A0A077YZH0_TRITR Loading...

Nuclear receptor binding protein

AlphaFold DB , UniProt , Accession A0A077YZH0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 530 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	37.8	Very low	237 Å²	237	166.7 Å²	166.7	100%	1.167	86%	0.864	S	S	*	*				0	115	0	-91.3	172.2	158	0	0	107.3
2	E	39.4	Very low	38	Very low	184 Å²	184	161.8 Å²	161.8	86%	0.86	87%	0.866	S	S	*	*			cis	-154	141.2	-7.2	-100.5	177.4	164.1	0	0	104.3
3	V	32	Very low	38	Very low	136 Å²	136	156.5 Å²	156.5	82%	0.824	86%	0.859	S	S	*	*			trans	-113	177.9	173.9	-169.1	0	0	0	0	105.6
4	P	41.3	Very low	37.6	Very low	105 Å²	105	153.6 Å²	153.6	68%	0.682	86%	0.856	S	S	*	*				-108.5	-168.6	-89.3	37.5	-18.8	0	0	0	112.5
5	K	45.1	Very low	37.8	Very low	212 Å²	212	156.2 Å²	156.2	92%	0.922	86%	0.859	S	S	*	*			trans	-118.5	112.2	159.8	-84.9	-173.7	176.9	179.2	0	111.8
6	S	36.9	Very low	37.6	Very low	105 Å²	105	154.8 Å²	154.8	73%	0.734	86%	0.856	S	S	*	*			trans	-80.5	150.8	165.4	23.3	0	0	0	0	111.4
7	V	46.3	Very low	37.6	Very low	149 Å²	149	151.3 Å²	151.3	90%	0.903	85%	0.845	S	S	*	*			trans	-130	128.9	161.4	177.3	0	0	0	0	108
8	E	37.4	Very low	37.9	Very low	194 Å²	194	149.9 Å²	149.9	91%	0.907	84%	0.843	S	S	*	*			trans	-80.9	162.1	-171	-83.9	176.8	125.1	0	0	115.6
9	K	32.9	Very low	38.1	Very low	183 Å²	183	146.4 Å²	146.4	80%	0.796	84%	0.836	S	S	*	*			trans	-61.3	175.6	-179.9	-99.5	174.1	172.9	175	0	116.4
10	P	33.7	Very low	38.3	Very low	132 Å²	132	144.2 Å²	144.2	86%	0.857	84%	0.836	S	S	*	*				-129.5	155.8	113.6	28.7	-14.3	0	0	0	115.4
11	K	33.6	Very low	38.8	Very low	197 Å²	197	143.9 Å²	143.9	86%	0.857	83%	0.831	S	S	*	*			trans	-84	139.3	178	-74.1	169.4	167.1	175	0	111.8
12	A	40	Very low	39.3	Very low	107 Å²	107	135.9 Å²	135.9	88%	0.884	80%	0.798	S	S	*	*			trans	178.1	139.4	150.2	0	0	0	0	0	106.8
13	A	38.1	Very low	40.3	Very low	94 Å²	94	133.8 Å²	133.8	78%	0.777	79%	0.793	S	S	*	*			cis	-147.7	150.7	-1.6	0	0	0	0	0	106.1	E15	A13-E15 PolarHBondContact O-N 3.22Å
14	S	33.5	Very low	41.5	Very low	116 Å²	116	135.7 Å²	135.7	81%	0.811	79%	0.793	S	S	*	*			trans	-71.9	112.5	178.4	58.5	0	0	0	0	110.6
15	E	39.7	Very low	42.7	Very low	192 Å²	192	135 Å²	135	90%	0.897	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.1	117.6	162.2	-73.4	-179.5	167.7	0	0	108.6	A13 S17	A13-E15 PolarHBondContact O-N 3.22Å; E15-S17 PolarHBondContact O-N 3.05Å
16	T	35.7	Very low	43.6	Very low	134 Å²	134	126.9 Å²	126.9	82%	0.822	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-61.2	118.2	177.4	-36.1	0	0	0	0	109.4
17	S	37.6	Very low	45.2	Very low	95 Å²	95	126.8 Å²	126.8	66%	0.664	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.4	167.4	49.9	0	0	0	0	109.7	E15 A19	E15-S17 PolarHBondContact O-N 3.05Å; S17-A19 PolarHBondContact O-N 3.35Å
18	P	42.6	Very low	46.9	Very low	126 Å²	126	122.7 Å²	122.7	82%	0.818	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-62.4	124.2	172.2	5	6.9	0	0	0	107.4	A20	P18-A20 PolarHBondContact O-N 3.17Å
19	A	41.2	Very low	49.3	Very low	84 Å²	84	117.2 Å²	117.2	69%	0.694	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-52.9	139.4	169.4	0	0	0	0	0	108.6	S17 D21	S17-A19 PolarHBondContact O-N 3.35Å; A19-D21 PolarHBondContact O-N 3.44Å
20	A	42.7	Very low	52	Low	101 Å²	101	112.1 Å²	112.1	84%	0.835	68%	0.675	S	S	*	*			trans	-60.2	103.5	169.6	0	0	0	0	0	107.7	P18 S22	P18-A20 PolarHBondContact O-N 3.17Å; A20-S22 PolarHBondContact O-N 3.43Å
21	D	47.5	Very low	54.8	Low	139 Å²	139	108 Å²	108	74%	0.743	65%	0.645	S	S	*	*			trans	-55.8	120	163.8	-71.8	-32.5	0	0	0	106.3	A19 D23	A19-D21 PolarHBondContact O-N 3.44Å; D21-D23 PolarHBondContact O-N 3.36Å
22	S	49	Very low	57.7	Low	68 Å²	68	103.4 Å²	103.4	48%	0.476	63%	0.626	S	S	.	*			trans	-57.9	129.7	174.2	42.9	0	0	0	0	109.2	A20 E24 D25	A20-S22 PolarHBondContact O-N 3.43Å; S22-E24 PolarHBondContact O-N 3.46Å; S22-D25 PolarHBondContact O-N 3.05Å; S22-D25 VanDerWaalsContact O-N 3.15Å
23	D	59.3	Low	60.2	Low	140 Å²	140	98.5 Å²	98.5	75%	0.749	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-54.7	-13.6	-179.5	-66.2	-43.6	0	0	0	113.6	D21 D25 T26	D21-D23 PolarHBondContact O-N 3.36Å; D23-D25 VanDerWaalsContact C-N 3.34Å; D23-D25 PolarHBondContact O-N 2.74Å; D23-T26 PolarHBondContact O-OG1 3.46Å
24	E	58.5	Low	62.7	Low	176 Å²	176	98.8 Å²	98.8	82%	0.822	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-71.3	-20.9	178.7	-64.1	-174.7	171.5	0	0	114.1	S22	S22-E24 PolarHBondContact O-N 3.46Å
25	D	65	Low	65.3	Low	92 Å²	92	95.6 Å²	95.6	49%	0.492	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-93.7	-8	-176.9	-80	-20.9	0	0	0	114.2	S22 D23 V28	S22-D25 PolarHBondContact O-N 3.05Å; S22-D25 VanDerWaalsContact O-N 3.15Å; D23-D25 VanDerWaalsContact C-N 3.34Å; D23-D25 PolarHBondContact O-N 2.74Å; D25-V28 WeakPolarHBondContact O-CG2 3.26Å
26	T	65.4	Low	67.6	Low	41 Å²	41	87.9 Å²	87.9	25%	0.252	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-29.9	-174.3	54.3	0	0	0	0	112.8	D23 V28 R42	D23-T26 PolarHBondContact O-OG1 3.46Å; T26-V28 VanDerWaalsContact C-N 3.29Å; T26-V28 PolarHBondContact O-N 3.34Å; T26-R42 PolarHBondContact O-N 3.18Å
27	D	70	Confident	70.4	Confident	103 Å²	103	81.7 Å²	81.7	55%	0.551	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	0.5	-178.3	-74.6	-30.3	0	0	0	114.2	I29 R41	D27-I29 PolarHBondContact O-N 3.05Å; D27-R41 IonicContact OD1-CZ 3.53Å; D27-R41 IonicContact OD1-NE 2.67Å; D27-R41 IonicContact OD1-NH1 2.67Å
28	V	82.6	Confident	73.1	Confident	62 Å²	62	77.2 Å²	77.2	38%	0.376	46%	0.459	S	S	.	.			trans	-62.8	121.2	176.2	-179.9	0	0	0	0	110.2	D25 T26 L30 R42	D25-V28 WeakPolarHBondContact O-CG2 3.26Å; T26-V28 VanDerWaalsContact C-N 3.29Å; T26-V28 PolarHBondContact O-N 3.34Å; V28-L30 PolarHBondContact O-N 3.23Å; V28-R42 PolarHBondContact O-N 3.32Å
29	I	86.8	Confident	75.6	Confident	80 Å²	80	73.5 Å²	73.5	41%	0.41	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	118.8	174.1	-57.8	170.7	0	0	0	108.4	D27 E32 Q39 K40	D27-I29 PolarHBondContact O-N 3.05Å; I29-E32 HydrophobicContact CG2-CG 4.01Å; I29-Q39 HydrophobicContact CD1-CB 4.26Å; I29-Q39 HydrophobicContact CD1-CG 4.3Å; I29-Q39 HydrophobicContact CG1-CB 4.28Å; I29-Q39 HydrophobicContact CG2-CB 4.1Å; I29-K40 CarbonylContact C-O 3.56Å; I29-K40 WeakPolarHBondContact CA-O 3.42Å
30	L	90.2	Very high	78.1	Confident	75 Å²	75	70 Å²	70	39%	0.393	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-34.6	179.2	-65.5	-172.7	0	0	0	112.7	V28 K40 R42 Y57	V28-L30 PolarHBondContact O-N 3.23Å; L30-K40 HydrophobicContact CB-CD 4.23Å; L30-K40 HydrophobicContact CB-CG 4.35Å; L30-K40 PolarHBondContact N-O 3.43Å; L30-R42 HydrophobicContact CD1-CB 4.28Å; L30-R42 HydrophobicContact CD2-CB 4.4Å; L30-R42 HydrophobicContact CG-CB 4.35Å; L30-Y57 HydrophobicContact CD1-CE1 4.35Å
31	E	93	Very high	80.6	Confident	47 Å²	47	67.4 Å²	67.4	22%	0.22	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	147.9	-171.2	-164.8	176.1	162.4	0	0	109.2	K40 W70 R119	E31-K40 HydrophobicContact CB-CB 4.03Å; E31-K40 HydrophobicContact CB-CD 3.84Å; E31-K40 VanDerWaalsContact O-CB 3.31Å; E31-K40 WeakPolarHBondContact O-CB 3.43Å; E31-K40 PolarHBondContact O-N 3.36Å; E31-K40 IonicContact OE2-NZ 3.18Å; E31-W70 HydrophobicContact CB-CH2 4.02Å; E31-W70 HydrophobicContact CB-CZ2 4.12Å; E31-W70 VanDerWaalsContact CD-CZ2 3.44Å; E31-W70 HydrophobicContact CG-CH2 3.82Å; E31-W70 HydrophobicContact CG-CZ2 3.86Å; E31-R119 VanDerWaalsContact CD-NH2 3.3Å; E31-R119 IonicContact OE1-CZ 2.87Å; E31-R119 IonicContact OE1-NH1 2.73Å; E31-R119 IonicContact OE1-NH2 3.84Å; E31-R119 PolarHBondContact OE1-NH2 3.06Å; E31-R119 IonicContact OE2-CZ 3.36Å; E31-R119 IonicContact OE2-NH1 3.76Å; E31-R119 PolarHBondContact OE2-NH1 2.96Å; E31-R119 IonicContact OE2-NH2 3.64Å; E31-R119 PolarHBondContact OE2-NH2 3.33Å
32	E	93.3	Very high	82.5	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.9	173.8	-60.1	-165.5	148.1	0	0	110.1	I29 W38 Q39	I29-E32 HydrophobicContact CG2-CG 4.01Å; E32-W38 WeakPolarHBondContact CA-O 3.08Å; E32-Q39 HydrophobicContact CG-CG 4.19Å; E32-Q39 PolarHBondContact OE1-NE2 3.39Å
33	S	93.3	Very high	84.4	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.028	36%	0.355	C	S	.	.			trans	-61.7	156.5	172.4	61.6	0	0	0	0	111.3	C35 G36 R37 W38	S33-C35 PolarHBondContact O-N 2.89Å; S33-G36 PolarHBondContact O-N 3Å; S33-G36 PolarHBondContact OG-N 3.07Å; S33-R37 PolarHBondContact OG-N 2.71Å; S33-W38 PolarHBondContact N-O 2.96Å; S33-W38 PolarHBondContact OG-N 2.91Å
34	P	90.7	Very high	85.8	Confident	101 Å²	101	67.2 Å²	67.2	66%	0.656	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.6	179.3	-28.8	35.3	0	0	0	115.4	W110	P34-W110 VanDerWaalsContact CD-CE2 3.49Å; P34-W110 HydrophobicContact CG-CB 4.15Å; P34-W110 HydrophobicContact CG-CD2 4.06Å; P34-W110 HydrophobicContact CG-CG 3.74Å
35	C	87.2	Confident	87.1	Confident	49 Å²	49	59.7 Å²	59.7	33%	0.331	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	3.6	176.4	61.2	0	0	0	0	114.4	S33 R37	S33-C35 PolarHBondContact O-N 2.89Å; C35-R37 PolarHBondContact O-N 3.35Å; C35-R37 VanDerWaalsContact O-N 3.13Å
36	G	89.3	Confident	87.6	Confident	30 Å²	30	66.4 Å²	66.4	31%	0.309	33%	0.328	S	S	.	.	S	Bend	trans	71.7	-5	-177.8	0	0	0	0	0	116	S33	S33-G36 PolarHBondContact O-N 3Å; S33-G36 PolarHBondContact OG-N 3.07Å
37	R	92.4	Very high	87.7	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.015	33%	0.326	C	S	.	.			trans	-71.6	-40.7	-175.2	179	173.9	171.6	-175.5	0.6	114.2	S33 C35 D61 S62 E63 L64 D458	S33-R37 PolarHBondContact OG-N 2.71Å; C35-R37 PolarHBondContact O-N 3.35Å; C35-R37 VanDerWaalsContact O-N 3.13Å; R37-D61 IonicContact CZ-OD1 3.02Å; R37-D61 IonicContact CZ-OD2 2.79Å; R37-D61 VanDerWaalsContact CZ-OD2 3.28Å; R37-D61 IonicContact NE-OD1 3.71Å; R37-D61 PolarHBondContact NE-OD1 3.03Å; R37-D61 IonicContact NE-OD2 2.71Å; R37-D61 PolarHBondContact NE-OD2 3.03Å; R37-D61 VanDerWaalsContact NE-OD2 3.12Å; R37-D61 IonicContact NH2-OD1 3.92Å; R37-D61 PolarHBondContact NH2-OD1 3.47Å; R37-D61 IonicContact NH2-OD2 3.58Å; R37-D61 PolarHBondContact NH2-OD2 3.13Å; R37-S62 PolarHBondContact O-N 3.25Å; R37-S62 PolarHBondContact O-OG 2.88Å; R37-E63 HydrophobicContact CG-CG 4.09Å; R37-E63 IonicContact CZ-OE2 3.63Å; R37-E63 IonicContact NE-OE2 3.49Å; R37-L64 VanDerWaalsContact NH2-CD1 3.3Å; R37-D458 IonicContact CZ-OD2 3.51Å; R37-D458 IonicContact NH1-OD1 3.17Å; R37-D458 IonicContact NH1-OD2 3.44Å; R37-D458 PolarHBondContact NH1-OD2 2.95Å
38	W	94.6	Very high	87.5	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.2	-176.5	-60.1	-70.1	0	0	0	111.5	E32 S33 M60 D61 V68 W70 H107 W110 I123 D458	E32-W38 WeakPolarHBondContact CA-O 3.08Å; S33-W38 PolarHBondContact N-O 2.96Å; S33-W38 PolarHBondContact OG-N 2.91Å; W38-M60 WeakPolarHBondContact CA-O 3.21Å; W38-D61 PolarHBondContact NE1-OD2 3.27Å; W38-V68 HydrophobicContact CG-CG2 4.49Å; W38-W70 HydrophobicContact CB-CZ3 4.48Å; W38-H107 HydrophobicContact CZ2-CB 3.91Å; W38-W110 HydrophobicContact CE3-CZ3 4.18Å; W38-I123 HydrophobicContact CB-CD1 4.29Å; W38-I123 HydrophobicContact CB-CG1 4.31Å; W38-I123 HydrophobicContact CD2-CB 4.39Å; W38-I123 HydrophobicContact CD2-CG1 3.86Å; W38-I123 HydrophobicContact CD2-CG2 4.22Å; W38-I123 HydrophobicContact CE3-CG1 4.12Å; W38-I123 HydrophobicContact CG-CD1 4.39Å; W38-I123 HydrophobicContact CG-CG1 3.95Å; W38-I123 HydrophobicContact CG-CG2 4.1Å; W38-D458 HydrophobicContact CH2-CB 4.25Å
39	Q	94.8	Very high	86.7	Confident	47 Å²	47	65.6 Å²	65.6	22%	0.22	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.5	-177.8	-63.6	177.9	-35.4	0	0	109.6	I29 E32 A59 M60	I29-Q39 HydrophobicContact CD1-CB 4.26Å; I29-Q39 HydrophobicContact CD1-CG 4.3Å; I29-Q39 HydrophobicContact CG1-CB 4.28Å; I29-Q39 HydrophobicContact CG2-CB 4.1Å; E32-Q39 HydrophobicContact CG-CG 4.19Å; E32-Q39 PolarHBondContact OE1-NE2 3.39Å; Q39-A59 CarbonylContact O-C 3.52Å; Q39-A59 WeakPolarHBondContact O-CA 3.33Å; Q39-A59 VanDerWaalsContact O-CB 3.27Å; Q39-A59 WeakPolarHBondContact O-CB 3.42Å; Q39-M60 PolarHBondContact N-O 3.4Å; Q39-M60 PolarHBondContact O-N 3.14Å
40	K	95.6	Very high	85.9	Confident	12 Å²	12	61.9 Å²	61.9	5%	0.052	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126.2	179.6	-176.8	-174.7	179.4	174.8	0	110.3	I29 L30 E31 Y57 W70 E72	I29-K40 CarbonylContact C-O 3.56Å; I29-K40 WeakPolarHBondContact CA-O 3.42Å; L30-K40 HydrophobicContact CB-CD 4.23Å; L30-K40 HydrophobicContact CB-CG 4.35Å; L30-K40 PolarHBondContact N-O 3.43Å; E31-K40 HydrophobicContact CB-CB 4.03Å; E31-K40 HydrophobicContact CB-CD 3.84Å; E31-K40 VanDerWaalsContact O-CB 3.31Å; E31-K40 WeakPolarHBondContact O-CB 3.43Å; E31-K40 PolarHBondContact O-N 3.36Å; E31-K40 IonicContact OE2-NZ 3.18Å; K40-Y57 HydrophobicContact CD-CD2 4.48Å; K40-Y57 VanDerWaalsContact CE-CE2 3.49Å; K40-Y57 HydrophobicContact CG-CG 4.26Å; K40-W70 HydrophobicContact CB-CD2 3.87Å; K40-W70 HydrophobicContact CB-CE3 3.73Å; K40-W70 HydrophobicContact CB-CG 4.4Å; K40-W70 HydrophobicContact CB-CH2 4.14Å; K40-W70 HydrophobicContact CB-CZ2 4.33Å; K40-W70 HydrophobicContact CB-CZ3 3.88Å; K40-W70 HydrophobicContact CD-CD2 4.1Å; K40-W70 HydrophobicContact CD-CG 4.28Å; K40-W70 HydrophobicContact CD-CZ2 4.09Å; K40-W70 HydrophobicContact CG-CD2 4.05Å; K40-W70 HydrophobicContact CG-CE3 4.41Å; K40-W70 HydrophobicContact CG-CG 4.13Å; K40-E72 IonicContact NZ-OE1 3.48Å; K40-E72 PolarHBondContact NZ-OE1 3.32Å; K40-E72 IonicContact NZ-OE2 3.43Å
41	R	93.3	Very high	84.8	Confident	45 Å²	45	59.7 Å²	59.7	17%	0.17	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	166.3	174.3	-64.2	-175.3	-174.4	156.7	1	111.6	D27 E43 Y57 L58 M60 E67	D27-R41 IonicContact OD1-CZ 3.53Å; D27-R41 IonicContact OD1-NE 2.67Å; D27-R41 IonicContact OD1-NH1 2.67Å; R41-E43 VanDerWaalsContact C-N 3.26Å; R41-E43 PolarHBondContact O-N 3.41Å; R41-Y57 WeakPolarHBondContact O-CD1 3.44Å; R41-L58 WeakPolarHBondContact CB-O 3.03Å; R41-L58 PolarHBondContact N-O 3.3Å; R41-M60 PolarHBondContact NH2-SD 3.03Å; R41-E67 IonicContact NH1-OE1 3.6Å
42	R	88.7	Confident	83.8	Confident	142 Å²	142	57.8 Å²	57.8	54%	0.536	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	-27.6	177.3	-176.8	174.9	-71.6	-117.7	-2.3	113.1	T26 V28 L30 K44	T26-R42 PolarHBondContact O-N 3.18Å; V28-R42 PolarHBondContact O-N 3.32Å; L30-R42 HydrophobicContact CD1-CB 4.28Å; L30-R42 HydrophobicContact CD2-CB 4.4Å; L30-R42 HydrophobicContact CG-CB 4.35Å; R42-K44 PolarHBondContact O-N 3.39Å
43	E	88.8	Confident	83.2	Confident	86 Å²	86	54 Å²	54	40%	0.402	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	123	-177.3	-171	177.8	165.8	0	0	112.6	R41 Y57 L58	R41-E43 VanDerWaalsContact C-N 3.26Å; R41-E43 PolarHBondContact O-N 3.41Å; E43-Y57 WeakPolarHBondContact O-CA 3.45Å; E43-L58 HydrophobicContact CB-CB 4.26Å; E43-L58 PolarHBondContact O-N 2.75Å
44	K	89	Confident	82.7	Confident	116 Å²	116	57.3 Å²	57.3	50%	0.504	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	137.6	171	-68.5	-175.7	179.8	-177.5	0	110.6	R42 R46 I55 A56 Y57	R42-K44 PolarHBondContact O-N 3.39Å; K44-R46 PolarHBondContact O-N 2.91Å; K44-I55 HydrophobicContact CD-CG2 4.44Å; K44-A56 WeakPolarHBondContact CA-O 3.47Å; K44-Y57 HydrophobicContact CD-CE1 4.35Å; K44-Y57 VanDerWaalsContact CE-OH 3.29Å; K44-Y57 WeakPolarHBondContact CE-OH 3.27Å; K44-Y57 HydrophobicContact CG-CD1 3.86Å; K44-Y57 HydrophobicContact CG-CE1 3.54Å
45	V	86	Confident	82.5	Confident	18 Å²	18	54.8 Å²	54.8	11%	0.109	26%	0.262	C	S	.	.			trans	-71	96.5	177.4	-174.7	0	0	0	0	109.7	Q47 R48 A56 V69 Y126	V45-Q47 HydrophobicContact CG1-CB 4.37Å; V45-Q47 PolarHBondContact O-N 2.84Å; V45-Q47 VanDerWaalsContact O-N 3.08Å; V45-R48 HydrophobicContact CB-CB 4.18Å; V45-R48 HydrophobicContact CG1-CB 3.82Å; V45-R48 PolarHBondContact O-N 2.65Å; V45-A56 HydrophobicContact CB-CB 4.24Å; V45-A56 HydrophobicContact CG2-CB 4.45Å; V45-A56 PolarHBondContact N-O 3.28Å; V45-V69 HydrophobicContact CG2-CG1 3.88Å; V45-V69 HydrophobicContact CG2-CG2 4.32Å; V45-Y126 HydrophobicContact CG1-CE2 4.27Å
46	R	74.9	Confident	82.7	Confident	233 Å²	233	52.9 Å²	52.9	88%	0.879	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.6	179.1	-62	-176.3	-179.9	-169.6	0.3	113.1	K44 R48	K44-R46 PolarHBondContact O-N 2.91Å; R46-R48 VanDerWaalsContact C-N 3.34Å
47	Q	66.7	Low	82.9	Confident	47 Å²	47	52.9 Å²	52.9	22%	0.22	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	0.2	-175.2	-55.7	-172	22.5	0	0	113.8	V45 S128 Q134	V45-Q47 HydrophobicContact CG1-CB 4.37Å; V45-Q47 PolarHBondContact O-N 2.84Å; V45-Q47 VanDerWaalsContact O-N 3.08Å; Q47-S128 PolarHBondContact NE2-O 3.44Å; Q47-S128 PolarHBondContact OE1-O 2.88Å; Q47-S128 VanDerWaalsContact OE1-O 3.14Å; Q47-Q134 VanDerWaalsContact CA-NE2 3.28Å; Q47-Q134 PolarHBondContact O-NE2 3.5Å
48	R	66.6	Low	83	Confident	28 Å²	28	53 Å²	53	11%	0.106	24%	0.241	C	C	.	.			trans	-119.5	92.6	-172.9	-161.2	172.2	-169.5	162.7	2.8	111.4	V45 R46 V50 A56 V69 N71 T124 F183	V45-R48 HydrophobicContact CB-CB 4.18Å; V45-R48 HydrophobicContact CG1-CB 3.82Å; V45-R48 PolarHBondContact O-N 2.65Å; R46-R48 VanDerWaalsContact C-N 3.34Å; R48-V50 HydrophobicContact CG-CB 4.15Å; R48-V50 HydrophobicContact CG-CG2 3.51Å; R48-A56 HydrophobicContact CB-CB 4.19Å; R48-A56 HydrophobicContact CG-CB 4.26Å; R48-V69 VanDerWaalsContact NH1-CB 3.27Å; R48-N71 PolarHBondContact NE-OD1 3.49Å; R48-N71 PolarHBondContact NH1-ND2 3.17Å; R48-N71 PolarHBondContact NH1-OD1 3.35Å; R48-N71 PolarHBondContact NH2-OD1 2.83Å; R48-T124 PolarHBondContact NH1-OG1 2.8Å; R48-T124 PolarHBondContact NH2-OG1 3.44Å; R48-F183 HydrophobicContact CG-CZ 4.21Å
49	D	66.7	Low	83	Confident	114 Å²	114	53 Å²	53	61%	0.61	24%	0.241	S	C	*	.			trans	-108.3	66	163.1	-172.2	18	0	0	0	107.6	P51	D49-P51 WeakPolarHBondContact O-CD 3.36Å
50	V	69.5	Low	83	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.012	24%	0.239	C	C	.	.			trans	-85.8	117.7	-178.8	170.4	0	0	0	0	107.5	R48 G52 V53 T181 F183 V193	R48-V50 HydrophobicContact CG-CB 4.15Å; R48-V50 HydrophobicContact CG-CG2 3.51Å; V50-G52 PolarHBondContact O-N 3.37Å; V50-V53 HydrophobicContact CB-CG2 4.38Å; V50-V53 HydrophobicContact CG1-CG2 4.14Å; V50-V53 PolarHBondContact O-N 2.83Å; V50-V53 VanDerWaalsContact O-N 3.09Å; V50-T181 HydrophobicContact CG1-CG2 4.22Å; V50-F183 HydrophobicContact CG2-CE2 3.95Å; V50-F183 HydrophobicContact CG2-CZ 4.02Å; V50-V193 HydrophobicContact CG1-CG1 4.37Å; V50-V193 HydrophobicContact CG2-CG2 4.46Å
51	P	67.5	Low	82.9	Confident	28 Å²	28	51.8 Å²	51.8	18%	0.182	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	130.6	178.7	-23.3	32.6	0	0	0	110.8	D49 N176	D49-P51 WeakPolarHBondContact O-CD 3.36Å; P51-N176 PolarHBondContact O-ND2 2.96Å
52	G	71.5	Confident	82.8	Confident	8 Å²	8	52.6 Å²	52.6	8%	0.082	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	-2.4	-178.6	0	0	0	0	0	116.1	V50 M200	V50-G52 PolarHBondContact O-N 3.37Å; G52-M200 WeakPolarHBondContact O-CE 3.32Å
53	V	80.3	Confident	82.8	Confident	18 Å²	18	49.4 Å²	49.4	11%	0.109	24%	0.24	C	C	.	.			trans	-107.9	123.1	165	179.2	0	0	0	0	107.7	V50 I55 N71 F122	V50-V53 HydrophobicContact CB-CG2 4.38Å; V50-V53 HydrophobicContact CG1-CG2 4.14Å; V50-V53 PolarHBondContact O-N 2.83Å; V50-V53 VanDerWaalsContact O-N 3.09Å; V53-I55 WeakPolarHBondContact CG1-O 3.39Å; V53-N71 HydrophobicContact CG1-CB 3.93Å; V53-F122 HydrophobicContact CG2-CE1 4.35Å; V53-F122 HydrophobicContact CG2-CZ 3.78Å
54	D	81.8	Confident	82.8	Confident	75 Å²	75	49.7 Å²	49.7	40%	0.401	24%	0.244	S	C	.	.	S	Bend	trans	-78.1	-42.3	-177	-66.3	-50	0	0	0	111.5	E72 H74	D54-E72 PolarHBondContact N-O 2.78Å; D54-H74 WeakPolarHBondContact OD2-CB 3.17Å; D54-H74 PolarHBondContact OD2-N 2.63Å; D54-H74 IonicContact OD2-ND1 3.04Å
55	I	87.4	Confident	82.9	Confident	48 Å²	48	46.9 Å²	46.9	25%	0.246	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	139.7	-178.4	-43.5	178.3	0	0	0	109.9	K44 V53 Y57 E72	K44-I55 HydrophobicContact CD-CG2 4.44Å; V53-I55 WeakPolarHBondContact CG1-O 3.39Å; I55-Y57 HydrophobicContact CB-CE2 4.08Å; I55-Y57 HydrophobicContact CG2-CD2 3.78Å; I55-Y57 HydrophobicContact CG2-CE2 3.19Å; I55-E72 PolarHBondContact N-O 3.03Å; I55-E72 PolarHBondContact O-N 2.89Å
56	A	91.8	Very high	83.2	Confident	8 Å²	8	49.4 Å²	49.4	7%	0.066	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.4	173.7	0	0	0	0	0	110.3	K44 V45 R48 V69 W70	K44-A56 WeakPolarHBondContact CA-O 3.47Å; V45-A56 HydrophobicContact CB-CB 4.24Å; V45-A56 HydrophobicContact CG2-CB 4.45Å; V45-A56 PolarHBondContact N-O 3.28Å; R48-A56 HydrophobicContact CB-CB 4.19Å; R48-A56 HydrophobicContact CG-CB 4.26Å; A56-V69 HydrophobicContact CB-CG1 3.9Å; A56-W70 CarbonylContact C-O 3.53Å; A56-W70 WeakPolarHBondContact CA-O 3.47Å
57	Y	93.7	Very high	84	Confident	30 Å²	30	42.4 Å²	42.4	12%	0.118	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.3	177.6	-69.8	-90.8	0	0	0	110.8	L30 K40 R41 E43 K44 I55 V69 W70	L30-Y57 HydrophobicContact CD1-CE1 4.35Å; K40-Y57 HydrophobicContact CD-CD2 4.48Å; K40-Y57 VanDerWaalsContact CE-CE2 3.49Å; K40-Y57 HydrophobicContact CG-CG 4.26Å; R41-Y57 WeakPolarHBondContact O-CD1 3.44Å; E43-Y57 WeakPolarHBondContact O-CA 3.45Å; K44-Y57 HydrophobicContact CD-CE1 4.35Å; K44-Y57 VanDerWaalsContact CE-OH 3.29Å; K44-Y57 WeakPolarHBondContact CE-OH 3.27Å; K44-Y57 HydrophobicContact CG-CD1 3.86Å; K44-Y57 HydrophobicContact CG-CE1 3.54Å; I55-Y57 HydrophobicContact CB-CE2 4.08Å; I55-Y57 HydrophobicContact CG2-CD2 3.78Å; I55-Y57 HydrophobicContact CG2-CE2 3.19Å; Y57-V69 WeakPolarHBondContact O-CA 3.37Å; Y57-W70 PolarHBondContact N-O 2.97Å; Y57-W70 PolarHBondContact O-N 3.34Å
58	L	93.2	Very high	85.4	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	141	165.2	-167.8	65.1	0	0	0	108.5	R41 E43 E67 Y126	R41-L58 WeakPolarHBondContact CB-O 3.03Å; R41-L58 PolarHBondContact N-O 3.3Å; E43-L58 HydrophobicContact CB-CB 4.26Å; E43-L58 PolarHBondContact O-N 2.75Å; L58-E67 HydrophobicContact CD1-CB 4.01Å; L58-E67 HydrophobicContact CD1-CG 4.3Å; L58-Y126 HydrophobicContact CD1-CD2 4.45Å
59	A	95.1	Very high	86.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	155.1	175.4	0	0	0	0	0	110.5	Q39 V68 W70	Q39-A59 CarbonylContact O-C 3.52Å; Q39-A59 WeakPolarHBondContact O-CA 3.33Å; Q39-A59 VanDerWaalsContact O-CB 3.27Å; Q39-A59 WeakPolarHBondContact O-CB 3.42Å; A59-V68 HydrophobicContact CB-CG2 3.88Å; A59-V68 PolarHBondContact N-O 3.09Å; A59-V68 WeakPolarHBondContact O-CG2 3.47Å; A59-V68 PolarHBondContact O-N 3.32Å; A59-W70 HydrophobicContact CB-CB 3.96Å; A59-W70 HydrophobicContact CB-CE3 4.37Å
60	M	94.4	Very high	88	Confident	35 Å²	35	33.6 Å²	33.6	17%	0.172	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.6	174.9	-173.2	83	-78.8	0	0	109.6	W38 Q39 R41 V66 E67	W38-M60 WeakPolarHBondContact CA-O 3.21Å; Q39-M60 PolarHBondContact N-O 3.4Å; Q39-M60 PolarHBondContact O-N 3.14Å; R41-M60 PolarHBondContact NH2-SD 3.03Å; M60-V66 VanDerWaalsContact CE-N 3.32Å; M60-V66 WeakPolarHBondContact CE-O 3.45Å; M60-E67 HydrophobicContact CE-CG 4.43Å
