydrophobicContact SD-CD2 4.48Å; F317-L390 HydrophobicContact CE2-CD1 4.02Å; V319-L390 HydrophobicContact CG2-CD1 4.25Å; V319-L390 HydrophobicContact CG2-CD2 4.26Å; F377-L390 HydrophobicContact CD2-CD1 4.19Å; F377-L390 HydrophobicContact CE2-CD1 4.3Å; F377-L390 HydrophobicContact CG-CD1 4.33Å; L379-L390 HydrophobicContact CD2-CB 4.43Å; L379-L390 HydrophobicContact CD2-CD2 3.64Å; L387-L390 WeakPolarHBondContact O-CB 3.23Å; L387-L390 PolarHBondContact O-N 2.89Å; L387-L390 VanDerWaalsContact O-N 3.16Å; D388-L390 VanDerWaalsContact C-N 3.28Å; D388-L390 PolarHBondContact O-N 3.19Å; L390-F393 HydrophobicContact CD1-CD1 4.33Å; L390-F393 WeakPolarHBondContact O-CB 3.31Å; L390-F393 PolarHBondContact O-N 2.94Å; L390-F394 HydrophobicContact CD1-CD2 4.21Å; L390-F394 HydrophobicContact CD1-CE2 3.65Å; L390-F394 HydrophobicContact CD1-CZ 3.91Å; L390-F394 HydrophobicContact CD2-CE2 3.9Å; L390-F394 HydrophobicContact CG-CD2 3.92Å; L390-F394 HydrophobicContact CG-CE2 3.47Å; L390-F394 VanDerWaalsContact CG-CE2 3.47Å; L390-F394 HydrophobicContact CG-CZ 4.21Å; L390-F394 WeakPolarHBondContact O-CD2 3.18Å; L390-F394 PolarHBondContact O-N 3.15Å
391	K	93.9	Very high	90.5	Very high	44 Å²	44	33.3 Å²	33.3	19%	0.191	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-44.4	173.3	-64.5	174.2	-167.3	158	0	111.7	L197 V241 Y244 L387 D388 F393 F394 N395	L197-K391 HydrophobicContact CD2-CG 4.33Å; V241-K391 HydrophobicContact CG2-CD 4.22Å; Y244-K391 WeakPolarHBondContact OH-CE 3.1Å; L387-K391 PolarHBondContact O-N 3Å; L387-K391 VanDerWaalsContact O-N 3.09Å; D388-K391 PolarHBondContact O-N 3.15Å; D388-K391 IonicContact OD1-NZ 3.17Å; D388-K391 PolarHBondContact OD1-NZ 3.44Å; K391-F393 VanDerWaalsContact C-N 3.31Å; K391-F393 PolarHBondContact O-N 2.91Å; K391-F394 PolarHBondContact O-N 3.19Å; K391-N395 WeakPolarHBondContact O-CB 3.2Å; K391-N395 PolarHBondContact O-N 2.85Å
392	V	93.2	Very high	89.4	Confident	43 Å²	43	37.2 Å²	37.2	26%	0.261	21%	0.211	S	C	.	.	H	α-helix	trans	-58.5	-45	174.9	169.2	0	0	0	0	110.4	A360 V361 D388 M389 F394 N395 I396	A360-V392 HydrophobicContact CB-CB 4.41Å; A360-V392 HydrophobicContact CB-CG1 4.14Å; V361-V392 HydrophobicContact CG2-CG1 3.96Å; D388-V392 WeakPolarHBondContact O-CG2 3.33Å; D388-V392 PolarHBondContact O-N 2.92Å; M389-V392 PolarHBondContact O-N 3.36Å; V392-F394 PolarHBondContact O-N 3.32Å; V392-N395 PolarHBondContact O-N 2.97Å; V392-I396 HydrophobicContact CG1-CD1 3.62Å; V392-I396 WeakPolarHBondContact O-CD1 3.38Å; V392-I396 WeakPolarHBondContact O-CG1 3.38Å; V392-I396 PolarHBondContact O-N 2.94Å; V392-I396 VanDerWaalsContact O-N 3.14Å
393	F	94.8	Very high	88.5	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-49.1	175.8	175.7	-99.5	0	0	0	112.2	F317 A363 A364 F367 P375 F377 M389 L390 K391 N395 I396 I397	F317-F393 HydrophobicContact CB-CZ 4.38Å; F317-F393 AromaticContact CD1-CE1 3.91Å; F317-F393 HydrophobicContact CD1-CE1 3.91Å; F317-F393 HydrophobicContact CD1-CZ 4.18Å; F317-F393 HydrophobicContact CD2-CE1 4.1Å; F317-F393 AromaticContact CE1-CE1 4Å; F317-F393 HydrophobicContact CE1-CE1 4Å; F317-F393 HydrophobicContact CE2-CE1 4.18Å; F317-F393 AromaticContact CG-CE1 3.96Å; F317-F393 HydrophobicContact CG-CE1 3.96Å; F317-F393 HydrophobicContact CG-CZ 4.16Å; F317-F393 HydrophobicContact CZ-CE1 4.13Å; A363-F393 HydrophobicContact CB-CD2 4.23Å; A363-F393 HydrophobicContact CB-CE2 4.28Å; A364-F393 HydrophobicContact CB-CD2 3.68Å; A364-F393 HydrophobicContact CB-CE2 4.11Å; A364-F393 HydrophobicContact CB-CG 4.46Å; F367-F393 HydrophobicContact CB-CE2 4.37Å; F367-F393 HydrophobicContact CD1-CE2 4.29Å; F367-F393 AromaticContact CD1-CZ 3.69Å; F367-F393 HydrophobicContact CD1-CZ 3.69Å; F367-F393 HydrophobicContact CE1-CZ 4.13Å; F367-F393 HydrophobicContact CG-CZ 4.29Å; P375-F393 HydrophobicContact CB-CE2 4.49Å; P375-F393 HydrophobicContact CG-CE2 4.06Å; P375-F393 HydrophobicContact CG-CZ 4.39Å; F377-F393 HydrophobicContact CE1-CB 4.02Å; F377-F393 HydrophobicContact CE1-CG 4.34Å; F377-F393 HydrophobicContact CE2-CD1 4.18Å; F377-F393 HydrophobicContact CE2-CD2 4.23Å; F377-F393 HydrophobicContact CE2-CE1 4.39Å; F377-F393 HydrophobicContact CE2-CE2 4.42Å; F377-F393 HydrophobicContact CE2-CG 4.1Å; F377-F393 HydrophobicContact CE2-CZ 4.49Å; F377-F393 HydrophobicContact CZ-CB 3.64Å; F377-F393 AromaticContact CZ-CD1 4Å; F377-F393 HydrophobicContact CZ-CD1 4Å; F377-F393 AromaticContact CZ-CD2 3.6Å; F377-F393 HydrophobicContact CZ-CD2 3.6Å; F377-F393 HydrophobicContact CZ-CE2 4.19Å; F377-F393 AromaticContact CZ-CG 3.47Å; F377-F393 HydrophobicContact CZ-CG 3.47Å; F377-F393 VanDerWaalsContact CZ-CG 3.47Å; M389-F393 WeakPolarHBondContact O-CB 3.2Å; M389-F393 PolarHBondContact O-N 3.39Å; L390-F393 HydrophobicContact CD1-CD1 4.33Å; L390-F393 WeakPolarHBondContact O-CB 3.31Å; L390-F393 PolarHBondContact O-N 2.94Å; K391-F393 VanDerWaalsContact C-N 3.31Å; K391-F393 PolarHBondContact O-N 2.91Å; F393-N395 VanDerWaalsContact C-N 3.32Å; F393-N395 PolarHBondContact O-N 2.96Å; F393-I396 PolarHBondContact O-N 2.77Å; F393-I397 HydrophobicContact CE1-CD1 3.96Å; F393-I397 HydrophobicContact CZ-CD1 3.84Å; F393-I397 WeakPolarHBondContact O-CB 3.42Å; F393-I397 PolarHBondContact O-N 3.21Å
394	F	94.6	Very high	87.8	Confident	1 Å²	1	36.3 Å²	36.3	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-34.4	176.9	-75.9	-47.7	0	0	0	113.7	V180 L197 L233 F235 I261 F263 M289 F317 L390 K391 V392 I396 I397	V180-F394 HydrophobicContact CG1-CE1 4.48Å; V180-F394 HydrophobicContact CG2-CE1 4.2Å; L197-F394 HydrophobicContact CD1-CE2 4.18Å; L233-F394 HydrophobicContact CD2-CD2 4.39Å; F235-F394 HydrophobicContact CE2-CB 3.93Å; F235-F394 HydrophobicContact CZ-CB 3.83Å; I261-F394 HydrophobicContact CG1-CB 4.13Å; I261-F394 HydrophobicContact CG1-CD1 4.4Å; I261-F394 HydrophobicContact CG1-CG 4.44Å; I261-F394 HydrophobicContact CG2-CD1 4.27Å; I261-F394 HydrophobicContact CG2-CE1 4.46Å; F263-F394 HydrophobicContact CE1-CE1 4Å; F263-F394 HydrophobicContact CE1-CE2 4.01Å; F263-F394 AromaticContact CE1-CZ 3.58Å; F263-F394 HydrophobicContact CE1-CZ 3.58Å; F263-F394 HydrophobicContact CZ-CD2 4.26Å; F263-F394 HydrophobicContact CZ-CE1 4.3Å; F263-F394 AromaticContact CZ-CE2 3.77Å; F263-F394 HydrophobicContact CZ-CE2 3.77Å; F263-F394 AromaticContact CZ-CZ 3.82Å; F263-F394 HydrophobicContact CZ-CZ 3.82Å; M289-F394 HydrophobicContact SD-CZ 4.13Å; F317-F394 HydrophobicContact CE1-CE1 4.3Å; F317-F394 HydrophobicContact CE2-CE1 4.32Å; F317-F394 HydrophobicContact CE2-CZ 4.13Å; F317-F394 AromaticContact CZ-CE1 3.57Å; F317-F394 HydrophobicContact CZ-CE1 3.57Å; F317-F394 AromaticContact CZ-CZ 3.71Å; F317-F394 HydrophobicContact CZ-CZ 3.71Å; L390-F394 HydrophobicContact CD1-CD2 4.21Å; L390-F394 HydrophobicContact CD1-CE2 3.65Å; L390-F394 HydrophobicContact CD1-CZ 3.91Å; L390-F394 HydrophobicContact CD2-CE2 3.9Å; L390-F394 HydrophobicContact CG-CD2 3.92Å; L390-F394 HydrophobicContact CG-CE2 3.47Å; L390-F394 VanDerWaalsContact CG-CE2 3.47Å; L390-F394 HydrophobicContact CG-CZ 4.21Å; L390-F394 WeakPolarHBondContact O-CD2 3.18Å; L390-F394 PolarHBondContact O-N 3.15Å; K391-F394 PolarHBondContact O-N 3.19Å; V392-F394 PolarHBondContact O-N 3.32Å; F394-I396 VanDerWaalsContact C-N 3.3Å; F394-I396 PolarHBondContact O-N 2.82Å; F394-I397 WeakPolarHBondContact O-CG2 3.39Å
395	N	92.6	Very high	87.3	Confident	13 Å²	13	39.6 Å²	39.6	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-37.1	176.3	-177.9	47.5	0	0	0	111.4	R167 F235 G239 K259 K391 V392 F393	R167-N395 PolarHBondContact NH1-OD1 3.09Å; R167-N395 PolarHBondContact NH2-O 2.99Å; R167-N395 PolarHBondContact NH2-OD1 2.75Å; F235-N395 HydrophobicContact CD1-CB 3.88Å; F235-N395 HydrophobicContact CE1-CB 3.79Å; F235-N395 HydrophobicContact CG-CB 4.35Å; F235-N395 HydrophobicContact CZ-CB 4.19Å; G239-N395 WeakPolarHBondContact CA-OD1 3.45Å; K259-N395 WeakPolarHBondContact CD-O 3.32Å; K259-N395 WeakPolarHBondContact CE-O 3.21Å; K259-N395 PolarHBondContact NZ-O 3.11Å; K391-N395 WeakPolarHBondContact O-CB 3.2Å; K391-N395 PolarHBondContact O-N 2.85Å; V392-N395 PolarHBondContact O-N 2.97Å; F393-N395 VanDerWaalsContact C-N 3.32Å; F393-N395 PolarHBondContact O-N 2.96Å
396	I	90.8	Very high	86.7	Confident	8 Å²	8	36 Å²	36	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-95.3	-29	-170	-62.2	166.3	0	0	0	112.9	L146 V361 A364 Q365 V392 F393 F394 P398	L146-I396 HydrophobicContact CD1-CD1 4.11Å; L146-I396 HydrophobicContact CD1-CG1 4.27Å; L146-I396 HydrophobicContact CD1-CG2 4.47Å; L146-I396 HydrophobicContact CD2-CD1 3.89Å; L146-I396 HydrophobicContact CD2-CG1 3.97Å; L146-I396 HydrophobicContact CG-CD1 4.5Å; V361-I396 HydrophobicContact CB-CD1 4.06Å; V361-I396 HydrophobicContact CG1-CD1 4.13Å; V361-I396 HydrophobicContact CG2-CD1 3.59Å; A364-I396 HydrophobicContact CB-CB 3.72Å; A364-I396 HydrophobicContact CB-CG2 3.67Å; Q365-I396 HydrophobicContact CG-CG2 4.37Å; V392-I396 HydrophobicContact CG1-CD1 3.62Å; V392-I396 WeakPolarHBondContact O-CD1 3.38Å; V392-I396 WeakPolarHBondContact O-CG1 3.38Å; V392-I396 PolarHBondContact O-N 2.94Å; V392-I396 VanDerWaalsContact O-N 3.14Å; F393-I396 PolarHBondContact O-N 2.77Å; F394-I396 VanDerWaalsContact C-N 3.3Å; F394-I396 PolarHBondContact O-N 2.82Å; I396-P398 WeakPolarHBondContact O-CD 3.48Å; I396-P398 VanDerWaalsContact O-N 3.14Å
397	I	90.7	Very high	86.4	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-55.2	118.7	-174.1	-169.7	175.6	0	0	0	111.4	L178 K259 F287 F367 F393 F394	L178-I397 HydrophobicContact CD1-CG2 3.86Å; L178-I397 VanDerWaalsContact CD1-O 3.27Å; L178-I397 WeakPolarHBondContact CD1-O 3.31Å; K259-I397 WeakPolarHBondContact CE-O 3.06Å; K259-I397 PolarHBondContact NZ-O 2.52Å; F287-I397 HydrophobicContact CD1-CD1 3.92Å; F287-I397 HydrophobicContact CD2-CD1 3.77Å; F287-I397 HydrophobicContact CE1-CD1 3.67Å; F287-I397 HydrophobicContact CE1-CG1 4.25Å; F287-I397 HydrophobicContact CE2-CD1 3.54Å; F287-I397 HydrophobicContact CE2-CG1 3.95Å; F287-I397 HydrophobicContact CG-CD1 3.95Å; F287-I397 HydrophobicContact CZ-CD1 3.48Å; F287-I397 VanDerWaalsContact CZ-CD1 3.48Å; F287-I397 HydrophobicContact CZ-CG1 3.72Å; F367-I397 HydrophobicContact CD1-CD1 3.57Å; F367-I397 HydrophobicContact CD1-CG1 4.32Å; F367-I397 HydrophobicContact CE1-CD1 3.72Å; F393-I397 HydrophobicContact CE1-CD1 3.96Å; F393-I397 HydrophobicContact CZ-CD1 3.84Å; F393-I397 WeakPolarHBondContact O-CB 3.42Å; F393-I397 PolarHBondContact O-N 3.21Å; F394-I397 WeakPolarHBondContact O-CG2 3.39Å
398	P	85.9	Confident	86.2	Confident	24 Å²	24	45.4 Å²	45.4	16%	0.156	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-81.2	163.5	-177.5	32.8	-35.4	0	0	0	111.3	F287 A368 I396	F287-P398 WeakPolarHBondContact CZ-O 3.5Å; A368-P398 HydrophobicContact CB-CG 3.37Å; I396-P398 WeakPolarHBondContact O-CD 3.48Å; I396-P398 VanDerWaalsContact O-N 3.14Å
399	P	84.1	Confident	86	Confident	22 Å²	22	42.4 Å²	42.4	14%	0.143	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-61.3	145.8	169.2	26.3	-32.9	0	0	0	111.2	R102 L176 L178	R102-P399 HydrophobicContact CG-CG 4.31Å; L176-P399 HydrophobicContact CD1-CB 4.11Å; L176-P399 HydrophobicContact CD1-CG 3.91Å; L178-P399 HydrophobicContact CD2-CB 3.87Å
400	L	79.1	Confident	85.6	Confident	69 Å²	69	43.1 Å²	43.1	36%	0.361	22%	0.221	S	C	.	.	S	Bend	trans	-74.1	-35.5	178	-70.6	174.3	0	0	0	113	D286 F287 P315	D286-L400 WeakPolarHBondContact O-CD1 3.29Å; F287-L400 HydrophobicContact CD1-CD1 4.18Å; F287-L400 HydrophobicContact CD1-CG 4.45Å; F287-L400 HydrophobicContact CE1-CD1 3.75Å; F287-L400 HydrophobicContact CE1-CD2 3.61Å; F287-L400 HydrophobicContact CE1-CG 3.55Å; F287-L400 HydrophobicContact CZ-CD1 4.16Å; F287-L400 HydrophobicContact CZ-CD2 3.97Å; F287-L400 HydrophobicContact CZ-CG 3.63Å; P315-L400 HydrophobicContact CG-CD1 3.71Å; P315-L400 HydrophobicContact CG-CD2 4.4Å
401	S	73.6	Confident	85.4	Confident	38 Å²	38	50.2 Å²	50.2	27%	0.266	25%	0.253	S	S	.	.	S	Bend	trans	-82.2	133.2	179.6	-65.8	0	0	0	0	110.2	R102 E405	R102-S401 PolarHBondContact NE-O 3.18Å; R102-S401 VanDerWaalsContact NE-O 3.17Å; R102-S401 PolarHBondContact NH2-O 2.84Å; S401-E405 WeakPolarHBondContact CB-OE2 3.36Å; S401-E405 PolarHBondContact OG-OE2 3.23Å
402	N	72.7	Confident	85.3	Confident	91 Å²	91	52.5 Å²	52.5	49%	0.487	27%	0.265	S	S	.	.			trans	-70.4	167.4	176.4	66	21.6	0	0	0	111	R102 K404 E405 Q406	R102-N402 PolarHBondContact NH2-O 2.9Å; N402-K404 VanDerWaalsContact C-N 3.32Å; N402-K404 PolarHBondContact OD1-N 2.8Å; N402-E405 WeakPolarHBondContact OD1-CB 3.33Å; N402-E405 PolarHBondContact OD1-N 2.82Å; N402-Q406 PolarHBondContact O-N 3.47Å
403	S	74.8	Confident	85.3	Confident	27 Å²	27	53.5 Å²	53.5	19%	0.189	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-37.4	178.2	56.6	0	0	0	0	112.3	Q99 Q406 E407	Q99-S403 WeakPolarHBondContact O-CB 3.37Å; S403-Q406 VanDerWaalsContact O-CB 3.29Å; S403-Q406 WeakPolarHBondContact O-CB 3.18Å; S403-Q406 PolarHBondContact O-N 3.14Å; S403-E407 PolarHBondContact O-N 3.47Å
404	K	77.9	Confident	85.3	Confident	86 Å²	86	54.4 Å²	54.4	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-61.3	-50.2	-179.2	-65.2	177.4	-178.4	169.2	0	112.1	E70 N402 Q406 E407 E408	E70-K404 IonicContact OE1-NZ 3.59Å; E70-K404 PolarHBondContact OE1-NZ 3.32Å; E70-K404 IonicContact OE2-NZ 3.53Å; E70-K404 PolarHBondContact OE2-NZ 2.8Å; N402-K404 VanDerWaalsContact C-N 3.32Å; N402-K404 PolarHBondContact OD1-N 2.8Å; K404-Q406 VanDerWaalsContact C-N 3.26Å; K404-Q406 PolarHBondContact O-N 2.98Å; K404-E407 WeakPolarHBondContact O-CB 3.17Å; K404-E407 PolarHBondContact O-N 2.87Å; K404-E407 VanDerWaalsContact O-N 3.09Å; K404-E408 WeakPolarHBondContact O-CG 3.13Å; K404-E408 PolarHBondContact O-N 3.4Å
405	E	80.4	Confident	85.3	Confident	88 Å²	88	54.4 Å²	54.4	41%	0.411	27%	0.274	S	S	.	.	H	α-helix	trans	-59.7	-38.1	176.9	-177.1	-176.9	-160.6	0	0	111.1	S401 N402 L409	S401-E405 WeakPolarHBondContact CB-OE2 3.36Å; S401-E405 PolarHBondContact OG-OE2 3.23Å; N402-E405 WeakPolarHBondContact OD1-CB 3.33Å; N402-E405 PolarHBondContact OD1-N 2.82Å; E405-L409 HydrophobicContact CG-CD1 4.29Å; E405-L409 WeakPolarHBondContact O-CB 3.49Å; E405-L409 VanDerWaalsContact O-CG 3.26Å; E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 2.94Å
406	Q	80.5	Confident	85.4	Confident	30 Å²	30	53.8 Å²	53.8	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-44.4	174.7	-164.2	58.9	33.1	0	0	112.2	R102 N402 S403 K404 L409 M410 A476	R102-Q406 VanDerWaalsContact CZ-OE1 3.32Å; R102-Q406 VanDerWaalsContact NH2-CB 3.35Å; N402-Q406 PolarHBondContact O-N 3.47Å; S403-Q406 VanDerWaalsContact O-CB 3.29Å; S403-Q406 WeakPolarHBondContact O-CB 3.18Å; S403-Q406 PolarHBondContact O-N 3.14Å; K404-Q406 VanDerWaalsContact C-N 3.26Å; K404-Q406 PolarHBondContact O-N 2.98Å; Q406-L409 PolarHBondContact O-N 3.37Å; Q406-M410 HydrophobicContact CG-SD 4.05Å; Q406-M410 WeakPolarHBondContact O-CB 3.34Å; Q406-M410 VanDerWaalsContact O-CG 3.22Å; Q406-M410 WeakPolarHBondContact O-CG 3.42Å; Q406-M410 PolarHBondContact O-N 3.41Å; Q406-A476 PolarHBondContact NE2-O 2.95Å
407	E	83.2	Confident	85.6	Confident	116 Å²	116	54.4 Å²	54.4	54%	0.542	27%	0.274	S	S	.	.	H	α-helix	trans	-66.7	-42.9	-178.6	-170.4	170.3	-173.8	0	0	110.5	S403 K404 L409 M410 Q411	S403-E407 PolarHBondContact O-N 3.47Å; K404-E407 WeakPolarHBondContact O-CB 3.17Å; K404-E407 PolarHBondContact O-N 2.87Å; K404-E407 VanDerWaalsContact O-N 3.09Å; E407-L409 PolarHBondContact O-N 3.45Å; E407-M410 PolarHBondContact O-N 3.48Å; E407-Q411 VanDerWaalsContact O-CG 3.3Å; E407-Q411 WeakPolarHBondContact O-CG 3.42Å; E407-Q411 PolarHBondContact O-N 2.8Å
408	E	87.1	Confident	85.7	Confident	120 Å²	120	54.3 Å²	54.3	56%	0.561	27%	0.273	S	S	*	.	H	α-helix	trans	-57.7	-47.3	171.5	-71.9	175.5	-172.7	0	0	111.6	K404 M410 Q411 Q412	K404-E408 WeakPolarHBondContact O-CG 3.13Å; K404-E408 PolarHBondContact O-N 3.4Å; E408-M410 VanDerWaalsContact C-N 3.31Å; E408-M410 PolarHBondContact O-N 2.63Å; E408-Q411 PolarHBondContact O-N 3.08Å; E408-Q412 WeakPolarHBondContact O-CG 3.43Å; E408-Q412 PolarHBondContact O-N 2.87Å
409	L	87	Confident	86	Confident	35 Å²	35	53.2 Å²	53.2	18%	0.183	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-38.3	176.3	-75	169.8	0	0	0	111.9	E405 Q406 E407 Q411 Q412 G438 A476	E405-L409 HydrophobicContact CG-CD1 4.29Å; E405-L409 WeakPolarHBondContact O-CB 3.49Å; E405-L409 VanDerWaalsContact O-CG 3.26Å; E405-L409 WeakPolarHBondContact O-CG 3.42Å; E405-L409 PolarHBondContact O-N 2.94Å; Q406-L409 PolarHBondContact O-N 3.37Å; E407-L409 PolarHBondContact O-N 3.45Å; L409-Q411 VanDerWaalsContact C-N 3.32Å; L409-Q412 WeakPolarHBondContact O-CB 3.41Å; L409-Q412 PolarHBondContact O-N 2.85Å; L409-G438 WeakPolarHBondContact O-CA 3.46Å; L409-G438 PolarHBondContact O-N 3.38Å; L409-A476 HydrophobicContact CB-CB 3.98Å
410	M	86.8	Confident	86.3	Confident	49 Å²	49	54.4 Å²	54.4	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-70.8	-26.9	178.7	-76	174	56.2	0	0	113.2	Q406 E407 E408 I439 R475 A476	Q406-M410 HydrophobicContact CG-SD 4.05Å; Q406-M410 WeakPolarHBondContact O-CB 3.34Å; Q406-M410 VanDerWaalsContact O-CG 3.22Å; Q406-M410 WeakPolarHBondContact O-CG 3.42Å; Q406-M410 PolarHBondContact O-N 3.41Å; E407-M410 PolarHBondContact O-N 3.48Å; E408-M410 VanDerWaalsContact C-N 3.31Å; E408-M410 PolarHBondContact O-N 2.63Å; M410-I439 HydrophobicContact CB-CD1 4.42Å; M410-I439 HydrophobicContact CB-CG1 4.31Å; M410-I439 HydrophobicContact CE-CD1 3.92Å; M410-I439 HydrophobicContact CE-CG1 4.37Å; M410-I439 HydrophobicContact CG-CG1 4.47Å; M410-R475 HydrophobicContact CE-CG 4.17Å; M410-R475 HydrophobicContact SD-CB 4.42Å; M410-R475 HydrophobicContact SD-CG 4.45Å; M410-A476 HydrophobicContact CG-CB 4.39Å
