A0A096MP04_PAPAN Loading...

Kelch repeat and BTB domain containing 4

AlphaFold DB (F6ZLM2), UniProt , Accession A0A096MP04, Species PAPAN (Papio anubis, Olive baboon), Gene KBTBD4, Length 543 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	32.3	Very low	29.8	Very low	239 Å²	239	160 Å²	160	100%	1.177	87%	0.866	S	S	*	*				0	113.1	0	-78.8	176.1	-172.2	0	0	107
2	A	28.2	Very low	29.8	Very low	111 Å²	111	157.3 Å²	157.3	92%	0.917	87%	0.866	S	S	*	*			trans	-69.6	129.3	177.8	0	0	0	0	0	109.8
3	V	28	Very low	29.9	Very low	138 Å²	138	152.6 Å²	152.6	84%	0.836	85%	0.849	S	S	*	*			trans	-121.3	118.7	169.3	-176.9	0	0	0	0	107.8	S5	V3-S5 PolarHBondContact O-N 3.36Å
4	N	25.8	Very low	30.1	Very low	166 Å²	166	152.7 Å²	152.7	89%	0.888	84%	0.837	S	S	*	*			trans	-52.3	124.2	-179.7	-93.2	-29.6	0	0	0	113.1
5	S	32	Very low	30.4	Very low	118 Å²	118	148.3 Å²	148.3	83%	0.825	83%	0.829	S	S	*	*			trans	-86.5	92.4	165.4	54.9	0	0	0	0	110.4	V3	V3-S5 PolarHBondContact O-N 3.36Å
6	A	31.6	Very low	30.7	Very low	88 Å²	88	146.3 Å²	146.3	73%	0.727	82%	0.816	S	S	*	*			trans	-170.7	82.6	163.1	0	0	0	0	0	111.1
7	S	30.1	Very low	30.7	Very low	106 Å²	106	141 Å²	141	74%	0.741	79%	0.791	S	S	*	*			trans	173.6	56.6	151.6	32.2	0	0	0	0	112.7
8	Y	30.1	Very low	30.9	Very low	241 Å²	241	144.6 Å²	144.6	95%	0.945	79%	0.79	S	S	*	*			trans	-143.9	68.6	165.5	-89.5	-83.6	0	0	0	110.6
9	S	30.3	Very low	31	Very low	118 Å²	118	144.9 Å²	144.9	83%	0.825	79%	0.786	S	S	*	*			trans	-137.9	57.9	173.4	55.1	0	0	0	0	111.1
10	R	30	Very low	31	Very low	226 Å²	226	148.4 Å²	148.4	85%	0.853	79%	0.787	S	S	*	*	S	Bend	trans	-141.8	5.1	174.4	-118.7	179	-144.6	-166.5	5.6	118.7
11	W	29	Very low	31.2	Very low	209 Å²	209	149 Å²	149	79%	0.792	79%	0.786	S	S	*	*	S	Bend	trans	-137.9	18.4	-174.9	-68.4	89.7	0	0	0	116.1	F14	W11-F14 HydrophobicContact CE3-CE2 4.37Å; W11-F14 HydrophobicContact CZ3-CE2 4.44Å
12	C	30.6	Very low	31.3	Very low	128 Å²	128	146.5 Å²	146.5	87%	0.865	77%	0.768	S	S	*	*			trans	-109.6	40.8	170.7	-69	0	0	0	0	112.6
13	C	30.1	Very low	31.5	Very low	96 Å²	96	148.7 Å²	148.7	65%	0.649	76%	0.764	S	S	*	*			trans	-131.7	66.4	172.9	-63.9	0	0	0	0	110
14	F	33.8	Very low	31.8	Very low	154 Å²	154	146.5 Å²	146.5	68%	0.675	76%	0.76	S	S	*	*	S	Bend	trans	-100.5	-0.3	168.6	-101.9	-81.1	0	0	0	113.4	W11	W11-F14 HydrophobicContact CE3-CE2 4.37Å; W11-F14 HydrophobicContact CZ3-CE2 4.44Å
15	A	34.8	Very low	32.2	Very low	87 Å²	87	143.5 Å²	143.5	72%	0.719	75%	0.752	S	S	*	*	S	Bend	trans	-93.5	-25.5	176.4	0	0	0	0	0	114.1
16	D	34.5	Very low	32.5	Very low	115 Å²	115	146.1 Å²	146.1	62%	0.615	75%	0.753	S	S	*	*	S	Bend	trans	-95.7	-9.1	-175.2	-79.1	-21.2	0	0	0	115.3	W18	D16-W18 VanDerWaalsContact C-N 3.34Å
17	S	31.4	Very low	32.6	Very low	57 Å²	57	151.3 Å²	151.3	40%	0.399	76%	0.762	S	S	.	*	H	α-helix	trans	-75.9	-22	179.8	56	0	0	0	0	113.3	Q19	S17-Q19 VanDerWaalsContact C-N 3.32Å; S17-Q19 PolarHBondContact O-N 3.17Å
18	W	33.7	Very low	32.8	Very low	205 Å²	205	151 Å²	151	78%	0.777	76%	0.76	S	S	*	*	H	α-helix	trans	-75.6	-12.9	-178.1	-88.9	80.6	0	0	0	114.8	D16	D16-W18 VanDerWaalsContact C-N 3.34Å
19	Q	32.4	Very low	33.3	Very low	151 Å²	151	145.7 Å²	145.7	71%	0.706	76%	0.755	S	S	*	*	H	α-helix	trans	-96.9	-19.9	176.1	-77.8	-171.3	-24.3	0	0	114	S17	S17-Q19 VanDerWaalsContact C-N 3.32Å; S17-Q19 PolarHBondContact O-N 3.17Å
20	R	32.1	Very low	33.7	Very low	215 Å²	215	149.1 Å²	149.1	81%	0.811	76%	0.758	S	S	*	*	H	α-helix	trans	-79.5	-26.2	179.1	-76.8	-170.9	-167.5	-170.6	4.5	114.3	K22	R20-K22 PolarHBondContact O-N 3.15Å
21	E	33.9	Very low	34.2	Very low	162 Å²	162	147.3 Å²	147.3	76%	0.757	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-11.4	176.5	-80	-174.9	159.5	0	0	113.8
22	K	34.4	Very low	34.9	Very low	185 Å²	185	143.7 Å²	143.7	80%	0.804	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-3.6	178.5	-119.5	-179.6	-179.4	-177.9	0	114.8	R20	R20-K22 PolarHBondContact O-N 3.15Å
23	L	32.7	Very low	35.2	Very low	158 Å²	158	141.1 Å²	141.1	83%	0.827	76%	0.758	S	S	*	*	S	Bend	trans	-111.1	-0.5	-178.6	-95.1	141.2	0	0	0	114
24	A	34	Very low	36	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	77%	0.77	S	S	*	*	S	Bend	trans	-102.3	6.8	-179.1	0	0	0	0	0	114.6
25	S	34	Very low	36.4	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	77%	0.773	S	S	*	*			trans	-109.6	27.6	-175.7	77.1	0	0	0	0	114.9
26	M	39.6	Very low	37.2	Very low	174 Å²	174	144.2 Å²	144.2	86%	0.857	78%	0.783	S	S	*	*			trans	-127.3	85.1	175.3	-75.8	-176.6	78.1	0	0	111
27	E	33.9	Very low	38	Very low	196 Å²	196	146 Å²	146	92%	0.916	79%	0.792	S	S	*	*			trans	178.5	128.2	159.5	-100.3	169.2	-159.8	0	0	104.1
28	S	32.4	Very low	39.2	Very low	100 Å²	100	150.8 Å²	150.8	70%	0.699	81%	0.808	S	S	*	*			cis	-161.2	172.9	12.7	54.9	0	0	0	0	107.8
29	P	41.4	Very low	40.4	Very low	130 Å²	130	147.6 Å²	147.6	84%	0.844	81%	0.807	S	S	*	*			trans	-92.4	124.1	-179.3	32.3	-25.4	0	0	0	112.4
30	E	38	Very low	41.5	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.883	81%	0.81	S	S	*	*			trans	-108.5	140.3	167.4	-75.5	-169.6	161.1	0	0	111.8
31	E	40.6	Very low	43	Very low	189 Å²	189	148.3 Å²	148.3	88%	0.883	81%	0.809	S	S	*	*			trans	-69.3	163	-175.3	-81.4	-164.5	166	0	0	115.1	G33	E31-G33 PolarHBondContact O-N 3Å
32	P	43.7	Very low	44.6	Very low	132 Å²	132	146.7 Å²	146.7	86%	0.857	81%	0.81	S	S	*	*			trans	-87	114.1	-174.1	32.9	-29.6	0	0	0	112.7
33	G	38.2	Very low	46.7	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	81%	0.813	S	S	*	*			trans	-117.2	113.2	163.9	0	0	0	0	0	110.3	E31	E31-G33 PolarHBondContact O-N 3Å
34	A	45.6	Very low	49.1	Very low	109 Å²	109	147.2 Å²	147.2	90%	0.901	81%	0.81	S	S	*	*			trans	-71.8	133.3	-176.8	0	0	0	0	0	113.2
35	S	42.9	Very low	51.7	Low	104 Å²	104	148.1 Å²	148.1	73%	0.727	81%	0.806	S	S	*	*			trans	-142.6	115.2	146	64	0	0	0	0	109.4	D37	S35-D37 PolarHBondContact O-N 2.79Å; S35-D37 VanDerWaalsContact O-N 3.15Å
36	M	50.7	Low	54.5	Low	189 Å²	189	150 Å²	150	93%	0.931	80%	0.802	S	S	*	*			trans	-68.5	100.5	170.5	-88.8	170.7	155.8	0	0	109
37	D	52.9	Low	56.9	Low	151 Å²	151	149.8 Å²	149.8	81%	0.807	80%	0.796	S	S	*	*			trans	-100.4	115.1	153.7	-89.1	-28.7	0	0	0	108.1	S35 N39	S35-D37 PolarHBondContact O-N 2.79Å; S35-D37 VanDerWaalsContact O-N 3.15Å; D37-N39 VanDerWaalsContact C-N 3.34Å; D37-N39 PolarHBondContact O-N 3.03Å
38	E	56.5	Low	59.8	Low	159 Å²	159	143 Å²	143	74%	0.743	77%	0.766	S	S	*	*			trans	-68.3	85.8	176.1	-67.7	-172.4	145.9	0	0	110.6	Y40	E38-Y40 HydrophobicContact CB-CE2 4.38Å; E38-Y40 HydrophobicContact CG-CE2 4.31Å
39	N	58.2	Low	62.7	Low	138 Å²	138	149.6 Å²	149.6	74%	0.738	78%	0.775	S	S	*	*			trans	-120.9	88.5	157	-114.9	-15.3	0	0	0	108.3	D37 F41	D37-N39 VanDerWaalsContact C-N 3.34Å; D37-N39 PolarHBondContact O-N 3.03Å; N39-F41 PolarHBondContact O-N 2.86Å; N39-F41 VanDerWaalsContact O-N 3.1Å
40	Y	56.3	Low	65.2	Low	199 Å²	199	146.7 Å²	146.7	78%	0.78	76%	0.758	S	S	*	*			trans	-64.2	-9.9	-179.1	-83.5	-90.8	0	0	0	114.1	E38	E38-Y40 HydrophobicContact CB-CE2 4.38Å; E38-Y40 HydrophobicContact CG-CE2 4.31Å
41	F	62.7	Low	67.9	Low	181 Å²	181	143.1 Å²	143.1	79%	0.794	74%	0.741	S	S	*	*			trans	-100.1	89.6	170.3	-63.5	-77	0	0	0	109.1	N39 N43	N39-F41 PolarHBondContact O-N 2.86Å; N39-F41 VanDerWaalsContact O-N 3.1Å; F41-N43 PolarHBondContact O-N 2.93Å
42	V	68.6	Low	70.4	Confident	128 Å²	128	138.4 Å²	138.4	78%	0.776	73%	0.729	S	S	*	*			trans	-61.3	125.9	164.4	-174.7	0	0	0	0	107	Y44	V42-Y44 PolarHBondContact O-N 3.47Å
43	N	77.7	Confident	72.8	Confident	163 Å²	163	133.8 Å²	133.8	87%	0.872	71%	0.706	S	S	*	*			trans	-52.4	116.2	174.3	-74.2	-27.1	0	0	0	109.4	F41	F41-N43 PolarHBondContact O-N 2.93Å
44	Y	83.5	Confident	75.5	Confident	191 Å²	191	136.4 Å²	136.4	75%	0.749	69%	0.692	S	S	*	*			trans	-110	120.5	179.5	174.5	-99.4	0	0	0	110.2	V42 F46	V42-Y44 PolarHBondContact O-N 3.47Å; Y44-F46 HydrophobicContact CE1-CB 3.84Å
45	T	88.3	Confident	77.8	Confident	111 Å²	111	134.4 Å²	134.4	68%	0.681	67%	0.669	S	S	*	*			trans	-97.1	109.2	174.2	-57.5	0	0	0	0	109.7	K47	T45-K47 HydrophobicContact CG2-CG 4.35Å
46	F	92.1	Very high	80.2	Confident	143 Å²	143	131.9 Å²	131.9	63%	0.627	65%	0.654	S	S	*	*			trans	-74	126.7	169	177	-116.5	0	0	0	110.3	Y44 D48	Y44-F46 HydrophobicContact CE1-CB 3.84Å; F46-D48 HydrophobicContact CD1-CB 4.47Å; F46-D48 HydrophobicContact CE1-CB 3.62Å; F46-D48 HydrophobicContact CZ-CB 3.8Å
47	K	91.7	Very high	82.1	Confident	169 Å²	169	129.6 Å²	129.6	74%	0.735	64%	0.641	S	S	*	*			trans	-116.7	104.8	172.3	-72.2	-173.2	177.3	-178.4	0	109.7	T45 R49	T45-K47 HydrophobicContact CG2-CG 4.35Å; K47-R49 PolarHBondContact O-N 3.39Å
48	D	93.6	Very high	84.1	Confident	52 Å²	52	124 Å²	124	28%	0.278	62%	0.619	S	S	.	*			trans	-80.4	108	171.4	-173.7	-16.4	0	0	0	110.6	F46 S50 H51 R54	F46-D48 HydrophobicContact CD1-CB 4.47Å; F46-D48 HydrophobicContact CE1-CB 3.62Å; F46-D48 HydrophobicContact CZ-CB 3.8Å; D48-S50 PolarHBondContact O-N 2.9Å; D48-S50 PolarHBondContact OD1-N 3.37Å; D48-H51 HydrophobicContact CB-CB 3.97Å; D48-H51 PolarHBondContact O-N 3.09Å; D48-H51 PolarHBondContact OD1-N 3.19Å; D48-R54 IonicContact OD1-NH1 3.32Å; D48-R54 PolarHBondContact OD1-NH1 2.96Å; D48-R54 IonicContact OD2-CZ 3.29Å; D48-R54 VanDerWaalsContact OD2-CZ 3.29Å; D48-R54 IonicContact OD2-NH1 3.09Å; D48-R54 PolarHBondContact OD2-NH1 3.48Å; D48-R54 VanDerWaalsContact OD2-NH1 3.09Å; D48-R54 IonicContact OD2-NH2 2.62Å; D48-R54 PolarHBondContact OD2-NH2 3.36Å
49	R	93.4	Very high	85.9	Confident	239 Å²	239	119.2 Å²	119.2	90%	0.902	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-16.9	-178.2	-62.1	-175.1	-177.1	-175	1.2	113.6	K47	K47-R49 PolarHBondContact O-N 3.39Å
50	S	94.8	Very high	87.5	Confident	69 Å²	69	115.2 Å²	115.2	48%	0.483	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.7	1.1	-177.2	-60.2	0	0	0	0	113	D48 S52 G53 R54	D48-S50 PolarHBondContact O-N 2.9Å; D48-S50 PolarHBondContact OD1-N 3.37Å; S50-S52 PolarHBondContact O-N 3.42Å; S50-G53 PolarHBondContact O-N 2.89Å; S50-R54 PolarHBondContact O-N 3.34Å
51	H	94.8	Very high	89.2	Confident	114 Å²	114	110.4 Å²	110.4	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-57	-49.6	-175.9	-179.4	74.4	0	0	0	112.7	D48 G53 R54 V55	D48-H51 HydrophobicContact CB-CB 3.97Å; D48-H51 PolarHBondContact O-N 3.09Å; D48-H51 PolarHBondContact OD1-N 3.19Å; H51-G53 PolarHBondContact O-N 3.43Å; H51-R54 PolarHBondContact O-N 3.33Å; H51-V55 WeakPolarHBondContact O-CG2 3.42Å; H51-V55 PolarHBondContact O-N 2.98Å
52	S	93.1	Very high	90.8	Very high	91 Å²	91	104.6 Å²	104.6	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-60.9	-43	179.3	52.7	0	0	0	0	112.6	S50 V55 A56	S50-S52 PolarHBondContact O-N 3.42Å; S52-V55 PolarHBondContact O-N 2.74Å; S52-A56 WeakPolarHBondContact O-CB 3.24Å; S52-A56 PolarHBondContact O-N 2.92Å
53	G	92.8	Very high	91.9	Very high	35 Å²	35	99.2 Å²	99.2	36%	0.361	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-44.1	177.1	0	0	0	0	0	112.6	S50 H51 A56 Q57	S50-G53 PolarHBondContact O-N 2.89Å; H51-G53 PolarHBondContact O-N 3.43Å; G53-A56 PolarHBondContact O-N 2.84Å; G53-Q57 WeakPolarHBondContact O-CB 3.42Å; G53-Q57 VanDerWaalsContact O-CG 3.3Å; G53-Q57 WeakPolarHBondContact O-CG 3.42Å; G53-Q57 PolarHBondContact O-N 3.22Å
54	R	95.2	Very high	92.5	Very high	129 Å²	129	94.6 Å²	94.6	49%	0.487	48%	0.478	S	S	.	.	H	α-helix	trans	-67.1	-38.8	177.1	-67.4	-163.4	-49.9	-89.4	-1.3	112.5	D48 S50 H51 G58	D48-R54 IonicContact OD1-NH1 3.32Å; D48-R54 PolarHBondContact OD1-NH1 2.96Å; D48-R54 IonicContact OD2-CZ 3.29Å; D48-R54 VanDerWaalsContact OD2-CZ 3.29Å; D48-R54 IonicContact OD2-NH1 3.09Å; D48-R54 PolarHBondContact OD2-NH1 3.48Å; D48-R54 VanDerWaalsContact OD2-NH1 3.09Å; D48-R54 IonicContact OD2-NH2 2.62Å; D48-R54 PolarHBondContact OD2-NH2 3.36Å; S50-R54 PolarHBondContact O-N 3.34Å; H51-R54 PolarHBondContact O-N 3.33Å; R54-G58 PolarHBondContact O-N 2.9Å
55	V	94.8	Very high	92.7	Very high	68 Å²	68	92.2 Å²	92.2	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-64.5	-47.3	175.2	171.2	0	0	0	0	110.5	H51 S52 Q57 G58 I59	H51-V55 WeakPolarHBondContact O-CG2 3.42Å; H51-V55 PolarHBondContact O-N 2.98Å; S52-V55 PolarHBondContact O-N 2.74Å; V55-Q57 PolarHBondContact O-N 3.1Å; V55-G58 PolarHBondContact O-N 3.2Å; V55-I59 HydrophobicContact CG1-CD1 3.85Å; V55-I59 HydrophobicContact CG1-CG1 4.46Å; V55-I59 WeakPolarHBondContact O-CG1 2.92Å; V55-I59 PolarHBondContact O-N 3.25Å
56	A	91.5	Very high	92.8	Very high	50 Å²	50	91.2 Å²	91.2	41%	0.413	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-46.5	178.4	0	0	0	0	0	111.8	S52 G53 G58 I59 M60	S52-A56 WeakPolarHBondContact O-CB 3.24Å; S52-A56 PolarHBondContact O-N 2.92Å; G53-A56 PolarHBondContact O-N 2.84Å; A56-G58 VanDerWaalsContact C-N 3.34Å; A56-G58 PolarHBondContact O-N 2.85Å; A56-I59 PolarHBondContact O-N 2.94Å; A56-M60 WeakPolarHBondContact O-CG 3.32Å; A56-M60 PolarHBondContact O-N 2.78Å
57	Q	92.4	Very high	92.7	Very high	141 Å²	141	92 Å²	92	66%	0.659	47%	0.467	S	S	*	.	H	α-helix	trans	-60.8	-42.2	174.8	-75.8	174.2	-6.7	0	0	112.2	G53 V55 M60 K61	G53-Q57 WeakPolarHBondContact O-CB 3.42Å; G53-Q57 VanDerWaalsContact O-CG 3.3Å; G53-Q57 WeakPolarHBondContact O-CG 3.42Å; G53-Q57 PolarHBondContact O-N 3.22Å; V55-Q57 PolarHBondContact O-N 3.1Å; Q57-M60 PolarHBondContact O-N 2.71Å; Q57-K61 WeakPolarHBondContact O-CB 3.33Å; Q57-K61 PolarHBondContact O-N 2.93Å
58	G	94	Very high	92.7	Very high	33 Å²	33	87.5 Å²	87.5	34%	0.34	45%	0.451	S	S	.	.	H	α-helix	trans	-61.7	-44.9	176.6	0	0	0	0	0	112.6	R54 V55 A56 K61 L62	R54-G58 PolarHBondContact O-N 2.9Å; V55-G58 PolarHBondContact O-N 3.2Å; A56-G58 VanDerWaalsContact C-N 3.34Å; A56-G58 PolarHBondContact O-N 2.85Å; G58-K61 PolarHBondContact O-N 2.98Å; G58-L62 WeakPolarHBondContact O-CG 3.5Å; G58-L62 PolarHBondContact O-N 3.22Å; G58-L62 VanDerWaalsContact O-N 3.09Å
59	I	93.6	Very high	92.7	Very high	60 Å²	60	92.2 Å²	92.2	31%	0.308	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-49.7	175.4	-68.5	167.8	0	0	0	110.3	V55 A56 K61 L62 C63 V87	V55-I59 HydrophobicContact CG1-CD1 3.85Å; V55-I59 HydrophobicContact CG1-CG1 4.46Å; V55-I59 WeakPolarHBondContact O-CG1 2.92Å; V55-I59 PolarHBondContact O-N 3.25Å; A56-I59 PolarHBondContact O-N 2.94Å; I59-K61 VanDerWaalsContact C-N 3.3Å; I59-K61 PolarHBondContact O-N 3.11Å; I59-L62 PolarHBondContact O-N 2.93Å; I59-C63 PolarHBondContact O-N 2.79Å; I59-C63 PolarHBondContact O-SG 2.78Å; I59-V87 HydrophobicContact CG2-CG2 4.29Å
60	M	92.9	Very high	92.7	Very high	54 Å²	54	82.1 Å²	82.1	27%	0.266	44%	0.437	S	S	.	.	H	α-helix	trans	-63.3	-37.2	-178.9	-66.8	-56.7	173.3	0	0	112.4	A56 Q57 C63 L64 V87 Y129	A56-M60 WeakPolarHBondContact O-CG 3.32Å; A56-M60 PolarHBondContact O-N 2.78Å; Q57-M60 PolarHBondContact O-N 2.71Å; M60-C63 PolarHBondContact O-N 2.88Å; M60-L64 VanDerWaalsContact O-CB 3.32Å; M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 WeakPolarHBondContact O-CG 3.49Å; M60-L64 PolarHBondContact O-N 2.76Å; M60-V87 HydrophobicContact CE-CG1 3.98Å; M60-V87 HydrophobicContact SD-CG1 4.42Å; M60-Y129 HydrophobicContact SD-CD1 4.33Å
61	K	92.8	Very high	92.7	Very high	98 Å²	98	82.2 Å²	82.2	43%	0.426	43%	0.432	S	S	.	.	H	α-helix	trans	-59.8	-48.5	173.3	179.5	176.6	177.3	-175.5	0	112	Q57 G58 I59 C63 L64 E65 E66	Q57-K61 WeakPolarHBondContact O-CB 3.33Å; Q57-K61 PolarHBondContact O-N 2.93Å; G58-K61 PolarHBondContact O-N 2.98Å; I59-K61 VanDerWaalsContact C-N 3.3Å; I59-K61 PolarHBondContact O-N 3.11Å; K61-C63 VanDerWaalsContact C-N 3.27Å; K61-C63 PolarHBondContact O-N 2.9Å; K61-L64 PolarHBondContact O-N 3.46Å; K61-E65 VanDerWaalsContact CE-OE2 3.24Å; K61-E65 WeakPolarHBondContact CE-OE2 3.3Å; K61-E65 HydrophobicContact CG-CB 4.32Å; K61-E65 HydrophobicContact CG-CG 4.35Å; K61-E65 WeakPolarHBondContact O-CB 3.38Å; K61-E65 PolarHBondContact O-N 3.49Å; K61-E66 PolarHBondContact O-N 3.4Å
62	L	94.6	Very high	92.7	Very high	59 Å²	59	76.8 Å²	76.8	31%	0.309	41%	0.407	S	S	.	.	H	α-helix	trans	-60.5	-39.6	178.3	-68.6	170	0	0	0	111.8	G58 I59 E66 E67 L68 F69	G58-L62 WeakPolarHBondContact O-CG 3.5Å; G58-L62 PolarHBondContact O-N 3.22Å; G58-L62 VanDerWaalsContact O-N 3.09Å; I59-L62 PolarHBondContact O-N 2.93Å; L62-E66 WeakPolarHBondContact CD2-OE2 3.28Å; L62-E66 CarbonylContact O-C 3.36Å; L62-E67 PolarHBondContact O-N 2.97Å; L62-L68 HydrophobicContact CD2-CD1 4.33Å; L62-L68 PolarHBondContact O-N 3.3Å; L62-F69 HydrophobicContact CB-CD2 4.43Å; L62-F69 HydrophobicContact CB-CE2 4.48Å; L62-F69 HydrophobicContact CD1-CE2 4.09Å; L62-F69 HydrophobicContact CD2-CE2 4.24Å
63	C	92.4	Very high	92.8	Very high	14 Å²	14	72.7 Å²	72.7	10%	0.095	38%	0.378	C	S	.	.	H	α-helix	trans	-72.6	-42.2	-179.7	-68.1	0	0	0	0	113.6	I59 M60 K61 H84 Y129	I59-C63 PolarHBondContact O-N 2.79Å; I59-C63 PolarHBondContact O-SG 2.78Å; M60-C63 PolarHBondContact O-N 2.88Å; K61-C63 VanDerWaalsContact C-N 3.27Å; K61-C63 PolarHBondContact O-N 2.9Å; C63-H84 VanDerWaalsContact CB-CE1 3.5Å; C63-H84 WeakPolarHBondContact CB-CE1 3.44Å; C63-H84 VanDerWaalsContact SG-CD2 3.55Å; C63-H84 VanDerWaalsContact SG-CE1 3.55Å; C63-H84 VanDerWaalsContact SG-CG 3.57Å; C63-Y129 HydrophobicContact CB-CD1 4.28Å; C63-Y129 HydrophobicContact CB-CE1 3.89Å
64	L	89.6	Confident	92.9	Very high	66 Å²	66	71 Å²	71	35%	0.346	36%	0.361	S	S	.	.	H	α-helix	trans	-98.4	-38.6	-169	-68.5	174.3	0	0	0	114.4	M60 K61 Y129	M60-L64 VanDerWaalsContact O-CB 3.32Å; M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 WeakPolarHBondContact O-CG 3.49Å; M60-L64 PolarHBondContact O-N 2.76Å; K61-L64 PolarHBondContact O-N 3.46Å; L64-Y129 HydrophobicContact CD2-CD1 3.79Å; L64-Y129 HydrophobicContact CD2-CG 4.09Å; L64-Y129 HydrophobicContact CG-CD1 4.1Å
65	E	89.1	Confident	92.9	Very high	142 Å²	142	65.7 Å²	65.7	66%	0.664	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-37.8	-177.3	-63.7	179.9	-164.7	0	0	111.8	K61	K61-E65 VanDerWaalsContact CE-OE2 3.24Å; K61-E65 WeakPolarHBondContact CE-OE2 3.3Å; K61-E65 HydrophobicContact CG-CB 4.32Å; K61-E65 HydrophobicContact CG-CG 4.35Å; K61-E65 WeakPolarHBondContact O-CB 3.38Å; K61-E65 PolarHBondContact O-N 3.49Å
66	E	90.4	Very high	93	Very high	89 Å²	89	62.4 Å²	62.4	42%	0.416	32%	0.324	S	S	.	.	S	Bend	trans	-101.1	-10.3	-174.9	-56.7	-177.8	-159.3	0	0	112.6	K61 L62 L68	K61-E66 PolarHBondContact O-N 3.4Å; L62-E66 WeakPolarHBondContact CD2-OE2 3.28Å; L62-E66 CarbonylContact O-C 3.36Å; E66-L68 HydrophobicContact CB-CD1 3.98Å; E66-L68 HydrophobicContact CB-CG 3.87Å; E66-L68 WeakPolarHBondContact O-CG 3.43Å; E66-L68 PolarHBondContact O-N 3.01Å; E66-L68 VanDerWaalsContact O-N 3.15Å
67	E	89.4	Confident	93.1	Very high	160 Å²	160	66.8 Å²	66.8	75%	0.748	34%	0.335	S	S	*	.			trans	50.7	33.6	-178.9	-60.7	-178.3	179.5	0	0	113.4	L62	L62-E67 PolarHBondContact O-N 2.97Å
68	L	92.1	Very high	92.9	Very high	75 Å²	75	63.3 Å²	63.3	39%	0.393	34%	0.337	S	S	.	.			trans	-94.4	150.5	-175.4	-65.6	179.8	0	0	0	112.3	L62 E66 A70 H84	L62-L68 HydrophobicContact CD2-CD1 4.33Å; L62-L68 PolarHBondContact O-N 3.3Å; E66-L68 HydrophobicContact CB-CD1 3.98Å; E66-L68 HydrophobicContact CB-CG 3.87Å; E66-L68 WeakPolarHBondContact O-CG 3.43Å; E66-L68 PolarHBondContact O-N 3.01Å; E66-L68 VanDerWaalsContact O-N 3.15Å; L68-A70 VanDerWaalsContact C-N 3.32Å; L68-A70 PolarHBondContact O-N 3.34Å; L68-H84 PolarHBondContact O-NE2 2.9Å
69	F	93.1	Very high	93	Very high	150 Å²	150	66.3 Å²	66.3	66%	0.658	34%	0.338	S	S	*	.			trans	70.5	16.4	171.5	-44.7	-72.8	0	0	0	116	L62 D71 H84	L62-F69 HydrophobicContact CB-CD2 4.43Å; L62-F69 HydrophobicContact CB-CE2 4.48Å; L62-F69 HydrophobicContact CD1-CE2 4.09Å; L62-F69 HydrophobicContact CD2-CE2 4.24Å; F69-D71 PolarHBondContact O-N 3.1Å; F69-H84 VanDerWaalsContact C-CD2 3.43Å; F69-H84 PolarHBondContact O-CD2 3.46Å
70	A	93.7	Very high	93.1	Very high	28 Å²	28	69.3 Å²	69.3	23%	0.231	35%	0.351	C	S	.	.			trans	-58.5	121.3	169.9	0	0	0	0	0	110.9	L68 Q82 L83 H84	L68-A70 VanDerWaalsContact C-N 3.32Å; L68-A70 PolarHBondContact O-N 3.34Å; A70-Q82 HydrophobicContact CB-CB 4.23Å; A70-L83 WeakPolarHBondContact CA-O 3.42Å; A70-H84 PolarHBondContact N-CD2 3Å; A70-H84 PolarHBondContact N-NE2 2.97Å
71	D	93.6	Very high	93.2	Very high	70 Å²	70	67.3 Å²	67.3	37%	0.374	34%	0.341	S	S	.	.			trans	-125.9	5.2	-169.5	64.9	-9.5	0	0	0	113	F69 L83 H84 R85	F69-D71 PolarHBondContact O-N 3.1Å; D71-L83 PolarHBondContact N-O 2.84Å; D71-L83 VanDerWaalsContact N-O 3.1Å; D71-H84 VanDerWaalsContact OD1-CA 3.3Å; D71-H84 WeakPolarHBondContact OD1-CA 3.32Å; D71-R85 PolarHBondContact O-NE 3.3Å; D71-R85 WeakPolarHBondContact OD1-CG 3.36Å; D71-R85 PolarHBondContact OD1-N 3.06Å
72	V	94.9	Very high	93.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	145.8	171.9	63.5	0	0	0	0	111.1	I74 L83 R85 L88 F99 I111	V72-I74 HydrophobicContact CG2-CG1 4.43Å; V72-L83 HydrophobicContact CG1-CB 4.07Å; V72-L83 WeakPolarHBondContact CG1-O 3.36Å; V72-L83 PolarHBondContact N-O 3.44Å; V72-L83 PolarHBondContact O-N 3.29Å; V72-L83 VanDerWaalsContact O-O 3.13Å; V72-R85 HydrophobicContact CB-CG 3.81Å; V72-R85 HydrophobicContact CG1-CG 3.75Å; V72-L88 HydrophobicContact CG1-CD1 4.07Å; V72-F99 HydrophobicContact CG1-CZ 4.35Å; V72-F99 HydrophobicContact CG2-CE1 4.25Å; V72-F99 HydrophobicContact CG2-CZ 4.34Å; V72-I111 HydrophobicContact CG2-CD1 3.87Å; V72-I111 HydrophobicContact CG2-CG1 4.43Å
73	T	95.7	Very high	93.4	Very high	5 Å²	5	65 Å²	65	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.9	171.6	-48.3	0	0	0	0	108.3	E80 F81 Q82 R109 V110 I111	T73-E80 HydrophobicContact CG2-CB 3.86Å; T73-E80 HydrophobicContact CG2-CG 4.19Å; T73-F81 CarbonylContact C-O 3.59Å; T73-F81 VanDerWaalsContact CA-O 3.28Å; T73-F81 WeakPolarHBondContact CA-O 3.39Å; T73-Q82 VanDerWaalsContact OG1-CD 3.24Å; T73-Q82 PolarHBondContact OG1-NE2 2.72Å; T73-Q82 PolarHBondContact OG1-OE1 3.09Å; T73-R109 PolarHBondContact N-O 3.01Å; T73-V110 CarbonylContact O-C 3.55Å; T73-V110 VanDerWaalsContact O-CA 3.32Å; T73-V110 WeakPolarHBondContact O-CA 3.4Å; T73-I111 PolarHBondContact O-N 3.46Å
74	I	95.3	Very high	93.5	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.4	172.7	-61.2	-177.3	0	0	0	108.3	V72 V76 F81 L83 L88 F95 I111 L113 F121	V72-I74 HydrophobicContact CG2-CG1 4.43Å; I74-V76 HydrophobicContact CG2-CG2 3.99Å; I74-F81 PolarHBondContact N-O 2.64Å; I74-F81 WeakPolarHBondContact O-CD2 3.35Å; I74-F81 PolarHBondContact O-N 3Å; I74-L83 HydrophobicContact CB-CD1 4.22Å; I74-L83 HydrophobicContact CD1-CD1 3.86Å; I74-L83 HydrophobicContact CG1-CD1 4.11Å; I74-L88 HydrophobicContact CD1-CD1 3.79Å; I74-F95 HydrophobicContact CD1-CD1 4.36Å; I74-F95 HydrophobicContact CD1-CE1 3.64Å; I74-F95 HydrophobicContact CD1-CZ 3.99Å; I74-I111 CarbonylContact C-O 3.37Å; I74-I111 WeakPolarHBondContact CA-O 3.32Å; I74-L113 HydrophobicContact CG2-CD1 3.56Å; I74-L113 HydrophobicContact CG2-CG 3.81Å; I74-F121 HydrophobicContact CB-CE1 4.12Å; I74-F121 HydrophobicContact CB-CZ 4.01Å; I74-F121 HydrophobicContact CD1-CZ 3.8Å; I74-F121 HydrophobicContact CG1-CZ 4.49Å; I74-F121 HydrophobicContact CG2-CE1 3.79Å; I74-F121 HydrophobicContact CG2-CE2 4.26Å; I74-F121 HydrophobicContact CG2-CZ 3.54Å
75	S	95.3	Very high	93.8	Very high	17 Å²	17	63.7 Å²	63.7	12%	0.119	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.7	177.2	173.2	0	0	0	0	109.7	R79 I111 V112 L113	S75-R79 WeakPolarHBondContact CA-O 3.38Å; S75-I111 PolarHBondContact N-O 2.85Å; S75-V112 WeakPolarHBondContact O-CA 3.2Å; S75-L113 PolarHBondContact O-N 3.21Å
76	V	95.9	Very high	94	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123	177.8	-175.8	0	0	0	0	108.1	I74 G78 R79 F81 L113 V116 F121	I74-V76 HydrophobicContact CG2-CG2 3.99Å; V76-G78 PolarHBondContact O-N 3.39Å; V76-R79 PolarHBondContact N-O 3.01Å; V76-R79 PolarHBondContact O-N 3.15Å; V76-F81 HydrophobicContact CB-CE2 4.24Å; V76-F81 HydrophobicContact CG2-CE2 4.36Å; V76-L113 HydrophobicContact CG2-CB 4.21Å; V76-L113 HydrophobicContact CG2-CD1 4.46Å; V76-V116 HydrophobicContact CG1-CG1 3.93Å; V76-V116 WeakPolarHBondContact CG1-O 3.41Å; V76-V116 HydrophobicContact CG2-CG1 4.3Å; V76-F121 HydrophobicContact CG1-CB 4.32Å; V76-F121 HydrophobicContact CG2-CB 4.11Å; V76-F121 HydrophobicContact CG2-CD1 3.65Å; V76-F121 HydrophobicContact CG2-CD2 4.16Å; V76-F121 HydrophobicContact CG2-CE1 4.1Å; V76-F121 HydrophobicContact CG2-CG 3.68Å
77	E	93.7	Very high	94.2	Very high	142 Å²	142	58.6 Å²	58.6	66%	0.664	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	26.7	-179	-60.7	-174.2	129.2	0	0	114.8	E118	E77-E118 PolarHBondContact OE2-N 3.48Å
78	G	89	Confident	94.5	Very high	67 Å²	67	51 Å²	51	69%	0.691	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	-5.7	-178.8	0	0	0	0	0	115.1	V76	V76-G78 PolarHBondContact O-N 3.39Å
79	R	95.4	Very high	94.7	Very high	97 Å²	97	48.4 Å²	48.4	37%	0.366	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.9	169.6	-174.5	169.8	177.4	-157.6	-10.3	111	S75 V76 F81 E118	S75-R79 WeakPolarHBondContact CA-O 3.38Å; V76-R79 PolarHBondContact N-O 3.01Å; V76-R79 PolarHBondContact O-N 3.15Å; R79-F81 HydrophobicContact CB-CE2 4.12Å; R79-F81 HydrophobicContact CG-CE2 3.9Å; R79-F81 HydrophobicContact CG-CZ 4.07Å; R79-E118 HydrophobicContact CB-CG 3.88Å; R79-E118 WeakPolarHBondContact CD-OE1 3.3Å; R79-E118 HydrophobicContact CG-CG 4.3Å; R79-E118 IonicContact CZ-OE1 3.53Å; R79-E118 IonicContact NE-OE1 3.6Å; R79-E118 IonicContact NH1-OE1 2.71Å; R79-E118 PolarHBondContact NH1-OE1 3.26Å
80	E	95.6	Very high	94.7	Very high	122 Å²	122	44 Å²	44	57%	0.57	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.1	179.9	-65.4	-171.2	165	0	0	112.4	T73	T73-E80 HydrophobicContact CG2-CB 3.86Å; T73-E80 HydrophobicContact CG2-CG 4.19Å
81	F	95.7	Very high	94.8	Very high	13 Å²	13	47 Å²	47	6%	0.057	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.6	178.1	-61.6	-98.9	0	0	0	109.3	T73 I74 V76 R79 L83 E118 F121 Q122 V125	T73-F81 CarbonylContact C-O 3.59Å; T73-F81 VanDerWaalsContact CA-O 3.28Å; T73-F81 WeakPolarHBondContact CA-O 3.39Å; I74-F81 PolarHBondContact N-O 2.64Å; I74-F81 WeakPolarHBondContact O-CD2 3.35Å; I74-F81 PolarHBondContact O-N 3Å; V76-F81 HydrophobicContact CB-CE2 4.24Å; V76-F81 HydrophobicContact CG2-CE2 4.36Å; R79-F81 HydrophobicContact CB-CE2 4.12Å; R79-F81 HydrophobicContact CG-CE2 3.9Å; R79-F81 HydrophobicContact CG-CZ 4.07Å; F81-L83 HydrophobicContact CB-CD1 3.84Å; F81-L83 HydrophobicContact CB-CD2 4.44Å; F81-L83 HydrophobicContact CB-CG 3.97Å; F81-E118 HydrophobicContact CZ-CG 4.25Å; F81-F121 HydrophobicContact CB-CE1 4.24Å; F81-F121 HydrophobicContact CD1-CD1 4.24Å; F81-F121 HydrophobicContact CD1-CE1 4.31Å; F81-F121 AromaticContact CD2-CD1 3.77Å; F81-F121 HydrophobicContact CD2-CD1 3.77Å; F81-F121 AromaticContact CD2-CE1 3.84Å; F81-F121 HydrophobicContact CD2-CE1 3.84Å; F81-F121 HydrophobicContact CE1-CD1 4.15Å; F81-F121 AromaticContact CE2-CD1 3.7Å; F81-F121 HydrophobicContact CE2-CD1 3.7Å; F81-F121 HydrophobicContact CE2-CE1 4.26Å; F81-F121 HydrophobicContact CG-CD1 4.06Å; F81-F121 AromaticContact CG-CE1 3.88Å; F81-F121 HydrophobicContact CG-CE1 3.88Å; F81-F121 AromaticContact CZ-CD1 3.89Å; F81-F121 HydrophobicContact CZ-CD1 3.89Å; F81-Q122 HydrophobicContact CE1-CB 4.32Å; F81-V125 HydrophobicContact CD1-CG2 4.34Å
82	Q	95.1	Very high	94.9	Very high	100 Å²	100	43.7 Å²	43.7	47%	0.467	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	115.7	173.5	-63.2	-63.9	-17.5	0	0	109.4	A70 T73	A70-Q82 HydrophobicContact CB-CB 4.23Å; T73-Q82 VanDerWaalsContact OG1-CD 3.24Å; T73-Q82 PolarHBondContact OG1-NE2 2.72Å; T73-Q82 PolarHBondContact OG1-OE1 3.09Å
83	L	96.1	Very high	94.9	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	175.2	-168.1	-59.8	171.5	0	0	0	111.1	A70 D71 V72 I74 F81 L88 F121 V125 Y129	A70-L83 WeakPolarHBondContact CA-O 3.42Å; D71-L83 PolarHBondContact N-O 2.84Å; D71-L83 VanDerWaalsContact N-O 3.1Å; V72-L83 HydrophobicContact CG1-CB 4.07Å; V72-L83 WeakPolarHBondContact CG1-O 3.36Å; V72-L83 PolarHBondContact N-O 3.44Å; V72-L83 PolarHBondContact O-N 3.29Å; V72-L83 VanDerWaalsContact O-O 3.13Å; I74-L83 HydrophobicContact CB-CD1 4.22Å; I74-L83 HydrophobicContact CD1-CD1 3.86Å; I74-L83 HydrophobicContact CG1-CD1 4.11Å; F81-L83 HydrophobicContact CB-CD1 3.84Å; F81-L83 HydrophobicContact CB-CD2 4.44Å; F81-L83 HydrophobicContact CB-CG 3.97Å; L83-L88 HydrophobicContact CB-CD1 3.96Å; L83-L88 HydrophobicContact CD1-CD1 4.12Å; L83-L88 HydrophobicContact CD1-CD2 4.37Å; L83-F121 HydrophobicContact CD1-CE1 4.24Å; L83-F121 HydrophobicContact CD1-CZ 4.29Å; L83-V125 HydrophobicContact CD1-CG2 4.09Å; L83-V125 HydrophobicContact CD2-CG1 3.79Å; L83-V125 HydrophobicContact CD2-CG2 4.18Å; L83-Y129 HydrophobicContact CD2-CE2 3.83Å
84	H	95.6	Very high	94.8	Very high	14 Å²	14	48.3 Å²	48.3	7%	0.065	26%	0.259	C	S	.	.			trans	-117	119.9	-175.5	-51.3	81.7	0	0	0	110.1	C63 L68 F69 A70 D71 L86 V87 L88 Y129	C63-H84 VanDerWaalsContact CB-CE1 3.5Å; C63-H84 WeakPolarHBondContact CB-CE1 3.44Å; C63-H84 VanDerWaalsContact SG-CD2 3.55Å; C63-H84 VanDerWaalsContact SG-CE1 3.55Å; C63-H84 VanDerWaalsContact SG-CG 3.57Å; L68-H84 PolarHBondContact O-NE2 2.9Å; F69-H84 VanDerWaalsContact C-CD2 3.43Å; F69-H84 PolarHBondContact O-CD2 3.46Å; A70-H84 PolarHBondContact N-CD2 3Å; A70-H84 PolarHBondContact N-NE2 2.97Å; D71-H84 VanDerWaalsContact OD1-CA 3.3Å; D71-H84 WeakPolarHBondContact OD1-CA 3.32Å; H84-L86 PolarHBondContact O-N 3.21Å; H84-V87 HydrophobicContact CB-CB 4.1Å; H84-V87 HydrophobicContact CB-CG2 3.84Å; H84-V87 PolarHBondContact O-N 3.28Å; H84-V87 VanDerWaalsContact O-N 3.15Å; H84-L88 WeakPolarHBondContact O-CG 3.21Å; H84-L88 PolarHBondContact O-N 3.39Å; H84-Y129 PolarHBondContact N-OH 3.41Å; H84-Y129 AromaticContact ND1-CE1 3.59Å; H84-Y129 AromaticContact ND1-CZ 3.68Å; H84-Y129 PolarHBondContact ND1-OH 3.03Å
85	R	94.1	Very high	94.8	Very high	38 Å²	38	48.4 Å²	48.4	14%	0.143	26%	0.26	C	S	.	.	H	α-helix	trans	-56.4	-40.1	179.3	-69.9	171.5	176.4	-95.9	-3.6	111.7	D71 V72 S89 F99 A106 N108	D71-R85 PolarHBondContact O-NE 3.3Å; D71-R85 WeakPolarHBondContact OD1-CG 3.36Å; D71-R85 PolarHBondContact OD1-N 3.06Å; V72-R85 HydrophobicContact CB-CG 3.81Å; V72-R85 HydrophobicContact CG1-CG 3.75Å; R85-S89 WeakPolarHBondContact O-CB 3.46Å; R85-S89 PolarHBondContact O-N 3.34Å; R85-S89 PolarHBondContact O-OG 3.2Å; R85-F99 HydrophobicContact CB-CD2 3.75Å; R85-F99 HydrophobicContact CB-CE2 3.96Å; R85-F99 HydrophobicContact CB-CG 4.38Å; R85-F99 HydrophobicContact CG-CD1 4.42Å; R85-F99 HydrophobicContact CG-CD2 3.84Å; R85-F99 HydrophobicContact CG-CE1 4.46Å; R85-F99 HydrophobicContact CG-CE2 3.89Å; R85-F99 HydrophobicContact CG-CG 4.13Å; R85-F99 HydrophobicContact CG-CZ 4.2Å; R85-A106 PolarHBondContact NH1-O 2.85Å; R85-A106 PolarHBondContact NH2-O 3.26Å; R85-N108 PolarHBondContact NH2-O 3.12Å
86	L	93.8	Very high	94.7	Very high	118 Å²	118	52.9 Å²	52.9	62%	0.618	27%	0.274	S	S	*	.	H	α-helix	trans	-61.7	-46.4	178.6	-178.1	65.6	0	0	0	111.7	H84 A90	H84-L86 PolarHBondContact O-N 3.21Å; L86-A90 VanDerWaalsContact O-CB 3.29Å; L86-A90 WeakPolarHBondContact O-CB 3.37Å; L86-A90 PolarHBondContact O-N 2.68Å
87	V	95.4	Very high	94.6	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-47.9	-177.8	179.7	0	0	0	0	110.5	I59 M60 H84 S89 A90 Q91 I128 Y129	I59-V87 HydrophobicContact CG2-CG2 4.29Å; M60-V87 HydrophobicContact CE-CG1 3.98Å; M60-V87 HydrophobicContact SD-CG1 4.42Å; H84-V87 HydrophobicContact CB-CB 4.1Å; H84-V87 HydrophobicContact CB-CG2 3.84Å; H84-V87 PolarHBondContact O-N 3.28Å; H84-V87 VanDerWaalsContact O-N 3.15Å; V87-S89 PolarHBondContact O-N 3.31Å; V87-A90 PolarHBondContact O-N 3.48Å; V87-Q91 PolarHBondContact O-N 3.44Å; V87-I128 HydrophobicContact CG1-CG2 3.82Å; V87-Y129 HydrophobicContact CB-CE1 4.1Å; V87-Y129 HydrophobicContact CG1-CD1 4.08Å; V87-Y129 HydrophobicContact CG1-CD2 4.36Å; V87-Y129 HydrophobicContact CG1-CE1 3.74Å; V87-Y129 HydrophobicContact CG1-CE2 4.05Å; V87-Y129 HydrophobicContact CG1-CG 4.38Å; V87-Y129 HydrophobicContact CG2-CE1 4.16Å
88	L	95.8	Very high	94.5	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-46.5	175.4	-70.8	174.8	0	0	0	111.5	V72 I74 L83 H84 A90 Q91 S92 F95 F99 I128	V72-L88 HydrophobicContact CG1-CD1 4.07Å; I74-L88 HydrophobicContact CD1-CD1 3.79Å; L83-L88 HydrophobicContact CB-CD1 3.96Å; L83-L88 HydrophobicContact CD1-CD1 4.12Å; L83-L88 HydrophobicContact CD1-CD2 4.37Å; H84-L88 WeakPolarHBondContact O-CG 3.21Å; H84-L88 PolarHBondContact O-N 3.39Å; L88-A90 VanDerWaalsContact C-N 3.32Å; L88-A90 PolarHBondContact O-N 2.82Å; L88-Q91 PolarHBondContact O-N 2.94Å; L88-S92 WeakPolarHBondContact O-CB 3.5Å; L88-S92 PolarHBondContact O-N 3.32Å; L88-F95 HydrophobicContact CB-CB 3.94Å; L88-F95 HydrophobicContact CB-CD2 4.19Å; L88-F95 HydrophobicContact CB-CG 4.09Å; L88-F95 HydrophobicContact CD2-CD2 4.1Å; L88-F95 HydrophobicContact CD2-CE2 4.23Å; L88-F99 HydrophobicContact CB-CE2 3.93Å; L88-F99 HydrophobicContact CD1-CE2 3.98Å; L88-F99 HydrophobicContact CD1-CZ 3.91Å; L88-I128 HydrophobicContact CD2-CD1 3.8Å; L88-I128 HydrophobicContact CD2-CG2 4.35Å
89	S	95.4	Very high	94.6	Very high	19 Å²	19	48.9 Å²	48.9	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-32.3	178.9	-60.2	0	0	0	0	113.1	R85 V87 Q91 R96 F99	R85-S89 WeakPolarHBondContact O-CB 3.46Å; R85-S89 PolarHBondContact O-N 3.34Å; R85-S89 PolarHBondContact O-OG 3.2Å; V87-S89 PolarHBondContact O-N 3.31Å; S89-Q91 VanDerWaalsContact C-N 3.34Å; S89-R96 VanDerWaalsContact O-CZ 3.23Å; S89-R96 PolarHBondContact O-NE 2.89Å; S89-R96 PolarHBondContact O-NH2 3.44Å; S89-F99 WeakPolarHBondContact OG-CD2 3.36Å
90	A	94	Very high	94.4	Very high	59 Å²	59	49.3 Å²	49.3	49%	0.488	26%	0.259	S	S	.	.	H	α-helix	trans	-65.2	-41	178.8	0	0	0	0	0	111	L86 V87 L88 R96	L86-A90 VanDerWaalsContact O-CB 3.29Å; L86-A90 WeakPolarHBondContact O-CB 3.37Å; L86-A90 PolarHBondContact O-N 2.68Å; V87-A90 PolarHBondContact O-N 3.48Å; L88-A90 VanDerWaalsContact C-N 3.32Å; L88-A90 PolarHBondContact O-N 2.82Å; A90-R96 PolarHBondContact O-NH2 3.44Å
91	Q	94.6	Very high	93.9	Very high	91 Å²	91	45 Å²	45	43%	0.425	24%	0.242	S	C	.	.	H	α-helix	trans	-91.9	-27.3	-176.9	-65.6	-58.2	-31	0	0	114.5	V87 L88 S89 I128 L152	V87-Q91 PolarHBondContact O-N 3.44Å; L88-Q91 PolarHBondContact O-N 2.94Å; S89-Q91 VanDerWaalsContact C-N 3.34Å; Q91-I128 HydrophobicContact CB-CG1 4.25Å; Q91-I128 HydrophobicContact CB-CG2 4.2Å; Q91-I128 HydrophobicContact CG-CG2 4.14Å; Q91-L152 HydrophobicContact CB-CD2 4.25Å
92	S	96.5	Very high	92.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.281	C	S	.	.			trans	-124.1	120.4	-175.1	165	0	0	0	0	111.4	L88 F94 F95 R96 Y150	L88-S92 WeakPolarHBondContact O-CB 3.5Å; L88-S92 PolarHBondContact O-N 3.32Å; S92-F94 PolarHBondContact O-N 3.32Å; S92-F94 PolarHBondContact OG-N 3.46Å; S92-F95 PolarHBondContact O-N 3.36Å; S92-F95 WeakPolarHBondContact OG-CD2 3.41Å; S92-F95 PolarHBondContact OG-N 3.29Å; S92-F95 VanDerWaalsContact OG-N 3.09Å; S92-R96 WeakPolarHBondContact O-CB 3.48Å; S92-R96 PolarHBondContact O-N 3.31Å; S92-Y150 WeakPolarHBondContact CB-O 3.36Å; S92-Y150 PolarHBondContact OG-O 3.27Å
93	C	93.8	Very high	92.1	Very high	45 Å²	45	52.8 Å²	52.8	30%	0.304	29%	0.287	S	S	.	.	H	α-helix	trans	-67.3	-27.7	173.5	-73.1	0	0	0	0	112.3	S97 Q151	C93-S97 VanDerWaalsContact O-CB 3.32Å; C93-S97 WeakPolarHBondContact O-CB 3.44Å; C93-S97 PolarHBondContact O-N 3.28Å; C93-S97 PolarHBondContact O-OG 3.11Å; C93-Q151 HydrophobicContact CB-CB 4Å
94	F	94.5	Very high	90.8	Very high	56 Å²	56	60.3 Å²	60.3	25%	0.246	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-55.3	172	171.2	-90	0	0	0	111.4	S92 R96 S97 M98 Y150 Q151	S92-F94 PolarHBondContact O-N 3.32Å; S92-F94 PolarHBondContact OG-N 3.46Å; F94-R96 VanDerWaalsContact C-N 3.3Å; F94-R96 PolarHBondContact O-N 3.43Å; F94-S97 PolarHBondContact O-N 3.27Å; F94-M98 HydrophobicContact CD1-CE 4.21Å; F94-M98 HydrophobicContact CE1-CE 3.21Å; F94-M98 HydrophobicContact CE2-CE 4.36Å; F94-M98 HydrophobicContact CZ-CE 3.3Å; F94-M98 WeakPolarHBondContact O-CB 3.41Å; F94-M98 PolarHBondContact O-N 2.89Å; F94-Y150 WeakPolarHBondContact CB-O 3.3Å; F94-Y150 AromaticContact CD1-CD1 3.49Å; F94-Y150 HydrophobicContact CD1-CD1 3.49Å; F94-Y150 VanDerWaalsContact CD1-CD1 3.49Å; F94-Y150 HydrophobicContact CD1-CE1 4.11Å; F94-Y150 AromaticContact CE1-CD1 3.5Å; F94-Y150 HydrophobicContact CE1-CD1 3.5Å; F94-Y150 AromaticContact CE1-CE1 3.61Å; F94-Y150 HydrophobicContact CE1-CE1 3.61Å; F94-Y150 HydrophobicContact CG-CD1 4.02Å; F94-Y150 HydrophobicContact CZ-CD1 4.08Å; F94-Y150 AromaticContact CZ-CE1 3.96Å; F94-Y150 HydrophobicContact CZ-CE1 3.96Å; F94-Q151 HydrophobicContact CB-CB 4.43Å; F94-Q151 HydrophobicContact CB-CG 4.34Å
95	F	94.6	Very high	89.7	Confident	2 Å²	2	64 Å²	64	1%	0.009	34%	0.336	C	S	.	.	H	α-helix	trans	-64.9	-37.1	180	-75	-58.9	0	0	0	111.8	I74 L88 S92 S97 M98 F99 L113 F121 Y150	I74-F95 HydrophobicContact CD1-CD1 4.36Å; I74-F95 HydrophobicContact CD1-CE1 3.64Å; I74-F95 HydrophobicContact CD1-CZ 3.99Å; L88-F95 HydrophobicContact CB-CB 3.94Å; L88-F95 HydrophobicContact CB-CD2 4.19Å; L88-F95 HydrophobicContact CB-CG 4.09Å; L88-F95 HydrophobicContact CD2-CD2 4.1Å; L88-F95 HydrophobicContact CD2-CE2 4.23Å; S92-F95 PolarHBondContact O-N 3.36Å; S92-F95 WeakPolarHBondContact OG-CD2 3.41Å; S92-F95 PolarHBondContact OG-N 3.29Å; S92-F95 VanDerWaalsContact OG-N 3.09Å; F95-S97 PolarHBondContact O-N 3.32Å; F95-M98 HydrophobicContact CD1-SD 4.27Å; F95-M98 PolarHBondContact O-N 3.09Å; F95-F99 HydrophobicContact CB-CD2 4.39Å; F95-F99 HydrophobicContact CB-CE2 3.85Å; F95-F99 HydrophobicContact CB-CZ 4.27Å; F95-F99 HydrophobicContact CD1-CE2 4.35Å; F95-F99 AromaticContact CD1-CZ 3.92Å; F95-F99 HydrophobicContact CD1-CZ 3.92Å; F95-F99 HydrophobicContact CG-CE2 4.43Å; F95-F99 HydrophobicContact CG-CZ 4.44Å; F95-F99 WeakPolarHBondContact O-CD2 3.48Å; F95-F99 VanDerWaalsContact O-CG 3.22Å; F95-F99 WeakPolarHBondContact O-CG 3.44Å; F95-F99 PolarHBondContact O-N 3.02Å; F95-L113 HydrophobicContact CE1-CD1 4.42Å; F95-L113 HydrophobicContact CZ-CD1 4.3Å; F95-F121 HydrophobicContact CZ-CE2 4.14Å; F95-Y150 HydrophobicContact CE2-CD1 4.27Å; F95-Y150 HydrophobicContact CZ-CD1 4.12Å; F95-Y150 HydrophobicContact CZ-CE1 4.3Å