61	D	94.5	Very high	89.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	103.7	159.2	-168.6	-37.6	0	0	0	108	R37 W38 E63 L64 G65 V66 V68	R37-D61 IonicContact CZ-OD1 3.02Å; R37-D61 IonicContact CZ-OD2 2.79Å; R37-D61 VanDerWaalsContact CZ-OD2 3.28Å; R37-D61 IonicContact NE-OD1 3.71Å; R37-D61 PolarHBondContact NE-OD1 3.03Å; R37-D61 IonicContact NE-OD2 2.71Å; R37-D61 PolarHBondContact NE-OD2 3.03Å; R37-D61 VanDerWaalsContact NE-OD2 3.12Å; R37-D61 IonicContact NH2-OD1 3.92Å; R37-D61 PolarHBondContact NH2-OD1 3.47Å; R37-D61 IonicContact NH2-OD2 3.58Å; R37-D61 PolarHBondContact NH2-OD2 3.13Å; W38-D61 PolarHBondContact NE1-OD2 3.27Å; D61-E63 PolarHBondContact O-N 3.25Å; D61-E63 PolarHBondContact OD1-N 2.97Å; D61-L64 HydrophobicContact CB-CB 4.33Å; D61-L64 PolarHBondContact OD1-N 2.85Å; D61-G65 WeakPolarHBondContact O-CA 3.47Å; D61-G65 PolarHBondContact O-N 3.33Å; D61-V66 HydrophobicContact CB-CG2 4.19Å; D61-V66 WeakPolarHBondContact CB-O 3.34Å; D61-V66 PolarHBondContact N-O 3.38Å; D61-V68 HydrophobicContact CB-CG1 4.01Å; D61-V68 HydrophobicContact CB-CG2 4.49Å
62	S	90.7	Very high	90.2	Very high	61 Å²	61	32.4 Å²	32.4	43%	0.427	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.3	-172.4	60	0	0	0	0	113.3	R37	R37-S62 PolarHBondContact O-N 3.25Å; R37-S62 PolarHBondContact O-OG 2.88Å
63	E	88.2	Confident	90.9	Very high	76 Å²	76	32.3 Å²	32.3	36%	0.355	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-40.3	-179.7	-65.1	-174.2	170.9	0	0	112.8	R37 D61 R430 L460	R37-E63 HydrophobicContact CG-CG 4.09Å; R37-E63 IonicContact CZ-OE2 3.63Å; R37-E63 IonicContact NE-OE2 3.49Å; D61-E63 PolarHBondContact O-N 3.25Å; D61-E63 PolarHBondContact OD1-N 2.97Å; E63-R430 IonicContact OE1-CZ 2.66Å; E63-R430 IonicContact OE1-NH1 3.54Å; E63-R430 PolarHBondContact OE1-NH1 2.98Å; E63-R430 IonicContact OE1-NH2 3.21Å; E63-R430 PolarHBondContact OE1-NH2 3.31Å; E63-R430 IonicContact OE2-CZ 3.56Å; E63-R430 IonicContact OE2-NH1 2.74Å; E63-R430 PolarHBondContact OE2-NH1 3.34Å; E63-R430 IonicContact OE2-NH2 3.61Å; E63-L460 HydrophobicContact CB-CD1 4.5Å; E63-L460 WeakPolarHBondContact OE2-CD1 3.25Å; E63-L460 WeakPolarHBondContact OE2-CD2 3.13Å
64	L	88.8	Confident	91.2	Very high	92 Å²	92	33.8 Å²	33.8	48%	0.482	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-16.1	179.2	-66.3	-177.2	0	0	0	112.8	R37 D61 V66 L460	R37-L64 VanDerWaalsContact NH2-CD1 3.3Å; D61-L64 HydrophobicContact CB-CB 4.33Å; D61-L64 PolarHBondContact OD1-N 2.85Å; L64-V66 VanDerWaalsContact C-N 3.25Å; L64-V66 HydrophobicContact CB-CG2 3.8Å; L64-V66 HydrophobicContact CD1-CG2 4.41Å; L64-V66 PolarHBondContact O-N 3.04Å; L64-L460 HydrophobicContact CD2-CD1 3.8Å; L64-L460 HydrophobicContact CG-CD1 4.13Å
65	G	91.2	Very high	91.1	Very high	57 Å²	57	30.3 Å²	30.3	59%	0.588	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.8	26.9	-175.9	0	0	0	0	0	113.3	D61	D61-G65 WeakPolarHBondContact O-CA 3.47Å; D61-G65 PolarHBondContact O-N 3.33Å
66	V	92.2	Very high	90.7	Very high	71 Å²	71	33.6 Å²	33.6	43%	0.43	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.1	-177.6	-59.7	0	0	0	0	112.8	M60 D61 L64	M60-V66 VanDerWaalsContact CE-N 3.32Å; M60-V66 WeakPolarHBondContact CE-O 3.45Å; D61-V66 HydrophobicContact CB-CG2 4.19Å; D61-V66 WeakPolarHBondContact CB-O 3.34Å; D61-V66 PolarHBondContact N-O 3.38Å; L64-V66 VanDerWaalsContact C-N 3.25Å; L64-V66 HydrophobicContact CB-CG2 3.8Å; L64-V66 HydrophobicContact CD1-CG2 4.41Å; L64-V66 PolarHBondContact O-N 3.04Å
67	E	93.3	Very high	90.2	Very high	86 Å²	86	36 Å²	36	40%	0.402	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.8	175.3	-66.4	-177.1	149.6	0	0	111.1	R41 L58 M60 Y126	R41-E67 IonicContact NH1-OE1 3.6Å; L58-E67 HydrophobicContact CD1-CB 4.01Å; L58-E67 HydrophobicContact CD1-CG 4.3Å; M60-E67 HydrophobicContact CE-CG 4.43Å; E67-Y126 HydrophobicContact CB-CD1 4.13Å; E67-Y126 HydrophobicContact CB-CG 4.48Å; E67-Y126 WeakPolarHBondContact O-CB 3.37Å
68	V	94.2	Very high	89.7	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	170.4	175	-64.3	0	0	0	0	109.6	W38 A59 D61 I123 T124	W38-V68 HydrophobicContact CG-CG2 4.49Å; A59-V68 HydrophobicContact CB-CG2 3.88Å; A59-V68 PolarHBondContact N-O 3.09Å; A59-V68 WeakPolarHBondContact O-CG2 3.47Å; A59-V68 PolarHBondContact O-N 3.32Å; D61-V68 HydrophobicContact CB-CG1 4.01Å; D61-V68 HydrophobicContact CB-CG2 4.49Å; V68-I123 HydrophobicContact CB-CG2 3.8Å; V68-I123 HydrophobicContact CG1-CG2 4.31Å; V68-I123 HydrophobicContact CG2-CG2 3.75Å; V68-T124 WeakPolarHBondContact CB-O 3.05Å
69	V	94.5	Very high	89.2	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.9	177.1	-172.5	0	0	0	0	110.2	V45 R48 A56 Y57 N71 I123 T124 Y126	V45-V69 HydrophobicContact CG2-CG1 3.88Å; V45-V69 HydrophobicContact CG2-CG2 4.32Å; R48-V69 VanDerWaalsContact NH1-CB 3.27Å; A56-V69 HydrophobicContact CB-CG1 3.9Å; Y57-V69 WeakPolarHBondContact O-CA 3.37Å; V69-N71 PolarHBondContact O-ND2 2.72Å; V69-N71 VanDerWaalsContact O-ND2 3.17Å; V69-I123 WeakPolarHBondContact O-CA 3.45Å; V69-T124 PolarHBondContact N-O 2.86Å; V69-T124 PolarHBondContact O-N 3.14Å; V69-Y126 HydrophobicContact CG2-CD2 3.7Å; V69-Y126 HydrophobicContact CG2-CG 4.34Å
70	W	94.9	Very high	88.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	109.9	171.6	-176.9	-66.6	0	0	0	109.7	E31 W38 K40 A56 Y57 A59 E72 W110 I121 I123	E31-W70 HydrophobicContact CB-CH2 4.02Å; E31-W70 HydrophobicContact CB-CZ2 4.12Å; E31-W70 VanDerWaalsContact CD-CZ2 3.44Å; E31-W70 HydrophobicContact CG-CH2 3.82Å; E31-W70 HydrophobicContact CG-CZ2 3.86Å; W38-W70 HydrophobicContact CB-CZ3 4.48Å; K40-W70 HydrophobicContact CB-CD2 3.87Å; K40-W70 HydrophobicContact CB-CE3 3.73Å; K40-W70 HydrophobicContact CB-CG 4.4Å; K40-W70 HydrophobicContact CB-CH2 4.14Å; K40-W70 HydrophobicContact CB-CZ2 4.33Å; K40-W70 HydrophobicContact CB-CZ3 3.88Å; K40-W70 HydrophobicContact CD-CD2 4.1Å; K40-W70 HydrophobicContact CD-CG 4.28Å; K40-W70 HydrophobicContact CD-CZ2 4.09Å; K40-W70 HydrophobicContact CG-CD2 4.05Å; K40-W70 HydrophobicContact CG-CE3 4.41Å; K40-W70 HydrophobicContact CG-CG 4.13Å; A56-W70 CarbonylContact C-O 3.53Å; A56-W70 WeakPolarHBondContact CA-O 3.47Å; Y57-W70 PolarHBondContact N-O 2.97Å; Y57-W70 PolarHBondContact O-N 3.34Å; A59-W70 HydrophobicContact CB-CB 3.96Å; A59-W70 HydrophobicContact CB-CE3 4.37Å; W70-E72 PolarHBondContact NE1-OE1 3.2Å; W70-W110 HydrophobicContact CD2-CZ2 4.46Å; W70-W110 HydrophobicContact CE3-CH2 4.09Å; W70-W110 HydrophobicContact CE3-CZ2 4.21Å; W70-W110 AromaticContact CH2-CH2 3.97Å; W70-W110 HydrophobicContact CH2-CH2 3.97Å; W70-W110 AromaticContact CH2-CZ2 3.35Å; W70-W110 HydrophobicContact CH2-CZ2 3.35Å; W70-W110 HydrophobicContact CZ2-CH2 4.38Å; W70-W110 AromaticContact CZ2-CZ2 3.57Å; W70-W110 HydrophobicContact CZ2-CZ2 3.57Å; W70-W110 AromaticContact CZ3-CH2 3.76Å; W70-W110 HydrophobicContact CZ3-CH2 3.76Å; W70-W110 AromaticContact CZ3-CZ2 3.66Å; W70-W110 HydrophobicContact CZ3-CZ2 3.66Å; W70-I121 HydrophobicContact CD2-CG2 3.91Å; W70-I121 VanDerWaalsContact CE2-CG2 3.41Å; W70-I121 HydrophobicContact CG-CG2 4.22Å; W70-I121 HydrophobicContact CZ2-CD1 3.99Å; W70-I121 HydrophobicContact CZ2-CG2 3.84Å; W70-I123 HydrophobicContact CB-CD1 4.05Å; W70-I123 HydrophobicContact CD2-CD1 3.99Å; W70-I123 HydrophobicContact CE3-CD1 3.68Å; W70-I123 HydrophobicContact CG-CD1 4.17Å
71	N	92.7	Very high	87.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.8	-178	-56.6	-81.9	0	0	0	110.5	R48 V53 V69 I121 F122 T124	R48-N71 PolarHBondContact NE-OD1 3.49Å; R48-N71 PolarHBondContact NH1-ND2 3.17Å; R48-N71 PolarHBondContact NH1-OD1 3.35Å; R48-N71 PolarHBondContact NH2-OD1 2.83Å; V53-N71 HydrophobicContact CG1-CB 3.93Å; V69-N71 PolarHBondContact O-ND2 2.72Å; V69-N71 VanDerWaalsContact O-ND2 3.17Å; N71-I121 VanDerWaalsContact O-CA 3.26Å; N71-I121 WeakPolarHBondContact O-CA 3.29Å; N71-F122 HydrophobicContact CB-CD1 3.78Å; N71-F122 HydrophobicContact CB-CD2 3.91Å; N71-F122 HydrophobicContact CB-CE1 3.41Å; N71-F122 VanDerWaalsContact CB-CE1 3.41Å; N71-F122 HydrophobicContact CB-CE2 3.55Å; N71-F122 HydrophobicContact CB-CG 4.02Å; N71-F122 HydrophobicContact CB-CZ 3.29Å; N71-F122 WeakPolarHBondContact CB-O 3.36Å; N71-F122 PolarHBondContact N-O 3.49Å; N71-F122 WeakPolarHBondContact ND2-CE2 3.49Å; N71-F122 PolarHBondContact ND2-O 3.37Å; N71-F122 PolarHBondContact O-N 3.1Å; N71-T124 PolarHBondContact ND2-OG1 3.2Å
72	E	90.3	Very high	87.3	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.019	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.1	179.4	-53.2	-170.7	150.1	0	0	110.5	K40 D54 I55 W70 H74 R119 I121	K40-E72 IonicContact NZ-OE1 3.48Å; K40-E72 PolarHBondContact NZ-OE1 3.32Å; K40-E72 IonicContact NZ-OE2 3.43Å; D54-E72 PolarHBondContact N-O 2.78Å; I55-E72 PolarHBondContact N-O 3.03Å; I55-E72 PolarHBondContact O-N 2.89Å; W70-E72 PolarHBondContact NE1-OE1 3.2Å; E72-H74 IonicContact OE2-CE1 3.91Å; E72-H74 PolarHBondContact OE2-CE1 3.25Å; E72-H74 IonicContact OE2-NE2 2.88Å; E72-R119 IonicContact OE1-CZ 2.84Å; E72-R119 IonicContact OE1-NH1 3.9Å; E72-R119 PolarHBondContact OE1-NH1 3.04Å; E72-I121 HydrophobicContact CG-CG1 4.31Å
73	V	86.3	Confident	86.9	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.036	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.5	171.5	-176.5	0	0	0	0	107.3	F75 R119 V120 F122 M200	V73-F75 HydrophobicContact CB-CE2 4.26Å; V73-F75 HydrophobicContact CG1-CE2 3.87Å; V73-F75 HydrophobicContact CG1-CZ 4.19Å; V73-F75 WeakPolarHBondContact O-CD2 3.47Å; V73-F75 WeakPolarHBondContact O-CE2 3.42Å; V73-R119 CarbonylContact O-C 3.56Å; V73-R119 WeakPolarHBondContact O-CA 3.28Å; V73-R119 WeakPolarHBondContact O-CB 3.39Å; V73-V120 PolarHBondContact N-O 3.14Å; V73-V120 PolarHBondContact O-N 3.02Å; V73-F122 HydrophobicContact CG2-CE1 3.92Å; V73-M200 HydrophobicContact CB-CE 4.34Å; V73-M200 HydrophobicContact CG1-CE 3.89Å; V73-M200 HydrophobicContact CG2-CE 3.66Å
74	H	85.8	Confident	86.5	Confident	50 Å²	50	56 Å²	56	23%	0.231	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.5	-176.9	-63.1	79.5	0	0	0	110.6	D54 E72	D54-H74 WeakPolarHBondContact OD2-CB 3.17Å; D54-H74 PolarHBondContact OD2-N 2.63Å; D54-H74 IonicContact OD2-ND1 3.04Å; E72-H74 IonicContact OE2-CE1 3.91Å; E72-H74 PolarHBondContact OE2-CE1 3.25Å; E72-H74 IonicContact OE2-NE2 2.88Å
75	F	79.6	Confident	86.3	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	29%	0.294	C	S	.	.			trans	-105.7	127.3	178.9	-65.9	-106.1	0	0	0	108.4	V73 D77 F81 V88 P118 V120 Y203	V73-F75 HydrophobicContact CB-CE2 4.26Å; V73-F75 HydrophobicContact CG1-CE2 3.87Å; V73-F75 HydrophobicContact CG1-CZ 4.19Å; V73-F75 WeakPolarHBondContact O-CD2 3.47Å; V73-F75 WeakPolarHBondContact O-CE2 3.42Å; F75-D77 VanDerWaalsContact C-N 3.31Å; F75-D77 PolarHBondContact O-N 3.32Å; F75-F81 HydrophobicContact CB-CB 4.01Å; F75-F81 HydrophobicContact CB-CD2 4.12Å; F75-F81 HydrophobicContact CB-CG 4.32Å; F75-F81 HydrophobicContact CD1-CB 4.31Å; F75-F81 AromaticContact CD1-CD2 3.61Å; F75-F81 HydrophobicContact CD1-CD2 3.61Å; F75-F81 HydrophobicContact CD1-CE2 4.47Å; F75-F81 HydrophobicContact CD1-CG 4.42Å; F75-F81 AromaticContact CD2-CD2 3.64Å; F75-F81 HydrophobicContact CD2-CD2 3.64Å; F75-F81 AromaticContact CD2-CE2 3.93Å; F75-F81 HydrophobicContact CD2-CE2 3.93Å; F75-F81 AromaticContact CE1-CD2 3.87Å; F75-F81 HydrophobicContact CE1-CD2 3.87Å; F75-F81 HydrophobicContact CE1-CE2 4.41Å; F75-F81 AromaticContact CE2-CD2 3.93Å; F75-F81 HydrophobicContact CE2-CD2 3.93Å; F75-F81 AromaticContact CE2-CE2 3.89Å; F75-F81 HydrophobicContact CE2-CE2 3.89Å; F75-F81 HydrophobicContact CG-CB 4.24Å; F75-F81 AromaticContact CG-CD2 3.5Å; F75-F81 HydrophobicContact CG-CD2 3.5Å; F75-F81 HydrophobicContact CG-CE2 4.27Å; F75-F81 HydrophobicContact CG-CG 4.19Å; F75-F81 HydrophobicContact CZ-CD2 4.04Å; F75-F81 HydrophobicContact CZ-CE2 4.13Å; F75-V88 HydrophobicContact CZ-CG2 4.38Å; F75-P118 HydrophobicContact CB-CG 4.15Å; F75-P118 WeakPolarHBondContact CB-O 3.47Å; F75-P118 PolarHBondContact N-O 2.9Å; F75-V120 HydrophobicContact CD2-CG2 4.46Å; F75-V120 HydrophobicContact CE2-CB 4.22Å; F75-V120 HydrophobicContact CE2-CG2 3.47Å; F75-V120 VanDerWaalsContact CE2-CG2 3.47Å; F75-V120 HydrophobicContact CZ-CG2 3.9Å; F75-Y203 HydrophobicContact CB-CE1 4.38Å; F75-Y203 AromaticContact CD1-CD1 3.64Å; F75-Y203 HydrophobicContact CD1-CD1 3.64Å; F75-Y203 AromaticContact CD1-CD2 3.68Å; F75-Y203 HydrophobicContact CD1-CD2 3.68Å; F75-Y203 AromaticContact CD1-CE1 3.44Å; F75-Y203 HydrophobicContact CD1-CE1 3.44Å; F75-Y203 VanDerWaalsContact CD1-CE1 3.44Å; F75-Y203 AromaticContact CD1-CE2 3.48Å; F75-Y203 HydrophobicContact CD1-CE2 3.48Å; F75-Y203 VanDerWaalsContact CD1-CE2 3.48Å; F75-Y203 AromaticContact CD1-CG 3.74Å; F75-Y203 HydrophobicContact CD1-CG 3.74Å; F75-Y203 AromaticContact CD1-CZ 3.34Å; F75-Y203 HydrophobicContact CE1-CD1 4.1Å; F75-Y203 AromaticContact CE1-CD2 3.33Å; F75-Y203 HydrophobicContact CE1-CD2 3.33Å; F75-Y203 HydrophobicContact CE1-CE1 4.16Å; F75-Y203 AromaticContact CE1-CE2 3.39Å; F75-Y203 HydrophobicContact CE1-CE2 3.39Å; F75-Y203 AromaticContact CE1-CG 3.69Å; F75-Y203 HydrophobicContact CE1-CG 3.69Å; F75-Y203 AromaticContact CE1-CZ 3.81Å; F75-Y203 HydrophobicContact CG-CD1 4.47Å; F75-Y203 HydrophobicContact CG-CE1 4.33Å; F75-Y203 HydrophobicContact CZ-CD2 4.44Å
76	S	78.8	Confident	86	Confident	118 Å²	118	56.9 Å²	56.9	83%	0.825	29%	0.293	S	S	*	.	S	Bend	trans	-73.7	-24.1	-176.4	-61.1	0	0	0	0	113.1
77	D	81.2	Confident	85.5	Confident	57 Å²	57	54.9 Å²	54.9	31%	0.305	29%	0.287	S	S	.	.			trans	-127.7	111.4	-174.2	-176.4	-17.7	0	0	0	110.3	F75 K79 K80 F81	F75-D77 VanDerWaalsContact C-N 3.31Å; F75-D77 PolarHBondContact O-N 3.32Å; D77-K79 VanDerWaalsContact C-N 3.31Å; D77-K79 PolarHBondContact O-N 3.37Å; D77-K79 WeakPolarHBondContact OD1-CB 3.46Å; D77-K79 PolarHBondContact OD1-N 2.76Å; D77-K80 HydrophobicContact CB-CB 4.13Å; D77-K80 HydrophobicContact CB-CD 3.94Å; D77-K80 HydrophobicContact CB-CG 4.07Å; D77-K80 PolarHBondContact O-N 3.37Å; D77-K80 PolarHBondContact OD1-N 3.48Å; D77-K80 WeakPolarHBondContact OD2-CD 3.39Å; D77-K80 WeakPolarHBondContact OD2-CE 3.15Å; D77-K80 WeakPolarHBondContact OD2-CG 3.34Å; D77-K80 IonicContact OD2-NZ 3.5Å; D77-F81 PolarHBondContact O-N 2.97Å
78	R	83.8	Confident	85	Confident	111 Å²	111	50.8 Å²	50.8	42%	0.419	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-36.9	-180	-176.2	-179.4	-71.6	-152.4	-2.5	113.1	K80 F81 L82 E114 S115 P118	R78-K80 VanDerWaalsContact C-N 3.34Å; R78-F81 PolarHBondContact O-N 3.38Å; R78-L82 HydrophobicContact CG-CD1 4.18Å; R78-L82 HydrophobicContact CG-CG 4.45Å; R78-L82 WeakPolarHBondContact O-CG 3.36Å; R78-L82 PolarHBondContact O-N 3.13Å; R78-E114 PolarHBondContact NH2-O 3.05Å; R78-S115 PolarHBondContact NH2-O 3.18Å; R78-P118 HydrophobicContact CB-CG 4Å; R78-P118 HydrophobicContact CG-CG 4.26Å
79	K	82.8	Confident	84.6	Confident	176 Å²	176	54.1 Å²	54.1	77%	0.765	28%	0.28	S	S	*	.	H	α-helix	trans	-67.5	-39.8	-179.5	-68.1	-176.8	178.5	179.9	0	111	D77 A83	D77-K79 VanDerWaalsContact C-N 3.31Å; D77-K79 PolarHBondContact O-N 3.37Å; D77-K79 WeakPolarHBondContact OD1-CB 3.46Å; D77-K79 PolarHBondContact OD1-N 2.76Å; K79-A83 WeakPolarHBondContact O-CB 3.26Å; K79-A83 PolarHBondContact O-N 3.4Å; K79-A83 VanDerWaalsContact O-N 3.13Å
80	K	79.3	Confident	84.1	Confident	104 Å²	104	56.8 Å²	56.8	45%	0.452	30%	0.297	S	S	.	.	H	α-helix	trans	-70.6	-35.8	175.4	-64.2	179	-173.4	171.5	0	111.9	D77 R78 A83 E84 Y203	D77-K80 HydrophobicContact CB-CB 4.13Å; D77-K80 HydrophobicContact CB-CD 3.94Å; D77-K80 HydrophobicContact CB-CG 4.07Å; D77-K80 PolarHBondContact O-N 3.37Å; D77-K80 PolarHBondContact OD1-N 3.48Å; D77-K80 WeakPolarHBondContact OD2-CD 3.39Å; D77-K80 WeakPolarHBondContact OD2-CE 3.15Å; D77-K80 WeakPolarHBondContact OD2-CG 3.34Å; D77-K80 IonicContact OD2-NZ 3.5Å; R78-K80 VanDerWaalsContact C-N 3.34Å; K80-A83 PolarHBondContact O-N 3.02Å; K80-E84 WeakPolarHBondContact O-CB 3.28Å; K80-E84 VanDerWaalsContact O-CG 3.3Å; K80-E84 WeakPolarHBondContact O-CG 3.11Å; K80-E84 PolarHBondContact O-N 3.04Å; K80-E84 VanDerWaalsContact O-N 3.1Å; K80-Y203 WeakPolarHBondContact CB-OH 3.39Å; K80-Y203 PolarHBondContact O-OH 3.35Å
81	F	81	Confident	83.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-51.2	174.4	176.9	-106.5	0	0	0	111.4	F75 D77 R78 A83 E84 E85 M111 S113 P118 V120 Y203	F75-F81 HydrophobicContact CB-CB 4.01Å; F75-F81 HydrophobicContact CB-CD2 4.12Å; F75-F81 HydrophobicContact CB-CG 4.32Å; F75-F81 HydrophobicContact CD1-CB 4.31Å; F75-F81 AromaticContact CD1-CD2 3.61Å; F75-F81 HydrophobicContact CD1-CD2 3.61Å; F75-F81 HydrophobicContact CD1-CE2 4.47Å; F75-F81 HydrophobicContact CD1-CG 4.42Å; F75-F81 AromaticContact CD2-CD2 3.64Å; F75-F81 HydrophobicContact CD2-CD2 3.64Å; F75-F81 AromaticContact CD2-CE2 3.93Å; F75-F81 HydrophobicContact CD2-CE2 3.93Å; F75-F81 AromaticContact CE1-CD2 3.87Å; F75-F81 HydrophobicContact CE1-CD2 3.87Å; F75-F81 HydrophobicContact CE1-CE2 4.41Å; F75-F81 AromaticContact CE2-CD2 3.93Å; F75-F81 HydrophobicContact CE2-CD2 3.93Å; F75-F81 AromaticContact CE2-CE2 3.89Å; F75-F81 HydrophobicContact CE2-CE2 3.89Å; F75-F81 HydrophobicContact CG-CB 4.24Å; F75-F81 AromaticContact CG-CD2 3.5Å; F75-F81 HydrophobicContact CG-CD2 3.5Å; F75-F81 HydrophobicContact CG-CE2 4.27Å; F75-F81 HydrophobicContact CG-CG 4.19Å; F75-F81 HydrophobicContact CZ-CD2 4.04Å; F75-F81 HydrophobicContact CZ-CE2 4.13Å; D77-F81 PolarHBondContact O-N 2.97Å; R78-F81 PolarHBondContact O-N 3.38Å; F81-A83 PolarHBondContact O-N 3.3Å; F81-E84 CarbonylContact O-C 3.52Å; F81-E84 PolarHBondContact O-N 3.18Å; F81-E85 PolarHBondContact O-N 3.08Å; F81-M111 HydrophobicContact CE2-SD 4.43Å; F81-M111 HydrophobicContact CZ-CB 4.1Å; F81-M111 HydrophobicContact CZ-CG 4.2Å; F81-M111 HydrophobicContact CZ-SD 3.91Å; F81-S113 WeakPolarHBondContact CE1-OG 3.48Å; F81-P118 HydrophobicContact CB-CB 4.2Å; F81-P118 HydrophobicContact CB-CG 3.96Å; F81-P118 HydrophobicContact CD1-CB 3.51Å; F81-P118 HydrophobicContact CD1-CG 4.16Å; F81-P118 HydrophobicContact CD2-CB 4.5Å; F81-P118 HydrophobicContact CE1-CB 3.99Å; F81-P118 HydrophobicContact CG-CB 3.79Å; F81-P118 HydrophobicContact CG-CG 4.12Å; F81-V120 HydrophobicContact CE2-CG2 3.82Å; F81-V120 HydrophobicContact CZ-CG2 4.35Å; F81-Y203 PolarHBondContact N-OH 3.28Å
82	L	83.1	Confident	83.2	Confident	92 Å²	92	57.7 Å²	57.7	48%	0.482	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-33.3	178.3	-68.1	172.7	0	0	0	112.7	R78 E84	R78-L82 HydrophobicContact CG-CD1 4.18Å; R78-L82 HydrophobicContact CG-CG 4.45Å; R78-L82 WeakPolarHBondContact O-CG 3.36Å; R78-L82 PolarHBondContact O-N 3.13Å; L82-E84 VanDerWaalsContact C-N 3.34Å
83	A	83.3	Confident	83	Confident	79 Å²	79	60.8 Å²	60.8	65%	0.653	32%	0.318	S	S	*	.	H	α-helix	trans	-69.7	-30.3	175.5	0	0	0	0	0	113.2	K79 K80 F81	K79-A83 WeakPolarHBondContact O-CB 3.26Å; K79-A83 PolarHBondContact O-N 3.4Å; K79-A83 VanDerWaalsContact O-N 3.13Å; K80-A83 PolarHBondContact O-N 3.02Å; F81-A83 PolarHBondContact O-N 3.3Å
84	E	79.7	Confident	82.9	Confident	68 Å²	68	65.1 Å²	65.1	32%	0.318	34%	0.337	S	S	.	.	H	α-helix	trans	-100.4	-3.3	-177.2	-63.7	-64.6	150.6	0	0	113.1	K80 F81 L82 E86 G87 V88 Y203	K80-E84 WeakPolarHBondContact O-CB 3.28Å; K80-E84 VanDerWaalsContact O-CG 3.3Å; K80-E84 WeakPolarHBondContact O-CG 3.11Å; K80-E84 PolarHBondContact O-N 3.04Å; K80-E84 VanDerWaalsContact O-N 3.1Å; F81-E84 CarbonylContact O-C 3.52Å; F81-E84 PolarHBondContact O-N 3.18Å; L82-E84 VanDerWaalsContact C-N 3.34Å; E84-E86 VanDerWaalsContact C-N 3.3Å; E84-E86 PolarHBondContact O-N 3.03Å; E84-G87 WeakPolarHBondContact O-CA 3.48Å; E84-G87 PolarHBondContact O-N 3.38Å; E84-V88 WeakPolarHBondContact O-CG2 3.47Å; E84-V88 PolarHBondContact O-N 3.09Å; E84-Y203 HydrophobicContact CG-CE2 4.42Å
85	E	84.1	Confident	82.8	Confident	47 Å²	47	62.9 Å²	62.9	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-54.1	-44	-171.4	-170	-169.9	152.9	0	0	112.4	F81 G87 V88 R89 M111	F81-E85 PolarHBondContact O-N 3.08Å; E85-G87 VanDerWaalsContact C-N 3.34Å; E85-G87 PolarHBondContact O-N 3.34Å; E85-V88 PolarHBondContact O-N 3.01Å; E85-R89 WeakPolarHBondContact O-CB 3.4Å; E85-R89 PolarHBondContact O-N 3.08Å; E85-R89 IonicContact OE1-CZ 3.15Å; E85-R89 IonicContact OE1-NH1 3.95Å; E85-R89 IonicContact OE1-NH2 2.61Å; E85-R89 PolarHBondContact OE1-NH2 3.27Å; E85-M111 HydrophobicContact CG-CE 3.65Å; E85-M111 HydrophobicContact CG-SD 3.82Å
86	E	85.2	Confident	83.2	Confident	120 Å²	120	64.2 Å²	64.2	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-68.3	-34.4	179.1	-172.4	59	-164.4	0	0	112.6	E84 R89 T90	E84-E86 VanDerWaalsContact C-N 3.3Å; E84-E86 PolarHBondContact O-N 3.03Å; E86-R89 IonicContact OE2-CZ 3.4Å; E86-R89 IonicContact OE2-NH1 3.45Å; E86-R89 PolarHBondContact OE2-NH1 3.09Å; E86-T90 WeakPolarHBondContact O-CB 3.25Å; E86-T90 PolarHBondContact O-N 3.15Å; E86-T90 PolarHBondContact O-OG1 3.38Å
87	G	81.3	Confident	83.6	Confident	30 Å²	30	62.9 Å²	62.9	31%	0.309	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-43.6	173	0	0	0	0	0	111.4	E84 E85 T90 V91 A199	E84-G87 WeakPolarHBondContact O-CA 3.48Å; E84-G87 PolarHBondContact O-N 3.38Å; E85-G87 VanDerWaalsContact C-N 3.34Å; E85-G87 PolarHBondContact O-N 3.34Å; G87-T90 PolarHBondContact O-N 3.04Å; G87-V91 WeakPolarHBondContact O-CG2 3.33Å; G87-V91 PolarHBondContact O-N 3.32Å; G87-V91 VanDerWaalsContact O-N 3.07Å; G87-A199 VanDerWaalsContact C-CB 3.47Å
88	V	82.4	Confident	83.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-49.4	175.6	173.9	0	0	0	0	110.8	F75 E84 E85 T90 V91 F92 M111 V120 A199	F75-V88 HydrophobicContact CZ-CG2 4.38Å; E84-V88 WeakPolarHBondContact O-CG2 3.47Å; E84-V88 PolarHBondContact O-N 3.09Å; E85-V88 PolarHBondContact O-N 3.01Å; V88-T90 PolarHBondContact O-N 3.36Å; V88-V91 WeakPolarHBondContact O-CB 3.38Å; V88-V91 PolarHBondContact O-N 3.1Å; V88-V91 VanDerWaalsContact O-N 3.15Å; V88-F92 HydrophobicContact CG1-CD2 3.88Å; V88-F92 HydrophobicContact CG1-CE2 4.04Å; V88-F92 WeakPolarHBondContact O-CD2 3.49Å; V88-F92 PolarHBondContact O-N 3.25Å; V88-M111 HydrophobicContact CB-SD 4.35Å; V88-M111 HydrophobicContact CG1-SD 3.91Å; V88-V120 HydrophobicContact CG1-CG1 4.35Å; V88-V120 HydrophobicContact CG1-CG2 3.56Å; V88-A199 HydrophobicContact CG2-CB 3.96Å