411	Q	89.2	Confident	86.9	Confident	148 Å²	148	52.4 Å²	52.4	69%	0.692	26%	0.259	S	S	*	.	H	α-helix	trans	-80.5	-16.7	175.6	-71	175.3	12.8	0	0	113.1	E407 E408 L409	E407-Q411 VanDerWaalsContact O-CG 3.3Å; E407-Q411 WeakPolarHBondContact O-CG 3.42Å; E407-Q411 PolarHBondContact O-N 2.8Å; E408-Q411 PolarHBondContact O-N 3.08Å; L409-Q411 VanDerWaalsContact C-N 3.32Å
412	Q	92.4	Very high	87.7	Confident	92 Å²	92	54.8 Å²	54.8	43%	0.43	26%	0.262	S	S	.	.	S	Bend	trans	-70.5	166.1	174.4	-71.6	170.6	31.6	0	0	112	E408 L409 G438	E408-Q412 WeakPolarHBondContact O-CG 3.43Å; E408-Q412 PolarHBondContact O-N 2.87Å; L409-Q412 WeakPolarHBondContact O-CB 3.41Å; L409-Q412 PolarHBondContact O-N 2.85Å; Q412-G438 WeakPolarHBondContact O-CA 2.97Å
413	L	93	Very high	88.5	Confident	65 Å²	65	54.3 Å²	54.3	34%	0.34	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-63.6	146.7	173.2	-66.6	176.8	0	0	0	111.3	E415 S437 E502 M503	L413-E415 PolarHBondContact O-N 2.92Å; L413-S437 CarbonylContact O-C 3.53Å; L413-S437 PolarHBondContact O-OG 3.11Å; L413-E502 HydrophobicContact CD1-CB 4.3Å; L413-E502 HydrophobicContact CD2-CB 4.41Å; L413-M503 HydrophobicContact CB-CE 3.53Å; L413-M503 HydrophobicContact CD1-CB 3.96Å
414	T	95.1	Very high	89.1	Confident	18 Å²	18	55.8 Å²	55.8	11%	0.11	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.8	126	-179.2	-50.2	0	0	0	0	110.9	L435 S437 I439 C440 L446 V499 S500	T414-L435 HydrophobicContact CG2-CD1 3.8Å; T414-S437 WeakPolarHBondContact CA-O 3.42Å; T414-I439 PolarHBondContact OG1-O 3.41Å; T414-C440 HydrophobicContact CG2-CB 3.92Å; T414-L446 HydrophobicContact CG2-CD1 4.33Å; T414-L446 HydrophobicContact CG2-CD2 4.11Å; T414-V499 CarbonylContact O-C 3.56Å; T414-V499 VanDerWaalsContact O-CA 3.25Å; T414-V499 WeakPolarHBondContact O-CA 3.32Å; T414-S500 PolarHBondContact O-N 3.34Å
415	E	94.5	Very high	89.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.009	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	110.4	173.2	178	-176.7	146	0	0	109.8	L413 L435 Y436 S437 M498 V499 M503 Y570 K572	L413-E415 PolarHBondContact O-N 2.92Å; E415-L435 WeakPolarHBondContact O-CD1 3.33Å; E415-Y436 PolarHBondContact O-N 2.83Å; E415-S437 WeakPolarHBondContact CB-OG 3.33Å; E415-S437 PolarHBondContact N-O 3.49Å; E415-S437 PolarHBondContact O-N 2.89Å; E415-M498 CarbonylContact C-O 3.49Å; E415-M498 WeakPolarHBondContact CA-O 3.16Å; E415-V499 HydrophobicContact CB-CG1 4.34Å; E415-V499 HydrophobicContact CG-CG1 4.12Å; E415-M503 HydrophobicContact CB-CE 4.19Å; E415-Y570 PolarHBondContact OE2-OH 3.35Å; E415-K572 IonicContact OE1-NZ 2.73Å; E415-K572 PolarHBondContact OE1-NZ 3.28Å; E415-K572 WeakPolarHBondContact OE2-CE 3.37Å; E415-K572 IonicContact OE2-NZ 2.72Å; E415-K572 PolarHBondContact OE2-NZ 3.16Å
416	F	95	Very high	89.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124	178.5	179.1	-89.4	0	0	0	110.3	V418 V431 G433 L435 L474 L482 V497 M498	F416-V418 HydrophobicContact CD1-CG2 4.32Å; F416-V418 HydrophobicContact CE1-CG2 4.44Å; F416-V431 HydrophobicContact CE1-CG2 4.18Å; F416-G433 VanDerWaalsContact CZ-C 3.47Å; F416-L435 HydrophobicContact CB-CD1 3.88Å; F416-L435 HydrophobicContact CD2-CB 4.09Å; F416-L435 HydrophobicContact CD2-CD1 4.3Å; F416-L474 HydrophobicContact CD2-CD2 4.02Å; F416-L474 HydrophobicContact CE2-CD2 3.92Å; F416-L482 HydrophobicContact CD1-CD1 3.73Å; F416-L482 HydrophobicContact CD2-CD1 3.93Å; F416-L482 HydrophobicContact CE1-CD1 3.65Å; F416-L482 HydrophobicContact CE1-CG 4.14Å; F416-L482 HydrophobicContact CE2-CD1 3.86Å; F416-L482 HydrophobicContact CE2-CG 4.1Å; F416-L482 HydrophobicContact CG-CD1 3.86Å; F416-L482 HydrophobicContact CZ-CD1 3.7Å; F416-L482 HydrophobicContact CZ-CG 3.81Å; F416-V497 CarbonylContact O-C 3.56Å; F416-V497 WeakPolarHBondContact O-CA 3.4Å; F416-M498 HydrophobicContact CB-CB 4.13Å; F416-M498 HydrophobicContact CD1-CB 4.35Å; F416-M498 HydrophobicContact CD1-CG 4.42Å; F416-M498 HydrophobicContact CD1-SD 3.8Å; F416-M498 HydrophobicContact CE1-SD 4.25Å; F416-M498 PolarHBondContact N-O 3.07Å; F416-M498 PolarHBondContact O-N 3.3Å
417	Q	94.1	Very high	90.1	Very high	21 Å²	21	64.1 Å²	64.1	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.9	-177.9	-67.1	-175.1	-0	0	0	110.3	G433 T434 V497 N536	Q417-G433 WeakPolarHBondContact O-CA 3.49Å; Q417-T434 PolarHBondContact N-O 3.36Å; Q417-T434 PolarHBondContact O-N 3.42Å; Q417-V497 HydrophobicContact CG-CG1 4.27Å; Q417-N536 HydrophobicContact CB-CB 4.41Å
418	V	94.2	Very high	90.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	111.4	-178.4	-177.9	0	0	0	0	110.3	F416 I421 V431 G495 M496 M498 N536	F416-V418 HydrophobicContact CD1-CG2 4.32Å; F416-V418 HydrophobicContact CE1-CG2 4.44Å; V418-I421 HydrophobicContact CG1-CG1 4.08Å; V418-V431 HydrophobicContact CG1-CB 4.1Å; V418-V431 HydrophobicContact CG1-CG1 4.11Å; V418-G495 PolarHBondContact O-N 3.35Å; V418-M496 HydrophobicContact CB-CB 4.47Å; V418-M496 WeakPolarHBondContact CB-O 3.49Å; V418-M496 PolarHBondContact N-O 2.92Å; V418-M498 HydrophobicContact CG2-CG 3.89Å; V418-M498 HydrophobicContact CG2-SD 3.99Å; V418-N536 PolarHBondContact N-ND2 3.43Å; V418-N536 PolarHBondContact O-ND2 2.9Å
419	D	91.5	Very high	90.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-36.6	-176.4	-63.9	-44.3	0	0	0	112.3	F278 S282 Y283 G432 G433 K494 N536	F278-D419 HydrophobicContact CE1-CB 4.46Å; F278-D419 HydrophobicContact CZ-CB 4.07Å; S282-D419 WeakPolarHBondContact CB-OD1 3.5Å; S282-D419 PolarHBondContact OG-OD1 2.76Å; S282-D419 PolarHBondContact OG-OD2 3.24Å; Y283-D419 HydrophobicContact CE1-CB 4.36Å; D419-G432 PolarHBondContact N-O 3.39Å; D419-G433 WeakPolarHBondContact OD2-CA 3.49Å; D419-K494 VanDerWaalsContact O-CD 3.26Å; D419-K494 WeakPolarHBondContact O-CD 3.32Å; D419-K494 WeakPolarHBondContact O-CE 3.46Å; D419-K494 WeakPolarHBondContact O-CG 3.42Å; D419-K494 PolarHBondContact O-NZ 2.86Å; D419-N536 WeakPolarHBondContact OD1-CB 3.48Å
420	E	89.8	Confident	91.1	Very high	47 Å²	47	53.3 Å²	53.3	22%	0.22	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	150.3	-174.4	-58.8	-107.8	96.2	0	0	110.5	Y283 Y422 V431 G432 K494	Y283-E420 WeakPolarHBondContact OH-CG 3.39Å; E420-Y422 HydrophobicContact CB-CE1 4.17Å; E420-Y422 HydrophobicContact CB-CE2 3.64Å; E420-Y422 VanDerWaalsContact CB-CZ 3.44Å; E420-Y422 VanDerWaalsContact CB-OH 3.28Å; E420-Y422 WeakPolarHBondContact CB-OH 3.18Å; E420-Y422 VanDerWaalsContact CD-OH 3.3Å; E420-Y422 WeakPolarHBondContact CG-OH 3.4Å; E420-Y422 PolarHBondContact OE2-OH 3.16Å; E420-V431 CarbonylContact O-C 3.56Å; E420-V431 WeakPolarHBondContact O-CA 3.39Å; E420-G432 PolarHBondContact N-O 3.25Å; E420-G432 PolarHBondContact O-N 3.24Å; E420-K494 IonicContact OE1-NZ 3.8Å; E420-K494 PolarHBondContact OE1-NZ 3.28Å
421	I	92.3	Very high	91.5	Very high	27 Å²	27	51 Å²	51	14%	0.138	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.6	176.6	-55.4	164.2	0	0	0	107	V418 V431 R489 L492	V418-I421 HydrophobicContact CG1-CG1 4.08Å; I421-V431 HydrophobicContact CG1-CG1 4.36Å; I421-R489 HydrophobicContact CG2-CG 4.13Å; I421-L492 HydrophobicContact CD1-CB 3.66Å; I421-L492 HydrophobicContact CG1-CB 4.43Å; I421-L492 HydrophobicContact CG2-CD1 4.47Å
422	Y	89.9	Confident	91.7	Very high	88 Å²	88	44.1 Å²	44.1	35%	0.345	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	158.3	-179.3	-45.7	-79.9	0	0	0	110.1	E420 V430 T481	E420-Y422 HydrophobicContact CB-CE1 4.17Å; E420-Y422 HydrophobicContact CB-CE2 3.64Å; E420-Y422 VanDerWaalsContact CB-CZ 3.44Å; E420-Y422 VanDerWaalsContact CB-OH 3.28Å; E420-Y422 WeakPolarHBondContact CB-OH 3.18Å; E420-Y422 VanDerWaalsContact CD-OH 3.3Å; E420-Y422 WeakPolarHBondContact CG-OH 3.4Å; E420-Y422 PolarHBondContact OE2-OH 3.16Å; Y422-V430 HydrophobicContact CD2-CG1 4.33Å; Y422-V430 PolarHBondContact N-O 3.08Å; Y422-V430 PolarHBondContact O-N 3.31Å; Y422-T481 HydrophobicContact CE2-CG2 4.11Å
423	T	89.1	Confident	91.7	Very high	81 Å²	81	40 Å²	40	50%	0.497	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.7	165.2	-62.1	0	0	0	0	106.5	R489	T423-R489 WeakPolarHBondContact OG1-CD 3.25Å; T423-R489 PolarHBondContact OG1-NH1 2.72Å
424	V	87.6	Confident	91.6	Very high	58 Å²	58	37.2 Å²	37.2	35%	0.352	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.9	-178.9	179.7	0	0	0	0	107.5	E426 V427 G428 V430	V424-E426 PolarHBondContact O-N 3.44Å; V424-V427 HydrophobicContact CB-CB 4.09Å; V424-V427 HydrophobicContact CG1-CB 4.09Å; V424-V427 HydrophobicContact CG1-CG2 3.99Å; V424-V427 PolarHBondContact O-N 3.39Å; V424-G428 PolarHBondContact N-O 3.45Å; V424-G428 PolarHBondContact O-N 3.14Å; V424-V430 HydrophobicContact CB-CG2 4.14Å; V424-V430 HydrophobicContact CG2-CB 4.29Å; V424-V430 HydrophobicContact CG2-CG2 3.76Å
425	P	86.7	Confident	91.4	Very high	109 Å²	109	36.4 Å²	36.4	71%	0.708	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	140.6	174.3	-24.3	33.9	0	0	0	110.6	V427	P425-V427 PolarHBondContact O-N 2.71Å
426	E	85.3	Confident	91.2	Very high	209 Å²	209	41.3 Å²	41.3	98%	0.977	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	-34.6	179.2	-52.4	176.4	177.1	0	0	115.9	V424	V424-E426 PolarHBondContact O-N 3.44Å
427	V	87.4	Confident	91.1	Very high	62 Å²	62	41.4 Å²	41.4	38%	0.376	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-33	179	-178.8	0	0	0	0	112.2	V424 P425 V430 A483	V424-V427 HydrophobicContact CB-CB 4.09Å; V424-V427 HydrophobicContact CG1-CB 4.09Å; V424-V427 HydrophobicContact CG1-CG2 3.99Å; V424-V427 PolarHBondContact O-N 3.39Å; P425-V427 PolarHBondContact O-N 2.71Å; V427-V430 HydrophobicContact CG1-CG2 3.86Å; V427-A483 HydrophobicContact CG1-CB 3.58Å
428	G	90.4	Very high	91	Very high	21 Å²	21	40.4 Å²	40.4	22%	0.216	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93.1	-135.5	-179.4	0	0	0	0	0	113.4	V424	V424-G428 PolarHBondContact N-O 3.45Å; V424-G428 PolarHBondContact O-N 3.14Å
429	T	94.4	Very high	91	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.4	-176.5	-62.3	0	0	0	0	110.4	L484 G485 F487 R489 L492	T429-L484 HydrophobicContact CG2-CD1 4.41Å; T429-L484 PolarHBondContact O-N 3.32Å; T429-G485 PolarHBondContact N-O 2.97Å; T429-G485 VanDerWaalsContact N-O 3.12Å; T429-F487 WeakPolarHBondContact CB-O 2.97Å; T429-F487 PolarHBondContact OG1-O 3.33Å; T429-R489 HydrophobicContact CG2-CB 4.26Å; T429-L492 HydrophobicContact CG2-CD1 3.51Å
430	V	94.8	Very high	91.1	Very high	12 Å²	12	42.6 Å²	42.6	7%	0.073	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.7	179.6	180	0	0	0	0	109.1	Y422 V424 V427 T481 L482 A483	Y422-V430 HydrophobicContact CD2-CG1 4.33Å; Y422-V430 PolarHBondContact N-O 3.08Å; Y422-V430 PolarHBondContact O-N 3.31Å; V424-V430 HydrophobicContact CB-CG2 4.14Å; V424-V430 HydrophobicContact CG2-CB 4.29Å; V424-V430 HydrophobicContact CG2-CG2 3.76Å; V427-V430 HydrophobicContact CG1-CG2 3.86Å; V430-T481 HydrophobicContact CG1-CG2 4.46Å; V430-L482 CarbonylContact C-O 3.5Å; V430-L482 WeakPolarHBondContact CA-O 3.5Å; V430-A483 HydrophobicContact CG2-CB 4.27Å
431	V	94.9	Very high	91.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.6	175.8	-65.3	0	0	0	0	110.3	F416 V418 E420 I421 T481 L482 L484 L492 M498	F416-V431 HydrophobicContact CE1-CG2 4.18Å; V418-V431 HydrophobicContact CG1-CB 4.1Å; V418-V431 HydrophobicContact CG1-CG1 4.11Å; E420-V431 CarbonylContact O-C 3.56Å; E420-V431 WeakPolarHBondContact O-CA 3.39Å; I421-V431 HydrophobicContact CG1-CG1 4.36Å; V431-T481 CarbonylContact O-C 3.58Å; V431-T481 VanDerWaalsContact O-CA 3.24Å; V431-T481 WeakPolarHBondContact O-CA 3.42Å; V431-L482 HydrophobicContact CG2-CB 3.89Å; V431-L482 PolarHBondContact N-O 3.13Å; V431-L482 PolarHBondContact O-N 3.42Å; V431-L484 HydrophobicContact CB-CD1 4.49Å; V431-L484 HydrophobicContact CG1-CD1 3.67Å; V431-L484 HydrophobicContact CG1-CG 4.45Å; V431-L484 HydrophobicContact CG2-CD1 4Å; V431-L484 HydrophobicContact CG2-CD2 4.14Å; V431-L484 HydrophobicContact CG2-CG 4.12Å; V431-L492 HydrophobicContact CG1-CD1 3.75Å; V431-M498 HydrophobicContact CG2-SD 3.71Å
432	G	93.1	Very high	91.4	Very high	4 Å²	4	50.4 Å²	50.4	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.1	173.1	0	0	0	0	0	110.2	D419 E420 A480	D419-G432 PolarHBondContact N-O 3.39Å; E420-G432 PolarHBondContact N-O 3.25Å; E420-G432 PolarHBondContact O-N 3.24Å; G432-A480 WeakPolarHBondContact CA-O 3.49Å
433	G	92	Very high	91.6	Very high	4 Å²	4	48.1 Å²	48.1	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	-178.1	-172.8	0	0	0	0	0	114.4	F416 Q417 D419 A479 A480	F416-G433 VanDerWaalsContact CZ-C 3.47Å; Q417-G433 WeakPolarHBondContact O-CA 3.49Å; D419-G433 WeakPolarHBondContact OD2-CA 3.49Å; G433-A479 CarbonylContact O-C 3.53Å; G433-A479 VanDerWaalsContact O-CA 3.29Å; G433-A479 WeakPolarHBondContact O-CA 3.5Å; G433-A480 PolarHBondContact N-O 3.49Å; G433-A480 PolarHBondContact O-N 3.03Å
434	T	90.8	Very high	91.8	Very high	8 Å²	8	46.5 Å²	46.5	5%	0.049	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.4	177.7	-54.5	0	0	0	0	110.1	Q417 Y436	Q417-T434 PolarHBondContact N-O 3.36Å; Q417-T434 PolarHBondContact O-N 3.42Å; T434-Y436 PolarHBondContact O-N 3.1Å
435	L	92.3	Very high	92.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.1	170.7	-171.2	63.6	0	0	0	108.6	T414 E415 F416 S437 C440 L474 R475 A476 G477 Q478	T414-L435 HydrophobicContact CG2-CD1 3.8Å; E415-L435 WeakPolarHBondContact O-CD1 3.33Å; F416-L435 HydrophobicContact CB-CD1 3.88Å; F416-L435 HydrophobicContact CD2-CB 4.09Å; F416-L435 HydrophobicContact CD2-CD1 4.3Å; L435-S437 WeakPolarHBondContact CD1-O 3.37Å; L435-C440 HydrophobicContact CD1-CB 4.2Å; L435-C440 HydrophobicContact CD2-CB 4.07Å; L435-L474 HydrophobicContact CB-CD2 3.77Å; L435-L474 HydrophobicContact CB-CG 4.01Å; L435-L474 HydrophobicContact CD2-CB 4.11Å; L435-L474 HydrophobicContact CD2-CD2 4.14Å; L435-L474 HydrophobicContact CD2-CG 3.82Å; L435-L474 VanDerWaalsContact CD2-O 3.24Å; L435-L474 WeakPolarHBondContact CD2-O 3.44Å; L435-L474 HydrophobicContact CG-CD2 4.47Å; L435-R475 VanDerWaalsContact CD2-C 3.46Å; L435-A476 CarbonylContact O-C 3.59Å; L435-G477 WeakPolarHBondContact O-CA 3.49Å; L435-G477 PolarHBondContact O-N 3.43Å; L435-Q478 PolarHBondContact N-O 3.35Å
436	Y	90.2	Very high	92.6	Very high	106 Å²	106	45.2 Å²	45.2	42%	0.416	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-47.9	-178.3	-175.7	-94.7	0	0	0	111.6	E415 T434 K572	E415-Y436 PolarHBondContact O-N 2.83Å; T434-Y436 PolarHBondContact O-N 3.1Å; Y436-K572 VanDerWaalsContact CE1-NZ 3.32Å
437	S	92.1	Very high	93.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	161.3	179	61.9	0	0	0	0	111.8	L413 T414 E415 L435	L413-S437 CarbonylContact O-C 3.53Å; L413-S437 PolarHBondContact O-OG 3.11Å; T414-S437 WeakPolarHBondContact CA-O 3.42Å; E415-S437 WeakPolarHBondContact CB-OG 3.33Å; E415-S437 PolarHBondContact N-O 3.49Å; E415-S437 PolarHBondContact O-N 2.89Å; L435-S437 WeakPolarHBondContact CD1-O 3.37Å
438	G	92.9	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	75.8	-158.6	179.9	0	0	0	0	0	114.4	L409 Q412 A476	L409-G438 WeakPolarHBondContact O-CA 3.46Å; L409-G438 PolarHBondContact O-N 3.38Å; Q412-G438 WeakPolarHBondContact O-CA 2.97Å; G438-A476 PolarHBondContact O-N 3.27Å
439	I	93.4	Very high	93.6	Very high	47 Å²	47	32.4 Å²	32.4	24%	0.241	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.6	178.1	-60.6	173.4	0	0	0	107.1	M410 T414 R441 V473 L474	M410-I439 HydrophobicContact CB-CD1 4.42Å; M410-I439 HydrophobicContact CB-CG1 4.31Å; M410-I439 HydrophobicContact CE-CD1 3.92Å; M410-I439 HydrophobicContact CE-CG1 4.37Å; M410-I439 HydrophobicContact CG-CG1 4.47Å; T414-I439 PolarHBondContact OG1-O 3.41Å; I439-R441 HydrophobicContact CG2-CG 4.21Å; I439-V473 HydrophobicContact CG2-CG1 3.46Å; I439-V473 VanDerWaalsContact CG2-CG1 3.46Å; I439-L474 WeakPolarHBondContact CA-O 3.41Å
440	C	94.6	Very high	93.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.2	174.3	179.4	0	0	0	0	108.8	T414 L435 L474	T414-C440 HydrophobicContact CG2-CB 3.92Å; L435-C440 HydrophobicContact CD1-CB 4.2Å; L435-C440 HydrophobicContact CD2-CB 4.07Å; C440-L474 HydrophobicContact CB-CB 4.23Å; C440-L474 PolarHBondContact N-O 3.4Å; C440-L474 PolarHBondContact O-N 3.42Å
441	R	94.6	Very high	93.3	Very high	145 Å²	145	32 Å²	32	55%	0.547	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	153.5	179.6	-55.3	-178	177.2	176.5	0.5	110.5	I439 G443 D444 R472 V473	I439-R441 HydrophobicContact CG2-CG 4.21Å; R441-G443 PolarHBondContact O-N 3.14Å; R441-D444 PolarHBondContact N-OD2 3.05Å; R441-D444 WeakPolarHBondContact O-CB 3.46Å; R441-D444 PolarHBondContact O-N 3.23Å; R441-D444 VanDerWaalsContact O-N 3.11Å; R441-R472 WeakPolarHBondContact CA-O 3.24Å; R441-V473 HydrophobicContact CG-CG1 4.46Å; R441-V473 HydrophobicContact CG-CG2 4.25Å
442	E	93.4	Very high	92.9	Very high	93 Å²	93	38 Å²	38	44%	0.435	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	128.5	168	-163.9	177	-177.8	0	0	110	G462 R472	E442-G462 WeakPolarHBondContact CG-O 3.24Å; E442-R472 PolarHBondContact N-O 2.83Å