96	R	94.6	Very high	88.8	Confident	111 Å²	111	62.6 Å²	62.6	42%	0.419	33%	0.333	S	S	.	.	H	α-helix	trans	-55.2	-53.5	172	-171.6	-178.4	-55.5	167.5	6.3	110.7	S89 A90 S92 F94 M98 F99 T100	S89-R96 VanDerWaalsContact O-CZ 3.23Å; S89-R96 PolarHBondContact O-NE 2.89Å; S89-R96 PolarHBondContact O-NH2 3.44Å; A90-R96 PolarHBondContact O-NH2 3.44Å; S92-R96 WeakPolarHBondContact O-CB 3.48Å; S92-R96 PolarHBondContact O-N 3.31Å; F94-R96 VanDerWaalsContact C-N 3.3Å; F94-R96 PolarHBondContact O-N 3.43Å; R96-M98 VanDerWaalsContact C-N 3.34Å; R96-M98 PolarHBondContact O-N 2.62Å; R96-F99 PolarHBondContact O-N 3.39Å; R96-T100 WeakPolarHBondContact O-CG2 3.09Å; R96-T100 PolarHBondContact O-N 2.97Å; R96-T100 PolarHBondContact O-OG1 3.31Å
97	S	93.2	Very high	88	Confident	70 Å²	70	64.1 Å²	64.1	49%	0.49	34%	0.337	S	S	.	.	H	α-helix	trans	-61.2	-43	-179.8	-59.7	0	0	0	0	111.6	C93 F94 F95 T100 S101	C93-S97 VanDerWaalsContact O-CB 3.32Å; C93-S97 WeakPolarHBondContact O-CB 3.44Å; C93-S97 PolarHBondContact O-N 3.28Å; C93-S97 PolarHBondContact O-OG 3.11Å; F94-S97 PolarHBondContact O-N 3.27Å; F95-S97 PolarHBondContact O-N 3.32Å; S97-T100 PolarHBondContact O-N 2.93Å; S97-S101 VanDerWaalsContact O-CB 3.3Å; S97-S101 WeakPolarHBondContact O-CB 3.4Å; S97-S101 PolarHBondContact O-N 2.86Å
98	M	91.3	Very high	87.4	Confident	31 Å²	31	67.8 Å²	67.8	15%	0.153	36%	0.356	C	S	.	.	H	α-helix	trans	-57.4	-50.4	176.6	-178.1	-174.9	-72	0	0	111.5	F94 F95 R96 S101 E105 A106 I111 L113	F94-M98 HydrophobicContact CD1-CE 4.21Å; F94-M98 HydrophobicContact CE1-CE 3.21Å; F94-M98 HydrophobicContact CE2-CE 4.36Å; F94-M98 HydrophobicContact CZ-CE 3.3Å; F94-M98 WeakPolarHBondContact O-CB 3.41Å; F94-M98 PolarHBondContact O-N 2.89Å; F95-M98 HydrophobicContact CD1-SD 4.27Å; F95-M98 PolarHBondContact O-N 3.09Å; R96-M98 VanDerWaalsContact C-N 3.34Å; R96-M98 PolarHBondContact O-N 2.62Å; M98-S101 PolarHBondContact O-N 3.35Å; M98-S101 PolarHBondContact O-OG 2.83Å; M98-E105 HydrophobicContact CG-CB 4.46Å; M98-A106 WeakPolarHBondContact O-CB 3.2Å; M98-I111 HydrophobicContact SD-CD1 3.93Å; M98-I111 HydrophobicContact SD-CG2 4.09Å; M98-L113 HydrophobicContact CE-CD2 4.4Å
99	F	92.1	Very high	86.9	Confident	24 Å²	24	75.3 Å²	75.3	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-76.4	-22	-175.8	-57.8	-30.7	0	0	0	114.2	V72 R85 L88 S89 F95 R96 I111	V72-F99 HydrophobicContact CG1-CZ 4.35Å; V72-F99 HydrophobicContact CG2-CE1 4.25Å; V72-F99 HydrophobicContact CG2-CZ 4.34Å; R85-F99 HydrophobicContact CB-CD2 3.75Å; R85-F99 HydrophobicContact CB-CE2 3.96Å; R85-F99 HydrophobicContact CB-CG 4.38Å; R85-F99 HydrophobicContact CG-CD1 4.42Å; R85-F99 HydrophobicContact CG-CD2 3.84Å; R85-F99 HydrophobicContact CG-CE1 4.46Å; R85-F99 HydrophobicContact CG-CE2 3.89Å; R85-F99 HydrophobicContact CG-CG 4.13Å; R85-F99 HydrophobicContact CG-CZ 4.2Å; L88-F99 HydrophobicContact CB-CE2 3.93Å; L88-F99 HydrophobicContact CD1-CE2 3.98Å; L88-F99 HydrophobicContact CD1-CZ 3.91Å; S89-F99 WeakPolarHBondContact OG-CD2 3.36Å; F95-F99 HydrophobicContact CB-CD2 4.39Å; F95-F99 HydrophobicContact CB-CE2 3.85Å; F95-F99 HydrophobicContact CB-CZ 4.27Å; F95-F99 HydrophobicContact CD1-CE2 4.35Å; F95-F99 AromaticContact CD1-CZ 3.92Å; F95-F99 HydrophobicContact CD1-CZ 3.92Å; F95-F99 HydrophobicContact CG-CE2 4.43Å; F95-F99 HydrophobicContact CG-CZ 4.44Å; F95-F99 WeakPolarHBondContact O-CD2 3.48Å; F95-F99 VanDerWaalsContact O-CG 3.22Å; F95-F99 WeakPolarHBondContact O-CG 3.44Å; F95-F99 PolarHBondContact O-N 3.02Å; R96-F99 PolarHBondContact O-N 3.39Å; F99-I111 HydrophobicContact CD1-CD1 4.24Å; F99-I111 HydrophobicContact CE1-CD1 3.55Å
100	T	89.8	Confident	86.8	Confident	107 Å²	107	77.8 Å²	77.8	66%	0.656	40%	0.399	S	S	*	.	H	α-helix	trans	-96.2	0.6	175.2	61.5	0	0	0	0	113.6	R96 S97	R96-T100 WeakPolarHBondContact O-CG2 3.09Å; R96-T100 PolarHBondContact O-N 2.97Å; R96-T100 PolarHBondContact O-OG1 3.31Å; S97-T100 PolarHBondContact O-N 2.93Å
101	S	85.5	Confident	86.7	Confident	30 Å²	30	75.4 Å²	75.4	21%	0.21	38%	0.377	C	S	.	.	S	Bend	trans	-76.8	162.1	-179.7	73.1	0	0	0	0	112.5	S97 M98 L103 A106	S97-S101 VanDerWaalsContact O-CB 3.3Å; S97-S101 WeakPolarHBondContact O-CB 3.4Å; S97-S101 PolarHBondContact O-N 2.86Å; M98-S101 PolarHBondContact O-N 3.35Å; M98-S101 PolarHBondContact O-OG 2.83Å; S101-L103 PolarHBondContact O-N 3.35Å; S101-L103 PolarHBondContact OG-N 3.43Å; S101-A106 WeakPolarHBondContact O-CB 3.34Å
102	N	75	Confident	86.6	Confident	165 Å²	165	75.4 Å²	75.4	88%	0.882	38%	0.384	S	S	*	.	S	Bend	trans	-84.6	13.9	172	-68.2	-25.5	0	0	0	112.9
103	L	78	Confident	86.4	Confident	112 Å²	112	76.3 Å²	76.3	59%	0.586	39%	0.388	S	S	*	.	S	Bend	trans	-84.2	166.7	-178.9	-58	176.1	0	0	0	111.1	S101 E105 A106 H107	S101-L103 PolarHBondContact O-N 3.35Å; S101-L103 PolarHBondContact OG-N 3.43Å; L103-E105 VanDerWaalsContact CB-OE2 3.27Å; L103-E105 WeakPolarHBondContact CB-OE2 3.35Å; L103-E105 PolarHBondContact O-N 3.22Å; L103-A106 WeakPolarHBondContact O-CB 3.18Å; L103-A106 PolarHBondContact O-N 2.87Å; L103-H107 PolarHBondContact O-ND1 3.15Å
104	K	68.9	Low	86.2	Confident	167 Å²	167	82.1 Å²	82.1	73%	0.726	41%	0.411	S	S	*	.	H	α-helix	trans	-64.2	-35.3	-176.1	-71.3	-178	178	177.8	0	111.4	A106 H107 N108	K104-A106 PolarHBondContact O-N 3.38Å; K104-H107 PolarHBondContact O-N 2.67Å; K104-H107 VanDerWaalsContact O-N 3.11Å; K104-N108 PolarHBondContact O-N 3.22Å; K104-N108 VanDerWaalsContact O-N 3.11Å
105	E	72.9	Confident	85.8	Confident	91 Å²	91	85.4 Å²	85.4	43%	0.425	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-33.3	180	-63.8	76.7	-171.1	0	0	111.8	M98 L103 H107 N108	M98-E105 HydrophobicContact CG-CB 4.46Å; L103-E105 VanDerWaalsContact CB-OE2 3.27Å; L103-E105 WeakPolarHBondContact CB-OE2 3.35Å; L103-E105 PolarHBondContact O-N 3.22Å; E105-H107 PolarHBondContact O-N 2.92Å; E105-N108 PolarHBondContact O-N 3.44Å
106	A	75	Confident	85.7	Confident	9 Å²	9	85.7 Å²	85.7	7%	0.074	43%	0.433	C	S	.	.	H	α-helix	trans	-61.5	-33.2	177.1	0	0	0	0	0	112.4	R85 M98 S101 L103 K104	R85-A106 PolarHBondContact NH1-O 2.85Å; R85-A106 PolarHBondContact NH2-O 3.26Å; M98-A106 WeakPolarHBondContact O-CB 3.2Å; S101-A106 WeakPolarHBondContact O-CB 3.34Å; L103-A106 WeakPolarHBondContact O-CB 3.18Å; L103-A106 PolarHBondContact O-N 2.87Å; K104-A106 PolarHBondContact O-N 3.38Å
107	H	76.3	Confident	85.6	Confident	149 Å²	149	81.4 Å²	81.4	69%	0.69	42%	0.42	S	S	*	.	H	α-helix	trans	-101.4	-13.3	-174.4	-58.5	85.5	0	0	0	113.3	L103 K104 E105	L103-H107 PolarHBondContact O-ND1 3.15Å; K104-H107 PolarHBondContact O-N 2.67Å; K104-H107 VanDerWaalsContact O-N 3.11Å; E105-H107 PolarHBondContact O-N 2.92Å
108	N	83.3	Confident	85.6	Confident	84 Å²	84	81.2 Å²	81.2	45%	0.449	41%	0.412	S	S	.	.			trans	-76.5	133.1	177.6	-79	-19.5	0	0	0	110.9	R85 K104 E105 V110	R85-N108 PolarHBondContact NH2-O 3.12Å; K104-N108 PolarHBondContact O-N 3.22Å; K104-N108 VanDerWaalsContact O-N 3.11Å; E105-N108 PolarHBondContact O-N 3.44Å; N108-V110 VanDerWaalsContact C-N 3.34Å
109	R	85.8	Confident	85.6	Confident	159 Å²	159	82.8 Å²	82.8	60%	0.6	43%	0.426	S	S	*	.	S	Bend	trans	-70.4	-31.9	173.4	-171.4	173.3	179.4	161.2	3	112.2	T73	T73-R109 PolarHBondContact N-O 3.01Å
110	V	92.3	Very high	85.7	Confident	72 Å²	72	81.7 Å²	81.7	44%	0.436	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127	178.8	-174.6	0	0	0	0	109.6	T73 N108	T73-V110 CarbonylContact O-C 3.55Å; T73-V110 VanDerWaalsContact O-CA 3.32Å; T73-V110 WeakPolarHBondContact O-CA 3.4Å; N108-V110 VanDerWaalsContact C-N 3.34Å
111	I	92.7	Very high	85.9	Confident	8 Å²	8	76.7 Å²	76.7	4%	0.041	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.6	-179.2	-63.1	171.2	0	0	0	108.2	V72 T73 I74 S75 M98 F99 L113	V72-I111 HydrophobicContact CG2-CD1 3.87Å; V72-I111 HydrophobicContact CG2-CG1 4.43Å; T73-I111 PolarHBondContact O-N 3.46Å; I74-I111 CarbonylContact C-O 3.37Å; I74-I111 WeakPolarHBondContact CA-O 3.32Å; S75-I111 PolarHBondContact N-O 2.85Å; M98-I111 HydrophobicContact SD-CD1 3.93Å; M98-I111 HydrophobicContact SD-CG2 4.09Å; F99-I111 HydrophobicContact CD1-CD1 4.24Å; F99-I111 HydrophobicContact CE1-CD1 3.55Å; I111-L113 HydrophobicContact CG2-CD2 4.19Å
112	V	92.7	Very high	86.2	Confident	92 Å²	92	77.5 Å²	77.5	56%	0.558	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.1	-179.7	-175.8	0	0	0	0	108.9	S75	S75-V112 WeakPolarHBondContact O-CA 3.2Å
113	L	92.1	Very high	87.1	Confident	18 Å²	18	70.9 Å²	70.9	9%	0.094	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.4	172.9	-54.4	177	0	0	0	109.2	I74 S75 V76 F95 M98 I111 V116 F121 Y150	I74-L113 HydrophobicContact CG2-CD1 3.56Å; I74-L113 HydrophobicContact CG2-CG 3.81Å; S75-L113 PolarHBondContact O-N 3.21Å; V76-L113 HydrophobicContact CG2-CB 4.21Å; V76-L113 HydrophobicContact CG2-CD1 4.46Å; F95-L113 HydrophobicContact CE1-CD1 4.42Å; F95-L113 HydrophobicContact CZ-CD1 4.3Å; M98-L113 HydrophobicContact CE-CD2 4.4Å; I111-L113 HydrophobicContact CG2-CD2 4.19Å; L113-V116 HydrophobicContact CB-CG1 4.24Å; L113-F121 HydrophobicContact CD1-CD2 4.19Å; L113-F121 HydrophobicContact CD1-CE2 3.63Å; L113-F121 HydrophobicContact CD1-CZ 4.16Å; L113-Y150 HydrophobicContact CD1-CE1 4.24Å
114	Q	89.2	Confident	87.9	Confident	168 Å²	168	65.7 Å²	65.7	79%	0.785	33%	0.328	S	S	*	.			trans	-113.7	-16.4	-176.7	-63.3	-176.2	0.8	0	0	113.3
115	D	86.9	Confident	89.1	Confident	125 Å²	125	58.4 Å²	58.4	67%	0.668	30%	0.297	S	S	*	.	S	Bend	trans	-99.2	20.6	-170.9	-52.7	-60.1	0	0	0	113.5	M149	D115-M149 HydrophobicContact CB-CE 4.23Å; D115-M149 HydrophobicContact CB-SD 4.14Å
116	V	92.6	Very high	90	Very high	8 Å²	8	56.6 Å²	56.6	5%	0.048	29%	0.291	C	S	.	.	S	Bend	trans	-148.5	141.2	179.6	64.2	0	0	0	0	110.6	V76 L113 V120 F121 V146 Y150	V76-V116 HydrophobicContact CG1-CG1 3.93Å; V76-V116 WeakPolarHBondContact CG1-O 3.41Å; V76-V116 HydrophobicContact CG2-CG1 4.3Å; L113-V116 HydrophobicContact CB-CG1 4.24Å; V116-V120 HydrophobicContact CG2-CB 4.13Å; V116-V120 HydrophobicContact CG2-CG1 3.99Å; V116-F121 HydrophobicContact CG1-CB 4.15Å; V116-F121 HydrophobicContact CG1-CD2 3.96Å; V116-F121 HydrophobicContact CG1-CG 4.37Å; V116-F121 HydrophobicContact CG2-CB 4.07Å; V116-V146 HydrophobicContact CB-CG1 4.42Å; V116-V146 HydrophobicContact CG2-CG1 4.01Å; V116-Y150 HydrophobicContact CB-CE2 4.17Å; V116-Y150 HydrophobicContact CG1-CE2 4.28Å; V116-Y150 WeakPolarHBondContact CG1-OH 3.29Å; V116-Y150 HydrophobicContact CG2-CE2 4.32Å
117	S	91.9	Very high	90.9	Very high	21 Å²	21	57.8 Å²	57.8	15%	0.147	29%	0.293	C	S	.	.			trans	-72.6	153.5	173.4	64	0	0	0	0	112.1	S119 V120 F121 E142	S117-S119 VanDerWaalsContact C-N 3.26Å; S117-S119 PolarHBondContact O-N 2.93Å; S117-S119 PolarHBondContact OG-OG 3.32Å; S117-V120 PolarHBondContact O-N 3.45Å; S117-V120 WeakPolarHBondContact OG-CB 3.28Å; S117-V120 WeakPolarHBondContact OG-CG2 3.34Å; S117-V120 PolarHBondContact OG-N 3.09Å; S117-F121 WeakPolarHBondContact O-CB 3.14Å; S117-F121 PolarHBondContact O-N 2.94Å; S117-E142 WeakPolarHBondContact CB-OE1 3.36Å; S117-E142 PolarHBondContact OG-OE1 3.4Å
118	E	94	Very high	91.8	Very high	66 Å²	66	51.1 Å²	51.1	31%	0.308	26%	0.262	S	S	.	.	H	α-helix	trans	-54.7	-43.8	175.7	-172.9	-159.4	130.4	0	0	112.1	E77 R79 F81 F121 Q122	E77-E118 PolarHBondContact OE2-N 3.48Å; R79-E118 HydrophobicContact CB-CG 3.88Å; R79-E118 WeakPolarHBondContact CD-OE1 3.3Å; R79-E118 HydrophobicContact CG-CG 4.3Å; R79-E118 IonicContact CZ-OE1 3.53Å; R79-E118 IonicContact NE-OE1 3.6Å; R79-E118 IonicContact NH1-OE1 2.71Å; R79-E118 PolarHBondContact NH1-OE1 3.26Å; F81-E118 HydrophobicContact CZ-CG 4.25Å; E118-F121 PolarHBondContact O-N 3.24Å; E118-Q122 PolarHBondContact O-N 3.45Å
119	S	91.4	Very high	92.3	Very high	64 Å²	64	47.9 Å²	47.9	45%	0.448	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-45.6	-178.5	41	0	0	0	0	112.4	S117 Q122 L123	S117-S119 VanDerWaalsContact C-N 3.26Å; S117-S119 PolarHBondContact O-N 2.93Å; S117-S119 PolarHBondContact OG-OG 3.32Å; S119-Q122 PolarHBondContact O-N 2.84Å; S119-L123 PolarHBondContact O-N 3.4Å
120	V	92.3	Very high	92.5	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-72.1	-37.9	179.8	170.6	0	0	0	0	110.9	V116 S117 Q122 L123 L124 E142 I143 V146	V116-V120 HydrophobicContact CG2-CB 4.13Å; V116-V120 HydrophobicContact CG2-CG1 3.99Å; S117-V120 PolarHBondContact O-N 3.45Å; S117-V120 WeakPolarHBondContact OG-CB 3.28Å; S117-V120 WeakPolarHBondContact OG-CG2 3.34Å; S117-V120 PolarHBondContact OG-N 3.09Å; V120-Q122 VanDerWaalsContact C-N 3.3Å; V120-Q122 PolarHBondContact O-N 3.41Å; V120-L123 WeakPolarHBondContact O-CB 3.4Å; V120-L123 PolarHBondContact O-N 3.38Å; V120-L123 VanDerWaalsContact O-N 3.09Å; V120-L124 PolarHBondContact O-N 3.47Å; V120-E142 HydrophobicContact CB-CG 4.42Å; V120-E142 HydrophobicContact CG1-CG 4.32Å; V120-E142 HydrophobicContact CG2-CB 4.19Å; V120-E142 HydrophobicContact CG2-CG 3.85Å; V120-E142 WeakPolarHBondContact CG2-OE1 3.15Å; V120-E142 WeakPolarHBondContact CG2-OE2 3.2Å; V120-I143 HydrophobicContact CG1-CG1 4.18Å; V120-I143 HydrophobicContact CG2-CG1 4.47Å; V120-V146 HydrophobicContact CG1-CB 4.46Å; V120-V146 HydrophobicContact CG1-CG1 4.32Å; V120-V146 HydrophobicContact CG1-CG2 3.43Å; V120-V146 VanDerWaalsContact CG1-CG2 3.43Å
121	F	94.5	Very high	92.4	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-38.7	175.8	-167.9	-103.7	0	0	0	112.3	I74 V76 F81 L83 F95 L113 V116 S117 E118 L123 L124 V125	I74-F121 HydrophobicContact CB-CE1 4.12Å; I74-F121 HydrophobicContact CB-CZ 4.01Å; I74-F121 HydrophobicContact CD1-CZ 3.8Å; I74-F121 HydrophobicContact CG1-CZ 4.49Å; I74-F121 HydrophobicContact CG2-CE1 3.79Å; I74-F121 HydrophobicContact CG2-CE2 4.26Å; I74-F121 HydrophobicContact CG2-CZ 3.54Å; V76-F121 HydrophobicContact CG1-CB 4.32Å; V76-F121 HydrophobicContact CG2-CB 4.11Å; V76-F121 HydrophobicContact CG2-CD1 3.65Å; V76-F121 HydrophobicContact CG2-CD2 4.16Å; V76-F121 HydrophobicContact CG2-CE1 4.1Å; V76-F121 HydrophobicContact CG2-CG 3.68Å; F81-F121 HydrophobicContact CB-CE1 4.24Å; F81-F121 HydrophobicContact CD1-CD1 4.24Å; F81-F121 HydrophobicContact CD1-CE1 4.31Å; F81-F121 AromaticContact CD2-CD1 3.77Å; F81-F121 HydrophobicContact CD2-CD1 3.77Å; F81-F121 AromaticContact CD2-CE1 3.84Å; F81-F121 HydrophobicContact CD2-CE1 3.84Å; F81-F121 HydrophobicContact CE1-CD1 4.15Å; F81-F121 AromaticContact CE2-CD1 3.7Å; F81-F121 HydrophobicContact CE2-CD1 3.7Å; F81-F121 HydrophobicContact CE2-CE1 4.26Å; F81-F121 HydrophobicContact CG-CD1 4.06Å; F81-F121 AromaticContact CG-CE1 3.88Å; F81-F121 HydrophobicContact CG-CE1 3.88Å; F81-F121 AromaticContact CZ-CD1 3.89Å; F81-F121 HydrophobicContact CZ-CD1 3.89Å; L83-F121 HydrophobicContact CD1-CE1 4.24Å; L83-F121 HydrophobicContact CD1-CZ 4.29Å; F95-F121 HydrophobicContact CZ-CE2 4.14Å; L113-F121 HydrophobicContact CD1-CD2 4.19Å; L113-F121 HydrophobicContact CD1-CE2 3.63Å; L113-F121 HydrophobicContact CD1-CZ 4.16Å; V116-F121 HydrophobicContact CG1-CB 4.15Å; V116-F121 HydrophobicContact CG1-CD2 3.96Å; V116-F121 HydrophobicContact CG1-CG 4.37Å; V116-F121 HydrophobicContact CG2-CB 4.07Å; S117-F121 WeakPolarHBondContact O-CB 3.14Å; S117-F121 PolarHBondContact O-N 2.94Å; E118-F121 PolarHBondContact O-N 3.24Å; F121-L123 VanDerWaalsContact C-N 3.33Å; F121-L123 PolarHBondContact O-N 2.88Å; F121-L124 WeakPolarHBondContact O-CB 3.22Å; F121-L124 PolarHBondContact O-N 3.34Å; F121-V125 HydrophobicContact CD1-CG2 4.07Å; F121-V125 HydrophobicContact CE1-CG2 3.7Å; F121-V125 HydrophobicContact CZ-CG2 4.14Å; F121-V125 WeakPolarHBondContact O-CG2 3.41Å; F121-V125 PolarHBondContact O-N 3.29Å
122	Q	93.3	Very high	92.2	Very high	47 Å²	47	48.8 Å²	48.8	22%	0.22	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-43.3	172.3	-178.9	67.9	70.7	0	0	111.7	F81 E118 S119 V120 L124 V125 D126	F81-Q122 HydrophobicContact CE1-CB 4.32Å; E118-Q122 PolarHBondContact O-N 3.45Å; S119-Q122 PolarHBondContact O-N 2.84Å; V120-Q122 VanDerWaalsContact C-N 3.3Å; V120-Q122 PolarHBondContact O-N 3.41Å; Q122-L124 VanDerWaalsContact C-N 3.3Å; Q122-L124 PolarHBondContact O-N 2.86Å; Q122-V125 PolarHBondContact O-N 3.35Å; Q122-D126 PolarHBondContact NE2-OD1 3.04Å; Q122-D126 WeakPolarHBondContact O-CB 3.19Å; Q122-D126 PolarHBondContact O-N 2.79Å
123	L	93.1	Very high	92	Very high	26 Å²	26	46.3 Å²	46.3	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-36.2	177	-67.1	174	0	0	0	112.4	S119 V120 F121 D126 Y127 V133 I143	S119-L123 PolarHBondContact O-N 3.4Å; V120-L123 WeakPolarHBondContact O-CB 3.4Å; V120-L123 PolarHBondContact O-N 3.38Å; V120-L123 VanDerWaalsContact O-N 3.09Å; F121-L123 VanDerWaalsContact C-N 3.33Å; F121-L123 PolarHBondContact O-N 2.88Å; L123-D126 PolarHBondContact O-N 2.83Å; L123-Y127 WeakPolarHBondContact O-CB 3.43Å; L123-Y127 PolarHBondContact O-N 3.26Å; L123-V133 HydrophobicContact CB-CG2 4.11Å; L123-V133 HydrophobicContact CD2-CG2 4.21Å; L123-I143 HydrophobicContact CD1-CD1 3.65Å; L123-I143 HydrophobicContact CD1-CG1 4.36Å
124	L	94.1	Very high	91.7	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-66	-43.2	173.8	-63.8	-173.2	0	0	0	111.8	V120 F121 Q122 D126 Y127 I128 V146 Y150 L152 L155	V120-L124 PolarHBondContact O-N 3.47Å; F121-L124 WeakPolarHBondContact O-CB 3.22Å; F121-L124 PolarHBondContact O-N 3.34Å; Q122-L124 VanDerWaalsContact C-N 3.3Å; Q122-L124 PolarHBondContact O-N 2.86Å; L124-D126 VanDerWaalsContact C-N 3.34Å; L124-Y127 PolarHBondContact O-N 3.06Å; L124-I128 WeakPolarHBondContact O-CB 3.44Å; L124-I128 WeakPolarHBondContact O-CG1 3.34Å; L124-I128 PolarHBondContact O-N 2.75Å; L124-V146 HydrophobicContact CD1-CB 4.32Å; L124-V146 HydrophobicContact CD1-CG2 3.86Å; L124-V146 HydrophobicContact CD2-CG2 4.05Å; L124-V146 HydrophobicContact CG-CG2 4.24Å; L124-Y150 HydrophobicContact CD1-CD2 3.36Å; L124-Y150 HydrophobicContact CD1-CE2 3.77Å; L124-Y150 HydrophobicContact CD1-CG 4.35Å; L124-L152 HydrophobicContact CB-CD1 4.41Å; L124-L152 HydrophobicContact CD1-CD1 4.35Å; L124-L152 HydrophobicContact CD2-CD1 3.73Å; L124-L152 HydrophobicContact CG-CD1 4.39Å; L124-L155 HydrophobicContact CD2-CD2 3.63Å
125	V	93.9	Very high	91.3	Very high	13 Å²	13	48.6 Å²	48.6	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-45.9	175.2	171.8	0	0	0	0	110.1	F81 L83 F121 Q122 Y127 I128 Y129	F81-V125 HydrophobicContact CD1-CG2 4.34Å; L83-V125 HydrophobicContact CD1-CG2 4.09Å; L83-V125 HydrophobicContact CD2-CG1 3.79Å; L83-V125 HydrophobicContact CD2-CG2 4.18Å; F121-V125 HydrophobicContact CD1-CG2 4.07Å; F121-V125 HydrophobicContact CE1-CG2 3.7Å; F121-V125 HydrophobicContact CZ-CG2 4.14Å; F121-V125 WeakPolarHBondContact O-CG2 3.41Å; F121-V125 PolarHBondContact O-N 3.29Å; Q122-V125 PolarHBondContact O-N 3.35Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.41Å; V125-I128 PolarHBondContact O-N 3.21Å; V125-Y129 HydrophobicContact CG1-CD2 4.06Å; V125-Y129 HydrophobicContact CG1-CE2 4.34Å; V125-Y129 WeakPolarHBondContact O-CD2 3.48Å; V125-Y129 PolarHBondContact O-N 2.86Å
126	D	92.3	Very high	91	Very high	54 Å²	54	49.7 Å²	49.7	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-44.8	177.9	-68.5	-9.6	0	0	0	110.9	Q122 L123 L124 H130	Q122-D126 PolarHBondContact NE2-OD1 3.04Å; Q122-D126 WeakPolarHBondContact O-CB 3.19Å; Q122-D126 PolarHBondContact O-N 2.79Å; L123-D126 PolarHBondContact O-N 2.83Å; L124-D126 VanDerWaalsContact C-N 3.34Å; D126-H130 WeakPolarHBondContact O-CA 3.35Å; D126-H130 WeakPolarHBondContact O-CB 3.02Å; D126-H130 PolarHBondContact O-N 2.81Å; D126-H130 PolarHBondContact O-ND1 3.32Å; D126-H130 VanDerWaalsContact O-ND1 3.1Å
127	Y	95	Very high	90.3	Very high	34 Å²	34	53.5 Å²	53.5	13%	0.133	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-49	174.3	171.7	-104.6	0	0	0	112.6	L123 L124 V125 Y129 G131 V133 L152 S154 L155	L123-Y127 WeakPolarHBondContact O-CB 3.43Å; L123-Y127 PolarHBondContact O-N 3.26Å; L124-Y127 PolarHBondContact O-N 3.06Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.41Å; Y127-Y129 VanDerWaalsContact C-N 3.27Å; Y127-Y129 PolarHBondContact O-N 3.11Å; Y127-G131 WeakPolarHBondContact O-CA 3.42Å; Y127-G131 PolarHBondContact O-N 3.4Å; Y127-V133 HydrophobicContact CD2-CG1 4.46Å; Y127-L152 HydrophobicContact CD1-CD1 4.41Å; Y127-L152 HydrophobicContact CD1-CD2 4.49Å; Y127-L152 HydrophobicContact CE1-CB 4.44Å; Y127-L152 HydrophobicContact CE1-CD2 4.24Å; Y127-S154 WeakPolarHBondContact OH-CB 3.46Å; Y127-L155 HydrophobicContact CD1-CB 4.19Å; Y127-L155 HydrophobicContact CD1-CD2 3.93Å; Y127-L155 HydrophobicContact CD2-CD1 4.45Å; Y127-L155 HydrophobicContact CE1-CB 3.8Å; Y127-L155 HydrophobicContact CE1-CD2 4.38Å; Y127-L155 HydrophobicContact CE2-CB 4.23Å; Y127-L155 HydrophobicContact CG-CD2 4.09Å
128	I	94.8	Very high	89.9	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-38	-176.2	-73.9	167.6	0	0	0	111.6	V87 L88 Q91 L124 V125 L152	V87-I128 HydrophobicContact CG1-CG2 3.82Å; L88-I128 HydrophobicContact CD2-CD1 3.8Å; L88-I128 HydrophobicContact CD2-CG2 4.35Å; Q91-I128 HydrophobicContact CB-CG1 4.25Å; Q91-I128 HydrophobicContact CB-CG2 4.2Å; Q91-I128 HydrophobicContact CG-CG2 4.14Å; L124-I128 WeakPolarHBondContact O-CB 3.44Å; L124-I128 WeakPolarHBondContact O-CG1 3.34Å; L124-I128 PolarHBondContact O-N 2.75Å; V125-I128 PolarHBondContact O-N 3.21Å; I128-L152 HydrophobicContact CD1-CD1 4.37Å; I128-L152 HydrophobicContact CD1-CD2 4.11Å; I128-L152 HydrophobicContact CG1-CD1 4.5Å; I128-L152 HydrophobicContact CG1-CD2 3.9Å
129	Y	93.3	Very high	89.3	Confident	16 Å²	16	59.4 Å²	59.4	6%	0.063	32%	0.317	C	S	.	.	H	α-helix	trans	-95.2	-35	-175	-78.3	-97.5	0	0	0	114.1	M60 C63 L64 L83 H84 V87 V125 Y127	M60-Y129 HydrophobicContact SD-CD1 4.33Å; C63-Y129 HydrophobicContact CB-CD1 4.28Å; C63-Y129 HydrophobicContact CB-CE1 3.89Å; L64-Y129 HydrophobicContact CD2-CD1 3.79Å; L64-Y129 HydrophobicContact CD2-CG 4.09Å; L64-Y129 HydrophobicContact CG-CD1 4.1Å; L83-Y129 HydrophobicContact CD2-CE2 3.83Å; H84-Y129 PolarHBondContact N-OH 3.41Å; H84-Y129 AromaticContact ND1-CE1 3.59Å; H84-Y129 AromaticContact ND1-CZ 3.68Å; H84-Y129 PolarHBondContact ND1-OH 3.03Å; V87-Y129 HydrophobicContact CB-CE1 4.1Å; V87-Y129 HydrophobicContact CG1-CD1 4.08Å; V87-Y129 HydrophobicContact CG1-CD2 4.36Å; V87-Y129 HydrophobicContact CG1-CE1 3.74Å; V87-Y129 HydrophobicContact CG1-CE2 4.05Å; V87-Y129 HydrophobicContact CG1-CG 4.38Å; V87-Y129 HydrophobicContact CG2-CE1 4.16Å; V125-Y129 HydrophobicContact CG1-CD2 4.06Å; V125-Y129 HydrophobicContact CG1-CE2 4.34Å; V125-Y129 WeakPolarHBondContact O-CD2 3.48Å; V125-Y129 PolarHBondContact O-N 2.86Å; Y127-Y129 VanDerWaalsContact C-N 3.27Å; Y127-Y129 PolarHBondContact O-N 3.11Å
130	H	91.1	Very high	89.1	Confident	107 Å²	107	56.7 Å²	56.7	50%	0.495	30%	0.298	S	S	.	.	H	α-helix	trans	-103.3	-16	-175.6	-54	84.1	0	0	0	112.8	D126 T132	D126-H130 WeakPolarHBondContact O-CA 3.35Å; D126-H130 WeakPolarHBondContact O-CB 3.02Å; D126-H130 PolarHBondContact O-N 2.81Å; D126-H130 PolarHBondContact O-ND1 3.32Å; D126-H130 VanDerWaalsContact O-ND1 3.1Å; H130-T132 PolarHBondContact O-N 2.59Å
131	G	89.8	Confident	89.1	Confident	54 Å²	54	60.2 Å²	60.2	56%	0.557	32%	0.315	S	S	*	.	S	Bend	trans	71.5	11.2	-175.8	0	0	0	0	0	113.9	Y127	Y127-G131 WeakPolarHBondContact O-CA 3.42Å; Y127-G131 PolarHBondContact O-N 3.4Å
132	T	87.4	Confident	88.9	Confident	98 Å²	98	63.7 Å²	63.7	60%	0.601	33%	0.331	S	S	*	.			trans	-132.4	137.9	-177.4	61.7	0	0	0	0	110.9	H130	H130-T132 PolarHBondContact O-N 2.59Å
133	V	88.3	Confident	88.9	Confident	40 Å²	40	61.5 Å²	61.5	24%	0.242	32%	0.32	C	S	.	.			trans	-137.4	141.4	173.8	64.2	0	0	0	0	109.4	L123 Y127 L135 L155	L123-V133 HydrophobicContact CB-CG2 4.11Å; L123-V133 HydrophobicContact CD2-CG2 4.21Å; Y127-V133 HydrophobicContact CD2-CG1 4.46Å; V133-L135 HydrophobicContact CG1-CD2 3.88Å; V133-L135 HydrophobicContact CG1-CG 4.07Å; V133-L135 HydrophobicContact CG2-CD2 3.96Å; V133-L155 HydrophobicContact CG1-CD1 3.68Å
134	K	85.8	Confident	89	Confident	183 Å²	183	60.2 Å²	60.2	80%	0.796	31%	0.314	S	S	*	.			trans	-98.9	100	174.1	-71.4	-178.3	-179.2	175.2	0	108.8
135	L	81.3	Confident	89	Confident	50 Å²	50	62.1 Å²	62.1	26%	0.262	32%	0.322	S	S	.	.			trans	-79.3	121.9	179.8	-57.4	175.9	0	0	0	110.2	V133 L140 I143	V133-L135 HydrophobicContact CG1-CD2 3.88Å; V133-L135 HydrophobicContact CG1-CG 4.07Å; V133-L135 HydrophobicContact CG2-CD2 3.96Å; L135-L140 HydrophobicContact CB-CD1 4.49Å; L135-L140 HydrophobicContact CD1-CD1 4.19Å; L135-I143 HydrophobicContact CD2-CB 4.44Å; L135-I143 HydrophobicContact CD2-CD1 3.54Å; L135-I143 HydrophobicContact CD2-CG2 3.89Å
136	R	81.5	Confident	89	Confident	148 Å²	148	61.7 Å²	61.7	56%	0.558	32%	0.32	S	S	*	.			trans	-99.4	150.2	168.4	-66.4	-178.9	-73.4	-161.8	-2.4	109.3	E138 E139 L140	R136-E138 PolarHBondContact O-N 3.31Å; R136-E139 IonicContact CZ-OE1 3.58Å; R136-E139 IonicContact CZ-OE2 3.26Å; R136-E139 VanDerWaalsContact CZ-OE2 3.26Å; R136-E139 IonicContact NE-OE1 3.8Å; R136-E139 IonicContact NE-OE2 2.72Å; R136-E139 PolarHBondContact NE-OE2 2.95Å; R136-E139 IonicContact NH2-OE1 2.64Å; R136-E139 PolarHBondContact NH2-OE1 2.91Å; R136-E139 IonicContact NH2-OE2 3Å; R136-E139 PolarHBondContact NH2-OE2 2.99Å; R136-E139 PolarHBondContact O-N 3.44Å; R136-E139 VanDerWaalsContact O-N 3.15Å; R136-L140 PolarHBondContact O-N 2.76Å; R136-L140 VanDerWaalsContact O-N 3.12Å
137	A	78	Confident	89.2	Confident	89 Å²	89	59.1 Å²	59.1	74%	0.736	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-36	-179.7	0	0	0	0	0	112.8	E139	A137-E139 VanDerWaalsContact C-N 3.34Å; A137-E139 PolarHBondContact O-N 3.32Å
138	E	82.1	Confident	89.2	Confident	187 Å²	187	60.5 Å²	60.5	87%	0.874	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-30	-179.1	-63.4	167.6	-159.4	0	0	113.4	R136	R136-E138 PolarHBondContact O-N 3.31Å
139	E	82.8	Confident	89.1	Confident	23 Å²	23	64.1 Å²	64.1	11%	0.107	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.2	-175.6	-62.7	172.2	136.1	0	0	112.5	R136 A137 Q141 E142 I143	R136-E139 IonicContact CZ-OE1 3.58Å; R136-E139 IonicContact CZ-OE2 3.26Å; R136-E139 VanDerWaalsContact CZ-OE2 3.26Å; R136-E139 IonicContact NE-OE1 3.8Å; R136-E139 IonicContact NE-OE2 2.72Å; R136-E139 PolarHBondContact NE-OE2 2.95Å; R136-E139 IonicContact NH2-OE1 2.64Å; R136-E139 PolarHBondContact NH2-OE1 2.91Å; R136-E139 IonicContact NH2-OE2 3Å; R136-E139 PolarHBondContact NH2-OE2 2.99Å; R136-E139 PolarHBondContact O-N 3.44Å; R136-E139 VanDerWaalsContact O-N 3.15Å; A137-E139 VanDerWaalsContact C-N 3.34Å; A137-E139 PolarHBondContact O-N 3.32Å; E139-Q141 VanDerWaalsContact C-N 3.33Å; E139-Q141 PolarHBondContact O-N 3.44Å; E139-E142 PolarHBondContact O-N 3.4Å; E139-I143 HydrophobicContact CB-CD1 3.89Å; E139-I143 HydrophobicContact CB-CG1 4.41Å; E139-I143 VanDerWaalsContact O-CG1 3.28Å; E139-I143 WeakPolarHBondContact O-CG1 3.12Å; E139-I143 PolarHBondContact O-N 3.01Å
140	L	87.6	Confident	89.2	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-40.6	-169.9	-179.6	66.1	0	0	0	112.6	L135 R136 Y144 C159 F162 L163	L135-L140 HydrophobicContact CB-CD1 4.49Å; L135-L140 HydrophobicContact CD1-CD1 4.19Å; R136-L140 PolarHBondContact O-N 2.76Å; R136-L140 VanDerWaalsContact O-N 3.12Å; L140-Y144 VanDerWaalsContact O-CB 3.26Å; L140-Y144 WeakPolarHBondContact O-CB 3.27Å; L140-Y144 PolarHBondContact O-N 3.21Å; L140-C159 HydrophobicContact CD1-CB 4.19Å; L140-F162 HydrophobicContact CD1-CD1 4.24Å; L140-F162 HydrophobicContact CD2-CD1 3.4Å; L140-F162 HydrophobicContact CD2-CE1 3.77Å; L140-F162 HydrophobicContact CD2-CG 4.5Å; L140-F162 HydrophobicContact CG-CD1 4.47Å; L140-L163 HydrophobicContact CD2-CD2 3.43Å; L140-L163 VanDerWaalsContact CD2-CD2 3.43Å; L140-L163 HydrophobicContact CD2-CG 3.79Å; L140-L163 HydrophobicContact CG-CD2 3.94Å; L140-L163 HydrophobicContact CG-CG 4.1Å
141	Q	90.6	Very high	89.4	Confident	75 Å²	75	62.8 Å²	62.8	35%	0.35	33%	0.328	S	S	.	.	H	α-helix	trans	-62.7	-51.6	177.1	-179	179.8	-25.1	0	0	110.3	E139 I143 Y144 E145 L178	E139-Q141 VanDerWaalsContact C-N 3.33Å; E139-Q141 PolarHBondContact O-N 3.44Å; Q141-I143 VanDerWaalsContact C-N 3.35Å; Q141-I143 PolarHBondContact O-N 3.49Å; Q141-Y144 WeakPolarHBondContact O-CB 3.47Å; Q141-Y144 PolarHBondContact O-N 2.94Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.45Å; Q141-E145 PolarHBondContact NE2-OE1 2.83Å; Q141-E145 WeakPolarHBondContact O-CG 3.45Å; Q141-E145 PolarHBondContact O-N 2.92Å; Q141-L178 HydrophobicContact CG-CD1 4.28Å; Q141-L178 HydrophobicContact CG-CD2 4Å
142	E	91.4	Very high	89.7	Confident	75 Å²	75	60.3 Å²	60.3	35%	0.35	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-44.4	-178.7	-165.7	-179.6	163.6	0	0	111.1	S117 V120 E139 Y144 E145 V146	S117-E142 WeakPolarHBondContact CB-OE1 3.36Å; S117-E142 PolarHBondContact OG-OE1 3.4Å; V120-E142 HydrophobicContact CB-CG 4.42Å; V120-E142 HydrophobicContact CG1-CG 4.32Å; V120-E142 HydrophobicContact CG2-CB 4.19Å; V120-E142 HydrophobicContact CG2-CG 3.85Å; V120-E142 WeakPolarHBondContact CG2-OE1 3.15Å; V120-E142 WeakPolarHBondContact CG2-OE2 3.2Å; E139-E142 PolarHBondContact O-N 3.4Å; E142-Y144 PolarHBondContact O-N 3.44Å; E142-E145 PolarHBondContact O-N 3.02Å; E142-V146 WeakPolarHBondContact O-CG1 3.39Å; E142-V146 WeakPolarHBondContact O-CG2 3.41Å; E142-V146 PolarHBondContact O-N 3.29Å
143	I	93.6	Very high	90	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.9	-43.2	176.9	-64.6	168.2	0	0	0	111.4	V120 L123 L135 E139 Q141 V146 S147 L155	V120-I143 HydrophobicContact CG1-CG1 4.18Å; V120-I143 HydrophobicContact CG2-CG1 4.47Å; L123-I143 HydrophobicContact CD1-CD1 3.65Å; L123-I143 HydrophobicContact CD1-CG1 4.36Å; L135-I143 HydrophobicContact CD2-CB 4.44Å; L135-I143 HydrophobicContact CD2-CD1 3.54Å; L135-I143 HydrophobicContact CD2-CG2 3.89Å; E139-I143 HydrophobicContact CB-CD1 3.89Å; E139-I143 HydrophobicContact CB-CG1 4.41Å; E139-I143 VanDerWaalsContact O-CG1 3.28Å; E139-I143 WeakPolarHBondContact O-CG1 3.12Å; E139-I143 PolarHBondContact O-N 3.01Å; Q141-I143 VanDerWaalsContact C-N 3.35Å; Q141-I143 PolarHBondContact O-N 3.49Å; I143-V146 WeakPolarHBondContact O-CG2 3.36Å; I143-S147 WeakPolarHBondContact O-CB 3.5Å; I143-S147 PolarHBondContact O-N 3.23Å; I143-S147 PolarHBondContact O-OG 3.1Å; I143-S147 VanDerWaalsContact O-OG 3.06Å; I143-L155 HydrophobicContact CG2-CD1 4.34Å; I143-L155 HydrophobicContact CG2-CD2 4.16Å; I143-L155 HydrophobicContact CG2-CG 4.32Å
144	Y	94.7	Very high	90.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.8	-51.2	175.1	175.3	-96.8	0	0	0	110.7	L140 Q141 E142 V146 S147 D148 F156 C159 L163 L178 H182 D184 L187	L140-Y144 VanDerWaalsContact O-CB 3.26Å; L140-Y144 WeakPolarHBondContact O-CB 3.27Å; L140-Y144 PolarHBondContact O-N 3.21Å; Q141-Y144 WeakPolarHBondContact O-CB 3.47Å; Q141-Y144 PolarHBondContact O-N 2.94Å; E142-Y144 PolarHBondContact O-N 3.44Å; Y144-V146 PolarHBondContact O-N 3.18Å; Y144-S147 PolarHBondContact O-N 2.73Å; Y144-S147 PolarHBondContact O-OG 3.03Å; Y144-D148 PolarHBondContact O-N 3.38Å; Y144-F156 HydrophobicContact CD1-CE2 4.44Å; Y144-F156 AromaticContact CD2-CD2 3.95Å; Y144-F156 HydrophobicContact CD2-CD2 3.95Å; Y144-F156 AromaticContact CD2-CE2 3.85Å; Y144-F156 HydrophobicContact CD2-CE2 3.85Å; Y144-F156 AromaticContact CE1-CE2 3.94Å; Y144-F156 HydrophobicContact CE1-CE2 3.94Å; Y144-F156 AromaticContact CE2-CD2 3.79Å; Y144-F156 HydrophobicContact CE2-CD2 3.79Å; Y144-F156 AromaticContact CE2-CE2 3.27Å; Y144-F156 HydrophobicContact CE2-CE2 3.27Å; Y144-F156 AromaticContact CE2-CZ 3.74Å; Y144-F156 HydrophobicContact CE2-CZ 3.74Å; Y144-F156 HydrophobicContact CG-CE2 4.41Å; Y144-F156 AromaticContact CZ-CE2 3.34Å; Y144-F156 AromaticContact CZ-CZ 3.72Å; Y144-F156 WeakPolarHBondContact OH-CZ 3.48Å; Y144-C159 HydrophobicContact CD2-CB 3.84Å; Y144-C159 HydrophobicContact CG-CB 4.45Å; Y144-L163 HydrophobicContact CD1-CD1 4.37Å; Y144-L163 HydrophobicContact CD2-CD1 3.79Å; Y144-L163 HydrophobicContact CE2-CD1 4.21Å; Y144-L163 HydrophobicContact CG-CD1 3.86Å; Y144-L178 HydrophobicContact CD1-CD1 4.14Å; Y144-L178 HydrophobicContact CD1-CD2 3.77Å; Y144-L178 HydrophobicContact CD1-CG 3.88Å; Y144-L178 HydrophobicContact CE1-CD1 4.24Å; Y144-L178 HydrophobicContact CE1-CD2 4.01Å; Y144-L178 HydrophobicContact CE1-CG 3.73Å; Y144-H182 HydrophobicContact CE1-CB 3.81Å; Y144-H182 AromaticContact CE1-CD2 3.6Å; Y144-H182 AromaticContact CE1-CG 3.68Å; Y144-D184 WeakPolarHBondContact OH-CB 3.49Å; Y144-D184 PolarHBondContact OH-OD2 3.24Å; Y144-L187 HydrophobicContact CE2-CD2 4.22Å
145	E	94.1	Very high	90.7	Very high	42 Å²	42	52.7 Å²	52.7	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-46.8	-179.1	-62.5	-172.9	-157.7	0	0	112.6	Q141 E142 S147 D148 M149 L178 R181 H182	Q141-E145 WeakPolarHBondContact CG-OE1 3.45Å; Q141-E145 PolarHBondContact NE2-OE1 2.83Å; Q141-E145 WeakPolarHBondContact O-CG 3.45Å; Q141-E145 PolarHBondContact O-N 2.92Å; E142-E145 PolarHBondContact O-N 3.02Å; E145-S147 VanDerWaalsContact C-N 3.34Å; E145-D148 PolarHBondContact O-N 3.35Å; E145-M149 WeakPolarHBondContact O-CB 3.5Å; E145-M149 PolarHBondContact O-N 2.64Å; E145-L178 HydrophobicContact CG-CD1 3.91Å; E145-R181 IonicContact OE1-CZ 2.84Å; E145-R181 IonicContact OE1-NH2 3.7Å; E145-R181 PolarHBondContact OE1-NH2 3.42Å; E145-R181 IonicContact OE2-CZ 3.91Å; E145-R181 IonicContact OE2-NH1 3.41Å; E145-R181 PolarHBondContact OE2-NH1 3.49Å; E145-R181 IonicContact OE2-NH2 2.71Å; E145-R181 PolarHBondContact OE2-NH2 2.9Å; E145-H182 WeakPolarHBondContact CG-NE2 3.4Å
146	V	94.2	Very high	91.4	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-73.6	-28	-178.6	-59	0	0	0	0	112.4	V116 V120 L124 E142 I143 Y144 D148 M149 Y150	V116-V146 HydrophobicContact CB-CG1 4.42Å; V116-V146 HydrophobicContact CG2-CG1 4.01Å; V120-V146 HydrophobicContact CG1-CB 4.46Å; V120-V146 HydrophobicContact CG1-CG1 4.32Å; V120-V146 HydrophobicContact CG1-CG2 3.43Å; V120-V146 VanDerWaalsContact CG1-CG2 3.43Å; L124-V146 HydrophobicContact CD1-CB 4.32Å; L124-V146 HydrophobicContact CD1-CG2 3.86Å; L124-V146 HydrophobicContact CD2-CG2 4.05Å; L124-V146 HydrophobicContact CG-CG2 4.24Å; E142-V146 WeakPolarHBondContact O-CG1 3.39Å; E142-V146 WeakPolarHBondContact O-CG2 3.41Å; E142-V146 PolarHBondContact O-N 3.29Å; I143-V146 WeakPolarHBondContact O-CG2 3.36Å; Y144-V146 PolarHBondContact O-N 3.18Å; V146-D148 VanDerWaalsContact C-N 3.32Å; V146-M149 PolarHBondContact O-N 2.95Å; V146-Y150 HydrophobicContact CB-CD2 3.96Å; V146-Y150 HydrophobicContact CB-CE2 4.03Å; V146-Y150 WeakPolarHBondContact O-CB 3.32Å; V146-Y150 WeakPolarHBondContact O-CD2 3.4Å; V146-Y150 PolarHBondContact O-N 2.91Å
147	S	95.2	Very high	91.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-35.4	176.4	69.1	0	0	0	0	111.6	I143 Y144 E145 Q151 L152 F156	I143-S147 WeakPolarHBondContact O-CB 3.5Å; I143-S147 PolarHBondContact O-N 3.23Å; I143-S147 PolarHBondContact O-OG 3.1Å; I143-S147 VanDerWaalsContact O-OG 3.06Å; Y144-S147 PolarHBondContact O-N 2.73Å; Y144-S147 PolarHBondContact O-OG 3.03Å; E145-S147 VanDerWaalsContact C-N 3.34Å; S147-Q151 PolarHBondContact O-N 2.97Å; S147-Q151 VanDerWaalsContact O-N 3.11Å; S147-L152 PolarHBondContact O-N 2.91Å; S147-F156 WeakPolarHBondContact OG-CA 3.33Å; S147-F156 WeakPolarHBondContact OG-CB 3.26Å
148	D	95.5	Very high	92.5	Very high	62 Å²	62	48.7 Å²	48.7	33%	0.332	25%	0.245	S	C	.	.	H	α-helix	trans	-68.6	-50.6	169.8	-175.9	38.2	0	0	0	111.1	Y144 E145 V146 Y150 Q151 F156 H182	Y144-D148 PolarHBondContact O-N 3.38Å; E145-D148 PolarHBondContact O-N 3.35Å; V146-D148 VanDerWaalsContact C-N 3.32Å; D148-Y150 VanDerWaalsContact C-N 3.33Å; D148-Y150 PolarHBondContact O-N 3.34Å; D148-Q151 WeakPolarHBondContact O-CA 3.5Å; D148-Q151 PolarHBondContact O-N 3.4Å; D148-F156 HydrophobicContact CB-CD2 3.65Å; D148-F156 HydrophobicContact CB-CE2 3.7Å; D148-H182 IonicContact OD2-CE1 3.12Å; D148-H182 IonicContact OD2-CG 2.73Å; D148-H182 IonicContact OD2-ND1 3.96Å; D148-H182 PolarHBondContact OD2-ND1 3.34Å
149	M	94.1	Very high	93.1	Very high	85 Å²	85	39.8 Å²	39.8	42%	0.419	20%	0.203	S	C	.	.	H	α-helix	trans	-55.1	-46.6	-179.8	-174	-171.1	-66	0	0	112.5	D115 E145 V146 Q151	D115-M149 HydrophobicContact CB-CE 4.23Å; D115-M149 HydrophobicContact CB-SD 4.14Å; E145-M149 WeakPolarHBondContact O-CB 3.5Å; E145-M149 PolarHBondContact O-N 2.64Å; V146-M149 PolarHBondContact O-N 2.95Å; M149-Q151 VanDerWaalsContact C-N 3.27Å; M149-Q151 PolarHBondContact O-N 2.97Å
150	Y	95.1	Very high	93.5	Very high	4 Å²	4	39 Å²	39	2%	0.016	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6	177.8	-63.4	-56.4	0	0	0	113.3	S92 F94 F95 L113 V116 L124 V146 D148 L152	S92-Y150 WeakPolarHBondContact CB-O 3.36Å; S92-Y150 PolarHBondContact OG-O 3.27Å; F94-Y150 WeakPolarHBondContact CB-O 3.3Å; F94-Y150 AromaticContact CD1-CD1 3.49Å; F94-Y150 HydrophobicContact CD1-CD1 3.49Å; F94-Y150 VanDerWaalsContact CD1-CD1 3.49Å; F94-Y150 HydrophobicContact CD1-CE1 4.11Å; F94-Y150 AromaticContact CE1-CD1 3.5Å; F94-Y150 HydrophobicContact CE1-CD1 3.5Å; F94-Y150 AromaticContact CE1-CE1 3.61Å; F94-Y150 HydrophobicContact CE1-CE1 3.61Å; F94-Y150 HydrophobicContact CG-CD1 4.02Å; F94-Y150 HydrophobicContact CZ-CD1 4.08Å; F94-Y150 AromaticContact CZ-CE1 3.96Å; F94-Y150 HydrophobicContact CZ-CE1 3.96Å; F95-Y150 HydrophobicContact CE2-CD1 4.27Å; F95-Y150 HydrophobicContact CZ-CD1 4.12Å; F95-Y150 HydrophobicContact CZ-CE1 4.3Å; L113-Y150 HydrophobicContact CD1-CE1 4.24Å; V116-Y150 HydrophobicContact CB-CE2 4.17Å; V116-Y150 HydrophobicContact CG1-CE2 4.28Å; V116-Y150 WeakPolarHBondContact CG1-OH 3.29Å; V116-Y150 HydrophobicContact CG2-CE2 4.32Å; L124-Y150 HydrophobicContact CD1-CD2 3.36Å; L124-Y150 HydrophobicContact CD1-CE2 3.77Å; L124-Y150 HydrophobicContact CD1-CG 4.35Å; V146-Y150 HydrophobicContact CB-CD2 3.96Å; V146-Y150 HydrophobicContact CB-CE2 4.03Å; V146-Y150 WeakPolarHBondContact O-CB 3.32Å; V146-Y150 WeakPolarHBondContact O-CD2 3.4Å; V146-Y150 PolarHBondContact O-N 2.91Å; D148-Y150 VanDerWaalsContact C-N 3.33Å; D148-Y150 PolarHBondContact O-N 3.34Å; Y150-L152 VanDerWaalsContact C-N 3.31Å; Y150-L152 PolarHBondContact O-N 3.31Å