89	R	87.1	Confident	84	Confident	71 Å²	71	59.8 Å²	59.8	27%	0.268	30%	0.304	S	S	.	.	H	α-helix	trans	-53.9	-51.2	175.5	-177.1	-179.2	-73.5	101.9	5.7	111.6	E85 E86 V91 F92 D93 Y109 M111	E85-R89 WeakPolarHBondContact O-CB 3.4Å; E85-R89 PolarHBondContact O-N 3.08Å; E85-R89 IonicContact OE1-CZ 3.15Å; E85-R89 IonicContact OE1-NH1 3.95Å; E85-R89 IonicContact OE1-NH2 2.61Å; E85-R89 PolarHBondContact OE1-NH2 3.27Å; E86-R89 IonicContact OE2-CZ 3.4Å; E86-R89 IonicContact OE2-NH1 3.45Å; E86-R89 PolarHBondContact OE2-NH1 3.09Å; R89-V91 VanDerWaalsContact C-N 3.25Å; R89-V91 PolarHBondContact O-N 2.91Å; R89-F92 PolarHBondContact O-N 3.49Å; R89-D93 WeakPolarHBondContact O-CB 3.49Å; R89-D93 VanDerWaalsContact O-CG 3.31Å; R89-D93 PolarHBondContact O-N 2.88Å; R89-Y109 VanDerWaalsContact CG-OH 3.28Å; R89-Y109 WeakPolarHBondContact CG-OH 3.45Å; R89-Y109 PolarHBondContact O-OH 3.22Å; R89-M111 HydrophobicContact CB-CE 4.13Å
90	T	84	Confident	84.2	Confident	59 Å²	59	52.1 Å²	52.1	36%	0.362	27%	0.271	S	S	.	.	H	α-helix	trans	-57.1	-38.4	178.7	-62.2	0	0	0	0	112.5	E86 G87 V88 K94	E86-T90 WeakPolarHBondContact O-CB 3.25Å; E86-T90 PolarHBondContact O-N 3.15Å; E86-T90 PolarHBondContact O-OG1 3.38Å; G87-T90 PolarHBondContact O-N 3.04Å; V88-T90 PolarHBondContact O-N 3.36Å; T90-K94 WeakPolarHBondContact O-CG 3.37Å; T90-K94 PolarHBondContact O-N 3.41Å
91	V	81.8	Confident	84.6	Confident	18 Å²	18	50.6 Å²	50.6	11%	0.109	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-52.4	177.1	165.4	0	0	0	0	110.6	G87 V88 R89 D93 K94 L95 T196 A199	G87-V91 WeakPolarHBondContact O-CG2 3.33Å; G87-V91 PolarHBondContact O-N 3.32Å; G87-V91 VanDerWaalsContact O-N 3.07Å; V88-V91 WeakPolarHBondContact O-CB 3.38Å; V88-V91 PolarHBondContact O-N 3.1Å; V88-V91 VanDerWaalsContact O-N 3.15Å; R89-V91 VanDerWaalsContact C-N 3.25Å; R89-V91 PolarHBondContact O-N 2.91Å; V91-D93 PolarHBondContact O-N 3.36Å; V91-K94 WeakPolarHBondContact O-CB 3.39Å; V91-K94 PolarHBondContact O-N 3.44Å; V91-K94 VanDerWaalsContact O-N 3.11Å; V91-L95 HydrophobicContact CG1-CD1 4.01Å; V91-L95 HydrophobicContact CG1-CG 4.37Å; V91-L95 WeakPolarHBondContact O-CG 3.43Å; V91-L95 PolarHBondContact O-N 3.04Å; V91-T196 WeakPolarHBondContact CG1-O 3.36Å; V91-A199 HydrophobicContact CG2-CB 3.94Å
92	F	86.8	Confident	85.2	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-69.3	-32.5	-176.3	-83	-84.5	0	0	0	113.4	V88 R89 K94 L95 I96 Y109 V120 F122 M200	V88-F92 HydrophobicContact CG1-CD2 3.88Å; V88-F92 HydrophobicContact CG1-CE2 4.04Å; V88-F92 WeakPolarHBondContact O-CD2 3.49Å; V88-F92 PolarHBondContact O-N 3.25Å; R89-F92 PolarHBondContact O-N 3.49Å; F92-K94 PolarHBondContact O-N 3.4Å; F92-L95 HydrophobicContact CD1-CD1 4.17Å; F92-L95 HydrophobicContact CE1-CD1 4.31Å; F92-L95 PolarHBondContact O-N 2.84Å; F92-L95 VanDerWaalsContact O-N 3.08Å; F92-I96 PolarHBondContact O-N 3.2Å; F92-Y109 HydrophobicContact CB-CD1 3.37Å; F92-Y109 HydrophobicContact CB-CD2 3.61Å; F92-Y109 HydrophobicContact CB-CE1 3.43Å; F92-Y109 VanDerWaalsContact CB-CE1 3.43Å; F92-Y109 HydrophobicContact CB-CE2 3.65Å; F92-Y109 HydrophobicContact CB-CG 3.47Å; F92-Y109 VanDerWaalsContact CB-CG 3.47Å; F92-Y109 HydrophobicContact CD1-CD1 4.29Å; F92-Y109 HydrophobicContact CD1-CD2 4.38Å; F92-Y109 AromaticContact CD1-CG 3.9Å; F92-Y109 HydrophobicContact CD1-CG 3.9Å; F92-Y109 HydrophobicContact CD2-CD2 4.36Å; F92-Y109 HydrophobicContact CG-CD1 4.14Å; F92-Y109 AromaticContact CG-CD2 3.88Å; F92-Y109 HydrophobicContact CG-CD2 3.88Å; F92-Y109 HydrophobicContact CG-CE2 4.32Å; F92-Y109 AromaticContact CG-CG 3.79Å; F92-Y109 HydrophobicContact CG-CG 3.79Å; F92-V120 HydrophobicContact CD2-CG1 4.03Å; F92-V120 HydrophobicContact CE1-CG1 4.42Å; F92-V120 HydrophobicContact CE2-CB 4.48Å; F92-V120 HydrophobicContact CE2-CG1 3.5Å; F92-V120 VanDerWaalsContact CE2-CG1 3.5Å; F92-V120 HydrophobicContact CZ-CG1 3.72Å; F92-F122 HydrophobicContact CD1-CB 4.15Å; F92-F122 HydrophobicContact CE1-CB 3.57Å; F92-F122 AromaticContact CE1-CD1 3.61Å; F92-F122 HydrophobicContact CE1-CD1 3.61Å; F92-F122 HydrophobicContact CE1-CD2 4.2Å; F92-F122 HydrophobicContact CE1-CE1 4.3Å; F92-F122 AromaticContact CE1-CG 3.54Å; F92-F122 HydrophobicContact CE1-CG 3.54Å; F92-F122 HydrophobicContact CZ-CB 4.41Å; F92-F122 AromaticContact CZ-CD1 3.71Å; F92-F122 HydrophobicContact CZ-CD1 3.71Å; F92-F122 HydrophobicContact CZ-CE1 4.17Å; F92-F122 HydrophobicContact CZ-CG 4.14Å; F92-M200 HydrophobicContact CE2-SD 4.05Å; F92-M200 HydrophobicContact CZ-SD 4.11Å
93	D	86.4	Confident	85.6	Confident	68 Å²	68	46.8 Å²	46.8	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-29.9	171.3	-76.9	-10.3	0	0	0	112.7	R89 V91 K97 Y109	R89-D93 WeakPolarHBondContact O-CB 3.49Å; R89-D93 VanDerWaalsContact O-CG 3.31Å; R89-D93 PolarHBondContact O-N 2.88Å; V91-D93 PolarHBondContact O-N 3.36Å; D93-K97 VanDerWaalsContact O-CD 3.3Å; D93-K97 WeakPolarHBondContact O-CD 3.44Å; D93-K97 VanDerWaalsContact O-CE 3.24Å; D93-K97 WeakPolarHBondContact O-CE 3.46Å; D93-K97 VanDerWaalsContact O-CG 3.3Å; D93-K97 WeakPolarHBondContact O-CG 3.41Å; D93-Y109 WeakPolarHBondContact OD1-CE1 3.3Å; D93-Y109 PolarHBondContact OD1-OH 3.38Å
94	K	82.5	Confident	86	Confident	97 Å²	97	43.4 Å²	43.4	42%	0.422	22%	0.223	S	C	.	.	H	α-helix	trans	-77.3	-43.3	171.2	-69.1	174.7	-177	179.5	0	111.1	T90 V91 F92 I96 K97 L98	T90-K94 WeakPolarHBondContact O-CG 3.37Å; T90-K94 PolarHBondContact O-N 3.41Å; V91-K94 WeakPolarHBondContact O-CB 3.39Å; V91-K94 PolarHBondContact O-N 3.44Å; V91-K94 VanDerWaalsContact O-N 3.11Å; F92-K94 PolarHBondContact O-N 3.4Å; K94-I96 PolarHBondContact O-N 2.95Å; K94-K97 PolarHBondContact O-N 3.38Å; K94-K97 VanDerWaalsContact O-N 3.13Å; K94-L98 PolarHBondContact O-N 2.93Å
95	L	85.4	Confident	86.5	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-41.8	-177.5	-68.8	178.8	0	0	0	113.1	V91 F92 K97 L98 V106 C194	V91-L95 HydrophobicContact CG1-CD1 4.01Å; V91-L95 HydrophobicContact CG1-CG 4.37Å; V91-L95 WeakPolarHBondContact O-CG 3.43Å; V91-L95 PolarHBondContact O-N 3.04Å; F92-L95 HydrophobicContact CD1-CD1 4.17Å; F92-L95 HydrophobicContact CE1-CD1 4.31Å; F92-L95 PolarHBondContact O-N 2.84Å; F92-L95 VanDerWaalsContact O-N 3.08Å; L95-K97 PolarHBondContact O-N 3.41Å; L95-L98 HydrophobicContact CD2-CD1 3.71Å; L95-L98 WeakPolarHBondContact O-CB 3.49Å; L95-L98 PolarHBondContact O-N 3.29Å; L95-L98 VanDerWaalsContact O-N 3.14Å; L95-V106 HydrophobicContact CB-CG2 4.34Å; L95-C194 HydrophobicContact CD2-CB 4.33Å
96	I	87.9	Confident	86.9	Confident	29 Å²	29	41.3 Å²	41.3	15%	0.149	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.9	175.8	-75.4	-178.4	0	0	0	112	F92 K94 L98 V106 Y109	F92-I96 PolarHBondContact O-N 3.2Å; K94-I96 PolarHBondContact O-N 2.95Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-V106 HydrophobicContact CG1-CG1 4.04Å; I96-Y109 HydrophobicContact CD1-CD1 3.43Å; I96-Y109 VanDerWaalsContact CD1-CD1 3.43Å; I96-Y109 HydrophobicContact CD1-CE1 3.85Å; I96-Y109 HydrophobicContact CG1-CD1 4.17Å
97	K	85.8	Confident	87.1	Confident	91 Å²	91	36.6 Å²	36.6	40%	0.396	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-8.6	-176.7	-62.2	177.2	-169.8	177.2	0	113.2	D93 K94 L95 D99 I388	D93-K97 VanDerWaalsContact O-CD 3.3Å; D93-K97 WeakPolarHBondContact O-CD 3.44Å; D93-K97 VanDerWaalsContact O-CE 3.24Å; D93-K97 WeakPolarHBondContact O-CE 3.46Å; D93-K97 VanDerWaalsContact O-CG 3.3Å; D93-K97 WeakPolarHBondContact O-CG 3.41Å; K94-K97 PolarHBondContact O-N 3.38Å; K94-K97 VanDerWaalsContact O-N 3.13Å; L95-K97 PolarHBondContact O-N 3.41Å; K97-D99 PolarHBondContact O-N 3.28Å; K97-I388 HydrophobicContact CB-CD1 4.29Å; K97-I388 HydrophobicContact CD-CG2 3.44Å; K97-I388 VanDerWaalsContact CD-CG2 3.44Å
98	L	87.6	Confident	87.6	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.063	18%	0.184	C	C	.	.			trans	-70.4	122	176.3	-60.7	179.6	0	0	0	109.7	K94 L95 I96 L103 Y164 L165 F168 I172 C194	K94-L98 PolarHBondContact O-N 2.93Å; L95-L98 HydrophobicContact CD2-CD1 3.71Å; L95-L98 WeakPolarHBondContact O-CB 3.49Å; L95-L98 PolarHBondContact O-N 3.29Å; L95-L98 VanDerWaalsContact O-N 3.14Å; I96-L98 VanDerWaalsContact C-N 3.32Å; L98-L103 HydrophobicContact CB-CD1 4.25Å; L98-L103 HydrophobicContact CD1-CD1 4.3Å; L98-Y164 HydrophobicContact CB-CE1 4.39Å; L98-Y164 HydrophobicContact CD2-CE1 3.95Å; L98-L165 HydrophobicContact CD1-CD2 3.82Å; L98-L165 HydrophobicContact CD2-CD2 4.12Å; L98-F168 HydrophobicContact CD2-CE2 3.95Å; L98-F168 HydrophobicContact CD2-CZ 3.73Å; L98-I172 HydrophobicContact CD2-CD1 3.91Å; L98-C194 HydrophobicContact CD1-CB 4.13Å
99	D	85.8	Confident	88.1	Confident	90 Å²	90	37.9 Å²	37.9	48%	0.481	19%	0.19	S	C	.	.			trans	-128.6	97.6	178	176.4	40.1	0	0	0	109.3	K97 Y164 R383	K97-D99 PolarHBondContact O-N 3.28Å; D99-Y164 PolarHBondContact N-OH 3.1Å; D99-R383 IonicContact OD2-NH1 3.82Å; D99-R383 PolarHBondContact OD2-NH1 3.16Å
100	H	88.3	Confident	88.4	Confident	16 Å²	16	36.1 Å²	36.1	7%	0.074	18%	0.184	C	C	.	.			trans	-147	135.1	179.6	-171.6	-91.5	0	0	0	110.9	N102 L103 W160 Y164	H100-N102 PolarHBondContact ND1-N 2.86Å; H100-N102 VanDerWaalsContact ND1-N 3.12Å; H100-N102 PolarHBondContact O-N 3.06Å; H100-N102 VanDerWaalsContact O-N 3.1Å; H100-L103 HydrophobicContact CB-CB 4.11Å; H100-L103 HydrophobicContact CB-CD1 3.81Å; H100-L103 HydrophobicContact CB-CG 3.82Å; H100-L103 PolarHBondContact O-N 3.41Å; H100-W160 AromaticContact CE1-CD2 3.72Å; H100-W160 AromaticContact CE1-CE3 3.93Å; H100-W160 AromaticContact CE1-CG 3.85Å; H100-W160 AromaticContact NE2-CD1 3.72Å; H100-W160 AromaticContact NE2-CD2 3.47Å; H100-W160 AromaticContact NE2-CE2 3.55Å; H100-W160 AromaticContact NE2-CG 3.63Å; H100-W160 AromaticContact NE2-NE1 3.68Å; H100-Y164 HydrophobicContact CB-CD1 3.79Å; H100-Y164 HydrophobicContact CB-CE1 3.89Å; H100-Y164 HydrophobicContact CB-CG 4.25Å; H100-Y164 AromaticContact CD2-CG 3.73Å
101	P	88.1	Confident	88.7	Confident	72 Å²	72	35 Å²	35	47%	0.468	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.8	-175	24.9	-36.3	0	0	0	114.4	W160 K191	P101-W160 HydrophobicContact CG-CE3 4.38Å; P101-W160 HydrophobicContact CG-CH2 3.76Å; P101-W160 HydrophobicContact CG-CZ3 3.65Å; P101-K191 WeakPolarHBondContact O-CE 3.35Å
102	N	92	Very high	89	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.027	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	16.4	177.3	-54.4	107.5	0	0	0	113.4	H100 P157 W160 A161 I190 K191 M192	H100-N102 PolarHBondContact ND1-N 2.86Å; H100-N102 VanDerWaalsContact ND1-N 3.12Å; H100-N102 PolarHBondContact O-N 3.06Å; H100-N102 VanDerWaalsContact O-N 3.1Å; N102-P157 HydrophobicContact CB-CB 4.06Å; N102-P157 WeakPolarHBondContact CB-O 3.46Å; N102-P157 WeakPolarHBondContact ND2-CB 3.27Å; N102-W160 WeakPolarHBondContact OD1-CZ3 3.35Å; N102-A161 HydrophobicContact CB-CB 4.19Å; N102-I190 WeakPolarHBondContact CB-O 2.9Å; N102-I190 PolarHBondContact ND2-O 3.36Å; N102-K191 CarbonylContact O-C 3.51Å; N102-K191 WeakPolarHBondContact O-CA 3.37Å; N102-M192 PolarHBondContact O-N 3.03Å
103	L	92.1	Very high	89	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	143.8	163.8	-67.1	-179	0	0	0	109.2	L98 H100 K105 A161 Y164 L165 M192 C194	L98-L103 HydrophobicContact CB-CD1 4.25Å; L98-L103 HydrophobicContact CD1-CD1 4.3Å; H100-L103 HydrophobicContact CB-CB 4.11Å; H100-L103 HydrophobicContact CB-CD1 3.81Å; H100-L103 HydrophobicContact CB-CG 3.82Å; H100-L103 PolarHBondContact O-N 3.41Å; L103-K105 PolarHBondContact O-N 3.34Å; L103-A161 HydrophobicContact CD2-CB 3.76Å; L103-A161 HydrophobicContact CG-CB 4.17Å; L103-Y164 HydrophobicContact CD1-CD1 3.8Å; L103-Y164 HydrophobicContact CD1-CE1 3.88Å; L103-L165 HydrophobicContact CD1-CD2 3.89Å; L103-L165 HydrophobicContact CD1-CG 4.35Å; L103-L165 HydrophobicContact CD2-CD1 4.41Å; L103-M192 CarbonylContact C-O 3.5Å; L103-M192 WeakPolarHBondContact CA-O 3.43Å; L103-M192 HydrophobicContact CD2-CB 4.12Å; L103-M192 HydrophobicContact CD2-CE 3.43Å; L103-M192 VanDerWaalsContact CD2-CE 3.43Å; L103-M192 HydrophobicContact CD2-CG 4.5Å; L103-C194 HydrophobicContact CD2-CB 4.2Å
104	I	92.1	Very high	88.8	Confident	8 Å²	8	41.2 Å²	41.2	4%	0.041	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	121.4	167.9	-64.6	-165.4	0	0	0	107.7	V106 T124 E125 M127 F183 K191 M192 V193	I104-V106 PolarHBondContact O-N 3.28Å; I104-T124 HydrophobicContact CG2-CG2 4.37Å; I104-E125 WeakPolarHBondContact CA-OE1 3.49Å; I104-E125 HydrophobicContact CB-CG 4.44Å; I104-E125 HydrophobicContact CG2-CG 3.62Å; I104-M127 HydrophobicContact CD1-CG 3.52Å; I104-M127 HydrophobicContact CD1-SD 4.35Å; I104-M127 HydrophobicContact CG1-CG 4.3Å; I104-F183 HydrophobicContact CD1-CB 4.07Å; I104-F183 HydrophobicContact CD1-CD2 3.67Å; I104-F183 HydrophobicContact CD1-CE2 4.29Å; I104-F183 HydrophobicContact CD1-CG 3.85Å; I104-K191 HydrophobicContact CD1-CB 4.49Å; I104-K191 HydrophobicContact CG1-CB 3.7Å; I104-K191 HydrophobicContact CG1-CD 4.41Å; I104-M192 PolarHBondContact N-O 3.42Å; I104-V193 HydrophobicContact CD1-CG2 3.55Å; I104-V193 HydrophobicContact CG1-CG2 4.3Å
105	K	90.1	Very high	88.7	Confident	63 Å²	63	38 Å²	38	27%	0.274	20%	0.195	S	C	.	.			trans	-67.2	130.9	-178.5	-173.1	170.5	-178.7	176.3	0	110.7	L103 T124 E125	L103-K105 PolarHBondContact O-N 3.34Å; K105-T124 VanDerWaalsContact O-CA 3.25Å; K105-T124 WeakPolarHBondContact O-CA 3.48Å; K105-T124 WeakPolarHBondContact O-CB 3.48Å; K105-E125 PolarHBondContact N-OE1 2.95Å; K105-E125 PolarHBondContact O-N 3.12Å
106	V	91.5	Very high	88.4	Confident	8 Å²	8	46.7 Å²	46.7	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114	164.7	-176.9	0	0	0	0	107	L95 I96 I104 F122 I123 T124	L95-V106 HydrophobicContact CB-CG2 4.34Å; I96-V106 HydrophobicContact CG1-CG1 4.04Å; I104-V106 PolarHBondContact O-N 3.28Å; V106-F122 HydrophobicContact CG1-CB 4.45Å; V106-I123 CarbonylContact C-O 3.48Å; V106-I123 WeakPolarHBondContact CA-O 3.21Å; V106-T124 HydrophobicContact CG2-CG2 4.25Å
107	H	90.4	Very high	88.2	Confident	22 Å²	22	51.2 Å²	51.2	10%	0.102	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-46.3	-176.9	-67.5	-75	0	0	0	111.8	W38 I123 E125	W38-H107 HydrophobicContact CZ2-CB 3.91Å; H107-I123 HydrophobicContact CB-CB 4.28Å; H107-I123 HydrophobicContact CB-CG2 4.16Å; H107-I123 PolarHBondContact N-O 3.16Å; H107-E125 PolarHBondContact CD2-N 3.13Å; H107-E125 PolarHBondContact NE2-N 3.41Å
108	S	92.2	Very high	88.3	Confident	25 Å²	25	47 Å²	47	18%	0.175	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	167.1	-179.2	-168.7	0	0	0	0	110.7	F122 I123	S108-F122 WeakPolarHBondContact O-CA 3.41Å; S108-I123 PolarHBondContact O-N 3.04Å
109	Y	92.5	Very high	88.4	Confident	32 Å²	32	47.9 Å²	47.9	13%	0.125	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	160	168.1	80.3	-79.4	0	0	0	110.4	R89 F92 D93 I96 I121	R89-Y109 VanDerWaalsContact CG-OH 3.28Å; R89-Y109 WeakPolarHBondContact CG-OH 3.45Å; R89-Y109 PolarHBondContact O-OH 3.22Å; F92-Y109 HydrophobicContact CB-CD1 3.37Å; F92-Y109 HydrophobicContact CB-CD2 3.61Å; F92-Y109 HydrophobicContact CB-CE1 3.43Å; F92-Y109 VanDerWaalsContact CB-CE1 3.43Å; F92-Y109 HydrophobicContact CB-CE2 3.65Å; F92-Y109 HydrophobicContact CB-CG 3.47Å; F92-Y109 VanDerWaalsContact CB-CG 3.47Å; F92-Y109 HydrophobicContact CD1-CD1 4.29Å; F92-Y109 HydrophobicContact CD1-CD2 4.38Å; F92-Y109 AromaticContact CD1-CG 3.9Å; F92-Y109 HydrophobicContact CD1-CG 3.9Å; F92-Y109 HydrophobicContact CD2-CD2 4.36Å; F92-Y109 HydrophobicContact CG-CD1 4.14Å; F92-Y109 AromaticContact CG-CD2 3.88Å; F92-Y109 HydrophobicContact CG-CD2 3.88Å; F92-Y109 HydrophobicContact CG-CE2 4.32Å; F92-Y109 AromaticContact CG-CG 3.79Å; F92-Y109 HydrophobicContact CG-CG 3.79Å; D93-Y109 WeakPolarHBondContact OD1-CE1 3.3Å; D93-Y109 PolarHBondContact OD1-OH 3.38Å; I96-Y109 HydrophobicContact CD1-CD1 3.43Å; I96-Y109 VanDerWaalsContact CD1-CD1 3.43Å; I96-Y109 HydrophobicContact CD1-CE1 3.85Å; I96-Y109 HydrophobicContact CG1-CD1 4.17Å; Y109-I121 CarbonylContact C-O 3.33Å; Y109-I121 WeakPolarHBondContact CA-O 3.48Å; Y109-I121 VanDerWaalsContact CB-O 3.31Å; Y109-I121 WeakPolarHBondContact CB-O 3.42Å
110	W	92.8	Very high	88.6	Confident	33 Å²	33	43.7 Å²	43.7	13%	0.125	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	168.4	166.5	58.4	98	0	0	0	109.7	P34 W38 W70 I121 I123	P34-W110 VanDerWaalsContact CD-CE2 3.49Å; P34-W110 HydrophobicContact CG-CB 4.15Å; P34-W110 HydrophobicContact CG-CD2 4.06Å; P34-W110 HydrophobicContact CG-CG 3.74Å; W38-W110 HydrophobicContact CE3-CZ3 4.18Å; W70-W110 HydrophobicContact CD2-CZ2 4.46Å; W70-W110 HydrophobicContact CE3-CH2 4.09Å; W70-W110 HydrophobicContact CE3-CZ2 4.21Å; W70-W110 AromaticContact CH2-CH2 3.97Å; W70-W110 HydrophobicContact CH2-CH2 3.97Å; W70-W110 AromaticContact CH2-CZ2 3.35Å; W70-W110 HydrophobicContact CH2-CZ2 3.35Å; W70-W110 HydrophobicContact CZ2-CH2 4.38Å; W70-W110 AromaticContact CZ2-CZ2 3.57Å; W70-W110 HydrophobicContact CZ2-CZ2 3.57Å; W70-W110 AromaticContact CZ3-CH2 3.76Å; W70-W110 HydrophobicContact CZ3-CH2 3.76Å; W70-W110 AromaticContact CZ3-CZ2 3.66Å; W70-W110 HydrophobicContact CZ3-CZ2 3.66Å; W110-I121 HydrophobicContact CD2-CB 4.18Å; W110-I121 HydrophobicContact CD2-CG2 4.25Å; W110-I121 HydrophobicContact CH2-CG2 3.71Å; W110-I121 HydrophobicContact CZ2-CB 3.96Å; W110-I121 HydrophobicContact CZ2-CD1 4.32Å; W110-I121 HydrophobicContact CZ2-CG2 3.27Å; W110-I121 HydrophobicContact CZ3-CG2 4.36Å; W110-I121 PolarHBondContact N-O 3.47Å; W110-I121 VanDerWaalsContact NE1-CD1 3.26Å; W110-I121 PolarHBondContact O-N 2.78Å; W110-I123 HydrophobicContact CH2-CD1 3.78Å; W110-I123 HydrophobicContact CH2-CG1 3.81Å; W110-I123 HydrophobicContact CZ3-CD1 4.2Å; W110-I123 HydrophobicContact CZ3-CG1 3.72Å
111	M	90.2	Very high	88.8	Confident	37 Å²	37	42.9 Å²	42.9	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133.3	-178.3	-66.5	-175.5	-70.9	0	0	109.1	F81 E85 V88 R89 V120	F81-M111 HydrophobicContact CE2-SD 4.43Å; F81-M111 HydrophobicContact CZ-CB 4.1Å; F81-M111 HydrophobicContact CZ-CG 4.2Å; F81-M111 HydrophobicContact CZ-SD 3.91Å; E85-M111 HydrophobicContact CG-CE 3.65Å; E85-M111 HydrophobicContact CG-SD 3.82Å; V88-M111 HydrophobicContact CB-SD 4.35Å; V88-M111 HydrophobicContact CG1-SD 3.91Å; R89-M111 HydrophobicContact CB-CE 4.13Å; M111-V120 HydrophobicContact CG-CG1 4.43Å; M111-V120 HydrophobicContact CG-CG2 4.07Å; M111-V120 HydrophobicContact SD-CG2 4.44Å
112	D	89.7	Confident	89	Confident	34 Å²	34	39.5 Å²	39.5	18%	0.182	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	95.2	173.9	171.9	-0.7	0	0	0	107.4	E114 S115 P118 R119 I121	D112-E114 PolarHBondContact OD1-N 2.8Å; D112-S115 VanDerWaalsContact CG-OG 3.25Å; D112-S115 PolarHBondContact O-OG 2.49Å; D112-S115 WeakPolarHBondContact OD1-CB 3.49Å; D112-S115 PolarHBondContact OD1-N 2.76Å; D112-S115 PolarHBondContact OD1-OG 3.29Å; D112-S115 VanDerWaalsContact OD1-OG 3.09Å; D112-S115 VanDerWaalsContact OD2-CB 3.3Å; D112-S115 WeakPolarHBondContact OD2-CB 3.48Å; D112-S115 PolarHBondContact OD2-OG 3.47Å; D112-P118 VanDerWaalsContact O-CA 3.27Å; D112-P118 WeakPolarHBondContact O-CA 3.41Å; D112-R119 HydrophobicContact CB-CG 3.85Å; D112-R119 PolarHBondContact N-O 3.38Å; D112-R119 PolarHBondContact O-N 3.3Å; D112-R119 IonicContact OD2-CZ 3.84Å; D112-R119 VanDerWaalsContact OD2-CZ 3.31Å; D112-R119 IonicContact OD2-NE 3.64Å; D112-R119 PolarHBondContact OD2-NE 3.45Å; D112-R119 IonicContact OD2-NH2 3.95Å; D112-R119 PolarHBondContact OD2-NH2 3.01Å; D112-I121 HydrophobicContact CB-CD1 4.49Å
113	S	85.7	Confident	89.1	Confident	33 Å²	33	39.3 Å²	39.3	23%	0.231	19%	0.189	C	C	.	.			trans	-83.9	-16.4	179.8	-51.3	0	0	0	0	112.8	F81	F81-S113 WeakPolarHBondContact CE1-OG 3.48Å
114	E	81.7	Confident	89.2	Confident	149 Å²	149	39.1 Å²	39.1	70%	0.696	19%	0.188	S	C	*	.	S	Bend	trans	-90.6	-30.9	-168.8	-62.8	-169.7	168.4	0	0	112.4	R78 D112	R78-E114 PolarHBondContact NH2-O 3.05Å; D112-E114 PolarHBondContact OD1-N 2.8Å
115	S	80.9	Confident	89.1	Confident	29 Å²	29	40.7 Å²	40.7	20%	0.203	20%	0.195	C	C	.	.	S	Bend	trans	-52.2	153.7	174.1	55.8	0	0	0	0	113.8	R78 D112 K117	R78-S115 PolarHBondContact NH2-O 3.18Å; D112-S115 VanDerWaalsContact CG-OG 3.25Å; D112-S115 PolarHBondContact O-OG 2.49Å; D112-S115 WeakPolarHBondContact OD1-CB 3.49Å; D112-S115 PolarHBondContact OD1-N 2.76Å; D112-S115 PolarHBondContact OD1-OG 3.29Å; D112-S115 VanDerWaalsContact OD1-OG 3.09Å; D112-S115 VanDerWaalsContact OD2-CB 3.3Å; D112-S115 WeakPolarHBondContact OD2-CB 3.48Å; D112-S115 PolarHBondContact OD2-OG 3.47Å; S115-K117 PolarHBondContact O-N 2.91Å; S115-K117 VanDerWaalsContact O-N 3.1Å; S115-K117 PolarHBondContact OG-O 3.29Å
116	E	80	Confident	89.2	Confident	186 Å²	186	40.8 Å²	40.8	87%	0.869	19%	0.194	S	C	*	.	S	Bend	trans	-50.5	-39.6	-179.7	-170.7	-171.8	171	0	0	111.9
117	K	83.3	Confident	89.1	Confident	125 Å²	125	41.1 Å²	41.1	54%	0.543	20%	0.196	S	C	.	.	S	Bend	trans	-117.3	108.9	170.2	-65.6	-177	-175	177	0	108.9	S115 R119	S115-K117 PolarHBondContact O-N 2.91Å; S115-K117 VanDerWaalsContact O-N 3.1Å; S115-K117 PolarHBondContact OG-O 3.29Å; K117-R119 PolarHBondContact O-N 3.43Å
118	P	88.2	Confident	89	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.013	21%	0.207	C	C	.	.			trans	-56.1	139.2	-180	16.5	-23.8	0	0	0	109.9	F75 R78 F81 D112	F75-P118 HydrophobicContact CB-CG 4.15Å; F75-P118 WeakPolarHBondContact CB-O 3.47Å; F75-P118 PolarHBondContact N-O 2.9Å; R78-P118 HydrophobicContact CB-CG 4Å; R78-P118 HydrophobicContact CG-CG 4.26Å; F81-P118 HydrophobicContact CB-CB 4.2Å; F81-P118 HydrophobicContact CB-CG 3.96Å; F81-P118 HydrophobicContact CD1-CB 3.51Å; F81-P118 HydrophobicContact CD1-CG 4.16Å; F81-P118 HydrophobicContact CD2-CB 4.5Å; F81-P118 HydrophobicContact CE1-CB 3.99Å; F81-P118 HydrophobicContact CG-CB 3.79Å; F81-P118 HydrophobicContact CG-CG 4.12Å; D112-P118 VanDerWaalsContact O-CA 3.27Å; D112-P118 WeakPolarHBondContact O-CA 3.41Å
119	R	89	Confident	88.8	Confident	31 Å²	31	43.1 Å²	43.1	12%	0.117	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.7	-174	61.8	-176.8	169.5	152.5	6.6	112	E31 E72 V73 D112 K117 I121	E31-R119 VanDerWaalsContact CD-NH2 3.3Å; E31-R119 IonicContact OE1-CZ 2.87Å; E31-R119 IonicContact OE1-NH1 2.73Å; E31-R119 IonicContact OE1-NH2 3.84Å; E31-R119 PolarHBondContact OE1-NH2 3.06Å; E31-R119 IonicContact OE2-CZ 3.36Å; E31-R119 IonicContact OE2-NH1 3.76Å; E31-R119 PolarHBondContact OE2-NH1 2.96Å; E31-R119 IonicContact OE2-NH2 3.64Å; E31-R119 PolarHBondContact OE2-NH2 3.33Å; E72-R119 IonicContact OE1-CZ 2.84Å; E72-R119 IonicContact OE1-NH1 3.9Å; E72-R119 PolarHBondContact OE1-NH1 3.04Å; V73-R119 CarbonylContact O-C 3.56Å; V73-R119 WeakPolarHBondContact O-CA 3.28Å; V73-R119 WeakPolarHBondContact O-CB 3.39Å; D112-R119 HydrophobicContact CB-CG 3.85Å; D112-R119 PolarHBondContact N-O 3.38Å; D112-R119 PolarHBondContact O-N 3.3Å; D112-R119 IonicContact OD2-CZ 3.84Å; D112-R119 VanDerWaalsContact OD2-CZ 3.31Å; D112-R119 IonicContact OD2-NE 3.64Å; D112-R119 PolarHBondContact OD2-NE 3.45Å; D112-R119 IonicContact OD2-NH2 3.95Å; D112-R119 PolarHBondContact OD2-NH2 3.01Å; K117-R119 PolarHBondContact O-N 3.43Å; R119-I121 HydrophobicContact CG-CD1 4.29Å; R119-I121 HydrophobicContact CG-CG1 4.24Å