443	G	93	Very high	92.6	Very high	39 Å²	39	43.9 Å²	43.9	40%	0.402	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	-4.8	-175.1	0	0	0	0	0	115.8	R441 V461	R441-G443 PolarHBondContact O-N 3.14Å; G443-V461 WeakPolarHBondContact CA-O 3.41Å; G443-V461 PolarHBondContact N-O 3.31Å
444	D	94.7	Very high	92.2	Very high	47 Å²	47	43.7 Å²	43.7	25%	0.251	21%	0.214	S	C	.	.			trans	-64.7	142.7	-178.9	-79.4	-8.3	0	0	0	112.5	R441 T460 V461	R441-D444 PolarHBondContact N-OD2 3.05Å; R441-D444 WeakPolarHBondContact O-CB 3.46Å; R441-D444 PolarHBondContact O-N 3.23Å; R441-D444 VanDerWaalsContact O-N 3.11Å; D444-T460 WeakPolarHBondContact O-CA 3.38Å; D444-V461 PolarHBondContact O-N 3.21Å
445	H	95.1	Very high	92.2	Very high	136 Å²	136	48 Å²	48	63%	0.63	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	116.6	172.9	-58.9	-57.1	0	0	0	110.1	T460 P501	H445-T460 PolarHBondContact CE1-OG1 3.42Å; H445-T460 PolarHBondContact ND1-OG1 3.24Å; H445-P501 WeakPolarHBondContact O-CD 3.34Å
446	L	95.4	Very high	92.2	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	170.9	180	-60.7	177.2	0	0	0	110.2	T414 L459 V461 M498	T414-L446 HydrophobicContact CG2-CD1 4.33Å; T414-L446 HydrophobicContact CG2-CD2 4.11Å; L446-L459 HydrophobicContact CB-CD1 3.91Å; L446-L459 HydrophobicContact CB-CG 4.46Å; L446-L459 PolarHBondContact N-O 3.49Å; L446-L459 VanDerWaalsContact N-O 3.09Å; L446-L459 PolarHBondContact O-N 3.05Å; L446-L459 VanDerWaalsContact O-O 3.1Å; L446-V461 HydrophobicContact CD1-CG2 3.82Å; L446-V461 HydrophobicContact CG-CG2 4.34Å; L446-M498 HydrophobicContact CD1-CB 4.34Å; L446-M498 HydrophobicContact CD1-CE 3.88Å
447	V	95	Very high	92.4	Very high	20 Å²	20	48.2 Å²	48.2	12%	0.121	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138	169.6	-62.9	0	0	0	0	110.6	F456 H457 K458 M498 V499 P501	V447-F456 HydrophobicContact CB-CB 4.11Å; V447-F456 HydrophobicContact CB-CD1 4.23Å; V447-F456 HydrophobicContact CG2-CB 4.24Å; V447-F456 HydrophobicContact CG2-CD1 3.85Å; V447-F456 HydrophobicContact CG2-CG 4.34Å; V447-H457 CarbonylContact C-O 3.48Å; V447-H457 VanDerWaalsContact CA-O 3.24Å; V447-H457 WeakPolarHBondContact CA-O 3.22Å; V447-K458 HydrophobicContact CG1-CG 4.07Å; V447-M498 CarbonylContact O-C 3.57Å; V447-M498 VanDerWaalsContact O-CA 3.25Å; V447-M498 WeakPolarHBondContact O-CA 3.26Å; V447-V499 HydrophobicContact CG2-CG2 3.57Å; V447-V499 WeakPolarHBondContact CG2-O 3.36Å; V447-V499 PolarHBondContact N-O 3.18Å; V447-V499 PolarHBondContact O-N 3.42Å; V447-P501 HydrophobicContact CG1-CB 4.38Å; V447-P501 HydrophobicContact CG1-CG 4.3Å
448	V	95	Very high	92.4	Very high	2 Å²	2	57 Å²	57	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.5	179.2	66.4	0	0	0	0	111.7	F456 H457 L459 F487 L492 M496 V497 M498	V448-F456 VanDerWaalsContact C-CD1 3.42Å; V448-F456 CarbonylContact O-C 3.53Å; V448-F456 VanDerWaalsContact O-CA 3.31Å; V448-F456 WeakPolarHBondContact O-CA 3.26Å; V448-H457 HydrophobicContact CG1-CB 4.33Å; V448-H457 PolarHBondContact N-O 2.69Å; V448-H457 PolarHBondContact O-N 3.25Å; V448-L459 HydrophobicContact CB-CD2 3.62Å; V448-L459 HydrophobicContact CG1-CD2 3.71Å; V448-L459 HydrophobicContact CG2-CD2 4.49Å; V448-F487 HydrophobicContact CG1-CE1 4.34Å; V448-F487 HydrophobicContact CG1-CE2 4.41Å; V448-F487 HydrophobicContact CG1-CZ 3.8Å; V448-L492 HydrophobicContact CB-CD2 4.45Å; V448-L492 HydrophobicContact CG1-CD2 3.94Å; V448-L492 HydrophobicContact CG2-CD2 3.75Å; V448-M496 HydrophobicContact CG2-CB 4.2Å; V448-M496 HydrophobicContact CG2-SD 4.23Å; V448-V497 WeakPolarHBondContact CA-O 3.37Å; V448-M498 HydrophobicContact CB-CG 3.95Å; V448-M498 HydrophobicContact CG2-CG 3.76Å
449	G	93.8	Very high	92.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176	-171.9	-179.6	0	0	0	0	0	111.2	F456 M496 V497	G449-F456 VanDerWaalsContact CA-CE1 3.49Å; G449-F456 VanDerWaalsContact N-CD1 3.33Å; G449-M496 CarbonylContact O-C 3.59Å; G449-M496 WeakPolarHBondContact O-CA 3.01Å; G449-M496 WeakPolarHBondContact O-CB 3.4Å; G449-V497 PolarHBondContact N-O 3.46Å; G449-V497 WeakPolarHBondContact O-CG2 3.42Å; G449-V497 PolarHBondContact O-N 2.96Å; G449-V497 VanDerWaalsContact O-O 3.05Å
450	P	93.5	Very high	92.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.286	C	S	.	.			cis	-76.7	137.9	-3.4	26.9	-29.3	0	0	0	112.2	F456 R493 M496 I507 P568	P450-F456 HydrophobicContact CB-CE2 4.49Å; P450-R493 PolarHBondContact O-NE 2.81Å; P450-R493 PolarHBondContact O-NH2 2.91Å; P450-M496 WeakPolarHBondContact O-CE 3.36Å; P450-I507 HydrophobicContact CB-CD1 4.2Å; P450-I507 HydrophobicContact CB-CG1 4.45Å; P450-I507 HydrophobicContact CB-CG2 3.96Å; P450-I507 HydrophobicContact CG-CG2 4.27Å; P450-P568 WeakPolarHBondContact CG-O 3.43Å
451	T	90.4	Very high	92.6	Very high	14 Å²	14	58.4 Å²	58.4	9%	0.086	29%	0.286	C	S	.	.			trans	-68.3	178.2	167.3	67.3	0	0	0	0	111.2	L453 G454 Q455 H457 M496	T451-L453 PolarHBondContact O-N 3.34Å; T451-L453 PolarHBondContact OG1-N 3.06Å; T451-G454 WeakPolarHBondContact O-CA 3.49Å; T451-G454 PolarHBondContact O-N 3.03Å; T451-Q455 VanDerWaalsContact CG2-O 3.32Å; T451-Q455 WeakPolarHBondContact CG2-O 3.25Å; T451-Q455 PolarHBondContact N-O 3.44Å; T451-Q455 PolarHBondContact OG1-N 3.16Å; T451-Q455 PolarHBondContact OG1-O 3.29Å; T451-H457 WeakPolarHBondContact CG2-CD2 3.43Å; T451-H457 VanDerWaalsContact CG2-NE2 3.26Å; T451-H457 WeakPolarHBondContact CG2-NE2 3.47Å; T451-M496 HydrophobicContact CG2-CE 4.32Å
452	E	86.7	Confident	92.6	Very high	126 Å²	126	53.3 Å²	53.3	59%	0.589	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.5	176.7	-59.1	-167.7	152.3	0	0	112.7	G454 P568	E452-G454 VanDerWaalsContact C-N 3.32Å; E452-P568 WeakPolarHBondContact O-CD 3.46Å
453	L	85.1	Confident	92.6	Very high	128 Å²	128	50.7 Å²	50.7	67%	0.67	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	2.3	173.2	-59.3	177.8	0	0	0	113	T451 Q455 Y598	T451-L453 PolarHBondContact O-N 3.34Å; T451-L453 PolarHBondContact OG1-N 3.06Å; L453-Q455 VanDerWaalsContact C-N 3.3Å; L453-Q455 HydrophobicContact CB-CG 4.28Å; L453-Q455 PolarHBondContact O-N 3.24Å; L453-Y598 PolarHBondContact O-OH 3.32Å; L453-Y598 VanDerWaalsContact O-OH 3.07Å
454	G	85.3	Confident	92.6	Very high	1 Å²	1	49 Å²	49	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	73.6	15.2	-175.3	0	0	0	0	0	114.5	T451 E452 I507 Y598	T451-G454 WeakPolarHBondContact O-CA 3.49Å; T451-G454 PolarHBondContact O-N 3.03Å; E452-G454 VanDerWaalsContact C-N 3.32Å; G454-I507 WeakPolarHBondContact O-CD1 3.49Å; G454-Y598 WeakPolarHBondContact CA-OH 3.37Å; G454-Y598 PolarHBondContact O-OH 2.74Å
455	Q	89.6	Confident	92.4	Very high	99 Å²	99	50.6 Å²	50.6	46%	0.463	26%	0.258	S	S	.	.			trans	-87.6	164.9	-179	-64	176.2	-8.9	0	0	111.5	T451 L453	T451-Q455 VanDerWaalsContact CG2-O 3.32Å; T451-Q455 WeakPolarHBondContact CG2-O 3.25Å; T451-Q455 PolarHBondContact N-O 3.44Å; T451-Q455 PolarHBondContact OG1-N 3.16Å; T451-Q455 PolarHBondContact OG1-O 3.29Å; L453-Q455 VanDerWaalsContact C-N 3.3Å; L453-Q455 HydrophobicContact CB-CG 4.28Å; L453-Q455 PolarHBondContact O-N 3.24Å
456	F	92.6	Very high	91.9	Very high	50 Å²	50	44.5 Å²	44.5	22%	0.219	23%	0.23	C	C	.	.			trans	-117.2	136.8	175.1	-82.1	-96.6	0	0	0	110.4	V447 V448 G449 P450 V497 V499 P505 I507	V447-F456 HydrophobicContact CB-CB 4.11Å; V447-F456 HydrophobicContact CB-CD1 4.23Å; V447-F456 HydrophobicContact CG2-CB 4.24Å; V447-F456 HydrophobicContact CG2-CD1 3.85Å; V447-F456 HydrophobicContact CG2-CG 4.34Å; V448-F456 VanDerWaalsContact C-CD1 3.42Å; V448-F456 CarbonylContact O-C 3.53Å; V448-F456 VanDerWaalsContact O-CA 3.31Å; V448-F456 WeakPolarHBondContact O-CA 3.26Å; G449-F456 VanDerWaalsContact CA-CE1 3.49Å; G449-F456 VanDerWaalsContact N-CD1 3.33Å; P450-F456 HydrophobicContact CB-CE2 4.49Å; F456-V497 HydrophobicContact CE1-CG2 4.09Å; F456-V497 HydrophobicContact CZ-CG2 4.21Å; F456-V499 HydrophobicContact CD1-CG2 4.29Å; F456-V499 HydrophobicContact CE1-CG2 3.93Å; F456-P505 HydrophobicContact CD2-CG 4.07Å; F456-P505 HydrophobicContact CE1-CG 4.16Å; F456-P505 HydrophobicContact CE2-CB 4.08Å; F456-P505 HydrophobicContact CE2-CG 3.36Å; F456-P505 HydrophobicContact CZ-CB 3.81Å; F456-P505 HydrophobicContact CZ-CG 3.43Å; F456-P505 VanDerWaalsContact CZ-CG 3.43Å; F456-I507 HydrophobicContact CD2-CD1 4.06Å; F456-I507 HydrophobicContact CE2-CD1 3.5Å; F456-I507 HydrophobicContact CE2-CG1 4.01Å
457	H	93.3	Very high	91.1	Very high	60 Å²	60	45.9 Å²	45.9	28%	0.278	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.5	178.5	-65.1	-57.3	0	0	0	110.9	V447 V448 T451 F487	V447-H457 CarbonylContact C-O 3.48Å; V447-H457 VanDerWaalsContact CA-O 3.24Å; V447-H457 WeakPolarHBondContact CA-O 3.22Å; V448-H457 HydrophobicContact CG1-CB 4.33Å; V448-H457 PolarHBondContact N-O 2.69Å; V448-H457 PolarHBondContact O-N 3.25Å; T451-H457 WeakPolarHBondContact CG2-CD2 3.43Å; T451-H457 VanDerWaalsContact CG2-NE2 3.26Å; T451-H457 WeakPolarHBondContact CG2-NE2 3.47Å; H457-F487 HydrophobicContact CB-CE2 4.42Å; H457-F487 HydrophobicContact CB-CZ 4.22Å
458	K	93.8	Very high	90.4	Very high	184 Å²	184	53.3 Å²	53.3	80%	0.8	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	140.7	175.9	-64.2	-178.6	179.2	-177.1	0	110.3	V447	V447-K458 HydrophobicContact CG1-CG 4.07Å
459	L	94.8	Very high	89.8	Confident	11 Å²	11	53.4 Å²	53.4	6%	0.058	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	168.4	172	67.1	73.6	0	0	0	110.3	L446 V448 V461 L484 F487 M498	L446-L459 HydrophobicContact CB-CD1 3.91Å; L446-L459 HydrophobicContact CB-CG 4.46Å; L446-L459 PolarHBondContact N-O 3.49Å; L446-L459 VanDerWaalsContact N-O 3.09Å; L446-L459 PolarHBondContact O-N 3.05Å; L446-L459 VanDerWaalsContact O-O 3.1Å; V448-L459 HydrophobicContact CB-CD2 3.62Å; V448-L459 HydrophobicContact CG1-CD2 3.71Å; V448-L459 HydrophobicContact CG2-CD2 4.49Å; L459-V461 HydrophobicContact CD1-CG2 4.21Å; L459-L484 HydrophobicContact CD1-CD2 4.09Å; L459-L484 HydrophobicContact CD2-CD1 4.13Å; L459-L484 HydrophobicContact CD2-CD2 4.07Å; L459-F487 HydrophobicContact CB-CD2 3.98Å; L459-F487 HydrophobicContact CB-CE2 4.08Å; L459-M498 HydrophobicContact CD1-CE 3.74Å; L459-M498 HydrophobicContact CD2-CE 3.83Å; L459-M498 HydrophobicContact CD2-CG 4.17Å; L459-M498 HydrophobicContact CD2-SD 4.16Å; L459-M498 HydrophobicContact CG-CE 4.41Å
460	T	94.5	Very high	89.5	Confident	66 Å²	66	56.9 Å²	56.9	41%	0.405	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.8	170.4	-55.1	0	0	0	0	108.8	D444 H445 G462	D444-T460 WeakPolarHBondContact O-CA 3.38Å; H445-T460 PolarHBondContact CE1-OG1 3.42Å; H445-T460 PolarHBondContact ND1-OG1 3.24Å; T460-G462 PolarHBondContact O-N 3.02Å
461	V	95.5	Very high	89.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.296	C	S	.	.			trans	-76.8	114.6	175.1	180	0	0	0	0	108.1	G443 D444 L446 L459 I464 L482 M498	G443-V461 WeakPolarHBondContact CA-O 3.41Å; G443-V461 PolarHBondContact N-O 3.31Å; D444-V461 PolarHBondContact O-N 3.21Å; L446-V461 HydrophobicContact CD1-CG2 3.82Å; L446-V461 HydrophobicContact CG-CG2 4.34Å; L459-V461 HydrophobicContact CD1-CG2 4.21Å; V461-I464 HydrophobicContact CG1-CD1 4.11Å; V461-I464 HydrophobicContact CG1-CG1 3.8Å; V461-L482 HydrophobicContact CG1-CB 4.45Å; V461-L482 HydrophobicContact CG1-CD2 4.24Å; V461-M498 HydrophobicContact CG2-CE 4.19Å
462	G	93.1	Very high	89	Confident	38 Å²	38	66.2 Å²	66.2	39%	0.392	33%	0.328	S	S	.	.			trans	-77	-70.5	-178.5	0	0	0	0	0	112.2	E442 T460 A483	E442-G462 WeakPolarHBondContact CG-O 3.24Å; T460-G462 PolarHBondContact O-N 3.02Å; G462-A483 WeakPolarHBondContact CA-O 3.23Å; G462-A483 PolarHBondContact N-O 3.47Å
463	S	93.6	Very high	89.1	Confident	39 Å²	39	63.1 Å²	63.1	27%	0.273	32%	0.317	S	S	.	.			trans	-135.2	148.1	178.3	66.7	0	0	0	0	110.5	A483	S463-A483 PolarHBondContact O-N 3.25Å; S463-A483 VanDerWaalsContact OG-CB 3.29Å; S463-A483 WeakPolarHBondContact OG-CB 3.49Å
464	I	93.2	Very high	89.3	Confident	2 Å²	2	57 Å²	57	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.1	178.5	-49.4	-175.2	0	0	0	109.1	V461 C471 L474 A480 L482	V461-I464 HydrophobicContact CG1-CD1 4.11Å; V461-I464 HydrophobicContact CG1-CG1 3.8Å; I464-C471 WeakPolarHBondContact CB-O 3.47Å; I464-C471 WeakPolarHBondContact CG2-SG 3.45Å; I464-C471 PolarHBondContact O-N 2.91Å; I464-C471 VanDerWaalsContact O-O 3.11Å; I464-L474 HydrophobicContact CD1-CB 4.38Å; I464-L474 HydrophobicContact CG2-CB 4.33Å; I464-A480 HydrophobicContact CG2-CB 4.05Å; I464-L482 HydrophobicContact CB-CD2 4.06Å; I464-L482 HydrophobicContact CD1-CD2 4Å; I464-L482 HydrophobicContact CG1-CD2 3.64Å; I464-L482 HydrophobicContact CG2-CD2 3.69Å
465	Q	90.4	Very high	89.5	Confident	81 Å²	81	60.8 Å²	60.8	38%	0.379	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.4	171.2	-63.3	-177.8	6.2	0	0	110.9	S469 A480 T481	Q465-S469 CarbonylContact C-O 3.52Å; Q465-S469 VanDerWaalsContact CA-O 3.22Å; Q465-S469 WeakPolarHBondContact CA-O 3.43Å; Q465-A480 CarbonylContact O-C 3.59Å; Q465-A480 WeakPolarHBondContact O-CA 3.07Å; Q465-A480 WeakPolarHBondContact O-CB 3.46Å; Q465-T481 PolarHBondContact N-O 3.23Å; Q465-T481 PolarHBondContact O-N 2.72Å; Q465-T481 PolarHBondContact O-OG1 3.31Å
466	R	86.3	Confident	89.5	Confident	8 Å²	8	56.2 Å²	56.2	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.5	173.2	-173.3	-175.6	72.5	-154.1	-6.1	108.6	Q173 F175 R468 S469 Q478 A479	Q173-R466 PolarHBondContact O-NH1 3.46Å; Q173-R466 PolarHBondContact O-NH2 2.71Å; F175-R466 VanDerWaalsContact CZ-CZ 3.46Å; R466-R468 PolarHBondContact O-N 2.93Å; R466-R468 VanDerWaalsContact O-N 3.17Å; R466-S469 PolarHBondContact N-O 2.81Å; R466-S469 WeakPolarHBondContact O-CB 3.27Å; R466-S469 PolarHBondContact O-N 3.31Å; R466-Q478 VanDerWaalsContact NH1-NE2 3.13Å; R466-A479 WeakPolarHBondContact CG-O 3.33Å
467	N	77.9	Confident	89	Confident	35 Å²	35	55.2 Å²	55.2	19%	0.187	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	37	-177.6	-62.3	-22.5	0	0	0	113.4	A250 C254 S469	A250-N467 WeakPolarHBondContact CB-O 3.43Å; C254-N467 VanDerWaalsContact SG-CB 3.59Å; N467-S469 PolarHBondContact O-N 2.84Å
468	R	79.8	Confident	88.6	Confident	176 Å²	176	53.8 Å²	53.8	66%	0.664	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-4.9	-174.4	-50.1	177.7	-179.4	164	2.4	115.5	R466	R466-R468 PolarHBondContact O-N 2.93Å; R466-R468 VanDerWaalsContact O-N 3.17Å
469	S	83.3	Confident	88.4	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.028	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.8	173.5	-44.4	0	0	0	0	111	E251 Q465 R466 N467 C471	E251-S469 VanDerWaalsContact CA-OG 3.29Å; E251-S469 WeakPolarHBondContact CA-OG 3.47Å; E251-S469 WeakPolarHBondContact CG-OG 3.04Å; Q465-S469 CarbonylContact C-O 3.52Å; Q465-S469 VanDerWaalsContact CA-O 3.22Å; Q465-S469 WeakPolarHBondContact CA-O 3.43Å; R466-S469 PolarHBondContact N-O 2.81Å; R466-S469 WeakPolarHBondContact O-CB 3.27Å; R466-S469 PolarHBondContact O-N 3.31Å; N467-S469 PolarHBondContact O-N 2.84Å; S469-C471 PolarHBondContact O-N 3.19Å
470	A	86.1	Confident	88.2	Confident	72 Å²	72	46.2 Å²	46.2	60%	0.595	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	134	172.9	0	0	0	0	0	110.7	Q173	Q173-A470 PolarHBondContact NE2-O 2.94Å; Q173-A470 PolarHBondContact OE1-O 3.36Å
471	C	86.1	Confident	88.1	Confident	13 Å²	13	45 Å²	45	9%	0.088	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.9	173	67.8	0	0	0	0	110.4	I464 S469	I464-C471 WeakPolarHBondContact CB-O 3.47Å; I464-C471 WeakPolarHBondContact CG2-SG 3.45Å; I464-C471 PolarHBondContact O-N 2.91Å; I464-C471 VanDerWaalsContact O-O 3.11Å; S469-C471 PolarHBondContact O-N 3.19Å
472	R	87.4	Confident	88.1	Confident	197 Å²	197	45 Å²	45	74%	0.743	24%	0.242	S	C	*	.	S	Bend	trans	-94.2	-20.5	-178.7	-67.6	-177.2	176	171.7	0.4	113.6	R441 E442	R441-R472 WeakPolarHBondContact CA-O 3.24Å; E442-R472 PolarHBondContact N-O 2.83Å
473	V	89.6	Confident	88.2	Confident	61 Å²	61	43.5 Å²	43.5	37%	0.37	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130.4	-172.4	-175.4	0	0	0	0	109.3	I439 R441	I439-V473 HydrophobicContact CG2-CG1 3.46Å; I439-V473 VanDerWaalsContact CG2-CG1 3.46Å; R441-V473 HydrophobicContact CG-CG1 4.46Å; R441-V473 HydrophobicContact CG-CG2 4.25Å
474	L	90	Very high	88.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.4	173.3	-171.7	65.7	0	0	0	109.3	F416 L435 I439 C440 I464 Q478 A480 L482	F416-L474 HydrophobicContact CD2-CD2 4.02Å; F416-L474 HydrophobicContact CE2-CD2 3.92Å; L435-L474 HydrophobicContact CB-CD2 3.77Å; L435-L474 HydrophobicContact CB-CG 4.01Å; L435-L474 HydrophobicContact CD2-CB 4.11Å; L435-L474 HydrophobicContact CD2-CD2 4.14Å; L435-L474 HydrophobicContact CD2-CG 3.82Å; L435-L474 VanDerWaalsContact CD2-O 3.24Å; L435-L474 WeakPolarHBondContact CD2-O 3.44Å; L435-L474 HydrophobicContact CG-CD2 4.47Å; I439-L474 WeakPolarHBondContact CA-O 3.41Å; C440-L474 HydrophobicContact CB-CB 4.23Å; C440-L474 PolarHBondContact N-O 3.4Å; C440-L474 PolarHBondContact O-N 3.42Å; I464-L474 HydrophobicContact CD1-CB 4.38Å; I464-L474 HydrophobicContact CG2-CB 4.33Å; L474-Q478 HydrophobicContact CD1-CB 3.45Å; L474-Q478 VanDerWaalsContact CD1-CB 3.45Å; L474-Q478 HydrophobicContact CG-CB 4.31Å; L474-A480 HydrophobicContact CD1-CB 3.62Å; L474-A480 HydrophobicContact CD2-CB 3.62Å; L474-A480 HydrophobicContact CG-CB 4.26Å; L474-L482 HydrophobicContact CD2-CD2 4.43Å