151	Q	95.6	Very high	93.5	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.421	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	45.3	175.3	-56.2	178.9	14.8	0	0	113.1	C93 F94 S147 D148 M149 T153	C93-Q151 HydrophobicContact CB-CB 4Å; F94-Q151 HydrophobicContact CB-CB 4.43Å; F94-Q151 HydrophobicContact CB-CG 4.34Å; S147-Q151 PolarHBondContact O-N 2.97Å; S147-Q151 VanDerWaalsContact O-N 3.11Å; D148-Q151 WeakPolarHBondContact O-CA 3.5Å; D148-Q151 PolarHBondContact O-N 3.4Å; M149-Q151 VanDerWaalsContact C-N 3.27Å; M149-Q151 PolarHBondContact O-N 2.97Å; Q151-T153 PolarHBondContact O-N 3.2Å
152	L	96	Very high	93.4	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	22%	0.216	C	C	.	.			trans	-92.6	71.2	172.2	-67.6	169.3	0	0	0	109.1	Q91 L124 Y127 I128 S147 Y150 S154 L155 F156	Q91-L152 HydrophobicContact CB-CD2 4.25Å; L124-L152 HydrophobicContact CB-CD1 4.41Å; L124-L152 HydrophobicContact CD1-CD1 4.35Å; L124-L152 HydrophobicContact CD2-CD1 3.73Å; L124-L152 HydrophobicContact CG-CD1 4.39Å; Y127-L152 HydrophobicContact CD1-CD1 4.41Å; Y127-L152 HydrophobicContact CD1-CD2 4.49Å; Y127-L152 HydrophobicContact CE1-CB 4.44Å; Y127-L152 HydrophobicContact CE1-CD2 4.24Å; I128-L152 HydrophobicContact CD1-CD1 4.37Å; I128-L152 HydrophobicContact CD1-CD2 4.11Å; I128-L152 HydrophobicContact CG1-CD1 4.5Å; I128-L152 HydrophobicContact CG1-CD2 3.9Å; S147-L152 PolarHBondContact O-N 2.91Å; Y150-L152 VanDerWaalsContact C-N 3.31Å; Y150-L152 PolarHBondContact O-N 3.31Å; L152-S154 PolarHBondContact O-N 3.37Å; L152-L155 HydrophobicContact CB-CB 4.19Å; L152-L155 HydrophobicContact CD1-CD2 4.33Å; L152-L155 WeakPolarHBondContact O-CB 3.47Å; L152-L155 PolarHBondContact O-N 2.91Å; L152-F156 PolarHBondContact O-N 3Å
153	T	93.4	Very high	93.3	Very high	80 Å²	80	40.7 Å²	40.7	49%	0.491	20%	0.203	S	C	.	.	H	α-helix	trans	-51	-47.7	-167.3	-51.5	0	0	0	0	114.2	Q151 L155 F156 E157	Q151-T153 PolarHBondContact O-N 3.2Å; T153-L155 VanDerWaalsContact C-N 3.3Å; T153-L155 PolarHBondContact O-N 3.2Å; T153-F156 WeakPolarHBondContact O-CB 3.45Å; T153-F156 PolarHBondContact O-N 3.26Å; T153-E157 HydrophobicContact CG2-CG 4.39Å; T153-E157 WeakPolarHBondContact CG2-OE1 3.34Å; T153-E157 WeakPolarHBondContact O-CG 3.46Å; T153-E157 PolarHBondContact O-N 3.21Å
154	S	93.7	Very high	92.9	Very high	77 Å²	77	42.4 Å²	42.4	54%	0.538	22%	0.217	S	C	.	.	H	α-helix	trans	-67.7	-29.7	-178.2	-55.3	0	0	0	0	113.4	Y127 L152 E158	Y127-S154 WeakPolarHBondContact OH-CB 3.46Å; L152-S154 PolarHBondContact O-N 3.37Å; S154-E158 PolarHBondContact O-N 3.26Å
155	L	94.7	Very high	92.4	Very high	5 Å²	5	51.2 Å²	51.2	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-73.6	-42.7	174.1	177.6	58.7	0	0	0	110.8	L124 Y127 V133 I143 L152 T153 E158 C159	L124-L155 HydrophobicContact CD2-CD2 3.63Å; Y127-L155 HydrophobicContact CD1-CB 4.19Å; Y127-L155 HydrophobicContact CD1-CD2 3.93Å; Y127-L155 HydrophobicContact CD2-CD1 4.45Å; Y127-L155 HydrophobicContact CE1-CB 3.8Å; Y127-L155 HydrophobicContact CE1-CD2 4.38Å; Y127-L155 HydrophobicContact CE2-CB 4.23Å; Y127-L155 HydrophobicContact CG-CD2 4.09Å; V133-L155 HydrophobicContact CG1-CD1 3.68Å; I143-L155 HydrophobicContact CG2-CD1 4.34Å; I143-L155 HydrophobicContact CG2-CD2 4.16Å; I143-L155 HydrophobicContact CG2-CG 4.32Å; L152-L155 HydrophobicContact CB-CB 4.19Å; L152-L155 HydrophobicContact CD1-CD2 4.33Å; L152-L155 WeakPolarHBondContact O-CB 3.47Å; L152-L155 PolarHBondContact O-N 2.91Å; T153-L155 VanDerWaalsContact C-N 3.3Å; T153-L155 PolarHBondContact O-N 3.2Å; L155-E158 PolarHBondContact O-N 3.48Å; L155-C159 PolarHBondContact O-N 3.31Å; L155-C159 PolarHBondContact O-SG 3.36Å
156	F	94.9	Very high	92	Very high	30 Å²	30	51.8 Å²	51.8	13%	0.132	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-49.7	175	174.8	-99.6	0	0	0	111.8	Y144 S147 D148 L152 T153 E158 C159 S160 H182 D184	Y144-F156 HydrophobicContact CD1-CE2 4.44Å; Y144-F156 AromaticContact CD2-CD2 3.95Å; Y144-F156 HydrophobicContact CD2-CD2 3.95Å; Y144-F156 AromaticContact CD2-CE2 3.85Å; Y144-F156 HydrophobicContact CD2-CE2 3.85Å; Y144-F156 AromaticContact CE1-CE2 3.94Å; Y144-F156 HydrophobicContact CE1-CE2 3.94Å; Y144-F156 AromaticContact CE2-CD2 3.79Å; Y144-F156 HydrophobicContact CE2-CD2 3.79Å; Y144-F156 AromaticContact CE2-CE2 3.27Å; Y144-F156 HydrophobicContact CE2-CE2 3.27Å; Y144-F156 AromaticContact CE2-CZ 3.74Å; Y144-F156 HydrophobicContact CE2-CZ 3.74Å; Y144-F156 HydrophobicContact CG-CE2 4.41Å; Y144-F156 AromaticContact CZ-CE2 3.34Å; Y144-F156 AromaticContact CZ-CZ 3.72Å; Y144-F156 WeakPolarHBondContact OH-CZ 3.48Å; S147-F156 WeakPolarHBondContact OG-CA 3.33Å; S147-F156 WeakPolarHBondContact OG-CB 3.26Å; D148-F156 HydrophobicContact CB-CD2 3.65Å; D148-F156 HydrophobicContact CB-CE2 3.7Å; L152-F156 PolarHBondContact O-N 3Å; T153-F156 WeakPolarHBondContact O-CB 3.45Å; T153-F156 PolarHBondContact O-N 3.26Å; F156-E158 VanDerWaalsContact C-N 3.32Å; F156-E158 PolarHBondContact O-N 2.83Å; F156-C159 PolarHBondContact O-N 3.35Å; F156-S160 WeakPolarHBondContact O-CB 3.49Å; F156-S160 PolarHBondContact O-N 2.84Å; F156-H182 HydrophobicContact CE2-CB 4.21Å; F156-H182 HydrophobicContact CZ-CB 4.3Å; F156-D184 HydrophobicContact CZ-CB 4.2Å
157	E	92.4	Very high	91.6	Very high	93 Å²	93	53 Å²	53	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-38.3	178.2	-73.5	173.7	-179.2	0	0	112.6	T153 R161	T153-E157 HydrophobicContact CG2-CG 4.39Å; T153-E157 WeakPolarHBondContact CG2-OE1 3.34Å; T153-E157 WeakPolarHBondContact O-CG 3.46Å; T153-E157 PolarHBondContact O-N 3.21Å; E157-R161 WeakPolarHBondContact O-CB 3.38Å; E157-R161 PolarHBondContact O-N 3.01Å
158	E	91.5	Very high	91.3	Very high	80 Å²	80	58.9 Å²	58.9	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-70.1	-40.2	176.5	-172.2	59.8	-153.5	0	0	111.7	S154 L155 F156 R161 F162	S154-E158 PolarHBondContact O-N 3.26Å; L155-E158 PolarHBondContact O-N 3.48Å; F156-E158 VanDerWaalsContact C-N 3.32Å; F156-E158 PolarHBondContact O-N 2.83Å; E158-R161 PolarHBondContact O-N 3.23Å; E158-R161 IonicContact OE2-CZ 3.4Å; E158-R161 IonicContact OE2-NH1 2.81Å; E158-R161 PolarHBondContact OE2-NH1 2.87Å; E158-F162 WeakPolarHBondContact O-CB 3.47Å; E158-F162 PolarHBondContact O-N 2.78Å
159	C	93.5	Very high	91.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-44.2	174.8	-65.3	0	0	0	0	111.3	L140 Y144 L155 F156 R161 F162 L163	L140-C159 HydrophobicContact CD1-CB 4.19Å; Y144-C159 HydrophobicContact CD2-CB 3.84Å; Y144-C159 HydrophobicContact CG-CB 4.45Å; L155-C159 PolarHBondContact O-N 3.31Å; L155-C159 PolarHBondContact O-SG 3.36Å; F156-C159 PolarHBondContact O-N 3.35Å; C159-R161 PolarHBondContact O-N 3.24Å; C159-F162 PolarHBondContact O-N 3.28Å; C159-L163 WeakPolarHBondContact O-CB 3.44Å; C159-L163 WeakPolarHBondContact O-CG 3.44Å; C159-L163 PolarHBondContact O-N 3.36Å
160	S	91.6	Very high	91	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-54.9	-51.8	173.5	177.6	0	0	0	0	111.5	F156 F162 L163 A164 D184	F156-S160 WeakPolarHBondContact O-CB 3.49Å; F156-S160 PolarHBondContact O-N 2.84Å; S160-F162 VanDerWaalsContact C-N 3.3Å; S160-F162 PolarHBondContact O-N 2.94Å; S160-L163 PolarHBondContact O-N 3.5Å; S160-A164 WeakPolarHBondContact O-CB 3.39Å; S160-A164 PolarHBondContact O-N 3.01Å; S160-D184 WeakPolarHBondContact CB-OD2 3.38Å; S160-D184 PolarHBondContact OG-OD1 2.68Å; S160-D184 PolarHBondContact OG-OD2 3.34Å
161	R	88.4	Confident	90.9	Very high	100 Å²	100	58.6 Å²	58.6	38%	0.377	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-38.5	179.3	-172.3	-179.3	-61.4	112.4	10.8	112.5	E157 E158 C159 R165	E157-R161 WeakPolarHBondContact O-CB 3.38Å; E157-R161 PolarHBondContact O-N 3.01Å; E158-R161 PolarHBondContact O-N 3.23Å; E158-R161 IonicContact OE2-CZ 3.4Å; E158-R161 IonicContact OE2-NH1 2.81Å; E158-R161 PolarHBondContact OE2-NH1 2.87Å; C159-R161 PolarHBondContact O-N 3.24Å; R161-R165 WeakPolarHBondContact O-CG 3.41Å; R161-R165 PolarHBondContact O-N 3.2Å
162	F	87.9	Confident	90.9	Very high	81 Å²	81	54.3 Å²	54.3	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-68.7	-47.4	176.3	-170.8	-83.1	0	0	0	111.2	L140 E158 C159 S160 A164 R165 T166	L140-F162 HydrophobicContact CD1-CD1 4.24Å; L140-F162 HydrophobicContact CD2-CD1 3.4Å; L140-F162 HydrophobicContact CD2-CE1 3.77Å; L140-F162 HydrophobicContact CD2-CG 4.5Å; L140-F162 HydrophobicContact CG-CD1 4.47Å; E158-F162 WeakPolarHBondContact O-CB 3.47Å; E158-F162 PolarHBondContact O-N 2.78Å; C159-F162 PolarHBondContact O-N 3.28Å; S160-F162 VanDerWaalsContact C-N 3.3Å; S160-F162 PolarHBondContact O-N 2.94Å; F162-A164 VanDerWaalsContact C-N 3.29Å; F162-A164 PolarHBondContact O-N 3.26Å; F162-R165 PolarHBondContact O-N 3.31Å; F162-R165 VanDerWaalsContact O-N 3.12Å; F162-T166 HydrophobicContact CD1-CG2 4.08Å; F162-T166 HydrophobicContact CE1-CG2 3.75Å; F162-T166 HydrophobicContact CZ-CG2 4.32Å; F162-T166 WeakPolarHBondContact O-CG2 3.48Å; F162-T166 PolarHBondContact O-N 3.12Å; F162-T166 PolarHBondContact O-OG1 2.81Å
163	L	90.4	Very high	90.9	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-55.1	-46	175.8	-76.4	168.4	0	0	0	111.1	L140 Y144 C159 S160 R165 T166 V167 L178 L187	L140-L163 HydrophobicContact CD2-CD2 3.43Å; L140-L163 VanDerWaalsContact CD2-CD2 3.43Å; L140-L163 HydrophobicContact CD2-CG 3.79Å; L140-L163 HydrophobicContact CG-CD2 3.94Å; L140-L163 HydrophobicContact CG-CG 4.1Å; Y144-L163 HydrophobicContact CD1-CD1 4.37Å; Y144-L163 HydrophobicContact CD2-CD1 3.79Å; Y144-L163 HydrophobicContact CE2-CD1 4.21Å; Y144-L163 HydrophobicContact CG-CD1 3.86Å; C159-L163 WeakPolarHBondContact O-CB 3.44Å; C159-L163 WeakPolarHBondContact O-CG 3.44Å; C159-L163 PolarHBondContact O-N 3.36Å; S160-L163 PolarHBondContact O-N 3.5Å; L163-R165 VanDerWaalsContact C-N 3.27Å; L163-R165 PolarHBondContact O-N 2.97Å; L163-T166 WeakPolarHBondContact CA-OG1 3.44Å; L163-T166 CarbonylContact O-C 3.57Å; L163-T166 WeakPolarHBondContact O-CA 3.32Å; L163-T166 PolarHBondContact O-N 3.42Å; L163-T166 PolarHBondContact O-OG1 3.36Å; L163-V167 PolarHBondContact O-N 3.37Å; L163-L178 HydrophobicContact CD1-CD2 4.12Å; L163-L187 HydrophobicContact CB-CD1 3.67Å; L163-L187 HydrophobicContact CB-CD2 3.97Å; L163-L187 HydrophobicContact CB-CG 4.49Å; L163-L187 HydrophobicContact CD1-CD2 3.85Å
164	A	85.1	Confident	90.9	Very high	35 Å²	35	55.6 Å²	55.6	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-57.3	-37.5	178.9	0	0	0	0	0	112.9	S160 F162 T166 L187 A190	S160-A164 WeakPolarHBondContact O-CB 3.39Å; S160-A164 PolarHBondContact O-N 3.01Å; F162-A164 VanDerWaalsContact C-N 3.29Å; F162-A164 PolarHBondContact O-N 3.26Å; A164-T166 VanDerWaalsContact C-N 3.26Å; A164-T166 PolarHBondContact O-N 2.92Å; A164-L187 HydrophobicContact CB-CD1 3.84Å; A164-L187 VanDerWaalsContact N-CD1 3.31Å; A164-A190 HydrophobicContact CB-CB 4.44Å
165	R	83.9	Confident	90.9	Very high	186 Å²	186	52.3 Å²	52.3	70%	0.702	27%	0.268	S	S	*	.	H	α-helix	trans	-72.6	-18.1	176.5	-69.7	172.3	179.4	168.8	2.1	113.7	R161 F162 L163	R161-R165 WeakPolarHBondContact O-CG 3.41Å; R161-R165 PolarHBondContact O-N 3.2Å; F162-R165 PolarHBondContact O-N 3.31Å; F162-R165 VanDerWaalsContact O-N 3.12Å; L163-R165 VanDerWaalsContact C-N 3.27Å; L163-R165 PolarHBondContact O-N 2.97Å
166	T	84.5	Confident	90.9	Very high	53 Å²	53	52.1 Å²	52.1	33%	0.325	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	4.8	-177.8	63.1	0	0	0	0	113.5	F162 L163 A164 Q168 N171	F162-T166 HydrophobicContact CD1-CG2 4.08Å; F162-T166 HydrophobicContact CE1-CG2 3.75Å; F162-T166 HydrophobicContact CZ-CG2 4.32Å; F162-T166 WeakPolarHBondContact O-CG2 3.48Å; F162-T166 PolarHBondContact O-N 3.12Å; F162-T166 PolarHBondContact O-OG1 2.81Å; L163-T166 WeakPolarHBondContact CA-OG1 3.44Å; L163-T166 CarbonylContact O-C 3.57Å; L163-T166 WeakPolarHBondContact O-CA 3.32Å; L163-T166 PolarHBondContact O-N 3.42Å; L163-T166 PolarHBondContact O-OG1 3.36Å; A164-T166 VanDerWaalsContact C-N 3.26Å; A164-T166 PolarHBondContact O-N 2.92Å; T166-Q168 PolarHBondContact O-N 2.9Å; T166-N171 PolarHBondContact O-ND2 2.58Å
167	V	86.3	Confident	90.9	Very high	31 Å²	31	56.9 Å²	56.9	19%	0.188	28%	0.284	C	S	.	.			trans	-62.4	124.3	174.8	173.7	0	0	0	0	109.6	L163 C172 V175 L187 A191 C194	L163-V167 PolarHBondContact O-N 3.37Å; V167-C172 HydrophobicContact CG1-CB 3.89Å; V167-V175 HydrophobicContact CG2-CG1 4.03Å; V167-L187 HydrophobicContact CG2-CD1 4.49Å; V167-A191 HydrophobicContact CG2-CB 4.45Å; V167-C194 HydrophobicContact CG1-CB 3.56Å
168	Q	89.5	Confident	91	Very high	124 Å²	124	52.8 Å²	52.8	58%	0.579	27%	0.265	S	S	*	.			trans	-145	167.5	177.8	56.2	179.6	-8.9	0	0	109.4	T166 G170 N171 C172	T166-Q168 PolarHBondContact O-N 2.9Å; Q168-G170 PolarHBondContact O-N 3.12Å; Q168-G170 VanDerWaalsContact O-N 3.11Å; Q168-N171 WeakPolarHBondContact CG-OD1 3.14Å; Q168-N171 PolarHBondContact N-OD1 2.89Å; Q168-N171 PolarHBondContact O-N 3.11Å; Q168-N171 PolarHBondContact O-OD1 2.8Å; Q168-C172 WeakPolarHBondContact O-CB 3.5Å; Q168-C172 PolarHBondContact O-N 3.02Å
169	V	91	Very high	91.2	Very high	37 Å²	37	49 Å²	49	22%	0.224	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-39.9	-177.5	-174.3	0	0	0	0	112	N171 H198 Q201 L202	V169-N171 VanDerWaalsContact C-N 3.3Å; V169-N171 PolarHBondContact O-N 2.9Å; V169-H198 HydrophobicContact CG1-CB 4.15Å; V169-H198 HydrophobicContact CG2-CB 3.84Å; V169-Q201 HydrophobicContact CG1-CB 4.13Å; V169-L202 HydrophobicContact CG1-CD2 3.82Å; V169-L202 HydrophobicContact CG1-CG 4.26Å; V169-L202 WeakPolarHBondContact O-CD2 3.46Å
170	G	91.8	Very high	91.2	Very high	74 Å²	74	51.8 Å²	51.8	76%	0.763	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-13.8	-178	0	0	0	0	0	116	Q168	Q168-G170 PolarHBondContact O-N 3.12Å; Q168-G170 VanDerWaalsContact O-N 3.11Å
171	N	92.5	Very high	91.3	Very high	33 Å²	33	57.1 Å²	57.1	18%	0.176	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-6.2	-178.5	70	1.5	0	0	0	114.3	T166 Q168 V169 L173 Q174 V175	T166-N171 PolarHBondContact O-ND2 2.58Å; Q168-N171 WeakPolarHBondContact CG-OD1 3.14Å; Q168-N171 PolarHBondContact N-OD1 2.89Å; Q168-N171 PolarHBondContact O-N 3.11Å; Q168-N171 PolarHBondContact O-OD1 2.8Å; V169-N171 VanDerWaalsContact C-N 3.3Å; V169-N171 PolarHBondContact O-N 2.9Å; N171-L173 VanDerWaalsContact C-N 3.31Å; N171-L173 PolarHBondContact O-N 3.3Å; N171-Q174 PolarHBondContact O-N 3.32Å; N171-V175 HydrophobicContact CB-CG2 4.39Å; N171-V175 WeakPolarHBondContact O-CG2 3.34Å; N171-V175 PolarHBondContact O-N 3.41Å
172	C	95.2	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-36.9	-170.2	63	0	0	0	0	113.1	V167 Q168 M176 C194	V167-C172 HydrophobicContact CG1-CB 3.89Å; Q168-C172 WeakPolarHBondContact O-CB 3.5Å; Q168-C172 PolarHBondContact O-N 3.02Å; C172-M176 WeakPolarHBondContact O-CB 3.33Å; C172-M176 PolarHBondContact O-N 2.85Å; C172-C194 HydrophobicContact CB-CB 3.82Å
173	L	95.9	Very high	91.9	Very high	8 Å²	8	54.7 Å²	54.7	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-68.7	-42.3	178.9	-63.8	178.5	0	0	0	112.2	N171 M176 W177 A195 L202 E207 F208 L211 I219	N171-L173 VanDerWaalsContact C-N 3.31Å; N171-L173 PolarHBondContact O-N 3.3Å; L173-M176 PolarHBondContact O-N 2.95Å; L173-W177 WeakPolarHBondContact O-CB 3.34Å; L173-W177 PolarHBondContact O-N 2.87Å; L173-A195 HydrophobicContact CD2-CB 3.84Å; L173-L202 HydrophobicContact CD1-CB 4.31Å; L173-L202 HydrophobicContact CD1-CD1 4.31Å; L173-L202 HydrophobicContact CD1-CD2 4.09Å; L173-L202 HydrophobicContact CD1-CG 4.47Å; L173-L202 HydrophobicContact CD2-CD1 4.19Å; L173-L202 HydrophobicContact CG-CD1 4.15Å; L173-L202 HydrophobicContact CG-CD2 4.36Å; L173-E207 HydrophobicContact CB-CB 4.4Å; L173-E207 HydrophobicContact CD1-CB 4.1Å; L173-F208 HydrophobicContact CD1-CB 3.7Å; L173-F208 HydrophobicContact CD1-CD2 4.15Å; L173-F208 HydrophobicContact CD1-CG 4.45Å; L173-L211 HydrophobicContact CD2-CD1 4.44Å; L173-I219 HydrophobicContact CD2-CD1 4.29Å
174	Q	93.3	Very high	92.2	Very high	101 Å²	101	54.6 Å²	54.6	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-43	176.9	-173.5	178.4	4.6	0	0	111.2	N171 W177 L178	N171-Q174 PolarHBondContact O-N 3.32Å; Q174-W177 PolarHBondContact O-N 2.94Å; Q174-L178 WeakPolarHBondContact O-CB 3.37Å; Q174-L178 PolarHBondContact O-N 3.02Å
175	V	94.5	Very high	92.4	Very high	9 Å²	9	57.1 Å²	57.1	6%	0.055	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-40	176.4	175.4	0	0	0	0	111.2	V167 N171 L178 A179 L187 A191	V167-V175 HydrophobicContact CG2-CG1 4.03Å; N171-V175 HydrophobicContact CB-CG2 4.39Å; N171-V175 WeakPolarHBondContact O-CG2 3.34Å; N171-V175 PolarHBondContact O-N 3.41Å; V175-L178 PolarHBondContact O-N 3.32Å; V175-A179 WeakPolarHBondContact O-CB 3.1Å; V175-A179 PolarHBondContact O-N 3.39Å; V175-L187 HydrophobicContact CG1-CD1 3.54Å; V175-L187 HydrophobicContact CG1-CD2 4.02Å; V175-L187 HydrophobicContact CG1-CG 3.73Å; V175-A191 HydrophobicContact CB-CB 4.3Å; V175-A191 HydrophobicContact CG1-CB 4.05Å
176	M	95.7	Very high	92.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-44.7	175.8	-174.6	-178.6	160.5	0	0	111.3	C172 L173 A179 D180 Y188 A191 K192 L215 I219	C172-M176 WeakPolarHBondContact O-CB 3.33Å; C172-M176 PolarHBondContact O-N 2.85Å; L173-M176 PolarHBondContact O-N 2.95Å; M176-A179 PolarHBondContact O-N 3.19Å; M176-D180 PolarHBondContact O-N 3.17Å; M176-Y188 HydrophobicContact CE-CE1 4.35Å; M176-Y188 HydrophobicContact CE-CE2 3.67Å; M176-Y188 VanDerWaalsContact CE-OH 3.23Å; M176-Y188 WeakPolarHBondContact CE-OH 3.49Å; M176-Y188 HydrophobicContact CG-CD2 3.8Å; M176-Y188 HydrophobicContact CG-CE2 3.58Å; M176-Y188 WeakPolarHBondContact O-CD2 3.35Å; M176-A191 HydrophobicContact CB-CB 3.65Å; M176-A191 HydrophobicContact CG-CB 4.39Å; M176-K192 HydrophobicContact CE-CB 4.35Å; M176-K192 HydrophobicContact CE-CG 4.38Å; M176-K192 HydrophobicContact SD-CB 4.11Å; M176-L215 HydrophobicContact CE-CB 3.89Å; M176-L215 HydrophobicContact CE-CD2 4.06Å; M176-L215 HydrophobicContact CE-CG 4.43Å; M176-I219 HydrophobicContact CE-CD1 4.1Å; M176-I219 HydrophobicContact CE-CG1 3.81Å; M176-I219 HydrophobicContact SD-CD1 3.98Å; M176-I219 HydrophobicContact SD-CG1 4.04Å
177	W	94	Very high	92.8	Very high	131 Å²	131	52.9 Å²	52.9	50%	0.496	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-39.2	176	-179.1	48.8	0	0	0	112.5	L173 Q174 D180 R181 L215	L173-W177 WeakPolarHBondContact O-CB 3.34Å; L173-W177 PolarHBondContact O-N 2.87Å; Q174-W177 PolarHBondContact O-N 2.94Å; W177-D180 PolarHBondContact O-N 2.91Å; W177-R181 PolarHBondContact O-N 3.38Å; W177-R181 VanDerWaalsContact O-N 3.17Å; W177-L215 HydrophobicContact CB-CD1 4.23Å
178	L	93.7	Very high	93.2	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.037	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-47.5	174.1	-175.5	65.9	0	0	0	111.1	Q141 Y144 E145 L163 Q174 V175 D180 R181 H182	Q141-L178 HydrophobicContact CG-CD1 4.28Å; Q141-L178 HydrophobicContact CG-CD2 4Å; Y144-L178 HydrophobicContact CD1-CD1 4.14Å; Y144-L178 HydrophobicContact CD1-CD2 3.77Å; Y144-L178 HydrophobicContact CD1-CG 3.88Å; Y144-L178 HydrophobicContact CE1-CD1 4.24Å; Y144-L178 HydrophobicContact CE1-CD2 4.01Å; Y144-L178 HydrophobicContact CE1-CG 3.73Å; E145-L178 HydrophobicContact CG-CD1 3.91Å; L163-L178 HydrophobicContact CD1-CD2 4.12Å; Q174-L178 WeakPolarHBondContact O-CB 3.37Å; Q174-L178 PolarHBondContact O-N 3.02Å; V175-L178 PolarHBondContact O-N 3.32Å; L178-D180 PolarHBondContact O-N 3.48Å; L178-R181 PolarHBondContact O-N 3.2Å; L178-H182 PolarHBondContact O-CD2 3.45Å; L178-H182 VanDerWaalsContact O-CD2 3.28Å; L178-H182 PolarHBondContact O-N 3.32Å; L178-H182 VanDerWaalsContact O-N 3.17Å
179	A	95.9	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.8	-37.7	179.4	0	0	0	0	0	113	V175 M176 H182 S183 D184 L187 Y188	V175-A179 WeakPolarHBondContact O-CB 3.1Å; V175-A179 PolarHBondContact O-N 3.39Å; M176-A179 PolarHBondContact O-N 3.19Å; A179-H182 CarbonylContact O-C 3.53Å; A179-H182 PolarHBondContact O-N 2.96Å; A179-S183 PolarHBondContact O-N 3.24Å; A179-D184 HydrophobicContact CB-CB 4.29Å; A179-D184 PolarHBondContact O-N 3.35Å; A179-L187 HydrophobicContact CB-CB 3.93Å; A179-L187 HydrophobicContact CB-CD2 4.01Å; A179-L187 HydrophobicContact CB-CG 3.86Å; A179-Y188 HydrophobicContact CB-CD2 4.31Å
180	D	95.2	Very high	92.6	Very high	58 Å²	58	51 Å²	51	31%	0.31	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-48.3	173.8	-175.6	56.1	0	0	0	111.3	M176 W177 L178 H182 S183 Y188 H214 L215	M176-D180 PolarHBondContact O-N 3.17Å; W177-D180 PolarHBondContact O-N 2.91Å; L178-D180 PolarHBondContact O-N 3.48Å; D180-H182 VanDerWaalsContact C-N 3.29Å; D180-H182 PolarHBondContact O-N 3.17Å; D180-S183 PolarHBondContact O-N 2.98Å; D180-Y188 HydrophobicContact CB-CD2 4.11Å; D180-Y188 HydrophobicContact CB-CE2 3.92Å; D180-H214 IonicContact OD1-NE2 2.67Å; D180-H214 IonicContact OD2-CD2 3.84Å; D180-H214 IonicContact OD2-CE1 2.91Å; D180-H214 IonicContact OD2-NE2 2.97Å; D180-H214 PolarHBondContact OD2-NE2 2.78Å; D180-L215 HydrophobicContact CB-CD2 4.04Å
181	R	93.7	Very high	92.7	Very high	119 Å²	119	47.5 Å²	47.5	45%	0.449	25%	0.246	S	C	.	.	H	α-helix	trans	-62	-35.4	-179.7	-179.1	167.9	57.3	119.2	-8.3	113	E145 W177 L178	E145-R181 IonicContact OE1-CZ 2.84Å; E145-R181 IonicContact OE1-NH2 3.7Å; E145-R181 PolarHBondContact OE1-NH2 3.42Å; E145-R181 IonicContact OE2-CZ 3.91Å; E145-R181 IonicContact OE2-NH1 3.41Å; E145-R181 PolarHBondContact OE2-NH1 3.49Å; E145-R181 IonicContact OE2-NH2 2.71Å; E145-R181 PolarHBondContact OE2-NH2 2.9Å; W177-R181 PolarHBondContact O-N 3.38Å; W177-R181 VanDerWaalsContact O-N 3.17Å; L178-R181 PolarHBondContact O-N 3.2Å
182	H	94.4	Very high	92.7	Very high	22 Å²	22	47 Å²	47	10%	0.102	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	7.5	-179.1	-70	-78.8	0	0	0	113.7	Y144 E145 D148 F156 L178 A179 D180 D184	Y144-H182 HydrophobicContact CE1-CB 3.81Å; Y144-H182 AromaticContact CE1-CD2 3.6Å; Y144-H182 AromaticContact CE1-CG 3.68Å; E145-H182 WeakPolarHBondContact CG-NE2 3.4Å; D148-H182 IonicContact OD2-CE1 3.12Å; D148-H182 IonicContact OD2-CG 2.73Å; D148-H182 IonicContact OD2-ND1 3.96Å; D148-H182 PolarHBondContact OD2-ND1 3.34Å; F156-H182 HydrophobicContact CE2-CB 4.21Å; F156-H182 HydrophobicContact CZ-CB 4.3Å; L178-H182 PolarHBondContact O-CD2 3.45Å; L178-H182 VanDerWaalsContact O-CD2 3.28Å; L178-H182 PolarHBondContact O-N 3.32Å; L178-H182 VanDerWaalsContact O-N 3.17Å; A179-H182 CarbonylContact O-C 3.53Å; A179-H182 PolarHBondContact O-N 2.96Å; D180-H182 VanDerWaalsContact C-N 3.29Å; D180-H182 PolarHBondContact O-N 3.17Å; H182-D184 VanDerWaalsContact C-N 3.28Å; H182-D184 PolarHBondContact O-N 3.28Å
183	S	94.4	Very high	92.3	Very high	108 Å²	108	52.5 Å²	52.5	76%	0.755	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	43.9	-179.7	-59	0	0	0	0	113.1	A179 D180 P185	A179-S183 PolarHBondContact O-N 3.24Å; D180-S183 PolarHBondContact O-N 2.98Å; S183-P185 WeakPolarHBondContact O-CD 3.18Å
184	D	95	Very high	91.9	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.059	27%	0.271	C	S	.	.			trans	-101.9	94.3	-178.6	-175.2	-19.8	0	0	0	110.7	Y144 F156 S160 A179 H182 E186 L187 Y188	Y144-D184 WeakPolarHBondContact OH-CB 3.49Å; Y144-D184 PolarHBondContact OH-OD2 3.24Å; F156-D184 HydrophobicContact CZ-CB 4.2Å; S160-D184 WeakPolarHBondContact CB-OD2 3.38Å; S160-D184 PolarHBondContact OG-OD1 2.68Å; S160-D184 PolarHBondContact OG-OD2 3.34Å; A179-D184 HydrophobicContact CB-CB 4.29Å; A179-D184 PolarHBondContact O-N 3.35Å; H182-D184 VanDerWaalsContact C-N 3.28Å; H182-D184 PolarHBondContact O-N 3.28Å; D184-E186 PolarHBondContact O-N 3.13Å; D184-E186 PolarHBondContact OD1-N 3.29Å; D184-L187 HydrophobicContact CB-CB 4.25Å; D184-L187 VanDerWaalsContact CG-CB 3.47Å; D184-L187 WeakPolarHBondContact OD1-CB 3.29Å; D184-L187 PolarHBondContact OD1-N 3.44Å; D184-L187 VanDerWaalsContact OD1-N 3.12Å; D184-L187 WeakPolarHBondContact OD2-CB 3.49Å; D184-Y188 WeakPolarHBondContact O-CB 3.39Å; D184-Y188 PolarHBondContact O-N 3.06Å
185	P	89.1	Confident	91.9	Very high	87 Å²	87	48 Å²	48	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-70	-31.1	-171.8	28.1	-36	0	0	0	113.2	S183 T189	S183-P185 WeakPolarHBondContact O-CD 3.18Å; P185-T189 VanDerWaalsContact O-CB 3.32Å; P185-T189 WeakPolarHBondContact O-CB 3.49Å; P185-T189 PolarHBondContact O-N 3.32Å; P185-T189 PolarHBondContact O-OG1 3.46Å
186	E	85.3	Confident	91.6	Very high	151 Å²	151	49.2 Å²	49.2	71%	0.706	25%	0.253	S	S	*	.	H	α-helix	trans	-69.6	-49.2	-178.7	-67.2	-171.6	-179.4	0	0	110.3	D184 T189 A190	D184-E186 PolarHBondContact O-N 3.13Å; D184-E186 PolarHBondContact OD1-N 3.29Å; E186-T189 PolarHBondContact O-N 2.79Å; E186-A190 PolarHBondContact O-N 3.28Å
187	L	92.1	Very high	91	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-42.6	177.1	-175.4	59.1	0	0	0	111.6	Y144 L163 A164 V167 V175 A179 D184 T189 A190 A191	Y144-L187 HydrophobicContact CE2-CD2 4.22Å; L163-L187 HydrophobicContact CB-CD1 3.67Å; L163-L187 HydrophobicContact CB-CD2 3.97Å; L163-L187 HydrophobicContact CB-CG 4.49Å; L163-L187 HydrophobicContact CD1-CD2 3.85Å; A164-L187 HydrophobicContact CB-CD1 3.84Å; A164-L187 VanDerWaalsContact N-CD1 3.31Å; V167-L187 HydrophobicContact CG2-CD1 4.49Å; V175-L187 HydrophobicContact CG1-CD1 3.54Å; V175-L187 HydrophobicContact CG1-CD2 4.02Å; V175-L187 HydrophobicContact CG1-CG 3.73Å; A179-L187 HydrophobicContact CB-CB 3.93Å; A179-L187 HydrophobicContact CB-CD2 4.01Å; A179-L187 HydrophobicContact CB-CG 3.86Å; D184-L187 HydrophobicContact CB-CB 4.25Å; D184-L187 VanDerWaalsContact CG-CB 3.47Å; D184-L187 WeakPolarHBondContact OD1-CB 3.29Å; D184-L187 PolarHBondContact OD1-N 3.44Å; D184-L187 VanDerWaalsContact OD1-N 3.12Å; D184-L187 WeakPolarHBondContact OD2-CB 3.49Å; L187-T189 VanDerWaalsContact C-N 3.32Å; L187-T189 PolarHBondContact O-N 3.27Å; L187-A190 PolarHBondContact O-N 3.15Å; L187-A191 WeakPolarHBondContact O-CB 3.18Å; L187-A191 PolarHBondContact O-N 3.44Å
188	Y	94.4	Very high	90.6	Very high	27 Å²	27	48 Å²	48	11%	0.106	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-45.9	177.2	-174.1	-98.2	0	0	0	111.6	M176 A179 D180 D184 A190 A191 K192 L215 D218	M176-Y188 HydrophobicContact CE-CE1 4.35Å; M176-Y188 HydrophobicContact CE-CE2 3.67Å; M176-Y188 VanDerWaalsContact CE-OH 3.23Å; M176-Y188 WeakPolarHBondContact CE-OH 3.49Å; M176-Y188 HydrophobicContact CG-CD2 3.8Å; M176-Y188 HydrophobicContact CG-CE2 3.58Å; M176-Y188 WeakPolarHBondContact O-CD2 3.35Å; A179-Y188 HydrophobicContact CB-CD2 4.31Å; D180-Y188 HydrophobicContact CB-CD2 4.11Å; D180-Y188 HydrophobicContact CB-CE2 3.92Å; D184-Y188 WeakPolarHBondContact O-CB 3.39Å; D184-Y188 PolarHBondContact O-N 3.06Å; Y188-A190 PolarHBondContact O-N 3.46Å; Y188-A191 PolarHBondContact O-N 3.38Å; Y188-K192 HydrophobicContact CE1-CD 4.09Å; Y188-K192 WeakPolarHBondContact O-CB 3.42Å; Y188-K192 PolarHBondContact O-N 3.19Å; Y188-L215 HydrophobicContact CE2-CD2 3.74Å; Y188-L215 VanDerWaalsContact OH-CD2 3.29Å; Y188-L215 WeakPolarHBondContact OH-CD2 3.5Å; Y188-D218 WeakPolarHBondContact OH-CB 3.35Å; Y188-D218 PolarHBondContact OH-OD2 2.7Å
189	T	87.8	Confident	90.5	Very high	88 Å²	88	47.7 Å²	47.7	54%	0.54	25%	0.254	S	S	.	.	H	α-helix	trans	-63.1	-44	-180	-59.3	0	0	0	0	111.7	P185 E186 L187 H193	P185-T189 VanDerWaalsContact O-CB 3.32Å; P185-T189 WeakPolarHBondContact O-CB 3.49Å; P185-T189 PolarHBondContact O-N 3.32Å; P185-T189 PolarHBondContact O-OG1 3.46Å; E186-T189 PolarHBondContact O-N 2.79Å; L187-T189 VanDerWaalsContact C-N 3.32Å; L187-T189 PolarHBondContact O-N 3.27Å; T189-H193 WeakPolarHBondContact O-CB 3.32Å; T189-H193 PolarHBondContact O-N 3.31Å
190	A	81.6	Confident	90.2	Very high	37 Å²	37	49.2 Å²	49.2	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-45.2	177.5	0	0	0	0	0	111.8	A164 E186 L187 Y188 H193 C194	A164-A190 HydrophobicContact CB-CB 4.44Å; E186-A190 PolarHBondContact O-N 3.28Å; L187-A190 PolarHBondContact O-N 3.15Å; Y188-A190 PolarHBondContact O-N 3.46Å; A190-H193 PolarHBondContact O-N 3.43Å; A190-C194 PolarHBondContact O-N 2.99Å
191	A	92.9	Very high	90	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-44.4	-180	0	0	0	0	0	112.6	V167 V175 M176 L187 Y188 H193 C194 A195	V167-A191 HydrophobicContact CG2-CB 4.45Å; V175-A191 HydrophobicContact CB-CB 4.3Å; V175-A191 HydrophobicContact CG1-CB 4.05Å; M176-A191 HydrophobicContact CB-CB 3.65Å; M176-A191 HydrophobicContact CG-CB 4.39Å; L187-A191 WeakPolarHBondContact O-CB 3.18Å; L187-A191 PolarHBondContact O-N 3.44Å; Y188-A191 PolarHBondContact O-N 3.38Å; A191-H193 VanDerWaalsContact C-N 3.33Å; A191-H193 PolarHBondContact O-N 2.61Å; A191-C194 PolarHBondContact O-N 3.3Å; A191-A195 PolarHBondContact O-N 3.19Å
192	K	93.4	Very high	90	Very high	24 Å²	24	47.1 Å²	47.1	10%	0.104	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-43.5	173.5	-179.8	-174.1	179.3	179.9	0	111.6	M176 Y188 C194 A195 K196 D218 D222	M176-K192 HydrophobicContact CE-CB 4.35Å; M176-K192 HydrophobicContact CE-CG 4.38Å; M176-K192 HydrophobicContact SD-CB 4.11Å; Y188-K192 HydrophobicContact CE1-CD 4.09Å; Y188-K192 WeakPolarHBondContact O-CB 3.42Å; Y188-K192 PolarHBondContact O-N 3.19Å; K192-C194 PolarHBondContact O-N 3.43Å; K192-A195 PolarHBondContact O-N 2.99Å; K192-K196 WeakPolarHBondContact O-CB 3.42Å; K192-K196 PolarHBondContact O-N 3.49Å; K192-D218 VanDerWaalsContact CE-C 3.47Å; K192-D218 WeakPolarHBondContact CE-O 3.42Å; K192-D218 PolarHBondContact NZ-O 3.02Å; K192-D222 WeakPolarHBondContact CE-OD2 3.17Å; K192-D222 IonicContact NZ-OD2 3.47Å; K192-D222 PolarHBondContact NZ-OD2 3.05Å
193	H	86.3	Confident	89.9	Confident	114 Å²	114	46.6 Å²	46.6	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-47.3	178	-176.5	73.7	0	0	0	111.4	T189 A190 A191 K196 T197	T189-H193 WeakPolarHBondContact O-CB 3.32Å; T189-H193 PolarHBondContact O-N 3.31Å; A190-H193 PolarHBondContact O-N 3.43Å; A191-H193 VanDerWaalsContact C-N 3.33Å; A191-H193 PolarHBondContact O-N 2.61Å; H193-K196 PolarHBondContact O-N 3.41Å; H193-T197 WeakPolarHBondContact O-CG2 3.14Å; H193-T197 PolarHBondContact O-N 2.95Å; H193-T197 PolarHBondContact O-OG1 3.44Å
194	C	86.8	Confident	89.7	Confident	16 Å²	16	47.3 Å²	47.3	11%	0.108	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-44.2	176.4	-174.4	0	0	0	0	112.1	V167 C172 A190 A191 K192 K196 T197 H198	V167-C194 HydrophobicContact CG1-CB 3.56Å; C172-C194 HydrophobicContact CB-CB 3.82Å; A190-C194 PolarHBondContact O-N 2.99Å; A191-C194 PolarHBondContact O-N 3.3Å; K192-C194 PolarHBondContact O-N 3.43Å; C194-K196 VanDerWaalsContact C-N 3.32Å; C194-K196 PolarHBondContact O-N 2.7Å; C194-T197 PolarHBondContact O-N 3.28Å; C194-T197 PolarHBondContact O-OG1 3.21Å; C194-H198 PolarHBondContact O-CD2 2.95Å; C194-H198 VanDerWaalsContact O-CD2 3.32Å; C194-H198 PolarHBondContact O-N 3.41Å; C194-H198 VanDerWaalsContact O-N 3.16Å
195	A	94.1	Very high	89.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-43.2	177.3	0	0	0	0	0	111.9	L173 A191 K192 L199 L202 I219	L173-A195 HydrophobicContact CD2-CB 3.84Å; A191-A195 PolarHBondContact O-N 3.19Å; K192-A195 PolarHBondContact O-N 2.99Å; A195-L199 WeakPolarHBondContact O-CA 3.19Å; A195-L199 WeakPolarHBondContact O-CB 3.44Å; A195-L199 PolarHBondContact O-N 2.91Å; A195-L202 HydrophobicContact CB-CD1 4.11Å; A195-I219 HydrophobicContact CB-CD1 4.03Å; A195-I219 HydrophobicContact CB-CG1 4.36Å
196	K	87.8	Confident	90	Very high	34 Å²	34	51.4 Å²	51.4	15%	0.148	27%	0.268	C	S	.	.	H	α-helix	trans	-65.7	-42	177.6	165.7	173.1	140.9	170.3	0	113	K192 H193 C194 H198 I219 D222 G223 V224	K192-K196 WeakPolarHBondContact O-CB 3.42Å; K192-K196 PolarHBondContact O-N 3.49Å; H193-K196 PolarHBondContact O-N 3.41Å; C194-K196 VanDerWaalsContact C-N 3.32Å; C194-K196 PolarHBondContact O-N 2.7Å; K196-H198 VanDerWaalsContact C-N 3.29Å; K196-H198 PolarHBondContact O-N 2.98Å; K196-I219 HydrophobicContact CB-CG2 4.34Å; K196-D222 PolarHBondContact NZ-O 2.81Å; K196-G223 VanDerWaalsContact CD-O 3.22Å; K196-G223 WeakPolarHBondContact CD-O 3.39Å; K196-G223 WeakPolarHBondContact CE-O 3.14Å; K196-G223 PolarHBondContact NZ-O 3.45Å; K196-V224 HydrophobicContact CG-CG2 4.18Å
197	T	82.3	Confident	90.4	Very high	42 Å²	42	49.5 Å²	49.5	26%	0.258	26%	0.259	S	S	.	.	H	α-helix	trans	-76.6	-15.8	-177.8	55.4	0	0	0	0	113.8	H193 C194 Q228	H193-T197 WeakPolarHBondContact O-CG2 3.14Å; H193-T197 PolarHBondContact O-N 2.95Å; H193-T197 PolarHBondContact O-OG1 3.44Å; C194-T197 PolarHBondContact O-N 3.28Å; C194-T197 PolarHBondContact O-OG1 3.21Å; T197-Q228 PolarHBondContact O-NE2 3.36Å; T197-Q228 PolarHBondContact O-OE1 3Å
198	H	86.1	Confident	90.6	Very high	62 Å²	62	49.5 Å²	49.5	29%	0.287	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	21.7	-178	-59.9	-72.6	0	0	0	113.5	V169 C194 K196 A200 Q201 L202 Q228	V169-H198 HydrophobicContact CG1-CB 4.15Å; V169-H198 HydrophobicContact CG2-CB 3.84Å; C194-H198 PolarHBondContact O-CD2 2.95Å; C194-H198 VanDerWaalsContact O-CD2 3.32Å; C194-H198 PolarHBondContact O-N 3.41Å; C194-H198 VanDerWaalsContact O-N 3.16Å; K196-H198 VanDerWaalsContact C-N 3.29Å; K196-H198 PolarHBondContact O-N 2.98Å; H198-A200 VanDerWaalsContact C-N 3.26Å; H198-A200 PolarHBondContact O-N 3.03Å; H198-A200 VanDerWaalsContact O-N 3.16Å; H198-Q201 WeakPolarHBondContact O-CB 3.46Å; H198-Q201 PolarHBondContact O-N 2.86Å; H198-L202 PolarHBondContact O-N 2.88Å; H198-Q228 VanDerWaalsContact C-OE1 3.23Å; H198-Q228 VanDerWaalsContact CA-OE1 3.31Å
199	L	92.4	Very high	90.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-55.3	-36.8	-173.2	178.9	68.3	0	0	0	113.2	A195 Q201 L202 Q203 F208 I219 V224 Q228 P230 A233	A195-L199 WeakPolarHBondContact O-CA 3.19Å; A195-L199 WeakPolarHBondContact O-CB 3.44Å; A195-L199 PolarHBondContact O-N 2.91Å; L199-Q201 VanDerWaalsContact C-N 3.26Å; L199-Q201 PolarHBondContact O-N 2.78Å; L199-L202 PolarHBondContact O-N 3.03Å; L199-Q203 PolarHBondContact O-N 3.25Å; L199-F208 HydrophobicContact CD1-CD2 4.18Å; L199-F208 HydrophobicContact CD1-CE2 3.34Å; L199-F208 HydrophobicContact CD1-CZ 3.79Å; L199-I219 HydrophobicContact CD1-CG2 4.48Å; L199-V224 HydrophobicContact CD2-CG1 3.87Å; L199-Q228 HydrophobicContact CB-CB 3.96Å; L199-P230 HydrophobicContact CD2-CB 3.93Å; L199-A233 HydrophobicContact CD1-CB 4.06Å; L199-A233 HydrophobicContact CD2-CB 3.9Å; L199-A233 HydrophobicContact CG-CB 3.83Å
200	A	88.6	Confident	91	Very high	33 Å²	33	51 Å²	51	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-28.6	177.6	0	0	0	0	0	113.3	H198 Q228	H198-A200 VanDerWaalsContact C-N 3.26Å; H198-A200 PolarHBondContact O-N 3.03Å; H198-A200 VanDerWaalsContact O-N 3.16Å; A200-Q228 PolarHBondContact N-O 2.84Å
201	Q	90.8	Very high	91.5	Very high	125 Å²	125	49.6 Å²	49.6	58%	0.584	25%	0.248	S	C	*	.	H	α-helix	trans	-77.3	-28	174.6	-60.1	-177.1	23	0	0	111.5	V169 H198 L199	V169-Q201 HydrophobicContact CG1-CB 4.13Å; H198-Q201 WeakPolarHBondContact O-CB 3.46Å; H198-Q201 PolarHBondContact O-N 2.86Å; L199-Q201 VanDerWaalsContact C-N 3.26Å; L199-Q201 PolarHBondContact O-N 2.78Å
202	L	94.6	Very high	91.6	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-87.8	-27.6	-175.1	-64.3	172.4	0	0	0	113.3	V169 L173 A195 H198 L199 N204 T205 F208	V169-L202 HydrophobicContact CG1-CD2 3.82Å; V169-L202 HydrophobicContact CG1-CG 4.26Å; V169-L202 WeakPolarHBondContact O-CD2 3.46Å; L173-L202 HydrophobicContact CD1-CB 4.31Å; L173-L202 HydrophobicContact CD1-CD1 4.31Å; L173-L202 HydrophobicContact CD1-CD2 4.09Å; L173-L202 HydrophobicContact CD1-CG 4.47Å; L173-L202 HydrophobicContact CD2-CD1 4.19Å; L173-L202 HydrophobicContact CG-CD1 4.15Å; L173-L202 HydrophobicContact CG-CD2 4.36Å; A195-L202 HydrophobicContact CB-CD1 4.11Å; H198-L202 PolarHBondContact O-N 2.88Å; L199-L202 PolarHBondContact O-N 3.03Å; L202-N204 PolarHBondContact O-N 2.84Å; L202-T205 WeakPolarHBondContact O-CB 3.43Å; L202-T205 WeakPolarHBondContact O-CG2 3.41Å; L202-T205 PolarHBondContact O-N 3.22Å; L202-T205 PolarHBondContact O-OG1 2.76Å; L202-F208 HydrophobicContact CB-CD2 4.35Å; L202-F208 WeakPolarHBondContact O-CB 3.08Å
203	Q	93.1	Very high	91.7	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.056	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.3	-167.8	71.7	-176.1	14.1	0	0	115.7	L199 F208 A233	L199-Q203 PolarHBondContact O-N 3.25Å; Q203-F208 HydrophobicContact CB-CE1 4.42Å; Q203-F208 WeakPolarHBondContact O-CD1 3.12Å; Q203-A233 HydrophobicContact CB-CB 3.8Å
204	N	90.1	Very high	92	Very high	122 Å²	122	51.3 Å²	51.3	65%	0.652	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	3	-179.3	-65.8	-40.5	0	0	0	113.9	L202	L202-N204 PolarHBondContact O-N 2.84Å
205	T	95.6	Very high	92.4	Very high	39 Å²	39	50.6 Å²	50.6	24%	0.239	26%	0.255	C	S	.	.	S	Bend	trans	-80	148.2	-180	63.1	0	0	0	0	110.9	L202 E207 F208 L209	L202-T205 WeakPolarHBondContact O-CB 3.43Å; L202-T205 WeakPolarHBondContact O-CG2 3.41Å; L202-T205 PolarHBondContact O-N 3.22Å; L202-T205 PolarHBondContact O-OG1 2.76Å; T205-E207 WeakPolarHBondContact CB-OE2 3.39Å; T205-E207 PolarHBondContact O-N 3.22Å; T205-F208 PolarHBondContact O-N 2.96Å; T205-F208 VanDerWaalsContact OG1-CB 3.29Å; T205-F208 WeakPolarHBondContact OG1-CB 3.24Å; T205-F208 PolarHBondContact OG1-N 3.12Å; T205-L209 WeakPolarHBondContact O-CG 3.43Å; T205-L209 PolarHBondContact O-N 3.22Å; T205-L209 VanDerWaalsContact O-N 3.13Å
206	E	94.2	Very high	92.5	Very high	146 Å²	146	50.6 Å²	50.6	68%	0.682	26%	0.255	S	S	*	.	H	α-helix	trans	-60.9	-36.7	178.1	-72.7	-164.8	165.1	0	0	111.2	F208 L209 H210	E206-F208 VanDerWaalsContact C-N 3.34Å; E206-F208 PolarHBondContact O-N 3.4Å; E206-L209 PolarHBondContact O-N 3.43Å; E206-H210 PolarHBondContact O-N 2.84Å; E206-H210 PolarHBondContact O-ND1 2.93Å
207	E	93.7	Very high	92.8	Very high	111 Å²	111	50.1 Å²	50.1	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-42.7	178.5	-63	78.2	-174.7	0	0	111.5	L173 T205 L211	L173-E207 HydrophobicContact CB-CB 4.4Å; L173-E207 HydrophobicContact CD1-CB 4.1Å; T205-E207 WeakPolarHBondContact CB-OE2 3.39Å; T205-E207 PolarHBondContact O-N 3.22Å; E207-L211 PolarHBondContact O-N 2.82Å