120	V	89.9	Confident	88.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.4	166.6	-178	0	0	0	0	107.2	V73 F75 F81 V88 F92 M111	V73-V120 PolarHBondContact N-O 3.14Å; V73-V120 PolarHBondContact O-N 3.02Å; F75-V120 HydrophobicContact CD2-CG2 4.46Å; F75-V120 HydrophobicContact CE2-CB 4.22Å; F75-V120 HydrophobicContact CE2-CG2 3.47Å; F75-V120 VanDerWaalsContact CE2-CG2 3.47Å; F75-V120 HydrophobicContact CZ-CG2 3.9Å; F81-V120 HydrophobicContact CE2-CG2 3.82Å; F81-V120 HydrophobicContact CZ-CG2 4.35Å; V88-V120 HydrophobicContact CG1-CG1 4.35Å; V88-V120 HydrophobicContact CG1-CG2 3.56Å; F92-V120 HydrophobicContact CD2-CG1 4.03Å; F92-V120 HydrophobicContact CE1-CG1 4.42Å; F92-V120 HydrophobicContact CE2-CB 4.48Å; F92-V120 HydrophobicContact CE2-CG1 3.5Å; F92-V120 VanDerWaalsContact CE2-CG1 3.5Å; F92-V120 HydrophobicContact CZ-CG1 3.72Å; M111-V120 HydrophobicContact CG-CG1 4.43Å; M111-V120 HydrophobicContact CG-CG2 4.07Å; M111-V120 HydrophobicContact SD-CG2 4.44Å
121	I	92.5	Very high	88.6	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133	177.7	-62.2	157.4	0	0	0	108.1	W70 N71 E72 Y109 W110 D112 R119	W70-I121 HydrophobicContact CD2-CG2 3.91Å; W70-I121 VanDerWaalsContact CE2-CG2 3.41Å; W70-I121 HydrophobicContact CG-CG2 4.22Å; W70-I121 HydrophobicContact CZ2-CD1 3.99Å; W70-I121 HydrophobicContact CZ2-CG2 3.84Å; N71-I121 VanDerWaalsContact O-CA 3.26Å; N71-I121 WeakPolarHBondContact O-CA 3.29Å; E72-I121 HydrophobicContact CG-CG1 4.31Å; Y109-I121 CarbonylContact C-O 3.33Å; Y109-I121 WeakPolarHBondContact CA-O 3.48Å; Y109-I121 VanDerWaalsContact CB-O 3.31Å; Y109-I121 WeakPolarHBondContact CB-O 3.42Å; W110-I121 HydrophobicContact CD2-CB 4.18Å; W110-I121 HydrophobicContact CD2-CG2 4.25Å; W110-I121 HydrophobicContact CH2-CG2 3.71Å; W110-I121 HydrophobicContact CZ2-CB 3.96Å; W110-I121 HydrophobicContact CZ2-CD1 4.32Å; W110-I121 HydrophobicContact CZ2-CG2 3.27Å; W110-I121 HydrophobicContact CZ3-CG2 4.36Å; W110-I121 PolarHBondContact N-O 3.47Å; W110-I121 VanDerWaalsContact NE1-CD1 3.26Å; W110-I121 PolarHBondContact O-N 2.78Å; D112-I121 HydrophobicContact CB-CD1 4.49Å; R119-I121 HydrophobicContact CG-CD1 4.29Å; R119-I121 HydrophobicContact CG-CG1 4.24Å
122	F	92.5	Very high	88.7	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142.3	175.4	65.8	-85.1	0	0	0	112.4	V53 N71 V73 F92 V106 S108 T124 V195	V53-F122 HydrophobicContact CG2-CE1 4.35Å; V53-F122 HydrophobicContact CG2-CZ 3.78Å; N71-F122 HydrophobicContact CB-CD1 3.78Å; N71-F122 HydrophobicContact CB-CD2 3.91Å; N71-F122 HydrophobicContact CB-CE1 3.41Å; N71-F122 VanDerWaalsContact CB-CE1 3.41Å; N71-F122 HydrophobicContact CB-CE2 3.55Å; N71-F122 HydrophobicContact CB-CG 4.02Å; N71-F122 HydrophobicContact CB-CZ 3.29Å; N71-F122 WeakPolarHBondContact CB-O 3.36Å; N71-F122 PolarHBondContact N-O 3.49Å; N71-F122 WeakPolarHBondContact ND2-CE2 3.49Å; N71-F122 PolarHBondContact ND2-O 3.37Å; N71-F122 PolarHBondContact O-N 3.1Å; V73-F122 HydrophobicContact CG2-CE1 3.92Å; F92-F122 HydrophobicContact CD1-CB 4.15Å; F92-F122 HydrophobicContact CE1-CB 3.57Å; F92-F122 AromaticContact CE1-CD1 3.61Å; F92-F122 HydrophobicContact CE1-CD1 3.61Å; F92-F122 HydrophobicContact CE1-CD2 4.2Å; F92-F122 HydrophobicContact CE1-CE1 4.3Å; F92-F122 AromaticContact CE1-CG 3.54Å; F92-F122 HydrophobicContact CE1-CG 3.54Å; F92-F122 HydrophobicContact CZ-CB 4.41Å; F92-F122 AromaticContact CZ-CD1 3.71Å; F92-F122 HydrophobicContact CZ-CD1 3.71Å; F92-F122 HydrophobicContact CZ-CE1 4.17Å; F92-F122 HydrophobicContact CZ-CG 4.14Å; V106-F122 HydrophobicContact CG1-CB 4.45Å; S108-F122 WeakPolarHBondContact O-CA 3.41Å; F122-T124 HydrophobicContact CD2-CG2 3.72Å; F122-T124 HydrophobicContact CE2-CG2 3.78Å; F122-V195 HydrophobicContact CE2-CG2 4.18Å; F122-V195 HydrophobicContact CZ-CG2 4.03Å
123	I	94.1	Very high	88.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.1	-175.8	-55.1	-53.7	0	0	0	109.6	W38 V68 V69 W70 V106 H107 S108 W110	W38-I123 HydrophobicContact CB-CD1 4.29Å; W38-I123 HydrophobicContact CB-CG1 4.31Å; W38-I123 HydrophobicContact CD2-CB 4.39Å; W38-I123 HydrophobicContact CD2-CG1 3.86Å; W38-I123 HydrophobicContact CD2-CG2 4.22Å; W38-I123 HydrophobicContact CE3-CG1 4.12Å; W38-I123 HydrophobicContact CG-CD1 4.39Å; W38-I123 HydrophobicContact CG-CG1 3.95Å; W38-I123 HydrophobicContact CG-CG2 4.1Å; V68-I123 HydrophobicContact CB-CG2 3.8Å; V68-I123 HydrophobicContact CG1-CG2 4.31Å; V68-I123 HydrophobicContact CG2-CG2 3.75Å; V69-I123 WeakPolarHBondContact O-CA 3.45Å; W70-I123 HydrophobicContact CB-CD1 4.05Å; W70-I123 HydrophobicContact CD2-CD1 3.99Å; W70-I123 HydrophobicContact CE3-CD1 3.68Å; W70-I123 HydrophobicContact CG-CD1 4.17Å; V106-I123 CarbonylContact C-O 3.48Å; V106-I123 WeakPolarHBondContact CA-O 3.21Å; H107-I123 HydrophobicContact CB-CB 4.28Å; H107-I123 HydrophobicContact CB-CG2 4.16Å; H107-I123 PolarHBondContact N-O 3.16Å; S108-I123 PolarHBondContact O-N 3.04Å; W110-I123 HydrophobicContact CH2-CD1 3.78Å; W110-I123 HydrophobicContact CH2-CG1 3.81Å; W110-I123 HydrophobicContact CZ3-CD1 4.2Å; W110-I123 HydrophobicContact CZ3-CG1 3.72Å
124	T	93.1	Very high	88.6	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	159.8	173.4	69.6	0	0	0	0	111.2	R48 V68 V69 N71 I104 K105 V106 F122	R48-T124 PolarHBondContact NH1-OG1 2.8Å; R48-T124 PolarHBondContact NH2-OG1 3.44Å; V68-T124 WeakPolarHBondContact CB-O 3.05Å; V69-T124 PolarHBondContact N-O 2.86Å; V69-T124 PolarHBondContact O-N 3.14Å; N71-T124 PolarHBondContact ND2-OG1 3.2Å; I104-T124 HydrophobicContact CG2-CG2 4.37Å; K105-T124 VanDerWaalsContact O-CA 3.25Å; K105-T124 WeakPolarHBondContact O-CA 3.48Å; K105-T124 WeakPolarHBondContact O-CB 3.48Å; V106-T124 HydrophobicContact CG2-CG2 4.25Å; F122-T124 HydrophobicContact CD2-CG2 3.72Å; F122-T124 HydrophobicContact CE2-CG2 3.78Å
125	E	91	Very high	88.9	Confident	41 Å²	41	33.1 Å²	33.1	19%	0.192	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	149.4	167.7	62	-179.1	125.2	0	0	111.3	I104 K105 H107 K191	I104-E125 WeakPolarHBondContact CA-OE1 3.49Å; I104-E125 HydrophobicContact CB-CG 4.44Å; I104-E125 HydrophobicContact CG2-CG 3.62Å; K105-E125 PolarHBondContact N-OE1 2.95Å; K105-E125 PolarHBondContact O-N 3.12Å; H107-E125 PolarHBondContact CD2-N 3.13Å; H107-E125 PolarHBondContact NE2-N 3.41Å; E125-K191 IonicContact OE1-NZ 3.11Å; E125-K191 PolarHBondContact OE1-NZ 2.79Å; E125-K191 IonicContact OE2-NZ 2.82Å; E125-K191 PolarHBondContact OE2-NZ 3.22Å
126	Y	91.4	Very high	89.2	Confident	65 Å²	65	31.9 Å²	31.9	26%	0.255	15%	0.154	S	C	.	.			trans	-85.8	136.9	174.8	176.9	-123	0	0	0	111.8	V45 L58 E67 V69	V45-Y126 HydrophobicContact CG1-CE2 4.27Å; L58-Y126 HydrophobicContact CD1-CD2 4.45Å; E67-Y126 HydrophobicContact CB-CD1 4.13Å; E67-Y126 HydrophobicContact CB-CG 4.48Å; E67-Y126 WeakPolarHBondContact O-CB 3.37Å; V69-Y126 HydrophobicContact CG2-CD2 3.7Å; V69-Y126 HydrophobicContact CG2-CG 4.34Å
127	M	90.6	Very high	89.3	Confident	15 Å²	15	28.3 Å²	28.3	7%	0.074	14%	0.135	C	C	.	.			trans	-117.1	99.2	179.6	-64	-64.7	-69	0	0	110.1	I104 S129 G130 F183 Q185 K191	I104-M127 HydrophobicContact CD1-CG 3.52Å; I104-M127 HydrophobicContact CD1-SD 4.35Å; I104-M127 HydrophobicContact CG1-CG 4.3Å; M127-S129 PolarHBondContact O-N 2.85Å; M127-G130 PolarHBondContact O-N 3.34Å; M127-F183 HydrophobicContact CB-CB 4.04Å; M127-F183 HydrophobicContact CB-CD1 3.41Å; M127-F183 VanDerWaalsContact CB-CD1 3.41Å; M127-F183 HydrophobicContact CB-CE1 4.16Å; M127-F183 HydrophobicContact CB-CG 3.99Å; M127-F183 HydrophobicContact CE-CB 3.72Å; M127-F183 HydrophobicContact CG-CB 3.96Å; M127-F183 HydrophobicContact CG-CD1 3.97Å; M127-F183 HydrophobicContact CG-CG 4.08Å; M127-Q185 HydrophobicContact CE-CB 4.46Å; M127-Q185 HydrophobicContact CE-CG 3.54Å; M127-K191 HydrophobicContact CE-CB 3.89Å; M127-K191 HydrophobicContact CE-CD 3.99Å; M127-K191 HydrophobicContact CE-CG 4.17Å; M127-K191 HydrophobicContact SD-CD 3.93Å
128	S	86.9	Confident	89.3	Confident	49 Å²	49	29.5 Å²	29.5	34%	0.343	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-24.6	-171.7	50	0	0	0	0	115.5	Q47 G130 Q186	Q47-S128 PolarHBondContact NE2-O 3.44Å; Q47-S128 PolarHBondContact OE1-O 2.88Å; Q47-S128 VanDerWaalsContact OE1-O 3.14Å; S128-G130 VanDerWaalsContact C-N 3.35Å; S128-Q186 PolarHBondContact OG-NE2 2.96Å; S128-Q186 VanDerWaalsContact OG-NE2 3.1Å
129	S	88.7	Confident	88.9	Confident	40 Å²	40	31.2 Å²	31.2	28%	0.28	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5	-178.2	-41.3	0	0	0	0	114.3	M127 I184	M127-S129 PolarHBondContact O-N 2.85Å; S129-I184 VanDerWaalsContact CB-O 3.23Å; S129-I184 WeakPolarHBondContact CB-O 3.35Å
130	G	90.1	Very high	88	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.			trans	75.7	-168.7	177.2	0	0	0	0	0	115	M127 S128 F183 I184	M127-G130 PolarHBondContact O-N 3.34Å; S128-G130 VanDerWaalsContact C-N 3.35Å; G130-F183 WeakPolarHBondContact O-CA 3.49Å; G130-I184 PolarHBondContact O-N 2.95Å
131	T	91.5	Very high	86.9	Confident	1 Å²	1	41 Å²	41	1%	0.006	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-85.9	158.2	-174.7	67.5	0	0	0	0	112.9	S133 Q134 F135 N180 L182 F183	T131-S133 VanDerWaalsContact C-N 3.26Å; T131-S133 PolarHBondContact O-N 2.87Å; T131-Q134 PolarHBondContact O-N 3.27Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.3Å; T131-Q134 PolarHBondContact OG1-N 3.49Å; T131-F135 PolarHBondContact O-N 3.11Å; T131-N180 VanDerWaalsContact CG2-O 3.26Å; T131-N180 WeakPolarHBondContact CG2-O 3.26Å; T131-L182 CarbonylContact C-O 3.58Å; T131-L182 VanDerWaalsContact CA-O 3.23Å; T131-L182 WeakPolarHBondContact CA-O 3.4Å; T131-F183 HydrophobicContact CG2-CD1 4.13Å; T131-F183 HydrophobicContact CG2-CD2 4.22Å; T131-F183 HydrophobicContact CG2-CE1 3.69Å; T131-F183 HydrophobicContact CG2-CE2 3.74Å; T131-F183 HydrophobicContact CG2-CG 4.4Å; T131-F183 HydrophobicContact CG2-CZ 3.46Å; T131-F183 VanDerWaalsContact CG2-CZ 3.46Å
132	I	91.5	Very high	85.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-54.3	-45.4	169.4	-70	-73.9	0	0	0	109.9	Q134 F135 L136 W154 C179 L182 I184 I190 M243	I132-Q134 VanDerWaalsContact C-N 3.27Å; I132-Q134 PolarHBondContact O-N 3.47Å; I132-F135 WeakPolarHBondContact O-CA 3.47Å; I132-F135 WeakPolarHBondContact O-CB 3.39Å; I132-F135 PolarHBondContact O-N 3.26Å; I132-L136 HydrophobicContact CG2-CD1 3.64Å; I132-L136 HydrophobicContact CG2-CG 3.88Å; I132-L136 VanDerWaalsContact O-CG 3.27Å; I132-L136 WeakPolarHBondContact O-CG 2.91Å; I132-L136 PolarHBondContact O-N 2.77Å; I132-W154 HydrophobicContact CD1-CD2 3.95Å; I132-W154 HydrophobicContact CD1-CE3 3.77Å; I132-W154 HydrophobicContact CD1-CH2 4.27Å; I132-W154 HydrophobicContact CD1-CZ2 4.45Å; I132-W154 HydrophobicContact CD1-CZ3 3.93Å; I132-C179 HydrophobicContact CB-CB 4.19Å; I132-C179 HydrophobicContact CG2-CB 3.86Å; I132-C179 PolarHBondContact N-O 3.41Å; I132-L182 HydrophobicContact CB-CB 4.24Å; I132-L182 HydrophobicContact CG1-CB 3.72Å; I132-L182 PolarHBondContact N-O 3.08Å; I132-I184 HydrophobicContact CD1-CD1 3.88Å; I132-I184 HydrophobicContact CD1-CG1 3.65Å; I132-I184 HydrophobicContact CG1-CG1 4.23Å; I132-I190 HydrophobicContact CD1-CD1 3.57Å; I132-I190 HydrophobicContact CD1-CG1 4.44Å; I132-I190 HydrophobicContact CG1-CD1 4.25Å; I132-M243 HydrophobicContact CD1-SD 4.23Å; I132-M243 HydrophobicContact CG2-CG 3.85Å; I132-M243 HydrophobicContact CG2-SD 4.23Å
133	S	87.7	Confident	84.1	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-56.9	-40.9	179.7	-172.6	0	0	0	0	112.3	T131 K137 C179 N180	T131-S133 VanDerWaalsContact C-N 3.26Å; T131-S133 PolarHBondContact O-N 2.87Å; S133-K137 WeakPolarHBondContact O-CB 3.33Å; S133-K137 VanDerWaalsContact O-CG 3.22Å; S133-K137 WeakPolarHBondContact O-CG 3.48Å; S133-K137 PolarHBondContact O-N 3Å; S133-C179 PolarHBondContact N-O 2.83Å; S133-N180 WeakPolarHBondContact CB-OD1 3.3Å; S133-N180 PolarHBondContact OG-OD1 3.28Å
134	Q	86.2	Confident	82.9	Confident	29 Å²	29	57.8 Å²	57.8	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-67.3	-42.4	175.2	-73	167.1	5.5	0	0	112.2	Q47 T131 I132 L136 K137 R138	Q47-Q134 VanDerWaalsContact CA-NE2 3.28Å; Q47-Q134 PolarHBondContact O-NE2 3.5Å; T131-Q134 PolarHBondContact O-N 3.27Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.3Å; T131-Q134 PolarHBondContact OG1-N 3.49Å; I132-Q134 VanDerWaalsContact C-N 3.27Å; I132-Q134 PolarHBondContact O-N 3.47Å; Q134-L136 VanDerWaalsContact C-N 3.34Å; Q134-L136 PolarHBondContact O-N 3.37Å; Q134-K137 PolarHBondContact O-N 3.11Å; Q134-R138 WeakPolarHBondContact O-CG 3.41Å; Q134-R138 PolarHBondContact O-N 3.49Å
135	F	88	Confident	81.9	Confident	69 Å²	69	60.8 Å²	60.8	30%	0.303	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-45.4	175.8	-177.1	-83	0	0	0	111.8	T131 I132 R138 T139 W154 I184	T131-F135 PolarHBondContact O-N 3.11Å; I132-F135 WeakPolarHBondContact O-CA 3.47Å; I132-F135 WeakPolarHBondContact O-CB 3.39Å; I132-F135 PolarHBondContact O-N 3.26Å; F135-R138 PolarHBondContact O-N 3.27Å; F135-T139 HydrophobicContact CE1-CG2 4.31Å; F135-T139 VanDerWaalsContact CE1-OG1 3.25Å; F135-T139 WeakPolarHBondContact CE1-OG1 3.34Å; F135-T139 WeakPolarHBondContact O-CB 2.91Å; F135-T139 PolarHBondContact O-N 2.99Å; F135-T139 PolarHBondContact O-OG1 3.27Å; F135-W154 AromaticContact CD1-CH2 3.5Å; F135-W154 HydrophobicContact CD1-CH2 3.5Å; F135-W154 HydrophobicContact CD1-CZ2 4.17Å; F135-W154 HydrophobicContact CD1-CZ3 4.46Å; F135-W154 AromaticContact CE1-CH2 3.45Å; F135-W154 HydrophobicContact CE1-CH2 3.45Å; F135-W154 VanDerWaalsContact CE1-CH2 3.45Å; F135-W154 AromaticContact CE1-CZ2 3.96Å; F135-W154 HydrophobicContact CE1-CZ2 3.96Å; F135-W154 HydrophobicContact CG-CH2 4.36Å; F135-W154 HydrophobicContact CZ-CH2 4.23Å; F135-W154 HydrophobicContact CZ-CZ2 4.3Å; F135-I184 HydrophobicContact CB-CD1 3.42Å; F135-I184 VanDerWaalsContact CB-CD1 3.42Å; F135-I184 HydrophobicContact CD1-CD1 4.33Å; F135-I184 HydrophobicContact CD2-CD1 3.59Å; F135-I184 HydrophobicContact CE2-CD1 4.47Å; F135-I184 HydrophobicContact CG-CD1 3.5Å
136	L	87.2	Confident	81.5	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-42.7	177.6	-61.1	176.9	0	0	0	110.9	I132 Q134 R138 T139 S140 W154 E242 L246	I132-L136 HydrophobicContact CG2-CD1 3.64Å; I132-L136 HydrophobicContact CG2-CG 3.88Å; I132-L136 VanDerWaalsContact O-CG 3.27Å; I132-L136 WeakPolarHBondContact O-CG 2.91Å; I132-L136 PolarHBondContact O-N 2.77Å; Q134-L136 VanDerWaalsContact C-N 3.34Å; Q134-L136 PolarHBondContact O-N 3.37Å; L136-R138 VanDerWaalsContact C-N 3.34Å; L136-R138 PolarHBondContact O-N 3.05Å; L136-T139 PolarHBondContact O-N 3.29Å; L136-S140 VanDerWaalsContact O-CB 3.25Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.22Å; L136-W154 HydrophobicContact CD2-CZ3 4.27Å; L136-E242 HydrophobicContact CD1-CG 3.87Å; L136-L246 HydrophobicContact CD2-CD2 3.78Å
137	K	82.9	Confident	81.4	Confident	110 Å²	110	60.1 Å²	60.1	48%	0.478	33%	0.329	S	S	.	.	H	α-helix	trans	-56.5	-46.1	174	-75	167.5	-171.7	168.1	0	112	S133 Q134 S140	S133-K137 WeakPolarHBondContact O-CB 3.33Å; S133-K137 VanDerWaalsContact O-CG 3.22Å; S133-K137 WeakPolarHBondContact O-CG 3.48Å; S133-K137 PolarHBondContact O-N 3Å; Q134-K137 PolarHBondContact O-N 3.11Å; K137-S140 PolarHBondContact O-OG 2.94Å
138	R	82	Confident	81.4	Confident	150 Å²	150	61.6 Å²	61.6	57%	0.566	34%	0.336	S	S	*	.	H	α-helix	trans	-68.8	-40.5	179.1	-67.7	177.8	-167.6	127.3	0.7	112.4	Q134 F135 L136	Q134-R138 WeakPolarHBondContact O-CG 3.41Å; Q134-R138 PolarHBondContact O-N 3.49Å; F135-R138 PolarHBondContact O-N 3.27Å; L136-R138 VanDerWaalsContact C-N 3.34Å; L136-R138 PolarHBondContact O-N 3.05Å
139	T	80.6	Confident	81.5	Confident	38 Å²	38	67.2 Å²	67.2	23%	0.233	36%	0.355	C	S	.	.	H	α-helix	trans	-82.8	-19.9	-174.8	-51.1	0	0	0	0	112.9	F135 L136 Q141 S142 L246	F135-T139 HydrophobicContact CE1-CG2 4.31Å; F135-T139 VanDerWaalsContact CE1-OG1 3.25Å; F135-T139 WeakPolarHBondContact CE1-OG1 3.34Å; F135-T139 WeakPolarHBondContact O-CB 2.91Å; F135-T139 PolarHBondContact O-N 2.99Å; F135-T139 PolarHBondContact O-OG1 3.27Å; L136-T139 PolarHBondContact O-N 3.29Å; T139-Q141 PolarHBondContact O-N 2.83Å; T139-S142 WeakPolarHBondContact O-CA 3.3Å; T139-S142 WeakPolarHBondContact O-CB 3.42Å; T139-S142 PolarHBondContact O-N 2.86Å; T139-L246 HydrophobicContact CG2-CD1 4.17Å; T139-L246 HydrophobicContact CG2-CD2 4.35Å
140	S	70.4	Confident	81.5	Confident	55 Å²	55	67.4 Å²	67.4	39%	0.385	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.2	180	66.5	0	0	0	0	114.5	L136 K137 S142	L136-S140 VanDerWaalsContact O-CB 3.25Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.22Å; K137-S140 PolarHBondContact O-OG 2.94Å; S140-S142 VanDerWaalsContact C-N 3.27Å
141	Q	65.8	Low	81.7	Confident	184 Å²	184	67.4 Å²	67.4	86%	0.86	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-22.7	173.2	-64.2	-175.1	-17.9	0	0	112.9	T139	T139-Q141 PolarHBondContact O-N 2.83Å
142	S	66.1	Low	81.7	Confident	60 Å²	60	69 Å²	69	42%	0.42	36%	0.363	S	S	.	.	S	Bend	trans	-88.6	112.7	171.6	171	0	0	0	0	108.5	T139 S140 K144	T139-S142 WeakPolarHBondContact O-CA 3.3Å; T139-S142 WeakPolarHBondContact O-CB 3.42Å; T139-S142 PolarHBondContact O-N 2.86Å; S140-S142 VanDerWaalsContact C-N 3.27Å; S142-K144 PolarHBondContact O-N 3.11Å
143	S	60.4	Low	81.7	Confident	125 Å²	125	72.4 Å²	72.4	87%	0.874	38%	0.378	S	S	*	.			trans	-67.4	11.2	-177.2	65.5	0	0	0	0	115.3
144	K	69.3	Low	82	Confident	167 Å²	167	72.7 Å²	72.7	73%	0.726	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-97.9	116.5	-178.5	-69.3	-174.9	179.3	179	0	109.5	S142 L246	S142-K144 PolarHBondContact O-N 3.11Å; K144-L246 WeakPolarHBondContact O-CD1 3.26Å
145	A	72.7	Confident	82.4	Confident	66 Å²	66	71.3 Å²	71.3	55%	0.545	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-52.4	153.6	173	0	0	0	0	0	112.1	S147	A145-S147 PolarHBondContact O-N 3.25Å
146	L	82.4	Confident	82.7	Confident	28 Å²	28	69.9 Å²	69.9	15%	0.147	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-63	131	176.3	-171.1	69.1	0	0	0	109.5	I148 W151 W154 L246	L146-I148 PolarHBondContact O-N 3.34Å; L146-W151 HydrophobicContact CD2-CB 4Å; L146-W154 HydrophobicContact CD1-CH2 3.93Å; L146-W154 HydrophobicContact CD1-CZ2 4.29Å; L146-W154 HydrophobicContact CD1-CZ3 4.24Å; L146-W154 HydrophobicContact CD2-CD2 4.1Å; L146-W154 HydrophobicContact CD2-CE3 3.46Å; L146-W154 VanDerWaalsContact CD2-CE3 3.46Å; L146-W154 HydrophobicContact CD2-CH2 3.93Å; L146-W154 HydrophobicContact CD2-CZ2 4.5Å; L146-W154 HydrophobicContact CD2-CZ3 3.38Å; L146-W154 HydrophobicContact CG-CZ3 4.45Å; L146-L246 HydrophobicContact CB-CD2 4.06Å
147	S	88.1	Confident	83	Confident	63 Å²	63	69.8 Å²	69.8	44%	0.441	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-58	143.5	177.1	85.2	0	0	0	0	110.7	A145 K149 S150 W151	A145-S147 PolarHBondContact O-N 3.25Å; S147-K149 PolarHBondContact O-N 3.29Å; S147-K149 VanDerWaalsContact O-N 3.12Å; S147-S150 WeakPolarHBondContact O-CB 3.43Å; S147-S150 PolarHBondContact O-N 2.86Å; S147-S150 PolarHBondContact OG-N 3.33Å; S147-S150 PolarHBondContact OG-OG 3.31Å; S147-W151 PolarHBondContact O-N 3.39Å
148	I	90.6	Very high	83.6	Confident	46 Å²	46	64.7 Å²	64.7	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-56	-34.4	178.7	-169.4	61.3	0	0	0	112.1	L146 W151 K152 Q275	L146-I148 PolarHBondContact O-N 3.34Å; I148-W151 HydrophobicContact CD1-CD2 4.34Å; I148-W151 HydrophobicContact CD1-CE3 3.67Å; I148-W151 HydrophobicContact CD1-CZ3 4.22Å; I148-W151 PolarHBondContact O-N 2.86Å; I148-K152 VanDerWaalsContact O-CG 3.27Å; I148-K152 WeakPolarHBondContact O-CG 3.28Å; I148-K152 PolarHBondContact O-N 3.47Å; I148-Q275 HydrophobicContact CD1-CB 4.12Å; I148-Q275 HydrophobicContact CD1-CG 4.24Å
149	K	89.3	Confident	84.2	Confident	168 Å²	168	57.5 Å²	57.5	73%	0.73	32%	0.316	S	S	*	.	H	α-helix	trans	-62.1	-45.9	176.3	-67.3	-175.7	178.8	-178.7	0	111.6	S147 K153	S147-K149 PolarHBondContact O-N 3.29Å; S147-K149 VanDerWaalsContact O-N 3.12Å; K149-K153 WeakPolarHBondContact O-CB 3.11Å; K149-K153 PolarHBondContact O-N 2.83Å
150	S	89.8	Confident	84.8	Confident	44 Å²	44	56.8 Å²	56.8	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-66.4	-41.7	176.6	-56.9	0	0	0	0	111.5	S147 K152 K153 W154	S147-S150 WeakPolarHBondContact O-CB 3.43Å; S147-S150 PolarHBondContact O-N 2.86Å; S147-S150 PolarHBondContact OG-N 3.33Å; S147-S150 PolarHBondContact OG-OG 3.31Å; S150-K152 PolarHBondContact O-N 2.81Å; S150-K153 WeakPolarHBondContact O-CB 3.4Å; S150-K153 PolarHBondContact O-N 2.96Å; S150-W154 PolarHBondContact O-N 3.3Å
151	W	93.5	Very high	85.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-45.7	176.7	179.9	86	0	0	0	112.1	L146 S147 I148 W154 C155 A240 Q275 L278 I279 A301 L302	L146-W151 HydrophobicContact CD2-CB 4Å; S147-W151 PolarHBondContact O-N 3.39Å; I148-W151 HydrophobicContact CD1-CD2 4.34Å; I148-W151 HydrophobicContact CD1-CE3 3.67Å; I148-W151 HydrophobicContact CD1-CZ3 4.22Å; I148-W151 PolarHBondContact O-N 2.86Å; W151-W154 PolarHBondContact O-N 2.82Å; W151-C155 PolarHBondContact O-N 3.01Å; W151-C155 PolarHBondContact O-SG 3.31Å; W151-A240 HydrophobicContact CZ2-CB 4.03Å; W151-A240 PolarHBondContact NE1-O 3.12Å; W151-Q275 HydrophobicContact CD2-CG 4.07Å; W151-Q275 VanDerWaalsContact CD2-NE2 3.31Å; W151-Q275 HydrophobicContact CE3-CG 4.15Å; W151-Q275 VanDerWaalsContact CG-NE2 3.31Å; W151-Q275 HydrophobicContact CH2-CB 4.37Å; W151-Q275 HydrophobicContact CH2-CG 3.69Å; W151-Q275 HydrophobicContact CZ2-CG 3.6Å; W151-Q275 HydrophobicContact CZ3-CB 4.45Å; W151-Q275 HydrophobicContact CZ3-CG 3.97Å; W151-L278 HydrophobicContact CH2-CB 4.5Å; W151-L278 HydrophobicContact CH2-CD1 4.18Å; W151-L278 HydrophobicContact CH2-CD2 3.99Å; W151-L278 HydrophobicContact CH2-CG 4.46Å; W151-L278 HydrophobicContact CZ2-CD2 4.33Å; W151-I279 HydrophobicContact CZ2-CD1 4.19Å; W151-I279 HydrophobicContact CZ2-CG1 4.31Å; W151-A301 HydrophobicContact CZ3-CB 4.45Å; W151-L302 HydrophobicContact CE3-CD2 4.18Å; W151-L302 HydrophobicContact CH2-CD2 4.15Å; W151-L302 HydrophobicContact CZ3-CD2 3.55Å
152	K	92.5	Very high	87.3	Confident	35 Å²	35	45.4 Å²	45.4	15%	0.152	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-46.3	173.4	-68.4	-178.7	-167.8	-152.4	0	111.7	I148 S150 W154 C155 I156 A301 L302 E304	I148-K152 VanDerWaalsContact O-CG 3.27Å; I148-K152 WeakPolarHBondContact O-CG 3.28Å; I148-K152 PolarHBondContact O-N 3.47Å; S150-K152 PolarHBondContact O-N 2.81Å; K152-W154 PolarHBondContact O-N 3.37Å; K152-C155 PolarHBondContact O-N 3.37Å; K152-I156 HydrophobicContact CB-CD1 4.43Å; K152-I156 WeakPolarHBondContact O-CG1 3.29Å; K152-I156 PolarHBondContact O-N 2.95Å; K152-A301 WeakPolarHBondContact CD-O 3.3Å; K152-A301 WeakPolarHBondContact CE-O 3.47Å; K152-A301 PolarHBondContact NZ-O 2.73Å; K152-A301 VanDerWaalsContact NZ-O 3.08Å; K152-L302 HydrophobicContact CB-CD2 4.23Å; K152-L302 HydrophobicContact CG-CD2 3.97Å; K152-E304 WeakPolarHBondContact CD-OE1 3.29Å; K152-E304 IonicContact NZ-OE1 3.53Å; K152-E304 PolarHBondContact NZ-OE1 3.09Å