475	R	89	Confident	87.9	Confident	81 Å²	81	43.3 Å²	43.3	31%	0.306	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	153.6	179.6	-62.7	-179.8	178.9	166	3.1	111.3	Q174 M410 L435 G477 Q478	Q174-R475 VanDerWaalsContact OE1-CZ 3.26Å; M410-R475 HydrophobicContact CE-CG 4.17Å; M410-R475 HydrophobicContact SD-CB 4.42Å; M410-R475 HydrophobicContact SD-CG 4.45Å; L435-R475 VanDerWaalsContact CD2-C 3.46Å; R475-G477 PolarHBondContact O-N 3.49Å; R475-Q478 VanDerWaalsContact O-CB 3.27Å; R475-Q478 WeakPolarHBondContact O-CB 3.5Å; R475-Q478 WeakPolarHBondContact O-CG 3.12Å; R475-Q478 PolarHBondContact O-N 2.79Å; R475-Q478 VanDerWaalsContact O-N 3.08Å
476	A	88.7	Confident	87.6	Confident	2 Å²	2	47.6 Å²	47.6	2%	0.017	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	139.5	175.6	0	0	0	0	0	112.3	Q406 L409 M410 L435 G438 Q478	Q406-A476 PolarHBondContact NE2-O 2.95Å; L409-A476 HydrophobicContact CB-CB 3.98Å; M410-A476 HydrophobicContact CG-CB 4.39Å; L435-A476 CarbonylContact O-C 3.59Å; G438-A476 PolarHBondContact O-N 3.27Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 3.45Å
477	G	82.6	Confident	87.8	Confident	30 Å²	30	48.7 Å²	48.7	31%	0.309	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-15.8	-174.7	0	0	0	0	0	115.4	R179 L435 R475	R179-G477 PolarHBondContact NH1-O 3.2Å; L435-G477 WeakPolarHBondContact O-CA 3.49Å; L435-G477 PolarHBondContact O-N 3.43Å; R475-G477 PolarHBondContact O-N 3.49Å
478	Q	85.9	Confident	88.4	Confident	29 Å²	29	51.1 Å²	51.1	14%	0.136	27%	0.272	C	S	.	.			trans	-86.6	140.4	-177.4	-63.2	-179.6	-32.6	0	0	112.2	L435 R466 L474 R475 A476	L435-Q478 PolarHBondContact N-O 3.35Å; R466-Q478 VanDerWaalsContact NH1-NE2 3.13Å; L474-Q478 HydrophobicContact CD1-CB 3.45Å; L474-Q478 VanDerWaalsContact CD1-CB 3.45Å; L474-Q478 HydrophobicContact CG-CB 4.31Å; R475-Q478 VanDerWaalsContact O-CB 3.27Å; R475-Q478 WeakPolarHBondContact O-CB 3.5Å; R475-Q478 WeakPolarHBondContact O-CG 3.12Å; R475-Q478 PolarHBondContact O-N 2.79Å; R475-Q478 VanDerWaalsContact O-N 3.08Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 3.45Å
479	A	88.1	Confident	88.9	Confident	28 Å²	28	48.8 Å²	48.8	23%	0.231	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.3	171.6	0	0	0	0	0	110.7	G433 R466	G433-A479 CarbonylContact O-C 3.53Å; G433-A479 VanDerWaalsContact O-CA 3.29Å; G433-A479 WeakPolarHBondContact O-CA 3.5Å; R466-A479 WeakPolarHBondContact CG-O 3.33Å
480	A	91.3	Very high	89.2	Confident	9 Å²	9	52.9 Å²	52.9	7%	0.074	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	168.1	-178.6	0	0	0	0	0	112	G432 G433 I464 Q465 L474	G432-A480 WeakPolarHBondContact CA-O 3.49Å; G433-A480 PolarHBondContact N-O 3.49Å; G433-A480 PolarHBondContact O-N 3.03Å; I464-A480 HydrophobicContact CG2-CB 4.05Å; Q465-A480 CarbonylContact O-C 3.59Å; Q465-A480 WeakPolarHBondContact O-CA 3.07Å; Q465-A480 WeakPolarHBondContact O-CB 3.46Å; L474-A480 HydrophobicContact CD1-CB 3.62Å; L474-A480 HydrophobicContact CD2-CB 3.62Å; L474-A480 HydrophobicContact CG-CB 4.26Å
481	T	93.4	Very high	89.4	Confident	40 Å²	40	53 Å²	53	25%	0.245	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.2	165.4	49.7	0	0	0	0	110.2	Y422 V430 V431 Q465	Y422-T481 HydrophobicContact CE2-CG2 4.11Å; V430-T481 HydrophobicContact CG1-CG2 4.46Å; V431-T481 CarbonylContact O-C 3.58Å; V431-T481 VanDerWaalsContact O-CA 3.24Å; V431-T481 WeakPolarHBondContact O-CA 3.42Å; Q465-T481 PolarHBondContact N-O 3.23Å; Q465-T481 PolarHBondContact O-N 2.72Å; Q465-T481 PolarHBondContact O-OG1 3.31Å
482	L	95.3	Very high	89.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.1	178.9	-50.5	179.5	0	0	0	109.1	F416 V430 V431 V461 I464 L474 L484 M498	F416-L482 HydrophobicContact CD1-CD1 3.73Å; F416-L482 HydrophobicContact CD2-CD1 3.93Å; F416-L482 HydrophobicContact CE1-CD1 3.65Å; F416-L482 HydrophobicContact CE1-CG 4.14Å; F416-L482 HydrophobicContact CE2-CD1 3.86Å; F416-L482 HydrophobicContact CE2-CG 4.1Å; F416-L482 HydrophobicContact CG-CD1 3.86Å; F416-L482 HydrophobicContact CZ-CD1 3.7Å; F416-L482 HydrophobicContact CZ-CG 3.81Å; V430-L482 CarbonylContact C-O 3.5Å; V430-L482 WeakPolarHBondContact CA-O 3.5Å; V431-L482 HydrophobicContact CG2-CB 3.89Å; V431-L482 PolarHBondContact N-O 3.13Å; V431-L482 PolarHBondContact O-N 3.42Å; V461-L482 HydrophobicContact CG1-CB 4.45Å; V461-L482 HydrophobicContact CG1-CD2 4.24Å; I464-L482 HydrophobicContact CB-CD2 4.06Å; I464-L482 HydrophobicContact CD1-CD2 4Å; I464-L482 HydrophobicContact CG1-CD2 3.64Å; I464-L482 HydrophobicContact CG2-CD2 3.69Å; L474-L482 HydrophobicContact CD2-CD2 4.43Å; L482-L484 HydrophobicContact CB-CD2 4.44Å; L482-M498 HydrophobicContact CD1-CE 3.69Å; L482-M498 HydrophobicContact CD1-SD 4.21Å
483	A	95.3	Very high	90	Very high	6 Å²	6	45.4 Å²	45.4	5%	0.05	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.4	168.6	0	0	0	0	0	109.5	V427 V430 G462 S463	V427-A483 HydrophobicContact CG1-CB 3.58Å; V430-A483 HydrophobicContact CG2-CB 4.27Å; G462-A483 WeakPolarHBondContact CA-O 3.23Å; G462-A483 PolarHBondContact N-O 3.47Å; S463-A483 PolarHBondContact O-N 3.25Å; S463-A483 VanDerWaalsContact OG-CB 3.29Å; S463-A483 WeakPolarHBondContact OG-CB 3.49Å
484	L	93.9	Very high	90.1	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.058	26%	0.255	C	S	.	.			trans	-105.9	6.6	179.9	-52.8	-177.9	0	0	0	112.1	T429 V431 L459 L482 N486 F487 L492 M498	T429-L484 HydrophobicContact CG2-CD1 4.41Å; T429-L484 PolarHBondContact O-N 3.32Å; V431-L484 HydrophobicContact CB-CD1 4.49Å; V431-L484 HydrophobicContact CG1-CD1 3.67Å; V431-L484 HydrophobicContact CG1-CG 4.45Å; V431-L484 HydrophobicContact CG2-CD1 4Å; V431-L484 HydrophobicContact CG2-CD2 4.14Å; V431-L484 HydrophobicContact CG2-CG 4.12Å; L459-L484 HydrophobicContact CD1-CD2 4.09Å; L459-L484 HydrophobicContact CD2-CD1 4.13Å; L459-L484 HydrophobicContact CD2-CD2 4.07Å; L482-L484 HydrophobicContact CB-CD2 4.44Å; L484-N486 PolarHBondContact O-N 3.48Å; L484-F487 HydrophobicContact CB-CB 3.82Å; L484-F487 PolarHBondContact O-N 2.76Å; L484-L492 HydrophobicContact CD1-CD1 3.8Å; L484-M498 HydrophobicContact CD2-CE 3.98Å; L484-M498 HydrophobicContact CD2-SD 4.44Å
485	G	85.8	Confident	90	Very high	27 Å²	27	47.3 Å²	47.3	28%	0.278	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	-125.5	-176.1	0	0	0	0	0	112.2	T429 F487	T429-G485 PolarHBondContact N-O 2.97Å; T429-G485 VanDerWaalsContact N-O 3.12Å; G485-F487 PolarHBondContact O-N 3.49Å
486	N	83.9	Confident	90.3	Very high	170 Å²	170	43.7 Å²	43.7	91%	0.909	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	16.1	-175.5	-66	-19.1	0	0	0	114.3	L484 D488	L484-N486 PolarHBondContact O-N 3.48Å; N486-D488 PolarHBondContact O-N 3.44Å
487	F	90.3	Very high	90.6	Very high	31 Å²	31	43.7 Å²	43.7	14%	0.136	24%	0.242	C	C	.	.			trans	-61.8	133.4	176.6	-166.7	-89.6	0	0	0	110.8	T429 V448 H457 L459 L484 G485 R489 L491 L492	T429-F487 WeakPolarHBondContact CB-O 2.97Å; T429-F487 PolarHBondContact OG1-O 3.33Å; V448-F487 HydrophobicContact CG1-CE1 4.34Å; V448-F487 HydrophobicContact CG1-CE2 4.41Å; V448-F487 HydrophobicContact CG1-CZ 3.8Å; H457-F487 HydrophobicContact CB-CE2 4.42Å; H457-F487 HydrophobicContact CB-CZ 4.22Å; L459-F487 HydrophobicContact CB-CD2 3.98Å; L459-F487 HydrophobicContact CB-CE2 4.08Å; L484-F487 HydrophobicContact CB-CB 3.82Å; L484-F487 PolarHBondContact O-N 2.76Å; G485-F487 PolarHBondContact O-N 3.49Å; F487-R489 PolarHBondContact O-N 2.99Å; F487-R489 VanDerWaalsContact O-N 3.16Å; F487-L491 HydrophobicContact CE1-CB 3.99Å; F487-L491 HydrophobicContact CE1-CD1 4.45Å; F487-L491 HydrophobicContact CZ-CB 4.32Å; F487-L491 HydrophobicContact CZ-CD1 4.25Å; F487-L492 HydrophobicContact CD1-CD1 3.92Å; F487-L492 HydrophobicContact CD1-CD2 4.13Å; F487-L492 HydrophobicContact CD1-CG 3.92Å; F487-L492 HydrophobicContact CE1-CD1 4.17Å; F487-L492 HydrophobicContact CE1-CD2 3.56Å; F487-L492 HydrophobicContact CE1-CG 3.66Å; F487-L492 HydrophobicContact CZ-CD2 4.37Å
488	D	90.3	Very high	91.2	Very high	87 Å²	87	42.2 Å²	42.2	47%	0.465	23%	0.228	S	C	.	.			trans	-67.1	116.7	-179.6	-176.8	7	0	0	0	110.8	N486 S490 L491	N486-D488 PolarHBondContact O-N 3.44Å; D488-S490 PolarHBondContact O-N 3.05Å; D488-S490 WeakPolarHBondContact OD1-CB 3.4Å; D488-S490 PolarHBondContact OD1-N 2.88Å; D488-S490 PolarHBondContact OD1-OG 2.95Å; D488-S490 PolarHBondContact OD2-OG 3.12Å; D488-L491 HydrophobicContact CB-CD1 4.24Å; D488-L491 HydrophobicContact CB-CG 4.28Å; D488-L491 PolarHBondContact O-N 2.83Å
489	R	90.1	Very high	91.6	Very high	126 Å²	126	40.9 Å²	40.9	48%	0.475	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-58.5	-29.1	176.8	174.1	173.1	173.9	-179.3	0.4	112.5	I421 T423 T429 F487 L491 L492	I421-R489 HydrophobicContact CG2-CG 4.13Å; T423-R489 WeakPolarHBondContact OG1-CD 3.25Å; T423-R489 PolarHBondContact OG1-NH1 2.72Å; T429-R489 HydrophobicContact CG2-CB 4.26Å; F487-R489 PolarHBondContact O-N 2.99Å; F487-R489 VanDerWaalsContact O-N 3.16Å; R489-L491 PolarHBondContact O-N 3.06Å; R489-L492 PolarHBondContact O-N 2.9Å; R489-L492 VanDerWaalsContact O-N 3.09Å
490	S	90.3	Very high	91.9	Very high	91 Å²	91	40.3 Å²	40.3	64%	0.636	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-62.3	-27.2	-177.2	84.7	0	0	0	0	112.9	D488 L492	D488-S490 PolarHBondContact O-N 3.05Å; D488-S490 WeakPolarHBondContact OD1-CB 3.4Å; D488-S490 PolarHBondContact OD1-N 2.88Å; D488-S490 PolarHBondContact OD1-OG 2.95Å; D488-S490 PolarHBondContact OD2-OG 3.12Å; S490-L492 VanDerWaalsContact C-N 3.31Å
491	L	90.8	Very high	91.9	Very high	74 Å²	74	43.6 Å²	43.6	39%	0.387	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-80.6	-11	179.4	-58.6	178.1	0	0	0	113.1	F487 D488 R489 M496	F487-L491 HydrophobicContact CE1-CB 3.99Å; F487-L491 HydrophobicContact CE1-CD1 4.45Å; F487-L491 HydrophobicContact CZ-CB 4.32Å; F487-L491 HydrophobicContact CZ-CD1 4.25Å; D488-L491 HydrophobicContact CB-CD1 4.24Å; D488-L491 HydrophobicContact CB-CG 4.28Å; D488-L491 PolarHBondContact O-N 2.83Å; R489-L491 PolarHBondContact O-N 3.06Å; L491-M496 WeakPolarHBondContact O-CE 3.5Å
492	L	92.9	Very high	91.8	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	26%	0.261	C	S	.	.			trans	-99.5	137.4	-176.9	-61.9	176.2	0	0	0	111.7	I421 T429 V431 V448 L484 F487 R489 S490 M496	I421-L492 HydrophobicContact CD1-CB 3.66Å; I421-L492 HydrophobicContact CG1-CB 4.43Å; I421-L492 HydrophobicContact CG2-CD1 4.47Å; T429-L492 HydrophobicContact CG2-CD1 3.51Å; V431-L492 HydrophobicContact CG1-CD1 3.75Å; V448-L492 HydrophobicContact CB-CD2 4.45Å; V448-L492 HydrophobicContact CG1-CD2 3.94Å; V448-L492 HydrophobicContact CG2-CD2 3.75Å; L484-L492 HydrophobicContact CD1-CD1 3.8Å; F487-L492 HydrophobicContact CD1-CD1 3.92Å; F487-L492 HydrophobicContact CD1-CD2 4.13Å; F487-L492 HydrophobicContact CD1-CG 3.92Å; F487-L492 HydrophobicContact CE1-CD1 4.17Å; F487-L492 HydrophobicContact CE1-CD2 3.56Å; F487-L492 HydrophobicContact CE1-CG 3.66Å; F487-L492 HydrophobicContact CZ-CD2 4.37Å; R489-L492 PolarHBondContact O-N 2.9Å; R489-L492 VanDerWaalsContact O-N 3.09Å; S490-L492 VanDerWaalsContact C-N 3.31Å; L492-M496 HydrophobicContact CD2-SD 4.39Å
493	R	92.6	Very high	91.5	Very high	35 Å²	35	51.3 Å²	51.3	13%	0.132	27%	0.27	C	S	.	.			trans	-133.4	154.3	168.6	72.5	-175.6	176.3	86.1	1.7	110.8	P450 M496 H567 P568 E569	P450-R493 PolarHBondContact O-NE 2.81Å; P450-R493 PolarHBondContact O-NH2 2.91Å; R493-M496 HydrophobicContact CB-CE 4.39Å; R493-M496 HydrophobicContact CG-CE 3.6Å; R493-M496 HydrophobicContact CG-CG 3.65Å; R493-M496 HydrophobicContact CG-SD 3.87Å; R493-M496 PolarHBondContact N-SD 3.21Å; R493-M496 WeakPolarHBondContact O-CB 3.47Å; R493-M496 WeakPolarHBondContact O-CG 3.49Å; R493-M496 PolarHBondContact O-N 2.96Å; R493-H567 PolarHBondContact NH1-CD2 2.77Å; R493-H567 PolarHBondContact NH1-NE2 3.23Å; R493-P568 PolarHBondContact NH2-O 3.11Å; R493-E569 IonicContact CZ-OE1 3.8Å; R493-E569 IonicContact CZ-OE2 3.29Å; R493-E569 VanDerWaalsContact CZ-OE2 3.29Å; R493-E569 VanDerWaalsContact NH1-CD 3.32Å; R493-E569 IonicContact NH1-OE1 2.95Å; R493-E569 PolarHBondContact NH1-OE1 3.37Å; R493-E569 IonicContact NH1-OE2 2.94Å; R493-E569 PolarHBondContact NH1-OE2 2.9Å; R493-E569 IonicContact NH2-OE1 3.82Å; R493-E569 IonicContact NH2-OE2 2.72Å; R493-E569 PolarHBondContact NH2-OE2 2.76Å
494	K	90.9	Very high	91	Very high	98 Å²	98	58.2 Å²	58.2	43%	0.426	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	140.6	169.5	-61.4	-173.4	168.9	-130.8	0	109.8	D419 E420	D419-K494 VanDerWaalsContact O-CD 3.26Å; D419-K494 WeakPolarHBondContact O-CD 3.32Å; D419-K494 WeakPolarHBondContact O-CE 3.46Å; D419-K494 WeakPolarHBondContact O-CG 3.42Å; D419-K494 PolarHBondContact O-NZ 2.86Å; E420-K494 IonicContact OE1-NZ 3.8Å; E420-K494 PolarHBondContact OE1-NZ 3.28Å
495	G	89.5	Confident	90.6	Very high	2 Å²	2	58.6 Å²	58.6	2%	0.021	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-7.6	-175.8	0	0	0	0	0	114.1	V418 N536	V418-G495 PolarHBondContact O-N 3.35Å; G495-N536 WeakPolarHBondContact CA-ND2 3.47Å; G495-N536 WeakPolarHBondContact CA-O 3.27Å
496	M	94.2	Very high	90.7	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.03	31%	0.312	C	S	.	.			trans	-69.2	161.9	167.8	-74.5	176	170.3	0	0	111.3	V418 V448 G449 P450 T451 L491 L492 R493 N536	V418-M496 HydrophobicContact CB-CB 4.47Å; V418-M496 WeakPolarHBondContact CB-O 3.49Å; V418-M496 PolarHBondContact N-O 2.92Å; V448-M496 HydrophobicContact CG2-CB 4.2Å; V448-M496 HydrophobicContact CG2-SD 4.23Å; G449-M496 CarbonylContact O-C 3.59Å; G449-M496 WeakPolarHBondContact O-CA 3.01Å; G449-M496 WeakPolarHBondContact O-CB 3.4Å; P450-M496 WeakPolarHBondContact O-CE 3.36Å; T451-M496 HydrophobicContact CG2-CE 4.32Å; L491-M496 WeakPolarHBondContact O-CE 3.5Å; L492-M496 HydrophobicContact CD2-SD 4.39Å; R493-M496 HydrophobicContact CB-CE 4.39Å; R493-M496 HydrophobicContact CG-CE 3.6Å; R493-M496 HydrophobicContact CG-CG 3.65Å; R493-M496 HydrophobicContact CG-SD 3.87Å; R493-M496 PolarHBondContact N-SD 3.21Å; R493-M496 WeakPolarHBondContact O-CB 3.47Å; R493-M496 WeakPolarHBondContact O-CG 3.49Å; R493-M496 PolarHBondContact O-N 2.96Å; M496-N536 PolarHBondContact O-ND2 3.11Å
497	V	94.5	Very high	91.1	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.1	172.6	-63.2	0	0	0	0	109.8	F416 Q417 V448 G449 F456 V499 Y570	F416-V497 CarbonylContact O-C 3.56Å; F416-V497 WeakPolarHBondContact O-CA 3.4Å; Q417-V497 HydrophobicContact CG-CG1 4.27Å; V448-V497 WeakPolarHBondContact CA-O 3.37Å; G449-V497 PolarHBondContact N-O 3.46Å; G449-V497 WeakPolarHBondContact O-CG2 3.42Å; G449-V497 PolarHBondContact O-N 2.96Å; G449-V497 VanDerWaalsContact O-O 3.05Å; F456-V497 HydrophobicContact CE1-CG2 4.09Å; F456-V497 HydrophobicContact CZ-CG2 4.21Å; V497-V499 HydrophobicContact CB-CG1 4.2Å; V497-V499 HydrophobicContact CG2-CG1 3.9Å; V497-Y570 HydrophobicContact CB-CD1 4.28Å; V497-Y570 HydrophobicContact CG1-CD1 3.66Å; V497-Y570 HydrophobicContact CG1-CE1 4.22Å; V497-Y570 HydrophobicContact CG1-CG 4.49Å; V497-Y570 HydrophobicContact CG2-CD1 3.74Å; V497-Y570 HydrophobicContact CG2-CE1 4.33Å; V497-Y570 HydrophobicContact CG2-CG 3.88Å
498	M	95.3	Very high	91.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.6	170.4	-67	171.9	49.8	0	0	107.7	E415 F416 V418 V431 L446 V447 V448 L459 V461 L482 L484	E415-M498 CarbonylContact C-O 3.49Å; E415-M498 WeakPolarHBondContact CA-O 3.16Å; F416-M498 HydrophobicContact CB-CB 4.13Å; F416-M498 HydrophobicContact CD1-CB 4.35Å; F416-M498 HydrophobicContact CD1-CG 4.42Å; F416-M498 HydrophobicContact CD1-SD 3.8Å; F416-M498 HydrophobicContact CE1-SD 4.25Å; F416-M498 PolarHBondContact N-O 3.07Å; F416-M498 PolarHBondContact O-N 3.3Å; V418-M498 HydrophobicContact CG2-CG 3.89Å; V418-M498 HydrophobicContact CG2-SD 3.99Å; V431-M498 HydrophobicContact CG2-SD 3.71Å; L446-M498 HydrophobicContact CD1-CB 4.34Å; L446-M498 HydrophobicContact CD1-CE 3.88Å; V447-M498 CarbonylContact O-C 3.57Å; V447-M498 VanDerWaalsContact O-CA 3.25Å; V447-M498 WeakPolarHBondContact O-CA 3.26Å; V448-M498 HydrophobicContact CB-CG 3.95Å; V448-M498 HydrophobicContact CG2-CG 3.76Å; L459-M498 HydrophobicContact CD1-CE 3.74Å; L459-M498 HydrophobicContact CD2-CE 3.83Å; L459-M498 HydrophobicContact CD2-CG 4.17Å; L459-M498 HydrophobicContact CD2-SD 4.16Å; L459-M498 HydrophobicContact CG-CE 4.41Å; V461-M498 HydrophobicContact CG2-CE 4.19Å; L482-M498 HydrophobicContact CD1-CE 3.69Å; L482-M498 HydrophobicContact CD1-SD 4.21Å; L484-M498 HydrophobicContact CD2-CE 3.98Å; L484-M498 HydrophobicContact CD2-SD 4.44Å
499	V	95.4	Very high	91.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	159	-173	-61.4	0	0	0	0	111.8	T414 E415 V447 F456 V497 M503 P505	T414-V499 CarbonylContact O-C 3.56Å; T414-V499 VanDerWaalsContact O-CA 3.25Å; T414-V499 WeakPolarHBondContact O-CA 3.32Å; E415-V499 HydrophobicContact CB-CG1 4.34Å; E415-V499 HydrophobicContact CG-CG1 4.12Å; V447-V499 HydrophobicContact CG2-CG2 3.57Å; V447-V499 WeakPolarHBondContact CG2-O 3.36Å; V447-V499 PolarHBondContact N-O 3.18Å; V447-V499 PolarHBondContact O-N 3.42Å; F456-V499 HydrophobicContact CD1-CG2 4.29Å; F456-V499 HydrophobicContact CE1-CG2 3.93Å; V497-V499 HydrophobicContact CB-CG1 4.2Å; V497-V499 HydrophobicContact CG2-CG1 3.9Å; V499-M503 HydrophobicContact CB-CB 4.21Å; V499-M503 HydrophobicContact CB-CE 4.42Å; V499-M503 HydrophobicContact CB-CG 4.47Å; V499-M503 HydrophobicContact CB-SD 3.68Å; V499-M503 HydrophobicContact CG1-CE 4.46Å; V499-M503 HydrophobicContact CG1-SD 3.56Å; V499-M503 VanDerWaalsContact CG1-SD 3.56Å; V499-M503 HydrophobicContact CG2-CB 4.33Å; V499-M503 HydrophobicContact CG2-SD 4.39Å; V499-P505 HydrophobicContact CG2-CG 4.46Å