208	F	96.3	Very high	93.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-43.7	176.6	-176.5	-96.1	0	0	0	111.9	L173 L199 L202 Q203 T205 E206 H210 L211 L216 A233 W237	L173-F208 HydrophobicContact CD1-CB 3.7Å; L173-F208 HydrophobicContact CD1-CD2 4.15Å; L173-F208 HydrophobicContact CD1-CG 4.45Å; L199-F208 HydrophobicContact CD1-CD2 4.18Å; L199-F208 HydrophobicContact CD1-CE2 3.34Å; L199-F208 HydrophobicContact CD1-CZ 3.79Å; L202-F208 HydrophobicContact CB-CD2 4.35Å; L202-F208 WeakPolarHBondContact O-CB 3.08Å; Q203-F208 HydrophobicContact CB-CE1 4.42Å; Q203-F208 WeakPolarHBondContact O-CD1 3.12Å; T205-F208 PolarHBondContact O-N 2.96Å; T205-F208 VanDerWaalsContact OG1-CB 3.29Å; T205-F208 WeakPolarHBondContact OG1-CB 3.24Å; T205-F208 PolarHBondContact OG1-N 3.12Å; E206-F208 VanDerWaalsContact C-N 3.34Å; E206-F208 PolarHBondContact O-N 3.4Å; F208-H210 PolarHBondContact O-N 3.09Å; F208-L211 WeakPolarHBondContact O-CB 3.44Å; F208-L211 PolarHBondContact O-N 3.3Å; F208-L216 HydrophobicContact CE2-CD1 3.94Å; F208-L216 HydrophobicContact CZ-CD1 3.74Å; F208-A233 HydrophobicContact CE1-CB 4.28Å; F208-A233 WeakPolarHBondContact CE1-O 2.97Å; F208-A233 HydrophobicContact CZ-CB 3.96Å; F208-W237 HydrophobicContact CE1-CB 4.02Å
209	L	95.1	Very high	93.7	Very high	27 Å²	27	47.9 Å²	47.9	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-26.8	-178.5	-63.1	176.4	0	0	0	112.4	T205 E206 F240 R245	T205-L209 WeakPolarHBondContact O-CG 3.43Å; T205-L209 PolarHBondContact O-N 3.22Å; T205-L209 VanDerWaalsContact O-N 3.13Å; E206-L209 PolarHBondContact O-N 3.43Å; L209-F240 HydrophobicContact CB-CB 4.35Å; L209-F240 HydrophobicContact CB-CD1 4.03Å; L209-F240 HydrophobicContact CB-CD2 3.97Å; L209-F240 HydrophobicContact CB-CE1 4.3Å; L209-F240 HydrophobicContact CB-CE2 4.24Å; L209-F240 HydrophobicContact CB-CG 3.85Å; L209-F240 HydrophobicContact CB-CZ 4.4Å; L209-F240 HydrophobicContact CD1-CD2 3.73Å; L209-F240 HydrophobicContact CD1-CE2 4.11Å; L209-F240 HydrophobicContact CD1-CG 4.31Å; L209-F240 HydrophobicContact CD2-CB 4.11Å; L209-F240 HydrophobicContact CD2-CG 4.45Å; L209-F240 HydrophobicContact CG-CD2 4.3Å; L209-F240 HydrophobicContact CG-CG 4.42Å; L209-R245 VanDerWaalsContact O-CZ 3.3Å; L209-R245 PolarHBondContact O-NH1 2.73Å; L209-R245 PolarHBondContact O-NH2 2.79Å
210	H	94.4	Very high	93.8	Very high	119 Å²	119	47.9 Å²	47.9	55%	0.551	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	1.1	174.4	-68.9	86.3	0	0	0	114.2	E206 F208 F240	E206-H210 PolarHBondContact O-N 2.84Å; E206-H210 PolarHBondContact O-ND1 2.93Å; F208-H210 PolarHBondContact O-N 3.09Å; H210-F240 AromaticContact CE1-CE1 3.87Å; H210-F240 AromaticContact CE1-CZ 3.49Å; H210-F240 VanDerWaalsContact CE1-CZ 3.49Å; H210-F240 WeakPolarHBondContact CE1-CZ 3.34Å; H210-F240 AromaticContact NE2-CE1 3.81Å; H210-F240 AromaticContact NE2-CZ 3.71Å
211	L	94.1	Very high	93.7	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.037	25%	0.246	C	C	.	.			trans	-61.7	134.6	-177	-163.4	73	0	0	0	111.4	L173 E207 F208 L215 L216 I219 W237	L173-L211 HydrophobicContact CD2-CD1 4.44Å; E207-L211 PolarHBondContact O-N 2.82Å; F208-L211 WeakPolarHBondContact O-CB 3.44Å; F208-L211 PolarHBondContact O-N 3.3Å; L211-L215 HydrophobicContact CD1-CB 4.03Å; L211-L215 HydrophobicContact CD1-CD1 3.95Å; L211-L215 HydrophobicContact CD2-CB 4.05Å; L211-L215 HydrophobicContact CG-CB 3.88Å; L211-L216 HydrophobicContact CD2-CB 4.08Å; L211-I219 HydrophobicContact CD2-CD1 3.7Å; L211-W237 WeakPolarHBondContact O-CZ2 3.37Å; L211-W237 PolarHBondContact O-NE1 2.93Å
212	P	93.9	Very high	92.9	Very high	40 Å²	40	46.8 Å²	46.8	26%	0.26	24%	0.241	S	C	.	.			trans	-58.6	146.8	171.6	-25.5	33.9	0	0	0	113	H214 L215 L216	P212-H214 VanDerWaalsContact C-N 3.3Å; P212-H214 VanDerWaalsContact CB-CE1 3.43Å; P212-H214 WeakPolarHBondContact CB-CE1 3.36Å; P212-H214 WeakPolarHBondContact CB-ND1 3.31Å; P212-H214 PolarHBondContact O-N 2.81Å; P212-L215 HydrophobicContact CB-CG 4.28Å; P212-L215 HydrophobicContact CG-CD1 4.19Å; P212-L215 HydrophobicContact CG-CG 4.39Å; P212-L215 PolarHBondContact O-N 2.96Å; P212-L216 PolarHBondContact O-N 2.71Å; P212-L216 VanDerWaalsContact O-N 3.13Å
213	H	94.7	Very high	91.9	Very high	51 Å²	51	46.5 Å²	46.5	24%	0.236	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-41.1	-179	168.5	-94.2	0	0	0	113.3	L216 T217 W237 F248	H213-L216 PolarHBondContact O-N 2.89Å; H213-T217 PolarHBondContact CE1-OG1 2.85Å; H213-T217 PolarHBondContact NE2-OG1 2.94Å; H213-T217 WeakPolarHBondContact O-CB 3.48Å; H213-T217 PolarHBondContact O-N 3.01Å; H213-T217 PolarHBondContact O-OG1 3.34Å; H213-W237 HydrophobicContact CB-CH2 4.02Å; H213-W237 HydrophobicContact CB-CZ2 4.34Å; H213-F248 AromaticContact CD2-CD1 3.7Å; H213-F248 AromaticContact CD2-CG 3.53Å; H213-F248 AromaticContact NE2-CD1 3.66Å; H213-F248 AromaticContact NE2-CG 3.84Å
214	H	94.2	Very high	91.3	Very high	84 Å²	84	45.9 Å²	45.9	39%	0.389	24%	0.237	S	C	.	.	H	α-helix	trans	-66.5	-39.6	-178.3	68	-74.4	0	0	0	111.8	D180 P212 T217 D218	D180-H214 IonicContact OD1-NE2 2.67Å; D180-H214 IonicContact OD2-CD2 3.84Å; D180-H214 IonicContact OD2-CE1 2.91Å; D180-H214 IonicContact OD2-NE2 2.97Å; D180-H214 PolarHBondContact OD2-NE2 2.78Å; P212-H214 VanDerWaalsContact C-N 3.3Å; P212-H214 VanDerWaalsContact CB-CE1 3.43Å; P212-H214 WeakPolarHBondContact CB-CE1 3.36Å; P212-H214 WeakPolarHBondContact CB-ND1 3.31Å; P212-H214 PolarHBondContact O-N 2.81Å; H214-T217 WeakPolarHBondContact O-CB 3.45Å; H214-T217 PolarHBondContact O-N 3.41Å; H214-D218 PolarHBondContact O-N 2.91Å
215	L	94.8	Very high	90.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-41.5	176.7	-60.2	-167.5	0	0	0	112	M176 W177 D180 Y188 L211 P212 T217 D218 I219	M176-L215 HydrophobicContact CE-CB 3.89Å; M176-L215 HydrophobicContact CE-CD2 4.06Å; M176-L215 HydrophobicContact CE-CG 4.43Å; W177-L215 HydrophobicContact CB-CD1 4.23Å; D180-L215 HydrophobicContact CB-CD2 4.04Å; Y188-L215 HydrophobicContact CE2-CD2 3.74Å; Y188-L215 VanDerWaalsContact OH-CD2 3.29Å; Y188-L215 WeakPolarHBondContact OH-CD2 3.5Å; L211-L215 HydrophobicContact CD1-CB 4.03Å; L211-L215 HydrophobicContact CD1-CD1 3.95Å; L211-L215 HydrophobicContact CD2-CB 4.05Å; L211-L215 HydrophobicContact CG-CB 3.88Å; P212-L215 HydrophobicContact CB-CG 4.28Å; P212-L215 HydrophobicContact CG-CD1 4.19Å; P212-L215 HydrophobicContact CG-CG 4.39Å; P212-L215 PolarHBondContact O-N 2.96Å; L215-T217 VanDerWaalsContact C-N 3.34Å; L215-D218 PolarHBondContact O-N 2.76Å; L215-I219 WeakPolarHBondContact O-CG1 3.05Å; L215-I219 PolarHBondContact O-N 3.4Å
216	L	95.6	Very high	89.3	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-45.9	173.7	179.4	58.6	0	0	0	110.9	F208 L211 P212 H213 D218 I219 I220 W237 L252	F208-L216 HydrophobicContact CE2-CD1 3.94Å; F208-L216 HydrophobicContact CZ-CD1 3.74Å; L211-L216 HydrophobicContact CD2-CB 4.08Å; P212-L216 PolarHBondContact O-N 2.71Å; P212-L216 VanDerWaalsContact O-N 3.13Å; H213-L216 PolarHBondContact O-N 2.89Å; L216-D218 VanDerWaalsContact C-N 3.27Å; L216-D218 PolarHBondContact O-N 2.82Å; L216-I219 PolarHBondContact O-N 2.81Å; L216-I220 HydrophobicContact CD1-CG2 4.1Å; L216-I220 WeakPolarHBondContact O-CG1 3.41Å; L216-I220 PolarHBondContact O-N 2.92Å; L216-I220 VanDerWaalsContact O-N 3.08Å; L216-W237 HydrophobicContact CD2-CB 3.98Å; L216-W237 HydrophobicContact CD2-CD2 3.58Å; L216-W237 HydrophobicContact CD2-CE3 3.87Å; L216-W237 HydrophobicContact CD2-CG 3.62Å; L216-L252 HydrophobicContact CD2-CD1 4.08Å; L216-L252 HydrophobicContact CD2-CD2 4.22Å; L216-L252 HydrophobicContact CG-CD2 4.23Å
217	T	95.3	Very high	88.3	Confident	24 Å²	24	36.9 Å²	36.9	15%	0.147	20%	0.199	C	C	.	.	H	α-helix	trans	-57.5	-42.8	177.7	-56.7	0	0	0	0	111	H213 H214 L215 I220 S221 L252	H213-T217 PolarHBondContact CE1-OG1 2.85Å; H213-T217 PolarHBondContact NE2-OG1 2.94Å; H213-T217 WeakPolarHBondContact O-CB 3.48Å; H213-T217 PolarHBondContact O-N 3.01Å; H213-T217 PolarHBondContact O-OG1 3.34Å; H214-T217 WeakPolarHBondContact O-CB 3.45Å; H214-T217 PolarHBondContact O-N 3.41Å; L215-T217 VanDerWaalsContact C-N 3.34Å; T217-I220 WeakPolarHBondContact O-CG1 3.15Å; T217-I220 PolarHBondContact O-N 3.21Å; T217-S221 WeakPolarHBondContact O-CB 3.43Å; T217-S221 PolarHBondContact O-N 3.33Å; T217-S221 PolarHBondContact O-OG 3.39Å; T217-L252 WeakPolarHBondContact OG1-CD2 3.5Å
218	D	93.6	Very high	87.7	Confident	57 Å²	57	33.1 Å²	33.1	31%	0.305	18%	0.182	S	C	.	.	H	α-helix	trans	-62.9	-43.9	176.5	-85.5	10.2	0	0	0	112.4	Y188 K192 H214 L215 L216 I220 S221	Y188-D218 WeakPolarHBondContact OH-CB 3.35Å; Y188-D218 PolarHBondContact OH-OD2 2.7Å; K192-D218 VanDerWaalsContact CE-C 3.47Å; K192-D218 WeakPolarHBondContact CE-O 3.42Å; K192-D218 PolarHBondContact NZ-O 3.02Å; H214-D218 PolarHBondContact O-N 2.91Å; L215-D218 PolarHBondContact O-N 2.76Å; L216-D218 VanDerWaalsContact C-N 3.27Å; L216-D218 PolarHBondContact O-N 2.82Å; D218-I220 VanDerWaalsContact C-N 3.31Å; D218-I220 PolarHBondContact O-N 3.34Å; D218-S221 PolarHBondContact O-OG 3.38Å
219	I	93.4	Very high	87.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-44.9	177.6	-68.9	164.7	0	0	0	110.4	L173 M176 A195 K196 L199 L211 L215 L216 V224	L173-I219 HydrophobicContact CD2-CD1 4.29Å; M176-I219 HydrophobicContact CE-CD1 4.1Å; M176-I219 HydrophobicContact CE-CG1 3.81Å; M176-I219 HydrophobicContact SD-CD1 3.98Å; M176-I219 HydrophobicContact SD-CG1 4.04Å; A195-I219 HydrophobicContact CB-CD1 4.03Å; A195-I219 HydrophobicContact CB-CG1 4.36Å; K196-I219 HydrophobicContact CB-CG2 4.34Å; L199-I219 HydrophobicContact CD1-CG2 4.48Å; L211-I219 HydrophobicContact CD2-CD1 3.7Å; L215-I219 WeakPolarHBondContact O-CG1 3.05Å; L215-I219 PolarHBondContact O-N 3.4Å; L216-I219 PolarHBondContact O-N 2.81Å; I219-V224 WeakPolarHBondContact O-CG2 2.82Å
220	I	92.9	Very high	86.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-84.7	-24.4	-172.3	69.3	177.2	0	0	0	114.7	L216 T217 D218 V224 I234 L252 L256 K257	L216-I220 HydrophobicContact CD1-CG2 4.1Å; L216-I220 WeakPolarHBondContact O-CG1 3.41Å; L216-I220 PolarHBondContact O-N 2.92Å; L216-I220 VanDerWaalsContact O-N 3.08Å; T217-I220 WeakPolarHBondContact O-CG1 3.15Å; T217-I220 PolarHBondContact O-N 3.21Å; D218-I220 VanDerWaalsContact C-N 3.31Å; D218-I220 PolarHBondContact O-N 3.34Å; I220-V224 HydrophobicContact CB-CG2 4.42Å; I220-V224 HydrophobicContact CG2-CG2 4.43Å; I220-I234 HydrophobicContact CD1-CD1 3.72Å; I220-I234 HydrophobicContact CD1-CG1 4.19Å; I220-I234 HydrophobicContact CG2-CD1 4.38Å; I220-I234 HydrophobicContact CG2-CG1 4.42Å; I220-L252 HydrophobicContact CD1-CB 4.06Å; I220-L252 HydrophobicContact CD1-CD2 3.66Å; I220-L252 HydrophobicContact CD1-CG 4.48Å; I220-L252 WeakPolarHBondContact CD1-O 3.37Å; I220-L256 HydrophobicContact CB-CD1 3.95Å; I220-L256 HydrophobicContact CD1-CB 4.47Å; I220-L256 HydrophobicContact CG2-CD1 4.46Å; I220-K257 PolarHBondContact O-N 3.26Å
221	S	88.1	Confident	86.7	Confident	46 Å²	46	32.5 Å²	32.5	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-78.6	-24.6	-177	55.8	0	0	0	0	113.8	T217 D218 G223 S255	T217-S221 WeakPolarHBondContact O-CB 3.43Å; T217-S221 PolarHBondContact O-N 3.33Å; T217-S221 PolarHBondContact O-OG 3.39Å; D218-S221 PolarHBondContact O-OG 3.38Å; S221-G223 PolarHBondContact O-N 3.12Å; S221-S255 VanDerWaalsContact CA-O 3.31Å; S221-S255 WeakPolarHBondContact CA-O 3.25Å
222	D	73.3	Confident	86.5	Confident	90 Å²	90	36.7 Å²	36.7	48%	0.481	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	20	-176.3	-133.5	-2.5	0	0	0	113.1	K192 K196	K192-D222 WeakPolarHBondContact CE-OD2 3.17Å; K192-D222 IonicContact NZ-OD2 3.47Å; K192-D222 PolarHBondContact NZ-OD2 3.05Å; K196-D222 PolarHBondContact NZ-O 2.81Å
223	G	74.4	Confident	86.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	97.2	176.3	0	0	0	0	0	113.8	K196 S221 K257 I259	K196-G223 VanDerWaalsContact CD-O 3.22Å; K196-G223 WeakPolarHBondContact CD-O 3.39Å; K196-G223 WeakPolarHBondContact CE-O 3.14Å; K196-G223 PolarHBondContact NZ-O 3.45Å; S221-G223 PolarHBondContact O-N 3.12Å; G223-K257 CarbonylContact C-O 3.53Å; G223-K257 WeakPolarHBondContact CA-O 3.43Å; G223-I259 WeakPolarHBondContact O-CD1 3.28Å; G223-I259 WeakPolarHBondContact O-CG1 3.34Å
224	V	79.8	Confident	86.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.6	179.4	-177.4	0	0	0	0	111.5	K196 L199 I219 I220 C226 Q228 P230 K257 I259	K196-V224 HydrophobicContact CG-CG2 4.18Å; L199-V224 HydrophobicContact CD2-CG1 3.87Å; I219-V224 WeakPolarHBondContact O-CG2 2.82Å; I220-V224 HydrophobicContact CB-CG2 4.42Å; I220-V224 HydrophobicContact CG2-CG2 4.43Å; V224-C226 PolarHBondContact O-N 3.12Å; V224-Q228 HydrophobicContact CG1-CB 4.07Å; V224-P230 HydrophobicContact CB-CB 4.07Å; V224-P230 HydrophobicContact CB-CG 4.24Å; V224-P230 HydrophobicContact CG1-CB 3.9Å; V224-P230 HydrophobicContact CG1-CG 4.14Å; V224-K257 PolarHBondContact N-O 3.3Å; V224-I259 VanDerWaalsContact C-CG1 3.43Å; V224-I259 WeakPolarHBondContact O-CG1 3.23Å; V224-I259 PolarHBondContact O-N 3.23Å
225	P	71.1	Confident	86.6	Confident	20 Å²	20	32.8 Å²	32.8	13%	0.13	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	132.6	176.3	-21.2	32	0	0	0	111.8	S227 Q228 I259	P225-S227 PolarHBondContact O-N 3.26Å; P225-S227 VanDerWaalsContact O-N 3.12Å; P225-Q228 HydrophobicContact CB-CG 4.19Å; P225-Q228 HydrophobicContact CG-CG 4.38Å; P225-Q228 WeakPolarHBondContact O-CB 3.3Å; P225-Q228 PolarHBondContact O-N 3.35Å; P225-I259 WeakPolarHBondContact CA-O 3.28Å; P225-I259 HydrophobicContact CG-CD1 4.47Å
226	C	73.1	Confident	86.6	Confident	50 Å²	50	34 Å²	34	34%	0.338	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-58.1	-27.7	-178.3	60.1	0	0	0	0	114.1	V224 Q228 N229 I259	V224-C226 PolarHBondContact O-N 3.12Å; C226-Q228 PolarHBondContact O-N 2.86Å; C226-N229 PolarHBondContact O-N 3.38Å; C226-I259 PolarHBondContact N-O 2.77Å
227	S	71.4	Confident	86.7	Confident	47 Å²	47	34.1 Å²	34.1	33%	0.329	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-70.1	-11.2	174.1	46.9	0	0	0	0	115.3	P225 E261	P225-S227 PolarHBondContact O-N 3.26Å; P225-S227 VanDerWaalsContact O-N 3.12Å; S227-E261 WeakPolarHBondContact CB-OE1 3.28Å; S227-E261 WeakPolarHBondContact OG-CG 3.31Å; S227-E261 PolarHBondContact OG-OE1 3.04Å
228	Q	82.6	Confident	86.7	Confident	32 Å²	32	33.3 Å²	33.3	15%	0.15	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-88	10.5	173.5	-58	-56.9	-55.6	0	0	112.8	T197 H198 L199 A200 V224 P225 C226	T197-Q228 PolarHBondContact O-NE2 3.36Å; T197-Q228 PolarHBondContact O-OE1 3Å; H198-Q228 VanDerWaalsContact C-OE1 3.23Å; H198-Q228 VanDerWaalsContact CA-OE1 3.31Å; L199-Q228 HydrophobicContact CB-CB 3.96Å; A200-Q228 PolarHBondContact N-O 2.84Å; V224-Q228 HydrophobicContact CG1-CB 4.07Å; P225-Q228 HydrophobicContact CB-CG 4.19Å; P225-Q228 HydrophobicContact CG-CG 4.38Å; P225-Q228 WeakPolarHBondContact O-CB 3.3Å; P225-Q228 PolarHBondContact O-N 3.35Å; C226-Q228 PolarHBondContact O-N 2.86Å
229	N	83.9	Confident	86.8	Confident	72 Å²	72	35.4 Å²	35.4	39%	0.385	20%	0.2	S	C	.	.			trans	45.1	52.3	176.9	-59.4	-14.3	0	0	0	113.8	C226 T231 E232 A233	C226-N229 PolarHBondContact O-N 3.38Å; N229-T231 PolarHBondContact O-N 3.16Å; N229-T231 VanDerWaalsContact O-N 3.16Å; N229-E232 HydrophobicContact CB-CB 3.89Å; N229-E232 WeakPolarHBondContact CB-OE2 3.38Å; N229-E232 PolarHBondContact ND2-OE2 3.46Å; N229-E232 WeakPolarHBondContact O-CB 3.49Å; N229-E232 PolarHBondContact O-N 3.07Å; N229-A233 PolarHBondContact O-N 3.32Å
230	P	89.4	Confident	86.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-31.8	-173.1	24.5	-34	0	0	0	113.6	L199 V224 A233 I234 L256 E258	L199-P230 HydrophobicContact CD2-CB 3.93Å; V224-P230 HydrophobicContact CB-CB 4.07Å; V224-P230 HydrophobicContact CB-CG 4.24Å; V224-P230 HydrophobicContact CG1-CB 3.9Å; V224-P230 HydrophobicContact CG1-CG 4.14Å; P230-A233 PolarHBondContact O-N 2.99Å; P230-I234 VanDerWaalsContact O-CG1 3.27Å; P230-I234 WeakPolarHBondContact O-CG1 3.4Å; P230-I234 PolarHBondContact O-N 3.4Å; P230-L256 HydrophobicContact CB-CD1 3.64Å; P230-L256 HydrophobicContact CG-CD1 3.95Å; P230-E258 HydrophobicContact CG-CG 3.79Å
231	T	90.4	Very high	87	Confident	61 Å²	61	42.6 Å²	42.6	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-43.5	173.5	-64	0	0	0	0	111.7	N229 I234 E235 E258	N229-T231 PolarHBondContact O-N 3.16Å; N229-T231 VanDerWaalsContact O-N 3.16Å; T231-I234 PolarHBondContact O-N 3.47Å; T231-E235 WeakPolarHBondContact O-CG 3.33Å; T231-E235 PolarHBondContact O-N 3.25Å; T231-E235 VanDerWaalsContact O-N 3.07Å; T231-E258 PolarHBondContact OG1-OE1 2.82Å
232	E	90.9	Very high	87.2	Confident	95 Å²	95	46.1 Å²	46.1	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-65.1	-40.6	176.7	-169.3	-178.4	-175.7	0	0	111.1	N229 I234 E235 A236	N229-E232 HydrophobicContact CB-CB 3.89Å; N229-E232 WeakPolarHBondContact CB-OE2 3.38Å; N229-E232 PolarHBondContact ND2-OE2 3.46Å; N229-E232 WeakPolarHBondContact O-CB 3.49Å; N229-E232 PolarHBondContact O-N 3.07Å; E232-I234 PolarHBondContact O-N 3.22Å; E232-E235 PolarHBondContact O-N 3.19Å; E232-A236 WeakPolarHBondContact O-CB 3.48Å; E232-A236 PolarHBondContact O-N 3.33Å
233	A	93.6	Very high	88.2	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-41.6	176.5	0	0	0	0	0	112.6	L199 Q203 F208 N229 P230 E235 A236 W237	L199-A233 HydrophobicContact CD1-CB 4.06Å; L199-A233 HydrophobicContact CD2-CB 3.9Å; L199-A233 HydrophobicContact CG-CB 3.83Å; Q203-A233 HydrophobicContact CB-CB 3.8Å; F208-A233 HydrophobicContact CE1-CB 4.28Å; F208-A233 WeakPolarHBondContact CE1-O 2.97Å; F208-A233 HydrophobicContact CZ-CB 3.96Å; N229-A233 PolarHBondContact O-N 3.32Å; P230-A233 PolarHBondContact O-N 2.99Å; A233-E235 VanDerWaalsContact C-N 3.35Å; A233-A236 PolarHBondContact O-N 3.3Å; A233-W237 PolarHBondContact O-N 3.48Å
234	I	95.8	Very high	89.1	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-44.6	174.1	-70.1	163.7	0	0	0	110.4	I220 P230 T231 E232 W237 I238 L252 L256	I220-I234 HydrophobicContact CD1-CD1 3.72Å; I220-I234 HydrophobicContact CD1-CG1 4.19Å; I220-I234 HydrophobicContact CG2-CD1 4.38Å; I220-I234 HydrophobicContact CG2-CG1 4.42Å; P230-I234 VanDerWaalsContact O-CG1 3.27Å; P230-I234 WeakPolarHBondContact O-CG1 3.4Å; P230-I234 PolarHBondContact O-N 3.4Å; T231-I234 PolarHBondContact O-N 3.47Å; E232-I234 PolarHBondContact O-N 3.22Å; I234-W237 PolarHBondContact O-N 3.32Å; I234-I238 HydrophobicContact CG2-CD1 3.65Å; I234-I238 HydrophobicContact CG2-CG1 4.41Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.47Å; I234-I238 PolarHBondContact O-N 2.93Å; I234-L252 HydrophobicContact CD1-CB 4.47Å; I234-L252 HydrophobicContact CG2-CB 4Å; I234-L252 HydrophobicContact CG2-CD1 4.09Å; I234-L256 HydrophobicContact CD1-CB 4.22Å; I234-L256 HydrophobicContact CD1-CD1 4.34Å; I234-L256 HydrophobicContact CD1-CD2 4Å; I234-L256 HydrophobicContact CD1-CG 4.41Å
235	E	94.6	Very high	89.8	Confident	88 Å²	88	58.7 Å²	58.7	41%	0.411	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-42.2	178.2	-72.5	-178.2	174.4	0	0	112.1	T231 E232 A233 W237 I238 N239	T231-E235 WeakPolarHBondContact O-CG 3.33Å; T231-E235 PolarHBondContact O-N 3.25Å; T231-E235 VanDerWaalsContact O-N 3.07Å; E232-E235 PolarHBondContact O-N 3.19Å; A233-E235 VanDerWaalsContact C-N 3.35Å; E235-W237 VanDerWaalsContact C-N 3.35Å; E235-W237 PolarHBondContact O-N 2.95Å; E235-I238 PolarHBondContact O-N 3.29Å; E235-N239 VanDerWaalsContact O-CB 3.27Å; E235-N239 WeakPolarHBondContact O-CB 3.33Å; E235-N239 PolarHBondContact O-N 3.16Å; E235-N239 PolarHBondContact O-ND2 3.04Å
236	A	95.4	Very high	90.9	Very high	24 Å²	24	62.2 Å²	62.2	20%	0.198	31%	0.312	C	S	.	.	H	α-helix	trans	-58.7	-46	175.1	0	0	0	0	0	111.6	E232 A233 N239 F240	E232-A236 WeakPolarHBondContact O-CB 3.48Å; E232-A236 PolarHBondContact O-N 3.33Å; A233-A236 PolarHBondContact O-N 3.3Å; A236-N239 PolarHBondContact O-N 3.48Å; A236-F240 PolarHBondContact O-N 3.34Å
237	W	97.2	Very high	91.9	Very high	5 Å²	5	64 Å²	64	2%	0.019	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-42.3	177.9	-174.3	91.4	0	0	0	112.6	F208 L211 H213 L216 A233 I234 E235 R245 F248 L252	F208-W237 HydrophobicContact CE1-CB 4.02Å; L211-W237 WeakPolarHBondContact O-CZ2 3.37Å; L211-W237 PolarHBondContact O-NE1 2.93Å; H213-W237 HydrophobicContact CB-CH2 4.02Å; H213-W237 HydrophobicContact CB-CZ2 4.34Å; L216-W237 HydrophobicContact CD2-CB 3.98Å; L216-W237 HydrophobicContact CD2-CD2 3.58Å; L216-W237 HydrophobicContact CD2-CE3 3.87Å; L216-W237 HydrophobicContact CD2-CG 3.62Å; A233-W237 PolarHBondContact O-N 3.48Å; I234-W237 PolarHBondContact O-N 3.32Å; E235-W237 VanDerWaalsContact C-N 3.35Å; E235-W237 PolarHBondContact O-N 2.95Å; W237-R245 VanDerWaalsContact CE2-NH1 3.34Å; W237-R245 HydrophobicContact CE3-CB 4.28Å; W237-R245 HydrophobicContact CE3-CG 4.23Å; W237-R245 HydrophobicContact CH2-CB 4.29Å; W237-R245 HydrophobicContact CH2-CG 3.66Å; W237-R245 HydrophobicContact CZ2-CG 4.36Å; W237-R245 HydrophobicContact CZ3-CB 3.74Å; W237-R245 VanDerWaalsContact CZ3-CD 3.47Å; W237-R245 HydrophobicContact CZ3-CG 3.6Å; W237-R245 VanDerWaalsContact O-CD 3.24Å; W237-R245 WeakPolarHBondContact O-CD 2.89Å; W237-R245 PolarHBondContact O-NH1 3.18Å; W237-F248 HydrophobicContact CH2-CD2 4.23Å; W237-F248 HydrophobicContact CZ3-CD2 4.32Å; W237-L252 HydrophobicContact CE3-CD1 4.08Å; W237-L252 HydrophobicContact CZ3-CD1 4.02Å
238	I	96.3	Very high	93	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.036	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-47.1	177.1	-67.8	165.6	0	0	0	110.4	I234 E235 F240 N241 K242 R245 A249 L252	I234-I238 HydrophobicContact CG2-CD1 3.65Å; I234-I238 HydrophobicContact CG2-CG1 4.41Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.47Å; I234-I238 PolarHBondContact O-N 2.93Å; E235-I238 PolarHBondContact O-N 3.29Å; I238-F240 PolarHBondContact O-N 3.17Å; I238-N241 CarbonylContact O-C 3.56Å; I238-N241 VanDerWaalsContact O-C 3.23Å; I238-N241 PolarHBondContact O-N 3.03Å; I238-K242 VanDerWaalsContact O-CA 3.28Å; I238-K242 WeakPolarHBondContact O-CA 3.37Å; I238-K242 PolarHBondContact O-N 3.33Å; I238-K242 VanDerWaalsContact O-N 3.12Å; I238-R245 HydrophobicContact CG2-CB 4.39Å; I238-A249 HydrophobicContact CD1-CB 3.8Å; I238-L252 HydrophobicContact CD1-CD1 4.48Å; I238-L252 HydrophobicContact CG1-CD1 4.48Å
239	N	95.3	Very high	93.4	Very high	101 Å²	101	64.1 Å²	64.1	54%	0.54	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-27	-175.3	-75.2	-36.7	0	0	0	113.4	E235 A236 N241	E235-N239 VanDerWaalsContact O-CB 3.27Å; E235-N239 WeakPolarHBondContact O-CB 3.33Å; E235-N239 PolarHBondContact O-N 3.16Å; E235-N239 PolarHBondContact O-ND2 3.04Å; A236-N239 PolarHBondContact O-N 3.48Å; N239-N241 VanDerWaalsContact C-N 3.32Å; N239-N241 PolarHBondContact O-N 2.66Å
240	F	96.1	Very high	93.8	Very high	100 Å²	100	66.9 Å²	66.9	44%	0.439	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-36.4	176.8	-177.3	-104.9	0	0	0	113.6	L209 H210 A236 I238	L209-F240 HydrophobicContact CB-CB 4.35Å; L209-F240 HydrophobicContact CB-CD1 4.03Å; L209-F240 HydrophobicContact CB-CD2 3.97Å; L209-F240 HydrophobicContact CB-CE1 4.3Å; L209-F240 HydrophobicContact CB-CE2 4.24Å; L209-F240 HydrophobicContact CB-CG 3.85Å; L209-F240 HydrophobicContact CB-CZ 4.4Å; L209-F240 HydrophobicContact CD1-CD2 3.73Å; L209-F240 HydrophobicContact CD1-CE2 4.11Å; L209-F240 HydrophobicContact CD1-CG 4.31Å; L209-F240 HydrophobicContact CD2-CB 4.11Å; L209-F240 HydrophobicContact CD2-CG 4.45Å; L209-F240 HydrophobicContact CG-CD2 4.3Å; L209-F240 HydrophobicContact CG-CG 4.42Å; H210-F240 AromaticContact CE1-CE1 3.87Å; H210-F240 AromaticContact CE1-CZ 3.49Å; H210-F240 VanDerWaalsContact CE1-CZ 3.49Å; H210-F240 WeakPolarHBondContact CE1-CZ 3.34Å; H210-F240 AromaticContact NE2-CE1 3.81Å; H210-F240 AromaticContact NE2-CZ 3.71Å; A236-F240 PolarHBondContact O-N 3.34Å; I238-F240 PolarHBondContact O-N 3.17Å
241	N	94.4	Very high	94	Very high	50 Å²	50	69.4 Å²	69.4	27%	0.267	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.3	69.4	173.4	-178	-1	0	0	0	109.6	I238 N239 E243 E244 R245	I238-N241 CarbonylContact O-C 3.56Å; I238-N241 VanDerWaalsContact O-C 3.23Å; I238-N241 PolarHBondContact O-N 3.03Å; N239-N241 VanDerWaalsContact C-N 3.32Å; N239-N241 PolarHBondContact O-N 2.66Å; N241-E243 VanDerWaalsContact C-N 3.3Å; N241-E243 PolarHBondContact O-N 3.08Å; N241-E244 PolarHBondContact ND2-OE2 3.13Å; N241-E244 PolarHBondContact O-N 3.37Å; N241-R245 HydrophobicContact CB-CG 4.25Å; N241-R245 WeakPolarHBondContact O-CB 3.35Å; N241-R245 VanDerWaalsContact O-CG 3.29Å; N241-R245 WeakPolarHBondContact O-CG 3.48Å; N241-R245 PolarHBondContact O-N 3.42Å
242	K	93.5	Very high	94.1	Very high	120 Å²	120	66.5 Å²	66.5	52%	0.522	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-38.6	-171.4	-171.2	172.3	-177.7	168.3	0	113.3	I238 E244 E246	I238-K242 VanDerWaalsContact O-CA 3.28Å; I238-K242 WeakPolarHBondContact O-CA 3.37Å; I238-K242 PolarHBondContact O-N 3.33Å; I238-K242 VanDerWaalsContact O-N 3.12Å; K242-E244 VanDerWaalsContact C-N 3.35Å; K242-E244 PolarHBondContact O-N 3.31Å; K242-E246 WeakPolarHBondContact CE-OE2 3.23Å; K242-E246 WeakPolarHBondContact CG-OE2 3.46Å; K242-E246 WeakPolarHBondContact O-CB 3.33Å; K242-E246 PolarHBondContact O-N 2.9Å; K242-E246 VanDerWaalsContact O-N 3.14Å
243	E	94.3	Very high	94.1	Very high	191 Å²	191	67.9 Å²	67.9	89%	0.893	34%	0.337	S	S	*	.	H	α-helix	trans	-60.3	-42.8	-176.4	-69	-171.3	164.5	0	0	112.6	N241	N241-E243 VanDerWaalsContact C-N 3.3Å; N241-E243 PolarHBondContact O-N 3.08Å
244	E	92.5	Very high	93.9	Very high	135 Å²	135	73 Å²	73	63%	0.631	37%	0.368	S	S	*	.	H	α-helix	trans	-89.9	-31.1	-179.1	-64.3	-178.3	161.2	0	0	112.6	N241 K242	N241-E244 PolarHBondContact ND2-OE2 3.13Å; N241-E244 PolarHBondContact O-N 3.37Å; K242-E244 VanDerWaalsContact C-N 3.35Å; K242-E244 PolarHBondContact O-N 3.31Å
245	R	95.2	Very high	93.7	Very high	28 Å²	28	74.6 Å²	74.6	11%	0.106	38%	0.38	C	S	.	.	H	α-helix	trans	-92.2	-16.6	-168.7	-63.8	176.9	175.1	-175.7	-1.6	115	L209 W237 I238 N241 A247 F248	L209-R245 VanDerWaalsContact O-CZ 3.3Å; L209-R245 PolarHBondContact O-NH1 2.73Å; L209-R245 PolarHBondContact O-NH2 2.79Å; W237-R245 VanDerWaalsContact CE2-NH1 3.34Å; W237-R245 HydrophobicContact CE3-CB 4.28Å; W237-R245 HydrophobicContact CE3-CG 4.23Å; W237-R245 HydrophobicContact CH2-CB 4.29Å; W237-R245 HydrophobicContact CH2-CG 3.66Å; W237-R245 HydrophobicContact CZ2-CG 4.36Å; W237-R245 HydrophobicContact CZ3-CB 3.74Å; W237-R245 VanDerWaalsContact CZ3-CD 3.47Å; W237-R245 HydrophobicContact CZ3-CG 3.6Å; W237-R245 VanDerWaalsContact O-CD 3.24Å; W237-R245 WeakPolarHBondContact O-CD 2.89Å; W237-R245 PolarHBondContact O-NH1 3.18Å; I238-R245 HydrophobicContact CG2-CB 4.39Å; N241-R245 HydrophobicContact CB-CG 4.25Å; N241-R245 WeakPolarHBondContact O-CB 3.35Å; N241-R245 VanDerWaalsContact O-CG 3.29Å; N241-R245 WeakPolarHBondContact O-CG 3.48Å; N241-R245 PolarHBondContact O-N 3.42Å; R245-A247 PolarHBondContact O-N 2.92Å; R245-A247 VanDerWaalsContact O-N 3.15Å; R245-F248 HydrophobicContact CB-CD2 4.44Å; R245-F248 PolarHBondContact O-N 2.88Å
246	E	93.5	Very high	93.5	Very high	94 Å²	94	72 Å²	72	44%	0.439	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-56.3	-33.1	177	-164.6	75.5	-152.1	0	0	111.6	K242 F248 A249	K242-E246 WeakPolarHBondContact CE-OE2 3.23Å; K242-E246 WeakPolarHBondContact CG-OE2 3.46Å; K242-E246 WeakPolarHBondContact O-CB 3.33Å; K242-E246 PolarHBondContact O-N 2.9Å; K242-E246 VanDerWaalsContact O-N 3.14Å; E246-F248 PolarHBondContact O-N 3.24Å; E246-A249 VanDerWaalsContact O-CB 3.29Å; E246-A249 WeakPolarHBondContact O-CB 3.41Å; E246-A249 PolarHBondContact O-N 3.47Å; E246-A249 VanDerWaalsContact O-N 3.14Å
247	A	93.7	Very high	92.8	Very high	88 Å²	88	74.8 Å²	74.8	73%	0.727	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24	177.5	0	0	0	0	0	113.7	R245	R245-A247 PolarHBondContact O-N 2.92Å; R245-A247 VanDerWaalsContact O-N 3.15Å
248	F	94.1	Very high	91.7	Very high	78 Å²	78	79.2 Å²	79.2	34%	0.342	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-91	-8.6	179.2	-55.9	-61.4	0	0	0	113.4	H213 W237 R245 E246 E250 S251 L252	H213-F248 AromaticContact CD2-CD1 3.7Å; H213-F248 AromaticContact CD2-CG 3.53Å; H213-F248 AromaticContact NE2-CD1 3.66Å; H213-F248 AromaticContact NE2-CG 3.84Å; W237-F248 HydrophobicContact CH2-CD2 4.23Å; W237-F248 HydrophobicContact CZ3-CD2 4.32Å; R245-F248 HydrophobicContact CB-CD2 4.44Å; R245-F248 PolarHBondContact O-N 2.88Å; E246-F248 PolarHBondContact O-N 3.24Å; F248-E250 PolarHBondContact O-N 3.49Å; F248-S251 WeakPolarHBondContact O-CB 3.29Å; F248-S251 PolarHBondContact O-N 3.04Å; F248-S251 VanDerWaalsContact O-N 3.13Å; F248-L252 HydrophobicContact CB-CD1 4.2Å; F248-L252 HydrophobicContact CB-CG 4.44Å; F248-L252 WeakPolarHBondContact O-CG 3.47Å; F248-L252 PolarHBondContact O-N 3.34Å
249	A	91.8	Very high	89.9	Confident	4 Å²	4	80.3 Å²	80.3	3%	0.033	40%	0.403	C	S	.	.	H	α-helix	trans	-56.6	-46.6	-172	0	0	0	0	0	112.8	I238 E246 L252 R253	I238-A249 HydrophobicContact CD1-CB 3.8Å; E246-A249 VanDerWaalsContact O-CB 3.29Å; E246-A249 WeakPolarHBondContact O-CB 3.41Å; E246-A249 PolarHBondContact O-N 3.47Å; E246-A249 VanDerWaalsContact O-N 3.14Å; A249-L252 PolarHBondContact O-N 3.4Å; A249-R253 WeakPolarHBondContact O-CB 3.47Å; A249-R253 VanDerWaalsContact O-CG 3.3Å; A249-R253 WeakPolarHBondContact O-CG 3.29Å; A249-R253 PolarHBondContact O-N 2.76Å
250	E	91.5	Very high	87.7	Confident	129 Å²	129	77.9 Å²	77.9	60%	0.603	40%	0.402	S	S	*	.	H	α-helix	trans	-67.5	-38.7	179.9	-166.5	61.6	-161.6	0	0	112	F248 R253 T254	F248-E250 PolarHBondContact O-N 3.49Å; E250-R253 PolarHBondContact O-N 2.99Å; E250-T254 WeakPolarHBondContact O-CB 3.27Å; E250-T254 PolarHBondContact O-N 3.43Å; E250-T254 PolarHBondContact O-OG1 2.96Å
251	S	93.6	Very high	85.5	Confident	55 Å²	55	75.6 Å²	75.6	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-45.9	177.1	-175.7	0	0	0	0	111.4	F248 T254 S255	F248-S251 WeakPolarHBondContact O-CB 3.29Å; F248-S251 PolarHBondContact O-N 3.04Å; F248-S251 VanDerWaalsContact O-N 3.13Å; S251-T254 PolarHBondContact O-N 2.9Å; S251-S255 VanDerWaalsContact O-CB 3.27Å; S251-S255 WeakPolarHBondContact O-CB 3.29Å; S251-S255 PolarHBondContact O-N 3.14Å; S251-S255 PolarHBondContact O-OG 3.39Å
252	L	93.7	Very high	82.9	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-66.3	-42.5	178.7	-69.3	170.6	0	0	0	111.4	L216 T217 I220 I234 W237 I238 F248 A249 T254 S255 L256	L216-L252 HydrophobicContact CD2-CD1 4.08Å; L216-L252 HydrophobicContact CD2-CD2 4.22Å; L216-L252 HydrophobicContact CG-CD2 4.23Å; T217-L252 WeakPolarHBondContact OG1-CD2 3.5Å; I220-L252 HydrophobicContact CD1-CB 4.06Å; I220-L252 HydrophobicContact CD1-CD2 3.66Å; I220-L252 HydrophobicContact CD1-CG 4.48Å; I220-L252 WeakPolarHBondContact CD1-O 3.37Å; I234-L252 HydrophobicContact CD1-CB 4.47Å; I234-L252 HydrophobicContact CG2-CB 4Å; I234-L252 HydrophobicContact CG2-CD1 4.09Å; W237-L252 HydrophobicContact CE3-CD1 4.08Å; W237-L252 HydrophobicContact CZ3-CD1 4.02Å; I238-L252 HydrophobicContact CD1-CD1 4.48Å; I238-L252 HydrophobicContact CG1-CD1 4.48Å; F248-L252 HydrophobicContact CB-CD1 4.2Å; F248-L252 HydrophobicContact CB-CG 4.44Å; F248-L252 WeakPolarHBondContact O-CG 3.47Å; F248-L252 PolarHBondContact O-N 3.34Å; A249-L252 PolarHBondContact O-N 3.4Å; L252-T254 PolarHBondContact O-N 3.36Å; L252-S255 PolarHBondContact O-N 3.15Å; L252-L256 WeakPolarHBondContact O-CB 3.19Å; L252-L256 PolarHBondContact O-N 3.48Å
253	R	90.1	Very high	80.4	Confident	124 Å²	124	72.1 Å²	72.1	47%	0.468	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-38.9	175.9	-74	178	-175.3	130.7	3.4	112.9	A249 E250	A249-R253 WeakPolarHBondContact O-CB 3.47Å; A249-R253 VanDerWaalsContact O-CG 3.3Å; A249-R253 WeakPolarHBondContact O-CG 3.29Å; A249-R253 PolarHBondContact O-N 2.76Å; E250-R253 PolarHBondContact O-N 2.99Å
254	T	90.6	Very high	77.9	Confident	107 Å²	107	64.9 Å²	64.9	66%	0.656	35%	0.346	S	S	*	.	H	α-helix	trans	-72.3	-33.9	177.7	-53.5	0	0	0	0	111.6	E250 S251 L252	E250-T254 WeakPolarHBondContact O-CB 3.27Å; E250-T254 PolarHBondContact O-N 3.43Å; E250-T254 PolarHBondContact O-OG1 2.96Å; S251-T254 PolarHBondContact O-N 2.9Å; L252-T254 PolarHBondContact O-N 3.36Å
255	S	90.6	Very high	75.5	Confident	39 Å²	39	58.7 Å²	58.7	27%	0.273	32%	0.317	S	S	.	.	H	α-helix	trans	-79.7	-21.6	178.8	-55.9	0	0	0	0	112.7	S221 S251 L252 K257	S221-S255 VanDerWaalsContact CA-O 3.31Å; S221-S255 WeakPolarHBondContact CA-O 3.25Å; S251-S255 VanDerWaalsContact O-CB 3.27Å; S251-S255 WeakPolarHBondContact O-CB 3.29Å; S251-S255 PolarHBondContact O-N 3.14Å; S251-S255 PolarHBondContact O-OG 3.39Å; L252-S255 PolarHBondContact O-N 3.15Å; S255-K257 PolarHBondContact O-N 2.81Å; S255-K257 VanDerWaalsContact O-N 3.12Å
256	L	90	Very high	73.2	Confident	32 Å²	32	57.9 Å²	57.9	17%	0.168	31%	0.314	C	S	.	.			trans	-61.5	115.7	179.9	174.3	60.4	0	0	0	110.3	I220 P230 I234 L252 E258	I220-L256 HydrophobicContact CB-CD1 3.95Å; I220-L256 HydrophobicContact CD1-CB 4.47Å; I220-L256 HydrophobicContact CG2-CD1 4.46Å; P230-L256 HydrophobicContact CB-CD1 3.64Å; P230-L256 HydrophobicContact CG-CD1 3.95Å; I234-L256 HydrophobicContact CD1-CB 4.22Å; I234-L256 HydrophobicContact CD1-CD1 4.34Å; I234-L256 HydrophobicContact CD1-CD2 4Å; I234-L256 HydrophobicContact CD1-CG 4.41Å; L252-L256 WeakPolarHBondContact O-CB 3.19Å; L252-L256 PolarHBondContact O-N 3.48Å; L256-E258 HydrophobicContact CD1-CG 3.99Å; L256-E258 HydrophobicContact CD2-CG 3.9Å; L256-E258 HydrophobicContact CG-CG 3.87Å
257	K	81.8	Confident	71	Confident	84 Å²	84	54 Å²	54	37%	0.365	30%	0.297	S	S	.	.			trans	-105	100.6	168.5	-169.8	-179.7	-170.4	-174.9	0	107.4	I220 G223 V224 S255 E286	I220-K257 PolarHBondContact O-N 3.26Å; G223-K257 CarbonylContact C-O 3.53Å; G223-K257 WeakPolarHBondContact CA-O 3.43Å; V224-K257 PolarHBondContact N-O 3.3Å; S255-K257 PolarHBondContact O-N 2.81Å; S255-K257 VanDerWaalsContact O-N 3.12Å; K257-E286 VanDerWaalsContact CE-CD 3.47Å; K257-E286 WeakPolarHBondContact CE-OE1 3.4Å; K257-E286 IonicContact NZ-OE1 3.67Å; K257-E286 PolarHBondContact NZ-OE1 3.12Å; K257-E286 IonicContact NZ-OE2 2.76Å; K257-E286 PolarHBondContact NZ-OE2 3.42Å
258	E	72.4	Confident	68.9	Low	97 Å²	97	49.9 Å²	49.9	45%	0.453	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.4	169.2	-65.1	-167.2	-175.8	0	0	108.9	P230 T231 L256	P230-E258 HydrophobicContact CG-CG 3.79Å; T231-E258 PolarHBondContact OG1-OE1 2.82Å; L256-E258 HydrophobicContact CD1-CG 3.99Å; L256-E258 HydrophobicContact CD2-CG 3.9Å; L256-E258 HydrophobicContact CG-CG 3.87Å
259	I	59.8	Low	66.7	Low	31 Å²	31	46.3 Å²	46.3	16%	0.159	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	142.4	170	59	173.4	0	0	0	108.8	G223 V224 P225 C226 E286	G223-I259 WeakPolarHBondContact O-CD1 3.28Å; G223-I259 WeakPolarHBondContact O-CG1 3.34Å; V224-I259 VanDerWaalsContact C-CG1 3.43Å; V224-I259 WeakPolarHBondContact O-CG1 3.23Å; V224-I259 PolarHBondContact O-N 3.23Å; P225-I259 WeakPolarHBondContact CA-O 3.28Å; P225-I259 HydrophobicContact CG-CD1 4.47Å; C226-I259 PolarHBondContact N-O 2.77Å; I259-E286 HydrophobicContact CG2-CG 4.24Å
260	G	49.6	Very low	64.4	Low	50 Å²	50	50.2 Å²	50.2	52%	0.515	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-55.4	146.7	161.9	0	0	0	0	0	108.7
261	E	48.2	Very low	62	Low	52 Å²	52	46.4 Å²	46.4	24%	0.243	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-57.3	157.5	179.5	-50	-177.4	-165.8	0	0	110.6	S227 V263 N498	S227-E261 WeakPolarHBondContact CB-OE1 3.28Å; S227-E261 WeakPolarHBondContact OG-CG 3.31Å; S227-E261 PolarHBondContact OG-OE1 3.04Å; E261-V263 VanDerWaalsContact C-N 3.29Å; E261-V263 WeakPolarHBondContact O-CG2 3.32Å; E261-V263 PolarHBondContact O-N 2.88Å; E261-N498 HydrophobicContact CB-CB 4.23Å; E261-N498 VanDerWaalsContact CB-ND2 3.28Å; E261-N498 WeakPolarHBondContact CB-ND2 3.33Å; E261-N498 WeakPolarHBondContact CB-OD1 3.27Å; E261-N498 HydrophobicContact CG-CB 3.65Å; E261-N498 WeakPolarHBondContact CG-ND2 3.4Å; E261-N498 VanDerWaalsContact OE1-CB 3.29Å; E261-N498 WeakPolarHBondContact OE1-CB 3.46Å; E261-N498 PolarHBondContact OE2-ND2 3.11Å
262	N	41.6	Very low	59.6	Low	90 Å²	90	48.5 Å²	48.5	48%	0.481	26%	0.261	S	S	.	.			trans	-60.2	95.7	166	-75	-26.3	0	0	0	108.9	H264	N262-H264 PolarHBondContact O-CD2 3.42Å; N262-H264 PolarHBondContact O-N 2.81Å
263	V	39.3	Very low	57.1	Low	7 Å²	7	52.8 Å²	52.8	4%	0.042	29%	0.291	C	S	.	.			trans	-75.2	92.3	176.1	177.9	0	0	0	0	108.4	E261 I265 L282 C284 C497 N498	E261-V263 VanDerWaalsContact C-N 3.29Å; E261-V263 WeakPolarHBondContact O-CG2 3.32Å; E261-V263 PolarHBondContact O-N 2.88Å; V263-I265 HydrophobicContact CG1-CD1 3.32Å; V263-I265 HydrophobicContact CG1-CG1 3.57Å; V263-I265 PolarHBondContact O-N 3.35Å; V263-L282 CarbonylContact C-O 3.58Å; V263-L282 CarbonylContact O-C 3.56Å; V263-C284 HydrophobicContact CB-CB 4.17Å; V263-C284 HydrophobicContact CG2-CB 4.47Å; V263-C497 HydrophobicContact CG1-CB 4.26Å; V263-N498 VanDerWaalsContact CG2-OD1 3.23Å; V263-N498 WeakPolarHBondContact CG2-OD1 3.37Å
264	H	41.5	Very low	54.9	Low	38 Å²	38	54 Å²	54	18%	0.176	30%	0.296	C	S	.	.			trans	-78	93	169	-65.7	-84.4	0	0	0	109.5	N262 Y266 S281 L282 H283 N328	N262-H264 PolarHBondContact O-CD2 3.42Å; N262-H264 PolarHBondContact O-N 2.81Å; H264-Y266 HydrophobicContact CB-CE2 4.22Å; H264-S281 PolarHBondContact ND1-OG 3.06Å; H264-L282 WeakPolarHBondContact CA-O 3.35Å; H264-H283 AromaticContact CE1-CE1 3.56Å; H264-H283 AromaticContact CE1-ND1 3.87Å; H264-H283 AromaticContact ND1-CE1 3.95Å; H264-N328 PolarHBondContact CD2-ND2 3.38Å; H264-N328 PolarHBondContact CE1-ND2 3.14Å; H264-N328 PolarHBondContact CE1-OD1 3.21Å; H264-N328 PolarHBondContact ND1-OD1 3.13Å; H264-N328 PolarHBondContact NE2-ND2 3.3Å