153	K	90.1	Very high	88.6	Confident	71 Å²	71	44.5 Å²	44.5	31%	0.309	24%	0.24	S	C	.	.	H	α-helix	trans	-59	-26.7	178.9	-175.5	174.6	175.6	-178	0	112.4	K149 S150 P157 N187 L189	K149-K153 WeakPolarHBondContact O-CB 3.11Å; K149-K153 PolarHBondContact O-N 2.83Å; S150-K153 WeakPolarHBondContact O-CB 3.4Å; S150-K153 PolarHBondContact O-N 2.96Å; K153-P157 WeakPolarHBondContact O-CD 3.43Å; K153-P157 VanDerWaalsContact O-CG 3.24Å; K153-P157 WeakPolarHBondContact O-CG 3.33Å; K153-N187 PolarHBondContact NZ-O 3.26Å; K153-L189 HydrophobicContact CD-CD2 4.26Å; K153-L189 VanDerWaalsContact CE-CD2 3.45Å; K153-L189 HydrophobicContact CG-CD2 3.73Å
154	W	94	Very high	90.1	Very high	15 Å²	15	40.9 Å²	40.9	6%	0.057	21%	0.208	C	C	.	.	H	α-helix	trans	-86.5	-42.8	174	-65.3	-5.9	0	0	0	113.2	I132 F135 L136 L146 S150 W151 K152 P157 I158 I184 G188 I190 M243	I132-W154 HydrophobicContact CD1-CD2 3.95Å; I132-W154 HydrophobicContact CD1-CE3 3.77Å; I132-W154 HydrophobicContact CD1-CH2 4.27Å; I132-W154 HydrophobicContact CD1-CZ2 4.45Å; I132-W154 HydrophobicContact CD1-CZ3 3.93Å; F135-W154 AromaticContact CD1-CH2 3.5Å; F135-W154 HydrophobicContact CD1-CH2 3.5Å; F135-W154 HydrophobicContact CD1-CZ2 4.17Å; F135-W154 HydrophobicContact CD1-CZ3 4.46Å; F135-W154 AromaticContact CE1-CH2 3.45Å; F135-W154 HydrophobicContact CE1-CH2 3.45Å; F135-W154 VanDerWaalsContact CE1-CH2 3.45Å; F135-W154 AromaticContact CE1-CZ2 3.96Å; F135-W154 HydrophobicContact CE1-CZ2 3.96Å; F135-W154 HydrophobicContact CG-CH2 4.36Å; F135-W154 HydrophobicContact CZ-CH2 4.23Å; F135-W154 HydrophobicContact CZ-CZ2 4.3Å; L136-W154 HydrophobicContact CD2-CZ3 4.27Å; L146-W154 HydrophobicContact CD1-CH2 3.93Å; L146-W154 HydrophobicContact CD1-CZ2 4.29Å; L146-W154 HydrophobicContact CD1-CZ3 4.24Å; L146-W154 HydrophobicContact CD2-CD2 4.1Å; L146-W154 HydrophobicContact CD2-CE3 3.46Å; L146-W154 VanDerWaalsContact CD2-CE3 3.46Å; L146-W154 HydrophobicContact CD2-CH2 3.93Å; L146-W154 HydrophobicContact CD2-CZ2 4.5Å; L146-W154 HydrophobicContact CD2-CZ3 3.38Å; L146-W154 HydrophobicContact CG-CZ3 4.45Å; S150-W154 PolarHBondContact O-N 3.3Å; W151-W154 PolarHBondContact O-N 2.82Å; K152-W154 PolarHBondContact O-N 3.37Å; W154-P157 WeakPolarHBondContact O-CD 3.49Å; W154-I158 VanDerWaalsContact O-CD1 3.26Å; W154-I158 WeakPolarHBondContact O-CD1 3.22Å; W154-I158 VanDerWaalsContact O-CG1 3.3Å; W154-I158 WeakPolarHBondContact O-CG1 3.24Å; W154-I184 HydrophobicContact CZ2-CD1 4.37Å; W154-G188 PolarHBondContact NE1-O 2.87Å; W154-I190 HydrophobicContact CB-CD1 4.42Å; W154-I190 HydrophobicContact CB-CG1 3.86Å; W154-I190 HydrophobicContact CD2-CD1 4.41Å; W154-I190 HydrophobicContact CG-CD1 3.97Å; W154-I190 HydrophobicContact CG-CG1 3.9Å; W154-M243 HydrophobicContact CB-SD 3.93Å; W154-M243 HydrophobicContact CD2-SD 4.34Å; W154-M243 HydrophobicContact CE3-CB 4.11Å; W154-M243 HydrophobicContact CE3-CG 3.87Å; W154-M243 HydrophobicContact CE3-SD 3.56Å; W154-M243 VanDerWaalsContact CE3-SD 3.56Å; W154-M243 HydrophobicContact CZ3-CB 4.34Å; W154-M243 HydrophobicContact CZ3-CG 4.16Å; W154-M243 HydrophobicContact CZ3-SD 4.38Å
155	C	95.7	Very high	91.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.4	-40.5	-178.1	-68.8	0	0	0	0	113.2	W151 K152 I158 L159 F236 L302	W151-C155 PolarHBondContact O-N 3.01Å; W151-C155 PolarHBondContact O-SG 3.31Å; K152-C155 PolarHBondContact O-N 3.37Å; C155-I158 PolarHBondContact O-N 2.99Å; C155-L159 PolarHBondContact O-N 3.43Å; C155-F236 HydrophobicContact CB-CE2 4.16Å; C155-F236 HydrophobicContact CB-CZ 4.01Å; C155-L302 HydrophobicContact CB-CD1 4.21Å; C155-L302 HydrophobicContact CB-CD2 3.9Å
156	I	93.5	Very high	92.1	Very high	39 Å²	39	31.1 Å²	31.1	20%	0.2	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-52.3	-175.5	-70.3	165.6	0	0	0	112	K152 I158 L159 W160 L297 L302 T378	K152-I156 HydrophobicContact CB-CD1 4.43Å; K152-I156 WeakPolarHBondContact O-CG1 3.29Å; K152-I156 PolarHBondContact O-N 2.95Å; I156-I158 VanDerWaalsContact C-N 3.29Å; I156-I158 PolarHBondContact O-N 2.97Å; I156-L159 PolarHBondContact O-N 3.06Å; I156-W160 WeakPolarHBondContact O-CB 3.25Å; I156-W160 PolarHBondContact O-N 3.04Å; I156-L297 HydrophobicContact CG2-CD2 4.31Å; I156-L302 HydrophobicContact CG1-CB 4.18Å; I156-L302 HydrophobicContact CG1-CD1 4.47Å; I156-L302 HydrophobicContact CG1-CD2 4.42Å; I156-T378 HydrophobicContact CG2-CG2 3.81Å
157	P	92.9	Very high	92.5	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.013	17%	0.17	C	C	.	.	H	α-helix	trans	-52	-41.8	173.3	-35.2	40.1	0	0	0	115.2	N102 K153 W154 W160 A161 L189 I190	N102-P157 HydrophobicContact CB-CB 4.06Å; N102-P157 WeakPolarHBondContact CB-O 3.46Å; N102-P157 WeakPolarHBondContact ND2-CB 3.27Å; K153-P157 WeakPolarHBondContact O-CD 3.43Å; K153-P157 VanDerWaalsContact O-CG 3.24Å; K153-P157 WeakPolarHBondContact O-CG 3.33Å; W154-P157 WeakPolarHBondContact O-CD 3.49Å; P157-W160 PolarHBondContact O-N 2.78Å; P157-A161 WeakPolarHBondContact O-CB 3.46Å; P157-A161 PolarHBondContact O-N 3.42Å; P157-L189 HydrophobicContact CG-CD2 4.06Å; P157-I190 HydrophobicContact CB-CB 4.09Å
158	I	95.8	Very high	92.4	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-66.9	-49.3	-177.9	-58.8	162.5	0	0	0	109.7	W154 C155 I156 W160 A161 L162 L177 L182 I190 F236 M243	W154-I158 VanDerWaalsContact O-CD1 3.26Å; W154-I158 WeakPolarHBondContact O-CD1 3.22Å; W154-I158 VanDerWaalsContact O-CG1 3.3Å; W154-I158 WeakPolarHBondContact O-CG1 3.24Å; C155-I158 PolarHBondContact O-N 2.99Å; I156-I158 VanDerWaalsContact C-N 3.29Å; I156-I158 PolarHBondContact O-N 2.97Å; I158-W160 VanDerWaalsContact C-N 3.3Å; I158-W160 PolarHBondContact O-N 3.15Å; I158-A161 PolarHBondContact O-N 3.03Å; I158-L162 HydrophobicContact CG2-CD1 4.34Å; I158-L162 WeakPolarHBondContact O-CG 3.09Å; I158-L162 PolarHBondContact O-N 3.41Å; I158-L177 HydrophobicContact CG2-CD1 4.48Å; I158-L177 HydrophobicContact CG2-CD2 4.45Å; I158-L182 HydrophobicContact CD1-CD1 3.55Å; I158-L182 HydrophobicContact CD1-CD2 4.16Å; I158-L182 HydrophobicContact CD1-CG 4.44Å; I158-L182 HydrophobicContact CG1-CD1 4.21Å; I158-L182 HydrophobicContact CG1-CD2 3.84Å; I158-L182 HydrophobicContact CG2-CD2 4.21Å; I158-I190 HydrophobicContact CD1-CG2 4.33Å; I158-I190 HydrophobicContact CG1-CB 4.38Å; I158-I190 HydrophobicContact CG1-CG2 3.89Å; I158-F236 HydrophobicContact CB-CD2 4.27Å; I158-F236 HydrophobicContact CB-CE2 4.25Å; I158-F236 HydrophobicContact CG2-CD2 3.72Å; I158-F236 HydrophobicContact CG2-CE2 4.21Å; I158-M243 HydrophobicContact CD1-CE 3.87Å; I158-M243 HydrophobicContact CD1-SD 4.33Å
159	L	95.8	Very high	92	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-35.7	177.4	-74.4	171	0	0	0	112.5	C155 I156 L162 D163 F236 A293 L296 L297 L302	C155-L159 PolarHBondContact O-N 3.43Å; I156-L159 PolarHBondContact O-N 3.06Å; L159-L162 PolarHBondContact O-N 3.23Å; L159-D163 WeakPolarHBondContact O-CB 3.47Å; L159-D163 PolarHBondContact O-N 3.38Å; L159-F236 HydrophobicContact CD1-CE1 3.9Å; L159-F236 HydrophobicContact CD1-CE2 4.22Å; L159-F236 HydrophobicContact CD1-CZ 3.54Å; L159-F236 HydrophobicContact CD2-CD1 3.74Å; L159-F236 HydrophobicContact CD2-CD2 4.18Å; L159-F236 HydrophobicContact CD2-CE1 3.6Å; L159-F236 HydrophobicContact CD2-CE2 4.05Å; L159-F236 HydrophobicContact CD2-CG 4.04Å; L159-F236 HydrophobicContact CD2-CZ 3.77Å; L159-F236 HydrophobicContact CG-CD1 4.39Å; L159-F236 HydrophobicContact CG-CD2 4.25Å; L159-F236 HydrophobicContact CG-CE1 3.86Å; L159-F236 HydrophobicContact CG-CE2 3.7Å; L159-F236 HydrophobicContact CG-CZ 3.49Å; L159-F236 VanDerWaalsContact CG-CZ 3.49Å; L159-A293 HydrophobicContact CD2-CB 4.31Å; L159-L296 HydrophobicContact CD1-CB 3.68Å; L159-L296 HydrophobicContact CD2-CB 3.84Å; L159-L296 HydrophobicContact CD2-CD1 3.65Å; L159-L296 HydrophobicContact CD2-CG 4.4Å; L159-L296 HydrophobicContact CG-CB 4.4Å; L159-L297 HydrophobicContact CB-CD2 3.65Å; L159-L297 HydrophobicContact CB-CG 3.94Å; L159-L297 HydrophobicContact CD1-CD2 4.45Å; L159-L302 HydrophobicContact CD1-CD1 3.26Å
160	W	93	Very high	91.8	Very high	23 Å²	23	33.8 Å²	33.8	9%	0.087	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-41.1	176.9	-169.6	22.9	0	0	0	111.7	H100 P101 N102 I156 P157 I158 D163 Y164 P376 T378 R381	H100-W160 AromaticContact CE1-CD2 3.72Å; H100-W160 AromaticContact CE1-CE3 3.93Å; H100-W160 AromaticContact CE1-CG 3.85Å; H100-W160 AromaticContact NE2-CD1 3.72Å; H100-W160 AromaticContact NE2-CD2 3.47Å; H100-W160 AromaticContact NE2-CE2 3.55Å; H100-W160 AromaticContact NE2-CG 3.63Å; H100-W160 AromaticContact NE2-NE1 3.68Å; P101-W160 HydrophobicContact CG-CE3 4.38Å; P101-W160 HydrophobicContact CG-CH2 3.76Å; P101-W160 HydrophobicContact CG-CZ3 3.65Å; N102-W160 WeakPolarHBondContact OD1-CZ3 3.35Å; I156-W160 WeakPolarHBondContact O-CB 3.25Å; I156-W160 PolarHBondContact O-N 3.04Å; P157-W160 PolarHBondContact O-N 2.78Å; I158-W160 VanDerWaalsContact C-N 3.3Å; I158-W160 PolarHBondContact O-N 3.15Å; W160-D163 PolarHBondContact O-N 3.48Å; W160-Y164 PolarHBondContact O-N 3.27Å; W160-P376 HydrophobicContact CH2-CB 4.29Å; W160-P376 HydrophobicContact CZ3-CB 3.81Å; W160-P376 HydrophobicContact CZ3-CG 4.34Å; W160-T378 HydrophobicContact CD2-CG2 3.63Å; W160-T378 HydrophobicContact CE3-CG2 3.17Å; W160-T378 HydrophobicContact CG-CG2 4.25Å; W160-T378 HydrophobicContact CH2-CG2 4.23Å; W160-T378 HydrophobicContact CZ3-CG2 3.53Å; W160-T378 PolarHBondContact NE1-O 3.15Å; W160-R381 HydrophobicContact CZ2-CB 4.23Å
161	A	93.6	Very high	91.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-40.4	173.7	0	0	0	0	0	112.3	N102 L103 P157 I158 Y164 L165 M192	N102-A161 HydrophobicContact CB-CB 4.19Å; L103-A161 HydrophobicContact CD2-CB 3.76Å; L103-A161 HydrophobicContact CG-CB 4.17Å; P157-A161 WeakPolarHBondContact O-CB 3.46Å; P157-A161 PolarHBondContact O-N 3.42Å; I158-A161 PolarHBondContact O-N 3.03Å; A161-Y164 WeakPolarHBondContact O-CB 3.46Å; A161-Y164 PolarHBondContact O-N 3.37Å; A161-L165 WeakPolarHBondContact O-CG 3.47Å; A161-L165 PolarHBondContact O-N 2.96Å; A161-M192 HydrophobicContact CB-CE 3.69Å
162	L	94.8	Very high	91.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-43	174	-71.3	175.8	0	0	0	112.2	I158 L159 Y164 L165 H166 H174 L177 M192 D232 F236 A293	I158-L162 HydrophobicContact CG2-CD1 4.34Å; I158-L162 WeakPolarHBondContact O-CG 3.09Å; I158-L162 PolarHBondContact O-N 3.41Å; L159-L162 PolarHBondContact O-N 3.23Å; L162-Y164 VanDerWaalsContact C-N 3.26Å; L162-Y164 PolarHBondContact O-N 2.87Å; L162-L165 PolarHBondContact O-N 3.22Å; L162-H166 VanDerWaalsContact O-CB 3.29Å; L162-H166 WeakPolarHBondContact O-CB 3.49Å; L162-H166 PolarHBondContact O-CD2 3.28Å; L162-H166 PolarHBondContact O-N 3.03Å; L162-H174 HydrophobicContact CD2-CB 4.35Å; L162-L177 HydrophobicContact CD1-CD2 3.92Å; L162-L177 HydrophobicContact CD2-CD2 4.42Å; L162-M192 HydrophobicContact CD2-CE 4.04Å; L162-M192 HydrophobicContact CD2-SD 4.2Å; L162-M192 HydrophobicContact CG-CE 4.4Å; L162-D232 HydrophobicContact CD1-CB 4.4Å; L162-D232 HydrophobicContact CD2-CB 3.81Å; L162-F236 HydrophobicContact CD1-CB 4.09Å; L162-A293 HydrophobicContact CB-CB 3.87Å
163	D	93.8	Very high	91.1	Very high	40 Å²	40	34.9 Å²	34.9	21%	0.214	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-41.2	176.2	-167.1	45.5	0	0	0	111	L159 W160 S167 A293 H294 L297	L159-D163 WeakPolarHBondContact O-CB 3.47Å; L159-D163 PolarHBondContact O-N 3.38Å; W160-D163 PolarHBondContact O-N 3.48Å; D163-S167 VanDerWaalsContact O-CB 3.32Å; D163-S167 WeakPolarHBondContact O-CB 3.14Å; D163-S167 PolarHBondContact O-N 2.76Å; D163-A293 HydrophobicContact CB-CB 4.03Å; D163-H294 VanDerWaalsContact OD1-CB 3.24Å; D163-H294 WeakPolarHBondContact OD1-CB 3.43Å; D163-H294 IonicContact OD1-CG 3.49Å; D163-H294 PolarHBondContact OD1-N 3.03Å; D163-H294 IonicContact OD1-ND1 3.19Å; D163-H294 IonicContact OD2-ND1 3.27Å; D163-H294 PolarHBondContact OD2-ND1 2.87Å; D163-L297 HydrophobicContact CB-CD1 4.18Å
164	Y	91.6	Very high	91	Very high	50 Å²	50	31.5 Å²	31.5	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-60.5	-51.8	173	173	-106.7	0	0	0	112.3	L98 D99 H100 L103 W160 A161 L162 H166 S167 F168	L98-Y164 HydrophobicContact CB-CE1 4.39Å; L98-Y164 HydrophobicContact CD2-CE1 3.95Å; D99-Y164 PolarHBondContact N-OH 3.1Å; H100-Y164 HydrophobicContact CB-CD1 3.79Å; H100-Y164 HydrophobicContact CB-CE1 3.89Å; H100-Y164 HydrophobicContact CB-CG 4.25Å; H100-Y164 AromaticContact CD2-CG 3.73Å; L103-Y164 HydrophobicContact CD1-CD1 3.8Å; L103-Y164 HydrophobicContact CD1-CE1 3.88Å; W160-Y164 PolarHBondContact O-N 3.27Å; A161-Y164 WeakPolarHBondContact O-CB 3.46Å; A161-Y164 PolarHBondContact O-N 3.37Å; L162-Y164 VanDerWaalsContact C-N 3.26Å; L162-Y164 PolarHBondContact O-N 2.87Å; Y164-H166 PolarHBondContact O-N 3.1Å; Y164-S167 PolarHBondContact O-N 3.25Å; Y164-S167 PolarHBondContact O-OG 3.23Å; Y164-F168 HydrophobicContact CD1-CE2 4.16Å; Y164-F168 HydrophobicContact CD2-CE2 4.38Å; Y164-F168 AromaticContact CE1-CE2 3.8Å; Y164-F168 HydrophobicContact CE1-CE2 3.8Å; Y164-F168 HydrophobicContact CE1-CZ 4.11Å; Y164-F168 HydrophobicContact CE2-CE2 4.03Å; Y164-F168 HydrophobicContact CE2-CZ 4.11Å; Y164-F168 HydrophobicContact CG-CE2 4.45Å; Y164-F168 AromaticContact CZ-CE2 3.74Å; Y164-F168 AromaticContact CZ-CZ 3.69Å; Y164-F168 VanDerWaalsContact O-CD2 3.24Å; Y164-F168 WeakPolarHBondContact O-CD2 3.27Å; Y164-F168 WeakPolarHBondContact O-CE2 2.98Å
165	L	91.5	Very high	90.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-40	179.2	-66.1	178.4	0	0	0	112.6	L98 L103 A161 L162 S167 F168 I172 H174 M192	L98-L165 HydrophobicContact CD1-CD2 3.82Å; L98-L165 HydrophobicContact CD2-CD2 4.12Å; L103-L165 HydrophobicContact CD1-CD2 3.89Å; L103-L165 HydrophobicContact CD1-CG 4.35Å; L103-L165 HydrophobicContact CD2-CD1 4.41Å; A161-L165 WeakPolarHBondContact O-CG 3.47Å; A161-L165 PolarHBondContact O-N 2.96Å; L162-L165 PolarHBondContact O-N 3.22Å; L165-S167 PolarHBondContact O-N 2.92Å; L165-F168 WeakPolarHBondContact O-CD2 3.36Å; L165-I172 CarbonylContact C-O 3.48Å; L165-I172 HydrophobicContact CB-CB 4.22Å; L165-I172 HydrophobicContact CB-CG2 4.44Å; L165-I172 WeakPolarHBondContact CB-O 3.48Å; L165-I172 HydrophobicContact CD2-CB 4.33Å; L165-I172 HydrophobicContact CD2-CG2 4.04Å; L165-I172 PolarHBondContact O-N 2.95Å; L165-H174 HydrophobicContact CD1-CB 4.49Å; L165-M192 HydrophobicContact CD1-CE 3.62Å
166	H	92.3	Very high	89.8	Confident	28 Å²	28	33.5 Å²	33.5	13%	0.13	19%	0.187	C	C	.	.	H	α-helix	trans	-74.3	-13.8	-179.9	-63	173.8	0	0	0	112.9	L162 Y164 I172 P229 D232	L162-H166 VanDerWaalsContact O-CB 3.29Å; L162-H166 WeakPolarHBondContact O-CB 3.49Å; L162-H166 PolarHBondContact O-CD2 3.28Å; L162-H166 PolarHBondContact O-N 3.03Å; Y164-H166 PolarHBondContact O-N 3.1Å; H166-I172 PolarHBondContact CD2-O 3.31Å; H166-P229 HydrophobicContact CB-CB 4.41Å; H166-P229 PolarHBondContact CE1-O 3.17Å; H166-D232 IonicContact CD2-OD2 2.83Å; H166-D232 IonicContact CE1-OD2 2.78Å; H166-D232 IonicContact NE2-OD2 3.26Å; H166-D232 PolarHBondContact NE2-OD2 2.88Å
167	S	90.1	Very high	89.6	Confident	70 Å²	70	31.7 Å²	31.7	49%	0.49	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.8	178	77.2	0	0	0	0	114.9	D163 Y164 L165	D163-S167 VanDerWaalsContact O-CB 3.32Å; D163-S167 WeakPolarHBondContact O-CB 3.14Å; D163-S167 PolarHBondContact O-N 2.76Å; Y164-S167 PolarHBondContact O-N 3.25Å; Y164-S167 PolarHBondContact O-OG 3.23Å; L165-S167 PolarHBondContact O-N 2.92Å
168	F	86.6	Confident	89.4	Confident	38 Å²	38	31.9 Å²	31.9	17%	0.167	18%	0.179	C	C	.	.	S	Bend	trans	-69.9	159.8	175.9	-75.5	-92.9	0	0	0	111.8	L98 Y164 L165 P170 P171 I172 I388	L98-F168 HydrophobicContact CD2-CE2 3.95Å; L98-F168 HydrophobicContact CD2-CZ 3.73Å; Y164-F168 HydrophobicContact CD1-CE2 4.16Å; Y164-F168 HydrophobicContact CD2-CE2 4.38Å; Y164-F168 AromaticContact CE1-CE2 3.8Å; Y164-F168 HydrophobicContact CE1-CE2 3.8Å; Y164-F168 HydrophobicContact CE1-CZ 4.11Å; Y164-F168 HydrophobicContact CE2-CE2 4.03Å; Y164-F168 HydrophobicContact CE2-CZ 4.11Å; Y164-F168 HydrophobicContact CG-CE2 4.45Å; Y164-F168 AromaticContact CZ-CE2 3.74Å; Y164-F168 AromaticContact CZ-CZ 3.69Å; Y164-F168 VanDerWaalsContact O-CD2 3.24Å; Y164-F168 WeakPolarHBondContact O-CD2 3.27Å; Y164-F168 WeakPolarHBondContact O-CE2 2.98Å; L165-F168 WeakPolarHBondContact O-CD2 3.36Å; F168-P170 VanDerWaalsContact C-C 3.44Å; F168-P170 CarbonylContact C-O 3.19Å; F168-P170 WeakPolarHBondContact CB-O 3.44Å; F168-P170 CarbonylContact O-C 3.55Å; F168-P171 VanDerWaalsContact O-CA 3.27Å; F168-P171 WeakPolarHBondContact O-CA 3.42Å; F168-P171 WeakPolarHBondContact O-CD 3.48Å; F168-I172 HydrophobicContact CB-CD1 4.3Å; F168-I172 HydrophobicContact CB-CG1 4.1Å; F168-I172 HydrophobicContact CD1-CD1 4.14Å; F168-I172 HydrophobicContact CD2-CD1 3.84Å; F168-I172 HydrophobicContact CD2-CG1 4.31Å; F168-I172 HydrophobicContact CE1-CD1 4.47Å; F168-I172 HydrophobicContact CE2-CD1 4.16Å; F168-I172 HydrophobicContact CG-CD1 3.81Å; F168-I172 HydrophobicContact CG-CG1 4.16Å; F168-I172 HydrophobicContact CZ-CD1 4.46Å; F168-I388 HydrophobicContact CD1-CD1 4.1Å; F168-I388 HydrophobicContact CE1-CD1 3.45Å; F168-I388 VanDerWaalsContact CE1-CD1 3.45Å; F168-I388 HydrophobicContact CE1-CG1 4.01Å; F168-I388 HydrophobicContact CZ-CD1 4.37Å
169	D	82.3	Confident	89.1	Confident	162 Å²	162	31.8 Å²	31.8	87%	0.866	18%	0.178	S	C	*	.	S	Bend	trans	-124.8	106.6	173.1	-174.4	30.1	0	0	0	109.8
170	P	85.1	Confident	88.8	Confident	90 Å²	90	32.5 Å²	32.5	58%	0.584	18%	0.183	S	C	*	.	S	Bend	cis	-68.6	157.4	-4.4	30.7	-36.2	0	0	0	112.7	F168	F168-P170 VanDerWaalsContact C-C 3.44Å; F168-P170 CarbonylContact C-O 3.19Å; F168-P170 WeakPolarHBondContact CB-O 3.44Å; F168-P170 CarbonylContact O-C 3.55Å
171	P	87.4	Confident	88.6	Confident	62 Å²	62	31.5 Å²	31.5	40%	0.403	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-58.7	139.2	178.2	-26.3	35.1	0	0	0	112.6	F168 P229	F168-P171 VanDerWaalsContact O-CA 3.27Å; F168-P171 WeakPolarHBondContact O-CA 3.42Å; F168-P171 WeakPolarHBondContact O-CD 3.48Å; P171-P229 HydrophobicContact CB-CG 3.78Å; P171-P229 HydrophobicContact CG-CG 4.3Å
172	I	86.9	Confident	88.6	Confident	22 Å²	22	31.5 Å²	31.5	11%	0.113	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-88.2	117.8	172.7	-63	172.7	0	0	0	108.1	L98 L165 H166 F168 T196	L98-I172 HydrophobicContact CD2-CD1 3.91Å; L165-I172 CarbonylContact C-O 3.48Å; L165-I172 HydrophobicContact CB-CB 4.22Å; L165-I172 HydrophobicContact CB-CG2 4.44Å; L165-I172 WeakPolarHBondContact CB-O 3.48Å; L165-I172 HydrophobicContact CD2-CB 4.33Å; L165-I172 HydrophobicContact CD2-CG2 4.04Å; L165-I172 PolarHBondContact O-N 2.95Å; H166-I172 PolarHBondContact CD2-O 3.31Å; F168-I172 HydrophobicContact CB-CD1 4.3Å; F168-I172 HydrophobicContact CB-CG1 4.1Å; F168-I172 HydrophobicContact CD1-CD1 4.14Å; F168-I172 HydrophobicContact CD2-CD1 3.84Å; F168-I172 HydrophobicContact CD2-CG1 4.31Å; F168-I172 HydrophobicContact CE1-CD1 4.47Å; F168-I172 HydrophobicContact CE2-CD1 4.16Å; F168-I172 HydrophobicContact CG-CD1 3.81Å; F168-I172 HydrophobicContact CG-CG1 4.16Å; F168-I172 HydrophobicContact CZ-CD1 4.46Å; I172-T196 HydrophobicContact CG2-CG2 3.43Å; I172-T196 VanDerWaalsContact CG2-CG2 3.43Å
173	V	87	Confident	88.6	Confident	18 Å²	18	31.9 Å²	31.9	11%	0.109	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-101.5	124.5	178.4	-169.8	0	0	0	0	109.2	C175 T196 V227 P229 D232	V173-C175 VanDerWaalsContact CG1-SG 3.55Å; V173-C175 PolarHBondContact O-N 2.94Å; V173-C175 PolarHBondContact O-SG 3.36Å; V173-C175 VanDerWaalsContact O-SG 3.34Å; V173-T196 WeakPolarHBondContact O-CG2 3.2Å; V173-V227 HydrophobicContact CB-CG1 3.88Å; V173-V227 HydrophobicContact CG1-CG1 3.82Å; V173-V227 HydrophobicContact CG2-CG1 4.2Å; V173-P229 HydrophobicContact CG2-CG 4.26Å; V173-D232 WeakPolarHBondContact CA-OD2 3.4Å; V173-D232 WeakPolarHBondContact CG1-OD2 3.39Å
174	H	87.3	Confident	88.5	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.173	C	C	.	.			trans	-63.8	-42.7	-175	-177.9	-73.2	0	0	0	112.5	L162 L165 N176 L177 M192 V193 D232	L162-H174 HydrophobicContact CD2-CB 4.35Å; L165-H174 HydrophobicContact CD1-CB 4.49Å; H174-N176 PolarHBondContact CE1-O 3.12Å; H174-N176 VanDerWaalsContact CE1-O 3.28Å; H174-N176 PolarHBondContact ND1-N 2.99Å; H174-N176 VanDerWaalsContact ND1-N 3.16Å; H174-N176 PolarHBondContact O-N 2.92Å; H174-L177 PolarHBondContact CE1-N 3.29Å; H174-L177 WeakPolarHBondContact ND1-CA 3.46Å; H174-L177 PolarHBondContact ND1-N 2.8Å; H174-M192 VanDerWaalsContact CD2-SD 3.58Å; H174-V193 PolarHBondContact NE2-O 3.46Å; H174-D232 WeakPolarHBondContact CB-OD1 3.28Å; H174-D232 PolarHBondContact N-OD1 3.43Å; H174-D232 PolarHBondContact N-OD2 3.19Å
175	C	82.7	Confident	88.4	Confident	31 Å²	31	30.1 Å²	30.1	21%	0.209	17%	0.173	C	C	.	.			trans	64.2	-15.2	175.2	-57.4	0	0	0	0	117.3	V173 Q201 V227 D232	V173-C175 VanDerWaalsContact CG1-SG 3.55Å; V173-C175 PolarHBondContact O-N 2.94Å; V173-C175 PolarHBondContact O-SG 3.36Å; V173-C175 VanDerWaalsContact O-SG 3.34Å; C175-Q201 PolarHBondContact SG-NE2 3.18Å; C175-V227 WeakPolarHBondContact SG-CG1 3.36Å; C175-D232 PolarHBondContact N-OD1 3.28Å
176	N	81.3	Confident	88.1	Confident	25 Å²	25	38 Å²	38	13%	0.134	21%	0.21	C	C	.	.			trans	-126	30.2	-178.4	-169.1	29	0	0	0	112.7	P51 H174 T178 T181	P51-N176 PolarHBondContact O-ND2 2.96Å; H174-N176 PolarHBondContact CE1-O 3.12Å; H174-N176 VanDerWaalsContact CE1-O 3.28Å; H174-N176 PolarHBondContact ND1-N 2.99Å; H174-N176 VanDerWaalsContact ND1-N 3.16Å; H174-N176 PolarHBondContact O-N 2.92Å; N176-T178 PolarHBondContact O-N 3.07Å; N176-T181 WeakPolarHBondContact O-CG2 3.27Å; N176-T181 PolarHBondContact O-OG1 3.48Å
177	L	89.9	Confident	87.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	22%	0.216	C	C	.	.			trans	-73.5	115.1	-173.1	-178.5	63.1	0	0	0	109.7	I158 L162 H174 L182 M192 A235 F236	I158-L177 HydrophobicContact CG2-CD1 4.48Å; I158-L177 HydrophobicContact CG2-CD2 4.45Å; L162-L177 HydrophobicContact CD1-CD2 3.92Å; L162-L177 HydrophobicContact CD2-CD2 4.42Å; H174-L177 PolarHBondContact CE1-N 3.29Å; H174-L177 WeakPolarHBondContact ND1-CA 3.46Å; H174-L177 PolarHBondContact ND1-N 2.8Å; L177-L182 HydrophobicContact CD1-CD1 4.48Å; L177-L182 HydrophobicContact CD1-CD2 3.84Å; L177-L182 HydrophobicContact CD1-CG 4.2Å; L177-M192 HydrophobicContact CD1-CG 4.18Å; L177-M192 HydrophobicContact CD1-SD 3.52Å; L177-M192 VanDerWaalsContact CD1-SD 3.52Å; L177-A235 HydrophobicContact CB-CB 3.86Å; L177-A235 HydrophobicContact CD2-CB 4.32Å; L177-A235 HydrophobicContact CG-CB 4.35Å; L177-F236 HydrophobicContact CD2-CB 3.84Å