500	S	94.8	Very high	91.6	Very high	17 Å²	17	47.8 Å²	47.8	12%	0.119	25%	0.25	C	S	.	.			trans	-57	139.6	168.9	179.5	0	0	0	0	110.2	T414 E502 M503	T414-S500 PolarHBondContact O-N 3.34Å; S500-E502 PolarHBondContact O-N 3.05Å; S500-E502 VanDerWaalsContact O-N 3.1Å; S500-E502 PolarHBondContact OG-N 3.04Å; S500-M503 VanDerWaalsContact O-CB 3.23Å; S500-M503 WeakPolarHBondContact O-CB 3.45Å; S500-M503 PolarHBondContact O-N 3.11Å
501	P	91.6	Very high	91.9	Very high	78 Å²	78	43.5 Å²	43.5	51%	0.506	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21	176.3	-22.7	32.9	0	0	0	114.4	H445 V447 M503	H445-P501 WeakPolarHBondContact O-CD 3.34Å; V447-P501 HydrophobicContact CG1-CB 4.38Å; V447-P501 HydrophobicContact CG1-CG 4.3Å; P501-M503 VanDerWaalsContact C-N 3.31Å
502	E	90.4	Very high	92.1	Very high	165 Å²	165	41.8 Å²	41.8	77%	0.771	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.3	177	-60.8	177.5	177	0	0	112.8	L413 S500	L413-E502 HydrophobicContact CD1-CB 4.3Å; L413-E502 HydrophobicContact CD2-CB 4.41Å; S500-E502 PolarHBondContact O-N 3.05Å; S500-E502 VanDerWaalsContact O-N 3.1Å; S500-E502 PolarHBondContact OG-N 3.04Å
503	M	88.4	Confident	92.2	Very high	36 Å²	36	41 Å²	41	18%	0.177	21%	0.206	C	C	.	.			trans	-76.2	139.1	177.7	-170.5	176.6	-70.7	0	0	109.9	L413 E415 V499 S500 P501 P505	L413-M503 HydrophobicContact CB-CE 3.53Å; L413-M503 HydrophobicContact CD1-CB 3.96Å; E415-M503 HydrophobicContact CB-CE 4.19Å; V499-M503 HydrophobicContact CB-CB 4.21Å; V499-M503 HydrophobicContact CB-CE 4.42Å; V499-M503 HydrophobicContact CB-CG 4.47Å; V499-M503 HydrophobicContact CB-SD 3.68Å; V499-M503 HydrophobicContact CG1-CE 4.46Å; V499-M503 HydrophobicContact CG1-SD 3.56Å; V499-M503 VanDerWaalsContact CG1-SD 3.56Å; V499-M503 HydrophobicContact CG2-CB 4.33Å; V499-M503 HydrophobicContact CG2-SD 4.39Å; S500-M503 VanDerWaalsContact O-CB 3.23Å; S500-M503 WeakPolarHBondContact O-CB 3.45Å; S500-M503 PolarHBondContact O-N 3.11Å; P501-M503 VanDerWaalsContact C-N 3.31Å; M503-P505 VanDerWaalsContact C-CD 3.49Å; M503-P505 WeakPolarHBondContact O-CD 3.33Å
504	D	84.4	Confident	92.3	Very high	151 Å²	151	42.7 Å²	42.7	81%	0.807	22%	0.215	S	C	*	.			trans	-102.1	88.1	169.7	-172.6	22.6	0	0	0	109.8	T506	D504-T506 PolarHBondContact O-N 3.01Å
505	P	85.8	Confident	92.3	Very high	20 Å²	20	38 Å²	38	13%	0.13	20%	0.195	C	C	.	.			trans	-72.8	124.8	-176	28	-34.5	0	0	0	111.4	F456 V499 M503 I507 Y570	F456-P505 HydrophobicContact CD2-CG 4.07Å; F456-P505 HydrophobicContact CE1-CG 4.16Å; F456-P505 HydrophobicContact CE2-CB 4.08Å; F456-P505 HydrophobicContact CE2-CG 3.36Å; F456-P505 HydrophobicContact CZ-CB 3.81Å; F456-P505 HydrophobicContact CZ-CG 3.43Å; F456-P505 VanDerWaalsContact CZ-CG 3.43Å; V499-P505 HydrophobicContact CG2-CG 4.46Å; M503-P505 VanDerWaalsContact C-CD 3.49Å; M503-P505 WeakPolarHBondContact O-CD 3.33Å; P505-I507 WeakPolarHBondContact O-CG1 3.34Å; P505-I507 PolarHBondContact O-N 3.16Å; P505-I507 VanDerWaalsContact O-N 3.16Å; P505-Y570 HydrophobicContact CB-CD2 3.51Å; P505-Y570 HydrophobicContact CB-CE2 3.49Å; P505-Y570 VanDerWaalsContact CB-CE2 3.49Å
506	T	87.7	Confident	92.3	Very high	54 Å²	54	38.1 Å²	38.1	33%	0.331	20%	0.195	S	C	.	.			trans	-72.4	109.5	173.4	-50	0	0	0	0	111.2	D504 Y570 L571 L593 P595	D504-T506 PolarHBondContact O-N 3.01Å; T506-Y570 WeakPolarHBondContact O-CD2 3.36Å; T506-L571 PolarHBondContact O-N 2.86Å; T506-L593 HydrophobicContact CG2-CB 4.01Å; T506-L593 HydrophobicContact CG2-CD1 3.79Å; T506-P595 HydrophobicContact CG2-CB 4.32Å; T506-P595 HydrophobicContact CG2-CG 4.14Å
507	I	92.5	Very high	91.9	Very high	12 Å²	12	37.8 Å²	37.8	6%	0.062	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.1	177.2	-47.7	171.5	0	0	0	108.6	P450 G454 F456 P505 P568 P595 I596 Y598	P450-I507 HydrophobicContact CB-CD1 4.2Å; P450-I507 HydrophobicContact CB-CG1 4.45Å; P450-I507 HydrophobicContact CB-CG2 3.96Å; P450-I507 HydrophobicContact CG-CG2 4.27Å; G454-I507 WeakPolarHBondContact O-CD1 3.49Å; F456-I507 HydrophobicContact CD2-CD1 4.06Å; F456-I507 HydrophobicContact CE2-CD1 3.5Å; F456-I507 HydrophobicContact CE2-CG1 4.01Å; P505-I507 WeakPolarHBondContact O-CG1 3.34Å; P505-I507 PolarHBondContact O-N 3.16Å; P505-I507 VanDerWaalsContact O-N 3.16Å; I507-P568 HydrophobicContact CG2-CB 3.76Å; I507-P568 HydrophobicContact CG2-CG 4.17Å; I507-P595 WeakPolarHBondContact O-CA 3.44Å; I507-I596 HydrophobicContact CB-CD1 4.43Å; I507-I596 HydrophobicContact CG2-CD1 3.78Å; I507-I596 PolarHBondContact O-N 3.32Å; I507-Y598 HydrophobicContact CD1-CE2 4.1Å
508	C	92.6	Very high	91.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.8	-178.3	65.9	0	0	0	0	112.9	M510 E569 Q594	C508-M510 WeakPolarHBondContact CB-O 3.41Å; C508-E569 PolarHBondContact N-O 3.26Å; C508-E569 PolarHBondContact O-N 3.33Å; C508-E569 VanDerWaalsContact O-N 3.09Å; C508-Q594 WeakPolarHBondContact CB-O 3.18Å
509	W	94.2	Very high	89.8	Confident	85 Å²	85	42 Å²	42	32%	0.322	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-32.5	161.2	-77.5	100.9	0	0	0	111.6	K563 F564 P568 I596	W509-K563 CarbonylContact O-C 3.49Å; W509-K563 VanDerWaalsContact O-CA 3.3Å; W509-K563 WeakPolarHBondContact O-CA 3.23Å; W509-F564 HydrophobicContact CE3-CB 4.07Å; W509-F564 VanDerWaalsContact CE3-O 3.27Å; W509-F564 PolarHBondContact O-N 2.86Å; W509-P568 HydrophobicContact CD2-CB 4.04Å; W509-P568 HydrophobicContact CG-CB 4.17Å; W509-P568 HydrophobicContact CZ2-CB 4.37Å; W509-P568 VanDerWaalsContact CZ2-CD 3.46Å; W509-P568 HydrophobicContact CZ2-CG 4.23Å; W509-I596 HydrophobicContact CG-CD1 4.37Å
510	M	94.9	Very high	88.3	Confident	63 Å²	63	42.6 Å²	42.6	31%	0.31	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.1	-173	-66.5	-179.4	-66.2	0	0	110.4	C508 L561 F562 K563 Q594	C508-M510 WeakPolarHBondContact CB-O 3.41Å; M510-L561 HydrophobicContact CB-CD1 4.28Å; M510-F562 VanDerWaalsContact CA-O 3.23Å; M510-F562 WeakPolarHBondContact CA-O 3.32Å; M510-K563 HydrophobicContact CG-CB 3.89Å; M510-K563 HydrophobicContact CG-CD 4.2Å; M510-K563 HydrophobicContact CG-CG 3.77Å; M510-K563 HydrophobicContact SD-CD 4.27Å; M510-K563 HydrophobicContact SD-CG 4.49Å; M510-Q594 HydrophobicContact CB-CB 4.14Å; M510-Q594 HydrophobicContact CB-CG 4.45Å; M510-Q594 VanDerWaalsContact CB-OE1 3.27Å; M510-Q594 VanDerWaalsContact CE-OE1 3.24Å; M510-Q594 WeakPolarHBondContact O-CB 3.34Å; M510-Q594 PolarHBondContact O-N 3.13Å
511	F	95.9	Very high	86.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	148.6	178.4	66.8	-86.1	0	0	0	110.6	A513 V532 I534 F562 F564 L571 L577 V590 N592 L593	F511-A513 HydrophobicContact CD2-CB 4.34Å; F511-A513 HydrophobicContact CE2-CB 4.21Å; F511-V532 HydrophobicContact CZ-CG1 4.19Å; F511-I534 HydrophobicContact CE1-CD1 4.35Å; F511-I534 HydrophobicContact CE2-CD1 3.93Å; F511-I534 HydrophobicContact CZ-CD1 3.77Å; F511-F562 HydrophobicContact CD1-CB 4.09Å; F511-F562 HydrophobicContact CD2-CB 4.33Å; F511-F562 HydrophobicContact CD2-CD2 4.4Å; F511-F562 HydrophobicContact CE1-CB 3.52Å; F511-F562 HydrophobicContact CE1-CG 4.43Å; F511-F562 HydrophobicContact CE2-CB 3.79Å; F511-F562 AromaticContact CE2-CD2 3.69Å; F511-F562 HydrophobicContact CE2-CD2 3.69Å; F511-F562 AromaticContact CE2-CG 4Å; F511-F562 HydrophobicContact CE2-CG 4Å; F511-F562 HydrophobicContact CG-CB 4.46Å; F511-F562 HydrophobicContact CZ-CB 3.35Å; F511-F562 AromaticContact CZ-CD2 3.98Å; F511-F562 HydrophobicContact CZ-CD2 3.98Å; F511-F562 AromaticContact CZ-CG 3.79Å; F511-F562 HydrophobicContact CZ-CG 3.79Å; F511-F562 PolarHBondContact N-O 2.92Å; F511-F562 PolarHBondContact O-N 3.5Å; F511-F564 HydrophobicContact CD1-CD2 4.39Å; F511-F564 AromaticContact CD1-CE2 3.78Å; F511-F564 HydrophobicContact CD1-CE2 3.78Å; F511-F564 HydrophobicContact CD1-CZ 4.01Å; F511-F564 HydrophobicContact CE1-CD1 4.49Å; F511-F564 HydrophobicContact CE1-CD2 4.3Å; F511-F564 AromaticContact CE1-CE1 3.89Å; F511-F564 HydrophobicContact CE1-CE1 3.89Å; F511-F564 AromaticContact CE1-CE2 3.66Å; F511-F564 HydrophobicContact CE1-CE2 3.66Å; F511-F564 AromaticContact CE1-CZ 3.43Å; F511-F564 HydrophobicContact CE1-CZ 3.43Å; F511-F564 VanDerWaalsContact CE1-CZ 3.43Å; F511-F564 HydrophobicContact CZ-CZ 4.26Å; F511-L571 HydrophobicContact CB-CD1 4.11Å; F511-L571 HydrophobicContact CD1-CD1 3.69Å; F511-L571 HydrophobicContact CD2-CD1 4.31Å; F511-L571 HydrophobicContact CE1-CD1 4.17Å; F511-L571 HydrophobicContact CG-CD1 3.77Å; F511-L577 HydrophobicContact CE2-CD2 4.23Å; F511-V590 HydrophobicContact CB-CG1 4.47Å; F511-V590 HydrophobicContact CD2-CG1 4.36Å; F511-V590 HydrophobicContact CD2-CG2 4.07Å; F511-V590 HydrophobicContact CE2-CG2 4.34Å; F511-N592 WeakPolarHBondContact CA-O 3.11Å; F511-L593 HydrophobicContact CB-CD2 3.85Å
512	E	96	Very high	85.2	Confident	38 Å²	38	50.4 Å²	50.4	18%	0.178	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.2	173.4	-60.7	173.3	-175.6	0	0	109.2	Y547 V559 V560 L561 T591 N592	E512-Y547 HydrophobicContact CG-CE2 4.22Å; E512-V559 HydrophobicContact CB-CG1 4.15Å; E512-V560 WeakPolarHBondContact CA-O 3.43Å; E512-L561 HydrophobicContact CG-CD1 3.82Å; E512-T591 PolarHBondContact O-N 3.45Å; E512-T591 PolarHBondContact O-OG1 3.25Å; E512-N592 HydrophobicContact CB-CB 3.99Å; E512-N592 HydrophobicContact CG-CB 4.3Å; E512-N592 PolarHBondContact N-O 3.26Å; E512-N592 PolarHBondContact O-N 3.47Å; E512-N592 WeakPolarHBondContact OE2-CB 3.38Å
513	A	95.4	Very high	84.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.2	174.1	0	0	0	0	0	111.1	F511 I515 V559 V560 F562 L577 H589	F511-A513 HydrophobicContact CD2-CB 4.34Å; F511-A513 HydrophobicContact CE2-CB 4.21Å; A513-I515 HydrophobicContact CB-CG2 4.12Å; A513-I515 PolarHBondContact O-N 3.16Å; A513-V559 WeakPolarHBondContact O-CA 3.46Å; A513-V560 PolarHBondContact N-O 3.1Å; A513-V560 PolarHBondContact O-N 3.33Å; A513-F562 HydrophobicContact CB-CD2 4.27Å; A513-F562 HydrophobicContact CB-CE2 4.14Å; A513-L577 HydrophobicContact CB-CD2 3.43Å; A513-L577 VanDerWaalsContact CB-CD2 3.43Å; A513-H589 CarbonylContact C-O 3.38Å; A513-H589 VanDerWaalsContact CA-O 3.23Å; A513-H589 WeakPolarHBondContact CA-O 3.29Å; A513-H589 WeakPolarHBondContact CB-O 3.48Å
514	E	94.1	Very high	84	Confident	70 Å²	70	43.2 Å²	43.2	33%	0.327	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.1	165.8	-171.1	-166.6	159.6	0	0	108	V559 G588 H589 T591	E514-V559 HydrophobicContact CB-CG2 4.44Å; E514-G588 CarbonylContact O-C 3.59Å; E514-G588 WeakPolarHBondContact O-CA 3.42Å; E514-H589 PolarHBondContact N-O 2.95Å; E514-H589 PolarHBondContact O-N 3.42Å; E514-H589 IonicContact OE2-CE1 3.81Å; E514-H589 PolarHBondContact OE2-CE1 2.81Å; E514-H589 VanDerWaalsContact OE2-CE1 3.24Å; E514-H589 IonicContact OE2-NE2 3.34Å; E514-T591 HydrophobicContact CB-CG2 3.85Å
515	I	91.8	Very high	84	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	156.4	-177.2	66.2	161.5	0	0	0	112.2	A513 F524 L552 K557 A558 V560 F562 L577 F579 I587	A513-I515 HydrophobicContact CB-CG2 4.12Å; A513-I515 PolarHBondContact O-N 3.16Å; I515-F524 HydrophobicContact CD1-CE1 3.98Å; I515-F524 HydrophobicContact CD1-CZ 4.21Å; I515-L552 HydrophobicContact CD1-CD2 3.88Å; I515-L552 HydrophobicContact CG1-CD2 4.23Å; I515-K557 VanDerWaalsContact O-CA 3.23Å; I515-K557 WeakPolarHBondContact O-CA 3.05Å; I515-A558 WeakPolarHBondContact CG1-O 3.49Å; I515-A558 PolarHBondContact N-O 2.88Å; I515-A558 PolarHBondContact O-N 2.67Å; I515-A558 VanDerWaalsContact O-N 3.12Å; I515-V560 HydrophobicContact CD1-CB 4.16Å; I515-V560 HydrophobicContact CD1-CG2 3.51Å; I515-V560 HydrophobicContact CG1-CB 4.31Å; I515-V560 HydrophobicContact CG1-CG2 3.69Å; I515-F562 HydrophobicContact CD1-CZ 4.47Å; I515-F562 HydrophobicContact CG2-CE2 4Å; I515-F562 HydrophobicContact CG2-CZ 4.28Å; I515-L577 HydrophobicContact CG2-CD2 3.82Å; I515-F579 HydrophobicContact CB-CE1 3.96Å; I515-F579 HydrophobicContact CD1-CE1 3.84Å; I515-F579 HydrophobicContact CD1-CZ 3.7Å; I515-F579 HydrophobicContact CG2-CD1 4.48Å; I515-F579 HydrophobicContact CG2-CE1 3.91Å; I515-I587 CarbonylContact C-O 3.57Å; I515-I587 WeakPolarHBondContact CA-O 3.3Å
516	V	88.4	Confident	84.2	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.024	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.1	166.8	-171	0	0	0	0	107.6	M1 A3 L518 E556 K557 G586 I587	M1-V516 HydrophobicContact CB-CG2 4.45Å; A3-V516 HydrophobicContact CB-CG1 4.28Å; V516-L518 PolarHBondContact O-N 3.08Å; V516-E556 WeakPolarHBondContact CA-O 3.44Å; V516-K557 HydrophobicContact CG1-CG 4.42Å; V516-K557 HydrophobicContact CG2-CD 4.13Å; V516-K557 HydrophobicContact CG2-CG 3.93Å; V516-G586 WeakPolarHBondContact O-CA 3.4Å; V516-I587 HydrophobicContact CB-CG1 4.4Å; V516-I587 PolarHBondContact N-O 3.04Å; V516-I587 PolarHBondContact O-N 2.77Å; V516-I587 VanDerWaalsContact O-N 3.08Å
517	L	85.4	Confident	84.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116	175.7	-162.2	66.2	0	0	0	109	H520 F524 L552 G555 E556 F579 K585	L517-H520 HydrophobicContact CD1-CB 4.21Å; L517-H520 HydrophobicContact CD2-CB 3.84Å; L517-H520 HydrophobicContact CG-CB 4.12Å; L517-F524 HydrophobicContact CD1-CB 4.37Å; L517-F524 HydrophobicContact CD1-CD2 4.22Å; L517-F524 HydrophobicContact CD1-CG 4.33Å; L517-F524 HydrophobicContact CD2-CB 3.84Å; L517-L552 HydrophobicContact CB-CD2 3.84Å; L517-L552 HydrophobicContact CB-CG 4.27Å; L517-L552 HydrophobicContact CD2-CB 4.46Å; L517-L552 HydrophobicContact CD2-CD2 4.43Å; L517-L552 HydrophobicContact CD2-CG 4.34Å; L517-G555 WeakPolarHBondContact O-CA 3.42Å; L517-G555 PolarHBondContact O-N 3.17Å; L517-E556 PolarHBondContact N-O 3.18Å; L517-F579 HydrophobicContact CD1-CE2 3.95Å; L517-F579 HydrophobicContact CD1-CZ 3.88Å; L517-K585 HydrophobicContact CD1-CB 4.45Å
518	L	77.8	Confident	84.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.235	C	C	.	.			trans	-87.4	-46	-174.9	-65.6	173.1	0	0	0	112.3	V5 S6 F9 V516 T554 T584 K585 I587	V5-L518 HydrophobicContact CB-CD2 4.06Å; V5-L518 HydrophobicContact CG1-CD2 4.08Å; S6-L518 WeakPolarHBondContact CB-O 3.24Å; F9-L518 HydrophobicContact CD2-CB 4.4Å; F9-L518 HydrophobicContact CD2-CD1 4.02Å; F9-L518 HydrophobicContact CE2-CD1 3.63Å; F9-L518 HydrophobicContact CZ-CD1 4.15Å; V516-L518 PolarHBondContact O-N 3.08Å; L518-T554 WeakPolarHBondContact O-CG2 3.38Å; L518-T584 HydrophobicContact CD1-CG2 4.42Å; L518-K585 PolarHBondContact N-O 2.94Å; L518-I587 HydrophobicContact CD1-CB 4.33Å; L518-I587 HydrophobicContact CD1-CD1 4.22Å; L518-I587 HydrophobicContact CD1-CG1 3.96Å; L518-I587 HydrophobicContact CD1-CG2 3.61Å; L518-I587 HydrophobicContact CD2-CD1 4.23Å; L518-I587 HydrophobicContact CD2-CG1 4.23Å; L518-I587 HydrophobicContact CG-CG1 4.15Å
519	F	68.1	Low	84.1	Confident	86 Å²	86	51.1 Å²	51.1	38%	0.377	26%	0.261	S	S	.	.			trans	-156	112.5	179.8	-177.7	-100.9	0	0	0	110.4	K585	F519-K585 PolarHBondContact N-O 3.17Å; F519-K585 VanDerWaalsContact N-O 3.13Å; F519-K585 WeakPolarHBondContact O-CD 3.38Å
520	H	64.1	Low	84	Confident	13 Å²	13	47.1 Å²	47.1	6%	0.06	25%	0.247	C	C	.	.			trans	-144.1	127.4	170.1	-164.6	55.2	0	0	0	109.9	L517 K522 F528 T554 E581 K585	L517-H520 HydrophobicContact CD1-CB 4.21Å; L517-H520 HydrophobicContact CD2-CB 3.84Å; L517-H520 HydrophobicContact CG-CB 4.12Å; H520-K522 VanDerWaalsContact C-N 3.32Å; H520-K522 PolarHBondContact CD2-O 3.37Å; H520-F528 AromaticContact CE1-CE1 3.97Å; H520-F528 AromaticContact CE1-CZ 3.57Å; H520-F528 AromaticContact NE2-CZ 3.85Å; H520-T554 PolarHBondContact N-OG1 3.34Å; H520-T554 VanDerWaalsContact N-OG1 3.1Å; H520-T554 PolarHBondContact O-OG1 2.87Å; H520-T554 VanDerWaalsContact O-OG1 3.14Å; H520-E581 IonicContact CE1-OE2 3.04Å; H520-K585 HydrophobicContact CB-CD 4.41Å; H520-K585 WeakPolarHBondContact ND1-CD 3.22Å; H520-K585 WeakPolarHBondContact ND1-CE 3.26Å; H520-K585 PolarHBondContact ND1-NZ 3.01Å
521	A	54.8	Low	83.9	Confident	93 Å²	93	46.6 Å²	46.6	77%	0.769	25%	0.247	S	C	*	.	S	Bend	trans	-75.7	-21.4	-178.7	0	0	0	0	0	112.9
522	K	67.6	Low	83.8	Confident	166 Å²	166	46.6 Å²	46.6	72%	0.722	25%	0.247	S	C	*	.	S	Bend	trans	-109.6	-178.5	177.3	-65.3	-175.3	178.7	-179.2	0	110.3	H520	H520-K522 VanDerWaalsContact C-N 3.32Å; H520-K522 PolarHBondContact CD2-O 3.37Å
523	T	70.7	Confident	83.6	Confident	50 Å²	50	45 Å²	45	31%	0.307	24%	0.24	S	C	.	.			trans	-82.8	127.3	172.8	46	0	0	0	0	110.2	H525 E551	T523-H525 PolarHBondContact O-ND1 2.99Å; T523-E551 VanDerWaalsContact CB-OE1 3.26Å; T523-E551 WeakPolarHBondContact CB-OE1 3.26Å; T523-E551 WeakPolarHBondContact CB-OE2 3.46Å; T523-E551 HydrophobicContact CG2-CB 4.33Å; T523-E551 WeakPolarHBondContact CG2-OE2 3.38Å; T523-E551 PolarHBondContact OG1-OE1 2.95Å