265	I	43	Very low	52.3	Low	6 Å²	6	53.2 Å²	53.2	3%	0.031	29%	0.29	C	S	.	.			trans	-98.4	120.2	166.6	-64.7	144.7	0	0	0	107.3	V263 L267 L282 F504 L542	V263-I265 HydrophobicContact CG1-CD1 3.32Å; V263-I265 HydrophobicContact CG1-CG1 3.57Å; V263-I265 PolarHBondContact O-N 3.35Å; I265-L267 HydrophobicContact CG2-CD2 4.17Å; I265-L267 HydrophobicContact CG2-CG 4.31Å; I265-L282 HydrophobicContact CB-CB 4.06Å; I265-L282 HydrophobicContact CB-CD1 3.63Å; I265-L282 HydrophobicContact CB-CG 4.11Å; I265-L282 HydrophobicContact CD1-CD1 3.95Å; I265-L282 HydrophobicContact CG1-CD1 4.46Å; I265-L282 HydrophobicContact CG2-CD1 3.8Å; I265-L282 WeakPolarHBondContact O-CB 3.18Å; I265-L282 WeakPolarHBondContact O-CG 3.28Å; I265-L282 PolarHBondContact O-N 2.58Å; I265-F504 HydrophobicContact CD1-CE1 3.74Å; I265-F504 HydrophobicContact CD1-CE2 4.42Å; I265-F504 HydrophobicContact CD1-CZ 3.34Å; I265-F504 HydrophobicContact CG1-CZ 4.09Å; I265-F504 HydrophobicContact CG2-CZ 4.38Å; I265-L542 HydrophobicContact CG2-CD1 3.91Å; I265-L542 HydrophobicContact CG2-CG 4.02Å
266	Y	46.8	Very low	49.8	Very low	11 Å²	11	54.9 Å²	54.9	4%	0.043	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114.4	174.2	-66.7	-83.3	0	0	0	110.5	H264 V280 L312 N328	H264-Y266 HydrophobicContact CB-CE2 4.22Å; Y266-V280 CarbonylContact C-O 3.56Å; Y266-V280 WeakPolarHBondContact CA-O 3.09Å; Y266-L312 HydrophobicContact CD1-CD2 3.53Å; Y266-L312 HydrophobicContact CD1-CG 4.46Å; Y266-L312 HydrophobicContact CD2-CB 4.29Å; Y266-L312 HydrophobicContact CD2-CD1 3.85Å; Y266-L312 HydrophobicContact CD2-CD2 4.21Å; Y266-L312 HydrophobicContact CD2-CG 4.33Å; Y266-L312 HydrophobicContact CE1-CB 4.28Å; Y266-L312 HydrophobicContact CE1-CD2 3.81Å; Y266-L312 HydrophobicContact CE2-CB 3.97Å; Y266-L312 HydrophobicContact CE2-CD1 4.36Å; Y266-L312 HydrophobicContact CE2-CD2 4.49Å; Y266-L312 HydrophobicContact CE2-CG 4.5Å; Y266-L312 HydrophobicContact CG-CD1 3.94Å; Y266-L312 HydrophobicContact CG-CD2 3.66Å; Y266-L312 HydrophobicContact CG-CG 4.25Å; Y266-N328 WeakPolarHBondContact OH-CB 3.27Å; Y266-N328 PolarHBondContact OH-OD1 2.79Å
267	L	46.7	Very low	47.5	Very low	12 Å²	12	53.6 Å²	53.6	6%	0.063	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.7	169.8	-61.3	171.4	0	0	0	108.2	I265 L278 V280 L282 V533 L535	I265-L267 HydrophobicContact CG2-CD2 4.17Å; I265-L267 HydrophobicContact CG2-CG 4.31Å; L267-L278 VanDerWaalsContact O-O 3.09Å; L267-V280 HydrophobicContact CB-CB 4.25Å; L267-V280 PolarHBondContact N-O 2.92Å; L267-V280 PolarHBondContact O-N 3.01Å; L267-L282 HydrophobicContact CD1-CD1 3.73Å; L267-L282 HydrophobicContact CD1-CD2 4.12Å; L267-L282 HydrophobicContact CD1-CG 4.12Å; L267-L282 HydrophobicContact CG-CD1 4.08Å; L267-L282 HydrophobicContact CG-CG 4.42Å; L267-V533 HydrophobicContact CD1-CB 4.44Å; L267-V533 HydrophobicContact CD1-CG1 4.23Å; L267-V533 HydrophobicContact CD1-CG2 3.95Å; L267-L535 HydrophobicContact CB-CD1 4.28Å
268	I	50.1	Low	45.7	Very low	1 Å²	1	51.6 Å²	51.6	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.4	176.3	-24.4	176.9	0	0	0	111	L278 A279 I302 A305 L312 V314	I268-L278 VanDerWaalsContact CA-O 3.28Å; I268-L278 WeakPolarHBondContact CA-O 3.29Å; I268-L278 VanDerWaalsContact CG2-O 3.3Å; I268-L278 WeakPolarHBondContact CG2-O 3.35Å; I268-A279 HydrophobicContact CG1-CB 4.35Å; I268-A279 HydrophobicContact CG2-CB 4.01Å; I268-I302 HydrophobicContact CB-CD1 3.74Å; I268-I302 HydrophobicContact CD1-CD1 4.31Å; I268-I302 HydrophobicContact CG2-CD1 3Å; I268-I302 HydrophobicContact CG2-CG1 4.48Å; I268-A305 HydrophobicContact CD1-CB 3.94Å; I268-L312 HydrophobicContact CD1-CD2 4.24Å; I268-V314 HydrophobicContact CD1-CB 4.35Å; I268-V314 HydrophobicContact CD1-CG1 3.92Å; I268-V314 HydrophobicContact CD1-CG2 3.45Å; I268-V314 VanDerWaalsContact CD1-CG2 3.45Å
269	G	47.6	Very low	44.2	Very low	4 Å²	4	47.7 Å²	47.7	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	170	-177.5	0	0	0	0	0	113.8	S277 L278	G269-S277 VanDerWaalsContact O-CA 3.31Å; G269-S277 WeakPolarHBondContact O-CA 3.28Å; G269-L278 PolarHBondContact N-O 2.93Å; G269-L278 PolarHBondContact O-N 3.34Å
270	K	43.7	Very low	43.3	Very low	85 Å²	85	46.4 Å²	46.4	37%	0.37	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.5	-177.2	-178.5	-173.3	178.8	-171.5	0	111	N537	K270-N537 WeakPolarHBondContact O-CB 3.48Å; K270-N537 PolarHBondContact O-ND2 2.77Å
271	E	42.2	Very low	42.7	Very low	50 Å²	50	44.2 Å²	44.2	23%	0.234	24%	0.235	C	C	.	.			trans	-66.1	135.4	170.3	-165.2	-178.3	-177	0	0	109.9	S273 R274	E271-S273 WeakPolarHBondContact CG-OG 3.25Å; E271-S273 PolarHBondContact O-N 2.99Å; E271-S273 VanDerWaalsContact O-N 3.07Å; E271-S273 PolarHBondContact OE1-OG 2.79Å; E271-R274 HydrophobicContact CB-CB 4.18Å; E271-R274 HydrophobicContact CB-CG 4.19Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 WeakPolarHBondContact OE2-CD 3.49Å; E271-R274 WeakPolarHBondContact OE2-CG 3.45Å; E271-R274 IonicContact OE2-CZ 2.61Å; E271-R274 IonicContact OE2-NE 3.69Å; E271-R274 PolarHBondContact OE2-NE 3.31Å
272	S	42.2	Very low	42.2	Very low	98 Å²	98	42 Å²	42	69%	0.685	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.6	-178.1	26.5	0	0	0	0	114.3	T536	S272-T536 PolarHBondContact OG-OG1 3.21Å
273	S	42.1	Very low	42.2	Very low	91 Å²	91	39.7 Å²	39.7	64%	0.636	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-8.7	177.2	58.6	0	0	0	0	114.4	E271	E271-S273 WeakPolarHBondContact CG-OG 3.25Å; E271-S273 PolarHBondContact O-N 2.99Å; E271-S273 VanDerWaalsContact O-N 3.07Å; E271-S273 PolarHBondContact OE1-OG 2.79Å
274	R	42.3	Very low	42	Very low	150 Å²	150	41.8 Å²	41.8	57%	0.566	23%	0.225	S	C	*	.			trans	-117	152.4	-174.7	-62.3	-170.1	-170.5	-153.2	-4.4	112.9	E271	E271-R274 HydrophobicContact CB-CB 4.18Å; E271-R274 HydrophobicContact CB-CG 4.19Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 WeakPolarHBondContact OE2-CD 3.49Å; E271-R274 WeakPolarHBondContact OE2-CG 3.45Å; E271-R274 IonicContact OE2-CZ 2.61Å; E271-R274 IonicContact OE2-NE 3.69Å; E271-R274 PolarHBondContact OE2-NE 3.31Å
275	T	37.6	Very low	41.9	Very low	89 Å²	89	42.4 Å²	42.4	55%	0.546	24%	0.238	S	C	.	.	S	Bend	trans	-84.8	-6.9	178	46.2	0	0	0	0	113.7
276	H	38.3	Very low	41.6	Very low	74 Å²	74	47.3 Å²	47.3	34%	0.343	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.4	-170.5	-54.5	-32.9	0	0	0	111.8	S297 L298	H276-S297 WeakPolarHBondContact CD2-CB 3.04Å; H276-S297 PolarHBondContact CD2-OG 3.45Å; H276-S297 VanDerWaalsContact CD2-OG 3.23Å; H276-L298 CarbonylContact C-O 3.57Å; H276-L298 WeakPolarHBondContact CA-O 3.18Å
277	S	41	Very low	40.8	Very low	6 Å²	6	53 Å²	53	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	137.6	172.1	-55	0	0	0	0	109.5	G269 L298	G269-S277 VanDerWaalsContact O-CA 3.31Å; G269-S277 WeakPolarHBondContact O-CA 3.28Å; S277-L298 PolarHBondContact N-O 2.67Å
278	L	42.6	Very low	40.3	Very low	42 Å²	42	56.4 Å²	56.4	22%	0.22	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125	179.5	-176.6	71.7	0	0	0	108.9	L267 I268 G269 V280 L535	L267-L278 VanDerWaalsContact O-O 3.09Å; I268-L278 VanDerWaalsContact CA-O 3.28Å; I268-L278 WeakPolarHBondContact CA-O 3.29Å; I268-L278 VanDerWaalsContact CG2-O 3.3Å; I268-L278 WeakPolarHBondContact CG2-O 3.35Å; G269-L278 PolarHBondContact N-O 2.93Å; G269-L278 PolarHBondContact O-N 3.34Å; L278-V280 HydrophobicContact CB-CG2 4.49Å; L278-V280 HydrophobicContact CD2-CG2 3.33Å; L278-V280 HydrophobicContact CG-CG2 3.59Å; L278-L535 HydrophobicContact CB-CD2 4.32Å
279	A	41.1	Very low	39.3	Very low	14 Å²	14	59.3 Å²	59.3	12%	0.116	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.3	163.9	0	0	0	0	0	108.2	I268 W333	I268-A279 HydrophobicContact CG1-CB 4.35Å; I268-A279 HydrophobicContact CG2-CB 4.01Å; A279-W333 HydrophobicContact CB-CH2 3.92Å; A279-W333 HydrophobicContact CB-CZ2 3.67Å
280	V	41.1	Very low	38.7	Very low	4 Å²	4	61.1 Å²	61.1	2%	0.024	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	110.9	179.3	-177.1	0	0	0	0	107.7	Y266 L267 L278 L282 L535	Y266-V280 CarbonylContact C-O 3.56Å; Y266-V280 WeakPolarHBondContact CA-O 3.09Å; L267-V280 HydrophobicContact CB-CB 4.25Å; L267-V280 PolarHBondContact N-O 2.92Å; L267-V280 PolarHBondContact O-N 3.01Å; L278-V280 HydrophobicContact CB-CG2 4.49Å; L278-V280 HydrophobicContact CD2-CG2 3.33Å; L278-V280 HydrophobicContact CG-CG2 3.59Å; V280-L282 HydrophobicContact CG1-CD2 4.08Å; V280-L282 PolarHBondContact O-N 3.49Å; V280-L535 HydrophobicContact CG2-CD1 4.5Å
281	S	37.9	Very low	38.1	Very low	5 Å²	5	60.2 Å²	60.2	4%	0.035	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	114.4	160.1	173.1	0	0	0	0	107.4	H264 H283	H264-S281 PolarHBondContact ND1-OG 3.06Å; S281-H283 PolarHBondContact OG-NE2 3.46Å
282	L	37.5	Very low	37.8	Very low	6 Å²	6	61 Å²	61	3%	0.031	35%	0.351	C	S	.	.			trans	-71.6	130.1	166.7	-64.1	177.3	0	0	0	107.5	V263 H264 I265 L267 V280 I290 I531	V263-L282 CarbonylContact C-O 3.58Å; V263-L282 CarbonylContact O-C 3.56Å; H264-L282 WeakPolarHBondContact CA-O 3.35Å; I265-L282 HydrophobicContact CB-CB 4.06Å; I265-L282 HydrophobicContact CB-CD1 3.63Å; I265-L282 HydrophobicContact CB-CG 4.11Å; I265-L282 HydrophobicContact CD1-CD1 3.95Å; I265-L282 HydrophobicContact CG1-CD1 4.46Å; I265-L282 HydrophobicContact CG2-CD1 3.8Å; I265-L282 WeakPolarHBondContact O-CB 3.18Å; I265-L282 WeakPolarHBondContact O-CG 3.28Å; I265-L282 PolarHBondContact O-N 2.58Å; L267-L282 HydrophobicContact CD1-CD1 3.73Å; L267-L282 HydrophobicContact CD1-CD2 4.12Å; L267-L282 HydrophobicContact CD1-CG 4.12Å; L267-L282 HydrophobicContact CG-CD1 4.08Å; L267-L282 HydrophobicContact CG-CG 4.42Å; V280-L282 HydrophobicContact CG1-CD2 4.08Å; V280-L282 PolarHBondContact O-N 3.49Å; L282-I290 HydrophobicContact CD2-CB 4.38Å; L282-I290 HydrophobicContact CD2-CD1 3.49Å; L282-I290 VanDerWaalsContact CD2-CD1 3.49Å; L282-I290 HydrophobicContact CD2-CG1 3.8Å; L282-I290 HydrophobicContact CD2-CG2 3.63Å; L282-I531 HydrophobicContact CD1-CG2 3.95Å; L282-I531 HydrophobicContact CD2-CG2 4.47Å
283	H	40.7	Very low	37.5	Very low	41 Å²	41	58 Å²	58	19%	0.19	33%	0.33	C	S	.	.			trans	-110.1	122	169.2	-70.6	-86.8	0	0	0	106.8	H264 S281 A285 S291 S293	H264-H283 AromaticContact CE1-CE1 3.56Å; H264-H283 AromaticContact CE1-ND1 3.87Å; H264-H283 AromaticContact ND1-CE1 3.95Å; S281-H283 PolarHBondContact OG-NE2 3.46Å; H283-A285 PolarHBondContact O-N 2.82Å; H283-S291 PolarHBondContact CD2-OG 3.01Å; H283-S293 PolarHBondContact NE2-OG 3.26Å
284	C	36.5	Very low	37.4	Very low	50 Å²	50	55.2 Å²	55.2	34%	0.338	32%	0.315	S	S	.	.			trans	-95.3	81.2	171.5	-157.4	0	0	0	0	107.9	V263	V263-C284 HydrophobicContact CB-CB 4.17Å; V263-C284 HydrophobicContact CG2-CB 4.47Å
285	A	37.7	Very low	37.2	Very low	52 Å²	52	56 Å²	56	43%	0.43	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-91.4	168.4	168.8	0	0	0	0	0	110.4	H283 D287 D288	H283-A285 PolarHBondContact O-N 2.82Å; A285-D287 PolarHBondContact O-N 2.78Å; A285-D288 PolarHBondContact O-N 3.16Å
286	E	37.1	Very low	37.5	Very low	108 Å²	108	55.6 Å²	55.6	51%	0.505	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-11.9	-164.5	-61.5	-177.4	158.2	0	0	118.1	K257 I259	K257-E286 VanDerWaalsContact CE-CD 3.47Å; K257-E286 WeakPolarHBondContact CE-OE1 3.4Å; K257-E286 IonicContact NZ-OE1 3.67Å; K257-E286 PolarHBondContact NZ-OE1 3.12Å; K257-E286 IonicContact NZ-OE2 2.76Å; K257-E286 PolarHBondContact NZ-OE2 3.42Å; I259-E286 HydrophobicContact CG2-CG 4.24Å
287	D	31.5	Very low	37.8	Very low	131 Å²	131	55.8 Å²	55.8	70%	0.701	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	17.1	-172.5	-58	-26.2	0	0	0	114.2	A285 S289	A285-D287 PolarHBondContact O-N 2.78Å; D287-S289 PolarHBondContact O-N 3.21Å
288	D	34.9	Very low	38.1	Very low	83 Å²	83	55.9 Å²	55.9	44%	0.444	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	24.7	-170.4	-71.9	-33.7	0	0	0	112.5	A285	A285-D288 PolarHBondContact O-N 3.16Å
289	S	28.8	Very low	37.9	Very low	63 Å²	63	55.6 Å²	55.6	44%	0.441	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-98.1	119.6	-176.5	70.3	0	0	0	0	111.5	D287	D287-S289 PolarHBondContact O-N 3.21Å
290	I	35.2	Very low	38.3	Very low	41 Å²	41	59.5 Å²	59.5	21%	0.21	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-84.8	122	174.5	-63.3	159.3	0	0	0	109.2	L282 I531 K532	L282-I290 HydrophobicContact CD2-CB 4.38Å; L282-I290 HydrophobicContact CD2-CD1 3.49Å; L282-I290 VanDerWaalsContact CD2-CD1 3.49Å; L282-I290 HydrophobicContact CD2-CG1 3.8Å; L282-I290 HydrophobicContact CD2-CG2 3.63Å; I290-I531 HydrophobicContact CD1-CB 4.24Å; I290-I531 HydrophobicContact CD1-CG2 3.96Å; I290-K532 HydrophobicContact CD1-CB 4.22Å
291	S	32.7	Very low	39.3	Very low	67 Å²	67	63.8 Å²	63.8	47%	0.469	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-96.7	142.9	164.1	59.7	0	0	0	0	110.5	H283	H283-S291 PolarHBondContact CD2-OG 3.01Å
292	V	35.4	Very low	40.7	Very low	66 Å²	66	64.3 Å²	64.3	40%	0.4	37%	0.369	S	S	.	.			trans	-96.3	116	174.3	178.5	0	0	0	0	107.6	L534	V292-L534 HydrophobicContact CG2-CD1 4.28Å
293	S	35.6	Very low	42.5	Very low	36 Å²	36	64.7 Å²	64.7	25%	0.252	37%	0.371	S	S	.	.			trans	-111.2	132.4	171.1	57.7	0	0	0	0	109.6	H283	H283-S293 PolarHBondContact NE2-OG 3.26Å
294	G	39.2	Very low	44.3	Very low	31 Å²	31	62.9 Å²	62.9	32%	0.32	36%	0.363	S	S	.	.			trans	84.9	116	178.9	0	0	0	0	0	114.8	V331	G294-V331 VanDerWaalsContact CA-CG1 3.47Å
295	Q	39.6	Very low	46.4	Very low	166 Å²	166	60.8 Å²	60.8	78%	0.776	35%	0.349	S	S	*	.			trans	-115.4	113.2	166.1	-72.8	-179.6	-2.1	0	0	107.6
296	N	43.2	Very low	48.5	Very low	82 Å²	82	58.7 Å²	58.7	44%	0.439	33%	0.331	S	S	.	.			trans	-124.6	133.6	163.9	-142.6	-17.1	0	0	0	109.2	L298	N296-L298 PolarHBondContact O-N 2.74Å
297	S	43.5	Very low	50.5	Low	78 Å²	78	57.8 Å²	57.8	55%	0.545	33%	0.326	S	S	.	.			trans	-74.1	72.2	179.7	-65.5	0	0	0	0	109.8	H276 C299	H276-S297 WeakPolarHBondContact CD2-CB 3.04Å; H276-S297 PolarHBondContact CD2-OG 3.45Å; H276-S297 VanDerWaalsContact CD2-OG 3.23Å; S297-C299 VanDerWaalsContact C-N 3.34Å; S297-C299 PolarHBondContact O-N 3.41Å
298	L	48	Very low	53	Low	8 Å²	8	52 Å²	52	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	96.4	170.9	-69.3	174.2	0	0	0	107.3	H276 S277 N296 H300 I302 W324 W333	H276-L298 CarbonylContact C-O 3.57Å; H276-L298 WeakPolarHBondContact CA-O 3.18Å; S277-L298 PolarHBondContact N-O 2.67Å; N296-L298 PolarHBondContact O-N 2.74Å; L298-H300 PolarHBondContact O-N 3.02Å; L298-I302 HydrophobicContact CD1-CD1 4.43Å; L298-W324 HydrophobicContact CD2-CD2 4.11Å; L298-W324 HydrophobicContact CD2-CG 4.38Å; L298-W324 HydrophobicContact CD2-CZ2 4.28Å; L298-W333 HydrophobicContact CD1-CH2 4.24Å; L298-W333 HydrophobicContact CD1-CZ3 4.37Å
299	C	38.8	Very low	55.2	Low	36 Å²	36	50.8 Å²	50.8	24%	0.243	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	126.6	-179.6	111	0	0	0	0	108.4	S297 G317 S318	S297-C299 VanDerWaalsContact C-N 3.34Å; S297-C299 PolarHBondContact O-N 3.41Å; C299-G317 CarbonylContact O-C 3.55Å; C299-G317 WeakPolarHBondContact O-CA 3.22Å; C299-S318 WeakPolarHBondContact O-CA 3.42Å; C299-S318 PolarHBondContact O-N 3.43Å; C299-S318 WeakPolarHBondContact SG-CB 3.19Å; C299-S318 PolarHBondContact SG-OG 2.95Å
300	H	50.2	Low	57.3	Low	96 Å²	96	50.1 Å²	50.1	44%	0.444	31%	0.305	S	S	.	.	S	Bend	trans	65.9	150.8	170.5	-63.6	-74.1	0	0	0	119.7	L298 G317	L298-H300 PolarHBondContact O-N 3.02Å; H300-G317 CarbonylContact C-O 3.48Å; H300-G317 CarbonylContact O-C 3.54Å; H300-G317 WeakPolarHBondContact O-CA 3.46Å; H300-G317 PolarHBondContact O-N 2.76Å; H300-G317 VanDerWaalsContact O-O 3.08Å
301	Q	60.5	Low	59.4	Low	94 Å²	94	49.6 Å²	49.6	44%	0.439	30%	0.302	S	S	.	.			trans	0.6	111.2	176.5	-145.4	169.2	-14.3	0	0	119.3	G317 Q539	Q301-G317 PolarHBondContact O-N 2.98Å; Q301-Q539 VanDerWaalsContact CG-OE1 3.26Å
302	I	68.4	Low	61.4	Low	16 Å²	16	46.4 Å²	46.4	8%	0.082	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138	166.1	-70.5	164.9	0	0	0	109.1	I268 L298 V314 V541	I268-I302 HydrophobicContact CB-CD1 3.74Å; I268-I302 HydrophobicContact CD1-CD1 4.31Å; I268-I302 HydrophobicContact CG2-CD1 3Å; I268-I302 HydrophobicContact CG2-CG1 4.48Å; L298-I302 HydrophobicContact CD1-CD1 4.43Å; I302-V314 HydrophobicContact CB-CG1 4.46Å; I302-V314 HydrophobicContact CD1-CG1 3.82Å; I302-V314 HydrophobicContact CG1-CG1 3.92Å; I302-V314 HydrophobicContact CG2-CG1 3.7Å; I302-V541 HydrophobicContact CG2-CG2 4.09Å
303	T	74.3	Confident	63.6	Low	14 Å²	14	43.4 Å²	43.4	9%	0.086	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-33.3	-171.9	62.8	0	0	0	0	112.3	V315 P320 L344 H346	T303-V315 PolarHBondContact N-O 3.28Å; T303-V315 PolarHBondContact OG1-O 3.12Å; T303-P320 HydrophobicContact CG2-CB 4.22Å; T303-L344 HydrophobicContact CG2-CD2 3.6Å; T303-H346 PolarHBondContact OG1-CE1 2.95Å
304	A	79.6	Confident	65.6	Low	3 Å²	3	41.8 Å²	41.8	3%	0.025	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	165	173.3	0	0	0	0	0	110.9	V315 H346 L348	A304-V315 PolarHBondContact N-O 3.28Å; A304-V315 PolarHBondContact O-N 2.91Å; A304-H346 VanDerWaalsContact CB-NE2 3.28Å; A304-H346 WeakPolarHBondContact CB-NE2 3.33Å; A304-L348 HydrophobicContact CB-CB 3.57Å; A304-L348 HydrophobicContact CB-CD2 4.32Å; A304-L348 HydrophobicContact CB-CG 4.48Å
305	A	79.7	Confident	67.6	Low	5 Å²	5	40.3 Å²	40.3	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	154.5	175.8	0	0	0	0	0	109.4	I268 Y313 V314 V541 A543	I268-A305 HydrophobicContact CD1-CB 3.94Å; A305-Y313 CarbonylContact C-O 3.56Å; A305-Y313 WeakPolarHBondContact CA-O 3.06Å; A305-Y313 WeakPolarHBondContact CB-O 2.73Å; A305-V314 HydrophobicContact CB-CG1 4.49Å; A305-V314 HydrophobicContact CB-CG2 4.23Å; A305-V541 HydrophobicContact CB-CB 3.85Å; A305-V541 HydrophobicContact CB-CG1 3.65Å; A305-V541 VanDerWaalsContact N-CG1 3.29Å; A305-V541 WeakPolarHBondContact O-CG1 3.41Å; A305-A543 HydrophobicContact CB-CB 4.47Å
306	C	82.1	Confident	69.3	Low	8 Å²	8	32.4 Å²	32.4	5%	0.054	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	155.6	173.1	68.4	0	0	0	0	110.5	Y313 L348 I357	C306-Y313 PolarHBondContact N-O 2.73Å; C306-Y313 PolarHBondContact O-N 2.66Å; C306-L348 HydrophobicContact CB-CD2 4.17Å; C306-L348 HydrophobicContact CB-CG 4.25Å; C306-L348 VanDerWaalsContact SG-CD2 3.58Å; C306-I357 WeakPolarHBondContact SG-CG2 3.35Å
307	K	78.8	Confident	70.2	Confident	89 Å²	89	28.9 Å²	28.9	39%	0.387	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136.1	168.9	-178.1	-180	176.1	-179.1	0	110.6	G309 S350 A543	K307-G309 WeakPolarHBondContact CE-O 3.47Å; K307-S350 WeakPolarHBondContact O-CB 3.28Å; K307-S350 PolarHBondContact O-OG 2.76Å; K307-A543 HydrophobicContact CB-CB 4.45Å; K307-A543 WeakPolarHBondContact CB-OXT 2.67Å
308	H	84.6	Confident	70.8	Confident	11 Å²	11	28.1 Å²	28.1	5%	0.051	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	121.5	172.3	-172.8	93.1	0	0	0	109.9	G310 D311 Y313 S350 D355 A356 I357	H308-G310 PolarHBondContact O-N 3.21Å; H308-D311 PolarHBondContact N-O 3.19Å; H308-D311 PolarHBondContact O-N 3.5Å; H308-D311 VanDerWaalsContact O-N 3.12Å; H308-Y313 HydrophobicContact CB-CD2 3.81Å; H308-Y313 HydrophobicContact CB-CE2 3.69Å; H308-S350 PolarHBondContact ND1-OG 2.81Å; H308-D355 IonicContact CD2-OD1 2.65Å; H308-D355 IonicContact NE2-OD1 2.95Å; H308-D355 PolarHBondContact NE2-OD1 3.28Å; H308-D355 VanDerWaalsContact NE2-OD1 3.12Å; H308-A356 PolarHBondContact CE1-N 2.93Å; H308-I357 HydrophobicContact CB-CD1 3.78Å; H308-I357 HydrophobicContact CB-CG1 3.95Å
309	G	81.9	Confident	71.7	Confident	57 Å²	57	30.5 Å²	30.5	59%	0.588	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	-128.6	-169.3	0	0	0	0	0	111.6	K307	K307-G309 WeakPolarHBondContact CE-O 3.47Å
310	G	73	Confident	73.4	Confident	49 Å²	49	30.1 Å²	30.1	51%	0.505	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.9	175.6	0	0	0	0	0	114.8	H308 N328	H308-G310 PolarHBondContact O-N 3.21Å; G310-N328 WeakPolarHBondContact O-CB 3.47Å
311	D	77.7	Confident	75	Confident	30 Å²	30	30.4 Å²	30.4	16%	0.16	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.5	-166.2	-60.7	-37.5	0	0	0	112.7	H308 Y313 K325 N327	H308-D311 PolarHBondContact N-O 3.19Å; H308-D311 PolarHBondContact O-N 3.5Å; H308-D311 VanDerWaalsContact O-N 3.12Å; D311-Y313 HydrophobicContact CB-CE2 4.01Å; D311-K325 HydrophobicContact CB-CD 4.49Å; D311-K325 HydrophobicContact CB-CG 4.14Å; D311-K325 VanDerWaalsContact CG-CE 3.46Å; D311-K325 WeakPolarHBondContact OD2-CE 3.27Å; D311-K325 IonicContact OD2-NZ 2.64Å; D311-K325 PolarHBondContact OD2-NZ 2.98Å; D311-N327 WeakPolarHBondContact OD1-CA 3.48Å
312	L	74.8	Confident	76	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.3	173.7	173.1	72.9	0	0	0	110.1	Y266 I268 V314 K325 C326 W333 A543	Y266-L312 HydrophobicContact CD1-CD2 3.53Å; Y266-L312 HydrophobicContact CD1-CG 4.46Å; Y266-L312 HydrophobicContact CD2-CB 4.29Å; Y266-L312 HydrophobicContact CD2-CD1 3.85Å; Y266-L312 HydrophobicContact CD2-CD2 4.21Å; Y266-L312 HydrophobicContact CD2-CG 4.33Å; Y266-L312 HydrophobicContact CE1-CB 4.28Å; Y266-L312 HydrophobicContact CE1-CD2 3.81Å; Y266-L312 HydrophobicContact CE2-CB 3.97Å; Y266-L312 HydrophobicContact CE2-CD1 4.36Å; Y266-L312 HydrophobicContact CE2-CD2 4.49Å; Y266-L312 HydrophobicContact CE2-CG 4.5Å; Y266-L312 HydrophobicContact CG-CD1 3.94Å; Y266-L312 HydrophobicContact CG-CD2 3.66Å; Y266-L312 HydrophobicContact CG-CG 4.25Å; I268-L312 HydrophobicContact CD1-CD2 4.24Å; L312-V314 HydrophobicContact CD1-CG2 4.41Å; L312-V314 HydrophobicContact CD2-CG2 3.74Å; L312-V314 HydrophobicContact CG-CG2 3.84Å; L312-K325 CarbonylContact O-C 3.49Å; L312-K325 WeakPolarHBondContact O-CA 3.17Å; L312-C326 HydrophobicContact CB-CB 4.19Å; L312-C326 HydrophobicContact CD2-CB 4.48Å; L312-C326 PolarHBondContact N-O 2.67Å; L312-C326 PolarHBondContact O-N 3.48Å; L312-W333 HydrophobicContact CD2-CH2 4.06Å; L312-A543 HydrophobicContact CD1-CB 3.23Å
313	Y	81.4	Confident	76.8	Confident	3 Å²	3	28.4 Å²	28.4	1%	0.012	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134	172.5	-68.2	-96.6	0	0	0	110.9	A305 C306 H308 D311 M323 W324 K325 I357 Y376 V378	A305-Y313 CarbonylContact C-O 3.56Å; A305-Y313 WeakPolarHBondContact CA-O 3.06Å; A305-Y313 WeakPolarHBondContact CB-O 2.73Å; C306-Y313 PolarHBondContact N-O 2.73Å; C306-Y313 PolarHBondContact O-N 2.66Å; H308-Y313 HydrophobicContact CB-CD2 3.81Å; H308-Y313 HydrophobicContact CB-CE2 3.69Å; D311-Y313 HydrophobicContact CB-CE2 4.01Å; Y313-M323 HydrophobicContact CD1-CE 3.44Å; Y313-M323 VanDerWaalsContact CD1-CE 3.44Å; Y313-M323 HydrophobicContact CE1-CE 4.28Å; Y313-M323 HydrophobicContact CG-CE 4.03Å; Y313-W324 WeakPolarHBondContact CA-O 3.39Å; Y313-K325 HydrophobicContact CD1-CB 3.96Å; Y313-K325 HydrophobicContact CD1-CG 4.32Å; Y313-K325 HydrophobicContact CE1-CB 3.8Å; Y313-K325 HydrophobicContact CE1-CD 3.7Å; Y313-K325 HydrophobicContact CE1-CG 3.85Å; Y313-K325 HydrophobicContact CE2-CD 4.44Å; Y313-K325 HydrophobicContact CE2-CG 4.39Å; Y313-K325 WeakPolarHBondContact OH-CD 3.41Å; Y313-I357 HydrophobicContact CD1-CD1 3.77Å; Y313-I357 HydrophobicContact CD2-CD1 3.52Å; Y313-I357 HydrophobicContact CE1-CD1 4.09Å; Y313-I357 HydrophobicContact CE2-CD1 3.92Å; Y313-I357 HydrophobicContact CG-CD1 3.42Å; Y313-I357 VanDerWaalsContact CG-CD1 3.42Å; Y313-Y376 HydrophobicContact CE1-CE1 4.01Å; Y313-V378 WeakPolarHBondContact OH-CG1 3.5Å
314	V	78.8	Confident	76.9	Confident	1 Å²	1	29 Å²	29	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.9	-176.2	-173.7	0	0	0	0	109.7	I268 I302 A305 L312 M323 W324 W333	I268-V314 HydrophobicContact CD1-CB 4.35Å; I268-V314 HydrophobicContact CD1-CG1 3.92Å; I268-V314 HydrophobicContact CD1-CG2 3.45Å; I268-V314 VanDerWaalsContact CD1-CG2 3.45Å; I302-V314 HydrophobicContact CB-CG1 4.46Å; I302-V314 HydrophobicContact CD1-CG1 3.82Å; I302-V314 HydrophobicContact CG1-CG1 3.92Å; I302-V314 HydrophobicContact CG2-CG1 3.7Å; A305-V314 HydrophobicContact CB-CG1 4.49Å; A305-V314 HydrophobicContact CB-CG2 4.23Å; L312-V314 HydrophobicContact CD1-CG2 4.41Å; L312-V314 HydrophobicContact CD2-CG2 3.74Å; L312-V314 HydrophobicContact CG-CG2 3.84Å; V314-M323 CarbonylContact O-C 3.54Å; V314-M323 VanDerWaalsContact O-CA 3.31Å; V314-M323 WeakPolarHBondContact O-CA 3.43Å; V314-W324 PolarHBondContact N-O 3.07Å; V314-W324 PolarHBondContact O-N 3.39Å; V314-W333 HydrophobicContact CB-CZ3 4.43Å; V314-W333 HydrophobicContact CG2-CH2 4Å; V314-W333 HydrophobicContact CG2-CZ3 3.95Å
315	V	81.3	Confident	77.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.6	176	-175.4	0	0	0	0	110.2	T303 A304 R322 M323 L339 L348	T303-V315 PolarHBondContact N-O 3.28Å; T303-V315 PolarHBondContact OG1-O 3.12Å; A304-V315 PolarHBondContact N-O 3.28Å; A304-V315 PolarHBondContact O-N 2.91Å; V315-R322 CarbonylContact C-O 3.23Å; V315-R322 VanDerWaalsContact CA-O 3.26Å; V315-R322 WeakPolarHBondContact CA-O 3.47Å; V315-M323 HydrophobicContact CG2-CB 4.34Å; V315-M323 HydrophobicContact CG2-CG 4.06Å; V315-L339 HydrophobicContact CG1-CD1 3.4Å; V315-L339 VanDerWaalsContact CG1-CD1 3.4Å; V315-L339 HydrophobicContact CG1-CG 3.93Å; V315-L348 HydrophobicContact CG2-CD1 4.32Å; V315-L348 HydrophobicContact CG2-CD2 3.95Å
316	G	73.8	Confident	76.6	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.8	-158.4	-179.3	0	0	0	0	0	112.7	I319 R322 W324	G316-I319 CarbonylContact C-O 3.6Å; G316-R322 PolarHBondContact N-O 3.37Å; G316-W324 PolarHBondContact O-NE1 3.38Å
317	G	62	Low	75.9	Confident	7 Å²	7	32.7 Å²	32.7	7%	0.072	19%	0.187	C	C	.	.	S	Bend	trans	116.8	-148.2	-169.8	0	0	0	0	0	111.6	C299 H300 Q301 I319	C299-G317 CarbonylContact O-C 3.55Å; C299-G317 WeakPolarHBondContact O-CA 3.22Å; H300-G317 CarbonylContact C-O 3.48Å; H300-G317 CarbonylContact O-C 3.54Å; H300-G317 WeakPolarHBondContact O-CA 3.46Å; H300-G317 PolarHBondContact O-N 2.76Å; H300-G317 VanDerWaalsContact O-O 3.08Å; Q301-G317 PolarHBondContact O-N 2.98Å; G317-I319 PolarHBondContact O-N 3.16Å; G317-I319 VanDerWaalsContact O-N 3.15Å
318	S	56.5	Low	74.9	Confident	63 Å²	63	30.1 Å²	30.1	44%	0.441	18%	0.177	S	C	.	.	S	Bend	trans	-63.8	-23.6	178.1	-18.7	0	0	0	0	111.4	C299	C299-S318 WeakPolarHBondContact O-CA 3.42Å; C299-S318 PolarHBondContact O-N 3.43Å; C299-S318 WeakPolarHBondContact SG-CB 3.19Å; C299-S318 PolarHBondContact SG-OG 2.95Å
319	I	67.9	Low	73.6	Confident	58 Å²	58	34.1 Å²	34.1	30%	0.297	21%	0.212	S	C	.	.	S	Bend	trans	-128.4	117.9	-177.7	-60.1	-169.7	0	0	0	106.2	G316 G317 R321 R322	G316-I319 CarbonylContact C-O 3.6Å; G317-I319 PolarHBondContact O-N 3.16Å; G317-I319 VanDerWaalsContact O-N 3.15Å; I319-R321 VanDerWaalsContact C-N 3.25Å; I319-R321 HydrophobicContact CG2-CG 3.64Å; I319-R321 PolarHBondContact O-N 3.03Å; I319-R322 HydrophobicContact CB-CG 3.9Å; I319-R322 HydrophobicContact CG2-CG 4.24Å; I319-R322 PolarHBondContact O-N 2.97Å
320	P	74.1	Confident	72.4	Confident	28 Å²	28	35.2 Å²	35.2	18%	0.182	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-34.6	-175	-30.9	38.2	0	0	0	114.8	T303 R322 D342 L344 L365	T303-P320 HydrophobicContact CG2-CB 4.22Å; P320-R322 PolarHBondContact O-N 2.92Å; P320-D342 HydrophobicContact CB-CB 4.31Å; P320-L344 HydrophobicContact CB-CD2 3.97Å; P320-L344 HydrophobicContact CG-CD2 4.26Å; P320-L365 HydrophobicContact CG-CD2 4.11Å
321	R	84.3	Confident	71.7	Confident	101 Å²	101	34.7 Å²	34.7	38%	0.381	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.5	178.3	66.1	-178.7	-167.5	104.4	0.9	116.5	I319 P338 L339 D342	I319-R321 VanDerWaalsContact C-N 3.25Å; I319-R321 HydrophobicContact CG2-CG 3.64Å; I319-R321 PolarHBondContact O-N 3.03Å; R321-P338 HydrophobicContact CG-CB 4.45Å; R321-P338 CarbonylContact O-C 3.59Å; R321-P338 VanDerWaalsContact O-CA 3.27Å; R321-P338 WeakPolarHBondContact O-CA 2.98Å; R321-P338 VanDerWaalsContact O-CB 3.28Å; R321-P338 WeakPolarHBondContact O-CB 3.2Å; R321-L339 HydrophobicContact CB-CB 3.87Å; R321-L339 PolarHBondContact O-N 2.92Å; R321-D342 VanDerWaalsContact CB-OD1 3.27Å; R321-D342 WeakPolarHBondContact CB-OD1 3.43Å; R321-D342 VanDerWaalsContact CG-OD1 3.23Å; R321-D342 WeakPolarHBondContact CG-OD1 3.4Å; R321-D342 PolarHBondContact N-OD1 3.11Å
322	R	81.6	Confident	70.9	Confident	66 Å²	66	38.5 Å²	38.5	25%	0.249	21%	0.214	C	C	.	.			trans	-69.6	143.2	-178.4	-81.9	179.8	-170.3	177.8	4.8	111	V315 G316 I319 P320	V315-R322 CarbonylContact C-O 3.23Å; V315-R322 VanDerWaalsContact CA-O 3.26Å; V315-R322 WeakPolarHBondContact CA-O 3.47Å; G316-R322 PolarHBondContact N-O 3.37Å; I319-R322 HydrophobicContact CB-CG 3.9Å; I319-R322 HydrophobicContact CG2-CG 4.24Å; I319-R322 PolarHBondContact O-N 2.97Å; P320-R322 PolarHBondContact O-N 2.92Å
323	M	84.2	Confident	70.5	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.7	175.6	-174	179.3	-168.5	0	0	110.1	Y313 V314 V315 C336 I357 Y376 W383	Y313-M323 HydrophobicContact CD1-CE 3.44Å; Y313-M323 VanDerWaalsContact CD1-CE 3.44Å; Y313-M323 HydrophobicContact CE1-CE 4.28Å; Y313-M323 HydrophobicContact CG-CE 4.03Å; V314-M323 CarbonylContact O-C 3.54Å; V314-M323 VanDerWaalsContact O-CA 3.31Å; V314-M323 WeakPolarHBondContact O-CA 3.43Å; V315-M323 HydrophobicContact CG2-CB 4.34Å; V315-M323 HydrophobicContact CG2-CG 4.06Å; M323-C336 HydrophobicContact CB-CB 3.97Å; M323-C336 HydrophobicContact CG-CB 3.77Å; M323-C336 PolarHBondContact O-N 3.01Å; M323-C336 VanDerWaalsContact O-N 3.09Å; M323-C336 HydrophobicContact SD-CB 3.9Å; M323-I357 HydrophobicContact CE-CD1 4.05Å; M323-Y376 HydrophobicContact CE-CD1 3.78Å; M323-Y376 HydrophobicContact CE-CE1 4.06Å; M323-Y376 HydrophobicContact CE-CG 4.07Å; M323-Y376 HydrophobicContact SD-CD1 4.33Å; M323-Y376 HydrophobicContact SD-CD2 4.13Å; M323-Y376 HydrophobicContact SD-CE1 4.44Å; M323-Y376 HydrophobicContact SD-CE2 4.25Å; M323-Y376 HydrophobicContact SD-CG 4.16Å; M323-W383 HydrophobicContact CE-CZ2 4.08Å; M323-W383 HydrophobicContact SD-CZ2 3.46Å; M323-W383 WeakPolarHBondContact SD-CZ2 3.45Å
324	W	77.8	Confident	70.2	Confident	28 Å²	28	45 Å²	45	11%	0.106	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.3	-178.9	-54.2	83.4	0	0	0	109.2	L298 Y313 V314 G316 W333 E334 W335	L298-W324 HydrophobicContact CD2-CD2 4.11Å; L298-W324 HydrophobicContact CD2-CG 4.38Å; L298-W324 HydrophobicContact CD2-CZ2 4.28Å; Y313-W324 WeakPolarHBondContact CA-O 3.39Å; V314-W324 PolarHBondContact N-O 3.07Å; V314-W324 PolarHBondContact O-N 3.39Å; G316-W324 PolarHBondContact O-NE1 3.38Å; W324-W333 HydrophobicContact CB-CE3 3.81Å; W324-W333 HydrophobicContact CB-CZ3 3.92Å; W324-E334 WeakPolarHBondContact CA-O 3.41Å; W324-W335 HydrophobicContact CH2-CD2 4.17Å; W324-W335 AromaticContact CH2-CE2 3.47Å; W324-W335 VanDerWaalsContact CH2-CE2 3.47Å; W324-W335 HydrophobicContact CH2-CH2 4.18Å; W324-W335 AromaticContact CH2-CZ2 3.48Å; W324-W335 HydrophobicContact CH2-CZ2 3.48Å; W324-W335 VanDerWaalsContact CH2-CZ2 3.48Å; W324-W335 AromaticContact CH2-NE1 3.66Å; W324-W335 HydrophobicContact CZ2-CZ2 4.24Å; W324-W335 AromaticContact CZ3-CD1 3.7Å; W324-W335 HydrophobicContact CZ3-CD2 4.12Å; W324-W335 AromaticContact CZ3-CE2 3.56Å; W324-W335 HydrophobicContact CZ3-CG 4.21Å; W324-W335 HydrophobicContact CZ3-CZ2 4.06Å; W324-W335 AromaticContact CZ3-NE1 3.27Å; W324-W335 VanDerWaalsContact CZ3-NE1 3.27Å
325	K	82.8	Confident	70.3	Confident	39 Å²	39	52.7 Å²	52.7	17%	0.17	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.6	169.5	172.4	-179.8	169	-146.9	0	108.7	D311 L312 Y313 W333 E334 C336	D311-K325 HydrophobicContact CB-CD 4.49Å; D311-K325 HydrophobicContact CB-CG 4.14Å; D311-K325 VanDerWaalsContact CG-CE 3.46Å; D311-K325 WeakPolarHBondContact OD2-CE 3.27Å; D311-K325 IonicContact OD2-NZ 2.64Å; D311-K325 PolarHBondContact OD2-NZ 2.98Å; L312-K325 CarbonylContact O-C 3.49Å; L312-K325 WeakPolarHBondContact O-CA 3.17Å; Y313-K325 HydrophobicContact CD1-CB 3.96Å; Y313-K325 HydrophobicContact CD1-CG 4.32Å; Y313-K325 HydrophobicContact CE1-CB 3.8Å; Y313-K325 HydrophobicContact CE1-CD 3.7Å; Y313-K325 HydrophobicContact CE1-CG 3.85Å; Y313-K325 HydrophobicContact CE2-CD 4.44Å; Y313-K325 HydrophobicContact CE2-CG 4.39Å; Y313-K325 WeakPolarHBondContact OH-CD 3.41Å; K325-W333 CarbonylContact O-C 3.47Å; K325-W333 WeakPolarHBondContact O-CA 3.29Å; K325-E334 HydrophobicContact CB-CG 3.81Å; K325-E334 HydrophobicContact CD-CG 4.14Å; K325-E334 WeakPolarHBondContact CD-OE1 3.43Å; K325-E334 WeakPolarHBondContact CE-OE1 3.27Å; K325-E334 HydrophobicContact CG-CG 4.13Å; K325-E334 PolarHBondContact N-O 2.7Å; K325-E334 IonicContact NZ-OE1 2.82Å; K325-E334 PolarHBondContact NZ-OE1 3.31Å; K325-E334 PolarHBondContact O-N 3.15Å; K325-C336 WeakPolarHBondContact CB-SG 3.46Å
326	C	69.4	Low	70.6	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.4	173.7	-178.1	0	0	0	0	108.3	L312 N328 D332 W333	L312-C326 HydrophobicContact CB-CB 4.19Å; L312-C326 HydrophobicContact CD2-CB 4.48Å; L312-C326 PolarHBondContact N-O 2.67Å; L312-C326 PolarHBondContact O-N 3.48Å; C326-N328 PolarHBondContact O-N 3.49Å; C326-D332 WeakPolarHBondContact CA-O 3.44Å; C326-W333 HydrophobicContact CB-CD2 3.72Å; C326-W333 HydrophobicContact CB-CE3 3.72Å; C326-W333 HydrophobicContact CB-CG 4.44Å; C326-W333 HydrophobicContact CB-CH2 3.7Å; C326-W333 HydrophobicContact CB-CZ2 3.66Å; C326-W333 HydrophobicContact CB-CZ3 3.73Å; C326-W333 VanDerWaalsContact SG-CE2 3.56Å
327	N	66.5	Low	71.4	Confident	52 Å²	52	54.4 Å²	54.4	28%	0.278	29%	0.285	S	S	.	.			trans	-73	117.9	172	179.3	-71	0	0	0	108.9	D311 A329 T330 V331 D332	D311-N327 WeakPolarHBondContact OD1-CA 3.48Å; N327-A329 VanDerWaalsContact C-N 3.28Å; N327-A329 PolarHBondContact O-N 2.96Å; N327-A329 WeakPolarHBondContact OD1-CB 3.29Å; N327-A329 PolarHBondContact OD1-N 2.91Å; N327-T330 VanDerWaalsContact CB-OG1 3.3Å; N327-T330 WeakPolarHBondContact CB-OG1 3.44Å; N327-T330 PolarHBondContact OD1-N 2.85Å; N327-T330 PolarHBondContact OD1-OG1 3.5Å; N327-V331 WeakPolarHBondContact O-CA 3.16Å; N327-V331 PolarHBondContact O-N 3.21Å; N327-D332 PolarHBondContact N-O 3.18Å
328	N	58.3	Low	72.8	Confident	35 Å²	35	56.7 Å²	56.7	19%	0.187	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-28.1	-173.4	-176.5	48.3	0	0	0	113.4	H264 Y266 G310 C326	H264-N328 PolarHBondContact CD2-ND2 3.38Å; H264-N328 PolarHBondContact CE1-ND2 3.14Å; H264-N328 PolarHBondContact CE1-OD1 3.21Å; H264-N328 PolarHBondContact ND1-OD1 3.13Å; H264-N328 PolarHBondContact NE2-ND2 3.3Å; Y266-N328 WeakPolarHBondContact OH-CB 3.27Å; Y266-N328 PolarHBondContact OH-OD1 2.79Å; G310-N328 WeakPolarHBondContact O-CB 3.47Å; C326-N328 PolarHBondContact O-N 3.49Å
329	A	57	Low	74.5	Confident	94 Å²	94	53.7 Å²	53.7	78%	0.777	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-39	-176.8	0	0	0	0	0	112.4	N327	N327-A329 VanDerWaalsContact C-N 3.28Å; N327-A329 PolarHBondContact O-N 2.96Å; N327-A329 WeakPolarHBondContact OD1-CB 3.29Å; N327-A329 PolarHBondContact OD1-N 2.91Å
330	T	57.8	Low	75.6	Confident	80 Å²	80	54 Å²	54	49%	0.491	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-19.3	-176	55.2	0	0	0	0	113	N327 D332	N327-T330 VanDerWaalsContact CB-OG1 3.3Å; N327-T330 WeakPolarHBondContact CB-OG1 3.44Å; N327-T330 PolarHBondContact OD1-N 2.85Å; N327-T330 PolarHBondContact OD1-OG1 3.5Å; T330-D332 PolarHBondContact O-N 3.07Å; T330-D332 PolarHBondContact OG1-N 3.49Å
331	V	58.8	Low	76.3	Confident	39 Å²	39	61.7 Å²	61.7	24%	0.236	31%	0.309	C	S	.	.			trans	63.3	20.8	-172.2	-157.6	0	0	0	0	112.7	G294 N327	G294-V331 VanDerWaalsContact CA-CG1 3.47Å; N327-V331 WeakPolarHBondContact O-CA 3.16Å; N327-V331 PolarHBondContact O-N 3.21Å
332	D	59.1	Low	76.5	Confident	109 Å²	109	59.6 Å²	59.6	58%	0.583	31%	0.305	S	S	*	.			trans	-80.8	138.7	175.5	-72.3	-33	0	0	0	111.2	C326 N327 T330	C326-D332 WeakPolarHBondContact CA-O 3.44Å; N327-D332 PolarHBondContact N-O 3.18Å; T330-D332 PolarHBondContact O-N 3.07Å; T330-D332 PolarHBondContact OG1-N 3.49Å
333	W	67.1	Low	76.8	Confident	47 Å²	47	57.3 Å²	57.3	18%	0.178	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.3	-179.1	-70.2	78.4	0	0	0	111.1	A279 L298 L312 V314 W324 K325 C326	A279-W333 HydrophobicContact CB-CH2 3.92Å; A279-W333 HydrophobicContact CB-CZ2 3.67Å; L298-W333 HydrophobicContact CD1-CH2 4.24Å; L298-W333 HydrophobicContact CD1-CZ3 4.37Å; L312-W333 HydrophobicContact CD2-CH2 4.06Å; V314-W333 HydrophobicContact CB-CZ3 4.43Å; V314-W333 HydrophobicContact CG2-CH2 4Å; V314-W333 HydrophobicContact CG2-CZ3 3.95Å; W324-W333 HydrophobicContact CB-CE3 3.81Å; W324-W333 HydrophobicContact CB-CZ3 3.92Å; K325-W333 CarbonylContact O-C 3.47Å; K325-W333 WeakPolarHBondContact O-CA 3.29Å; C326-W333 HydrophobicContact CB-CD2 3.72Å; C326-W333 HydrophobicContact CB-CE3 3.72Å; C326-W333 HydrophobicContact CB-CG 4.44Å; C326-W333 HydrophobicContact CB-CH2 3.7Å; C326-W333 HydrophobicContact CB-CZ2 3.66Å; C326-W333 HydrophobicContact CB-CZ3 3.73Å; C326-W333 VanDerWaalsContact SG-CE2 3.56Å
334	E	75.6	Confident	76.9	Confident	93 Å²	93	59 Å²	59	44%	0.435	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	155.3	176.6	66.7	-175.9	162.4	0	0	112.6	W324 K325	W324-E334 WeakPolarHBondContact CA-O 3.41Å; K325-E334 HydrophobicContact CB-CG 3.81Å; K325-E334 HydrophobicContact CD-CG 4.14Å; K325-E334 WeakPolarHBondContact CD-OE1 3.43Å; K325-E334 WeakPolarHBondContact CE-OE1 3.27Å; K325-E334 HydrophobicContact CG-CG 4.13Å; K325-E334 PolarHBondContact N-O 2.7Å; K325-E334 IonicContact NZ-OE1 2.82Å; K325-E334 PolarHBondContact NZ-OE1 3.31Å; K325-E334 PolarHBondContact O-N 3.15Å
335	W	80.2	Confident	77.3	Confident	162 Å²	162	61.6 Å²	61.6	61%	0.614	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.8	-179.3	-69.8	59.4	0	0	0	110	W324	W324-W335 HydrophobicContact CH2-CD2 4.17Å; W324-W335 AromaticContact CH2-CE2 3.47Å; W324-W335 VanDerWaalsContact CH2-CE2 3.47Å; W324-W335 HydrophobicContact CH2-CH2 4.18Å; W324-W335 AromaticContact CH2-CZ2 3.48Å; W324-W335 HydrophobicContact CH2-CZ2 3.48Å; W324-W335 VanDerWaalsContact CH2-CZ2 3.48Å; W324-W335 AromaticContact CH2-NE1 3.66Å; W324-W335 HydrophobicContact CZ2-CZ2 4.24Å; W324-W335 AromaticContact CZ3-CD1 3.7Å; W324-W335 HydrophobicContact CZ3-CD2 4.12Å; W324-W335 AromaticContact CZ3-CE2 3.56Å; W324-W335 HydrophobicContact CZ3-CG 4.21Å; W324-W335 HydrophobicContact CZ3-CZ2 4.06Å; W324-W335 AromaticContact CZ3-NE1 3.27Å; W324-W335 VanDerWaalsContact CZ3-NE1 3.27Å