178	T	88.7	Confident	87.4	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.031	20%	0.203	C	C	.	.	S	Bend	trans	-145	167.7	178	70.1	0	0	0	0	110.1	N176 N180 T181 L182 Y216	N176-T178 PolarHBondContact O-N 3.07Å; T178-N180 PolarHBondContact O-N 3.02Å; T178-N180 PolarHBondContact OG1-N 3.35Å; T178-N180 VanDerWaalsContact OG1-N 3.15Å; T178-T181 PolarHBondContact N-OG1 3.44Å; T178-T181 PolarHBondContact O-N 2.99Å; T178-T181 PolarHBondContact O-OG1 3.27Å; T178-T181 VanDerWaalsContact O-OG1 3.06Å; T178-T181 PolarHBondContact OG1-N 3.2Å; T178-L182 WeakPolarHBondContact O-CG 3.26Å; T178-L182 PolarHBondContact O-N 2.93Å; T178-Y216 HydrophobicContact CG2-CD1 4.44Å; T178-Y216 HydrophobicContact CG2-CD2 3.56Å; T178-Y216 HydrophobicContact CG2-CE2 3.89Å; T178-Y216 HydrophobicContact CG2-CG 3.85Å
179	C	90.6	Very high	87.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-10.4	171.2	-73.2	0	0	0	0	113.9	I132 S133 E242	I132-C179 HydrophobicContact CB-CB 4.19Å; I132-C179 HydrophobicContact CG2-CB 3.86Å; I132-C179 PolarHBondContact N-O 3.41Å; S133-C179 PolarHBondContact N-O 2.83Å; C179-E242 PolarHBondContact SG-OE2 2.9Å
180	N	87.5	Confident	88	Confident	16 Å²	16	27.5 Å²	27.5	9%	0.086	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-19	171.6	-62.4	-64	0	0	0	113.3	T131 S133 T178	T131-N180 VanDerWaalsContact CG2-O 3.26Å; T131-N180 WeakPolarHBondContact CG2-O 3.26Å; S133-N180 WeakPolarHBondContact CB-OD1 3.3Å; S133-N180 PolarHBondContact OG-OD1 3.28Å; T178-N180 PolarHBondContact O-N 3.02Å; T178-N180 PolarHBondContact OG1-N 3.35Å; T178-N180 VanDerWaalsContact OG1-N 3.15Å
181	T	89.4	Confident	88.4	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.006	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-0.3	176.1	66.1	0	0	0	0	113.1	V50 N176 T178 V193	V50-T181 HydrophobicContact CG1-CG2 4.22Å; N176-T181 WeakPolarHBondContact O-CG2 3.27Å; N176-T181 PolarHBondContact O-OG1 3.48Å; T178-T181 PolarHBondContact N-OG1 3.44Å; T178-T181 PolarHBondContact O-N 2.99Å; T178-T181 PolarHBondContact O-OG1 3.27Å; T178-T181 VanDerWaalsContact O-OG1 3.06Å; T178-T181 PolarHBondContact OG1-N 3.2Å; T181-V193 PolarHBondContact O-N 2.81Å
182	L	94.1	Very high	88.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.4	177.2	-63.3	176	0	0	0	110.1	T131 I132 I158 L177 T178 I190 M192 C239	T131-L182 CarbonylContact C-O 3.58Å; T131-L182 VanDerWaalsContact CA-O 3.23Å; T131-L182 WeakPolarHBondContact CA-O 3.4Å; I132-L182 HydrophobicContact CB-CB 4.24Å; I132-L182 HydrophobicContact CG1-CB 3.72Å; I132-L182 PolarHBondContact N-O 3.08Å; I158-L182 HydrophobicContact CD1-CD1 3.55Å; I158-L182 HydrophobicContact CD1-CD2 4.16Å; I158-L182 HydrophobicContact CD1-CG 4.44Å; I158-L182 HydrophobicContact CG1-CD1 4.21Å; I158-L182 HydrophobicContact CG1-CD2 3.84Å; I158-L182 HydrophobicContact CG2-CD2 4.21Å; L177-L182 HydrophobicContact CD1-CD1 4.48Å; L177-L182 HydrophobicContact CD1-CD2 3.84Å; L177-L182 HydrophobicContact CD1-CG 4.2Å; T178-L182 WeakPolarHBondContact O-CG 3.26Å; T178-L182 PolarHBondContact O-N 2.93Å; L182-I190 HydrophobicContact CB-CG2 4.08Å; L182-I190 HydrophobicContact CD2-CG2 4.12Å; L182-M192 HydrophobicContact CD2-CB 3.87Å; L182-M192 HydrophobicContact CD2-CG 3.95Å; L182-M192 HydrophobicContact CD2-SD 4.44Å; L182-C239 HydrophobicContact CD1-CB 4.31Å
183	F	93.8	Very high	88.8	Confident	8 Å²	8	20.7 Å²	20.7	4%	0.035	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142	-178.3	-76.4	-104	0	0	0	111.5	R48 V50 I104 M127 G130 T131 I190 K191 V193	R48-F183 HydrophobicContact CG-CZ 4.21Å; V50-F183 HydrophobicContact CG2-CE2 3.95Å; V50-F183 HydrophobicContact CG2-CZ 4.02Å; I104-F183 HydrophobicContact CD1-CB 4.07Å; I104-F183 HydrophobicContact CD1-CD2 3.67Å; I104-F183 HydrophobicContact CD1-CE2 4.29Å; I104-F183 HydrophobicContact CD1-CG 3.85Å; M127-F183 HydrophobicContact CB-CB 4.04Å; M127-F183 HydrophobicContact CB-CD1 3.41Å; M127-F183 VanDerWaalsContact CB-CD1 3.41Å; M127-F183 HydrophobicContact CB-CE1 4.16Å; M127-F183 HydrophobicContact CB-CG 3.99Å; M127-F183 HydrophobicContact CE-CB 3.72Å; M127-F183 HydrophobicContact CG-CB 3.96Å; M127-F183 HydrophobicContact CG-CD1 3.97Å; M127-F183 HydrophobicContact CG-CG 4.08Å; G130-F183 WeakPolarHBondContact O-CA 3.49Å; T131-F183 HydrophobicContact CG2-CD1 4.13Å; T131-F183 HydrophobicContact CG2-CD2 4.22Å; T131-F183 HydrophobicContact CG2-CE1 3.69Å; T131-F183 HydrophobicContact CG2-CE2 3.74Å; T131-F183 HydrophobicContact CG2-CG 4.4Å; T131-F183 HydrophobicContact CG2-CZ 3.46Å; T131-F183 VanDerWaalsContact CG2-CZ 3.46Å; F183-I190 CarbonylContact O-C 3.53Å; F183-I190 VanDerWaalsContact O-CA 3.28Å; F183-I190 WeakPolarHBondContact O-CA 3.36Å; F183-K191 PolarHBondContact N-O 2.73Å; F183-K191 PolarHBondContact O-N 3.41Å; F183-V193 HydrophobicContact CD2-CG2 3.67Å; F183-V193 HydrophobicContact CE2-CG2 3.4Å; F183-V193 HydrophobicContact CZ-CG2 4.43Å
184	I	91.8	Very high	88.4	Confident	13 Å²	13	20 Å²	20	7%	0.067	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.5	175.4	-56.3	175.3	0	0	0	108.4	S129 G130 I132 F135 W154 I190	S129-I184 VanDerWaalsContact CB-O 3.23Å; S129-I184 WeakPolarHBondContact CB-O 3.35Å; G130-I184 PolarHBondContact O-N 2.95Å; I132-I184 HydrophobicContact CD1-CD1 3.88Å; I132-I184 HydrophobicContact CD1-CG1 3.65Å; I132-I184 HydrophobicContact CG1-CG1 4.23Å; F135-I184 HydrophobicContact CB-CD1 3.42Å; F135-I184 VanDerWaalsContact CB-CD1 3.42Å; F135-I184 HydrophobicContact CD1-CD1 4.33Å; F135-I184 HydrophobicContact CD2-CD1 3.59Å; F135-I184 HydrophobicContact CE2-CD1 4.47Å; F135-I184 HydrophobicContact CG-CD1 3.5Å; W154-I184 HydrophobicContact CZ2-CD1 4.37Å; I184-I190 HydrophobicContact CB-CD1 4.31Å; I184-I190 HydrophobicContact CG1-CD1 3.76Å
185	Q	89.5	Confident	87.3	Confident	41 Å²	41	20.2 Å²	20.2	19%	0.192	11%	0.107	C	C	.	.			trans	-86.6	160.9	170.3	-69.1	-176.6	-66.8	0	0	110.7	M127 N187 G188 L189 K191	M127-Q185 HydrophobicContact CE-CB 4.46Å; M127-Q185 HydrophobicContact CE-CG 3.54Å; Q185-N187 WeakPolarHBondContact CB-OD1 3.35Å; Q185-N187 PolarHBondContact O-N 3.45Å; Q185-G188 WeakPolarHBondContact O-CA 3.07Å; Q185-G188 PolarHBondContact O-N 2.81Å; Q185-L189 WeakPolarHBondContact CB-O 3.38Å; Q185-L189 PolarHBondContact N-O 3.04Å; Q185-K191 HydrophobicContact CG-CD 4.3Å; Q185-K191 HydrophobicContact CG-CG 4.05Å
186	Q	86.2	Confident	86	Confident	166 Å²	166	19.6 Å²	19.6	78%	0.776	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.3	175.9	-67.4	178	-8.3	0	0	112.8	S128 G188	S128-Q186 PolarHBondContact OG-NE2 2.96Å; S128-Q186 VanDerWaalsContact OG-NE2 3.1Å; Q186-G188 PolarHBondContact O-N 3.36Å
187	N	83	Confident	84.6	Confident	46 Å²	46	18.4 Å²	18.4	25%	0.246	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.5	175.2	70	6	0	0	0	114.2	K153 Q185 L189 N372 I374	K153-N187 PolarHBondContact NZ-O 3.26Å; Q185-N187 WeakPolarHBondContact CB-OD1 3.35Å; Q185-N187 PolarHBondContact O-N 3.45Å; N187-L189 WeakPolarHBondContact OD1-CB 3.45Å; N187-L189 PolarHBondContact OD1-N 3.19Å; N187-N372 PolarHBondContact ND2-O 2.61Å; N187-I374 HydrophobicContact CB-CD1 4.21Å; N187-I374 HydrophobicContact CB-CG1 4.01Å
188	G	85.5	Confident	82.7	Confident	21 Å²	21	24.2 Å²	24.2	22%	0.216	13%	0.128	C	C	.	.	S	Bend	trans	78.8	9.4	178.8	0	0	0	0	0	115.8	W154 Q185 Q186	W154-G188 PolarHBondContact NE1-O 2.87Å; Q185-G188 WeakPolarHBondContact O-CA 3.07Å; Q185-G188 PolarHBondContact O-N 2.81Å; Q186-G188 PolarHBondContact O-N 3.36Å
189	L	87.5	Confident	80.7	Confident	8 Å²	8	24.2 Å²	24.2	4%	0.042	13%	0.128	C	C	.	.			trans	-85.2	169.7	168.5	-67.1	177.6	0	0	0	111.4	K153 P157 Q185 N187 G373	K153-L189 HydrophobicContact CD-CD2 4.26Å; K153-L189 VanDerWaalsContact CE-CD2 3.45Å; K153-L189 HydrophobicContact CG-CD2 3.73Å; P157-L189 HydrophobicContact CG-CD2 4.06Å; Q185-L189 WeakPolarHBondContact CB-O 3.38Å; Q185-L189 PolarHBondContact N-O 3.04Å; N187-L189 WeakPolarHBondContact OD1-CB 3.45Å; N187-L189 PolarHBondContact OD1-N 3.19Å; L189-G373 WeakPolarHBondContact CD1-O 3.45Å
190	I	94.1	Very high	78.9	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.2	-174.9	-52.7	-53.9	0	0	0	110.7	N102 I132 W154 P157 I158 L182 F183 I184	N102-I190 WeakPolarHBondContact CB-O 2.9Å; N102-I190 PolarHBondContact ND2-O 3.36Å; I132-I190 HydrophobicContact CD1-CD1 3.57Å; I132-I190 HydrophobicContact CD1-CG1 4.44Å; I132-I190 HydrophobicContact CG1-CD1 4.25Å; W154-I190 HydrophobicContact CB-CD1 4.42Å; W154-I190 HydrophobicContact CB-CG1 3.86Å; W154-I190 HydrophobicContact CD2-CD1 4.41Å; W154-I190 HydrophobicContact CG-CD1 3.97Å; W154-I190 HydrophobicContact CG-CG1 3.9Å; P157-I190 HydrophobicContact CB-CB 4.09Å; I158-I190 HydrophobicContact CD1-CG2 4.33Å; I158-I190 HydrophobicContact CG1-CB 4.38Å; I158-I190 HydrophobicContact CG1-CG2 3.89Å; L182-I190 HydrophobicContact CB-CG2 4.08Å; L182-I190 HydrophobicContact CD2-CG2 4.12Å; F183-I190 CarbonylContact O-C 3.53Å; F183-I190 VanDerWaalsContact O-CA 3.28Å; F183-I190 WeakPolarHBondContact O-CA 3.36Å; I184-I190 HydrophobicContact CB-CD1 4.31Å; I184-I190 HydrophobicContact CG1-CD1 3.76Å
191	K	93.4	Very high	77.2	Confident	25 Å²	25	24.4 Å²	24.4	11%	0.109	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.4	164.3	-75.5	-172.5	160	-170.7	0	110.1	P101 N102 I104 E125 M127 F183 Q185	P101-K191 WeakPolarHBondContact O-CE 3.35Å; N102-K191 CarbonylContact O-C 3.51Å; N102-K191 WeakPolarHBondContact O-CA 3.37Å; I104-K191 HydrophobicContact CD1-CB 4.49Å; I104-K191 HydrophobicContact CG1-CB 3.7Å; I104-K191 HydrophobicContact CG1-CD 4.41Å; E125-K191 IonicContact OE1-NZ 3.11Å; E125-K191 PolarHBondContact OE1-NZ 2.79Å; E125-K191 IonicContact OE2-NZ 2.82Å; E125-K191 PolarHBondContact OE2-NZ 3.22Å; M127-K191 HydrophobicContact CE-CB 3.89Å; M127-K191 HydrophobicContact CE-CD 3.99Å; M127-K191 HydrophobicContact CE-CG 4.17Å; M127-K191 HydrophobicContact SD-CD 3.93Å; F183-K191 PolarHBondContact N-O 2.73Å; F183-K191 PolarHBondContact O-N 3.41Å; Q185-K191 HydrophobicContact CG-CD 4.3Å; Q185-K191 HydrophobicContact CG-CG 4.05Å
192	M	93.3	Very high	75.2	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.6	178.5	179.2	173.8	69.9	0	0	110.2	N102 L103 I104 A161 L162 L165 H174 L177 L182 C194	N102-M192 PolarHBondContact O-N 3.03Å; L103-M192 CarbonylContact C-O 3.5Å; L103-M192 WeakPolarHBondContact CA-O 3.43Å; L103-M192 HydrophobicContact CD2-CB 4.12Å; L103-M192 HydrophobicContact CD2-CE 3.43Å; L103-M192 VanDerWaalsContact CD2-CE 3.43Å; L103-M192 HydrophobicContact CD2-CG 4.5Å; I104-M192 PolarHBondContact N-O 3.42Å; A161-M192 HydrophobicContact CB-CE 3.69Å; L162-M192 HydrophobicContact CD2-CE 4.04Å; L162-M192 HydrophobicContact CD2-SD 4.2Å; L162-M192 HydrophobicContact CG-CE 4.4Å; L165-M192 HydrophobicContact CD1-CE 3.62Å; H174-M192 VanDerWaalsContact CD2-SD 3.58Å; L177-M192 HydrophobicContact CD1-CG 4.18Å; L177-M192 HydrophobicContact CD1-SD 3.52Å; L177-M192 VanDerWaalsContact CD1-SD 3.52Å; L182-M192 HydrophobicContact CD2-CB 3.87Å; L182-M192 HydrophobicContact CD2-CG 3.95Å; L182-M192 HydrophobicContact CD2-SD 4.44Å; M192-C194 PolarHBondContact O-N 3.36Å
193	V	88.7	Confident	72.8	Confident	5 Å²	5	29.9 Å²	29.9	3%	0.03	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	112.7	170.6	175.9	0	0	0	0	108.6	V50 I104 H174 T181 F183 V195	V50-V193 HydrophobicContact CG1-CG1 4.37Å; V50-V193 HydrophobicContact CG2-CG2 4.46Å; I104-V193 HydrophobicContact CD1-CG2 3.55Å; I104-V193 HydrophobicContact CG1-CG2 4.3Å; H174-V193 PolarHBondContact NE2-O 3.46Å; T181-V193 PolarHBondContact O-N 2.81Å; F183-V193 HydrophobicContact CD2-CG2 3.67Å; F183-V193 HydrophobicContact CE2-CG2 3.4Å; F183-V193 HydrophobicContact CZ-CG2 4.43Å; V193-V195 HydrophobicContact CG1-CG2 3.67Å; V193-V195 PolarHBondContact O-N 2.9Å
194	C	78.1	Confident	70.6	Confident	5 Å²	5	31 Å²	31	3%	0.034	16%	0.161	C	C	.	.			trans	-90.3	98	172.8	-162.6	0	0	0	0	110	L95 L98 L103 M192 T196	L95-C194 HydrophobicContact CD2-CB 4.33Å; L98-C194 HydrophobicContact CD1-CB 4.13Å; L103-C194 HydrophobicContact CD2-CB 4.2Å; M192-C194 PolarHBondContact O-N 3.36Å; C194-T196 WeakPolarHBondContact SG-CG2 3.39Å
195	V	64	Low	68.5	Low	4 Å²	4	37 Å²	37	2%	0.024	18%	0.183	C	C	.	.			trans	-119.7	82.2	166.5	179.1	0	0	0	0	105.8	F122 V193 P197 M200	F122-V195 HydrophobicContact CE2-CG2 4.18Å; F122-V195 HydrophobicContact CZ-CG2 4.03Å; V193-V195 HydrophobicContact CG1-CG2 3.67Å; V193-V195 PolarHBondContact O-N 2.9Å; V195-P197 WeakPolarHBondContact O-CD 3.35Å; V195-P197 WeakPolarHBondContact O-CG 3.47Å; V195-M200 HydrophobicContact CG1-CE 3.8Å; V195-M200 HydrophobicContact CG1-SD 3.66Å
196	T	56.5	Low	66.2	Low	18 Å²	18	41.6 Å²	41.6	11%	0.11	21%	0.205	C	C	.	.			trans	-85.9	115.5	-178.7	56.6	0	0	0	0	108.8	V91 I172 V173 C194	V91-T196 WeakPolarHBondContact CG1-O 3.36Å; I172-T196 HydrophobicContact CG2-CG2 3.43Å; I172-T196 VanDerWaalsContact CG2-CG2 3.43Å; V173-T196 WeakPolarHBondContact O-CG2 3.2Å; C194-T196 WeakPolarHBondContact SG-CG2 3.39Å
197	P	51.8	Low	64.2	Low	1 Å²	1	35.8 Å²	35.8	1%	0.006	18%	0.182	C	C	.	.			trans	-123.3	83.1	-170.7	27	-5.8	0	0	0	110.8	V195 A199 M200 Q201 I204	V195-P197 WeakPolarHBondContact O-CD 3.35Å; V195-P197 WeakPolarHBondContact O-CG 3.47Å; P197-A199 PolarHBondContact O-N 3.16Å; P197-M200 VanDerWaalsContact CB-CA 3.47Å; P197-M200 HydrophobicContact CB-CB 3.21Å; P197-M200 HydrophobicContact CB-CG 3.61Å; P197-M200 HydrophobicContact CB-SD 4.04Å; P197-M200 HydrophobicContact CG-CB 4.21Å; P197-Q201 HydrophobicContact CB-CG 4.47Å; P197-Q201 HydrophobicContact CG-CG 4Å; P197-Q201 WeakPolarHBondContact O-CA 3.39Å; P197-Q201 WeakPolarHBondContact O-CB 3.24Å; P197-Q201 WeakPolarHBondContact O-CG 3.39Å; P197-Q201 PolarHBondContact O-N 3.06Å; P197-Q201 PolarHBondContact O-NE2 2.68Å; P197-Q201 VanDerWaalsContact O-NE2 3.1Å; P197-I204 HydrophobicContact CB-CD1 4.13Å; P197-I204 HydrophobicContact CG-CD1 3.35Å; P197-I204 HydrophobicContact CG-CG1 4.46Å
198	D	50.1	Low	62.3	Low	124 Å²	124	44 Å²	44	66%	0.663	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-30.7	159.8	-74.6	-18.9	0	0	0	109.9
199	A	45.3	Very low	60.7	Low	5 Å²	5	50.1 Å²	50.1	4%	0.041	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-37.5	172.7	0	0	0	0	0	113.9	G87 V88 V91 P197	G87-A199 VanDerWaalsContact C-CB 3.47Å; V88-A199 HydrophobicContact CG2-CB 3.96Å; V91-A199 HydrophobicContact CG2-CB 3.94Å; P197-A199 PolarHBondContact O-N 3.16Å
200	M	52.7	Low	59.1	Low	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.3	177.4	-31.1	162.8	36.2	0	0	113.4	G52 V73 F92 V195 P197 L202 Y203 I204	G52-M200 WeakPolarHBondContact O-CE 3.32Å; V73-M200 HydrophobicContact CB-CE 4.34Å; V73-M200 HydrophobicContact CG1-CE 3.89Å; V73-M200 HydrophobicContact CG2-CE 3.66Å; F92-M200 HydrophobicContact CE2-SD 4.05Å; F92-M200 HydrophobicContact CZ-SD 4.11Å; V195-M200 HydrophobicContact CG1-CE 3.8Å; V195-M200 HydrophobicContact CG1-SD 3.66Å; P197-M200 VanDerWaalsContact CB-CA 3.47Å; P197-M200 HydrophobicContact CB-CB 3.21Å; P197-M200 HydrophobicContact CB-CG 3.61Å; P197-M200 HydrophobicContact CB-SD 4.04Å; P197-M200 HydrophobicContact CG-CB 4.21Å; M200-L202 PolarHBondContact O-N 3.23Å; M200-Y203 CarbonylContact O-C 3.54Å; M200-Y203 WeakPolarHBondContact O-CA 3.44Å; M200-Y203 PolarHBondContact O-N 2.85Å; M200-I204 HydrophobicContact CB-CD1 4.36Å; M200-I204 HydrophobicContact CB-CG1 4.24Å; M200-I204 HydrophobicContact CE-CD1 4.21Å; M200-I204 HydrophobicContact CE-CG1 4.4Å; M200-I204 WeakPolarHBondContact O-CG1 3.38Å; M200-I204 PolarHBondContact O-N 3.1Å
201	Q	52.5	Low	57.2	Low	19 Å²	19	56 Å²	56	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-29	-177.2	-94	169.9	68.8	0	0	110.8	C175 P197 Y203 R205 Y221	C175-Q201 PolarHBondContact SG-NE2 3.18Å; P197-Q201 HydrophobicContact CB-CG 4.47Å; P197-Q201 HydrophobicContact CG-CG 4Å; P197-Q201 WeakPolarHBondContact O-CA 3.39Å; P197-Q201 WeakPolarHBondContact O-CB 3.24Å; P197-Q201 WeakPolarHBondContact O-CG 3.39Å; P197-Q201 PolarHBondContact O-N 3.06Å; P197-Q201 PolarHBondContact O-NE2 2.68Å; P197-Q201 VanDerWaalsContact O-NE2 3.1Å; Q201-Y203 PolarHBondContact O-N 3.03Å; Q201-R205 VanDerWaalsContact O-CB 3.25Å; Q201-R205 WeakPolarHBondContact O-CB 3.47Å; Q201-R205 WeakPolarHBondContact O-CD 3.37Å; Q201-R205 WeakPolarHBondContact O-CG 3.27Å; Q201-R205 PolarHBondContact O-N 2.81Å; Q201-Y221 PolarHBondContact OE1-OH 2.9Å
202	L	47.3	Very low	55.4	Low	91 Å²	91	62.8 Å²	62.8	48%	0.476	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-29.5	171.3	-69	175.1	0	0	0	112.6	M200	M200-L202 PolarHBondContact O-N 3.23Å
203	Y	44	Very low	54.2	Low	25 Å²	25	64.6 Å²	64.6	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-94	-36.5	178.6	-67.1	-82	0	0	0	113.3	F75 K80 F81 E84 M200 Q201 R205 Q206 S207	F75-Y203 HydrophobicContact CB-CE1 4.38Å; F75-Y203 AromaticContact CD1-CD1 3.64Å; F75-Y203 HydrophobicContact CD1-CD1 3.64Å; F75-Y203 AromaticContact CD1-CD2 3.68Å; F75-Y203 HydrophobicContact CD1-CD2 3.68Å; F75-Y203 AromaticContact CD1-CE1 3.44Å; F75-Y203 HydrophobicContact CD1-CE1 3.44Å; F75-Y203 VanDerWaalsContact CD1-CE1 3.44Å; F75-Y203 AromaticContact CD1-CE2 3.48Å; F75-Y203 HydrophobicContact CD1-CE2 3.48Å; F75-Y203 VanDerWaalsContact CD1-CE2 3.48Å; F75-Y203 AromaticContact CD1-CG 3.74Å; F75-Y203 HydrophobicContact CD1-CG 3.74Å; F75-Y203 AromaticContact CD1-CZ 3.34Å; F75-Y203 HydrophobicContact CE1-CD1 4.1Å; F75-Y203 AromaticContact CE1-CD2 3.33Å; F75-Y203 HydrophobicContact CE1-CD2 3.33Å; F75-Y203 HydrophobicContact CE1-CE1 4.16Å; F75-Y203 AromaticContact CE1-CE2 3.39Å; F75-Y203 HydrophobicContact CE1-CE2 3.39Å; F75-Y203 AromaticContact CE1-CG 3.69Å; F75-Y203 HydrophobicContact CE1-CG 3.69Å; F75-Y203 AromaticContact CE1-CZ 3.81Å; F75-Y203 HydrophobicContact CG-CD1 4.47Å; F75-Y203 HydrophobicContact CG-CE1 4.33Å; F75-Y203 HydrophobicContact CZ-CD2 4.44Å; K80-Y203 WeakPolarHBondContact CB-OH 3.39Å; K80-Y203 PolarHBondContact O-OH 3.35Å; F81-Y203 PolarHBondContact N-OH 3.28Å; E84-Y203 HydrophobicContact CG-CE2 4.42Å; M200-Y203 CarbonylContact O-C 3.54Å; M200-Y203 WeakPolarHBondContact O-CA 3.44Å; M200-Y203 PolarHBondContact O-N 2.85Å; Q201-Y203 PolarHBondContact O-N 3.03Å; Y203-R205 VanDerWaalsContact C-N 3.31Å; Y203-R205 PolarHBondContact O-N 3.49Å; Y203-Q206 PolarHBondContact O-N 3.31Å; Y203-Q206 VanDerWaalsContact O-N 3.1Å; Y203-S207 PolarHBondContact O-N 2.87Å
204	I	47.5	Very low	53.6	Low	30 Å²	30	66.7 Å²	66.7	15%	0.154	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-36.4	173.5	-59.5	-176.4	0	0	0	110.7	P197 M200 Q206 S207	P197-I204 HydrophobicContact CB-CD1 4.13Å; P197-I204 HydrophobicContact CG-CD1 3.35Å; P197-I204 HydrophobicContact CG-CG1 4.46Å; M200-I204 HydrophobicContact CB-CD1 4.36Å; M200-I204 HydrophobicContact CB-CG1 4.24Å; M200-I204 HydrophobicContact CE-CD1 4.21Å; M200-I204 HydrophobicContact CE-CG1 4.4Å; M200-I204 WeakPolarHBondContact O-CG1 3.38Å; M200-I204 PolarHBondContact O-N 3.1Å; I204-Q206 PolarHBondContact O-N 2.72Å; I204-S207 PolarHBondContact O-N 2.96Å
205	R	48.2	Very low	53.8	Low	139 Å²	139	67.2 Å²	67.2	53%	0.525	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-32.8	173.2	-78.5	174.9	-175.5	-171.4	3.6	112.4	Q201 Y203 Y221	Q201-R205 VanDerWaalsContact O-CB 3.25Å; Q201-R205 WeakPolarHBondContact O-CB 3.47Å; Q201-R205 WeakPolarHBondContact O-CD 3.37Å; Q201-R205 WeakPolarHBondContact O-CG 3.27Å; Q201-R205 PolarHBondContact O-N 2.81Å; Y203-R205 VanDerWaalsContact C-N 3.31Å; Y203-R205 PolarHBondContact O-N 3.49Å; R205-Y221 PolarHBondContact NE-OH 3Å; R205-Y221 PolarHBondContact NH2-OH 2.88Å
206	Q	41.3	Very low	54.7	Low	139 Å²	139	67.7 Å²	67.7	65%	0.65	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-28.1	177.6	-66.6	-174.6	0.3	0	0	112.5	Y203 I204 R208	Y203-Q206 PolarHBondContact O-N 3.31Å; Y203-Q206 VanDerWaalsContact O-N 3.1Å; I204-Q206 PolarHBondContact O-N 2.72Å; Q206-R208 VanDerWaalsContact C-N 3.31Å; Q206-R208 PolarHBondContact O-N 3.39Å
207	S	43.2	Very low	55.9	Low	43 Å²	43	69.4 Å²	69.4	30%	0.301	33%	0.325	S	S	.	.	S	Bend	trans	-84.7	7.3	-169.6	80.2	0	0	0	0	116.1	Y203 I204	Y203-S207 PolarHBondContact O-N 2.87Å; I204-S207 PolarHBondContact O-N 2.96Å
208	R	44.2	Very low	57.6	Low	219 Å²	219	69.3 Å²	69.3	83%	0.826	33%	0.325	S	S	*	.			trans	142.2	104	154.4	-76.8	150.5	-171.5	-168.2	1.7	108.7	Q206 N210	Q206-R208 VanDerWaalsContact C-N 3.31Å; Q206-R208 PolarHBondContact O-N 3.39Å; R208-N210 PolarHBondContact O-N 3.49Å
209	E	50.2	Low	59.3	Low	149 Å²	149	65.3 Å²	65.3	70%	0.696	31%	0.305	S	S	*	.			trans	-59.7	80.2	145.7	-70.6	-178.2	173.7	0	0	107.1	P211	E209-P211 WeakPolarHBondContact O-CD 3.5Å; E209-P211 VanDerWaalsContact O-N 3.12Å
210	N	54.1	Low	61.2	Low	66 Å²	66	65.5 Å²	65.5	35%	0.353	31%	0.305	S	S	.	.			trans	-66.9	112.4	167.1	-166.1	-17.9	0	0	0	103.9	R208 R212 N213	R208-N210 PolarHBondContact O-N 3.49Å; N210-R212 PolarHBondContact O-N 2.71Å; N210-N213 PolarHBondContact O-N 3.29Å
211	P	54.2	Low	62.5	Low	68 Å²	68	67.7 Å²	67.7	44%	0.442	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-54.2	-23.2	-174.2	20.3	-32.9	0	0	0	111.7	E209 N213 L214	E209-P211 WeakPolarHBondContact O-CD 3.5Å; E209-P211 VanDerWaalsContact O-N 3.12Å; P211-N213 VanDerWaalsContact C-N 3.31Å; P211-N213 PolarHBondContact O-N 3.03Å; P211-L214 HydrophobicContact CB-CD1 4.38Å; P211-L214 PolarHBondContact O-N 3.01Å
212	R	55.6	Low	63.5	Low	166 Å²	166	72.8 Å²	72.8	63%	0.626	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-61.7	-26.1	174.4	-63.6	-175.3	175.8	-179.4	1.1	115	N210 H215	N210-R212 PolarHBondContact O-N 2.71Å; R212-H215 PolarHBondContact O-CE1 2.87Å; R212-H215 PolarHBondContact O-ND1 2.82Å
213	N	69.6	Low	64.9	Low	39 Å²	39	74.3 Å²	74.3	21%	0.209	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-103.2	-1.7	-176.3	-66.8	-12.9	0	0	0	113.6	N210 P211 H215 Y216	N210-N213 PolarHBondContact O-N 3.29Å; P211-N213 VanDerWaalsContact C-N 3.31Å; P211-N213 PolarHBondContact O-N 3.03Å; N213-H215 PolarHBondContact O-N 3.24Å; N213-H215 VanDerWaalsContact O-N 3.14Å; N213-Y216 HydrophobicContact CB-CD2 4.25Å; N213-Y216 WeakPolarHBondContact O-CD2 3.42Å; N213-Y216 PolarHBondContact O-N 3.04Å
214	L	75.8	Confident	66.2	Low	50 Å²	50	76.5 Å²	76.5	26%	0.262	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-60.7	-26.8	-177.8	-66.1	175.3	0	0	0	113	P211 Y216 I217	P211-L214 HydrophobicContact CB-CD1 4.38Å; P211-L214 PolarHBondContact O-N 3.01Å; L214-Y216 VanDerWaalsContact C-N 3.25Å; L214-Y216 PolarHBondContact O-N 3.24Å; L214-I217 HydrophobicContact CD2-CD1 3.86Å; L214-I217 WeakPolarHBondContact O-CB 3.49Å; L214-I217 PolarHBondContact O-N 3.18Å