524	F	81.1	Confident	83.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	116.7	175.5	-178.3	-88.5	0	0	0	108.3	I515 L517 F528 V530 V543 V546 E551 L552 V560 F562 F579	I515-F524 HydrophobicContact CD1-CE1 3.98Å; I515-F524 HydrophobicContact CD1-CZ 4.21Å; L517-F524 HydrophobicContact CD1-CB 4.37Å; L517-F524 HydrophobicContact CD1-CD2 4.22Å; L517-F524 HydrophobicContact CD1-CG 4.33Å; L517-F524 HydrophobicContact CD2-CB 3.84Å; F524-F528 AromaticContact CD2-CD1 3.84Å; F524-F528 HydrophobicContact CD2-CD1 3.84Å; F524-F528 HydrophobicContact CD2-CE1 4.37Å; F524-F528 AromaticContact CE2-CD1 3.89Å; F524-F528 HydrophobicContact CE2-CD1 3.89Å; F524-V530 HydrophobicContact CE2-CG1 4.22Å; F524-V543 HydrophobicContact CE1-CG1 3.99Å; F524-V543 HydrophobicContact CE1-CG2 3.8Å; F524-V543 HydrophobicContact CE2-CG2 3.9Å; F524-V543 HydrophobicContact CZ-CB 4.42Å; F524-V543 HydrophobicContact CZ-CG1 4.33Å; F524-V543 HydrophobicContact CZ-CG2 3.27Å; F524-V546 HydrophobicContact CD1-CG2 4.34Å; F524-V546 HydrophobicContact CE1-CG2 4.34Å; F524-E551 WeakPolarHBondContact O-CA 3.4Å; F524-L552 HydrophobicContact CB-CB 4.17Å; F524-L552 HydrophobicContact CD1-CB 4.19Å; F524-L552 HydrophobicContact CD1-CD2 4.45Å; F524-L552 PolarHBondContact N-O 3.3Å; F524-L552 PolarHBondContact O-N 3.04Å; F524-V560 HydrophobicContact CE1-CG1 4.14Å; F524-V560 HydrophobicContact CE1-CG2 4.19Å; F524-F562 HydrophobicContact CZ-CE1 4.32Å; F524-F562 HydrophobicContact CZ-CZ 4.34Å; F524-F579 HydrophobicContact CD2-CE2 4.38Å; F524-F579 HydrophobicContact CE2-CD2 4.3Å; F524-F579 AromaticContact CE2-CE2 3.72Å; F524-F579 HydrophobicContact CE2-CE2 3.72Å; F524-F579 HydrophobicContact CE2-CZ 4.39Å; F524-F579 HydrophobicContact CZ-CE2 4.18Å; F524-F579 HydrophobicContact CZ-CZ 4.49Å
525	H	84.9	Confident	83.1	Confident	77 Å²	77	43.1 Å²	43.1	36%	0.356	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	171.8	-167.4	61.2	-77.2	0	0	0	111.3	T523 F528 E551	T523-H525 PolarHBondContact O-ND1 2.99Å; H525-F528 VanDerWaalsContact O-CB 3.27Å; H525-F528 WeakPolarHBondContact O-CB 3.38Å; H525-F528 PolarHBondContact O-N 3.21Å; H525-E551 HydrophobicContact CB-CG 4.31Å
526	K	90	Very high	82.9	Confident	136 Å²	136	43.5 Å²	43.5	59%	0.591	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	138.2	173.4	175.4	173.4	-179.1	168	0	111.6	F528 V543 E544	K526-F528 VanDerWaalsContact C-N 3.35Å; K526-V543 CarbonylContact C-O 3.54Å; K526-E544 WeakPolarHBondContact CD-O 3.25Å; K526-E544 WeakPolarHBondContact CE-O 3.44Å; K526-E544 VanDerWaalsContact CG-O 3.26Å; K526-E544 WeakPolarHBondContact CG-O 3.35Å
527	G	88.8	Confident	83.1	Confident	45 Å²	45	43.4 Å²	43.4	46%	0.464	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	-8.6	-178.5	0	0	0	0	0	114	V543	G527-V543 PolarHBondContact N-O 2.9Å
528	F	89	Confident	83.4	Confident	29 Å²	29	49.4 Å²	49.4	13%	0.127	26%	0.261	C	S	.	.			trans	-67.4	137.5	179.6	-158.2	-111.3	0	0	0	111.4	H520 F524 H525 K526 V530 T542 V543 E581	H520-F528 AromaticContact CE1-CE1 3.97Å; H520-F528 AromaticContact CE1-CZ 3.57Å; H520-F528 AromaticContact NE2-CZ 3.85Å; F524-F528 AromaticContact CD2-CD1 3.84Å; F524-F528 HydrophobicContact CD2-CD1 3.84Å; F524-F528 HydrophobicContact CD2-CE1 4.37Å; F524-F528 AromaticContact CE2-CD1 3.89Å; F524-F528 HydrophobicContact CE2-CD1 3.89Å; H525-F528 VanDerWaalsContact O-CB 3.27Å; H525-F528 WeakPolarHBondContact O-CB 3.38Å; H525-F528 PolarHBondContact O-N 3.21Å; K526-F528 VanDerWaalsContact C-N 3.35Å; F528-V530 HydrophobicContact CD1-CG1 3.57Å; F528-V530 HydrophobicContact CE1-CG1 3.65Å; F528-T542 CarbonylContact O-C 3.16Å; F528-T542 WeakPolarHBondContact O-CA 3.48Å; F528-V543 HydrophobicContact CB-CB 4.39Å; F528-V543 HydrophobicContact CB-CG2 4.2Å; F528-V543 WeakPolarHBondContact O-CG2 3.47Å; F528-V543 PolarHBondContact O-N 3.43Å; F528-E581 HydrophobicContact CZ-CG 4.47Å; F528-E581 WeakPolarHBondContact CZ-OE2 3.49Å
529	Q	92.6	Very high	84.1	Confident	116 Å²	116	50 Å²	50	54%	0.542	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.9	-179.7	-67.7	-175.8	-1	0	0	110.7	T540 A541 T542 I565	Q529-T540 HydrophobicContact CB-CG2 4.26Å; Q529-A541 WeakPolarHBondContact CA-O 2.94Å; Q529-T542 HydrophobicContact CG-CG2 4.47Å; Q529-I565 HydrophobicContact CG-CD1 4.22Å
530	V	92.1	Very high	85.4	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.8	-179	-67.4	0	0	0	0	110.9	F524 F528 V532 T540 A541 F562 F579 R580	F524-V530 HydrophobicContact CE2-CG1 4.22Å; F528-V530 HydrophobicContact CD1-CG1 3.57Å; F528-V530 HydrophobicContact CE1-CG1 3.65Å; V530-V532 HydrophobicContact CG2-CG2 4.14Å; V530-V532 PolarHBondContact O-N 3.42Å; V530-T540 CarbonylContact O-C 3.49Å; V530-T540 WeakPolarHBondContact O-CA 3.31Å; V530-A541 PolarHBondContact N-O 3.47Å; V530-A541 PolarHBondContact O-N 2.88Å; V530-F562 HydrophobicContact CG2-CD1 4.33Å; V530-F562 HydrophobicContact CG2-CE1 3.83Å; V530-F579 HydrophobicContact CB-CB 4.23Å; V530-F579 HydrophobicContact CB-CD2 4.24Å; V530-F579 HydrophobicContact CG1-CD2 4.09Å; V530-F579 HydrophobicContact CG2-CB 3.96Å; V530-F579 HydrophobicContact CG2-CD2 4.19Å; V530-F579 HydrophobicContact CG2-CG 4.36Å; V530-R580 WeakPolarHBondContact CA-O 3.45Å
531	T	93.1	Very high	86.8	Confident	51 Å²	51	47.9 Å²	47.9	31%	0.313	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.1	167.4	-55.3	0	0	0	0	108.8	R538 F579 R580	T531-R538 HydrophobicContact CG2-CG 4.09Å; T531-F579 CarbonylContact O-C 3.58Å; T531-F579 VanDerWaalsContact O-CA 3.24Å; T531-F579 WeakPolarHBondContact O-CA 3.3Å; T531-R580 PolarHBondContact N-O 3.06Å; T531-R580 PolarHBondContact O-N 3.31Å
532	V	93.2	Very high	88.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.9	178.4	165.1	0	0	0	0	109.8	F511 V530 I534 R538 Q539 A541 F562 F564 L577 F579	F511-V532 HydrophobicContact CZ-CG1 4.19Å; V530-V532 HydrophobicContact CG2-CG2 4.14Å; V530-V532 PolarHBondContact O-N 3.42Å; V532-I534 HydrophobicContact CG1-CD1 3.55Å; V532-I534 HydrophobicContact CG1-CG1 3.57Å; V532-R538 WeakPolarHBondContact O-CA 3.25Å; V532-Q539 PolarHBondContact N-O 2.85Å; V532-Q539 PolarHBondContact O-N 2.73Å; V532-Q539 VanDerWaalsContact O-N 3.13Å; V532-A541 HydrophobicContact CB-CB 4.44Å; V532-A541 HydrophobicContact CG2-CB 3.74Å; V532-F562 HydrophobicContact CG2-CD1 4.36Å; V532-F564 HydrophobicContact CG1-CE1 4.36Å; V532-L577 HydrophobicContact CB-CD1 4.2Å; V532-L577 HydrophobicContact CG1-CD1 3.27Å; V532-L577 HydrophobicContact CG2-CD1 4.15Å; V532-F579 HydrophobicContact CG2-CB 4.15Å
533	H	92.1	Very high	90.1	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.028	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.8	172.1	-62.3	-97.9	0	0	0	108.6	I277 T281 V537 L578	I277-H533 HydrophobicContact CG2-CB 4.14Å; T281-H533 HydrophobicContact CG2-CB 4.5Å; H533-V537 WeakPolarHBondContact CA-O 3.39Å; H533-L578 HydrophobicContact CB-CB 4.36Å; H533-L578 HydrophobicContact CB-CD2 4.49Å; H533-L578 PolarHBondContact N-O 3.38Å; H533-L578 PolarHBondContact O-N 2.96Å
534	I	91.4	Very high	91.2	Very high	6 Å²	6	37 Å²	37	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	108.6	176.1	-55.6	164.2	0	0	0	107.7	F511 V532 N536 V537 F564 L571 A575 L577 V590	F511-I534 HydrophobicContact CE1-CD1 4.35Å; F511-I534 HydrophobicContact CE2-CD1 3.93Å; F511-I534 HydrophobicContact CZ-CD1 3.77Å; V532-I534 HydrophobicContact CG1-CD1 3.55Å; V532-I534 HydrophobicContact CG1-CG1 3.57Å; I534-N536 PolarHBondContact O-N 2.88Å; I534-V537 PolarHBondContact N-O 3.37Å; I534-V537 WeakPolarHBondContact O-CA 3.45Å; I534-V537 VanDerWaalsContact O-CB 3.29Å; I534-V537 WeakPolarHBondContact O-CB 3.36Å; I534-V537 PolarHBondContact O-N 2.99Å; I534-F564 HydrophobicContact CD1-CZ 4.42Å; I534-L571 HydrophobicContact CB-CD2 3.98Å; I534-L571 HydrophobicContact CD1-CD1 3.88Å; I534-L571 HydrophobicContact CD1-CD2 3.72Å; I534-L571 HydrophobicContact CG1-CD2 4.48Å; I534-L571 HydrophobicContact CG2-CD2 3.78Å; I534-A575 HydrophobicContact CG2-CB 3.56Å; I534-L577 HydrophobicContact CD1-CD1 3.89Å; I534-L577 HydrophobicContact CG1-CB 4.31Å; I534-L577 HydrophobicContact CG1-CD1 3.56Å; I534-V590 HydrophobicContact CD1-CG2 4.13Å
535	G	87.8	Confident	91.7	Very high	23 Å²	23	38.2 Å²	38.2	24%	0.237	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-122.1	-173	0	0	0	0	0	111.9	T281 S282	T281-G535 CarbonylContact C-O 3.6Å; T281-G535 WeakPolarHBondContact CB-O 3.38Å; T281-G535 WeakPolarHBondContact O-CA 3.48Å; T281-G535 PolarHBondContact OG1-O 3.02Å; S282-G535 PolarHBondContact N-O 3.18Å
536	N	88.3	Confident	92	Very high	8 Å²	8	35.4 Å²	35.4	4%	0.043	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.5	174.2	70.9	-26.3	0	0	0	114.7	Q417 V418 D419 G495 M496 I534	Q417-N536 HydrophobicContact CB-CB 4.41Å; V418-N536 PolarHBondContact N-ND2 3.43Å; V418-N536 PolarHBondContact O-ND2 2.9Å; D419-N536 WeakPolarHBondContact OD1-CB 3.48Å; G495-N536 WeakPolarHBondContact CA-ND2 3.47Å; G495-N536 WeakPolarHBondContact CA-O 3.27Å; M496-N536 PolarHBondContact O-ND2 3.11Å; I534-N536 PolarHBondContact O-N 2.88Å
537	V	91.7	Very high	92	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	130.1	176.6	176.1	0	0	0	0	110.5	H533 I534 F564 E569 L571	H533-V537 WeakPolarHBondContact CA-O 3.39Å; I534-V537 PolarHBondContact N-O 3.37Å; I534-V537 WeakPolarHBondContact O-CA 3.45Å; I534-V537 VanDerWaalsContact O-CB 3.29Å; I534-V537 WeakPolarHBondContact O-CB 3.36Å; I534-V537 PolarHBondContact O-N 2.99Å; V537-F564 HydrophobicContact CG1-CE1 4.35Å; V537-F564 HydrophobicContact CG1-CZ 4.27Å; V537-E569 HydrophobicContact CG1-CB 4.1Å; V537-E569 HydrophobicContact CG1-CG 3.62Å; V537-E569 HydrophobicContact CG2-CB 4.19Å; V537-E569 HydrophobicContact CG2-CG 4.41Å; V537-L571 HydrophobicContact CG2-CD2 4.4Å
538	R	91.9	Very high	91.7	Very high	127 Å²	127	35.9 Å²	35.9	48%	0.479	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	103.9	171.9	-176.5	-172.8	70.2	-163.8	-1.5	110.7	T531 V532	T531-R538 HydrophobicContact CG2-CG 4.09Å; V532-R538 WeakPolarHBondContact O-CA 3.25Å
539	Q	92.7	Very high	91.4	Very high	13 Å²	13	38.6 Å²	38.6	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	155.2	-176.5	-145.5	-166.1	129.1	0	0	111.9	V532 F564 K566 H567 E569	V532-Q539 PolarHBondContact N-O 2.85Å; V532-Q539 PolarHBondContact O-N 2.73Å; V532-Q539 VanDerWaalsContact O-N 3.13Å; Q539-F564 HydrophobicContact CB-CD1 3.92Å; Q539-F564 HydrophobicContact CB-CE1 4.17Å; Q539-F564 HydrophobicContact CG-CD1 4.48Å; Q539-K566 HydrophobicContact CG-CB 4.34Å; Q539-K566 VanDerWaalsContact OE1-CB 3.29Å; Q539-H567 PolarHBondContact NE2-CD2 3.07Å; Q539-H567 PolarHBondContact NE2-NE2 3.4Å; Q539-H567 PolarHBondContact NE2-O 3.01Å; Q539-H567 VanDerWaalsContact OE1-N 3.12Å; Q539-H567 PolarHBondContact OE1-O 2.78Å; Q539-E569 VanDerWaalsContact NE2-CG 3.29Å; Q539-E569 PolarHBondContact NE2-OE1 2.93Å
540	T	94.8	Very high	90.7	Very high	56 Å²	56	41.7 Å²	41.7	34%	0.344	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133	169.7	-45	0	0	0	0	109.4	Q529 V530 I565	Q529-T540 HydrophobicContact CB-CG2 4.26Å; V530-T540 CarbonylContact O-C 3.49Å; V530-T540 WeakPolarHBondContact O-CA 3.31Å; T540-I565 HydrophobicContact CG2-CD1 3.55Å; T540-I565 PolarHBondContact O-N 3.05Å; T540-I565 VanDerWaalsContact O-N 3.13Å
541	A	95.2	Very high	90.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.3	173.2	0	0	0	0	0	110.7	Q529 V530 V532 F562 K563 F564	Q529-A541 WeakPolarHBondContact CA-O 2.94Å; V530-A541 PolarHBondContact N-O 3.47Å; V530-A541 PolarHBondContact O-N 2.88Å; V532-A541 HydrophobicContact CB-CB 4.44Å; V532-A541 HydrophobicContact CG2-CB 3.74Å; A541-F562 HydrophobicContact CB-CB 4.28Å; A541-F562 HydrophobicContact CB-CD1 4.26Å; A541-K563 CarbonylContact C-O 3.59Å; A541-K563 WeakPolarHBondContact CA-O 3.48Å; A541-K563 WeakPolarHBondContact CB-O 3.34Å; A541-F564 HydrophobicContact CB-CD1 4.2Å
542	T	95.6	Very high	89.8	Confident	22 Å²	22	43.4 Å²	43.4	14%	0.135	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140.1	172.2	-53.3	0	0	0	0	109.6	F528 Q529 E544 F562 K563 I565	F528-T542 CarbonylContact O-C 3.16Å; F528-T542 WeakPolarHBondContact O-CA 3.48Å; Q529-T542 HydrophobicContact CG-CG2 4.47Å; T542-E544 PolarHBondContact O-N 2.59Å; T542-F562 CarbonylContact O-C 3.55Å; T542-F562 WeakPolarHBondContact O-CA 3.37Å; T542-K563 PolarHBondContact N-O 2.84Å; T542-K563 PolarHBondContact O-N 2.8Å; T542-I565 WeakPolarHBondContact OG1-CD1 3.13Å
543	V	94.4	Very high	89.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	106.1	171.3	177.7	0	0	0	0	108.6	F524 K526 G527 F528 V546 V560 F562	F524-V543 HydrophobicContact CE1-CG1 3.99Å; F524-V543 HydrophobicContact CE1-CG2 3.8Å; F524-V543 HydrophobicContact CE2-CG2 3.9Å; F524-V543 HydrophobicContact CZ-CB 4.42Å; F524-V543 HydrophobicContact CZ-CG1 4.33Å; F524-V543 HydrophobicContact CZ-CG2 3.27Å; K526-V543 CarbonylContact C-O 3.54Å; G527-V543 PolarHBondContact N-O 2.9Å; F528-V543 HydrophobicContact CB-CB 4.39Å; F528-V543 HydrophobicContact CB-CG2 4.2Å; F528-V543 WeakPolarHBondContact O-CG2 3.47Å; F528-V543 PolarHBondContact O-N 3.43Å; V543-V546 HydrophobicContact CG1-CG2 3.94Å; V543-V560 HydrophobicContact CG1-CG1 3.69Å; V543-V560 HydrophobicContact CG2-CG1 4.4Å; V543-F562 HydrophobicContact CG2-CD1 4.25Å; V543-F562 HydrophobicContact CG2-CE1 3.88Å
544	E	93.9	Very high	89	Confident	58 Å²	58	54.3 Å²	54.3	27%	0.271	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-33.4	-178.2	-71.9	-64.7	165.6	0	0	112.5	K526 T542 L561 K563	K526-E544 WeakPolarHBondContact CD-O 3.25Å; K526-E544 WeakPolarHBondContact CE-O 3.44Å; K526-E544 VanDerWaalsContact CG-O 3.26Å; K526-E544 WeakPolarHBondContact CG-O 3.35Å; T542-E544 PolarHBondContact O-N 2.59Å; E544-L561 HydrophobicContact CB-CB 4.46Å; E544-L561 HydrophobicContact CB-CD2 3.97Å; E544-L561 HydrophobicContact CB-CG 4.13Å; E544-L561 PolarHBondContact N-O 3.25Å; E544-K563 HydrophobicContact CG-CB 3.59Å; E544-K563 HydrophobicContact CG-CD 4.2Å; E544-K563 WeakPolarHBondContact OE1-CD 3.41Å
545	A	91.8	Very high	88.5	Confident	25 Å²	25	55.1 Å²	55.1	21%	0.207	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	145.9	177.1	0	0	0	0	0	111.4	V560 L561	A545-V560 WeakPolarHBondContact O-CA 3.47Å; A545-V560 WeakPolarHBondContact O-CG1 3.27Å; A545-L561 HydrophobicContact CB-CB 4.11Å; A545-L561 PolarHBondContact O-N 3.09Å
546	V	91.4	Very high	88.3	Confident	18 Å²	18	57 Å²	57	11%	0.109	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	115.9	165.6	-178.8	0	0	0	0	106.1	F524 V543 K549 A558 V560	F524-V546 HydrophobicContact CD1-CG2 4.34Å; F524-V546 HydrophobicContact CE1-CG2 4.34Å; V543-V546 HydrophobicContact CG1-CG2 3.94Å; V546-K549 WeakPolarHBondContact CB-O 3.4Å; V546-K549 HydrophobicContact CG1-CB 4.31Å; V546-A558 HydrophobicContact CG1-CB 3.92Å; V546-V560 HydrophobicContact CB-CG2 4.47Å; V546-V560 HydrophobicContact CG1-CG2 4.2Å; V546-V560 HydrophobicContact CG2-CG2 4.12Å
547	Y	90.2	Very high	88.4	Confident	105 Å²	105	60.7 Å²	60.7	41%	0.412	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	134.4	-176.5	-69.2	-71	0	0	0	111	E512 K549 V559 L561	E512-Y547 HydrophobicContact CG-CE2 4.22Å; Y547-K549 PolarHBondContact O-N 3.24Å; Y547-V559 HydrophobicContact CD2-CB 4.18Å; Y547-V559 HydrophobicContact CD2-CG1 3.93Å; Y547-V559 PolarHBondContact N-O 3.3Å; Y547-L561 HydrophobicContact CE2-CB 4.13Å
548	G	83.6	Confident	88.4	Confident	87 Å²	87	61.2 Å²	61.2	90%	0.897	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-3.6	176	0	0	0	0	0	115.7
549	K	81.6	Confident	88.5	Confident	85 Å²	85	57.4 Å²	57.4	37%	0.37	31%	0.305	S	S	.	.			trans	-150.2	145.6	178.7	-63.7	-178	176.4	178.8	0	110.6	V546 Y547 L552 E556	V546-K549 WeakPolarHBondContact CB-O 3.4Å; V546-K549 HydrophobicContact CG1-CB 4.31Å; Y547-K549 PolarHBondContact O-N 3.24Å; K549-L552 HydrophobicContact CD-CD1 4.16Å; K549-E556 VanDerWaalsContact NZ-CD 3.3Å; K549-E556 IonicContact NZ-OE1 3.16Å; K549-E556 IonicContact NZ-OE2 3.96Å; K549-E556 PolarHBondContact NZ-OE2 2.94Å
550	E	77.9	Confident	88.6	Confident	181 Å²	181	56.8 Å²	56.8	85%	0.846	30%	0.302	S	S	*	.	S	Bend	trans	-76.5	-33.5	171.9	-64.5	-165.5	158	0	0	112.3
551	E	83.1	Confident	88.7	Confident	90 Å²	90	55 Å²	55	42%	0.421	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.3	-178.9	-61.1	-171.8	136	0	0	111	T523 F524 H525	T523-E551 VanDerWaalsContact CB-OE1 3.26Å; T523-E551 WeakPolarHBondContact CB-OE1 3.26Å; T523-E551 WeakPolarHBondContact CB-OE2 3.46Å; T523-E551 HydrophobicContact CG2-CB 4.33Å; T523-E551 WeakPolarHBondContact CG2-OE2 3.38Å; T523-E551 PolarHBondContact OG1-OE1 2.95Å; F524-E551 WeakPolarHBondContact O-CA 3.4Å; H525-E551 HydrophobicContact CB-CG 4.31Å
552	L	84	Confident	88.7	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.7	176.6	-164.8	70.9	0	0	0	110.7	I515 L517 F524 K549 E556 A558	I515-L552 HydrophobicContact CD1-CD2 3.88Å; I515-L552 HydrophobicContact CG1-CD2 4.23Å; L517-L552 HydrophobicContact CB-CD2 3.84Å; L517-L552 HydrophobicContact CB-CG 4.27Å; L517-L552 HydrophobicContact CD2-CB 4.46Å; L517-L552 HydrophobicContact CD2-CD2 4.43Å; L517-L552 HydrophobicContact CD2-CG 4.34Å; F524-L552 HydrophobicContact CB-CB 4.17Å; F524-L552 HydrophobicContact CD1-CB 4.19Å; F524-L552 HydrophobicContact CD1-CD2 4.45Å; F524-L552 PolarHBondContact N-O 3.3Å; F524-L552 PolarHBondContact O-N 3.04Å; K549-L552 HydrophobicContact CD-CD1 4.16Å; L552-E556 HydrophobicContact CD1-CB 3.5Å; L552-E556 VanDerWaalsContact CD1-CB 3.5Å; L552-E556 HydrophobicContact CG-CB 4.1Å; L552-A558 HydrophobicContact CD1-CB 3.62Å; L552-A558 HydrophobicContact CD2-CB 4.23Å
553	R	84.3	Confident	88.7	Confident	168 Å²	168	58 Å²	58	63%	0.634	30%	0.301	S	S	*	.			trans	-101.7	162.5	176.1	-63.2	-178.5	179.4	-171.9	0.8	111.8	G555 E556	R553-G555 PolarHBondContact O-N 2.81Å; R553-E556 HydrophobicContact CB-CG 4.22Å; R553-E556 PolarHBondContact N-OE2 3.06Å; R553-E556 VanDerWaalsContact O-CB 3.31Å; R553-E556 WeakPolarHBondContact O-CB 3.46Å; R553-E556 PolarHBondContact O-N 2.86Å; R553-E556 VanDerWaalsContact O-N 3.1Å