336	C	87.6	Confident	77.8	Confident	13 Å²	13	60.1 Å²	60.1	9%	0.088	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	169.1	170.6	-57	0	0	0	0	110.6	M323 K325 Y376	M323-C336 HydrophobicContact CB-CB 3.97Å; M323-C336 HydrophobicContact CG-CB 3.77Å; M323-C336 PolarHBondContact O-N 3.01Å; M323-C336 VanDerWaalsContact O-N 3.09Å; M323-C336 HydrophobicContact SD-CB 3.9Å; K325-C336 WeakPolarHBondContact CB-SG 3.46Å; C336-Y376 HydrophobicContact CB-CE2 4.33Å
337	A	91.4	Very high	78.8	Confident	24 Å²	24	60.5 Å²	60.5	20%	0.198	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-56.4	129.2	169.7	0	0	0	0	0	109.4	Y376 N381 W383	A337-Y376 HydrophobicContact CB-CE2 4.18Å; A337-N381 WeakPolarHBondContact CB-O 3.46Å; A337-N381 WeakPolarHBondContact CB-OD1 3.14Å; A337-N381 PolarHBondContact N-OD1 3.38Å; A337-W383 PolarHBondContact O-NE1 2.82Å
338	P	90.9	Very high	80	Confident	55 Å²	55	58.9 Å²	58.9	36%	0.357	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-71.5	157.9	179.9	31	-35.7	0	0	0	110.6	R321	R321-P338 HydrophobicContact CG-CB 4.45Å; R321-P338 CarbonylContact O-C 3.59Å; R321-P338 VanDerWaalsContact O-CA 3.27Å; R321-P338 WeakPolarHBondContact O-CA 2.98Å; R321-P338 VanDerWaalsContact O-CB 3.28Å; R321-P338 WeakPolarHBondContact O-CB 3.2Å
339	L	92.1	Very high	81.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-53.5	144.8	169.2	-65.9	168.2	0	0	0	110	V315 R321 R341 R343 I374 W383	V315-L339 HydrophobicContact CG1-CD1 3.4Å; V315-L339 VanDerWaalsContact CG1-CD1 3.4Å; V315-L339 HydrophobicContact CG1-CG 3.93Å; R321-L339 HydrophobicContact CB-CB 3.87Å; R321-L339 PolarHBondContact O-N 2.92Å; L339-R341 WeakPolarHBondContact CB-O 3.38Å; L339-R341 PolarHBondContact O-N 3.23Å; L339-R343 HydrophobicContact CD1-CB 4.16Å; L339-I374 HydrophobicContact CD2-CD1 3.56Å; L339-W383 HydrophobicContact CD2-CD2 4.06Å; L339-W383 HydrophobicContact CD2-CE3 4.09Å; L339-W383 HydrophobicContact CD2-CH2 3.48Å; L339-W383 VanDerWaalsContact CD2-CH2 3.48Å; L339-W383 HydrophobicContact CD2-CZ2 3.4Å; L339-W383 VanDerWaalsContact CD2-CZ2 3.4Å; L339-W383 HydrophobicContact CD2-CZ3 3.84Å; L339-W383 HydrophobicContact CG-CZ2 4.19Å
340	P	92	Very high	83.4	Confident	64 Å²	64	54.1 Å²	54.1	42%	0.416	27%	0.269	S	S	.	.	S	Bend	trans	-59.8	-31.5	176.6	-25.6	34.8	0	0	0	113.6	I374 W383	P340-I374 HydrophobicContact CG-CD1 4.46Å; P340-W383 HydrophobicContact CG-CB 3.9Å
341	R	88.4	Confident	85.2	Confident	191 Å²	191	50.5 Å²	50.5	72%	0.721	25%	0.247	S	C	*	.	S	Bend	trans	-139.8	152.2	179	-62.1	-174	-174.7	-179.7	3.5	110.8	L339 R343	L339-R341 WeakPolarHBondContact CB-O 3.38Å; L339-R341 PolarHBondContact O-N 3.23Å; R341-R343 PolarHBondContact O-N 3.22Å
342	D	87.1	Confident	86.7	Confident	56 Å²	56	52.5 Å²	52.5	30%	0.299	26%	0.261	S	S	.	.			trans	-62	134.5	174	-67.5	-43	0	0	0	110.8	P320 R321 L365	P320-D342 HydrophobicContact CB-CB 4.31Å; R321-D342 VanDerWaalsContact CB-OD1 3.27Å; R321-D342 WeakPolarHBondContact CB-OD1 3.43Å; R321-D342 VanDerWaalsContact CG-OD1 3.23Å; R321-D342 WeakPolarHBondContact CG-OD1 3.4Å; R321-D342 PolarHBondContact N-OD1 3.11Å; D342-L365 HydrophobicContact CB-CD1 3.82Å; D342-L365 HydrophobicContact CB-CD2 4.3Å; D342-L365 HydrophobicContact CB-CG 3.83Å; D342-L365 WeakPolarHBondContact OD2-CD1 3.26Å
343	R	88.4	Confident	88.1	Confident	19 Å²	19	51.2 Å²	51.2	7%	0.072	27%	0.273	C	S	.	.			trans	-149.4	118.8	-173.4	-164.8	-171.8	-76.7	-127.9	11	110.8	L339 R341 H346 G361 A372	L339-R343 HydrophobicContact CD1-CB 4.16Å; R341-R343 PolarHBondContact O-N 3.22Å; R343-H346 HydrophobicContact CG-CB 3.66Å; R343-H346 PolarHBondContact O-ND1 3.25Å; R343-G361 VanDerWaalsContact CD-O 3.26Å; R343-G361 WeakPolarHBondContact CD-O 3.26Å; R343-G361 PolarHBondContact NH1-O 2.78Å; R343-A372 PolarHBondContact NH1-O 3.31Å
344	L	86.8	Confident	89.4	Confident	37 Å²	37	52.4 Å²	52.4	19%	0.194	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-101.5	154	177.6	-56	-178.4	0	0	0	110.6	T303 P320 H346 G362 K363 L365	T303-L344 HydrophobicContact CG2-CD2 3.6Å; P320-L344 HydrophobicContact CB-CD2 3.97Å; P320-L344 HydrophobicContact CG-CD2 4.26Å; L344-H346 PolarHBondContact O-N 2.83Å; L344-G362 CarbonylContact O-C 3.58Å; L344-G362 WeakPolarHBondContact O-CA 3.48Å; L344-K363 PolarHBondContact N-O 2.77Å; L344-K363 PolarHBondContact O-N 3.03Å; L344-L365 HydrophobicContact CD1-CD2 3.93Å; L344-L365 HydrophobicContact CD2-CD2 4.24Å; L344-L365 HydrophobicContact CG-CD2 4.06Å
345	Q	86.7	Confident	90.3	Very high	82 Å²	82	51.7 Å²	51.7	38%	0.383	28%	0.279	S	S	.	.	S	Bend	trans	48.3	33	175.3	-61.8	-179.6	-39.6	0	0	114	G362 G395	Q345-G362 WeakPolarHBondContact O-CA 3.39Å; Q345-G395 PolarHBondContact O-N 2.81Å
346	H	91.9	Very high	91.1	Very high	9 Å²	9	44 Å²	44	4%	0.042	25%	0.25	C	C	.	.			trans	-86	155.9	176.6	64.5	-95.2	0	0	0	110.3	T303 A304 R343 L344 S359	T303-H346 PolarHBondContact OG1-CE1 2.95Å; A304-H346 VanDerWaalsContact CB-NE2 3.28Å; A304-H346 WeakPolarHBondContact CB-NE2 3.33Å; R343-H346 HydrophobicContact CG-CB 3.66Å; R343-H346 PolarHBondContact O-ND1 3.25Å; L344-H346 PolarHBondContact O-N 2.83Å; H346-S359 PolarHBondContact CD2-OG 3.36Å; H346-S359 PolarHBondContact NE2-OG 3.38Å
347	T	92.1	Very high	91.5	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.6	178.6	-51	0	0	0	0	108.5	V349 S359 L360 A396 G398 L407	T347-V349 HydrophobicContact CG2-CG2 3.74Å; T347-S359 CarbonylContact O-C 3.52Å; T347-S359 WeakPolarHBondContact O-CA 3.2Å; T347-L360 PolarHBondContact N-O 2.92Å; T347-L360 PolarHBondContact O-N 3.48Å; T347-A396 PolarHBondContact OG1-O 3.31Å; T347-G398 VanDerWaalsContact CG2-N 3.28Å; T347-L407 HydrophobicContact CG2-CD2 3.95Å; T347-L407 WeakPolarHBondContact OG1-CD2 3.43Å
348	L	91.7	Very high	91.8	Very high	17 Å²	17	42.5 Å²	42.5	9%	0.089	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.4	176	-163.5	75.1	0	0	0	109.2	A304 C306 V315 I357 Y358 W383	A304-L348 HydrophobicContact CB-CB 3.57Å; A304-L348 HydrophobicContact CB-CD2 4.32Å; A304-L348 HydrophobicContact CB-CG 4.48Å; C306-L348 HydrophobicContact CB-CD2 4.17Å; C306-L348 HydrophobicContact CB-CG 4.25Å; C306-L348 VanDerWaalsContact SG-CD2 3.58Å; V315-L348 HydrophobicContact CG2-CD1 4.32Å; V315-L348 HydrophobicContact CG2-CD2 3.95Å; L348-I357 HydrophobicContact CD1-CG2 3.58Å; L348-I357 HydrophobicContact CD2-CG2 4.17Å; L348-I357 HydrophobicContact CG-CG2 3.62Å; L348-Y358 CarbonylContact C-O 3.57Å; L348-Y358 VanDerWaalsContact CA-O 3.27Å; L348-Y358 WeakPolarHBondContact CA-O 3.44Å; L348-W383 HydrophobicContact CD1-CH2 4.13Å
349	V	93.7	Very high	92	Very high	9 Å²	9	39.9 Å²	39.9	6%	0.055	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.2	-172.3	-175.3	0	0	0	0	110.7	T347 I357 Y358 L360 N400 I405	T347-V349 HydrophobicContact CG2-CG2 3.74Å; V349-I357 CarbonylContact O-C 3.59Å; V349-I357 WeakPolarHBondContact O-CA 3.34Å; V349-Y358 PolarHBondContact N-O 3.05Å; V349-Y358 PolarHBondContact O-N 3.3Å; V349-L360 HydrophobicContact CB-CD1 4.46Å; V349-L360 HydrophobicContact CG2-CD1 4.14Å; V349-N400 HydrophobicContact CG1-CB 3.46Å; V349-N400 VanDerWaalsContact CG1-CB 3.46Å; V349-I405 HydrophobicContact CB-CD1 4.39Å; V349-I405 HydrophobicContact CB-CG2 4.26Å; V349-I405 HydrophobicContact CG1-CD1 4.43Å; V349-I405 HydrophobicContact CG1-CG1 4.22Å; V349-I405 HydrophobicContact CG1-CG2 4.21Å; V349-I405 HydrophobicContact CG2-CG2 3.97Å
350	S	92.6	Very high	92.2	Very high	20 Å²	20	39.9 Å²	39.9	14%	0.14	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135	175.6	175.9	0	0	0	0	111.7	K307 H308 N400	K307-S350 WeakPolarHBondContact O-CB 3.28Å; K307-S350 PolarHBondContact O-OG 2.76Å; H308-S350 PolarHBondContact ND1-OG 2.81Å; S350-N400 WeakPolarHBondContact O-CB 3.16Å; S350-N400 PolarHBondContact O-ND2 3.16Å
351	V	95.4	Very high	92.3	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	83.7	175.3	-173.7	0	0	0	0	108.6	G353 K354 D355 A356 Y358 I405 T430	V351-G353 VanDerWaalsContact C-N 3.3Å; V351-G353 PolarHBondContact O-N 2.89Å; V351-K354 HydrophobicContact CG1-CB 4.26Å; V351-K354 HydrophobicContact CG1-CG 4.2Å; V351-K354 PolarHBondContact O-N 2.68Å; V351-K354 VanDerWaalsContact O-N 3.12Å; V351-D355 PolarHBondContact O-N 2.95Å; V351-A356 PolarHBondContact N-O 2.84Å; V351-A356 PolarHBondContact O-N 2.9Å; V351-Y358 HydrophobicContact CB-CD2 4.17Å; V351-Y358 HydrophobicContact CB-CE2 4.06Å; V351-Y358 HydrophobicContact CG2-CD2 3.48Å; V351-Y358 VanDerWaalsContact CG2-CD2 3.48Å; V351-Y358 HydrophobicContact CG2-CE2 3.71Å; V351-Y358 HydrophobicContact CG2-CG 4.44Å; V351-I405 HydrophobicContact CG2-CD1 3.92Å; V351-I405 HydrophobicContact CG2-CG1 4.22Å; V351-T430 HydrophobicContact CG1-CG2 4.4Å; V351-T430 HydrophobicContact CG2-CG2 4.11Å
352	P	89.8	Confident	92.6	Very high	82 Å²	82	27.7 Å²	27.7	53%	0.532	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-59.1	-36.3	-172.7	-26.9	35.6	0	0	0	114.1	K354 D355	P352-K354 PolarHBondContact O-N 3.42Å; P352-K354 VanDerWaalsContact O-N 3.07Å; P352-D355 PolarHBondContact O-N 2.84Å
353	G	89.4	Confident	92.7	Very high	82 Å²	82	25.6 Å²	25.6	85%	0.845	15%	0.154	S	C	*	.	G	3₁₀ helix	trans	-61.7	-17.6	179.5	0	0	0	0	0	114.6	V351	V351-G353 VanDerWaalsContact C-N 3.3Å; V351-G353 PolarHBondContact O-N 2.89Å
354	K	93.1	Very high	92.8	Very high	72 Å²	72	26.9 Å²	26.9	31%	0.313	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-113.4	4.8	176.9	-63	-167.4	176.4	-135.2	0	113.5	V351 P352 A356 T430 E431	V351-K354 HydrophobicContact CG1-CB 4.26Å; V351-K354 HydrophobicContact CG1-CG 4.2Å; V351-K354 PolarHBondContact O-N 2.68Å; V351-K354 VanDerWaalsContact O-N 3.12Å; P352-K354 PolarHBondContact O-N 3.42Å; P352-K354 VanDerWaalsContact O-N 3.07Å; K354-A356 HydrophobicContact CB-CB 4.1Å; K354-A356 PolarHBondContact O-N 2.83Å; K354-T430 WeakPolarHBondContact CE-O 3.45Å; K354-T430 PolarHBondContact NZ-O 3.38Å; K354-E431 WeakPolarHBondContact CE-OE1 3.38Å; K354-E431 WeakPolarHBondContact CE-OE2 3.27Å; K354-E431 IonicContact NZ-OE1 3.71Å; K354-E431 PolarHBondContact NZ-OE1 2.93Å; K354-E431 IonicContact NZ-OE2 2.78Å; K354-E431 PolarHBondContact NZ-OE2 2.82Å
355	D	94.6	Very high	92.7	Very high	77 Å²	77	29.2 Å²	29.2	41%	0.412	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	43.3	-171.1	-166	48.9	0	0	0	112.2	H308 V351 P352 V378 G379	H308-D355 IonicContact CD2-OD1 2.65Å; H308-D355 IonicContact NE2-OD1 2.95Å; H308-D355 PolarHBondContact NE2-OD1 3.28Å; H308-D355 VanDerWaalsContact NE2-OD1 3.12Å; V351-D355 PolarHBondContact O-N 2.95Å; P352-D355 PolarHBondContact O-N 2.84Å; D355-V378 WeakPolarHBondContact O-CB 3.44Å; D355-V378 PolarHBondContact O-N 2.63Å; D355-G379 PolarHBondContact OD2-N 3.37Å
356	A	96.6	Very high	92.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.8	-171.2	0	0	0	0	0	113.5	H308 V351 K354 Y358 Y375 Y376	H308-A356 PolarHBondContact CE1-N 2.93Å; V351-A356 PolarHBondContact N-O 2.84Å; V351-A356 PolarHBondContact O-N 2.9Å; K354-A356 HydrophobicContact CB-CB 4.1Å; K354-A356 PolarHBondContact O-N 2.83Å; A356-Y358 HydrophobicContact CB-CE2 3.98Å; A356-Y375 HydrophobicContact CB-CD2 4.26Å; A356-Y376 CarbonylContact C-O 3.53Å; A356-Y376 VanDerWaalsContact CA-O 3.25Å; A356-Y376 WeakPolarHBondContact CA-O 3.17Å
357	I	96.7	Very high	92.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.5	175.4	-59.8	170.9	0	0	0	109.1	C306 H308 Y313 M323 L348 V349 Y375 Y376 V378	C306-I357 WeakPolarHBondContact SG-CG2 3.35Å; H308-I357 HydrophobicContact CB-CD1 3.78Å; H308-I357 HydrophobicContact CB-CG1 3.95Å; Y313-I357 HydrophobicContact CD1-CD1 3.77Å; Y313-I357 HydrophobicContact CD2-CD1 3.52Å; Y313-I357 HydrophobicContact CE1-CD1 4.09Å; Y313-I357 HydrophobicContact CE2-CD1 3.92Å; Y313-I357 HydrophobicContact CG-CD1 3.42Å; Y313-I357 VanDerWaalsContact CG-CD1 3.42Å; M323-I357 HydrophobicContact CE-CD1 4.05Å; L348-I357 HydrophobicContact CD1-CG2 3.58Å; L348-I357 HydrophobicContact CD2-CG2 4.17Å; L348-I357 HydrophobicContact CG-CG2 3.62Å; V349-I357 CarbonylContact O-C 3.59Å; V349-I357 WeakPolarHBondContact O-CA 3.34Å; I357-Y375 CarbonylContact O-C 3.53Å; I357-Y375 VanDerWaalsContact O-CA 3.25Å; I357-Y375 WeakPolarHBondContact O-CA 3.5Å; I357-Y376 HydrophobicContact CD1-CD1 4.29Å; I357-Y376 PolarHBondContact N-O 3.49Å; I357-Y376 PolarHBondContact O-N 3.43Å; I357-V378 HydrophobicContact CD1-CG2 4.06Å; I357-V378 HydrophobicContact CG1-CG2 4.12Å
358	Y	97.3	Very high	92.3	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.02	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.1	-178.2	-75.1	-110.4	0	0	0	111.2	L348 V349 V351 A356 V373 Y375 I405 F428 T430	L348-Y358 CarbonylContact C-O 3.57Å; L348-Y358 VanDerWaalsContact CA-O 3.27Å; L348-Y358 WeakPolarHBondContact CA-O 3.44Å; V349-Y358 PolarHBondContact N-O 3.05Å; V349-Y358 PolarHBondContact O-N 3.3Å; V351-Y358 HydrophobicContact CB-CD2 4.17Å; V351-Y358 HydrophobicContact CB-CE2 4.06Å; V351-Y358 HydrophobicContact CG2-CD2 3.48Å; V351-Y358 VanDerWaalsContact CG2-CD2 3.48Å; V351-Y358 HydrophobicContact CG2-CE2 3.71Å; V351-Y358 HydrophobicContact CG2-CG 4.44Å; A356-Y358 HydrophobicContact CB-CE2 3.98Å; Y358-V373 HydrophobicContact CD1-CG1 3.92Å; Y358-Y375 HydrophobicContact CE1-CD1 4.12Å; Y358-Y375 HydrophobicContact CE1-CG 4.12Å; Y358-Y375 HydrophobicContact CE2-CG 4.4Å; Y358-I405 HydrophobicContact CD1-CD1 3.96Å; Y358-I405 HydrophobicContact CD2-CD1 4.01Å; Y358-I405 HydrophobicContact CG-CD1 3.59Å; Y358-F428 HydrophobicContact CD1-CE1 4.22Å; Y358-F428 HydrophobicContact CE1-CD1 4.48Å; Y358-F428 AromaticContact CE1-CE1 3.81Å; Y358-F428 HydrophobicContact CE1-CE1 3.81Å; Y358-T430 HydrophobicContact CE1-CG2 4.18Å; Y358-T430 HydrophobicContact CE2-CG2 4.11Å
359	S	96.1	Very high	92.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.5	169	-180	0	0	0	0	108.8	H346 T347 I374	H346-S359 PolarHBondContact CD2-OG 3.36Å; H346-S359 PolarHBondContact NE2-OG 3.38Å; T347-S359 CarbonylContact O-C 3.52Å; T347-S359 WeakPolarHBondContact O-CA 3.2Å; S359-I374 PolarHBondContact N-O 2.95Å; S359-I374 PolarHBondContact O-N 3.47Å
360	L	96.3	Very high	92.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.2	-173.8	-46.3	96.9	0	0	0	110.6	T347 V349 V373 L389 I405 L407 F428	T347-L360 PolarHBondContact N-O 2.92Å; T347-L360 PolarHBondContact O-N 3.48Å; V349-L360 HydrophobicContact CB-CD1 4.46Å; V349-L360 HydrophobicContact CG2-CD1 4.14Å; L360-V373 HydrophobicContact CB-CG2 4.43Å; L360-V373 HydrophobicContact CD2-CG1 3.79Å; L360-V373 HydrophobicContact CD2-CG2 3.99Å; L360-V373 HydrophobicContact CG-CG1 3.94Å; L360-V373 HydrophobicContact CG-CG2 4.37Å; L360-L389 HydrophobicContact CB-CD1 4.35Å; L360-L389 HydrophobicContact CD2-CD2 4.18Å; L360-I405 HydrophobicContact CD1-CD1 4.22Å; L360-I405 HydrophobicContact CD1-CG2 4.03Å; L360-I405 HydrophobicContact CD2-CD1 4.34Å; L360-I405 HydrophobicContact CD2-CG2 4.22Å; L360-L407 HydrophobicContact CB-CD1 3.89Å; L360-L407 HydrophobicContact CB-CD2 4.33Å; L360-L407 HydrophobicContact CD2-CD1 3.81Å; L360-L407 HydrophobicContact CG-CD1 4.38Å; L360-F428 HydrophobicContact CD2-CB 4.14Å; L360-F428 HydrophobicContact CD2-CG 4.18Å
361	G	94.9	Very high	92.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.249	C	C	.	.			trans	63.6	-137	172.8	0	0	0	0	0	114.6	R343 S370 A372 V393	R343-G361 VanDerWaalsContact CD-O 3.26Å; R343-G361 WeakPolarHBondContact CD-O 3.26Å; R343-G361 PolarHBondContact NH1-O 2.78Å; G361-S370 VanDerWaalsContact CA-O 3.29Å; G361-S370 WeakPolarHBondContact CA-O 3.28Å; G361-A372 PolarHBondContact N-O 2.92Å; G361-A372 VanDerWaalsContact N-O 3.16Å; G361-V393 CarbonylContact C-O 3.54Å; G361-V393 VanDerWaalsContact CA-O 3.3Å; G361-V393 WeakPolarHBondContact CA-O 3.41Å
362	G	92.9	Very high	92.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.			trans	84.8	-168.4	-175.1	0	0	0	0	0	113.7	L344 Q345 S370 V393	L344-G362 CarbonylContact O-C 3.58Å; L344-G362 WeakPolarHBondContact O-CA 3.48Å; Q345-G362 WeakPolarHBondContact O-CA 3.39Å; G362-S370 PolarHBondContact O-N 3.27Å; G362-V393 PolarHBondContact N-O 2.95Å
363	K	90.6	Very high	92.8	Very high	12 Å²	12	39.9 Å²	39.9	5%	0.052	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-126.9	150.5	175.4	-51.3	-169	-171.1	180	0	111.2	L344 D367 T368 L369 S394 E411	L344-K363 PolarHBondContact N-O 2.77Å; L344-K363 PolarHBondContact O-N 3.03Å; K363-D367 WeakPolarHBondContact CD-OD1 3.45Å; K363-D367 IonicContact NZ-OD1 2.71Å; K363-D367 PolarHBondContact NZ-OD1 2.88Å; K363-T368 CarbonylContact C-O 3.49Å; K363-T368 VanDerWaalsContact CA-O 3.25Å; K363-T368 WeakPolarHBondContact CA-O 3.14Å; K363-L369 HydrophobicContact CD-CG 4.49Å; K363-L369 HydrophobicContact CG-CD2 4.13Å; K363-L369 HydrophobicContact CG-CG 4.33Å; K363-S394 WeakPolarHBondContact CE-OG 3.34Å; K363-E411 WeakPolarHBondContact CE-OE2 3.32Å; K363-E411 IonicContact NZ-OE2 3.66Å; K363-E411 PolarHBondContact NZ-OE2 2.79Å
364	T	88.9	Confident	93.1	Very high	45 Å²	45	36.3 Å²	36.3	28%	0.276	20%	0.195	S	C	.	.			trans	-69	171	167.4	65.6	0	0	0	0	111.4	Q366 D367 T368	T364-Q366 PolarHBondContact O-N 3.21Å; T364-Q366 PolarHBondContact OG1-N 3.38Å; T364-D367 PolarHBondContact O-N 2.95Å; T364-D367 VanDerWaalsContact O-N 3.08Å; T364-T368 PolarHBondContact N-O 2.6Å; T364-T368 WeakPolarHBondContact OG1-CB 3.4Å; T364-T368 PolarHBondContact OG1-N 2.67Å; T364-T368 VanDerWaalsContact OG1-N 3.14Å; T364-T368 PolarHBondContact OG1-O 3.03Å
365	L	84.9	Confident	93.3	Very high	87 Å²	87	35.2 Å²	35.2	46%	0.455	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.6	172.2	-62.1	179.6	0	0	0	113.3	P320 D342 L344 D367	P320-L365 HydrophobicContact CG-CD2 4.11Å; D342-L365 HydrophobicContact CB-CD1 3.82Å; D342-L365 HydrophobicContact CB-CD2 4.3Å; D342-L365 HydrophobicContact CB-CG 3.83Å; D342-L365 WeakPolarHBondContact OD2-CD1 3.26Å; L344-L365 HydrophobicContact CD1-CD2 3.93Å; L344-L365 HydrophobicContact CD2-CD2 4.24Å; L344-L365 HydrophobicContact CG-CD2 4.06Å; L365-D367 VanDerWaalsContact C-N 3.27Å
366	Q	86.9	Confident	93.4	Very high	152 Å²	152	31.8 Å²	31.8	71%	0.71	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	17.1	174.8	-64.2	75.7	22.1	0	0	112.3	T364 T368	T364-Q366 PolarHBondContact O-N 3.21Å; T364-Q366 PolarHBondContact OG1-N 3.38Å; Q366-T368 PolarHBondContact O-N 2.79Å; Q366-T368 VanDerWaalsContact O-N 3.08Å
367	D	85.4	Confident	93.4	Very high	105 Å²	105	36.3 Å²	36.3	56%	0.561	19%	0.187	S	C	*	.			trans	61.4	15.1	178.1	-155.8	29.8	0	0	0	115.1	K363 T364 L365	K363-D367 WeakPolarHBondContact CD-OD1 3.45Å; K363-D367 IonicContact NZ-OD1 2.71Å; K363-D367 PolarHBondContact NZ-OD1 2.88Å; T364-D367 PolarHBondContact O-N 2.95Å; T364-D367 VanDerWaalsContact O-N 3.08Å; L365-D367 VanDerWaalsContact C-N 3.27Å
368	T	90.8	Very high	93.3	Very high	84 Å²	84	37.6 Å²	37.6	52%	0.515	20%	0.195	S	C	.	.			trans	-78.5	125.6	171.9	-51.3	0	0	0	0	110.6	K363 T364 Q366	K363-T368 CarbonylContact C-O 3.49Å; K363-T368 VanDerWaalsContact CA-O 3.25Å; K363-T368 WeakPolarHBondContact CA-O 3.14Å; T364-T368 PolarHBondContact N-O 2.6Å; T364-T368 WeakPolarHBondContact OG1-CB 3.4Å; T364-T368 PolarHBondContact OG1-N 2.67Å; T364-T368 VanDerWaalsContact OG1-N 3.14Å; T364-T368 PolarHBondContact OG1-O 3.03Å; Q366-T368 PolarHBondContact O-N 2.79Å; Q366-T368 VanDerWaalsContact O-N 3.08Å
369	L	93.1	Very high	93	Very high	16 Å²	16	40.3 Å²	40.3	8%	0.084	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-61	140.6	172.1	-82	156.5	0	0	0	111.6	K363 A392 V393 S394 E411 N413 T419	K363-L369 HydrophobicContact CD-CG 4.49Å; K363-L369 HydrophobicContact CG-CD2 4.13Å; K363-L369 HydrophobicContact CG-CG 4.33Å; L369-A392 HydrophobicContact CB-CB 3.94Å; L369-V393 VanDerWaalsContact CD2-C 3.47Å; L369-S394 VanDerWaalsContact CD2-N 3.28Å; L369-S394 VanDerWaalsContact CD2-OG 3.26Å; L369-S394 WeakPolarHBondContact CD2-OG 3.46Å; L369-E411 WeakPolarHBondContact CD2-O 3.42Å; L369-N413 HydrophobicContact CD1-CB 4.39Å; L369-N413 WeakPolarHBondContact CD1-OD1 3.43Å; L369-T419 HydrophobicContact CD1-CG2 3.93Å
370	S	93.3	Very high	92.9	Very high	21 Å²	21	44.8 Å²	44.8	15%	0.147	25%	0.248	C	C	.	.			trans	-115.1	141.7	-178.9	175.2	0	0	0	0	110.6	G361 G362 A372 A392 V393	G361-S370 VanDerWaalsContact CA-O 3.29Å; G361-S370 WeakPolarHBondContact CA-O 3.28Å; G362-S370 PolarHBondContact O-N 3.27Å; S370-A372 WeakPolarHBondContact OG-CB 3.02Å; S370-A372 PolarHBondContact OG-N 3.12Å; S370-A372 VanDerWaalsContact OG-N 3.11Å; S370-A392 WeakPolarHBondContact O-CA 3.48Å; S370-V393 PolarHBondContact O-N 3Å
371	N	94.6	Very high	92.9	Very high	50 Å²	50	48.2 Å²	48.2	27%	0.267	27%	0.266	S	S	.	.			trans	-104.1	3.1	167	70	-22.1	0	0	0	112.3	Q388 L389 A392	N371-Q388 PolarHBondContact ND2-OE1 3.21Å; N371-Q388 WeakPolarHBondContact O-CA 3.31Å; N371-L389 HydrophobicContact CB-CB 4.08Å; N371-L389 WeakPolarHBondContact CB-O 3.29Å; N371-L389 PolarHBondContact ND2-O 2.87Å; N371-L389 PolarHBondContact O-N 3.02Å; N371-A392 HydrophobicContact CB-CB 4Å
372	A	94.9	Very high	92.9	Very high	26 Å²	26	51.2 Å²	51.2	22%	0.215	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	140.6	-174.9	0	0	0	0	0	111.8	R343 G361 S370	R343-A372 PolarHBondContact NH1-O 3.31Å; G361-A372 PolarHBondContact N-O 2.92Å; G361-A372 VanDerWaalsContact N-O 3.16Å; S370-A372 WeakPolarHBondContact OG-CB 3.02Å; S370-A372 PolarHBondContact OG-N 3.12Å; S370-A372 VanDerWaalsContact OG-N 3.11Å
373	V	96.8	Very high	93.1	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.9	169.8	-174.7	0	0	0	0	108.4	Y358 L360 T386 T387 L389 F428	Y358-V373 HydrophobicContact CD1-CG1 3.92Å; L360-V373 HydrophobicContact CB-CG2 4.43Å; L360-V373 HydrophobicContact CD2-CG1 3.79Å; L360-V373 HydrophobicContact CD2-CG2 3.99Å; L360-V373 HydrophobicContact CG-CG1 3.94Å; L360-V373 HydrophobicContact CG-CG2 4.37Å; V373-T386 HydrophobicContact CB-CG2 3.74Å; V373-T386 HydrophobicContact CG1-CG2 3.53Å; V373-T386 PolarHBondContact O-N 2.97Å; V373-T387 VanDerWaalsContact CB-O 3.28Å; V373-T387 WeakPolarHBondContact CB-O 3.42Å; V373-L389 HydrophobicContact CG2-CD2 3.71Å; V373-L389 HydrophobicContact CG2-CG 3.71Å; V373-F428 HydrophobicContact CB-CE2 4.18Å; V373-F428 HydrophobicContact CB-CZ 4.45Å; V373-F428 HydrophobicContact CG1-CD2 4.49Å; V373-F428 HydrophobicContact CG1-CE1 4.28Å; V373-F428 HydrophobicContact CG1-CE2 4.06Å; V373-F428 HydrophobicContact CG1-CZ 3.96Å; V373-F428 HydrophobicContact CG2-CD2 4.1Å; V373-F428 HydrophobicContact CG2-CE2 3.96Å
374	I	96.4	Very high	93.4	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.7	176	61.4	179.4	0	0	0	108.1	L339 P340 S359 W383 T384 E385	L339-I374 HydrophobicContact CD2-CD1 3.56Å; P340-I374 HydrophobicContact CG-CD1 4.46Å; S359-I374 PolarHBondContact N-O 2.95Å; S359-I374 PolarHBondContact O-N 3.47Å; I374-W383 HydrophobicContact CB-CE3 4.24Å; I374-W383 HydrophobicContact CD1-CE3 3.92Å; I374-W383 HydrophobicContact CD1-CZ3 4.18Å; I374-W383 HydrophobicContact CG1-CE3 3.82Å; I374-W383 HydrophobicContact CG1-CZ3 3.89Å; I374-T384 CarbonylContact C-O 3.56Å; I374-T384 VanDerWaalsContact CA-O 3.31Å; I374-T384 WeakPolarHBondContact CA-O 3.3Å; I374-E385 HydrophobicContact CG2-CB 4.43Å; I374-E385 HydrophobicContact CG2-CG 3.91Å
375	Y	97.1	Very high	93.6	Very high	48 Å²	48	57.8 Å²	57.8	19%	0.188	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.3	177.2	69.4	-86.5	0	0	0	111.6	A356 I357 Y358 R377 W383 T384 T386	A356-Y375 HydrophobicContact CB-CD2 4.26Å; I357-Y375 CarbonylContact O-C 3.53Å; I357-Y375 VanDerWaalsContact O-CA 3.25Å; I357-Y375 WeakPolarHBondContact O-CA 3.5Å; Y358-Y375 HydrophobicContact CE1-CD1 4.12Å; Y358-Y375 HydrophobicContact CE1-CG 4.12Å; Y358-Y375 HydrophobicContact CE2-CG 4.4Å; Y375-R377 HydrophobicContact CD2-CG 4.1Å; Y375-R377 HydrophobicContact CE2-CG 3.7Å; Y375-W383 VanDerWaalsContact C-CE3 3.45Å; Y375-W383 CarbonylContact O-C 3.4Å; Y375-W383 WeakPolarHBondContact O-CA 3.45Å; Y375-T384 HydrophobicContact CE1-CG2 3.9Å; Y375-T384 PolarHBondContact N-O 2.99Å; Y375-T384 PolarHBondContact O-N 2.82Å; Y375-T386 HydrophobicContact CD1-CG2 4.26Å
376	Y	97.6	Very high	94.1	Very high	6 Å²	6	55.2 Å²	55.2	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.7	178.3	175.4	-102.9	0	0	0	108.5	Y313 M323 C336 A337 A356 I357 V378 N381 V382 W383	Y313-Y376 HydrophobicContact CE1-CE1 4.01Å; M323-Y376 HydrophobicContact CE-CD1 3.78Å; M323-Y376 HydrophobicContact CE-CE1 4.06Å; M323-Y376 HydrophobicContact CE-CG 4.07Å; M323-Y376 HydrophobicContact SD-CD1 4.33Å; M323-Y376 HydrophobicContact SD-CD2 4.13Å; M323-Y376 HydrophobicContact SD-CE1 4.44Å; M323-Y376 HydrophobicContact SD-CE2 4.25Å; M323-Y376 HydrophobicContact SD-CG 4.16Å; C336-Y376 HydrophobicContact CB-CE2 4.33Å; A337-Y376 HydrophobicContact CB-CE2 4.18Å; A356-Y376 CarbonylContact C-O 3.53Å; A356-Y376 VanDerWaalsContact CA-O 3.25Å; A356-Y376 WeakPolarHBondContact CA-O 3.17Å; I357-Y376 HydrophobicContact CD1-CD1 4.29Å; I357-Y376 PolarHBondContact N-O 3.49Å; I357-Y376 PolarHBondContact O-N 3.43Å; Y376-V378 HydrophobicContact CD1-CG2 3.94Å; Y376-V378 HydrophobicContact CE1-CB 4.39Å; Y376-V378 HydrophobicContact CE1-CG2 3.97Å; Y376-N381 WeakPolarHBondContact CE2-OD1 3.31Å; Y376-N381 WeakPolarHBondContact OH-CA 3Å; Y376-N381 PolarHBondContact OH-OD1 2.77Å; Y376-V382 WeakPolarHBondContact CA-O 3.39Å; Y376-W383 AromaticContact CD2-CD1 3.88Å; Y376-W383 HydrophobicContact CD2-CD2 4.18Å; Y376-W383 AromaticContact CD2-CE2 3.87Å; Y376-W383 HydrophobicContact CD2-CG 4.21Å; Y376-W383 HydrophobicContact CD2-CZ2 4.43Å; Y376-W383 AromaticContact CD2-NE1 3.65Å; Y376-W383 HydrophobicContact CG-CD2 4.44Å; Y376-W383 HydrophobicContact CG-CZ2 4.3Å
377	R	96.1	Very high	94.5	Very high	96 Å²	96	50.9 Å²	50.9	36%	0.362	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.4	170.5	-75.1	-174.3	-79.6	141.8	-5	108.7	Y375 D380 N381 V382	Y375-R377 HydrophobicContact CD2-CG 4.1Å; Y375-R377 HydrophobicContact CE2-CG 3.7Å; R377-D380 HydrophobicContact CB-CB 4.06Å; R377-D380 WeakPolarHBondContact CD-OD2 3.42Å; R377-D380 IonicContact CZ-OD2 3.83Å; R377-D380 IonicContact NE-OD2 3.4Å; R377-D380 IonicContact NH1-OD2 2.73Å; R377-D380 PolarHBondContact NH1-OD2 3.14Å; R377-D380 PolarHBondContact O-N 3Å; R377-N381 PolarHBondContact O-N 2.73Å; R377-V382 PolarHBondContact N-O 2.82Å
378	V	94.4	Very high	95	Very high	26 Å²	26	51.5 Å²	51.5	16%	0.158	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-49.8	-170.9	170.4	0	0	0	0	111.1	Y313 D355 I357 Y376 D380 N381	Y313-V378 WeakPolarHBondContact OH-CG1 3.5Å; D355-V378 WeakPolarHBondContact O-CB 3.44Å; D355-V378 PolarHBondContact O-N 2.63Å; I357-V378 HydrophobicContact CD1-CG2 4.06Å; I357-V378 HydrophobicContact CG1-CG2 4.12Å; Y376-V378 HydrophobicContact CD1-CG2 3.94Å; Y376-V378 HydrophobicContact CE1-CB 4.39Å; Y376-V378 HydrophobicContact CE1-CG2 3.97Å; V378-D380 VanDerWaalsContact C-N 3.27Å; V378-D380 PolarHBondContact O-N 3.08Å; V378-N381 PolarHBondContact O-N 2.89Å
379	G	92.1	Very high	95.2	Very high	62 Å²	62	47.7 Å²	47.7	64%	0.639	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.1	176.6	0	0	0	0	0	115	D355	D355-G379 PolarHBondContact OD2-N 3.37Å
380	D	93.5	Very high	95.3	Very high	95 Å²	95	52.9 Å²	52.9	51%	0.508	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-14	-175.2	-60.3	-55.4	0	0	0	114.1	R377 V378 V382	R377-D380 HydrophobicContact CB-CB 4.06Å; R377-D380 WeakPolarHBondContact CD-OD2 3.42Å; R377-D380 IonicContact CZ-OD2 3.83Å; R377-D380 IonicContact NE-OD2 3.4Å; R377-D380 IonicContact NH1-OD2 2.73Å; R377-D380 PolarHBondContact NH1-OD2 3.14Å; R377-D380 PolarHBondContact O-N 3Å; V378-D380 VanDerWaalsContact C-N 3.27Å; V378-D380 PolarHBondContact O-N 3.08Å; D380-V382 WeakPolarHBondContact O-CG2 3.27Å; D380-V382 PolarHBondContact O-N 2.86Å
381	N	95.6	Very high	95.4	Very high	71 Å²	71	54 Å²	54	38%	0.38	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	46.7	-173.8	-169.1	14.4	0	0	0	113.2	A337 Y376 R377 V378	A337-N381 WeakPolarHBondContact CB-O 3.46Å; A337-N381 WeakPolarHBondContact CB-OD1 3.14Å; A337-N381 PolarHBondContact N-OD1 3.38Å; Y376-N381 WeakPolarHBondContact CE2-OD1 3.31Å; Y376-N381 WeakPolarHBondContact OH-CA 3Å; Y376-N381 PolarHBondContact OH-OD1 2.77Å; R377-N381 PolarHBondContact O-N 2.73Å; V378-N381 PolarHBondContact O-N 2.89Å
382	V	96.2	Very high	95.4	Very high	63 Å²	63	52.9 Å²	52.9	38%	0.382	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	135.2	-176.2	171.4	0	0	0	0	112	Y376 R377 D380	Y376-V382 WeakPolarHBondContact CA-O 3.39Å; R377-V382 PolarHBondContact N-O 2.82Å; D380-V382 WeakPolarHBondContact O-CG2 3.27Å; D380-V382 PolarHBondContact O-N 2.86Å
383	W	97.1	Very high	95.4	Very high	25 Å²	25	51.7 Å²	51.7	10%	0.095	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	134.9	167.7	-72.6	95.4	0	0	0	111.6	M323 A337 L339 P340 L348 I374 Y375 Y376	M323-W383 HydrophobicContact CE-CZ2 4.08Å; M323-W383 HydrophobicContact SD-CZ2 3.46Å; M323-W383 WeakPolarHBondContact SD-CZ2 3.45Å; A337-W383 PolarHBondContact O-NE1 2.82Å; L339-W383 HydrophobicContact CD2-CD2 4.06Å; L339-W383 HydrophobicContact CD2-CE3 4.09Å; L339-W383 HydrophobicContact CD2-CH2 3.48Å; L339-W383 VanDerWaalsContact CD2-CH2 3.48Å; L339-W383 HydrophobicContact CD2-CZ2 3.4Å; L339-W383 VanDerWaalsContact CD2-CZ2 3.4Å; L339-W383 HydrophobicContact CD2-CZ3 3.84Å; L339-W383 HydrophobicContact CG-CZ2 4.19Å; P340-W383 HydrophobicContact CG-CB 3.9Å; L348-W383 HydrophobicContact CD1-CH2 4.13Å; I374-W383 HydrophobicContact CB-CE3 4.24Å; I374-W383 HydrophobicContact CD1-CE3 3.92Å; I374-W383 HydrophobicContact CD1-CZ3 4.18Å; I374-W383 HydrophobicContact CG1-CE3 3.82Å; I374-W383 HydrophobicContact CG1-CZ3 3.89Å; Y375-W383 VanDerWaalsContact C-CE3 3.45Å; Y375-W383 CarbonylContact O-C 3.4Å; Y375-W383 WeakPolarHBondContact O-CA 3.45Å; Y376-W383 AromaticContact CD2-CD1 3.88Å; Y376-W383 HydrophobicContact CD2-CD2 4.18Å; Y376-W383 AromaticContact CD2-CE2 3.87Å; Y376-W383 HydrophobicContact CD2-CG 4.21Å; Y376-W383 HydrophobicContact CD2-CZ2 4.43Å; Y376-W383 AromaticContact CD2-NE1 3.65Å; Y376-W383 HydrophobicContact CG-CD2 4.44Å; Y376-W383 HydrophobicContact CG-CZ2 4.3Å
384	T	96	Very high	95.2	Very high	37 Å²	37	51.6 Å²	51.6	23%	0.227	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.2	178.8	-51.2	0	0	0	0	109.5	I374 Y375	I374-T384 CarbonylContact C-O 3.56Å; I374-T384 VanDerWaalsContact CA-O 3.31Å; I374-T384 WeakPolarHBondContact CA-O 3.3Å; Y375-T384 HydrophobicContact CE1-CG2 3.9Å; Y375-T384 PolarHBondContact N-O 2.99Å; Y375-T384 PolarHBondContact O-N 2.82Å
385	E	93.9	Very high	94.8	Very high	134 Å²	134	52 Å²	52	63%	0.626	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	142.3	172.9	-63.6	-172.5	169.9	0	0	110.2	I374	I374-E385 HydrophobicContact CG2-CB 4.43Å; I374-E385 HydrophobicContact CG2-CG 3.91Å
386	T	94.2	Very high	94.5	Very high	32 Å²	32	50.1 Å²	50.1	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	-161.8	172.4	-173	0	0	0	0	109.1	V373 Y375 F428 D433	V373-T386 HydrophobicContact CB-CG2 3.74Å; V373-T386 HydrophobicContact CG1-CG2 3.53Å; V373-T386 PolarHBondContact O-N 2.97Å; Y375-T386 HydrophobicContact CD1-CG2 4.26Å; T386-F428 HydrophobicContact CG2-CE1 4.5Å; T386-F428 HydrophobicContact CG2-CE2 4.46Å; T386-F428 HydrophobicContact CG2-CZ 3.73Å; T386-D433 PolarHBondContact OG1-OD1 3.16Å
387	T	95.3	Very high	94.1	Very high	62 Å²	62	50.2 Å²	50.2	38%	0.38	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	-179.1	173.8	60.4	0	0	0	0	112	V373 F428 D433	V373-T387 VanDerWaalsContact CB-O 3.28Å; V373-T387 WeakPolarHBondContact CB-O 3.42Å; T387-F428 VanDerWaalsContact OG1-CE2 3.28Å; T387-F428 WeakPolarHBondContact OG1-CE2 3.15Å; T387-D433 VanDerWaalsContact CB-O 3.27Å; T387-D433 WeakPolarHBondContact CB-O 3.43Å; T387-D433 HydrophobicContact CG2-CB 4.13Å; T387-D433 WeakPolarHBondContact CG2-O 3.25Å; T387-D433 PolarHBondContact OG1-O 2.98Å
388	Q	95.9	Very high	93.9	Very high	118 Å²	118	46.7 Å²	46.7	55%	0.551	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	159.6	-173.1	-61.4	179.1	-0.5	0	0	110.7	N371	N371-Q388 PolarHBondContact ND2-OE1 3.21Å; N371-Q388 WeakPolarHBondContact O-CA 3.31Å
389	L	96.2	Very high	93.9	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	27%	0.269	C	S	.	.			trans	-67.4	149.9	167.1	-57.2	176.9	0	0	0	110.1	L360 N371 V373 V391 V393 L407 F428	L360-L389 HydrophobicContact CB-CD1 4.35Å; L360-L389 HydrophobicContact CD2-CD2 4.18Å; N371-L389 HydrophobicContact CB-CB 4.08Å; N371-L389 WeakPolarHBondContact CB-O 3.29Å; N371-L389 PolarHBondContact ND2-O 2.87Å; N371-L389 PolarHBondContact O-N 3.02Å; V373-L389 HydrophobicContact CG2-CD2 3.71Å; V373-L389 HydrophobicContact CG2-CG 3.71Å; L389-V391 VanDerWaalsContact C-N 3.31Å; L389-V393 HydrophobicContact CD1-CG1 3.79Å; L389-L407 HydrophobicContact CD1-CD1 3.63Å; L389-L407 HydrophobicContact CD2-CD1 3.36Å; L389-L407 HydrophobicContact CG-CD1 4.14Å; L389-F428 HydrophobicContact CD2-CD2 4.35Å
390	E	95	Very high	93.9	Very high	125 Å²	125	44.4 Å²	44.4	58%	0.584	25%	0.247	S	C	*	.	S	Bend	trans	-64.9	-38.5	173.9	-70	-65.8	158.9	0	0	111.2	C435 V437	E390-C435 HydrophobicContact CG-CB 4.21Å; E390-V437 HydrophobicContact CB-CG2 3.65Å; E390-V437 HydrophobicContact CG-CG2 4.09Å
391	V	94.3	Very high	93.9	Very high	44 Å²	44	40.5 Å²	40.5	27%	0.267	23%	0.226	S	C	.	.	S	Bend	trans	-125.5	127.2	179.7	-176.5	0	0	0	0	110.1	L389 V393 E412 L424 Q426 V437	L389-V391 VanDerWaalsContact C-N 3.31Å; V391-V393 PolarHBondContact O-N 2.7Å; V391-E412 HydrophobicContact CG1-CB 4.07Å; V391-L424 HydrophobicContact CB-CD1 4.05Å; V391-L424 HydrophobicContact CG1-CD1 4.04Å; V391-L424 HydrophobicContact CG2-CD1 3.79Å; V391-Q426 PolarHBondContact O-NE2 3Å; V391-Q426 PolarHBondContact O-OE1 2.76Å; V391-V437 HydrophobicContact CG2-CG2 4.49Å
392	A	95.1	Very high	93.7	Very high	26 Å²	26	43.4 Å²	43.4	22%	0.215	24%	0.242	C	C	.	.			trans	-62.5	128.1	173.1	0	0	0	0	0	110	L369 S370 N371	L369-A392 HydrophobicContact CB-CB 3.94Å; S370-A392 WeakPolarHBondContact O-CA 3.48Å; N371-A392 HydrophobicContact CB-CB 4Å
393	V	94.7	Very high	93.6	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	23%	0.232	C	C	.	.			trans	-143.7	145	-170	71.2	0	0	0	0	110.9	G361 G362 L369 S370 L389 V391 A396 L407 G409 E411	G361-V393 CarbonylContact C-O 3.54Å; G361-V393 VanDerWaalsContact CA-O 3.3Å; G361-V393 WeakPolarHBondContact CA-O 3.41Å; G362-V393 PolarHBondContact N-O 2.95Å; L369-V393 VanDerWaalsContact CD2-C 3.47Å; S370-V393 PolarHBondContact O-N 3Å; L389-V393 HydrophobicContact CD1-CG1 3.79Å; V391-V393 PolarHBondContact O-N 2.7Å; V393-A396 HydrophobicContact CG1-CB 4.2Å; V393-A396 HydrophobicContact CG2-CB 3.81Å; V393-L407 HydrophobicContact CG1-CD2 4.44Å; V393-G409 WeakPolarHBondContact CG2-O 3.29Å; V393-E411 VanDerWaalsContact CA-O 3.29Å; V393-E411 WeakPolarHBondContact CA-O 3.49Å; V393-E411 WeakPolarHBondContact CG2-O 3.23Å
394	S	93.1	Very high	93.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-132.7	147.5	171.9	62.4	0	0	0	0	112.6	K363 L369 A396 G410 E411	K363-S394 WeakPolarHBondContact CE-OG 3.34Å; L369-S394 VanDerWaalsContact CD2-N 3.28Å; L369-S394 VanDerWaalsContact CD2-OG 3.26Å; L369-S394 WeakPolarHBondContact CD2-OG 3.46Å; S394-A396 PolarHBondContact O-N 2.82Å; S394-G410 CarbonylContact O-C 3.14Å; S394-G410 VanDerWaalsContact O-CA 3.32Å; S394-G410 WeakPolarHBondContact O-CA 3.3Å; S394-E411 PolarHBondContact N-O 2.95Å; S394-E411 PolarHBondContact O-N 3.33Å
395	G	87.3	Confident	93.6	Very high	17 Å²	17	40.5 Å²	40.5	18%	0.175	23%	0.228	C	C	.	.	S	Bend	trans	62.7	25.4	179.5	0	0	0	0	0	113	Q345 G410 H447	Q345-G395 PolarHBondContact O-N 2.81Å; G395-G410 WeakPolarHBondContact O-CA 3.42Å; G395-H447 PolarHBondContact O-ND1 2.92Å; G395-H447 VanDerWaalsContact O-ND1 3.12Å
396	A	91.3	Very high	93.7	Very high	8 Å²	8	34.9 Å²	34.9	7%	0.066	20%	0.201	C	C	.	.			trans	-73.8	145.1	170.1	0	0	0	0	0	110.2	T347 V393 S394 L407 L408 G409	T347-A396 PolarHBondContact OG1-O 3.31Å; V393-A396 HydrophobicContact CG1-CB 4.2Å; V393-A396 HydrophobicContact CG2-CB 3.81Å; S394-A396 PolarHBondContact O-N 2.82Å; A396-L407 HydrophobicContact CB-CD2 3.71Å; A396-L408 WeakPolarHBondContact CA-O 3.3Å; A396-G409 WeakPolarHBondContact CB-O 3.05Å
397	A	89.9	Confident	93.7	Very high	7 Å²	7	33.5 Å²	33.5	6%	0.058	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.8	169.2	0	0	0	0	0	110.1	L407 L408 M448 A450	A397-L407 CarbonylContact O-C 3.53Å; A397-L407 WeakPolarHBondContact O-CA 3.46Å; A397-L408 HydrophobicContact CB-CB 4.3Å; A397-L408 PolarHBondContact N-O 2.85Å; A397-L408 PolarHBondContact O-N 3.33Å; A397-M448 HydrophobicContact CB-CG 3.73Å; A397-M448 WeakPolarHBondContact CB-O 3.41Å; A397-A450 HydrophobicContact CB-CB 3.72Å
398	G	91.8	Very high	93.6	Very high	22 Å²	22	30.5 Å²	30.5	23%	0.227	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.6	175.2	0	0	0	0	0	111.4	T347 Y406	T347-G398 VanDerWaalsContact CG2-N 3.28Å; G398-Y406 WeakPolarHBondContact CA-O 3.37Å
399	A	92.7	Very high	93.4	Very high	4 Å²	4	25 Å²	25	3%	0.033	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	119.4	175.4	0	0	0	0	0	109.1	Y406 A450 V452 V457	A399-Y406 PolarHBondContact N-O 2.91Å; A399-Y406 PolarHBondContact O-N 2.79Å; A399-A450 HydrophobicContact CB-CB 4.09Å; A399-V452 HydrophobicContact CB-CG2 3.62Å; A399-V457 HydrophobicContact CB-CG1 3.88Å
400	N	93.7	Very high	93.2	Very high	36 Å²	36	24.8 Å²	24.8	19%	0.193	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.6	171.2	170.6	37.7	0	0	0	109.5	V349 S350 G403 I405 V452	V349-N400 HydrophobicContact CG1-CB 3.46Å; V349-N400 VanDerWaalsContact CG1-CB 3.46Å; S350-N400 WeakPolarHBondContact O-CB 3.16Å; S350-N400 PolarHBondContact O-ND2 3.16Å; N400-G403 WeakPolarHBondContact OD1-CA 3.38Å; N400-G403 PolarHBondContact OD1-N 2.9Å; N400-I405 HydrophobicContact CB-CG1 4.45Å; N400-V452 WeakPolarHBondContact O-CG2 3.28Å
401	L	93.8	Very high	93	Very high	13 Å²	13	21 Å²	21	7%	0.068	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	114.5	172.1	174.6	67.9	0	0	0	108.6	G403 I404 Y406 V452 K454 V457 P471	L401-G403 VanDerWaalsContact C-N 3.27Å; L401-G403 PolarHBondContact O-N 2.79Å; L401-I404 PolarHBondContact N-O 2.81Å; L401-I404 PolarHBondContact O-N 2.9Å; L401-Y406 HydrophobicContact CB-CD2 4.24Å; L401-Y406 HydrophobicContact CB-CE2 3.92Å; L401-Y406 HydrophobicContact CD2-CE2 4.34Å; L401-V452 HydrophobicContact CB-CG1 4.22Å; L401-V452 HydrophobicContact CB-CG2 4.37Å; L401-V452 HydrophobicContact CD1-CG1 3.58Å; L401-V452 HydrophobicContact CG-CG1 4.44Å; L401-K454 WeakPolarHBondContact CD1-O 3.4Å; L401-V457 HydrophobicContact CD2-CG2 4.33Å; L401-P471 HydrophobicContact CD2-CB 4.45Å; L401-P471 HydrophobicContact CD2-CG 3.72Å