215	H	80.9	Confident	67.5	Low	16 Å²	16	79.8 Å²	79.8	7%	0.074	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-72	-14.1	-178.1	68.3	-79.2	0	0	0	114.4	R212 N213 I217 Y234 V238 F248 V258	R212-H215 PolarHBondContact O-CE1 2.87Å; R212-H215 PolarHBondContact O-ND1 2.82Å; N213-H215 PolarHBondContact O-N 3.24Å; N213-H215 VanDerWaalsContact O-N 3.14Å; H215-I217 VanDerWaalsContact C-N 3.33Å; H215-Y234 WeakPolarHBondContact O-CE1 3.26Å; H215-V238 WeakPolarHBondContact CD2-CG1 3.02Å; H215-V238 WeakPolarHBondContact O-CG2 3.23Å; H215-F248 AromaticContact CD2-CE2 3.6Å; H215-F248 AromaticContact NE2-CD2 3.73Å; H215-F248 AromaticContact NE2-CE2 3.28Å; H215-F248 VanDerWaalsContact NE2-CE2 3.28Å; H215-F248 WeakPolarHBondContact NE2-CE2 3.29Å; H215-V258 HydrophobicContact CB-CB 3.63Å; H215-V258 HydrophobicContact CB-CG1 3.98Å; H215-V258 WeakPolarHBondContact CB-O 3.33Å
216	Y	83.2	Confident	68.9	Low	13 Å²	13	78.5 Å²	78.5	5%	0.051	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-82.4	-14.6	169.2	-58.3	-80.1	0	0	0	112.4	T178 N213 L214 A218 Y234 A235 V238 C239 E242	T178-Y216 HydrophobicContact CG2-CD1 4.44Å; T178-Y216 HydrophobicContact CG2-CD2 3.56Å; T178-Y216 HydrophobicContact CG2-CE2 3.89Å; T178-Y216 HydrophobicContact CG2-CG 3.85Å; N213-Y216 HydrophobicContact CB-CD2 4.25Å; N213-Y216 WeakPolarHBondContact O-CD2 3.42Å; N213-Y216 PolarHBondContact O-N 3.04Å; L214-Y216 VanDerWaalsContact C-N 3.25Å; L214-Y216 PolarHBondContact O-N 3.24Å; Y216-A218 PolarHBondContact O-N 2.9Å; Y216-Y234 WeakPolarHBondContact O-CD1 3.47Å; Y216-A235 WeakPolarHBondContact O-CB 3.4Å; Y216-V238 HydrophobicContact CD1-CB 3.9Å; Y216-V238 HydrophobicContact CD1-CG1 3.48Å; Y216-V238 VanDerWaalsContact CD1-CG1 3.48Å; Y216-V238 HydrophobicContact CE1-CB 4.41Å; Y216-V238 HydrophobicContact CE1-CG1 3.73Å; Y216-V238 HydrophobicContact CG-CG1 4.23Å; Y216-C239 VanDerWaalsContact CE1-SG 3.56Å; Y216-E242 PolarHBondContact OH-OE2 2.96Å
217	I	83.4	Confident	70.9	Confident	54 Å²	54	74.3 Å²	74.3	28%	0.277	38%	0.379	S	S	.	.	S	Bend	trans	-80.4	122.2	-175.7	-55.8	178.7	0	0	0	109.2	L214 H215 Y221 H222 Y234	L214-I217 HydrophobicContact CD2-CD1 3.86Å; L214-I217 WeakPolarHBondContact O-CB 3.49Å; L214-I217 PolarHBondContact O-N 3.18Å; H215-I217 VanDerWaalsContact C-N 3.33Å; I217-Y221 HydrophobicContact CG2-CD1 3.69Å; I217-Y221 HydrophobicContact CG2-CG 3.9Å; I217-H222 WeakPolarHBondContact CG2-CE1 3.42Å; I217-Y234 WeakPolarHBondContact O-CE1 3.25Å
218	A	86.5	Confident	73	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.379	C	S	.	.			trans	-61.5	143.8	179.1	0	0	0	0	0	111.9	Y216 E220 Y221 I231 Y234	Y216-A218 PolarHBondContact O-N 2.9Å; A218-E220 WeakPolarHBondContact CB-OE1 3.34Å; A218-E220 WeakPolarHBondContact CB-OE2 3.47Å; A218-E220 PolarHBondContact O-N 2.8Å; A218-Y221 VanDerWaalsContact O-CB 3.25Å; A218-Y221 WeakPolarHBondContact O-CB 3.47Å; A218-Y221 PolarHBondContact O-N 3.34Å; A218-I231 HydrophobicContact CB-CB 4.31Å; A218-I231 HydrophobicContact CB-CG1 4.14Å; A218-I231 HydrophobicContact CB-CG2 4.16Å; A218-Y234 VanDerWaalsContact CA-CD1 3.48Å; A218-Y234 HydrophobicContact CB-CD1 3.94Å; A218-Y234 HydrophobicContact CB-CG 3.86Å
219	P	86.1	Confident	75.3	Confident	40 Å²	40	65.2 Å²	65.2	26%	0.26	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-33	-174.4	22.3	-33.6	0	0	0	113.4	Y221	P219-Y221 VanDerWaalsContact C-N 3.3Å; P219-Y221 PolarHBondContact O-N 2.95Å
220	E	85.2	Confident	77.5	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.037	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.8	178.7	70.6	-81.1	-170.1	0	0	114.3	A218 H222 Q223 K225 I231 P287 R290	A218-E220 WeakPolarHBondContact CB-OE1 3.34Å; A218-E220 WeakPolarHBondContact CB-OE2 3.47Å; A218-E220 PolarHBondContact O-N 2.8Å; E220-H222 VanDerWaalsContact C-N 3.27Å; E220-H222 PolarHBondContact O-N 2.86Å; E220-Q223 WeakPolarHBondContact O-CB 3.45Å; E220-Q223 PolarHBondContact O-N 2.84Å; E220-K225 HydrophobicContact CB-CB 4.49Å; E220-K225 HydrophobicContact CB-CD 4.06Å; E220-I231 HydrophobicContact CG-CG1 4.45Å; E220-I231 WeakPolarHBondContact OE1-CG1 3.12Å; E220-P287 HydrophobicContact CB-CG 4.48Å; E220-P287 HydrophobicContact CG-CB 4.36Å; E220-P287 HydrophobicContact CG-CG 4.19Å; E220-R290 IonicContact OE1-CZ 3.69Å; E220-R290 IonicContact OE1-NH1 3.18Å; E220-R290 PolarHBondContact OE1-NH1 2.81Å; E220-R290 IonicContact OE1-NH2 3.97Å; E220-R290 IonicContact OE2-CZ 3.17Å; E220-R290 IonicContact OE2-NH1 3.81Å; E220-R290 PolarHBondContact OE2-NH1 2.71Å; E220-R290 IonicContact OE2-NH2 3.93Å; E220-R290 PolarHBondContact OE2-NH2 3.4Å
221	Y	79.8	Confident	79.3	Confident	47 Å²	47	57.1 Å²	57.1	18%	0.184	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-61.9	-39.7	177.1	-168.3	-95.3	0	0	0	110.7	Q201 R205 I217 A218 P219 Q223 G224 V227 I231	Q201-Y221 PolarHBondContact OE1-OH 2.9Å; R205-Y221 PolarHBondContact NE-OH 3Å; R205-Y221 PolarHBondContact NH2-OH 2.88Å; I217-Y221 HydrophobicContact CG2-CD1 3.69Å; I217-Y221 HydrophobicContact CG2-CG 3.9Å; A218-Y221 VanDerWaalsContact O-CB 3.25Å; A218-Y221 WeakPolarHBondContact O-CB 3.47Å; A218-Y221 PolarHBondContact O-N 3.34Å; P219-Y221 VanDerWaalsContact C-N 3.3Å; P219-Y221 PolarHBondContact O-N 2.95Å; Y221-Q223 PolarHBondContact O-N 3.48Å; Y221-G224 PolarHBondContact O-N 3.04Å; Y221-V227 HydrophobicContact CD2-CG2 4.44Å; Y221-V227 HydrophobicContact CE2-CG2 3.92Å; Y221-I231 HydrophobicContact CD2-CD1 3.95Å
222	H	73.8	Confident	81.1	Confident	127 Å²	127	53.9 Å²	53.9	59%	0.588	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-71.5	-17.8	175.9	-58.2	95.7	0	0	0	113.4	I217 E220 G224	I217-H222 WeakPolarHBondContact CG2-CE1 3.42Å; E220-H222 VanDerWaalsContact C-N 3.27Å; E220-H222 PolarHBondContact O-N 2.86Å; H222-G224 PolarHBondContact O-N 2.95Å
223	Q	76.2	Confident	83.1	Confident	123 Å²	123	46.1 Å²	46.1	58%	0.575	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-84.6	2.3	-179.5	-61.2	171.2	9.5	0	0	112.5	E220 Y221 K225	E220-Q223 WeakPolarHBondContact O-CB 3.45Å; E220-Q223 PolarHBondContact O-N 2.84Å; Y221-Q223 PolarHBondContact O-N 3.48Å; Q223-K225 HydrophobicContact CB-CG 4.37Å; Q223-K225 PolarHBondContact O-N 3.18Å
224	G	70.7	Confident	84.4	Confident	70 Å²	70	44.9 Å²	44.9	72%	0.722	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	17.1	-178.5	0	0	0	0	0	113.9	Y221 H222	Y221-G224 PolarHBondContact O-N 3.04Å; H222-G224 PolarHBondContact O-N 2.95Å
225	K	76.1	Confident	85.2	Confident	100 Å²	100	42.8 Å²	42.8	44%	0.435	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-67.8	151.9	172.9	-68.8	-164.8	-168.3	163.4	0	110.1	E220 Q223	E220-K225 HydrophobicContact CB-CB 4.49Å; E220-K225 HydrophobicContact CB-CD 4.06Å; Q223-K225 HydrophobicContact CB-CG 4.37Å; Q223-K225 PolarHBondContact O-N 3.18Å
226	P	77.8	Confident	86	Confident	111 Å²	111	42 Å²	42	72%	0.721	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-58.7	142.7	177.2	24.7	-34.2	0	0	0	110.8	A228	P226-A228 PolarHBondContact O-N 3.17Å
227	V	81.8	Confident	86.7	Confident	52 Å²	52	41.4 Å²	41.4	32%	0.315	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-64.8	123.6	175.4	176.3	0	0	0	0	108.8	V173 C175 Y221 I231	V173-V227 HydrophobicContact CB-CG1 3.88Å; V173-V227 HydrophobicContact CG1-CG1 3.82Å; V173-V227 HydrophobicContact CG2-CG1 4.2Å; C175-V227 WeakPolarHBondContact SG-CG1 3.36Å; Y221-V227 HydrophobicContact CD2-CG2 4.44Å; Y221-V227 HydrophobicContact CE2-CG2 3.92Å; V227-I231 HydrophobicContact CB-CD1 4.31Å; V227-I231 HydrophobicContact CG1-CD1 4.1Å; V227-I231 HydrophobicContact CG2-CD1 4.48Å
228	A	88.4	Confident	87.2	Confident	36 Å²	36	38.8 Å²	38.8	30%	0.298	23%	0.226	S	C	.	.			trans	-142.6	159.7	-176.3	0	0	0	0	0	110.7	P226 P230 I231	P226-A228 PolarHBondContact O-N 3.17Å; A228-P230 VanDerWaalsContact C-N 3.29Å; A228-P230 WeakPolarHBondContact O-CD 3.47Å; A228-I231 WeakPolarHBondContact O-CB 3.47Å; A228-I231 PolarHBondContact O-N 2.79Å; A228-I231 VanDerWaalsContact O-N 3.08Å
229	P	92.8	Very high	87.6	Confident	34 Å²	34	38.8 Å²	38.8	22%	0.221	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-36.2	-179.6	-33.1	38.1	0	0	0	117.1	H166 P171 V173 I231 D232 I233	H166-P229 HydrophobicContact CB-CB 4.41Å; H166-P229 PolarHBondContact CE1-O 3.17Å; P171-P229 HydrophobicContact CB-CG 3.78Å; P171-P229 HydrophobicContact CG-CG 4.3Å; V173-P229 HydrophobicContact CG2-CG 4.26Å; P229-I231 PolarHBondContact O-N 2.86Å; P229-I231 VanDerWaalsContact O-N 3.08Å; P229-D232 PolarHBondContact O-N 3.15Å; P229-D232 VanDerWaalsContact O-N 3.09Å; P229-I233 PolarHBondContact O-N 3.04Å
230	P	95.1	Very high	88	Confident	36 Å²	36	36.9 Å²	36.9	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-19.3	179.2	-27.2	37.3	0	0	0	115.6	A228 I233 Y234 P287 R290	A228-P230 VanDerWaalsContact C-N 3.29Å; A228-P230 WeakPolarHBondContact O-CD 3.47Å; P230-I233 PolarHBondContact O-N 3.06Å; P230-Y234 PolarHBondContact O-N 3.45Å; P230-Y234 VanDerWaalsContact O-N 3.15Å; P230-P287 HydrophobicContact CB-CB 3.79Å; P230-P287 HydrophobicContact CG-CB 4.39Å; P230-R290 PolarHBondContact O-NH1 3.33Å
231	I	92	Very high	88.4	Confident	9 Å²	9	36.5 Å²	36.5	5%	0.046	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-45.1	174.6	-69.5	162.2	0	0	0	110.2	A218 E220 Y221 V227 A228 P229 I233 Y234 A235	A218-I231 HydrophobicContact CB-CB 4.31Å; A218-I231 HydrophobicContact CB-CG1 4.14Å; A218-I231 HydrophobicContact CB-CG2 4.16Å; E220-I231 HydrophobicContact CG-CG1 4.45Å; E220-I231 WeakPolarHBondContact OE1-CG1 3.12Å; Y221-I231 HydrophobicContact CD2-CD1 3.95Å; V227-I231 HydrophobicContact CB-CD1 4.31Å; V227-I231 HydrophobicContact CG1-CD1 4.1Å; V227-I231 HydrophobicContact CG2-CD1 4.48Å; A228-I231 WeakPolarHBondContact O-CB 3.47Å; A228-I231 PolarHBondContact O-N 2.79Å; A228-I231 VanDerWaalsContact O-N 3.08Å; P229-I231 PolarHBondContact O-N 2.86Å; P229-I231 VanDerWaalsContact O-N 3.08Å; I231-I233 VanDerWaalsContact C-N 3.25Å; I231-I233 PolarHBondContact O-N 3.24Å; I231-Y234 WeakPolarHBondContact O-CB 3.45Å; I231-Y234 PolarHBondContact O-N 3.03Å; I231-A235 PolarHBondContact O-N 3.43Å; I231-A235 VanDerWaalsContact O-N 3.13Å
232	D	93.6	Very high	89	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-32.3	177.4	-65.3	-25.1	0	0	0	111.5	L162 H166 V173 H174 C175 P229 A235 F236	L162-D232 HydrophobicContact CD1-CB 4.4Å; L162-D232 HydrophobicContact CD2-CB 3.81Å; H166-D232 IonicContact CD2-OD2 2.83Å; H166-D232 IonicContact CE1-OD2 2.78Å; H166-D232 IonicContact NE2-OD2 3.26Å; H166-D232 PolarHBondContact NE2-OD2 2.88Å; V173-D232 WeakPolarHBondContact CA-OD2 3.4Å; V173-D232 WeakPolarHBondContact CG1-OD2 3.39Å; H174-D232 WeakPolarHBondContact CB-OD1 3.28Å; H174-D232 PolarHBondContact N-OD1 3.43Å; H174-D232 PolarHBondContact N-OD2 3.19Å; C175-D232 PolarHBondContact N-OD1 3.28Å; P229-D232 PolarHBondContact O-N 3.15Å; P229-D232 VanDerWaalsContact O-N 3.09Å; D232-A235 PolarHBondContact O-N 3.02Å; D232-F236 VanDerWaalsContact O-CB 3.28Å; D232-F236 WeakPolarHBondContact O-CB 3.47Å; D232-F236 PolarHBondContact O-N 3.13Å
233	I	97.3	Very high	89.8	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.015	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-40.4	177.1	-56.8	-56.2	0	0	0	111.3	P229 P230 I231 F236 G237 C282 R290 P291 A293 L296	P229-I233 PolarHBondContact O-N 3.04Å; P230-I233 PolarHBondContact O-N 3.06Å; I231-I233 VanDerWaalsContact C-N 3.25Å; I231-I233 PolarHBondContact O-N 3.24Å; I233-F236 PolarHBondContact O-N 3.1Å; I233-G237 PolarHBondContact O-N 3.31Å; I233-C282 HydrophobicContact CG2-CB 4.17Å; I233-C282 WeakPolarHBondContact O-CB 3.43Å; I233-R290 HydrophobicContact CG2-CB 4.06Å; I233-P291 WeakPolarHBondContact CG2-O 3.42Å; I233-A293 HydrophobicContact CD1-CB 3.98Å; I233-L296 HydrophobicContact CD1-CD1 4.25Å; I233-L296 HydrophobicContact CG2-CD1 3.92Å
234	Y	95.7	Very high	90.5	Very high	14 Å²	14	23.6 Å²	23.6	6%	0.055	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-51.4	173.4	-179.2	-88.8	0	0	0	111	H215 Y216 I217 A218 P230 I231 F236 G237 V238 V283	H215-Y234 WeakPolarHBondContact O-CE1 3.26Å; Y216-Y234 WeakPolarHBondContact O-CD1 3.47Å; I217-Y234 WeakPolarHBondContact O-CE1 3.25Å; A218-Y234 VanDerWaalsContact CA-CD1 3.48Å; A218-Y234 HydrophobicContact CB-CD1 3.94Å; A218-Y234 HydrophobicContact CB-CG 3.86Å; P230-Y234 PolarHBondContact O-N 3.45Å; P230-Y234 VanDerWaalsContact O-N 3.15Å; I231-Y234 WeakPolarHBondContact O-CB 3.45Å; I231-Y234 PolarHBondContact O-N 3.03Å; Y234-F236 VanDerWaalsContact C-N 3.26Å; Y234-F236 PolarHBondContact O-N 3.11Å; Y234-G237 WeakPolarHBondContact O-CA 3.49Å; Y234-G237 PolarHBondContact O-N 3.31Å; Y234-V238 HydrophobicContact CD1-CG2 4.17Å; Y234-V238 HydrophobicContact CE1-CG2 3.8Å; Y234-V238 WeakPolarHBondContact O-CG2 3.24Å; Y234-V238 PolarHBondContact O-N 3.35Å; Y234-V283 HydrophobicContact CD2-CB 4.27Å; Y234-V283 HydrophobicContact CE2-CB 4.04Å; Y234-V283 HydrophobicContact CE2-CG1 4.44Å
235	A	93.8	Very high	91.3	Very high	5 Å²	5	21.8 Å²	21.8	4%	0.041	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-38.5	178.8	0	0	0	0	0	112.1	L177 Y216 I231 D232 V238 C239	L177-A235 HydrophobicContact CB-CB 3.86Å; L177-A235 HydrophobicContact CD2-CB 4.32Å; L177-A235 HydrophobicContact CG-CB 4.35Å; Y216-A235 WeakPolarHBondContact O-CB 3.4Å; I231-A235 PolarHBondContact O-N 3.43Å; I231-A235 VanDerWaalsContact O-N 3.13Å; D232-A235 PolarHBondContact O-N 3.02Å; A235-V238 PolarHBondContact O-N 3.11Å; A235-C239 PolarHBondContact O-N 3.42Å; A235-C239 PolarHBondContact O-SG 3.47Å
236	F	97.3	Very high	91.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62	-45.7	172.4	166.2	-100.7	0	0	0	111.8	C155 I158 L159 L162 L177 D232 I233 Y234 V238 C239 A240 L278 L296	C155-F236 HydrophobicContact CB-CE2 4.16Å; C155-F236 HydrophobicContact CB-CZ 4.01Å; I158-F236 HydrophobicContact CB-CD2 4.27Å; I158-F236 HydrophobicContact CB-CE2 4.25Å; I158-F236 HydrophobicContact CG2-CD2 3.72Å; I158-F236 HydrophobicContact CG2-CE2 4.21Å; L159-F236 HydrophobicContact CD1-CE1 3.9Å; L159-F236 HydrophobicContact CD1-CE2 4.22Å; L159-F236 HydrophobicContact CD1-CZ 3.54Å; L159-F236 HydrophobicContact CD2-CD1 3.74Å; L159-F236 HydrophobicContact CD2-CD2 4.18Å; L159-F236 HydrophobicContact CD2-CE1 3.6Å; L159-F236 HydrophobicContact CD2-CE2 4.05Å; L159-F236 HydrophobicContact CD2-CG 4.04Å; L159-F236 HydrophobicContact CD2-CZ 3.77Å; L159-F236 HydrophobicContact CG-CD1 4.39Å; L159-F236 HydrophobicContact CG-CD2 4.25Å; L159-F236 HydrophobicContact CG-CE1 3.86Å; L159-F236 HydrophobicContact CG-CE2 3.7Å; L159-F236 HydrophobicContact CG-CZ 3.49Å; L159-F236 VanDerWaalsContact CG-CZ 3.49Å; L162-F236 HydrophobicContact CD1-CB 4.09Å; L177-F236 HydrophobicContact CD2-CB 3.84Å; D232-F236 VanDerWaalsContact O-CB 3.28Å; D232-F236 WeakPolarHBondContact O-CB 3.47Å; D232-F236 PolarHBondContact O-N 3.13Å; I233-F236 PolarHBondContact O-N 3.1Å; Y234-F236 VanDerWaalsContact C-N 3.26Å; Y234-F236 PolarHBondContact O-N 3.11Å; F236-V238 VanDerWaalsContact C-N 3.28Å; F236-V238 PolarHBondContact O-N 2.99Å; F236-C239 PolarHBondContact O-N 3.1Å; F236-A240 HydrophobicContact CE1-CB 4.48Å; F236-A240 HydrophobicContact CE2-CB 4.46Å; F236-A240 HydrophobicContact CZ-CB 4.23Å; F236-A240 VanDerWaalsContact O-CB 3.3Å; F236-A240 WeakPolarHBondContact O-CB 3.43Å; F236-A240 PolarHBondContact O-N 3.36Å; F236-L278 HydrophobicContact CE1-CD2 3.96Å; F236-L278 HydrophobicContact CZ-CD2 4.43Å; F236-L296 HydrophobicContact CD1-CD1 4.17Å; F236-L296 HydrophobicContact CE1-CD1 4.17Å
237	G	96.9	Very high	91.4	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-56.8	-42.6	176.6	0	0	0	0	0	112.5	I233 Y234 A240 L241 C282	I233-G237 PolarHBondContact O-N 3.31Å; Y234-G237 WeakPolarHBondContact O-CA 3.49Å; Y234-G237 PolarHBondContact O-N 3.31Å; G237-A240 PolarHBondContact O-N 3.48Å; G237-L241 PolarHBondContact O-N 3.31Å; G237-C282 VanDerWaalsContact CA-CB 3.46Å
238	V	94	Very high	90.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66	-45.4	176.1	178.2	0	0	0	0	111.5	H215 Y216 Y234 A235 F236 A240 L241 E242 F248 L263 V283	H215-V238 WeakPolarHBondContact CD2-CG1 3.02Å; H215-V238 WeakPolarHBondContact O-CG2 3.23Å; Y216-V238 HydrophobicContact CD1-CB 3.9Å; Y216-V238 HydrophobicContact CD1-CG1 3.48Å; Y216-V238 VanDerWaalsContact CD1-CG1 3.48Å; Y216-V238 HydrophobicContact CE1-CB 4.41Å; Y216-V238 HydrophobicContact CE1-CG1 3.73Å; Y216-V238 HydrophobicContact CG-CG1 4.23Å; Y234-V238 HydrophobicContact CD1-CG2 4.17Å; Y234-V238 HydrophobicContact CE1-CG2 3.8Å; Y234-V238 WeakPolarHBondContact O-CG2 3.24Å; Y234-V238 PolarHBondContact O-N 3.35Å; A235-V238 PolarHBondContact O-N 3.11Å; F236-V238 VanDerWaalsContact C-N 3.28Å; F236-V238 PolarHBondContact O-N 2.99Å; V238-A240 VanDerWaalsContact C-N 3.32Å; V238-A240 PolarHBondContact O-N 2.97Å; V238-L241 PolarHBondContact O-N 2.82Å; V238-E242 PolarHBondContact O-N 3.21Å; V238-F248 HydrophobicContact CG1-CE2 4.32Å; V238-F248 HydrophobicContact CG1-CZ 4.08Å; V238-L263 HydrophobicContact CG1-CD2 4.42Å; V238-L263 HydrophobicContact CG2-CD1 4.05Å; V238-V283 HydrophobicContact CG2-CG1 4.12Å
239	C	94.6	Very high	89.4	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.8	-42.5	173.8	-67.1	0	0	0	0	111.7	L182 Y216 A235 F236 L241 E242 M243	L182-C239 HydrophobicContact CD1-CB 4.31Å; Y216-C239 VanDerWaalsContact CE1-SG 3.56Å; A235-C239 PolarHBondContact O-N 3.42Å; A235-C239 PolarHBondContact O-SG 3.47Å; F236-C239 PolarHBondContact O-N 3.1Å; C239-L241 VanDerWaalsContact C-N 3.32Å; C239-L241 PolarHBondContact O-N 3.28Å; C239-E242 PolarHBondContact O-N 3.26Å; C239-M243 WeakPolarHBondContact O-CB 3.33Å; C239-M243 VanDerWaalsContact O-CG 3.26Å; C239-M243 WeakPolarHBondContact O-CG 3.41Å; C239-M243 PolarHBondContact O-N 3.2Å
240	A	95.9	Very high	87.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.3	-37.9	179.7	0	0	0	0	0	112	W151 F236 G237 V238 M243 A244 I279	W151-A240 HydrophobicContact CZ2-CB 4.03Å; W151-A240 PolarHBondContact NE1-O 3.12Å; F236-A240 HydrophobicContact CE1-CB 4.48Å; F236-A240 HydrophobicContact CE2-CB 4.46Å; F236-A240 HydrophobicContact CZ-CB 4.23Å; F236-A240 VanDerWaalsContact O-CB 3.3Å; F236-A240 WeakPolarHBondContact O-CB 3.43Å; F236-A240 PolarHBondContact O-N 3.36Å; G237-A240 PolarHBondContact O-N 3.48Å; V238-A240 VanDerWaalsContact C-N 3.32Å; V238-A240 PolarHBondContact O-N 2.97Å; A240-M243 HydrophobicContact CB-CE 4.36Å; A240-A244 WeakPolarHBondContact O-CB 3.49Å; A240-A244 PolarHBondContact O-N 2.9Å; A240-I279 HydrophobicContact CB-CG1 4.17Å
241	L	93.5	Very high	85.4	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-48	172.5	-174.5	60.4	0	0	0	111.5	G237 V238 C239 M243 A244 T245 F248 L263 V266 T267 L270 I279	G237-L241 PolarHBondContact O-N 3.31Å; V238-L241 PolarHBondContact O-N 2.82Å; C239-L241 VanDerWaalsContact C-N 3.32Å; C239-L241 PolarHBondContact O-N 3.28Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 3.08Å; L241-A244 WeakPolarHBondContact O-CB 3.39Å; L241-A244 PolarHBondContact O-N 3.18Å; L241-T245 HydrophobicContact CD1-CG2 4.26Å; L241-T245 PolarHBondContact O-N 3.33Å; L241-T245 PolarHBondContact O-OG1 2.93Å; L241-F248 HydrophobicContact CD2-CE1 4.01Å; L241-F248 HydrophobicContact CG-CE1 4.13Å; L241-L263 HydrophobicContact CD2-CB 4.35Å; L241-L263 HydrophobicContact CD2-CD2 3.96Å; L241-V266 HydrophobicContact CD1-CG1 3.9Å; L241-V266 HydrophobicContact CD2-CB 4.19Å; L241-V266 HydrophobicContact CD2-CG1 4.03Å; L241-V266 HydrophobicContact CG-CG1 3.98Å; L241-T267 WeakPolarHBondContact CD2-OG1 3.31Å; L241-L270 HydrophobicContact CD1-CD1 3.85Å; L241-L270 HydrophobicContact CD1-CD2 4.3Å; L241-L270 HydrophobicContact CD1-CG 4.25Å; L241-I279 HydrophobicContact CB-CD1 4.23Å; L241-I279 HydrophobicContact CB-CG2 4.07Å; L241-I279 HydrophobicContact CD1-CD1 4.09Å; L241-I279 HydrophobicContact CD1-CG2 4.32Å
242	E	90.9	Very high	83.3	Confident	19 Å²	19	23.4 Å²	23.4	9%	0.089	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-40	178.7	-163.9	-175.3	165.9	0	0	112.1	L136 C179 Y216 V238 C239 L246 G247 F248	L136-E242 HydrophobicContact CD1-CG 3.87Å; C179-E242 PolarHBondContact SG-OE2 2.9Å; Y216-E242 PolarHBondContact OH-OE2 2.96Å; V238-E242 PolarHBondContact O-N 3.21Å; C239-E242 PolarHBondContact O-N 3.26Å; E242-L246 PolarHBondContact O-N 3.28Å; E242-L246 VanDerWaalsContact O-N 3.12Å; E242-G247 PolarHBondContact O-N 3.09Å; E242-F248 HydrophobicContact CB-CD2 4.39Å; E242-F248 HydrophobicContact CB-CE2 3.68Å; E242-F248 HydrophobicContact CB-CZ 3.81Å; E242-F248 HydrophobicContact CG-CD2 3.91Å; E242-F248 HydrophobicContact CG-CE2 3.67Å; E242-F248 HydrophobicContact CG-CZ 4.24Å
243	M	92.2	Very high	81.2	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-37.4	174.2	-71.2	-175.8	-61.7	0	0	112.4	I132 W154 I158 C239 A240 L241	I132-M243 HydrophobicContact CD1-SD 4.23Å; I132-M243 HydrophobicContact CG2-CG 3.85Å; I132-M243 HydrophobicContact CG2-SD 4.23Å; W154-M243 HydrophobicContact CB-SD 3.93Å; W154-M243 HydrophobicContact CD2-SD 4.34Å; W154-M243 HydrophobicContact CE3-CB 4.11Å; W154-M243 HydrophobicContact CE3-CG 3.87Å; W154-M243 HydrophobicContact CE3-SD 3.56Å; W154-M243 VanDerWaalsContact CE3-SD 3.56Å; W154-M243 HydrophobicContact CZ3-CB 4.34Å; W154-M243 HydrophobicContact CZ3-CG 4.16Å; W154-M243 HydrophobicContact CZ3-SD 4.38Å; I158-M243 HydrophobicContact CD1-CE 3.87Å; I158-M243 HydrophobicContact CD1-SD 4.33Å; C239-M243 WeakPolarHBondContact O-CB 3.33Å; C239-M243 VanDerWaalsContact O-CG 3.26Å; C239-M243 WeakPolarHBondContact O-CG 3.41Å; C239-M243 PolarHBondContact O-N 3.2Å; A240-M243 HydrophobicContact CB-CE 4.36Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 3.08Å
244	A	91.1	Very high	79.1	Confident	6 Å²	6	33.9 Å²	33.9	5%	0.05	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-39.5	178.9	0	0	0	0	0	112.2	A240 L241 L270	A240-A244 WeakPolarHBondContact O-CB 3.49Å; A240-A244 PolarHBondContact O-N 2.9Å; L241-A244 WeakPolarHBondContact O-CB 3.39Å; L241-A244 PolarHBondContact O-N 3.18Å; A244-L270 HydrophobicContact CB-CD2 3.73Å
245	T	85.9	Confident	77.2	Confident	33 Å²	33	36.3 Å²	36.3	20%	0.202	21%	0.214	C	C	.	.	H	α-helix	trans	-95.2	3.1	-175.5	67.6	0	0	0	0	114.3	L241 G247 V266 L270	L241-T245 HydrophobicContact CD1-CG2 4.26Å; L241-T245 PolarHBondContact O-N 3.33Å; L241-T245 PolarHBondContact O-OG1 2.93Å; T245-G247 VanDerWaalsContact C-N 3.26Å; T245-G247 PolarHBondContact O-N 3.28Å; T245-G247 PolarHBondContact OG1-O 2.8Å; T245-G247 VanDerWaalsContact OG1-O 3.06Å; T245-V266 HydrophobicContact CG2-CG1 3.63Å; T245-L270 HydrophobicContact CG2-CD2 3.91Å