554	T	83.8	Confident	88.8	Confident	66 Å²	66	58 Å²	58	41%	0.405	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	134.3	177.9	-66.9	0	0	0	0	111.1	L518 H520 E556	L518-T554 WeakPolarHBondContact O-CG2 3.38Å; H520-T554 PolarHBondContact N-OG1 3.34Å; H520-T554 VanDerWaalsContact N-OG1 3.1Å; H520-T554 PolarHBondContact O-OG1 2.87Å; H520-T554 VanDerWaalsContact O-OG1 3.14Å; T554-E556 VanDerWaalsContact C-N 3.29Å
555	G	80.1	Confident	88.8	Confident	24 Å²	24	59.2 Å²	59.2	25%	0.247	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	87	-12.5	-176.5	0	0	0	0	0	114.3	A3 L517 R553	A3-G555 VanDerWaalsContact CB-O 3.25Å; A3-G555 WeakPolarHBondContact CB-O 3.18Å; L517-G555 WeakPolarHBondContact O-CA 3.42Å; L517-G555 PolarHBondContact O-N 3.17Å; R553-G555 PolarHBondContact O-N 2.81Å
556	E	85.3	Confident	88.7	Confident	61 Å²	61	64.8 Å²	64.8	29%	0.285	33%	0.329	S	S	.	.			trans	-83.9	153.5	-176.9	-61.2	-171	168.7	0	0	112.8	V516 L517 K549 L552 R553 T554	V516-E556 WeakPolarHBondContact CA-O 3.44Å; L517-E556 PolarHBondContact N-O 3.18Å; K549-E556 VanDerWaalsContact NZ-CD 3.3Å; K549-E556 IonicContact NZ-OE1 3.16Å; K549-E556 IonicContact NZ-OE2 3.96Å; K549-E556 PolarHBondContact NZ-OE2 2.94Å; L552-E556 HydrophobicContact CD1-CB 3.5Å; L552-E556 VanDerWaalsContact CD1-CB 3.5Å; L552-E556 HydrophobicContact CG-CB 4.1Å; R553-E556 HydrophobicContact CB-CG 4.22Å; R553-E556 PolarHBondContact N-OE2 3.06Å; R553-E556 VanDerWaalsContact O-CB 3.31Å; R553-E556 WeakPolarHBondContact O-CB 3.46Å; R553-E556 PolarHBondContact O-N 2.86Å; R553-E556 VanDerWaalsContact O-N 3.1Å; T554-E556 VanDerWaalsContact C-N 3.29Å
557	K	89.3	Confident	88.8	Confident	87 Å²	87	64.6 Å²	64.6	38%	0.378	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.4	172.3	-52.7	-167.4	177.3	171.7	0	110.9	M1 I515 V516	M1-K557 VanDerWaalsContact O-CE 3.26Å; M1-K557 WeakPolarHBondContact O-CE 3.25Å; M1-K557 PolarHBondContact O-NZ 2.87Å; I515-K557 VanDerWaalsContact O-CA 3.23Å; I515-K557 WeakPolarHBondContact O-CA 3.05Å; V516-K557 HydrophobicContact CG1-CG 4.42Å; V516-K557 HydrophobicContact CG2-CD 4.13Å; V516-K557 HydrophobicContact CG2-CG 3.93Å
558	A	92.1	Very high	88.9	Confident	12 Å²	12	59.6 Å²	59.6	10%	0.099	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	159	170.3	0	0	0	0	0	110.6	I515 V546 L552 V560	I515-A558 WeakPolarHBondContact CG1-O 3.49Å; I515-A558 PolarHBondContact N-O 2.88Å; I515-A558 PolarHBondContact O-N 2.67Å; I515-A558 VanDerWaalsContact O-N 3.12Å; V546-A558 HydrophobicContact CG1-CB 3.92Å; L552-A558 HydrophobicContact CD1-CB 3.62Å; L552-A558 HydrophobicContact CD2-CB 4.23Å; A558-V560 HydrophobicContact CB-CG2 4.39Å
559	V	94.4	Very high	89.4	Confident	48 Å²	48	55.6 Å²	55.6	29%	0.291	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.8	165.8	-176.2	0	0	0	0	107.6	E512 A513 E514 Y547	E512-V559 HydrophobicContact CB-CG1 4.15Å; A513-V559 WeakPolarHBondContact O-CA 3.46Å; E514-V559 HydrophobicContact CB-CG2 4.44Å; Y547-V559 HydrophobicContact CD2-CB 4.18Å; Y547-V559 HydrophobicContact CD2-CG1 3.93Å; Y547-V559 PolarHBondContact N-O 3.3Å
560	V	94.6	Very high	90	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.9	-175.1	177.5	0	0	0	0	109.8	E512 A513 I515 F524 V543 A545 V546 A558 F562	E512-V560 WeakPolarHBondContact CA-O 3.43Å; A513-V560 PolarHBondContact N-O 3.1Å; A513-V560 PolarHBondContact O-N 3.33Å; I515-V560 HydrophobicContact CD1-CB 4.16Å; I515-V560 HydrophobicContact CD1-CG2 3.51Å; I515-V560 HydrophobicContact CG1-CB 4.31Å; I515-V560 HydrophobicContact CG1-CG2 3.69Å; F524-V560 HydrophobicContact CE1-CG1 4.14Å; F524-V560 HydrophobicContact CE1-CG2 4.19Å; V543-V560 HydrophobicContact CG1-CG1 3.69Å; V543-V560 HydrophobicContact CG2-CG1 4.4Å; A545-V560 WeakPolarHBondContact O-CA 3.47Å; A545-V560 WeakPolarHBondContact O-CG1 3.27Å; V546-V560 HydrophobicContact CB-CG2 4.47Å; V546-V560 HydrophobicContact CG1-CG2 4.2Å; V546-V560 HydrophobicContact CG2-CG2 4.12Å; A558-V560 HydrophobicContact CB-CG2 4.39Å; V560-F562 HydrophobicContact CB-CD2 4.34Å; V560-F562 HydrophobicContact CB-CE2 3.71Å; V560-F562 HydrophobicContact CB-CZ 4.1Å; V560-F562 HydrophobicContact CG1-CD2 4.03Å; V560-F562 HydrophobicContact CG1-CE1 4.14Å; V560-F562 HydrophobicContact CG1-CE2 3.59Å; V560-F562 HydrophobicContact CG1-CG 4.49Å; V560-F562 HydrophobicContact CG1-CZ 3.66Å
561	L	95.5	Very high	90.7	Very high	17 Å²	17	44.2 Å²	44.2	9%	0.089	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117	172.3	-177.1	66.7	0	0	0	109.1	M510 E512 E544 A545 Y547	M510-L561 HydrophobicContact CB-CD1 4.28Å; E512-L561 HydrophobicContact CG-CD1 3.82Å; E544-L561 HydrophobicContact CB-CB 4.46Å; E544-L561 HydrophobicContact CB-CD2 3.97Å; E544-L561 HydrophobicContact CB-CG 4.13Å; E544-L561 PolarHBondContact N-O 3.25Å; A545-L561 HydrophobicContact CB-CB 4.11Å; A545-L561 PolarHBondContact O-N 3.09Å; Y547-L561 HydrophobicContact CE2-CB 4.13Å
562	F	96	Very high	91	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	146.7	175.4	-68.9	-84.7	0	0	0	110.4	M510 F511 A513 I515 F524 V530 V532 A541 T542 V543 V560 L577 F579	M510-F562 VanDerWaalsContact CA-O 3.23Å; M510-F562 WeakPolarHBondContact CA-O 3.32Å; F511-F562 HydrophobicContact CD1-CB 4.09Å; F511-F562 HydrophobicContact CD2-CB 4.33Å; F511-F562 HydrophobicContact CD2-CD2 4.4Å; F511-F562 HydrophobicContact CE1-CB 3.52Å; F511-F562 HydrophobicContact CE1-CG 4.43Å; F511-F562 HydrophobicContact CE2-CB 3.79Å; F511-F562 AromaticContact CE2-CD2 3.69Å; F511-F562 HydrophobicContact CE2-CD2 3.69Å; F511-F562 AromaticContact CE2-CG 4Å; F511-F562 HydrophobicContact CE2-CG 4Å; F511-F562 HydrophobicContact CG-CB 4.46Å; F511-F562 HydrophobicContact CZ-CB 3.35Å; F511-F562 AromaticContact CZ-CD2 3.98Å; F511-F562 HydrophobicContact CZ-CD2 3.98Å; F511-F562 AromaticContact CZ-CG 3.79Å; F511-F562 HydrophobicContact CZ-CG 3.79Å; F511-F562 PolarHBondContact N-O 2.92Å; F511-F562 PolarHBondContact O-N 3.5Å; A513-F562 HydrophobicContact CB-CD2 4.27Å; A513-F562 HydrophobicContact CB-CE2 4.14Å; I515-F562 HydrophobicContact CD1-CZ 4.47Å; I515-F562 HydrophobicContact CG2-CE2 4Å; I515-F562 HydrophobicContact CG2-CZ 4.28Å; F524-F562 HydrophobicContact CZ-CE1 4.32Å; F524-F562 HydrophobicContact CZ-CZ 4.34Å; V530-F562 HydrophobicContact CG2-CD1 4.33Å; V530-F562 HydrophobicContact CG2-CE1 3.83Å; V532-F562 HydrophobicContact CG2-CD1 4.36Å; A541-F562 HydrophobicContact CB-CB 4.28Å; A541-F562 HydrophobicContact CB-CD1 4.26Å; T542-F562 CarbonylContact O-C 3.55Å; T542-F562 WeakPolarHBondContact O-CA 3.37Å; V543-F562 HydrophobicContact CG2-CD1 4.25Å; V543-F562 HydrophobicContact CG2-CE1 3.88Å; V560-F562 HydrophobicContact CB-CD2 4.34Å; V560-F562 HydrophobicContact CB-CE2 3.71Å; V560-F562 HydrophobicContact CB-CZ 4.1Å; V560-F562 HydrophobicContact CG1-CD2 4.03Å; V560-F562 HydrophobicContact CG1-CE1 4.14Å; V560-F562 HydrophobicContact CG1-CE2 3.59Å; V560-F562 HydrophobicContact CG1-CG 4.49Å; V560-F562 HydrophobicContact CG1-CZ 3.66Å; F562-L577 HydrophobicContact CD2-CD2 4.35Å; F562-L577 HydrophobicContact CE2-CD2 3.85Å; F562-L577 HydrophobicContact CZ-CD2 4.34Å; F562-F579 HydrophobicContact CZ-CD1 4.47Å
563	K	96.1	Very high	91.4	Very high	85 Å²	85	47.3 Å²	47.3	37%	0.37	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123	172.3	-178	178.9	177.6	-178.3	0	111	W509 M510 A541 T542 E544	W509-K563 CarbonylContact O-C 3.49Å; W509-K563 VanDerWaalsContact O-CA 3.3Å; W509-K563 WeakPolarHBondContact O-CA 3.23Å; M510-K563 HydrophobicContact CG-CB 3.89Å; M510-K563 HydrophobicContact CG-CD 4.2Å; M510-K563 HydrophobicContact CG-CG 3.77Å; M510-K563 HydrophobicContact SD-CD 4.27Å; M510-K563 HydrophobicContact SD-CG 4.49Å; A541-K563 CarbonylContact C-O 3.59Å; A541-K563 WeakPolarHBondContact CA-O 3.48Å; A541-K563 WeakPolarHBondContact CB-O 3.34Å; T542-K563 PolarHBondContact N-O 2.84Å; T542-K563 PolarHBondContact O-N 2.8Å; E544-K563 HydrophobicContact CG-CB 3.59Å; E544-K563 HydrophobicContact CG-CD 4.2Å; E544-K563 WeakPolarHBondContact OE1-CD 3.41Å
564	F	95.5	Very high	91.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	143.1	172.7	-69	-57.4	0	0	0	111.5	W509 F511 V532 I534 V537 Q539 A541 E569 L571	W509-F564 HydrophobicContact CE3-CB 4.07Å; W509-F564 VanDerWaalsContact CE3-O 3.27Å; W509-F564 PolarHBondContact O-N 2.86Å; F511-F564 HydrophobicContact CD1-CD2 4.39Å; F511-F564 AromaticContact CD1-CE2 3.78Å; F511-F564 HydrophobicContact CD1-CE2 3.78Å; F511-F564 HydrophobicContact CD1-CZ 4.01Å; F511-F564 HydrophobicContact CE1-CD1 4.49Å; F511-F564 HydrophobicContact CE1-CD2 4.3Å; F511-F564 AromaticContact CE1-CE1 3.89Å; F511-F564 HydrophobicContact CE1-CE1 3.89Å; F511-F564 AromaticContact CE1-CE2 3.66Å; F511-F564 HydrophobicContact CE1-CE2 3.66Å; F511-F564 AromaticContact CE1-CZ 3.43Å; F511-F564 HydrophobicContact CE1-CZ 3.43Å; F511-F564 VanDerWaalsContact CE1-CZ 3.43Å; F511-F564 HydrophobicContact CZ-CZ 4.26Å; V532-F564 HydrophobicContact CG1-CE1 4.36Å; I534-F564 HydrophobicContact CD1-CZ 4.42Å; V537-F564 HydrophobicContact CG1-CE1 4.35Å; V537-F564 HydrophobicContact CG1-CZ 4.27Å; Q539-F564 HydrophobicContact CB-CD1 3.92Å; Q539-F564 HydrophobicContact CB-CE1 4.17Å; Q539-F564 HydrophobicContact CG-CD1 4.48Å; A541-F564 HydrophobicContact CB-CD1 4.2Å; F564-E569 HydrophobicContact CD1-CG 4.41Å; F564-E569 HydrophobicContact CD2-CB 4.07Å; F564-E569 HydrophobicContact CD2-CG 3.92Å; F564-E569 HydrophobicContact CE1-CG 4.26Å; F564-E569 HydrophobicContact CE2-CB 3.61Å; F564-E569 HydrophobicContact CE2-CG 3.76Å; F564-E569 HydrophobicContact CG-CG 4.24Å; F564-E569 HydrophobicContact CZ-CB 4.03Å; F564-E569 HydrophobicContact CZ-CG 3.93Å; F564-L571 HydrophobicContact CE2-CD1 3.83Å; F564-L571 HydrophobicContact CE2-CG 4.39Å; F564-L571 HydrophobicContact CZ-CD1 3.99Å; F564-L571 HydrophobicContact CZ-CD2 4.5Å
565	I	93.8	Very high	92	Very high	82 Å²	82	39.6 Å²	39.6	42%	0.421	22%	0.215	S	C	.	.	S	Bend	trans	-92.7	-37.4	-175.4	-71.2	160.4	0	0	0	112.5	Q529 T540 T542	Q529-I565 HydrophobicContact CG-CD1 4.22Å; T540-I565 HydrophobicContact CG2-CD1 3.55Å; T540-I565 PolarHBondContact O-N 3.05Å; T540-I565 VanDerWaalsContact O-N 3.13Å; T542-I565 WeakPolarHBondContact OG1-CD1 3.13Å
566	K	91.4	Very high	92.5	Very high	142 Å²	142	43 Å²	43	62%	0.617	22%	0.223	S	C	*	.	S	Bend	trans	-99.3	-51.3	-165.7	-169.6	-179.2	173.8	-175.5	0	113.3	Q539	Q539-K566 HydrophobicContact CG-CB 4.34Å; Q539-K566 VanDerWaalsContact OE1-CB 3.29Å
567	H	91.9	Very high	92.8	Very high	14 Å²	14	40.2 Å²	40.2	7%	0.065	21%	0.21	C	C	.	.	S	Bend	trans	-152	158.5	-177.9	40.4	-109.7	0	0	0	110.3	R493 Q539 E569	R493-H567 PolarHBondContact NH1-CD2 2.77Å; R493-H567 PolarHBondContact NH1-NE2 3.23Å; Q539-H567 PolarHBondContact NE2-CD2 3.07Å; Q539-H567 PolarHBondContact NE2-NE2 3.4Å; Q539-H567 PolarHBondContact NE2-O 3.01Å; Q539-H567 VanDerWaalsContact OE1-N 3.12Å; Q539-H567 PolarHBondContact OE1-O 2.78Å; H567-E569 IonicContact CD2-OE1 3.09Å; H567-E569 PolarHBondContact CD2-OE1 3.2Å; H567-E569 IonicContact NE2-OE1 3.09Å; H567-E569 PolarHBondContact NE2-OE1 3.01Å; H567-E569 VanDerWaalsContact NE2-OE1 3.09Å
568	P	93.6	Very high	92.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	19%	0.192	C	C	.	.			trans	-75.4	153	176.8	34.7	-35.1	0	0	0	111.1	P450 E452 R493 I507 W509 I596	P450-P568 WeakPolarHBondContact CG-O 3.43Å; E452-P568 WeakPolarHBondContact O-CD 3.46Å; R493-P568 PolarHBondContact NH2-O 3.11Å; I507-P568 HydrophobicContact CG2-CB 3.76Å; I507-P568 HydrophobicContact CG2-CG 4.17Å; W509-P568 HydrophobicContact CD2-CB 4.04Å; W509-P568 HydrophobicContact CG-CB 4.17Å; W509-P568 HydrophobicContact CZ2-CB 4.37Å; W509-P568 VanDerWaalsContact CZ2-CD 3.46Å; W509-P568 HydrophobicContact CZ2-CG 4.23Å; P568-I596 HydrophobicContact CB-CD1 3.34Å; P568-I596 HydrophobicContact CG-CD1 3.82Å
569	E	94.4	Very high	92.8	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.009	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151.6	-174.8	-59.6	-73.6	-165.3	0	0	111	R493 C508 V537 Q539 F564 H567	R493-E569 IonicContact CZ-OE1 3.8Å; R493-E569 IonicContact CZ-OE2 3.29Å; R493-E569 VanDerWaalsContact CZ-OE2 3.29Å; R493-E569 VanDerWaalsContact NH1-CD 3.32Å; R493-E569 IonicContact NH1-OE1 2.95Å; R493-E569 PolarHBondContact NH1-OE1 3.37Å; R493-E569 IonicContact NH1-OE2 2.94Å; R493-E569 PolarHBondContact NH1-OE2 2.9Å; R493-E569 IonicContact NH2-OE1 3.82Å; R493-E569 IonicContact NH2-OE2 2.72Å; R493-E569 PolarHBondContact NH2-OE2 2.76Å; C508-E569 PolarHBondContact N-O 3.26Å; C508-E569 PolarHBondContact O-N 3.33Å; C508-E569 VanDerWaalsContact O-N 3.09Å; V537-E569 HydrophobicContact CG1-CB 4.1Å; V537-E569 HydrophobicContact CG1-CG 3.62Å; V537-E569 HydrophobicContact CG2-CB 4.19Å; V537-E569 HydrophobicContact CG2-CG 4.41Å; Q539-E569 VanDerWaalsContact NE2-CG 3.29Å; Q539-E569 PolarHBondContact NE2-OE1 2.93Å; F564-E569 HydrophobicContact CD1-CG 4.41Å; F564-E569 HydrophobicContact CD2-CB 4.07Å; F564-E569 HydrophobicContact CD2-CG 3.92Å; F564-E569 HydrophobicContact CE1-CG 4.26Å; F564-E569 HydrophobicContact CE2-CB 3.61Å; F564-E569 HydrophobicContact CE2-CG 3.76Å; F564-E569 HydrophobicContact CG-CG 4.24Å; F564-E569 HydrophobicContact CZ-CB 4.03Å; F564-E569 HydrophobicContact CZ-CG 3.93Å; H567-E569 IonicContact CD2-OE1 3.09Å; H567-E569 PolarHBondContact CD2-OE1 3.2Å; H567-E569 IonicContact NE2-OE1 3.09Å; H567-E569 PolarHBondContact NE2-OE1 3.01Å; H567-E569 VanDerWaalsContact NE2-OE1 3.09Å
570	Y	92.9	Very high	92.5	Very high	22 Å²	22	34.1 Å²	34.1	9%	0.086	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.5	169.3	171.9	-105.1	0	0	0	108.8	E415 V497 P505 T506 K572	E415-Y570 PolarHBondContact OE2-OH 3.35Å; V497-Y570 HydrophobicContact CB-CD1 4.28Å; V497-Y570 HydrophobicContact CG1-CD1 3.66Å; V497-Y570 HydrophobicContact CG1-CE1 4.22Å; V497-Y570 HydrophobicContact CG1-CG 4.49Å; V497-Y570 HydrophobicContact CG2-CD1 3.74Å; V497-Y570 HydrophobicContact CG2-CE1 4.33Å; V497-Y570 HydrophobicContact CG2-CG 3.88Å; P505-Y570 HydrophobicContact CB-CD2 3.51Å; P505-Y570 HydrophobicContact CB-CE2 3.49Å; P505-Y570 VanDerWaalsContact CB-CE2 3.49Å; T506-Y570 WeakPolarHBondContact O-CD2 3.36Å; Y570-K572 HydrophobicContact CE1-CG 4.33Å; Y570-K572 WeakPolarHBondContact OH-CE 3.39Å
571	L	92.4	Very high	92	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.031	20%	0.196	C	C	.	.			trans	-134.7	156.2	179.2	-63.8	-176	0	0	0	110.3	T506 F511 I534 V537 F564 L593	T506-L571 PolarHBondContact O-N 2.86Å; F511-L571 HydrophobicContact CB-CD1 4.11Å; F511-L571 HydrophobicContact CD1-CD1 3.69Å; F511-L571 HydrophobicContact CD2-CD1 4.31Å; F511-L571 HydrophobicContact CE1-CD1 4.17Å; F511-L571 HydrophobicContact CG-CD1 3.77Å; I534-L571 HydrophobicContact CB-CD2 3.98Å; I534-L571 HydrophobicContact CD1-CD1 3.88Å; I534-L571 HydrophobicContact CD1-CD2 3.72Å; I534-L571 HydrophobicContact CG1-CD2 4.48Å; I534-L571 HydrophobicContact CG2-CD2 3.78Å; V537-L571 HydrophobicContact CG2-CD2 4.4Å; F564-L571 HydrophobicContact CE2-CD1 3.83Å; F564-L571 HydrophobicContact CE2-CG 4.39Å; F564-L571 HydrophobicContact CZ-CD1 3.99Å; F564-L571 HydrophobicContact CZ-CD2 4.5Å; L571-L593 HydrophobicContact CB-CD1 4.36Å; L571-L593 HydrophobicContact CB-CD2 3.63Å; L571-L593 HydrophobicContact CD1-CD2 4.08Å; L571-L593 HydrophobicContact CG-CD2 4.5Å; L571-L593 WeakPolarHBondContact O-CD1 3.36Å
572	K	90.4	Very high	91	Very high	63 Å²	63	40.9 Å²	40.9	27%	0.274	23%	0.228	S	C	.	.			trans	-115	146.7	170.5	-68.8	-174.2	177.4	-179.3	0	110.9	E415 Y436 Y570 A575	E415-K572 IonicContact OE1-NZ 2.73Å; E415-K572 PolarHBondContact OE1-NZ 3.28Å; E415-K572 WeakPolarHBondContact OE2-CE 3.37Å; E415-K572 IonicContact OE2-NZ 2.72Å; E415-K572 PolarHBondContact OE2-NZ 3.16Å; Y436-K572 VanDerWaalsContact CE1-NZ 3.32Å; Y570-K572 HydrophobicContact CE1-CG 4.33Å; Y570-K572 WeakPolarHBondContact OH-CE 3.39Å; K572-A575 WeakPolarHBondContact O-CB 3.47Å; K572-A575 PolarHBondContact O-N 3.09Å
573	V	92.2	Very high	89.9	Confident	92 Å²	92	44 Å²	44	56%	0.558	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	138.2	168.6	-179.9	0	0	0	0	108.9	A575 T591 L593	V573-A575 VanDerWaalsContact C-N 3.3Å; V573-T591 WeakPolarHBondContact CG1-O 3.36Å; V573-L593 HydrophobicContact CG2-CD1 4.16Å; V573-L593 HydrophobicContact CG2-CG 4.14Å
574	G	90.6	Very high	89	Confident	46 Å²	46	40.1 Å²	40.1	47%	0.474	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-6.1	-174.9	0	0	0	0	0	114.7	K576 V590	G574-K576 PolarHBondContact O-N 3.21Å; G574-V590 WeakPolarHBondContact CA-O 3.34Å; G574-V590 PolarHBondContact N-O 2.89Å
575	A	90	Very high	88.4	Confident	25 Å²	25	40.9 Å²	40.9	21%	0.207	23%	0.234	C	C	.	.			trans	-60.1	134.1	178.7	0	0	0	0	0	111.2	I534 K572 V573 L577 H589 V590	I534-A575 HydrophobicContact CG2-CB 3.56Å; K572-A575 WeakPolarHBondContact O-CB 3.47Å; K572-A575 PolarHBondContact O-N 3.09Å; V573-A575 VanDerWaalsContact C-N 3.3Å; A575-L577 PolarHBondContact O-N 2.95Å; A575-H589 CarbonylContact O-C 3.55Å; A575-H589 VanDerWaalsContact O-CA 3.22Å; A575-H589 WeakPolarHBondContact O-CA 3.38Å; A575-V590 HydrophobicContact CB-CG2 4.23Å; A575-V590 PolarHBondContact O-N 2.89Å