402	N	90.6	Very high	93	Very high	132 Å²	132	19.8 Å²	19.8	71%	0.706	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	39.9	175.7	-59.9	-25.2	0	0	0	114.2	I404	N402-I404 VanDerWaalsContact C-N 3.32Å; N402-I404 PolarHBondContact O-N 3.41Å
403	G	92.9	Very high	92.8	Very high	16 Å²	16	21.1 Å²	21.1	17%	0.165	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	0.1	178.4	0	0	0	0	0	114.6	N400 L401 T430	N400-G403 WeakPolarHBondContact OD1-CA 3.38Å; N400-G403 PolarHBondContact OD1-N 2.9Å; L401-G403 VanDerWaalsContact C-N 3.27Å; L401-G403 PolarHBondContact O-N 2.79Å; G403-T430 WeakPolarHBondContact O-CB 3.41Å; G403-T430 VanDerWaalsContact O-CG2 3.29Å; G403-T430 WeakPolarHBondContact O-CG2 3.26Å; G403-T430 PolarHBondContact O-N 2.76Å; G403-T430 PolarHBondContact O-OG1 2.86Å
404	I	96.3	Very high	92.5	Very high	49 Å²	49	23.6 Å²	23.6	25%	0.251	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.5	171.8	-56.7	175.9	0	0	0	108.5	L401 N402 Y406 C427	L401-I404 PolarHBondContact N-O 2.81Å; L401-I404 PolarHBondContact O-N 2.9Å; N402-I404 VanDerWaalsContact C-N 3.32Å; N402-I404 PolarHBondContact O-N 3.41Å; I404-Y406 HydrophobicContact CB-CE2 3.84Å; I404-Y406 HydrophobicContact CG2-CD2 4.13Å; I404-Y406 HydrophobicContact CG2-CE2 3.63Å; I404-Y406 WeakPolarHBondContact O-CD2 3.22Å; I404-C427 HydrophobicContact CG2-CB 3.99Å
405	I	97.1	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.5	174.6	-57.3	173.1	0	0	0	108.7	V349 V351 Y358 L360 N400 C427 F428 T430	V349-I405 HydrophobicContact CB-CD1 4.39Å; V349-I405 HydrophobicContact CB-CG2 4.26Å; V349-I405 HydrophobicContact CG1-CD1 4.43Å; V349-I405 HydrophobicContact CG1-CG1 4.22Å; V349-I405 HydrophobicContact CG1-CG2 4.21Å; V349-I405 HydrophobicContact CG2-CG2 3.97Å; V351-I405 HydrophobicContact CG2-CD1 3.92Å; V351-I405 HydrophobicContact CG2-CG1 4.22Å; Y358-I405 HydrophobicContact CD1-CD1 3.96Å; Y358-I405 HydrophobicContact CD2-CD1 4.01Å; Y358-I405 HydrophobicContact CG-CD1 3.59Å; L360-I405 HydrophobicContact CD1-CD1 4.22Å; L360-I405 HydrophobicContact CD1-CG2 4.03Å; L360-I405 HydrophobicContact CD2-CD1 4.34Å; L360-I405 HydrophobicContact CD2-CG2 4.22Å; N400-I405 HydrophobicContact CB-CG1 4.45Å; I405-C427 WeakPolarHBondContact O-CA 3.35Å; I405-F428 HydrophobicContact CB-CB 4.3Å; I405-F428 PolarHBondContact N-O 3.08Å; I405-F428 PolarHBondContact O-N 3.24Å; I405-T430 HydrophobicContact CD1-CG2 3.74Å; I405-T430 HydrophobicContact CG1-CG2 3.89Å
406	Y	95.7	Very high	91.9	Very high	16 Å²	16	36.4 Å²	36.4	6%	0.063	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.4	173.1	-65.8	-99.8	0	0	0	109.3	G398 A399 L401 I404 I425 C427 Y469 P471	G398-Y406 WeakPolarHBondContact CA-O 3.37Å; A399-Y406 PolarHBondContact N-O 2.91Å; A399-Y406 PolarHBondContact O-N 2.79Å; L401-Y406 HydrophobicContact CB-CD2 4.24Å; L401-Y406 HydrophobicContact CB-CE2 3.92Å; L401-Y406 HydrophobicContact CD2-CE2 4.34Å; I404-Y406 HydrophobicContact CB-CE2 3.84Å; I404-Y406 HydrophobicContact CG2-CD2 4.13Å; I404-Y406 HydrophobicContact CG2-CE2 3.63Å; I404-Y406 WeakPolarHBondContact O-CD2 3.22Å; Y406-I425 HydrophobicContact CD1-CG2 4.24Å; Y406-C427 WeakPolarHBondContact CD1-SG 2.8Å; Y406-C427 WeakPolarHBondContact CE1-SG 3.29Å; Y406-Y469 HydrophobicContact CD1-CE1 4.05Å; Y406-Y469 AromaticContact CE1-CE1 3.99Å; Y406-Y469 HydrophobicContact CE1-CE1 3.99Å; Y406-P471 HydrophobicContact CE1-CB 3.97Å; Y406-P471 HydrophobicContact CE1-CG 4.23Å; Y406-P471 WeakPolarHBondContact OH-CB 3.37Å
407	L	95.2	Very high	91.4	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.9	170.6	-85.7	155.7	0	0	0	108.8	T347 L360 L389 V393 A396 A397 I425 Q426	T347-L407 HydrophobicContact CG2-CD2 3.95Å; T347-L407 WeakPolarHBondContact OG1-CD2 3.43Å; L360-L407 HydrophobicContact CB-CD1 3.89Å; L360-L407 HydrophobicContact CB-CD2 4.33Å; L360-L407 HydrophobicContact CD2-CD1 3.81Å; L360-L407 HydrophobicContact CG-CD1 4.38Å; L389-L407 HydrophobicContact CD1-CD1 3.63Å; L389-L407 HydrophobicContact CD2-CD1 3.36Å; L389-L407 HydrophobicContact CG-CD1 4.14Å; V393-L407 HydrophobicContact CG1-CD2 4.44Å; A396-L407 HydrophobicContact CB-CD2 3.71Å; A397-L407 CarbonylContact O-C 3.53Å; A397-L407 WeakPolarHBondContact O-CA 3.46Å; L407-I425 WeakPolarHBondContact O-CA 3.34Å; L407-Q426 HydrophobicContact CB-CB 4.04Å; L407-Q426 PolarHBondContact N-O 3.48Å; L407-Q426 PolarHBondContact O-N 3.29Å
408	L	93.6	Very high	91.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.9	-168.5	-54.3	165.9	0	0	0	109.5	A396 A397 I425 L442 M448 A450 V457 I459	A396-L408 WeakPolarHBondContact CA-O 3.3Å; A397-L408 HydrophobicContact CB-CB 4.3Å; A397-L408 PolarHBondContact N-O 2.85Å; A397-L408 PolarHBondContact O-N 3.33Å; L408-I425 HydrophobicContact CD2-CB 4.26Å; L408-I425 HydrophobicContact CD2-CG1 3.92Å; L408-I425 HydrophobicContact CD2-CG2 3.76Å; L408-L442 HydrophobicContact CB-CD1 3.93Å; L408-L442 HydrophobicContact CD2-CD1 4.41Å; L408-L442 HydrophobicContact CD2-CD2 4.25Å; L408-M448 HydrophobicContact CB-CG 4.4Å; L408-M448 HydrophobicContact CB-SD 3.53Å; L408-M448 VanDerWaalsContact CB-SD 3.53Å; L408-M448 VanDerWaalsContact O-CG 3.22Å; L408-M448 WeakPolarHBondContact O-CG 3.46Å; L408-A450 HydrophobicContact CD1-CB 3.69Å; L408-V457 HydrophobicContact CD1-CG1 3.9Å; L408-I459 HydrophobicContact CD1-CD1 3.7Å; L408-I459 HydrophobicContact CD1-CG1 3.86Å; L408-I459 HydrophobicContact CD2-CD1 4.38Å
409	G	92.1	Very high	91	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.021	27%	0.272	C	S	.	.			trans	62.3	-133.9	174.8	0	0	0	0	0	114.1	V393 A396 S422 L424 L442	V393-G409 WeakPolarHBondContact CG2-O 3.29Å; A396-G409 WeakPolarHBondContact CB-O 3.05Å; G409-S422 WeakPolarHBondContact CA-O 3.35Å; G409-L424 PolarHBondContact N-O 3.37Å; G409-L442 VanDerWaalsContact N-CD1 3.28Å
410	G	90.6	Very high	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	88.9	-149.6	-172	0	0	0	0	0	112.6	S394 G395 S422 G446	S394-G410 CarbonylContact O-C 3.14Å; S394-G410 VanDerWaalsContact O-CA 3.32Å; S394-G410 WeakPolarHBondContact O-CA 3.3Å; G395-G410 WeakPolarHBondContact O-CA 3.42Å; G410-S422 PolarHBondContact O-N 3.28Å; G410-G446 WeakPolarHBondContact CA-O 3.48Å; G410-G446 PolarHBondContact N-O 2.61Å; G410-G446 WeakPolarHBondContact O-CA 3.31Å
411	E	91.7	Very high	90.7	Very high	46 Å²	46	59 Å²	59	22%	0.215	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.5	173.3	-61.6	-178.3	158.6	0	0	110	K363 L369 V393 S394 K420 H447	K363-E411 WeakPolarHBondContact CE-OE2 3.32Å; K363-E411 IonicContact NZ-OE2 3.66Å; K363-E411 PolarHBondContact NZ-OE2 2.79Å; L369-E411 WeakPolarHBondContact CD2-O 3.42Å; V393-E411 VanDerWaalsContact CA-O 3.29Å; V393-E411 WeakPolarHBondContact CA-O 3.49Å; V393-E411 WeakPolarHBondContact CG2-O 3.23Å; S394-E411 PolarHBondContact N-O 2.95Å; S394-E411 PolarHBondContact O-N 3.33Å; E411-K420 WeakPolarHBondContact CA-O 3.33Å; E411-H447 IonicContact OE1-NE2 2.74Å
412	E	93.5	Very high	90.6	Very high	18 Å²	18	58.4 Å²	58.4	8%	0.084	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	167.4	174.7	70.3	-174.6	-157	0	0	109.8	V391 T419 K420 S422 L424	V391-E412 HydrophobicContact CG1-CB 4.07Å; E412-T419 CarbonylContact O-C 3.53Å; E412-T419 WeakPolarHBondContact O-CA 3.45Å; E412-K420 HydrophobicContact CG-CD 4.42Å; E412-K420 HydrophobicContact CG-CG 3.95Å; E412-K420 PolarHBondContact N-O 3.11Å; E412-K420 PolarHBondContact O-N 2.86Å; E412-K420 WeakPolarHBondContact OE1-CE 3.23Å; E412-K420 IonicContact OE1-NZ 3.8Å; E412-K420 PolarHBondContact OE1-NZ 2.94Å; E412-S422 VanDerWaalsContact OE2-CB 3.27Å; E412-S422 WeakPolarHBondContact OE2-CB 3.35Å; E412-S422 PolarHBondContact OE2-OG 2.85Å; E412-L424 WeakPolarHBondContact OE2-CD1 3.2Å; E412-L424 VanDerWaalsContact OE2-CG 3.25Å; E412-L424 WeakPolarHBondContact OE2-CG 3.41Å
413	N	91.8	Very high	90.7	Very high	54 Å²	54	57 Å²	57	29%	0.289	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	141.1	170.5	-77.2	-29.9	0	0	0	111.2	L369 F417 F418	L369-N413 HydrophobicContact CD1-CB 4.39Å; L369-N413 WeakPolarHBondContact CD1-OD1 3.43Å; N413-F417 PolarHBondContact OD1-O 2.82Å; N413-F418 CarbonylContact C-O 3.59Å; N413-F418 WeakPolarHBondContact CA-O 3.46Å
414	D	87.1	Confident	90.7	Very high	53 Å²	53	58 Å²	58	28%	0.283	29%	0.287	S	S	.	.			trans	-77.9	-176.6	160.7	71.1	13.7	0	0	0	111.8	D416 F417 F418 K420	D414-D416 PolarHBondContact O-N 3.19Å; D414-D416 WeakPolarHBondContact OD1-CA 3.44Å; D414-D416 PolarHBondContact OD1-N 3.45Å; D414-F417 PolarHBondContact O-N 3.19Å; D414-F417 VanDerWaalsContact O-N 3.15Å; D414-F417 PolarHBondContact OD1-N 2.75Å; D414-F417 VanDerWaalsContact OD1-N 3.11Å; D414-F418 PolarHBondContact N-O 2.94Å; D414-F418 PolarHBondContact OD1-N 2.95Å; D414-K420 HydrophobicContact CB-CD 3.88Å; D414-K420 HydrophobicContact CB-CG 4.18Å
415	L	83.3	Confident	90.6	Very high	167 Å²	167	55.7 Å²	55.7	87%	0.874	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.9	-178	-66.4	172.6	0	0	0	113
416	D	85.6	Confident	90.6	Very high	120 Å²	120	55.9 Å²	55.9	64%	0.642	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	11.7	-179.3	-65.1	-41.1	0	0	0	111.8	D414 F418	D414-D416 PolarHBondContact O-N 3.19Å; D414-D416 WeakPolarHBondContact OD1-CA 3.44Å; D414-D416 PolarHBondContact OD1-N 3.45Å; D416-F418 HydrophobicContact CB-CD2 3.69Å; D416-F418 HydrophobicContact CB-CE2 3.89Å; D416-F418 PolarHBondContact O-N 2.8Å
417	F	80.3	Confident	90.6	Very high	172 Å²	172	55.1 Å²	55.1	75%	0.754	27%	0.273	S	S	*	.	S	Bend	trans	63.4	20.8	-177.5	-57.8	-88.9	0	0	0	114.9	N413 D414	N413-F417 PolarHBondContact OD1-O 2.82Å; D414-F417 PolarHBondContact O-N 3.19Å; D414-F417 VanDerWaalsContact O-N 3.15Å; D414-F417 PolarHBondContact OD1-N 2.75Å; D414-F417 VanDerWaalsContact OD1-N 3.11Å
418	F	86.6	Confident	90.7	Very high	143 Å²	143	55 Å²	55	63%	0.627	27%	0.273	S	S	*	.			trans	-85	139.8	167.3	-64	-74.1	0	0	0	110.4	N413 D414 D416 K420	N413-F418 CarbonylContact C-O 3.59Å; N413-F418 WeakPolarHBondContact CA-O 3.46Å; D414-F418 PolarHBondContact N-O 2.94Å; D414-F418 PolarHBondContact OD1-N 2.95Å; D416-F418 HydrophobicContact CB-CD2 3.69Å; D416-F418 HydrophobicContact CB-CE2 3.89Å; D416-F418 PolarHBondContact O-N 2.8Å; F418-K420 PolarHBondContact O-N 2.98Å
419	T	87.5	Confident	90.9	Very high	72 Å²	72	56.9 Å²	56.9	44%	0.442	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.2	177	52.3	0	0	0	0	110.5	L369 E412	L369-T419 HydrophobicContact CD1-CG2 3.93Å; E412-T419 CarbonylContact O-C 3.53Å; E412-T419 WeakPolarHBondContact O-CA 3.45Å
420	K	90.2	Very high	91	Very high	84 Å²	84	56.8 Å²	56.8	37%	0.365	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.9	173.7	59.6	165.2	177.6	156.6	0	111.4	E411 E412 D414 F418 S422	E411-K420 WeakPolarHBondContact CA-O 3.33Å; E412-K420 HydrophobicContact CG-CD 4.42Å; E412-K420 HydrophobicContact CG-CG 3.95Å; E412-K420 PolarHBondContact N-O 3.11Å; E412-K420 PolarHBondContact O-N 2.86Å; E412-K420 WeakPolarHBondContact OE1-CE 3.23Å; E412-K420 IonicContact OE1-NZ 3.8Å; E412-K420 PolarHBondContact OE1-NZ 2.94Å; D414-K420 HydrophobicContact CB-CD 3.88Å; D414-K420 HydrophobicContact CB-CG 4.18Å; F418-K420 PolarHBondContact O-N 2.98Å; K420-S422 PolarHBondContact O-N 3.24Å
421	P	90.4	Very high	91.3	Very high	79 Å²	79	63.1 Å²	63.1	51%	0.513	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	124.6	171.3	-26	36.2	0	0	0	111.9	A445	P421-A445 HydrophobicContact CB-CB 3.67Å
422	S	90.9	Very high	91.5	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.007	32%	0.323	C	S	.	.			trans	-86.8	145.3	178	-173.3	0	0	0	0	111.4	G409 G410 E412 K420 L424 A445 G446	G409-S422 WeakPolarHBondContact CA-O 3.35Å; G410-S422 PolarHBondContact O-N 3.28Å; E412-S422 VanDerWaalsContact OE2-CB 3.27Å; E412-S422 WeakPolarHBondContact OE2-CB 3.35Å; E412-S422 PolarHBondContact OE2-OG 2.85Å; K420-S422 PolarHBondContact O-N 3.24Å; S422-L424 WeakPolarHBondContact OG-CB 3.06Å; S422-L424 WeakPolarHBondContact OG-CG 3.19Å; S422-L424 PolarHBondContact OG-N 2.83Å; S422-L424 VanDerWaalsContact OG-N 3.09Å; S422-A445 WeakPolarHBondContact O-CA 3.36Å; S422-G446 PolarHBondContact O-N 3.1Å; S422-G446 VanDerWaalsContact O-N 3.08Å
423	R	91.8	Very high	91.5	Very high	103 Å²	103	66.2 Å²	66.2	39%	0.389	33%	0.332	S	S	.	.			trans	-113	8	168.8	-58.8	178.1	67.6	123.3	-5.8	111.7	V441 L442 P443 A445	R423-V441 HydrophobicContact CB-CB 4Å; R423-L442 HydrophobicContact CB-CB 4.47Å; R423-L442 PolarHBondContact NE-O 2.65Å; R423-L442 PolarHBondContact NH2-O 2.82Å; R423-L442 PolarHBondContact O-N 3.18Å; R423-P443 PolarHBondContact NH1-O 3.39Å; R423-P443 VanDerWaalsContact NH2-CA 3.29Å; R423-P443 PolarHBondContact NH2-O 3.21Å; R423-A445 HydrophobicContact CG-CB 3.43Å; R423-A445 VanDerWaalsContact CG-CB 3.43Å
424	L	93.3	Very high	91.7	Very high	36 Å²	36	70.3 Å²	70.3	19%	0.188	35%	0.348	C	S	.	.			trans	-73.4	153.3	-172.8	-62.4	-175.9	0	0	0	111.5	V391 G409 E412 S422 V437 L442	V391-L424 HydrophobicContact CB-CD1 4.05Å; V391-L424 HydrophobicContact CG1-CD1 4.04Å; V391-L424 HydrophobicContact CG2-CD1 3.79Å; G409-L424 PolarHBondContact N-O 3.37Å; E412-L424 WeakPolarHBondContact OE2-CD1 3.2Å; E412-L424 VanDerWaalsContact OE2-CG 3.25Å; E412-L424 WeakPolarHBondContact OE2-CG 3.41Å; S422-L424 WeakPolarHBondContact OG-CB 3.06Å; S422-L424 WeakPolarHBondContact OG-CG 3.19Å; S422-L424 PolarHBondContact OG-N 2.83Å; S422-L424 VanDerWaalsContact OG-N 3.09Å; L424-V437 HydrophobicContact CB-CG1 4.48Å; L424-V437 HydrophobicContact CD2-CG1 4.09Å; L424-L442 WeakPolarHBondContact O-CD1 3.38Å
425	I	94.8	Very high	92.1	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	106.8	169.4	-56.6	169.7	0	0	0	105.5	Y406 L407 L408 K438 L442 F476	Y406-I425 HydrophobicContact CD1-CG2 4.24Å; L407-I425 WeakPolarHBondContact O-CA 3.34Å; L408-I425 HydrophobicContact CD2-CB 4.26Å; L408-I425 HydrophobicContact CD2-CG1 3.92Å; L408-I425 HydrophobicContact CD2-CG2 3.76Å; I425-K438 HydrophobicContact CB-CB 4.08Å; I425-K438 HydrophobicContact CB-CG 4.31Å; I425-K438 HydrophobicContact CG2-CB 4.28Å; I425-K438 HydrophobicContact CG2-CG 3.94Å; I425-K438 PolarHBondContact O-N 2.98Å; I425-L442 HydrophobicContact CD1-CD2 3.99Å; I425-L442 HydrophobicContact CD1-CG 3.97Å; I425-L442 HydrophobicContact CG1-CD1 4.02Å; I425-L442 HydrophobicContact CG1-CD2 4Å; I425-L442 HydrophobicContact CG1-CG 3.61Å; I425-F476 HydrophobicContact CD1-CZ 3.75Å
426	Q	96.2	Very high	92.6	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.019	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.5	174.5	-54.3	-170.8	74.2	0	0	108.4	V391 L407 V437	V391-Q426 PolarHBondContact O-NE2 3Å; V391-Q426 PolarHBondContact O-OE1 2.76Å; L407-Q426 HydrophobicContact CB-CB 4.04Å; L407-Q426 PolarHBondContact N-O 3.48Å; L407-Q426 PolarHBondContact O-N 3.29Å; Q426-V437 HydrophobicContact CG-CG2 4.25Å
427	C	96.4	Very high	93.1	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.007	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.4	179.4	-65.6	0	0	0	0	108.2	I404 I405 Y406 C435 H436	I404-C427 HydrophobicContact CG2-CB 3.99Å; I405-C427 WeakPolarHBondContact O-CA 3.35Å; Y406-C427 WeakPolarHBondContact CD1-SG 2.8Å; Y406-C427 WeakPolarHBondContact CE1-SG 3.29Å; C427-C435 CarbonylContact O-C 3.59Å; C427-C435 WeakPolarHBondContact O-CA 3.47Å; C427-H436 WeakPolarHBondContact CB-CE1 3.48Å; C427-H436 VanDerWaalsContact CB-NE2 3.34Å; C427-H436 WeakPolarHBondContact CB-NE2 3.49Å; C427-H436 PolarHBondContact N-O 3.39Å; C427-H436 PolarHBondContact O-N 2.87Å; C427-H436 PolarHBondContact O-ND1 3.34Å
428	F	97.6	Very high	93.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	109.8	174.1	-172.6	-85.7	0	0	0	109	Y358 L360 V373 T386 T387 L389 I405 T430 D433 C435	Y358-F428 HydrophobicContact CD1-CE1 4.22Å; Y358-F428 HydrophobicContact CE1-CD1 4.48Å; Y358-F428 AromaticContact CE1-CE1 3.81Å; Y358-F428 HydrophobicContact CE1-CE1 3.81Å; L360-F428 HydrophobicContact CD2-CB 4.14Å; L360-F428 HydrophobicContact CD2-CG 4.18Å; V373-F428 HydrophobicContact CB-CE2 4.18Å; V373-F428 HydrophobicContact CB-CZ 4.45Å; V373-F428 HydrophobicContact CG1-CD2 4.49Å; V373-F428 HydrophobicContact CG1-CE1 4.28Å; V373-F428 HydrophobicContact CG1-CE2 4.06Å; V373-F428 HydrophobicContact CG1-CZ 3.96Å; V373-F428 HydrophobicContact CG2-CD2 4.1Å; V373-F428 HydrophobicContact CG2-CE2 3.96Å; T386-F428 HydrophobicContact CG2-CE1 4.5Å; T386-F428 HydrophobicContact CG2-CE2 4.46Å; T386-F428 HydrophobicContact CG2-CZ 3.73Å; T387-F428 VanDerWaalsContact OG1-CE2 3.28Å; T387-F428 WeakPolarHBondContact OG1-CE2 3.15Å; L389-F428 HydrophobicContact CD2-CD2 4.35Å; I405-F428 HydrophobicContact CB-CB 4.3Å; I405-F428 PolarHBondContact N-O 3.08Å; I405-F428 PolarHBondContact O-N 3.24Å; F428-T430 HydrophobicContact CD1-CG2 4.15Å; F428-T430 HydrophobicContact CE1-CG2 4.41Å; F428-T430 PolarHBondContact O-N 3.06Å; F428-D433 HydrophobicContact CZ-CB 4.48Å; F428-C435 HydrophobicContact CD2-CB 4.08Å
429	D	96.6	Very high	93.6	Very high	38 Å²	38	53.4 Å²	53.4	20%	0.203	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.5	175	176.6	-5	0	0	0	109.1	E431 T432 D433 K434	D429-E431 VanDerWaalsContact C-N 3.3Å; D429-E431 PolarHBondContact O-N 3.47Å; D429-E431 WeakPolarHBondContact OD1-CB 3.32Å; D429-E431 PolarHBondContact OD1-N 3.26Å; D429-T432 WeakPolarHBondContact CB-OG1 3.18Å; D429-T432 PolarHBondContact OD1-N 2.96Å; D429-T432 WeakPolarHBondContact OD2-CG2 3.02Å; D429-T432 PolarHBondContact OD2-OG1 3.13Å; D429-D433 VanDerWaalsContact O-CA 3.28Å; D429-D433 WeakPolarHBondContact O-CA 3.45Å; D429-D433 PolarHBondContact O-N 2.85Å; D429-K434 PolarHBondContact N-O 2.99Å; D429-K434 PolarHBondContact O-N 2.92Å
430	T	95.9	Very high	93.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-17.1	-176.5	65.2	0	0	0	0	113.1	V351 K354 Y358 G403 I405 F428	V351-T430 HydrophobicContact CG1-CG2 4.4Å; V351-T430 HydrophobicContact CG2-CG2 4.11Å; K354-T430 WeakPolarHBondContact CE-O 3.45Å; K354-T430 PolarHBondContact NZ-O 3.38Å; Y358-T430 HydrophobicContact CE1-CG2 4.18Å; Y358-T430 HydrophobicContact CE2-CG2 4.11Å; G403-T430 WeakPolarHBondContact O-CB 3.41Å; G403-T430 VanDerWaalsContact O-CG2 3.29Å; G403-T430 WeakPolarHBondContact O-CG2 3.26Å; G403-T430 PolarHBondContact O-N 2.76Å; G403-T430 PolarHBondContact O-OG1 2.86Å; I405-T430 HydrophobicContact CD1-CG2 3.74Å; I405-T430 HydrophobicContact CG1-CG2 3.89Å; F428-T430 HydrophobicContact CD1-CG2 4.15Å; F428-T430 HydrophobicContact CE1-CG2 4.41Å; F428-T430 PolarHBondContact O-N 3.06Å
431	E	95.6	Very high	93.4	Very high	133 Å²	133	56.1 Å²	56.1	62%	0.621	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-40.9	175.8	-67.3	-59	159.5	0	0	112.2	K354 D429	K354-E431 WeakPolarHBondContact CE-OE1 3.38Å; K354-E431 WeakPolarHBondContact CE-OE2 3.27Å; K354-E431 IonicContact NZ-OE1 3.71Å; K354-E431 PolarHBondContact NZ-OE1 2.93Å; K354-E431 IonicContact NZ-OE2 2.78Å; K354-E431 PolarHBondContact NZ-OE2 2.82Å; D429-E431 VanDerWaalsContact C-N 3.3Å; D429-E431 PolarHBondContact O-N 3.47Å; D429-E431 WeakPolarHBondContact OD1-CB 3.32Å; D429-E431 PolarHBondContact OD1-N 3.26Å
432	T	95.4	Very high	93.3	Very high	74 Å²	74	52.5 Å²	52.5	45%	0.454	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-7.3	-179.2	63.3	0	0	0	0	113.7	D429 K434	D429-T432 WeakPolarHBondContact CB-OG1 3.18Å; D429-T432 PolarHBondContact OD1-N 2.96Å; D429-T432 WeakPolarHBondContact OD2-CG2 3.02Å; D429-T432 PolarHBondContact OD2-OG1 3.13Å; T432-K434 PolarHBondContact O-N 2.78Å
433	D	94.7	Very high	93	Very high	54 Å²	54	54.7 Å²	54.7	29%	0.289	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	42.5	-170.9	-74.9	-51.8	0	0	0	111.3	T386 T387 F428 D429	T386-D433 PolarHBondContact OG1-OD1 3.16Å; T387-D433 VanDerWaalsContact CB-O 3.27Å; T387-D433 WeakPolarHBondContact CB-O 3.43Å; T387-D433 HydrophobicContact CG2-CB 4.13Å; T387-D433 WeakPolarHBondContact CG2-O 3.25Å; T387-D433 PolarHBondContact OG1-O 2.98Å; F428-D433 HydrophobicContact CZ-CB 4.48Å; D429-D433 VanDerWaalsContact O-CA 3.28Å; D429-D433 WeakPolarHBondContact O-CA 3.45Å; D429-D433 PolarHBondContact O-N 2.85Å
434	K	95	Very high	92.6	Very high	140 Å²	140	52.4 Å²	52.4	61%	0.609	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.1	179.8	-72.5	179.2	-176.9	179.5	0	111.3	D429 T432	D429-K434 PolarHBondContact N-O 2.99Å; D429-K434 PolarHBondContact O-N 2.92Å; T432-K434 PolarHBondContact O-N 2.78Å
435	C	95.8	Very high	92.3	Very high	13 Å²	13	52.7 Å²	52.7	9%	0.088	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	143.3	170	-164.8	0	0	0	0	110.1	E390 C427 F428	E390-C435 HydrophobicContact CG-CB 4.21Å; C427-C435 CarbonylContact O-C 3.59Å; C427-C435 WeakPolarHBondContact O-CA 3.47Å; F428-C435 HydrophobicContact CD2-CB 4.08Å
436	H	94.2	Very high	91.6	Very high	84 Å²	84	53 Å²	53	39%	0.389	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.7	167	60.3	-82.7	0	0	0	110.4	C427	C427-H436 WeakPolarHBondContact CB-CE1 3.48Å; C427-H436 VanDerWaalsContact CB-NE2 3.34Å; C427-H436 WeakPolarHBondContact CB-NE2 3.49Å; C427-H436 PolarHBondContact N-O 3.39Å; C427-H436 PolarHBondContact O-N 2.87Å; C427-H436 PolarHBondContact O-ND1 3.34Å
437	V	94.9	Very high	90.8	Very high	54 Å²	54	55 Å²	55	33%	0.327	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129	174.3	-170.8	0	0	0	0	108.7	E390 V391 L424 Q426	E390-V437 HydrophobicContact CB-CG2 3.65Å; E390-V437 HydrophobicContact CG-CG2 4.09Å; V391-V437 HydrophobicContact CG2-CG2 4.49Å; L424-V437 HydrophobicContact CB-CG1 4.48Å; L424-V437 HydrophobicContact CD2-CG1 4.09Å; Q426-V437 HydrophobicContact CG-CG2 4.25Å
438	K	92.3	Very high	90.3	Very high	36 Å²	36	55.1 Å²	55.1	16%	0.157	29%	0.29	C	S	.	.			trans	-68.2	144.9	173.9	-72.6	-80.8	-169.6	153.4	0	110.2	I425 Y440 D474	I425-K438 HydrophobicContact CB-CB 4.08Å; I425-K438 HydrophobicContact CB-CG 4.31Å; I425-K438 HydrophobicContact CG2-CB 4.28Å; I425-K438 HydrophobicContact CG2-CG 3.94Å; I425-K438 PolarHBondContact O-N 2.98Å; K438-Y440 VanDerWaalsContact C-N 3.25Å; K438-Y440 PolarHBondContact O-N 2.89Å; K438-D474 VanDerWaalsContact NZ-CG 3.3Å; K438-D474 IonicContact NZ-OD1 3.76Å; K438-D474 PolarHBondContact NZ-OD1 2.78Å; K438-D474 IonicContact NZ-OD2 3.41Å; K438-D474 PolarHBondContact NZ-OD2 2.9Å
439	P	86.1	Confident	89.7	Confident	113 Å²	113	57.7 Å²	57.7	73%	0.734	30%	0.302	S	S	*	.	S	Bend	trans	-70.1	-23.6	178.7	27.8	-34.1	0	0	0	112.9
440	Y	85.2	Confident	89.3	Confident	139 Å²	139	56.7 Å²	56.7	55%	0.545	30%	0.299	S	S	.	.	S	Bend	trans	-87.1	144.3	175.5	-57.7	-80.3	0	0	0	110.8	K438 D474	K438-Y440 VanDerWaalsContact C-N 3.25Å; K438-Y440 PolarHBondContact O-N 2.89Å; Y440-D474 HydrophobicContact CD2-CB 4Å; Y440-D474 HydrophobicContact CE2-CB 4.08Å
441	V	88.4	Confident	88.9	Confident	75 Å²	75	57.1 Å²	57.1	46%	0.455	30%	0.303	S	S	.	.			trans	-106.4	152.6	179.7	-64.1	0	0	0	0	111	R423	R423-V441 HydrophobicContact CB-CB 4Å
442	L	87.9	Confident	88.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	28%	0.284	C	S	.	.			trans	-59.3	148.3	174.1	-70.9	160.5	0	0	0	110.6	L408 G409 R423 L424 I425 F444 M448 I459 F476	L408-L442 HydrophobicContact CB-CD1 3.93Å; L408-L442 HydrophobicContact CD2-CD1 4.41Å; L408-L442 HydrophobicContact CD2-CD2 4.25Å; G409-L442 VanDerWaalsContact N-CD1 3.28Å; R423-L442 HydrophobicContact CB-CB 4.47Å; R423-L442 PolarHBondContact NE-O 2.65Å; R423-L442 PolarHBondContact NH2-O 2.82Å; R423-L442 PolarHBondContact O-N 3.18Å; L424-L442 WeakPolarHBondContact O-CD1 3.38Å; I425-L442 HydrophobicContact CD1-CD2 3.99Å; I425-L442 HydrophobicContact CD1-CG 3.97Å; I425-L442 HydrophobicContact CG1-CD1 4.02Å; I425-L442 HydrophobicContact CG1-CD2 4Å; I425-L442 HydrophobicContact CG1-CG 3.61Å; L442-F444 WeakPolarHBondContact CB-O 3.43Å; L442-F444 PolarHBondContact O-N 3.04Å; L442-M448 HydrophobicContact CD1-CE 3.74Å; L442-M448 HydrophobicContact CD1-SD 3.68Å; L442-I459 HydrophobicContact CD2-CD1 3.77Å; L442-F476 HydrophobicContact CD2-CE1 3.77Å; L442-F476 HydrophobicContact CD2-CZ 3.92Å
443	P	84.9	Confident	88	Confident	48 Å²	48	49.9 Å²	49.9	31%	0.312	27%	0.266	S	S	.	.	S	Bend	trans	-66	-18.5	175.9	23.5	-30.7	0	0	0	113.2	R423 V467 F476	R423-P443 PolarHBondContact NH1-O 3.39Å; R423-P443 VanDerWaalsContact NH2-CA 3.29Å; R423-P443 PolarHBondContact NH2-O 3.21Å; P443-V467 HydrophobicContact CG-CG2 4.43Å; P443-F476 HydrophobicContact CG-CD1 4.45Å
444	F	84.2	Confident	87.5	Confident	54 Å²	54	54.5 Å²	54.5	24%	0.237	28%	0.284	C	S	.	.	S	Bend	trans	-127.7	160.4	-180	-40.7	-69.6	0	0	0	110.8	L442 A461 V467	L442-F444 WeakPolarHBondContact CB-O 3.43Å; L442-F444 PolarHBondContact O-N 3.04Å; F444-A461 HydrophobicContact CB-CB 3.77Å; F444-A461 HydrophobicContact CD2-CB 3.82Å; F444-A461 HydrophobicContact CG-CB 3.97Å; F444-V467 HydrophobicContact CE2-CB 4.39Å; F444-V467 HydrophobicContact CE2-CG2 3.48Å; F444-V467 VanDerWaalsContact CE2-CG2 3.48Å; F444-V467 HydrophobicContact CZ-CG2 3.9Å
445	A	85.4	Confident	87.2	Confident	43 Å²	43	52.8 Å²	52.8	36%	0.355	28%	0.281	S	S	.	.			trans	-117.8	152.6	178.2	0	0	0	0	0	110.7	P421 S422 R423	P421-A445 HydrophobicContact CB-CB 3.67Å; S422-A445 WeakPolarHBondContact O-CA 3.36Å; R423-A445 HydrophobicContact CG-CB 3.43Å; R423-A445 VanDerWaalsContact CG-CB 3.43Å
446	G	81.4	Confident	87	Confident	7 Å²	7	54.6 Å²	54.6	7%	0.072	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	100.6	-155.4	171.5	0	0	0	0	0	113.8	G410 S422 M448	G410-G446 WeakPolarHBondContact CA-O 3.48Å; G410-G446 PolarHBondContact N-O 2.61Å; G410-G446 WeakPolarHBondContact O-CA 3.31Å; S422-G446 PolarHBondContact O-N 3.1Å; S422-G446 VanDerWaalsContact O-N 3.08Å; G446-M448 WeakPolarHBondContact O-CE 3.48Å
447	H	79.5	Confident	86.9	Confident	45 Å²	45	50.6 Å²	50.6	21%	0.208	27%	0.271	C	S	.	.			trans	-69.6	136.5	-176.6	-66	-57.5	0	0	0	112.2	G395 E411	G395-H447 PolarHBondContact O-ND1 2.92Å; G395-H447 VanDerWaalsContact O-ND1 3.12Å; E411-H447 IonicContact OE1-NE2 2.74Å
448	M	84.7	Confident	86.7	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.025	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	169.9	-179.3	57.6	-172.6	69.8	0	0	110.9	A397 L408 L442 G446 I459 V460 A461	A397-M448 HydrophobicContact CB-CG 3.73Å; A397-M448 WeakPolarHBondContact CB-O 3.41Å; L408-M448 HydrophobicContact CB-CG 4.4Å; L408-M448 HydrophobicContact CB-SD 3.53Å; L408-M448 VanDerWaalsContact CB-SD 3.53Å; L408-M448 VanDerWaalsContact O-CG 3.22Å; L408-M448 WeakPolarHBondContact O-CG 3.46Å; L442-M448 HydrophobicContact CD1-CE 3.74Å; L442-M448 HydrophobicContact CD1-SD 3.68Å; G446-M448 WeakPolarHBondContact O-CE 3.48Å; M448-I459 HydrophobicContact CB-CG2 4.23Å; M448-I459 HydrophobicContact CG-CG2 4.42Å; M448-I459 HydrophobicContact SD-CG2 3.82Å; M448-V460 CarbonylContact C-O 3.52Å; M448-V460 VanDerWaalsContact CA-O 3.26Å; M448-V460 WeakPolarHBondContact CA-O 3.49Å; M448-V460 VanDerWaalsContact CB-O 3.29Å; M448-V460 WeakPolarHBondContact CB-O 3Å; M448-A461 HydrophobicContact CB-CB 4.35Å
449	H	85.2	Confident	86.5	Confident	53 Å²	53	46.9 Å²	46.9	25%	0.245	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147	171.1	-63.7	78.3	0	0	0	108.8	I459 V460 W492 K493 I494	H449-I459 WeakPolarHBondContact O-CA 3.43Å; H449-V460 PolarHBondContact N-O 3.03Å; H449-V460 PolarHBondContact O-N 2.75Å; H449-W492 PolarHBondContact ND1-O 2.85Å; H449-W492 VanDerWaalsContact ND1-O 3.11Å; H449-K493 VanDerWaalsContact CD2-CD 3.48Å; H449-K493 WeakPolarHBondContact CD2-CD 3.17Å; H449-K493 VanDerWaalsContact CE1-CD 3.48Å; H449-K493 WeakPolarHBondContact CE1-CD 3.26Å; H449-K493 VanDerWaalsContact CE1-CE 3.45Å; H449-K493 WeakPolarHBondContact CE1-CE 3.14Å; H449-K493 PolarHBondContact CE1-NZ 3.08Å; H449-K493 VanDerWaalsContact NE2-CD 3.31Å; H449-K493 WeakPolarHBondContact NE2-CD 3.41Å; H449-K493 WeakPolarHBondContact NE2-CE 3.44Å; H449-K493 PolarHBondContact NE2-NZ 2.8Å; H449-I494 VanDerWaalsContact C-CG2 3.45Å; H449-I494 HydrophobicContact CB-CG2 3.73Å; H449-I494 WeakPolarHBondContact O-CG2 3.22Å
450	A	88.4	Confident	86.4	Confident	18 Å²	18	41.7 Å²	41.7	15%	0.149	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.9	-178.7	0	0	0	0	0	111.1	A397 A399 L408 V457 F458 I459	A397-A450 HydrophobicContact CB-CB 3.72Å; A399-A450 HydrophobicContact CB-CB 4.09Å; L408-A450 HydrophobicContact CD1-CB 3.69Å; A450-V457 HydrophobicContact CB-CG1 4.17Å; A450-F458 CarbonylContact C-O 2.83Å; A450-F458 WeakPolarHBondContact CA-O 3.3Å; A450-I459 HydrophobicContact CB-CG1 4.47Å
451	A	87.1	Confident	86	Confident	10 Å²	10	35.2 Å²	35.2	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.9	172.3	0	0	0	0	0	109.5	F458 I494 I501	A451-F458 PolarHBondContact N-O 3.28Å; A451-F458 PolarHBondContact O-N 2.77Å; A451-I494 HydrophobicContact CB-CD1 4.38Å; A451-I494 HydrophobicContact CB-CG1 3.95Å; A451-I494 HydrophobicContact CB-CG2 4.15Å; A451-I501 HydrophobicContact CB-CD1 4.26Å
452	V	87.8	Confident	85	Confident	36 Å²	36	36.2 Å²	36.2	22%	0.218	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.1	178.1	180	0	0	0	0	109.3	A399 N400 L401 K454 L456 V457 S496	A399-V452 HydrophobicContact CB-CG2 3.62Å; N400-V452 WeakPolarHBondContact O-CG2 3.28Å; L401-V452 HydrophobicContact CB-CG1 4.22Å; L401-V452 HydrophobicContact CB-CG2 4.37Å; L401-V452 HydrophobicContact CD1-CG1 3.58Å; L401-V452 HydrophobicContact CG-CG1 4.44Å; V452-K454 WeakPolarHBondContact CG1-O 3.44Å; V452-L456 WeakPolarHBondContact CA-O 3.5Å; V452-V457 HydrophobicContact CG2-CG2 4.35Å; V452-S496 WeakPolarHBondContact O-CB 3.44Å; V452-S496 PolarHBondContact O-OG 3.27Å
453	H	85	Confident	83.7	Confident	19 Å²	19	38.4 Å²	38.4	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	118.1	168	171.8	88.4	0	0	0	108.9	D455 L456 F458 G499 I501	H453-D455 PolarHBondContact O-N 2.93Å; H453-L456 PolarHBondContact N-O 2.83Å; H453-L456 PolarHBondContact O-N 2.84Å; H453-L456 VanDerWaalsContact O-N 3.11Å; H453-F458 HydrophobicContact CB-CD2 4.19Å; H453-F458 HydrophobicContact CB-CE2 3.85Å; H453-G499 WeakPolarHBondContact CE1-CA 3.5Å; H453-G499 PolarHBondContact CE1-O 2.85Å; H453-G499 PolarHBondContact ND1-O 3.26Å; H453-I501 HydrophobicContact CB-CD1 3.88Å; H453-I501 HydrophobicContact CB-CG1 4.32Å
454	K	84.9	Confident	82.6	Confident	151 Å²	151	36.8 Å²	36.8	66%	0.657	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	-125.2	-170.8	-59.6	176	-179.5	176.8	0	109.4	L401 V452 L456	L401-K454 WeakPolarHBondContact CD1-O 3.4Å; V452-K454 WeakPolarHBondContact CG1-O 3.44Å; K454-L456 VanDerWaalsContact C-N 3.35Å
455	D	88.8	Confident	81.9	Confident	103 Å²	103	34.6 Å²	34.6	55%	0.551	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	13.7	-177.4	-55	-57.4	0	0	0	114.3	H453 P471	H453-D455 PolarHBondContact O-N 2.93Å; D455-P471 WeakPolarHBondContact O-CD 3.34Å
456	L	91.4	Very high	81.8	Confident	52 Å²	52	32.6 Å²	32.6	27%	0.272	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.3	-173.3	-62.4	174.5	0	0	0	111.6	V452 H453 K454 F458 N470	V452-L456 WeakPolarHBondContact CA-O 3.5Å; H453-L456 PolarHBondContact N-O 2.83Å; H453-L456 PolarHBondContact O-N 2.84Å; H453-L456 VanDerWaalsContact O-N 3.11Å; K454-L456 VanDerWaalsContact C-N 3.35Å; L456-F458 HydrophobicContact CB-CD2 4.47Å; L456-F458 HydrophobicContact CB-CE2 3.81Å; L456-F458 HydrophobicContact CB-CZ 4.48Å; L456-N470 HydrophobicContact CD2-CB 3.65Å
457	V	91.3	Very high	82.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	117	177.2	-173	0	0	0	0	109.1	A399 L401 L408 A450 V452 I459 Y469 P471	A399-V457 HydrophobicContact CB-CG1 3.88Å; L401-V457 HydrophobicContact CD2-CG2 4.33Å; L408-V457 HydrophobicContact CD1-CG1 3.9Å; A450-V457 HydrophobicContact CB-CG1 4.17Å; V452-V457 HydrophobicContact CG2-CG2 4.35Å; V457-I459 HydrophobicContact CG1-CG1 4.13Å; V457-Y469 HydrophobicContact CB-CD1 4.21Å; V457-Y469 HydrophobicContact CG2-CD1 4.35Å; V457-Y469 PolarHBondContact N-O 3.49Å; V457-Y469 PolarHBondContact O-N 3.24Å; V457-P471 HydrophobicContact CG2-CG 4Å
458	F	89.9	Confident	82.5	Confident	5 Å²	5	31 Å²	31	2%	0.022	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.8	176.9	-66.8	-104.2	0	0	0	109.1	A450 A451 H453 L456 C468 L479 I494 I501 L518 P520	A450-F458 CarbonylContact C-O 2.83Å; A450-F458 WeakPolarHBondContact CA-O 3.3Å; A451-F458 PolarHBondContact N-O 3.28Å; A451-F458 PolarHBondContact O-N 2.77Å; H453-F458 HydrophobicContact CB-CD2 4.19Å; H453-F458 HydrophobicContact CB-CE2 3.85Å; L456-F458 HydrophobicContact CB-CD2 4.47Å; L456-F458 HydrophobicContact CB-CE2 3.81Å; L456-F458 HydrophobicContact CB-CZ 4.48Å; F458-C468 HydrophobicContact CD1-CB 4.18Å; F458-C468 HydrophobicContact CE1-CB 4.04Å; F458-C468 HydrophobicContact CZ-CB 4.45Å; F458-L479 HydrophobicContact CD1-CD1 3.67Å; F458-L479 HydrophobicContact CE1-CD1 3.55Å; F458-I494 HydrophobicContact CB-CD1 3.47Å; F458-I494 VanDerWaalsContact CB-CD1 3.47Å; F458-I501 HydrophobicContact CB-CD1 4.13Å; F458-I501 HydrophobicContact CB-CG1 4.48Å; F458-I501 HydrophobicContact CD1-CG1 4.04Å; F458-I501 HydrophobicContact CD2-CD1 3.74Å; F458-I501 HydrophobicContact CD2-CG1 3.92Å; F458-I501 HydrophobicContact CE1-CG1 4.24Å; F458-I501 HydrophobicContact CE2-CD1 4.33Å; F458-I501 HydrophobicContact CE2-CG1 4.17Å; F458-I501 HydrophobicContact CG-CD1 3.88Å; F458-I501 HydrophobicContact CG-CG1 3.88Å; F458-I501 HydrophobicContact CZ-CG1 4.32Å; F458-L518 HydrophobicContact CD1-CD2 4.13Å; F458-L518 HydrophobicContact CE1-CD2 3.89Å; F458-P520 HydrophobicContact CZ-CB 3.91Å; F458-P520 HydrophobicContact CZ-CG 4.23Å
459	I	88.8	Confident	82.8	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.3	-170.5	-51.5	172.1	0	0	0	108.4	L408 L442 M448 H449 A450 V457 L466 V467 F476	L408-I459 HydrophobicContact CD1-CD1 3.7Å; L408-I459 HydrophobicContact CD1-CG1 3.86Å; L408-I459 HydrophobicContact CD2-CD1 4.38Å; L442-I459 HydrophobicContact CD2-CD1 3.77Å; M448-I459 HydrophobicContact CB-CG2 4.23Å; M448-I459 HydrophobicContact CG-CG2 4.42Å; M448-I459 HydrophobicContact SD-CG2 3.82Å; H449-I459 WeakPolarHBondContact O-CA 3.43Å; A450-I459 HydrophobicContact CB-CG1 4.47Å; V457-I459 HydrophobicContact CG1-CG1 4.13Å; I459-L466 WeakPolarHBondContact O-CA 3.4Å; I459-V467 PolarHBondContact N-O 2.91Å; I459-V467 PolarHBondContact O-N 2.68Å; I459-F476 HydrophobicContact CD1-CE1 4.33Å
460	V	83.8	Confident	83.1	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.024	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.4	168.2	-172	0	0	0	0	109.6	M448 H449 S465 L466 W492 I494 V503	M448-V460 CarbonylContact C-O 3.52Å; M448-V460 VanDerWaalsContact CA-O 3.26Å; M448-V460 WeakPolarHBondContact CA-O 3.49Å; M448-V460 VanDerWaalsContact CB-O 3.29Å; M448-V460 WeakPolarHBondContact CB-O 3Å; H449-V460 PolarHBondContact N-O 3.03Å; H449-V460 PolarHBondContact O-N 2.75Å; V460-S465 WeakPolarHBondContact CA-O 3.34Å; V460-L466 HydrophobicContact CG2-CB 4.38Å; V460-L466 HydrophobicContact CG2-CD1 3.4Å; V460-L466 VanDerWaalsContact CG2-CD1 3.4Å; V460-L466 HydrophobicContact CG2-CG 4.45Å; V460-W492 HydrophobicContact CB-CB 4.33Å; V460-W492 HydrophobicContact CG1-CB 3.32Å; V460-W492 HydrophobicContact CG1-CG 3.92Å; V460-I494 HydrophobicContact CG2-CB 3.97Å; V460-I494 HydrophobicContact CG2-CD1 3.92Å; V460-I494 HydrophobicContact CG2-CG1 4.43Å; V460-I494 HydrophobicContact CG2-CG2 4.45Å; V460-V503 HydrophobicContact CG2-CG1 4.25Å; V460-V503 HydrophobicContact CG2-CG2 4.33Å
461	A	76.9	Confident	83.1	Confident	4 Å²	4	29.9 Å²	29.9	3%	0.033	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	164.5	176.8	0	0	0	0	0	111.8	F444 M448 S465	F444-A461 HydrophobicContact CB-CB 3.77Å; F444-A461 HydrophobicContact CD2-CB 3.82Å; F444-A461 HydrophobicContact CG-CB 3.97Å; M448-A461 HydrophobicContact CB-CB 4.35Å; A461-S465 PolarHBondContact N-O 3.07Å
462	E	68	Low	83.2	Confident	96 Å²	96	37 Å²	37	45%	0.449	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	137.1	169.2	-70	-177.6	177.8	0	0	111.1	L491	E462-L491 HydrophobicContact CG-CD2 4.47Å; E462-L491 WeakPolarHBondContact OE1-CD2 3.36Å
463	G	59.8	Low	83.2	Confident	48 Å²	48	40.9 Å²	40.9	50%	0.495	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	30.7	-177.9	0	0	0	0	0	115
464	D	61.6	Low	83.3	Confident	14 Å²	14	42.1 Å²	42.1	8%	0.075	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	70.8	173.5	-56.6	-9.1	0	0	0	111.5	W485 W492	D464-W485 HydrophobicContact CB-CB 4.12Å; D464-W485 HydrophobicContact CB-CD2 3.45Å; D464-W485 VanDerWaalsContact CB-CD2 3.45Å; D464-W485 HydrophobicContact CB-CE3 3.46Å; D464-W485 VanDerWaalsContact CB-CE3 3.46Å; D464-W485 HydrophobicContact CB-CG 3.78Å; D464-W485 HydrophobicContact CB-CH2 4.48Å; D464-W485 HydrophobicContact CB-CZ2 4.43Å; D464-W485 HydrophobicContact CB-CZ3 4.05Å; D464-W485 WeakPolarHBondContact O-CH2 2.96Å; D464-W485 WeakPolarHBondContact O-CZ3 3.37Å; D464-W485 VanDerWaalsContact OD2-CB 3.26Å; D464-W485 WeakPolarHBondContact OD2-CB 3.19Å; D464-W492 PolarHBondContact OD1-NE1 2.6Å
465	S	71	Confident	83.5	Confident	7 Å²	7	37 Å²	37	5%	0.049	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	114.5	172.2	-76.2	0	0	0	0	111.4	V460 A461 R478	V460-S465 WeakPolarHBondContact CA-O 3.34Å; A461-S465 PolarHBondContact N-O 3.07Å; S465-R478 PolarHBondContact OG-NH2 3.25Å
466	L	81.9	Confident	83.6	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.8	170.4	177.5	66.4	0	0	0	108.8	I459 V460 L479 L481 I494 V503 L518	I459-L466 WeakPolarHBondContact O-CA 3.4Å; V460-L466 HydrophobicContact CG2-CB 4.38Å; V460-L466 HydrophobicContact CG2-CD1 3.4Å; V460-L466 VanDerWaalsContact CG2-CD1 3.4Å; V460-L466 HydrophobicContact CG2-CG 4.45Å; L466-L479 HydrophobicContact CB-CB 4.48Å; L466-L479 HydrophobicContact CD2-CB 3.96Å; L466-L479 HydrophobicContact CD2-CD1 4.04Å; L466-L479 HydrophobicContact CG-CB 4.04Å; L466-L479 HydrophobicContact CG-CD1 4.05Å; L466-L479 PolarHBondContact O-N 2.93Å; L466-L481 HydrophobicContact CD2-CD2 4.17Å; L466-I494 HydrophobicContact CD1-CD1 3.74Å; L466-V503 HydrophobicContact CD1-CG2 4.3Å; L466-V503 HydrophobicContact CD2-CG2 4.27Å; L466-L518 HydrophobicContact CD2-CD2 3.98Å
467	V	87.5	Confident	83.4	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.2	179.7	173.6	0	0	0	0	109.6	P443 F444 I459 F476 T477 R478	P443-V467 HydrophobicContact CG-CG2 4.43Å; F444-V467 HydrophobicContact CE2-CB 4.39Å; F444-V467 HydrophobicContact CE2-CG2 3.48Å; F444-V467 VanDerWaalsContact CE2-CG2 3.48Å; F444-V467 HydrophobicContact CZ-CG2 3.9Å; I459-V467 PolarHBondContact N-O 2.91Å; I459-V467 PolarHBondContact O-N 2.68Å; V467-F476 HydrophobicContact CG1-CB 3.73Å; V467-F476 HydrophobicContact CG1-CD1 3.58Å; V467-F476 HydrophobicContact CG1-CG 4.1Å; V467-T477 WeakPolarHBondContact CA-O 3.15Å; V467-R478 HydrophobicContact CG2-CG 4.42Å
468	C	89.6	Confident	83	Confident	12 Å²	12	44 Å²	44	8%	0.081	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.8	167.8	176.7	0	0	0	0	108.8	F458 F476 T477 L479	F458-C468 HydrophobicContact CD1-CB 4.18Å; F458-C468 HydrophobicContact CE1-CB 4.04Å; F458-C468 HydrophobicContact CZ-CB 4.45Å; C468-F476 CarbonylContact O-C 3.56Å; C468-F476 WeakPolarHBondContact O-CA 3.4Å; C468-T477 PolarHBondContact N-O 3.29Å; C468-T477 PolarHBondContact O-N 3.35Å; C468-L479 HydrophobicContact CB-CD1 3.96Å; C468-L479 HydrophobicContact CB-CG 4.37Å
469	Y	90.8	Very high	82.4	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.2	171.5	173.5	-127.1	0	0	0	109	Y406 V457 P471 D474 F476	Y406-Y469 HydrophobicContact CD1-CE1 4.05Å; Y406-Y469 AromaticContact CE1-CE1 3.99Å; Y406-Y469 HydrophobicContact CE1-CE1 3.99Å; V457-Y469 HydrophobicContact CB-CD1 4.21Å; V457-Y469 HydrophobicContact CG2-CD1 4.35Å; V457-Y469 PolarHBondContact N-O 3.49Å; V457-Y469 PolarHBondContact O-N 3.24Å; Y469-P471 HydrophobicContact CD1-CG 3.89Å; Y469-P471 HydrophobicContact CE1-CB 3.93Å; Y469-P471 HydrophobicContact CE1-CG 3.69Å; Y469-P471 WeakPolarHBondContact O-CD 3.31Å; Y469-D474 PolarHBondContact OH-OD1 3.15Å; Y469-F476 AromaticContact CD2-CD1 3.85Å; Y469-F476 HydrophobicContact CD2-CD1 3.85Å; Y469-F476 AromaticContact CD2-CE1 3.41Å; Y469-F476 HydrophobicContact CD2-CE1 3.41Å; Y469-F476 VanDerWaalsContact CD2-CE1 3.41Å; Y469-F476 HydrophobicContact CD2-CE2 4.14Å; Y469-F476 HydrophobicContact CD2-CG 4.4Å; Y469-F476 AromaticContact CD2-CZ 3.56Å; Y469-F476 HydrophobicContact CD2-CZ 3.56Å; Y469-F476 HydrophobicContact CE2-CE1 4.28Å; Y469-F476 HydrophobicContact CE2-CE2 4.39Å; Y469-F476 AromaticContact CE2-CZ 3.97Å; Y469-F476 HydrophobicContact CE2-CZ 3.97Å; Y469-F476 HydrophobicContact CG-CD1 4.18Å; Y469-F476 AromaticContact CG-CE1 3.67Å; Y469-F476 HydrophobicContact CG-CE1 3.67Å; Y469-F476 HydrophobicContact CG-CZ 4.18Å
470	N	90.4	Very high	81.3	Confident	36 Å²	36	49.9 Å²	49.9	19%	0.193	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	106	171.5	-176.6	-28.5	0	0	0	108.7	L456 L472 L473 D474 S475	L456-N470 HydrophobicContact CD2-CB 3.65Å; N470-L472 VanDerWaalsContact C-N 3.28Å; N470-L472 PolarHBondContact O-N 2.84Å; N470-L472 WeakPolarHBondContact OD1-CB 3.41Å; N470-L472 PolarHBondContact OD1-N 3.43Å; N470-L473 HydrophobicContact CB-CB 4.41Å; N470-L473 PolarHBondContact O-N 2.85Å; N470-L473 PolarHBondContact OD1-N 3.48Å; N470-D474 WeakPolarHBondContact O-CA 3.44Å; N470-D474 PolarHBondContact O-N 3.11Å; N470-S475 PolarHBondContact N-O 2.94Å; N470-S475 PolarHBondContact O-N 2.71Å
471	P	89.4	Confident	80.3	Confident	14 Å²	14	50.6 Å²	50.6	9%	0.091	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.1	-177.8	-20.8	35.2	0	0	0	114.3	L401 Y406 D455 V457 Y469	L401-P471 HydrophobicContact CD2-CB 4.45Å; L401-P471 HydrophobicContact CD2-CG 3.72Å; Y406-P471 HydrophobicContact CE1-CB 3.97Å; Y406-P471 HydrophobicContact CE1-CG 4.23Å; Y406-P471 WeakPolarHBondContact OH-CB 3.37Å; D455-P471 WeakPolarHBondContact O-CD 3.34Å; V457-P471 HydrophobicContact CG2-CG 4Å; Y469-P471 HydrophobicContact CD1-CG 3.89Å; Y469-P471 HydrophobicContact CE1-CB 3.93Å; Y469-P471 HydrophobicContact CE1-CG 3.69Å; Y469-P471 WeakPolarHBondContact O-CD 3.31Å
472	L	88.1	Confident	79.1	Confident	158 Å²	158	53.8 Å²	53.8	83%	0.827	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-38.7	177.4	-177.3	68.3	0	0	0	111.4	N470	N470-L472 VanDerWaalsContact C-N 3.28Å; N470-L472 PolarHBondContact O-N 2.84Å; N470-L472 WeakPolarHBondContact OD1-CB 3.41Å; N470-L472 PolarHBondContact OD1-N 3.43Å
473	L	88.7	Confident	78.3	Confident	119 Å²	119	58.9 Å²	58.9	62%	0.623	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-6.1	-179.5	-60.7	-179	0	0	0	113.3	N470 S475	N470-L473 HydrophobicContact CB-CB 4.41Å; N470-L473 PolarHBondContact O-N 2.85Å; N470-L473 PolarHBondContact OD1-N 3.48Å; L473-S475 PolarHBondContact O-N 2.97Å
474	D	86.7	Confident	77.8	Confident	45 Å²	45	59.5 Å²	59.5	24%	0.241	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	44.5	-169.7	-83.1	-33.9	0	0	0	112.6	K438 Y440 Y469 N470	K438-D474 VanDerWaalsContact NZ-CG 3.3Å; K438-D474 IonicContact NZ-OD1 3.76Å; K438-D474 PolarHBondContact NZ-OD1 2.78Å; K438-D474 IonicContact NZ-OD2 3.41Å; K438-D474 PolarHBondContact NZ-OD2 2.9Å; Y440-D474 HydrophobicContact CD2-CB 4Å; Y440-D474 HydrophobicContact CE2-CB 4.08Å; Y469-D474 PolarHBondContact OH-OD1 3.15Å; N470-D474 WeakPolarHBondContact O-CA 3.44Å; N470-D474 PolarHBondContact O-N 3.11Å
475	S	90	Very high	77.3	Confident	43 Å²	43	62.5 Å²	62.5	30%	0.301	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.2	-173.4	71.3	0	0	0	0	113.1	N470 L473	N470-S475 PolarHBondContact N-O 2.94Å; N470-S475 PolarHBondContact O-N 2.71Å; L473-S475 PolarHBondContact O-N 2.97Å
476	F	89.1	Confident	76.1	Confident	64 Å²	64	64.4 Å²	64.4	28%	0.281	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.2	178	-63.9	-82	0	0	0	112	I425 L442 P443 I459 V467 C468 Y469	I425-F476 HydrophobicContact CD1-CZ 3.75Å; L442-F476 HydrophobicContact CD2-CE1 3.77Å; L442-F476 HydrophobicContact CD2-CZ 3.92Å; P443-F476 HydrophobicContact CG-CD1 4.45Å; I459-F476 HydrophobicContact CD1-CE1 4.33Å; V467-F476 HydrophobicContact CG1-CB 3.73Å; V467-F476 HydrophobicContact CG1-CD1 3.58Å; V467-F476 HydrophobicContact CG1-CG 4.1Å; C468-F476 CarbonylContact O-C 3.56Å; C468-F476 WeakPolarHBondContact O-CA 3.4Å; Y469-F476 AromaticContact CD2-CD1 3.85Å; Y469-F476 HydrophobicContact CD2-CD1 3.85Å; Y469-F476 AromaticContact CD2-CE1 3.41Å; Y469-F476 HydrophobicContact CD2-CE1 3.41Å; Y469-F476 VanDerWaalsContact CD2-CE1 3.41Å; Y469-F476 HydrophobicContact CD2-CE2 4.14Å; Y469-F476 HydrophobicContact CD2-CG 4.4Å; Y469-F476 AromaticContact CD2-CZ 3.56Å; Y469-F476 HydrophobicContact CD2-CZ 3.56Å; Y469-F476 HydrophobicContact CE2-CE1 4.28Å; Y469-F476 HydrophobicContact CE2-CE2 4.39Å; Y469-F476 AromaticContact CE2-CZ 3.97Å; Y469-F476 HydrophobicContact CE2-CZ 3.97Å; Y469-F476 HydrophobicContact CG-CD1 4.18Å; Y469-F476 AromaticContact CG-CE1 3.67Å; Y469-F476 HydrophobicContact CG-CE1 3.67Å; Y469-F476 HydrophobicContact CG-CZ 4.18Å
477	T	87.3	Confident	74.3	Confident	80 Å²	80	70.9 Å²	70.9	49%	0.491	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.8	173.1	-57.1	0	0	0	0	109.3	V467 C468	V467-T477 WeakPolarHBondContact CA-O 3.15Å; C468-T477 PolarHBondContact N-O 3.29Å; C468-T477 PolarHBondContact O-N 3.35Å
478	R	83.3	Confident	72.4	Confident	159 Å²	159	73 Å²	73	60%	0.6	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	132.2	175.3	-167	177.6	-167.3	-173.2	4.1	110	S465 V467	S465-R478 PolarHBondContact OG-NH2 3.25Å; V467-R478 HydrophobicContact CG2-CG 4.42Å
479	L	78.1	Confident	70.6	Confident	22 Å²	22	77.8 Å²	77.8	12%	0.115	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126	177.9	-59.9	172.1	0	0	0	108.9	F458 L466 C468 L518	F458-L479 HydrophobicContact CD1-CD1 3.67Å; F458-L479 HydrophobicContact CE1-CD1 3.55Å; L466-L479 HydrophobicContact CB-CB 4.48Å; L466-L479 HydrophobicContact CD2-CB 3.96Å; L466-L479 HydrophobicContact CD2-CD1 4.04Å; L466-L479 HydrophobicContact CG-CB 4.04Å; L466-L479 HydrophobicContact CG-CD1 4.05Å; L466-L479 PolarHBondContact O-N 2.93Å; C468-L479 HydrophobicContact CB-CD1 3.96Å; C468-L479 HydrophobicContact CB-CG 4.37Å; L479-L518 HydrophobicContact CD1-CD2 3.7Å
480	C	65	Low	68.8	Low	111 Å²	111	78.2 Å²	78.2	75%	0.75	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-91.6	124.2	-180	-67.1	0	0	0	0	110
481	L	62.5	Low	67.5	Low	20 Å²	20	78.4 Å²	78.4	11%	0.105	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-91.4	148.2	169.8	-60.7	177.7	0	0	0	109.8	L466 W485 Y516 V525	L466-L481 HydrophobicContact CD2-CD2 4.17Å; L481-W485 HydrophobicContact CB-CZ2 4.21Å; L481-W485 HydrophobicContact CD1-CZ2 3.87Å; L481-W485 HydrophobicContact CG-CZ2 4.04Å; L481-Y516 HydrophobicContact CD1-CG 4.45Å; L481-V525 HydrophobicContact CD2-CB 4.35Å; L481-V525 HydrophobicContact CD2-CG1 3.75Å; L481-V525 HydrophobicContact CD2-CG2 3.62Å
482	P	52.8	Low	66.7	Low	70 Å²	70	78.2 Å²	78.2	46%	0.455	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-62.2	152	179.3	-19.6	30.3	0	0	0	113.7	A484 V525	P482-A484 PolarHBondContact O-N 3.3Å; P482-V525 HydrophobicContact CG-CB 4.07Å; P482-V525 HydrophobicContact CG-CG1 4.2Å
483	E	51.1	Low	66.1	Low	204 Å²	204	71.7 Å²	71.7	95%	0.953	41%	0.408	S	S	*	.	S	Bend	trans	-33.8	106.7	-173.8	-66.4	179.6	154.7	0	0	116.1
484	A	48.8	Very low	65.5	Low	61 Å²	61	66.3 Å²	66.3	50%	0.504	38%	0.38	S	S	.	.			trans	159.7	53	144.2	0	0	0	0	0	110.9	P482 S486	P482-A484 PolarHBondContact O-N 3.3Å; A484-S486 PolarHBondContact O-N 2.79Å
485	W	51	Low	64.9	Low	77 Å²	77	64.6 Å²	64.6	29%	0.292	37%	0.372	S	S	.	.			trans	-74.5	104.3	161.5	-80.4	5.9	0	0	0	107.3	D464 L481	D464-W485 HydrophobicContact CB-CB 4.12Å; D464-W485 HydrophobicContact CB-CD2 3.45Å; D464-W485 VanDerWaalsContact CB-CD2 3.45Å; D464-W485 HydrophobicContact CB-CE3 3.46Å; D464-W485 VanDerWaalsContact CB-CE3 3.46Å; D464-W485 HydrophobicContact CB-CG 3.78Å; D464-W485 HydrophobicContact CB-CH2 4.48Å; D464-W485 HydrophobicContact CB-CZ2 4.43Å; D464-W485 HydrophobicContact CB-CZ3 4.05Å; D464-W485 WeakPolarHBondContact O-CH2 2.96Å; D464-W485 WeakPolarHBondContact O-CZ3 3.37Å; D464-W485 VanDerWaalsContact OD2-CB 3.26Å; D464-W485 WeakPolarHBondContact OD2-CB 3.19Å; L481-W485 HydrophobicContact CB-CZ2 4.21Å; L481-W485 HydrophobicContact CD1-CZ2 3.87Å; L481-W485 HydrophobicContact CG-CZ2 4.04Å
486	S	47	Very low	64	Low	47 Å²	47	64.7 Å²	64.7	33%	0.329	37%	0.373	S	S	.	.			trans	-75.8	150.9	-176.6	83.1	0	0	0	0	109.6	A484 A488 R505	A484-S486 PolarHBondContact O-N 2.79Å; S486-A488 PolarHBondContact O-N 3.12Å; S486-R505 PolarHBondContact OG-NH2 2.93Å
487	S	44	Very low	62.8	Low	137 Å²	137	63 Å²	63	96%	0.958	37%	0.369	S	S	*	.	S	Bend	trans	-60.9	11.4	177.1	55.4	0	0	0	0	117.3
488	A	47.7	Very low	61.3	Low	52 Å²	52	61.2 Å²	61.2	43%	0.43	36%	0.356	S	S	.	.	S	Bend	trans	-114.3	128.9	-179.7	0	0	0	0	0	110.8	S486 S490	S486-A488 PolarHBondContact O-N 3.12Å; A488-S490 PolarHBondContact O-N 2.93Å; A488-S490 VanDerWaalsContact O-N 3.13Å
489	P	51.1	Low	60.5	Low	111 Å²	111	55.5 Å²	55.5	72%	0.721	35%	0.347	S	S	*	.			trans	-60.6	115.9	177.1	23.6	-30.9	0	0	0	110.1
490	S	53.6	Low	60.1	Low	13 Å²	13	55 Å²	55	9%	0.091	35%	0.345	C	S	.	.			trans	-109	146.4	171.2	53.6	0	0	0	0	111.8	A488 W492 R505	A488-S490 PolarHBondContact O-N 2.93Å; A488-S490 VanDerWaalsContact O-N 3.13Å; S490-W492 PolarHBondContact O-N 3.31Å; S490-W492 PolarHBondContact OG-NE1 3.09Å; S490-R505 PolarHBondContact OG-NE 2.74Å
491	L	63.2	Low	60.7	Low	40 Å²	40	49.7 Å²	49.7	21%	0.209	31%	0.309	C	S	.	.			trans	-75.3	91	173.3	-68.6	176.2	0	0	0	109.7	E462 L538	E462-L491 HydrophobicContact CG-CD2 4.47Å; E462-L491 WeakPolarHBondContact OE1-CD2 3.36Å; L491-L538 HydrophobicContact CD1-CB 3.88Å; L491-L538 HydrophobicContact CD1-CD2 3.43Å; L491-L538 VanDerWaalsContact CD1-CD2 3.43Å; L491-L538 HydrophobicContact CD1-CG 4.25Å; L491-L538 HydrophobicContact CG-CD2 4.43Å
492	W	71.8	Confident	61.2	Low	9 Å²	9	49.6 Å²	49.6	3%	0.034	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	145.1	174.6	-62.5	92.1	0	0	0	111.3	H449 V460 D464 S490 V503 F504 R505 Y516	H449-W492 PolarHBondContact ND1-O 2.85Å; H449-W492 VanDerWaalsContact ND1-O 3.11Å; V460-W492 HydrophobicContact CB-CB 4.33Å; V460-W492 HydrophobicContact CG1-CB 3.32Å; V460-W492 HydrophobicContact CG1-CG 3.92Å; D464-W492 PolarHBondContact OD1-NE1 2.6Å; S490-W492 PolarHBondContact O-N 3.31Å; S490-W492 PolarHBondContact OG-NE1 3.09Å; W492-V503 HydrophobicContact CD2-CG1 4.48Å; W492-V503 HydrophobicContact CE3-CG1 3.58Å; W492-V503 HydrophobicContact CZ3-CG1 4.04Å; W492-F504 WeakPolarHBondContact CA-O 3.42Å; W492-R505 HydrophobicContact CD2-CB 4.45Å; W492-R505 HydrophobicContact CD2-CG 4.22Å; W492-R505 HydrophobicContact CE3-CB 3.78Å; W492-R505 HydrophobicContact CE3-CG 4.02Å; W492-R505 HydrophobicContact CH2-CB 3.94Å; W492-R505 HydrophobicContact CH2-CG 3.8Å; W492-R505 HydrophobicContact CZ2-CG 3.94Å; W492-R505 HydrophobicContact CZ3-CB 3.52Å; W492-R505 HydrophobicContact CZ3-CG 3.83Å; W492-Y516 HydrophobicContact CH2-CD2 4.43Å; W492-Y516 AromaticContact CH2-CE2 3.86Å; W492-Y516 HydrophobicContact CH2-CE2 3.86Å; W492-Y516 AromaticContact CZ3-CD2 3.9Å; W492-Y516 HydrophobicContact CZ3-CD2 3.9Å; W492-Y516 AromaticContact CZ3-CE2 3.72Å; W492-Y516 HydrophobicContact CZ3-CE2 3.72Å
493	K	74.7	Confident	62.4	Low	22 Å²	22	46.3 Å²	46.3	10%	0.096	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152	174.4	-56.7	-71.5	170.8	159.1	0	109.2	H449 V503 F504 F540 L542	H449-K493 VanDerWaalsContact CD2-CD 3.48Å; H449-K493 WeakPolarHBondContact CD2-CD 3.17Å; H449-K493 VanDerWaalsContact CE1-CD 3.48Å; H449-K493 WeakPolarHBondContact CE1-CD 3.26Å; H449-K493 VanDerWaalsContact CE1-CE 3.45Å; H449-K493 WeakPolarHBondContact CE1-CE 3.14Å; H449-K493 PolarHBondContact CE1-NZ 3.08Å; H449-K493 VanDerWaalsContact NE2-CD 3.31Å; H449-K493 WeakPolarHBondContact NE2-CD 3.41Å; H449-K493 WeakPolarHBondContact NE2-CE 3.44Å; H449-K493 PolarHBondContact NE2-NZ 2.8Å; K493-V503 WeakPolarHBondContact O-CA 2.82Å; K493-F504 HydrophobicContact CB-CB 4.39Å; K493-F504 HydrophobicContact CB-CD2 4.29Å; K493-F504 PolarHBondContact N-O 2.89Å; K493-F504 PolarHBondContact O-N 3.1Å; K493-F540 PolarHBondContact NZ-O 2.83Å; K493-L542 HydrophobicContact CB-CD1 4.15Å
494	I	77.2	Confident	63.4	Low	6 Å²	6	37 Å²	37	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143.2	-179.5	-171.1	168.9	0	0	0	110.6	H449 A451 F458 V460 L466 I501 Y502 V503	H449-I494 VanDerWaalsContact C-CG2 3.45Å; H449-I494 HydrophobicContact CB-CG2 3.73Å; H449-I494 WeakPolarHBondContact O-CG2 3.22Å; A451-I494 HydrophobicContact CB-CD1 4.38Å; A451-I494 HydrophobicContact CB-CG1 3.95Å; A451-I494 HydrophobicContact CB-CG2 4.15Å; F458-I494 HydrophobicContact CB-CD1 3.47Å; F458-I494 VanDerWaalsContact CB-CD1 3.47Å; V460-I494 HydrophobicContact CG2-CB 3.97Å; V460-I494 HydrophobicContact CG2-CD1 3.92Å; V460-I494 HydrophobicContact CG2-CG1 4.43Å; V460-I494 HydrophobicContact CG2-CG2 4.45Å; L466-I494 HydrophobicContact CD1-CD1 3.74Å; I494-I501 HydrophobicContact CD1-CG2 3.51Å; I494-I501 HydrophobicContact CG1-CG2 3.71Å; I494-Y502 CarbonylContact C-O 3.57Å; I494-Y502 VanDerWaalsContact CA-O 3.3Å; I494-Y502 WeakPolarHBondContact CA-O 3.25Å; I494-V503 HydrophobicContact CD1-CG2 4.25Å; I494-V503 HydrophobicContact CG1-CG2 4.14Å
495	A	74.6	Confident	64.3	Low	8 Å²	8	36.1 Å²	36.1	7%	0.066	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.9	173.7	0	0	0	0	0	109.8	I501 Y502 F504 L542	A495-I501 CarbonylContact O-C 3.48Å; A495-I501 WeakPolarHBondContact O-CA 3.27Å; A495-Y502 PolarHBondContact N-O 3.09Å; A495-Y502 PolarHBondContact O-N 2.86Å; A495-F504 HydrophobicContact CB-CE2 3.94Å; A495-L542 HydrophobicContact CB-CD1 4.18Å; A495-L542 HydrophobicContact CB-CD2 3.28Å; A495-L542 HydrophobicContact CB-CG 4.34Å
496	S	71.1	Confident	64.4	Low	46 Å²	46	34 Å²	34	32%	0.322	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.7	162.3	-169.6	0	0	0	0	109.4	V452 S500	V452-S496 WeakPolarHBondContact O-CB 3.44Å; V452-S496 PolarHBondContact O-OG 3.27Å; S496-S500 WeakPolarHBondContact CA-O 3.43Å; S496-S500 PolarHBondContact OG-O 3.05Å
497	C	62.2	Low	64.6	Low	29 Å²	29	37.4 Å²	37.4	20%	0.196	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	133.5	179.3	-151.9	0	0	0	0	109.5	V263 G499 S500 Y502	V263-C497 HydrophobicContact CG1-CB 4.26Å; C497-G499 VanDerWaalsContact C-N 3.28Å; C497-G499 PolarHBondContact O-N 3.08Å; C497-S500 PolarHBondContact N-O 2.86Å; C497-S500 CarbonylContact O-C 3.58Å; C497-S500 WeakPolarHBondContact O-CA 3.36Å; C497-S500 PolarHBondContact O-N 3.27Å; C497-S500 VanDerWaalsContact O-O 3.09Å; C497-Y502 HydrophobicContact CB-CD2 3.95Å; C497-Y502 HydrophobicContact CB-CE2 3.82Å
498	N	57.7	Low	64.5	Low	41 Å²	41	41.9 Å²	41.9	22%	0.219	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	46.8	174.3	-20.3	131.8	0	0	0	113.9	E261 V263 S500	E261-N498 HydrophobicContact CB-CB 4.23Å; E261-N498 VanDerWaalsContact CB-ND2 3.28Å; E261-N498 WeakPolarHBondContact CB-ND2 3.33Å; E261-N498 WeakPolarHBondContact CB-OD1 3.27Å; E261-N498 HydrophobicContact CG-CB 3.65Å; E261-N498 WeakPolarHBondContact CG-ND2 3.4Å; E261-N498 VanDerWaalsContact OE1-CB 3.29Å; E261-N498 WeakPolarHBondContact OE1-CB 3.46Å; E261-N498 PolarHBondContact OE2-ND2 3.11Å; V263-N498 VanDerWaalsContact CG2-OD1 3.23Å; V263-N498 WeakPolarHBondContact CG2-OD1 3.37Å; N498-S500 PolarHBondContact O-N 2.9Å; N498-S500 VanDerWaalsContact O-N 3.1Å
499	G	64.8	Low	64.3	Low	39 Å²	39	47.2 Å²	47.2	40%	0.402	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	6.5	180	0	0	0	0	0	115.3	H453 C497 P520	H453-G499 WeakPolarHBondContact CE1-CA 3.5Å; H453-G499 PolarHBondContact CE1-O 2.85Å; H453-G499 PolarHBondContact ND1-O 3.26Å; C497-G499 VanDerWaalsContact C-N 3.28Å; C497-G499 PolarHBondContact O-N 3.08Å; G499-P520 VanDerWaalsContact O-CD 3.23Å; G499-P520 WeakPolarHBondContact O-CD 3.42Å
500	S	70.6	Confident	63.6	Low	11 Å²	11	51.4 Å²	51.4	8%	0.077	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	162.1	174.2	-60.6	0	0	0	0	111.5	S496 C497 N498 K517	S496-S500 WeakPolarHBondContact CA-O 3.43Å; S496-S500 PolarHBondContact OG-O 3.05Å; C497-S500 PolarHBondContact N-O 2.86Å; C497-S500 CarbonylContact O-C 3.58Å; C497-S500 WeakPolarHBondContact O-CA 3.36Å; C497-S500 PolarHBondContact O-N 3.27Å; C497-S500 VanDerWaalsContact O-O 3.09Å; N498-S500 PolarHBondContact O-N 2.9Å; N498-S500 VanDerWaalsContact O-N 3.1Å; S500-K517 WeakPolarHBondContact OG-CE 3.26Å
501	I	77.4	Confident	63.1	Low	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.4	173	-68.8	-67.6	0	0	0	108.2	A451 H453 F458 I494 A495 V503 L518 P520	A451-I501 HydrophobicContact CB-CD1 4.26Å; H453-I501 HydrophobicContact CB-CD1 3.88Å; H453-I501 HydrophobicContact CB-CG1 4.32Å; F458-I501 HydrophobicContact CB-CD1 4.13Å; F458-I501 HydrophobicContact CB-CG1 4.48Å; F458-I501 HydrophobicContact CD1-CG1 4.04Å; F458-I501 HydrophobicContact CD2-CD1 3.74Å; F458-I501 HydrophobicContact CD2-CG1 3.92Å; F458-I501 HydrophobicContact CE1-CG1 4.24Å; F458-I501 HydrophobicContact CE2-CD1 4.33Å; F458-I501 HydrophobicContact CE2-CG1 4.17Å; F458-I501 HydrophobicContact CG-CD1 3.88Å; F458-I501 HydrophobicContact CG-CG1 3.88Å; F458-I501 HydrophobicContact CZ-CG1 4.32Å; I494-I501 HydrophobicContact CD1-CG2 3.51Å; I494-I501 HydrophobicContact CG1-CG2 3.71Å; A495-I501 CarbonylContact O-C 3.48Å; A495-I501 WeakPolarHBondContact O-CA 3.27Å; I501-V503 HydrophobicContact CG2-CG2 4.1Å; I501-L518 HydrophobicContact CB-CB 4.13Å; I501-L518 HydrophobicContact CB-CD2 4.22Å; I501-L518 HydrophobicContact CG2-CB 4.46Å; I501-L518 HydrophobicContact CG2-CD2 4.34Å; I501-L518 PolarHBondContact N-O 3.42Å; I501-L518 PolarHBondContact O-N 3.38Å; I501-P520 HydrophobicContact CG1-CG 3.86Å
502	Y	74.1	Confident	62.3	Low	18 Å²	18	53.9 Å²	53.9	7%	0.071	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128	177.7	-67.3	-98.1	0	0	0	109.4	I494 A495 C497 F504 T515 Y516 K517	I494-Y502 CarbonylContact C-O 3.57Å; I494-Y502 VanDerWaalsContact CA-O 3.3Å; I494-Y502 WeakPolarHBondContact CA-O 3.25Å; A495-Y502 PolarHBondContact N-O 3.09Å; A495-Y502 PolarHBondContact O-N 2.86Å; C497-Y502 HydrophobicContact CB-CD2 3.95Å; C497-Y502 HydrophobicContact CB-CE2 3.82Å; Y502-F504 VanDerWaalsContact CB-CZ 3.46Å; Y502-F504 HydrophobicContact CG-CZ 4.36Å; Y502-T515 HydrophobicContact CD1-CG2 4.08Å; Y502-Y516 WeakPolarHBondContact CA-O 3.45Å; Y502-K517 HydrophobicContact CD1-CB 4.22Å; Y502-K517 HydrophobicContact CD1-CG 4.42Å; Y502-K517 HydrophobicContact CE1-CB 3.99Å; Y502-K517 HydrophobicContact CE1-CD 4.03Å; Y502-K517 HydrophobicContact CE1-CG 3.91Å; Y502-K517 WeakPolarHBondContact OH-CE 3.38Å
503	V	76.2	Confident	61.2	Low	2 Å²	2	53.6 Å²	53.6	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.7	178.1	-178.7	0	0	0	0	108.7	V460 L466 W492 K493 I494 I501 Y516	V460-V503 HydrophobicContact CG2-CG1 4.25Å; V460-V503 HydrophobicContact CG2-CG2 4.33Å; L466-V503 HydrophobicContact CD1-CG2 4.3Å; L466-V503 HydrophobicContact CD2-CG2 4.27Å; W492-V503 HydrophobicContact CD2-CG1 4.48Å; W492-V503 HydrophobicContact CE3-CG1 3.58Å; W492-V503 HydrophobicContact CZ3-CG1 4.04Å; K493-V503 WeakPolarHBondContact O-CA 2.82Å; I494-V503 HydrophobicContact CD1-CG2 4.25Å; I494-V503 HydrophobicContact CG1-CG2 4.14Å; I501-V503 HydrophobicContact CG2-CG2 4.1Å; V503-Y516 PolarHBondContact N-O 3.49Å; V503-Y516 PolarHBondContact O-N 2.95Å
504	F	72	Confident	60.5	Low	9 Å²	9	55.5 Å²	55.5	4%	0.039	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.8	-175.8	-50.3	-87.1	0	0	0	110.2	I265 W492 K493 A495 Y502 T515 L542	I265-F504 HydrophobicContact CD1-CE1 3.74Å; I265-F504 HydrophobicContact CD1-CE2 4.42Å; I265-F504 HydrophobicContact CD1-CZ 3.34Å; I265-F504 HydrophobicContact CG1-CZ 4.09Å; I265-F504 HydrophobicContact CG2-CZ 4.38Å; W492-F504 WeakPolarHBondContact CA-O 3.42Å; K493-F504 HydrophobicContact CB-CB 4.39Å; K493-F504 HydrophobicContact CB-CD2 4.29Å; K493-F504 PolarHBondContact N-O 2.89Å; K493-F504 PolarHBondContact O-N 3.1Å; A495-F504 HydrophobicContact CB-CE2 3.94Å; Y502-F504 VanDerWaalsContact CB-CZ 3.46Å; Y502-F504 HydrophobicContact CG-CZ 4.36Å; F504-T515 HydrophobicContact CD1-CG2 3.74Å; F504-T515 HydrophobicContact CE1-CG2 3.52Å; F504-T515 HydrophobicContact CZ-CG2 4.31Å; F504-L542 HydrophobicContact CD2-CD1 3.63Å; F504-L542 HydrophobicContact CE2-CD1 3.54Å; F504-L542 HydrophobicContact CZ-CD1 4.47Å
505	R	67.6	Low	60.1	Low	42 Å²	42	55.2 Å²	55.2	16%	0.158	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.7	172.3	-161.8	179.8	-178.1	-170.6	-9.7	110.9	S486 S490 W492 R507 N514	S486-R505 PolarHBondContact OG-NH2 2.93Å; S490-R505 PolarHBondContact OG-NE 2.74Å; W492-R505 HydrophobicContact CD2-CB 4.45Å; W492-R505 HydrophobicContact CD2-CG 4.22Å; W492-R505 HydrophobicContact CE3-CB 3.78Å; W492-R505 HydrophobicContact CE3-CG 4.02Å; W492-R505 HydrophobicContact CH2-CB 3.94Å; W492-R505 HydrophobicContact CH2-CG 3.8Å; W492-R505 HydrophobicContact CZ2-CG 3.94Å; W492-R505 HydrophobicContact CZ3-CB 3.52Å; W492-R505 HydrophobicContact CZ3-CG 3.83Å; R505-R507 PolarHBondContact O-N 2.9Å; R505-N514 PolarHBondContact N-O 2.86Å
506	D	53.9	Low	60	Low	32 Å²	32	55.3 Å²	55.3	17%	0.171	27%	0.274	C	S	.	.			trans	-67.1	128.1	168.1	-169.5	5.6	0	0	0	110.2
507	R	50.4	Low	60.2	Low	118 Å²	118	56.4 Å²	56.4	45%	0.445	27%	0.273	S	S	.	.			trans	-99.7	123	171.5	-82.9	-142.9	-86.8	-170.5	-8.5	109.5	R505 K509 D512	R505-R507 PolarHBondContact O-N 2.9Å; R507-K509 PolarHBondContact O-N 2.8Å; R507-D512 PolarHBondContact NE-O 2.83Å; R507-D512 PolarHBondContact NH2-O 2.85Å
508	Y	43.2	Very low	60.8	Low	231 Å²	231	55.2 Å²	55.2	91%	0.906	27%	0.265	S	S	*	.	S	Bend	trans	-59.3	-7.7	170.4	-169.4	-99.2	0	0	0	114.5
509	K	43	Very low	61.7	Low	164 Å²	164	55.9 Å²	55.9	71%	0.713	27%	0.268	S	S	*	.	S	Bend	trans	-136.3	142.3	178.3	-71.6	-175.6	178.1	179	0	111.1	R507 G511	R507-K509 PolarHBondContact O-N 2.8Å; K509-G511 PolarHBondContact O-N 2.89Å
510	K	37.7	Very low	62.2	Low	200 Å²	200	55.3 Å²	55.3	87%	0.87	26%	0.258	S	S	*	.	S	Bend	trans	-41.3	119.4	173.8	-105.2	179.6	173.3	177.8	0	112
511	G	42.9	Very low	62.3	Low	40 Å²	40	58.8 Å²	58.8	41%	0.412	29%	0.287	S	S	.	.	S	Bend	trans	155.7	163.9	175.2	0	0	0	0	0	112.5	K509 A513	K509-G511 PolarHBondContact O-N 2.89Å; G511-A513 PolarHBondContact O-N 3.49Å
512	D	44.8	Very low	62.1	Low	65 Å²	65	63.2 Å²	63.2	35%	0.348	31%	0.314	S	S	.	.			trans	-43.9	127.8	-178.4	-58	-24.7	0	0	0	113.2	R507 K532	R507-D512 PolarHBondContact NE-O 2.83Å; R507-D512 PolarHBondContact NH2-O 2.85Å; D512-K532 WeakPolarHBondContact OD1-CG 3.42Å
513	A	50.3	Low	61.9	Low	3 Å²	3	65.9 Å²	65.9	3%	0.025	34%	0.335	C	S	.	.			trans	-70.5	136	171.5	0	0	0	0	0	108.7	G511 T515 I531 V533	G511-A513 PolarHBondContact O-N 3.49Å; A513-T515 PolarHBondContact O-N 3.23Å; A513-T515 VanDerWaalsContact O-N 3.1Å; A513-I531 PolarHBondContact N-O 2.87Å; A513-I531 VanDerWaalsContact N-O 3.09Å; A513-V533 HydrophobicContact CB-CB 3.94Å; A513-V533 HydrophobicContact CB-CG2 3.36Å
514	N	59.6	Low	61.6	Low	62 Å²	62	68.1 Å²	68.1	33%	0.332	35%	0.354	S	S	.	.			trans	-70.7	109.6	167.6	-74	-0.1	0	0	0	106.9	R505 Y516	R505-N514 PolarHBondContact N-O 2.86Å; N514-Y516 HydrophobicContact CB-CE2 3.83Å
515	T	67.5	Low	61.6	Low	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.8	171.8	-56.9	0	0	0	0	108.3	Y502 F504 A513 T528 I531	Y502-T515 HydrophobicContact CD1-CG2 4.08Å; F504-T515 HydrophobicContact CD1-CG2 3.74Å; F504-T515 HydrophobicContact CE1-CG2 3.52Å; F504-T515 HydrophobicContact CZ-CG2 4.31Å; A513-T515 PolarHBondContact O-N 3.23Å; A513-T515 VanDerWaalsContact O-N 3.1Å; T515-T528 PolarHBondContact O-N 3.12Å; T515-I531 HydrophobicContact CG2-CD1 3.73Å; T515-I531 WeakPolarHBondContact OG1-CD1 3.2Å
516	Y	73.2	Confident	61.6	Low	10 Å²	10	70.8 Å²	70.8	4%	0.039	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.1	175.6	-59.1	-88.5	0	0	0	108.1	L481 W492 Y502 V503 N514 V525 V527	L481-Y516 HydrophobicContact CD1-CG 4.45Å; W492-Y516 HydrophobicContact CH2-CD2 4.43Å; W492-Y516 AromaticContact CH2-CE2 3.86Å; W492-Y516 HydrophobicContact CH2-CE2 3.86Å; W492-Y516 AromaticContact CZ3-CD2 3.9Å; W492-Y516 HydrophobicContact CZ3-CD2 3.9Å; W492-Y516 AromaticContact CZ3-CE2 3.72Å; W492-Y516 HydrophobicContact CZ3-CE2 3.72Å; Y502-Y516 WeakPolarHBondContact CA-O 3.45Å; V503-Y516 PolarHBondContact N-O 3.49Å; V503-Y516 PolarHBondContact O-N 2.95Å; N514-Y516 HydrophobicContact CB-CE2 3.83Å; Y516-V525 HydrophobicContact CD1-CG1 4.02Å; Y516-V527 HydrophobicContact CD1-CG2 4.09Å; Y516-V527 HydrophobicContact CE1-CG2 3.97Å
517	K	74.3	Confident	62.2	Low	68 Å²	68	73.1 Å²	73.1	30%	0.296	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.6	169.4	179.8	-177.5	-179.3	178.8	0	107.7	S500 Y502 V525 T526	S500-K517 WeakPolarHBondContact OG-CE 3.26Å; Y502-K517 HydrophobicContact CD1-CB 4.22Å; Y502-K517 HydrophobicContact CD1-CG 4.42Å; Y502-K517 HydrophobicContact CE1-CB 3.99Å; Y502-K517 HydrophobicContact CE1-CD 4.03Å; Y502-K517 HydrophobicContact CE1-CG 3.91Å; Y502-K517 WeakPolarHBondContact OH-CE 3.38Å; K517-V525 WeakPolarHBondContact O-CA 3.29Å; K517-T526 PolarHBondContact N-O 2.7Å; K517-T526 PolarHBondContact O-N 3.06Å; K517-T526 PolarHBondContact O-OG1 3.49Å
518	L	76.3	Confident	62.5	Low	5 Å²	5	68.6 Å²	68.6	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.4	171.7	171.7	73	0	0	0	108.3	F458 L466 L479 I501 P520 A524 V525	F458-L518 HydrophobicContact CD1-CD2 4.13Å; F458-L518 HydrophobicContact CE1-CD2 3.89Å; L466-L518 HydrophobicContact CD2-CD2 3.98Å; L479-L518 HydrophobicContact CD1-CD2 3.7Å; I501-L518 HydrophobicContact CB-CB 4.13Å; I501-L518 HydrophobicContact CB-CD2 4.22Å; I501-L518 HydrophobicContact CG2-CB 4.46Å; I501-L518 HydrophobicContact CG2-CD2 4.34Å; I501-L518 PolarHBondContact N-O 3.42Å; I501-L518 PolarHBondContact O-N 3.38Å; L518-P520 WeakPolarHBondContact O-CD 3.43Å; L518-A524 WeakPolarHBondContact CA-O 3.38Å; L518-V525 HydrophobicContact CD1-CG2 3.78Å
519	D	76.3	Confident	62.7	Low	54 Å²	54	67 Å²	67	29%	0.289	37%	0.369	S	S	.	.			trans	-86.4	112	163.9	175.1	-1.2	0	0	0	109	A521 T522 S523 A524	D519-A521 PolarHBondContact O-N 2.82Å; D519-A521 WeakPolarHBondContact OD1-CB 3.45Å; D519-A521 PolarHBondContact OD1-N 2.68Å; D519-T522 WeakPolarHBondContact CB-OG1 3.47Å; D519-T522 PolarHBondContact O-N 3.41Å; D519-T522 VanDerWaalsContact OD2-CG2 3.31Å; D519-T522 WeakPolarHBondContact OD2-CG2 3.47Å; D519-T522 PolarHBondContact OD2-OG1 3.03Å; D519-S523 WeakPolarHBondContact O-CA 3.39Å; D519-S523 PolarHBondContact O-N 2.84Å; D519-A524 PolarHBondContact N-O 3.24Å
520	P	75.8	Confident	62.5	Low	28 Å²	28	60.3 Å²	60.3	18%	0.182	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.6	179.4	-25.3	38.2	0	0	0	114.1	F458 G499 I501 L518	F458-P520 HydrophobicContact CZ-CB 3.91Å; F458-P520 HydrophobicContact CZ-CG 4.23Å; G499-P520 VanDerWaalsContact O-CD 3.23Å; G499-P520 WeakPolarHBondContact O-CD 3.42Å; I501-P520 HydrophobicContact CG1-CG 3.86Å; L518-P520 WeakPolarHBondContact O-CD 3.43Å
521	A	72.3	Confident	62.8	Low	83 Å²	83	51.7 Å²	51.7	69%	0.686	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-41	-177.5	0	0	0	0	0	111.9	D519	D519-A521 PolarHBondContact O-N 2.82Å; D519-A521 WeakPolarHBondContact OD1-CB 3.45Å; D519-A521 PolarHBondContact OD1-N 2.68Å
522	T	72.9	Confident	62.5	Low	93 Å²	93	55.9 Å²	55.9	57%	0.571	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-10.6	-177.3	60.5	0	0	0	0	113.3	D519 A524	D519-T522 WeakPolarHBondContact CB-OG1 3.47Å; D519-T522 PolarHBondContact O-N 3.41Å; D519-T522 VanDerWaalsContact OD2-CG2 3.31Å; D519-T522 WeakPolarHBondContact OD2-CG2 3.47Å; D519-T522 PolarHBondContact OD2-OG1 3.03Å; T522-A524 PolarHBondContact O-N 3.25Å; T522-A524 VanDerWaalsContact O-N 3.12Å; T522-A524 WeakPolarHBondContact OG1-CB 3.41Å; T522-A524 PolarHBondContact OG1-N 2.67Å
523	S	70.3	Confident	62.3	Low	75 Å²	75	54.3 Å²	54.3	52%	0.524	31%	0.309	S	S	.	.			trans	55.8	15.6	-165.6	-57.4	0	0	0	0	113.6	D519	D519-S523 WeakPolarHBondContact O-CA 3.39Å; D519-S523 PolarHBondContact O-N 2.84Å
524	A	69.4	Low	61.5	Low	49 Å²	49	58.9 Å²	58.9	41%	0.405	33%	0.333	S	S	.	.			trans	-72.5	136.2	177.7	0	0	0	0	0	109.9	L518 D519 T522	L518-A524 WeakPolarHBondContact CA-O 3.38Å; D519-A524 PolarHBondContact N-O 3.24Å; T522-A524 PolarHBondContact O-N 3.25Å; T522-A524 VanDerWaalsContact O-N 3.12Å; T522-A524 WeakPolarHBondContact OG1-CB 3.41Å; T522-A524 PolarHBondContact OG1-N 2.67Å
525	V	71.2	Confident	60.4	Low	30 Å²	30	56.4 Å²	56.4	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.3	177.6	-179.1	0	0	0	0	108.3	L481 P482 Y516 K517 L518	L481-V525 HydrophobicContact CD2-CB 4.35Å; L481-V525 HydrophobicContact CD2-CG1 3.75Å; L481-V525 HydrophobicContact CD2-CG2 3.62Å; P482-V525 HydrophobicContact CG-CB 4.07Å; P482-V525 HydrophobicContact CG-CG1 4.2Å; Y516-V525 HydrophobicContact CD1-CG1 4.02Å; K517-V525 WeakPolarHBondContact O-CA 3.29Å; L518-V525 HydrophobicContact CD1-CG2 3.78Å
526	T	69	Low	58.8	Low	77 Å²	77	59.6 Å²	59.6	47%	0.472	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	144	172.4	56.1	0	0	0	0	110.1	K517	K517-T526 PolarHBondContact N-O 2.7Å; K517-T526 PolarHBondContact O-N 3.06Å; K517-T526 PolarHBondContact O-OG1 3.49Å
527	V	65.7	Low	56.9	Low	80 Å²	80	61.9 Å²	61.9	49%	0.485	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.8	175.4	179.5	0	0	0	0	107.7	Y516 R529	Y516-V527 HydrophobicContact CD1-CG2 4.09Å; Y516-V527 HydrophobicContact CE1-CG2 3.97Å; V527-R529 HydrophobicContact CG1-CG 4.38Å
528	T	56.2	Low	55.1	Low	24 Å²	24	64.4 Å²	64.4	15%	0.147	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	119.1	171.7	-49.7	0	0	0	0	108	T515 I531	T515-T528 PolarHBondContact O-N 3.12Å; T528-I531 HydrophobicContact CG2-CD1 4.15Å; T528-I531 HydrophobicContact CG2-CG1 4.49Å
529	R	47.5	Very low	53.4	Low	198 Å²	198	69.1 Å²	69.1	75%	0.747	39%	0.39	S	S	*	.			trans	-93	163.4	174.4	-64.2	-175	-179.9	-173.9	1.2	108.9	V527 I531	V527-R529 HydrophobicContact CG1-CG 4.38Å; R529-I531 PolarHBondContact O-N 3.26Å
530	G	40.2	Very low	52.1	Low	23 Å²	23	67.3 Å²	67.3	24%	0.237	38%	0.379	C	S	.	.			trans	90.6	-8.9	173.8	0	0	0	0	0	116.5	K532	G530-K532 VanDerWaalsContact C-N 3.33Å; G530-K532 PolarHBondContact O-N 3.22Å
531	I	43	Very low	50.7	Low	18 Å²	18	67.6 Å²	67.6	9%	0.092	38%	0.381	C	S	.	.			trans	-75	87.2	172.1	-59.4	176.3	0	0	0	110	L282 I290 A513 T515 T528 R529 V533	L282-I531 HydrophobicContact CD1-CG2 3.95Å; L282-I531 HydrophobicContact CD2-CG2 4.47Å; I290-I531 HydrophobicContact CD1-CB 4.24Å; I290-I531 HydrophobicContact CD1-CG2 3.96Å; A513-I531 PolarHBondContact N-O 2.87Å; A513-I531 VanDerWaalsContact N-O 3.09Å; T515-I531 HydrophobicContact CG2-CD1 3.73Å; T515-I531 WeakPolarHBondContact OG1-CD1 3.2Å; T528-I531 HydrophobicContact CG2-CD1 4.15Å; T528-I531 HydrophobicContact CG2-CG1 4.49Å; R529-I531 PolarHBondContact O-N 3.26Å; I531-V533 HydrophobicContact CG2-CG2 4.35Å; I531-V533 PolarHBondContact O-N 3.13Å; I531-V533 VanDerWaalsContact O-N 3.08Å
532	K	36.8	Very low	49.6	Very low	128 Å²	128	65.3 Å²	65.3	56%	0.557	36%	0.356	S	S	*	.			trans	-68.7	94.2	168.7	-77.5	-178.2	179.1	169.6	0	110.9	I290 D512 G530 L534	I290-K532 HydrophobicContact CD1-CB 4.22Å; D512-K532 WeakPolarHBondContact OD1-CG 3.42Å; G530-K532 VanDerWaalsContact C-N 3.33Å; G530-K532 PolarHBondContact O-N 3.22Å; K532-L534 PolarHBondContact O-N 2.98Å; K532-L534 VanDerWaalsContact O-N 3.16Å
533	V	40.4	Very low	48.2	Very low	32 Å²	32	62.7 Å²	62.7	19%	0.194	34%	0.344	C	S	.	.			trans	-70.5	104.2	162.4	177.6	0	0	0	0	107.8	L267 A513 I531 L535	L267-V533 HydrophobicContact CD1-CB 4.44Å; L267-V533 HydrophobicContact CD1-CG1 4.23Å; L267-V533 HydrophobicContact CD1-CG2 3.95Å; A513-V533 HydrophobicContact CB-CB 3.94Å; A513-V533 HydrophobicContact CB-CG2 3.36Å; I531-V533 HydrophobicContact CG2-CG2 4.35Å; I531-V533 PolarHBondContact O-N 3.13Å; I531-V533 VanDerWaalsContact O-N 3.08Å; V533-L535 PolarHBondContact O-N 2.71Å
534	L	34.3	Very low	47.1	Very low	100 Å²	100	62.1 Å²	62.1	52%	0.524	34%	0.335	S	S	.	.			trans	-81.2	7.7	-175.4	-75.1	168.3	0	0	0	114.3	V292 K532	V292-L534 HydrophobicContact CG2-CD1 4.28Å; K532-L534 PolarHBondContact O-N 2.98Å; K532-L534 VanDerWaalsContact O-N 3.16Å
535	L	36.3	Very low	45.9	Very low	9 Å²	9	62.7 Å²	62.7	5%	0.047	33%	0.331	C	S	.	.			trans	-119.6	140.6	-169.2	-70.2	168.4	0	0	0	111.1	L267 L278 V280 V533 F540	L267-L535 HydrophobicContact CB-CD1 4.28Å; L278-L535 HydrophobicContact CB-CD2 4.32Å; V280-L535 HydrophobicContact CG2-CD1 4.5Å; V533-L535 PolarHBondContact O-N 2.71Å; L535-F540 HydrophobicContact CB-CE1 3.44Å; L535-F540 VanDerWaalsContact CB-CE1 3.44Å; L535-F540 HydrophobicContact CB-CZ 3.84Å; L535-F540 HydrophobicContact CD1-CE1 3.95Å; L535-F540 HydrophobicContact CG-CE1 4.35Å
536	T	34	Very low	44.5	Very low	67 Å²	67	64.6 Å²	64.6	41%	0.411	34%	0.34	S	S	.	.			trans	-114.1	19.9	-164.6	50.7	0	0	0	0	114.1	S272	S272-T536 PolarHBondContact OG-OG1 3.21Å
537	N	33.1	Very low	43.1	Very low	58 Å²	58	63.8 Å²	63.8	31%	0.31	33%	0.332	S	S	.	.	S	Bend	trans	-143	144.2	-162.9	-129.2	-11.1	0	0	0	115.7	K270 Q539 F540	K270-N537 WeakPolarHBondContact O-CB 3.48Å; K270-N537 PolarHBondContact O-ND2 2.77Å; N537-Q539 PolarHBondContact O-N 3.26Å; N537-F540 VanDerWaalsContact O-CD2 3.26Å; N537-F540 WeakPolarHBondContact O-CD2 3.08Å; N537-F540 WeakPolarHBondContact O-CE2 3.26Å; N537-F540 WeakPolarHBondContact O-CZ 3.37Å
538	L	35.8	Very low	41.7	Very low	121 Å²	121	62.8 Å²	62.8	63%	0.634	32%	0.322	S	S	*	.	S	Bend	trans	-64.3	-2.6	-164.2	-56	166.1	0	0	0	117.2	L491	L491-L538 HydrophobicContact CD1-CB 3.88Å; L491-L538 HydrophobicContact CD1-CD2 3.43Å; L491-L538 VanDerWaalsContact CD1-CD2 3.43Å; L491-L538 HydrophobicContact CD1-CG 4.25Å; L491-L538 HydrophobicContact CG-CD2 4.43Å
539	Q	41.5	Very low	40.7	Very low	104 Å²	104	65.4 Å²	65.4	49%	0.486	33%	0.334	S	S	.	.			trans	-113.3	84.5	-177.4	-73.6	-175.7	-12.1	0	0	110.2	Q301 N537	Q301-Q539 VanDerWaalsContact CG-OE1 3.26Å; N537-Q539 PolarHBondContact O-N 3.26Å
540	F	49.4	Very low	40.2	Very low	17 Å²	17	55.9 Å²	55.9	8%	0.075	31%	0.305	C	S	.	.			trans	-109.8	134.8	174	-63.6	-73	0	0	0	110.3	K493 L535 N537	K493-F540 PolarHBondContact NZ-O 2.83Å; L535-F540 HydrophobicContact CB-CE1 3.44Å; L535-F540 VanDerWaalsContact CB-CE1 3.44Å; L535-F540 HydrophobicContact CB-CZ 3.84Å; L535-F540 HydrophobicContact CD1-CE1 3.95Å; L535-F540 HydrophobicContact CG-CE1 4.35Å; N537-F540 VanDerWaalsContact O-CD2 3.26Å; N537-F540 WeakPolarHBondContact O-CD2 3.08Å; N537-F540 WeakPolarHBondContact O-CE2 3.26Å; N537-F540 WeakPolarHBondContact O-CZ 3.37Å
541	V	45.3	Very low	40.2	Very low	34 Å²	34	58.5 Å²	58.5	21%	0.206	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-115.4	133.3	163.7	-163.9	0	0	0	0	108.9	I302 A305	I302-V541 HydrophobicContact CG2-CG2 4.09Å; A305-V541 HydrophobicContact CB-CB 3.85Å; A305-V541 HydrophobicContact CB-CG1 3.65Å; A305-V541 VanDerWaalsContact N-CG1 3.29Å; A305-V541 WeakPolarHBondContact O-CG1 3.41Å
542	L	49.8	Very low	40	Very low	34 Å²	34	61.8 Å²	61.8	18%	0.178	33%	0.328	C	S	.	.			trans	-108.7	129	179.6	-163.3	147	0	0	0	107.3	I265 K493 A495 F504	I265-L542 HydrophobicContact CG2-CD1 3.91Å; I265-L542 HydrophobicContact CG2-CG 4.02Å; K493-L542 HydrophobicContact CB-CD1 4.15Å; A495-L542 HydrophobicContact CB-CD1 4.18Å; A495-L542 HydrophobicContact CB-CD2 3.28Å; A495-L542 HydrophobicContact CB-CG 4.34Å; F504-L542 HydrophobicContact CD2-CD1 3.63Å; F504-L542 HydrophobicContact CE2-CD1 3.54Å; F504-L542 HydrophobicContact CZ-CD1 4.47Å
543	A	42.8	Very low	40.2	Very low	38 Å²	38	55.8 Å²	55.8	31%	0.314	31%	0.307	S	S	.	.			trans	-123.8	0	-174.5	0	0	0	0	0	111.1	A305 K307 L312	A305-A543 HydrophobicContact CB-CB 4.47Å; K307-A543 HydrophobicContact CB-CB 4.45Å; K307-A543 WeakPolarHBondContact CB-OXT 2.67Å; L312-A543 HydrophobicContact CD1-CB 3.23Å

Retrieved 543 of 543 residues in 97.8 ms (Link to these results)

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