576	K	90.5	Very high	88	Confident	95 Å²	95	37 Å²	37	41%	0.413	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.5	179.7	-64.4	173	-171.7	165	0	109.4	L312 G574	L312-K576 HydrophobicContact CD2-CB 4.43Å; L312-K576 WeakPolarHBondContact O-CE 3.13Å; L312-K576 PolarHBondContact O-NZ 2.66Å; G574-K576 PolarHBondContact O-N 3.21Å
577	L	91.6	Very high	88	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.2	-179.5	168.8	65.2	0	0	0	109.7	F511 A513 I515 V532 I534 F562 A575 F579 I587 G588	F511-L577 HydrophobicContact CE2-CD2 4.23Å; A513-L577 HydrophobicContact CB-CD2 3.43Å; A513-L577 VanDerWaalsContact CB-CD2 3.43Å; I515-L577 HydrophobicContact CG2-CD2 3.82Å; V532-L577 HydrophobicContact CB-CD1 4.2Å; V532-L577 HydrophobicContact CG1-CD1 3.27Å; V532-L577 HydrophobicContact CG2-CD1 4.15Å; I534-L577 HydrophobicContact CD1-CD1 3.89Å; I534-L577 HydrophobicContact CG1-CB 4.31Å; I534-L577 HydrophobicContact CG1-CD1 3.56Å; F562-L577 HydrophobicContact CD2-CD2 4.35Å; F562-L577 HydrophobicContact CE2-CD2 3.85Å; F562-L577 HydrophobicContact CZ-CD2 4.34Å; A575-L577 PolarHBondContact O-N 2.95Å; L577-F579 HydrophobicContact CD2-CD1 4.49Å; L577-F579 HydrophobicContact CG-CD1 4.47Å; L577-I587 CarbonylContact O-C 3.52Å; L577-I587 WeakPolarHBondContact O-CA 3.36Å; L577-G588 PolarHBondContact N-O 2.98Å; L577-G588 PolarHBondContact O-N 2.72Å
578	L	90.8	Very high	87.9	Confident	1 Å²	1	30 Å²	30	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.1	165.3	-177.3	150.5	0	0	0	109.3	I277 L308 H533 R580 T584 I587	I277-L578 HydrophobicContact CD1-CD1 4.15Å; I277-L578 HydrophobicContact CD1-CD2 3.65Å; I277-L578 HydrophobicContact CG2-CD2 4.17Å; L308-L578 HydrophobicContact CD2-CD1 3.35Å; H533-L578 HydrophobicContact CB-CB 4.36Å; H533-L578 HydrophobicContact CB-CD2 4.49Å; H533-L578 PolarHBondContact N-O 3.38Å; H533-L578 PolarHBondContact O-N 2.96Å; L578-R580 HydrophobicContact CD2-CG 3.46Å; L578-R580 VanDerWaalsContact CD2-CG 3.46Å; L578-T584 HydrophobicContact CD1-CG2 4.06Å; L578-T584 HydrophobicContact CD2-CG2 4.26Å; L578-T584 HydrophobicContact CG-CG2 4.11Å; L578-I587 HydrophobicContact CD1-CG2 4.3Å; L578-I587 HydrophobicContact CG-CG2 4.36Å
579	F	90.6	Very high	87.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.3	179	66.3	-89.1	0	0	0	113.5	I515 L517 F524 V530 T531 V532 F562 L577 K585 G586	I515-F579 HydrophobicContact CB-CE1 3.96Å; I515-F579 HydrophobicContact CD1-CE1 3.84Å; I515-F579 HydrophobicContact CD1-CZ 3.7Å; I515-F579 HydrophobicContact CG2-CD1 4.48Å; I515-F579 HydrophobicContact CG2-CE1 3.91Å; L517-F579 HydrophobicContact CD1-CE2 3.95Å; L517-F579 HydrophobicContact CD1-CZ 3.88Å; F524-F579 HydrophobicContact CD2-CE2 4.38Å; F524-F579 HydrophobicContact CE2-CD2 4.3Å; F524-F579 AromaticContact CE2-CE2 3.72Å; F524-F579 HydrophobicContact CE2-CE2 3.72Å; F524-F579 HydrophobicContact CE2-CZ 4.39Å; F524-F579 HydrophobicContact CZ-CE2 4.18Å; F524-F579 HydrophobicContact CZ-CZ 4.49Å; V530-F579 HydrophobicContact CB-CB 4.23Å; V530-F579 HydrophobicContact CB-CD2 4.24Å; V530-F579 HydrophobicContact CG1-CD2 4.09Å; V530-F579 HydrophobicContact CG2-CB 3.96Å; V530-F579 HydrophobicContact CG2-CD2 4.19Å; V530-F579 HydrophobicContact CG2-CG 4.36Å; T531-F579 CarbonylContact O-C 3.58Å; T531-F579 VanDerWaalsContact O-CA 3.24Å; T531-F579 WeakPolarHBondContact O-CA 3.3Å; V532-F579 HydrophobicContact CG2-CB 4.15Å; F562-F579 HydrophobicContact CZ-CD1 4.47Å; L577-F579 HydrophobicContact CD2-CD1 4.49Å; L577-F579 HydrophobicContact CG-CD1 4.47Å; F579-K585 HydrophobicContact CD2-CB 3.84Å; F579-K585 HydrophobicContact CE2-CB 3.61Å; F579-K585 PolarHBondContact O-N 2.84Å; F579-G586 WeakPolarHBondContact CD1-O 3.46Å; F579-G586 VanDerWaalsContact CE1-CA 3.46Å; F579-G586 PolarHBondContact N-O 3.24Å; F579-G586 PolarHBondContact O-N 3.45Å
580	R	87.3	Confident	87.9	Confident	18 Å²	18	32.6 Å²	32.6	7%	0.068	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.3	-167.1	-53.9	-164.6	52.7	162.9	8.3	113.9	L273 I277 E304 V530 T531 L578 G582 V583	L273-R580 VanDerWaalsContact CG-NH1 3.28Å; I277-R580 VanDerWaalsContact CD1-CD 3.42Å; E304-R580 IonicContact OE1-NH2 3.64Å; V530-R580 WeakPolarHBondContact CA-O 3.45Å; T531-R580 PolarHBondContact N-O 3.06Å; T531-R580 PolarHBondContact O-N 3.31Å; L578-R580 HydrophobicContact CD2-CG 3.46Å; L578-R580 VanDerWaalsContact CD2-CG 3.46Å; R580-G582 PolarHBondContact NH2-O 3.46Å; R580-V583 WeakPolarHBondContact CA-O 3.5Å; R580-V583 WeakPolarHBondContact CB-O 3.28Å
581	E	84.1	Confident	88	Confident	87 Å²	87	33.9 Å²	33.9	41%	0.407	21%	0.206	S	C	.	.	S	Bend	trans	-143.6	89.8	165.6	175.2	-150.7	-156.4	0	0	106.2	H520 F528 V583 K585	H520-E581 IonicContact CE1-OE2 3.04Å; F528-E581 HydrophobicContact CZ-CG 4.47Å; F528-E581 WeakPolarHBondContact CZ-OE2 3.49Å; E581-V583 PolarHBondContact N-O 3.33Å; E581-V583 VanDerWaalsContact N-O 3.15Å; E581-V583 PolarHBondContact O-N 2.85Å; E581-K585 HydrophobicContact CB-CG 4.2Å; E581-K585 WeakPolarHBondContact O-CE 3.44Å; E581-K585 WeakPolarHBondContact OE2-CE 3.45Å; E581-K585 IonicContact OE2-NZ 3.34Å; E581-K585 PolarHBondContact OE2-NZ 2.94Å
582	G	74.4	Confident	88.1	Confident	73 Å²	73	37.2 Å²	37.2	75%	0.753	22%	0.224	S	C	*	.	S	Bend	trans	70.7	-66.2	-167.6	0	0	0	0	0	112.5	R580	R580-G582 PolarHBondContact NH2-O 3.46Å
583	V	74.2	Confident	88.2	Confident	66 Å²	66	35 Å²	35	40%	0.4	22%	0.215	S	C	.	.	S	Bend	trans	-99.1	163.1	174.6	-65.7	0	0	0	0	111.7	R580 E581 K585	R580-V583 WeakPolarHBondContact CA-O 3.5Å; R580-V583 WeakPolarHBondContact CB-O 3.28Å; E581-V583 PolarHBondContact N-O 3.33Å; E581-V583 VanDerWaalsContact N-O 3.15Å; E581-V583 PolarHBondContact O-N 2.85Å; V583-K585 HydrophobicContact CG2-CD 4.18Å; V583-K585 PolarHBondContact O-N 2.84Å
584	T	77.3	Confident	88.2	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	121.1	174.6	-54.7	0	0	0	0	110	F9 L308 L518 L578	F9-T584 HydrophobicContact CE1-CG2 4.49Å; L308-T584 HydrophobicContact CD2-CG2 4.33Å; L518-T584 HydrophobicContact CD1-CG2 4.42Å; L578-T584 HydrophobicContact CD1-CG2 4.06Å; L578-T584 HydrophobicContact CD2-CG2 4.26Å; L578-T584 HydrophobicContact CG-CG2 4.11Å
585	K	82	Confident	87.9	Confident	18 Å²	18	35.4 Å²	35.4	8%	0.078	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-40.8	-175.7	-64.6	-58.8	-168.4	179	0	112	L517 L518 F519 H520 F579 E581 V583	L517-K585 HydrophobicContact CD1-CB 4.45Å; L518-K585 PolarHBondContact N-O 2.94Å; F519-K585 PolarHBondContact N-O 3.17Å; F519-K585 VanDerWaalsContact N-O 3.13Å; F519-K585 WeakPolarHBondContact O-CD 3.38Å; H520-K585 HydrophobicContact CB-CD 4.41Å; H520-K585 WeakPolarHBondContact ND1-CD 3.22Å; H520-K585 WeakPolarHBondContact ND1-CE 3.26Å; H520-K585 PolarHBondContact ND1-NZ 3.01Å; F579-K585 HydrophobicContact CD2-CB 3.84Å; F579-K585 HydrophobicContact CE2-CB 3.61Å; F579-K585 PolarHBondContact O-N 2.84Å; E581-K585 HydrophobicContact CB-CG 4.2Å; E581-K585 WeakPolarHBondContact O-CE 3.44Å; E581-K585 WeakPolarHBondContact OE2-CE 3.45Å; E581-K585 IonicContact OE2-NZ 3.34Å; E581-K585 PolarHBondContact OE2-NZ 2.94Å; V583-K585 HydrophobicContact CG2-CD 4.18Å; V583-K585 PolarHBondContact O-N 2.84Å
586	G	86.6	Confident	87.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	172.9	179.2	0	0	0	0	0	113.1	V516 F579	V516-G586 WeakPolarHBondContact O-CA 3.4Å; F579-G586 WeakPolarHBondContact CD1-O 3.46Å; F579-G586 VanDerWaalsContact CE1-CA 3.46Å; F579-G586 PolarHBondContact N-O 3.24Å; F579-G586 PolarHBondContact O-N 3.45Å
587	I	89.6	Confident	85.9	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	157.4	-174.4	60.2	170.8	0	0	0	108.5	M1 A311 I515 V516 L518 L577 L578	M1-I587 HydrophobicContact SD-CD1 4.48Å; A311-I587 HydrophobicContact CB-CB 4.36Å; A311-I587 HydrophobicContact CB-CD1 3.59Å; A311-I587 HydrophobicContact CB-CG2 3.7Å; I515-I587 CarbonylContact C-O 3.57Å; I515-I587 WeakPolarHBondContact CA-O 3.3Å; V516-I587 HydrophobicContact CB-CG1 4.4Å; V516-I587 PolarHBondContact N-O 3.04Å; V516-I587 PolarHBondContact O-N 2.77Å; V516-I587 VanDerWaalsContact O-N 3.08Å; L518-I587 HydrophobicContact CD1-CB 4.33Å; L518-I587 HydrophobicContact CD1-CD1 4.22Å; L518-I587 HydrophobicContact CD1-CG1 3.96Å; L518-I587 HydrophobicContact CD1-CG2 3.61Å; L518-I587 HydrophobicContact CD2-CD1 4.23Å; L518-I587 HydrophobicContact CD2-CG1 4.23Å; L518-I587 HydrophobicContact CG-CG1 4.15Å; L577-I587 CarbonylContact O-C 3.52Å; L577-I587 WeakPolarHBondContact O-CA 3.36Å; L578-I587 HydrophobicContact CD1-CG2 4.3Å; L578-I587 HydrophobicContact CG-CG2 4.36Å
588	G	90.6	Very high	84	Confident	2 Å²	2	42.1 Å²	42.1	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	-163.6	-179.9	0	0	0	0	0	112.3	E514 L577	E514-G588 CarbonylContact O-C 3.59Å; E514-G588 WeakPolarHBondContact O-CA 3.42Å; L577-G588 PolarHBondContact N-O 2.98Å; L577-G588 PolarHBondContact O-N 2.72Å
589	H	93.4	Very high	81.3	Confident	58 Å²	58	50.3 Å²	50.3	27%	0.269	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.4	170.6	59.8	-68.7	0	0	0	109.8	A513 E514 A575 T591	A513-H589 CarbonylContact C-O 3.38Å; A513-H589 VanDerWaalsContact CA-O 3.23Å; A513-H589 WeakPolarHBondContact CA-O 3.29Å; A513-H589 WeakPolarHBondContact CB-O 3.48Å; E514-H589 PolarHBondContact N-O 2.95Å; E514-H589 PolarHBondContact O-N 3.42Å; E514-H589 IonicContact OE2-CE1 3.81Å; E514-H589 PolarHBondContact OE2-CE1 2.81Å; E514-H589 VanDerWaalsContact OE2-CE1 3.24Å; E514-H589 IonicContact OE2-NE2 3.34Å; A575-H589 CarbonylContact O-C 3.55Å; A575-H589 VanDerWaalsContact O-CA 3.22Å; A575-H589 WeakPolarHBondContact O-CA 3.38Å; H589-T591 PolarHBondContact O-N 2.91Å
590	V	94.9	Very high	78.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	127.4	178.4	179.8	0	0	0	0	109	F511 I534 G574 A575 L593	F511-V590 HydrophobicContact CB-CG1 4.47Å; F511-V590 HydrophobicContact CD2-CG1 4.36Å; F511-V590 HydrophobicContact CD2-CG2 4.07Å; F511-V590 HydrophobicContact CE2-CG2 4.34Å; I534-V590 HydrophobicContact CD1-CG2 4.13Å; G574-V590 WeakPolarHBondContact CA-O 3.34Å; G574-V590 PolarHBondContact N-O 2.89Å; A575-V590 HydrophobicContact CB-CG2 4.23Å; A575-V590 PolarHBondContact O-N 2.89Å; V590-L593 HydrophobicContact CG1-CD2 3.56Å; V590-L593 HydrophobicContact CG1-CG 4.28Å
591	T	94.6	Very high	75.8	Confident	49 Å²	49	66.3 Å²	66.3	30%	0.301	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-33.9	-179	50.1	0	0	0	0	112	E512 E514 V573 H589	E512-T591 PolarHBondContact O-N 3.45Å; E512-T591 PolarHBondContact O-OG1 3.25Å; E514-T591 HydrophobicContact CB-CG2 3.85Å; V573-T591 WeakPolarHBondContact CG1-O 3.36Å; H589-T591 PolarHBondContact O-N 2.91Å
592	N	94.3	Very high	73.2	Confident	76 Å²	76	70.2 Å²	70.2	41%	0.406	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	150.3	-178.1	-163.4	12.2	0	0	0	111	F511 E512	F511-N592 WeakPolarHBondContact CA-O 3.11Å; E512-N592 HydrophobicContact CB-CB 3.99Å; E512-N592 HydrophobicContact CG-CB 4.3Å; E512-N592 PolarHBondContact N-O 3.26Å; E512-N592 PolarHBondContact O-N 3.47Å; E512-N592 WeakPolarHBondContact OE2-CB 3.38Å
593	L	92.9	Very high	71.2	Confident	17 Å²	17	76.3 Å²	76.3	9%	0.089	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.4	-180	-61.2	175.6	0	0	0	108.5	T506 F511 L571 V573 V590 P595	T506-L593 HydrophobicContact CG2-CB 4.01Å; T506-L593 HydrophobicContact CG2-CD1 3.79Å; F511-L593 HydrophobicContact CB-CD2 3.85Å; L571-L593 HydrophobicContact CB-CD1 4.36Å; L571-L593 HydrophobicContact CB-CD2 3.63Å; L571-L593 HydrophobicContact CD1-CD2 4.08Å; L571-L593 HydrophobicContact CG-CD2 4.5Å; L571-L593 WeakPolarHBondContact O-CD1 3.36Å; V573-L593 HydrophobicContact CG2-CD1 4.16Å; V573-L593 HydrophobicContact CG2-CG 4.14Å; V590-L593 HydrophobicContact CG1-CD2 3.56Å; V590-L593 HydrophobicContact CG1-CG 4.28Å; L593-P595 WeakPolarHBondContact O-CD 3.45Å
594	Q	91.5	Very high	69.2	Low	62 Å²	62	78.9 Å²	78.9	29%	0.29	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	100.8	171	-63.7	-176.4	-8.2	0	0	108.4	C508 M510	C508-Q594 WeakPolarHBondContact CB-O 3.18Å; M510-Q594 HydrophobicContact CB-CB 4.14Å; M510-Q594 HydrophobicContact CB-CG 4.45Å; M510-Q594 VanDerWaalsContact CB-OE1 3.27Å; M510-Q594 VanDerWaalsContact CE-OE1 3.24Å; M510-Q594 WeakPolarHBondContact O-CB 3.34Å; M510-Q594 PolarHBondContact O-N 3.13Å
595	P	85.2	Confident	67	Low	83 Å²	83	82 Å²	82	54%	0.539	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	146.6	-175.9	-17.3	30.9	0	0	0	110.7	T506 I507 L593 S597	T506-P595 HydrophobicContact CG2-CB 4.32Å; T506-P595 HydrophobicContact CG2-CG 4.14Å; I507-P595 WeakPolarHBondContact O-CA 3.44Å; L593-P595 WeakPolarHBondContact O-CD 3.45Å; P595-S597 PolarHBondContact O-N 2.86Å
596	I	81.8	Confident	64.6	Low	44 Å²	44	90.4 Å²	90.4	23%	0.226	47%	0.471	C	S	.	.			trans	-66.9	119.4	167	-61	178	0	0	0	107.3	I507 W509 P568 Y598	I507-I596 HydrophobicContact CB-CD1 4.43Å; I507-I596 HydrophobicContact CG2-CD1 3.78Å; I507-I596 PolarHBondContact O-N 3.32Å; W509-I596 HydrophobicContact CG-CD1 4.37Å; P568-I596 HydrophobicContact CB-CD1 3.34Å; P568-I596 HydrophobicContact CG-CD1 3.82Å; I596-Y598 VanDerWaalsContact C-N 3.31Å; I596-Y598 HydrophobicContact CB-CE2 4.23Å; I596-Y598 HydrophobicContact CG2-CD2 4.45Å; I596-Y598 HydrophobicContact CG2-CE2 4.19Å; I596-Y598 PolarHBondContact O-N 2.54Å
597	S	57.2	Low	62.1	Low	114 Å²	114	97.8 Å²	97.8	80%	0.797	51%	0.51	S	S	*	.			trans	-65.8	93.3	173.3	-40.6	0	0	0	0	108.6	P595 H599	P595-S597 PolarHBondContact O-N 2.86Å; S597-H599 PolarHBondContact O-N 2.82Å
598	Y	50.8	Low	59.7	Low	106 Å²	106	106.9 Å²	106.9	42%	0.416	55%	0.552	S	S	.	*			trans	-73.8	110.2	164.4	-77.7	-75	0	0	0	107.7	L453 G454 I507 I596 H600	L453-Y598 PolarHBondContact O-OH 3.32Å; L453-Y598 VanDerWaalsContact O-OH 3.07Å; G454-Y598 WeakPolarHBondContact CA-OH 3.37Å; G454-Y598 PolarHBondContact O-OH 2.74Å; I507-Y598 HydrophobicContact CD1-CE2 4.1Å; I596-Y598 VanDerWaalsContact C-N 3.31Å; I596-Y598 HydrophobicContact CB-CE2 4.23Å; I596-Y598 HydrophobicContact CG2-CD2 4.45Å; I596-Y598 HydrophobicContact CG2-CE2 4.19Å; I596-Y598 PolarHBondContact O-N 2.54Å; Y598-H600 VanDerWaalsContact C-N 3.32Å; Y598-H600 PolarHBondContact O-N 2.98Å
599	H	34.3	Very low	57.1	Low	174 Å²	174	116.2 Å²	116.2	81%	0.806	59%	0.592	S	S	*	*			trans	-58.8	106.1	151.8	-85.2	-71.4	0	0	0	106.3	S597 H601	S597-H599 PolarHBondContact O-N 2.82Å; H599-H601 VanDerWaalsContact C-N 3.3Å; H599-H601 PolarHBondContact O-N 3.22Å
600	H	31.7	Very low	54.3	Low	179 Å²	179	122 Å²	122	83%	0.829	65%	0.651	S	S	*	*			trans	-54.5	97.4	166.9	-94.4	-19.3	0	0	0	108.4	Y598 H602	Y598-H600 VanDerWaalsContact C-N 3.32Å; Y598-H600 PolarHBondContact O-N 2.98Å; H600-H602 VanDerWaalsContact C-N 3.31Å; H600-H602 PolarHBondContact O-N 2.89Å; H600-H602 VanDerWaalsContact O-N 3.11Å
601	H	30.6	Very low	52.2	Low	174 Å²	174	128.2 Å²	128.2	81%	0.806	68%	0.683	S	S	*	*			trans	-71.5	100.6	153.6	-85.3	-63.7	0	0	0	106.3	H599 F603	H599-H601 VanDerWaalsContact C-N 3.3Å; H599-H601 PolarHBondContact O-N 3.22Å; H601-F603 PolarHBondContact O-N 2.72Å; H601-F603 VanDerWaalsContact O-N 3.16Å
602	H	28.8	Very low	50	Low	169 Å²	169	132.3 Å²	132.3	78%	0.782	70%	0.704	S	S	*	*			trans	-39.6	120.2	154	-99.1	9.1	0	0	0	108.5	H600 P604	H600-H602 VanDerWaalsContact C-N 3.31Å; H600-H602 PolarHBondContact O-N 2.89Å; H600-H602 VanDerWaalsContact O-N 3.11Å; H602-P604 VanDerWaalsContact O-CD 3.25Å; H602-P604 WeakPolarHBondContact O-CD 3.43Å
603	F	32.8	Very low	47.5	Very low	202 Å²	202	135.4 Å²	135.4	89%	0.886	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55.9	116.3	156.6	-76.9	-90.9	0	0	0	106.5	H601 G605	H601-F603 PolarHBondContact O-N 2.72Å; H601-F603 VanDerWaalsContact O-N 3.16Å; F603-G605 PolarHBondContact O-N 3.14Å; F603-G605 VanDerWaalsContact O-N 3.14Å
604	P	31.4	Very low	44.9	Very low	119 Å²	119	142.4 Å²	142.4	77%	0.773	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-65.9	117.5	166.7	-2.2	17.7	0	0	0	105.7	H602 Q606	H602-P604 VanDerWaalsContact O-CD 3.25Å; H602-P604 WeakPolarHBondContact O-CD 3.43Å; P604-Q606 PolarHBondContact O-N 2.77Å
605	G	31.2	Very low	42	Very low	68 Å²	68	147.4 Å²	147.4	70%	0.701	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-52.3	124.3	166.5	0	0	0	0	0	108.3	F603 D607	F603-G605 PolarHBondContact O-N 3.14Å; F603-G605 VanDerWaalsContact O-N 3.14Å; G605-D607 PolarHBondContact O-N 3.19Å; G605-D607 VanDerWaalsContact O-N 3.11Å
606	Q	33	Very low	39.1	Very low	196 Å²	196	151.7 Å²	151.7	92%	0.916	80%	0.803	S	S	*	*			trans	-65.9	106.6	161.4	-77.7	179.1	-14.6	0	0	106.2	P604 E608	P604-Q606 PolarHBondContact O-N 2.77Å; Q606-E608 PolarHBondContact O-N 2.83Å
607	D	33.3	Very low	36	Very low	155 Å²	155	159.4 Å²	159.4	83%	0.829	84%	0.844	S	S	*	*			trans	-56.4	117.4	162.5	-80.9	-38.5	0	0	0	108.4	G605 K609	G605-D607 PolarHBondContact O-N 3.19Å; G605-D607 VanDerWaalsContact O-N 3.11Å; D607-K609 PolarHBondContact O-N 3.45Å; D607-K609 VanDerWaalsContact O-N 3.08Å
608	E	39.3	Very low	34.4	Very low	197 Å²	197	162.9 Å²	162.9	92%	0.921	85%	0.848	S	S	*	*			trans	-60.6	106.2	160	-84.8	-178.4	148.8	0	0	108.8	Q606	Q606-E608 PolarHBondContact O-N 2.83Å
609	K	35.9	Very low	33	Very low	198 Å²	198	167.7 Å²	167.7	86%	0.861	88%	0.884	S	S	*	*			trans	-136.8	96.9	154.3	-82	-169.7	178.9	177.3	0	109.3	D607	D607-K609 PolarHBondContact O-N 3.45Å; D607-K609 VanDerWaalsContact O-N 3.08Å
610	A	34.1	Very low	32.9	Very low	181 Å²	181	167.1 Å²	167.1	100%	1.496	89%	0.891	S	S	*	*			trans	175.2	0	131.9	0	0	0	0	0	109.3

Retrieved 610 of 610 residues in 240.5 ms (Link to these results)

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