246	L	82.5	Confident	75.3	Confident	17 Å²	17	41 Å²	41	9%	0.089	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	36.8	-172.4	-64	179.3	0	0	0	114.1	L136 T139 K144 L146 E242	L136-L246 HydrophobicContact CD2-CD2 3.78Å; T139-L246 HydrophobicContact CG2-CD1 4.17Å; T139-L246 HydrophobicContact CG2-CD2 4.35Å; K144-L246 WeakPolarHBondContact O-CD1 3.26Å; L146-L246 HydrophobicContact CB-CD2 4.06Å; E242-L246 PolarHBondContact O-N 3.28Å; E242-L246 VanDerWaalsContact O-N 3.12Å
247	G	73.4	Confident	73.8	Confident	8 Å²	8	44 Å²	44	8%	0.082	26%	0.263	C	S	.	.			trans	104.5	157.4	-178.4	0	0	0	0	0	113.5	E242 T245 R249	E242-G247 PolarHBondContact O-N 3.09Å; T245-G247 VanDerWaalsContact C-N 3.26Å; T245-G247 PolarHBondContact O-N 3.28Å; T245-G247 PolarHBondContact OG1-O 2.8Å; T245-G247 VanDerWaalsContact OG1-O 3.06Å; G247-R249 PolarHBondContact O-N 3.22Å
248	F	68.7	Low	72.7	Confident	22 Å²	22	45.1 Å²	45.1	10%	0.096	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-75.9	-7.8	174.2	-60.5	-64.8	0	0	0	113.2	H215 V238 L241 E242 S250 L251 V258 L263	H215-F248 AromaticContact CD2-CE2 3.6Å; H215-F248 AromaticContact NE2-CD2 3.73Å; H215-F248 AromaticContact NE2-CE2 3.28Å; H215-F248 VanDerWaalsContact NE2-CE2 3.28Å; H215-F248 WeakPolarHBondContact NE2-CE2 3.29Å; V238-F248 HydrophobicContact CG1-CE2 4.32Å; V238-F248 HydrophobicContact CG1-CZ 4.08Å; L241-F248 HydrophobicContact CD2-CE1 4.01Å; L241-F248 HydrophobicContact CG-CE1 4.13Å; E242-F248 HydrophobicContact CB-CD2 4.39Å; E242-F248 HydrophobicContact CB-CE2 3.68Å; E242-F248 HydrophobicContact CB-CZ 3.81Å; E242-F248 HydrophobicContact CG-CD2 3.91Å; E242-F248 HydrophobicContact CG-CE2 3.67Å; E242-F248 HydrophobicContact CG-CZ 4.24Å; F248-S250 PolarHBondContact O-N 2.91Å; F248-L251 HydrophobicContact CB-CD1 4.05Å; F248-L251 HydrophobicContact CD1-CD1 4.06Å; F248-L251 VanDerWaalsContact O-CB 3.26Å; F248-L251 WeakPolarHBondContact O-CB 3.47Å; F248-L251 WeakPolarHBondContact O-CD1 3.38Å; F248-L251 PolarHBondContact O-N 2.86Å; F248-V258 HydrophobicContact CB-CG2 4.33Å; F248-V258 HydrophobicContact CD2-CG2 4.4Å; F248-V258 HydrophobicContact CG-CG2 4.3Å; F248-L263 HydrophobicContact CE1-CD2 3.77Å; F248-L263 HydrophobicContact CZ-CD2 3.85Å
249	R	59.4	Low	71.9	Confident	140 Å²	140	48.2 Å²	48.2	53%	0.528	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-65.1	-21.4	-176.3	-70.3	-175.9	177.6	-91.1	-3.7	113.9	G247 L251 G252	G247-R249 PolarHBondContact O-N 3.22Å; R249-L251 PolarHBondContact O-N 2.83Å; R249-L251 VanDerWaalsContact O-N 3.14Å; R249-G252 PolarHBondContact O-N 2.66Å
250	S	51.2	Low	71.3	Confident	114 Å²	114	52 Å²	52	80%	0.797	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-59.8	-19.5	171.5	-164	0	0	0	0	112.4	F248 G252	F248-S250 PolarHBondContact O-N 2.91Å; S250-G252 PolarHBondContact O-N 2.91Å
251	L	53	Low	70.6	Confident	71 Å²	71	57.2 Å²	57.2	37%	0.372	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-83.1	4	176.6	-62.1	146.1	0	0	0	113.8	F248 R249 I255 V262 V266	F248-L251 HydrophobicContact CB-CD1 4.05Å; F248-L251 HydrophobicContact CD1-CD1 4.06Å; F248-L251 VanDerWaalsContact O-CB 3.26Å; F248-L251 WeakPolarHBondContact O-CB 3.47Å; F248-L251 WeakPolarHBondContact O-CD1 3.38Å; F248-L251 PolarHBondContact O-N 2.86Å; R249-L251 PolarHBondContact O-N 2.83Å; R249-L251 VanDerWaalsContact O-N 3.14Å; L251-I255 HydrophobicContact CB-CD1 3.62Å; L251-V262 HydrophobicContact CD1-CG1 3.9Å; L251-V266 HydrophobicContact CD1-CB 4.44Å; L251-V266 HydrophobicContact CD1-CG2 3.11Å; L251-V266 HydrophobicContact CD2-CG2 3.42Å; L251-V266 VanDerWaalsContact CD2-CG2 3.42Å; L251-V266 HydrophobicContact CG-CG2 3.75Å
252	G	48.6	Very low	70.2	Confident	39 Å²	39	58.4 Å²	58.4	40%	0.402	34%	0.34	S	S	.	.			trans	108.1	134.1	-174.6	0	0	0	0	0	111.1	R249 S250 D254	R249-G252 PolarHBondContact O-N 2.66Å; S250-G252 PolarHBondContact O-N 2.91Å; G252-D254 PolarHBondContact O-N 2.84Å
253	A	49.3	Very low	70	Confident	75 Å²	75	57.6 Å²	57.6	62%	0.62	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-5	-176.4	0	0	0	0	0	114.5
254	D	53.1	Low	69.7	Low	148 Å²	148	60.2 Å²	60.2	79%	0.791	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	8.7	-165.9	-64.5	-33.1	0	0	0	114.7	G252 P256	G252-D254 PolarHBondContact O-N 2.84Å; D254-P256 WeakPolarHBondContact O-CD 3.3Å; D254-P256 VanDerWaalsContact O-N 3.17Å
255	I	55.8	Low	69.6	Low	66 Å²	66	66.5 Å²	66.5	34%	0.338	38%	0.376	S	S	.	.			trans	-74.4	107.2	173.2	-55.3	-179.2	0	0	0	108	L251 V257 V262	L251-I255 HydrophobicContact CB-CD1 3.62Å; I255-V257 VanDerWaalsContact C-N 3.28Å; I255-V257 WeakPolarHBondContact CG2-O 3.32Å; I255-V257 PolarHBondContact O-N 2.84Å; I255-V262 HydrophobicContact CD1-CG1 4.27Å
256	P	54.6	Low	69.6	Low	103 Å²	103	65.1 Å²	65.1	67%	0.669	37%	0.368	S	S	*	.	S	Bend	trans	-74.5	-26.1	-173.4	6.5	7.3	0	0	0	111.7	D254	D254-P256 WeakPolarHBondContact O-CD 3.3Å; D254-P256 VanDerWaalsContact O-N 3.17Å
257	V	65.9	Low	69.9	Low	64 Å²	64	64.4 Å²	64.4	39%	0.388	36%	0.364	S	S	.	.	S	Bend	trans	-142.2	117.4	-177.2	-177.4	0	0	0	0	107.8	I255 T259	I255-V257 VanDerWaalsContact C-N 3.28Å; I255-V257 WeakPolarHBondContact CG2-O 3.32Å; I255-V257 PolarHBondContact O-N 2.84Å; V257-T259 PolarHBondContact O-N 3.14Å
258	V	72.6	Confident	70.7	Confident	22 Å²	22	71.1 Å²	71.1	13%	0.133	39%	0.393	C	S	.	.			trans	-74.8	108.4	173.5	175.4	0	0	0	0	107.5	H215 F248 V262 L263	H215-V258 HydrophobicContact CB-CB 3.63Å; H215-V258 HydrophobicContact CB-CG1 3.98Å; H215-V258 WeakPolarHBondContact CB-O 3.33Å; F248-V258 HydrophobicContact CB-CG2 4.33Å; F248-V258 HydrophobicContact CD2-CG2 4.4Å; F248-V258 HydrophobicContact CG-CG2 4.3Å; V258-V262 HydrophobicContact CG1-CB 4.36Å; V258-V262 HydrophobicContact CG1-CG1 4.18Å; V258-L263 HydrophobicContact CG1-CD2 3.54Å; V258-L263 HydrophobicContact CG1-CG 3.88Å
259	T	78.5	Confident	71.6	Confident	66 Å²	66	74.9 Å²	74.9	41%	0.405	42%	0.418	S	S	.	.			trans	-84.9	165.3	177	64.7	0	0	0	0	110.9	V257 D261 V262 L263	V257-T259 PolarHBondContact O-N 3.14Å; T259-D261 VanDerWaalsContact C-N 3.28Å; T259-D261 PolarHBondContact O-N 2.95Å; T259-V262 WeakPolarHBondContact O-CB 3.41Å; T259-V262 PolarHBondContact O-N 3.01Å; T259-L263 PolarHBondContact O-N 3.48Å; T259-L263 VanDerWaalsContact O-N 3.07Å
260	K	80.8	Confident	73.1	Confident	80 Å²	80	69.3 Å²	69.3	35%	0.348	40%	0.399	S	S	.	.	H	α-helix	trans	-55.9	-42.6	174.4	-170.7	-176.5	174.1	-161.4	0	112.4	V262 L263 D264 S285	K260-V262 PolarHBondContact O-N 3.49Å; K260-L263 WeakPolarHBondContact O-CA 3.26Å; K260-L263 WeakPolarHBondContact O-CB 3.23Å; K260-L263 PolarHBondContact O-N 2.89Å; K260-D264 PolarHBondContact O-N 2.9Å; K260-S285 PolarHBondContact NZ-OG 2.84Å
261	D	82.4	Confident	74.8	Confident	109 Å²	109	71.9 Å²	71.9	58%	0.583	40%	0.398	S	S	*	.	H	α-helix	trans	-59.9	-32.4	177.4	-57.1	-24.9	0	0	0	112.7	T259 K265	T259-D261 VanDerWaalsContact C-N 3.28Å; T259-D261 PolarHBondContact O-N 2.95Å; D261-K265 VanDerWaalsContact O-CG 3.26Å; D261-K265 WeakPolarHBondContact O-CG 3.36Å; D261-K265 PolarHBondContact O-N 3.03Å; D261-K265 VanDerWaalsContact O-N 3.17Å
262	V	84	Confident	76.7	Confident	25 Å²	25	72.2 Å²	72.2	15%	0.152	40%	0.398	C	S	.	.	H	α-helix	trans	-70.7	-44.8	173.8	175.4	0	0	0	0	109.8	L251 I255 V258 T259 K260 D264 K265 V266	L251-V262 HydrophobicContact CD1-CG1 3.9Å; I255-V262 HydrophobicContact CD1-CG1 4.27Å; V258-V262 HydrophobicContact CG1-CB 4.36Å; V258-V262 HydrophobicContact CG1-CG1 4.18Å; T259-V262 WeakPolarHBondContact O-CB 3.41Å; T259-V262 PolarHBondContact O-N 3.01Å; K260-V262 PolarHBondContact O-N 3.49Å; V262-D264 VanDerWaalsContact C-N 3.31Å; V262-D264 PolarHBondContact O-N 2.84Å; V262-K265 PolarHBondContact O-N 3.46Å; V262-V266 HydrophobicContact CG1-CG2 4.17Å; V262-V266 WeakPolarHBondContact O-CB 3.46Å; V262-V266 WeakPolarHBondContact O-CG2 3.47Å; V262-V266 PolarHBondContact O-N 2.82Å
263	L	86.6	Confident	78.9	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	41%	0.408	C	S	.	.	H	α-helix	trans	-58	-43.2	176	-63.1	175	0	0	0	111.9	V238 L241 F248 V258 T259 K260 V266 T267	V238-L263 HydrophobicContact CG1-CD2 4.42Å; V238-L263 HydrophobicContact CG2-CD1 4.05Å; L241-L263 HydrophobicContact CD2-CB 4.35Å; L241-L263 HydrophobicContact CD2-CD2 3.96Å; F248-L263 HydrophobicContact CE1-CD2 3.77Å; F248-L263 HydrophobicContact CZ-CD2 3.85Å; V258-L263 HydrophobicContact CG1-CD2 3.54Å; V258-L263 HydrophobicContact CG1-CG 3.88Å; T259-L263 PolarHBondContact O-N 3.48Å; T259-L263 VanDerWaalsContact O-N 3.07Å; K260-L263 WeakPolarHBondContact O-CA 3.26Å; K260-L263 WeakPolarHBondContact O-CB 3.23Å; K260-L263 PolarHBondContact O-N 2.89Å; L263-V266 PolarHBondContact O-N 3.46Å; L263-T267 WeakPolarHBondContact O-CB 3.13Å; L263-T267 PolarHBondContact O-N 3.18Å; L263-T267 PolarHBondContact O-OG1 3.22Å
264	D	87.3	Confident	81.1	Confident	55 Å²	55	74.8 Å²	74.8	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-63.7	-49.1	179.8	-67.9	-19.7	0	0	0	110.6	K260 V262 V266 T267 E268	K260-D264 PolarHBondContact O-N 2.9Å; V262-D264 VanDerWaalsContact C-N 3.31Å; V262-D264 PolarHBondContact O-N 2.84Å; D264-V266 VanDerWaalsContact C-N 3.29Å; D264-V266 PolarHBondContact O-N 3.17Å; D264-T267 WeakPolarHBondContact O-CB 3.31Å; D264-T267 PolarHBondContact O-N 2.96Å; D264-T267 VanDerWaalsContact O-N 3.14Å; D264-E268 WeakPolarHBondContact O-CG 3.41Å; D264-E268 PolarHBondContact O-N 2.88Å
265	K	87.1	Confident	83.1	Confident	137 Å²	137	68.2 Å²	68.2	60%	0.596	36%	0.361	S	S	*	.	H	α-helix	trans	-58.6	-38.5	175.6	-74.5	173.2	-176.9	177.1	0	113.3	D261 V262 T269	D261-K265 VanDerWaalsContact O-CG 3.26Å; D261-K265 WeakPolarHBondContact O-CG 3.36Å; D261-K265 PolarHBondContact O-N 3.03Å; D261-K265 VanDerWaalsContact O-N 3.17Å; V262-K265 PolarHBondContact O-N 3.46Å; K265-T269 VanDerWaalsContact O-CG2 3.27Å; K265-T269 WeakPolarHBondContact O-CG2 3.43Å
266	V	86.8	Confident	85	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.024	36%	0.36	C	S	.	.	H	α-helix	trans	-70.3	-40.3	179	177.4	0	0	0	0	110.4	L241 T245 L251 V262 L263 D264 E268 T269	L241-V266 HydrophobicContact CD1-CG1 3.9Å; L241-V266 HydrophobicContact CD2-CB 4.19Å; L241-V266 HydrophobicContact CD2-CG1 4.03Å; L241-V266 HydrophobicContact CG-CG1 3.98Å; T245-V266 HydrophobicContact CG2-CG1 3.63Å; L251-V266 HydrophobicContact CD1-CB 4.44Å; L251-V266 HydrophobicContact CD1-CG2 3.11Å; L251-V266 HydrophobicContact CD2-CG2 3.42Å; L251-V266 VanDerWaalsContact CD2-CG2 3.42Å; L251-V266 HydrophobicContact CG-CG2 3.75Å; V262-V266 HydrophobicContact CG1-CG2 4.17Å; V262-V266 WeakPolarHBondContact O-CB 3.46Å; V262-V266 WeakPolarHBondContact O-CG2 3.47Å; V262-V266 PolarHBondContact O-N 2.82Å; L263-V266 PolarHBondContact O-N 3.46Å; D264-V266 VanDerWaalsContact C-N 3.29Å; D264-V266 PolarHBondContact O-N 3.17Å; V266-E268 VanDerWaalsContact C-N 3.27Å; V266-E268 PolarHBondContact O-N 2.78Å; V266-T269 WeakPolarHBondContact O-CB 3.28Å; V266-T269 PolarHBondContact O-N 3.01Å; V266-T269 PolarHBondContact O-OG1 2.59Å
267	T	89.8	Confident	87	Confident	2 Å²	2	66 Å²	66	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-37.2	177.7	-56.3	0	0	0	0	111	L241 L263 D264 T269 L270 M276 I279 C280	L241-T267 WeakPolarHBondContact CD2-OG1 3.31Å; L263-T267 WeakPolarHBondContact O-CB 3.13Å; L263-T267 PolarHBondContact O-N 3.18Å; L263-T267 PolarHBondContact O-OG1 3.22Å; D264-T267 WeakPolarHBondContact O-CB 3.31Å; D264-T267 PolarHBondContact O-N 2.96Å; D264-T267 VanDerWaalsContact O-N 3.14Å; T267-T269 PolarHBondContact O-N 2.87Å; T267-L270 HydrophobicContact CG2-CD1 4.36Å; T267-L270 WeakPolarHBondContact O-CB 3.38Å; T267-L270 WeakPolarHBondContact O-CG 3.35Å; T267-L270 PolarHBondContact O-N 2.89Å; T267-M276 HydrophobicContact CG2-CG 3.73Å; T267-I279 HydrophobicContact CG2-CB 4.4Å; T267-I279 HydrophobicContact CG2-CG2 4.03Å; T267-C280 WeakPolarHBondContact CG2-SG 3.41Å
268	E	89.4	Confident	88.5	Confident	150 Å²	150	62.9 Å²	62.9	70%	0.701	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-19	173.5	-69.8	172.7	-179	0	0	114.1	D264 V266 L270	D264-E268 WeakPolarHBondContact O-CG 3.41Å; D264-E268 PolarHBondContact O-N 2.88Å; V266-E268 VanDerWaalsContact C-N 3.27Å; V266-E268 PolarHBondContact O-N 2.78Å; E268-L270 VanDerWaalsContact C-N 3.35Å
269	T	88	Confident	89.6	Confident	100 Å²	100	61.9 Å²	61.9	61%	0.613	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.6	178.5	71.2	0	0	0	0	113.9	K265 V266 T267	K265-T269 VanDerWaalsContact O-CG2 3.27Å; K265-T269 WeakPolarHBondContact O-CG2 3.43Å; V266-T269 WeakPolarHBondContact O-CB 3.28Å; V266-T269 PolarHBondContact O-N 3.01Å; V266-T269 PolarHBondContact O-OG1 2.59Å; T267-T269 PolarHBondContact O-N 2.87Å
270	L	89.7	Confident	90.5	Very high	23 Å²	23	60.9 Å²	60.9	12%	0.12	31%	0.313	C	S	.	.			trans	-71.2	132.1	-177.4	-64.6	178.2	0	0	0	112	L241 A244 T245 T267 E268 H272 Q275 M276 I279	L241-L270 HydrophobicContact CD1-CD1 3.85Å; L241-L270 HydrophobicContact CD1-CD2 4.3Å; L241-L270 HydrophobicContact CD1-CG 4.25Å; A244-L270 HydrophobicContact CB-CD2 3.73Å; T245-L270 HydrophobicContact CG2-CD2 3.91Å; T267-L270 HydrophobicContact CG2-CD1 4.36Å; T267-L270 WeakPolarHBondContact O-CB 3.38Å; T267-L270 WeakPolarHBondContact O-CG 3.35Å; T267-L270 PolarHBondContact O-N 2.89Å; E268-L270 VanDerWaalsContact C-N 3.35Å; L270-H272 VanDerWaalsContact C-N 3.32Å; L270-H272 PolarHBondContact O-N 2.96Å; L270-Q275 HydrophobicContact CD1-CG 4.38Å; L270-M276 HydrophobicContact CB-CB 4.45Å; L270-M276 HydrophobicContact CD1-CB 4.42Å; L270-I279 HydrophobicContact CD1-CD1 3.55Å
271	E	88.1	Confident	91.2	Very high	168 Å²	168	62.5 Å²	62.5	79%	0.785	32%	0.317	S	S	*	.	S	Bend	trans	-70.7	-24.1	-178.1	-61.6	-178.8	175.6	0	0	113.7	P273	E271-P273 WeakPolarHBondContact O-CD 3.41Å
272	H	92.8	Very high	91.9	Very high	79 Å²	79	57.3 Å²	57.3	37%	0.366	29%	0.289	S	S	.	.			trans	-105.5	111.9	-171.5	-68.5	-46	0	0	0	112.5	L270 L274 Q275 M276	L270-H272 VanDerWaalsContact C-N 3.32Å; L270-H272 PolarHBondContact O-N 2.96Å; H272-L274 VanDerWaalsContact C-N 3.3Å; H272-L274 PolarHBondContact O-N 3.48Å; H272-Q275 HydrophobicContact CB-CB 3.81Å; H272-Q275 WeakPolarHBondContact O-CB 3.02Å; H272-Q275 PolarHBondContact O-N 3.08Å; H272-M276 PolarHBondContact O-N 3.28Å
273	P	94.2	Very high	92.4	Very high	94 Å²	94	56.5 Å²	56.5	61%	0.61	28%	0.284	S	S	*	.	H	α-helix	trans	-59.2	-35.4	-175	-27	34.6	0	0	0	114.7	E271 D277	E271-P273 WeakPolarHBondContact O-CD 3.41Å; P273-D277 WeakPolarHBondContact O-CB 3.05Å; P273-D277 PolarHBondContact O-N 3.49Å
274	L	95.4	Very high	92.8	Very high	74 Å²	74	60.3 Å²	60.3	39%	0.387	30%	0.302	S	S	.	.	H	α-helix	trans	-72.7	-33.2	178.3	-65.4	178.4	0	0	0	112.4	H272 L278 R300 A301	H272-L274 VanDerWaalsContact C-N 3.3Å; H272-L274 PolarHBondContact O-N 3.48Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 PolarHBondContact O-N 3.44Å; L274-L278 VanDerWaalsContact O-N 3.1Å; L274-R300 HydrophobicContact CD1-CB 4.35Å; L274-R300 HydrophobicContact CD2-CB 4.17Å; L274-A301 HydrophobicContact CB-CB 3.9Å; L274-A301 VanDerWaalsContact O-CB 3.29Å; L274-A301 WeakPolarHBondContact O-CB 3.34Å
275	Q	95.2	Very high	92.9	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-45.6	174.7	-172.4	-177.9	30.8	0	0	109.8	I148 W151 L270 H272 L278 I279	I148-Q275 HydrophobicContact CD1-CB 4.12Å; I148-Q275 HydrophobicContact CD1-CG 4.24Å; W151-Q275 HydrophobicContact CD2-CG 4.07Å; W151-Q275 VanDerWaalsContact CD2-NE2 3.31Å; W151-Q275 HydrophobicContact CE3-CG 4.15Å; W151-Q275 VanDerWaalsContact CG-NE2 3.31Å; W151-Q275 HydrophobicContact CH2-CB 4.37Å; W151-Q275 HydrophobicContact CH2-CG 3.69Å; W151-Q275 HydrophobicContact CZ2-CG 3.6Å; W151-Q275 HydrophobicContact CZ3-CB 4.45Å; W151-Q275 HydrophobicContact CZ3-CG 3.97Å; L270-Q275 HydrophobicContact CD1-CG 4.38Å; H272-Q275 HydrophobicContact CB-CB 3.81Å; H272-Q275 WeakPolarHBondContact O-CB 3.02Å; H272-Q275 PolarHBondContact O-N 3.08Å; Q275-L278 PolarHBondContact O-N 3.01Å; Q275-I279 HydrophobicContact CG-CD1 4.13Å; Q275-I279 WeakPolarHBondContact O-CG1 3.24Å; Q275-I279 PolarHBondContact O-N 3.12Å; Q275-I279 VanDerWaalsContact O-N 3.09Å
276	M	95.3	Very high	93.2	Very high	66 Å²	66	58.4 Å²	58.4	33%	0.325	30%	0.303	S	S	.	.	H	α-helix	trans	-59.4	-50.1	174.5	-171.3	-178.4	67.2	0	0	111.9	T267 L270 H272 L278 I279 C280	T267-M276 HydrophobicContact CG2-CG 3.73Å; L270-M276 HydrophobicContact CB-CB 4.45Å; L270-M276 HydrophobicContact CD1-CB 4.42Å; H272-M276 PolarHBondContact O-N 3.28Å; M276-L278 VanDerWaalsContact C-N 3.33Å; M276-L278 PolarHBondContact O-N 3.1Å; M276-I279 PolarHBondContact O-N 2.92Å; M276-C280 WeakPolarHBondContact O-CB 3.3Å; M276-C280 PolarHBondContact O-N 3.36Å; M276-C280 PolarHBondContact O-SG 2.94Å; M276-C280 VanDerWaalsContact O-SG 3.32Å
277	D	96.6	Very high	93.5	Very high	55 Å²	55	59.4 Å²	59.4	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-56.3	-45	177.5	179.4	39.9	0	0	0	112	P273 C280 R281 H299	P273-D277 WeakPolarHBondContact O-CB 3.05Å; P273-D277 PolarHBondContact O-N 3.49Å; D277-C280 PolarHBondContact O-N 3.19Å; D277-R281 VanDerWaalsContact O-CG 3.28Å; D277-R281 WeakPolarHBondContact O-CG 3.3Å; D277-R281 PolarHBondContact O-N 3.49Å; D277-R281 VanDerWaalsContact O-N 3.09Å; D277-R281 IonicContact OD1-CZ 2.75Å; D277-R281 IonicContact OD1-NE 3.37Å; D277-R281 PolarHBondContact OD1-NE 3.14Å; D277-R281 IonicContact OD1-NH2 2.77Å; D277-R281 PolarHBondContact OD1-NH2 3.22Å; D277-R281 IonicContact OD2-CZ 3.51Å; D277-R281 IonicContact OD2-NE 2.65Å; D277-R281 PolarHBondContact OD2-NE 3.35Å; D277-R281 IonicContact OD2-NH2 3.55Å; D277-R281 PolarHBondContact OD2-NH2 3.16Å; D277-H299 IonicContact OD2-CE1 3.39Å; D277-H299 PolarHBondContact OD2-CE1 3.38Å; D277-H299 IonicContact OD2-NE2 2.75Å; D277-H299 PolarHBondContact OD2-NE2 3.4Å
278	L	97.5	Very high	93.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-49.8	177.4	-175.2	149.3	0	0	0	111.6	W151 F236 L274 Q275 M276 R281 C282 L296 H299 A301 L302	W151-L278 HydrophobicContact CH2-CB 4.5Å; W151-L278 HydrophobicContact CH2-CD1 4.18Å; W151-L278 HydrophobicContact CH2-CD2 3.99Å; W151-L278 HydrophobicContact CH2-CG 4.46Å; W151-L278 HydrophobicContact CZ2-CD2 4.33Å; F236-L278 HydrophobicContact CE1-CD2 3.96Å; F236-L278 HydrophobicContact CZ-CD2 4.43Å; L274-L278 WeakPolarHBondContact O-CB 3.46Å; L274-L278 PolarHBondContact O-N 3.44Å; L274-L278 VanDerWaalsContact O-N 3.1Å; Q275-L278 PolarHBondContact O-N 3.01Å; M276-L278 VanDerWaalsContact C-N 3.33Å; M276-L278 PolarHBondContact O-N 3.1Å; L278-R281 PolarHBondContact O-N 3.09Å; L278-C282 PolarHBondContact O-N 3.01Å; L278-C282 PolarHBondContact O-SG 3.02Å; L278-L296 HydrophobicContact CD1-CD2 4.38Å; L278-L296 HydrophobicContact CD2-CD2 4.42Å; L278-L296 HydrophobicContact CG-CD2 3.96Å; L278-H299 HydrophobicContact CD1-CB 4.01Å; L278-A301 HydrophobicContact CB-CB 4.16Å; L278-A301 HydrophobicContact CD1-CB 3.9Å; L278-L302 HydrophobicContact CD1-CD1 3.61Å; L278-L302 HydrophobicContact CD1-CD2 4.25Å; L278-L302 HydrophobicContact CD1-CG 3.55Å
279	I	96.7	Very high	94.1	Very high	0 Å²	0	59 Å²	59	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-46.6	-178.4	-70.1	164.1	0	0	0	110.5	W151 A240 L241 T267 L270 Q275 M276 R281 C282 V283	W151-I279 HydrophobicContact CZ2-CD1 4.19Å; W151-I279 HydrophobicContact CZ2-CG1 4.31Å; A240-I279 HydrophobicContact CB-CG1 4.17Å; L241-I279 HydrophobicContact CB-CD1 4.23Å; L241-I279 HydrophobicContact CB-CG2 4.07Å; L241-I279 HydrophobicContact CD1-CD1 4.09Å; L241-I279 HydrophobicContact CD1-CG2 4.32Å; T267-I279 HydrophobicContact CG2-CB 4.4Å; T267-I279 HydrophobicContact CG2-CG2 4.03Å; L270-I279 HydrophobicContact CD1-CD1 3.55Å; Q275-I279 HydrophobicContact CG-CD1 4.13Å; Q275-I279 WeakPolarHBondContact O-CG1 3.24Å; Q275-I279 PolarHBondContact O-N 3.12Å; Q275-I279 VanDerWaalsContact O-N 3.09Å; M276-I279 PolarHBondContact O-N 2.92Å; I279-R281 VanDerWaalsContact C-N 3.27Å; I279-R281 PolarHBondContact O-N 3.19Å; I279-C282 WeakPolarHBondContact O-CB 3.41Å; I279-C282 PolarHBondContact O-N 3.16Å; I279-V283 WeakPolarHBondContact O-CG2 3.5Å; I279-V283 PolarHBondContact O-N 3.03Å
280	C	95.9	Very high	94.5	Very high	45 Å²	45	55 Å²	55	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-55.7	-40	177.5	-75.7	0	0	0	0	112.6	T267 M276 D277 C282 Q284	T267-C280 WeakPolarHBondContact CG2-SG 3.41Å; M276-C280 WeakPolarHBondContact O-CB 3.3Å; M276-C280 PolarHBondContact O-N 3.36Å; M276-C280 PolarHBondContact O-SG 2.94Å; M276-C280 VanDerWaalsContact O-SG 3.32Å; D277-C280 PolarHBondContact O-N 3.19Å; C280-C282 VanDerWaalsContact C-N 3.34Å; C280-Q284 WeakPolarHBondContact O-CG 3.46Å; C280-Q284 PolarHBondContact O-NE2 3.01Å
281	R	96.8	Very high	94.9	Very high	115 Å²	115	55.2 Å²	55.2	43%	0.434	31%	0.309	S	S	.	.	H	α-helix	trans	-67.1	-34.4	176.7	-70.9	174.8	-168	-145.2	13.5	112.6	D277 L278 I279 Q284 P291	D277-R281 VanDerWaalsContact O-CG 3.28Å; D277-R281 WeakPolarHBondContact O-CG 3.3Å; D277-R281 PolarHBondContact O-N 3.49Å; D277-R281 VanDerWaalsContact O-N 3.09Å; D277-R281 IonicContact OD1-CZ 2.75Å; D277-R281 IonicContact OD1-NE 3.37Å; D277-R281 PolarHBondContact OD1-NE 3.14Å; D277-R281 IonicContact OD1-NH2 2.77Å; D277-R281 PolarHBondContact OD1-NH2 3.22Å; D277-R281 IonicContact OD2-CZ 3.51Å; D277-R281 IonicContact OD2-NE 2.65Å; D277-R281 PolarHBondContact OD2-NE 3.35Å; D277-R281 IonicContact OD2-NH2 3.55Å; D277-R281 PolarHBondContact OD2-NH2 3.16Å; L278-R281 PolarHBondContact O-N 3.09Å; I279-R281 VanDerWaalsContact C-N 3.27Å; I279-R281 PolarHBondContact O-N 3.19Å; R281-Q284 WeakPolarHBondContact O-CG 3.4Å; R281-P291 HydrophobicContact CB-CG 4.1Å; R281-P291 WeakPolarHBondContact O-CD 3.5Å
282	C	97.3	Very high	95.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-71.7	-40.5	177.6	-65.1	0	0	0	0	112.7	I233 G237 L278 I279 C280 Q284 R290 L296	I233-C282 HydrophobicContact CG2-CB 4.17Å; I233-C282 WeakPolarHBondContact O-CB 3.43Å; G237-C282 VanDerWaalsContact CA-CB 3.46Å; L278-C282 PolarHBondContact O-N 3.01Å; L278-C282 PolarHBondContact O-SG 3.02Å; I279-C282 WeakPolarHBondContact O-CB 3.41Å; I279-C282 PolarHBondContact O-N 3.16Å; C280-C282 VanDerWaalsContact C-N 3.34Å; C282-Q284 VanDerWaalsContact C-N 3.31Å; C282-Q284 PolarHBondContact O-N 2.82Å; C282-R290 WeakPolarHBondContact O-CD 3.25Å; C282-R290 WeakPolarHBondContact O-CG 3.46Å; C282-R290 PolarHBondContact O-NE 2.74Å; C282-L296 VanDerWaalsContact SG-CD1 3.56Å
283	V	94.5	Very high	95.5	Very high	8 Å²	8	47.6 Å²	47.6	5%	0.048	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	19.1	-173.7	-56.5	0	0	0	0	114.3	Y234 V238 I279	Y234-V283 HydrophobicContact CD2-CB 4.27Å; Y234-V283 HydrophobicContact CE2-CB 4.04Å; Y234-V283 HydrophobicContact CE2-CG1 4.44Å; V238-V283 HydrophobicContact CG2-CG1 4.12Å; I279-V283 WeakPolarHBondContact O-CG2 3.5Å; I279-V283 PolarHBondContact O-N 3.03Å
284	Q	93.9	Very high	95.5	Very high	82 Å²	82	46.6 Å²	46.6	38%	0.383	27%	0.267	S	S	.	.			trans	-58.3	141.9	175.5	-69.5	-63.3	-49.1	0	0	111.8	C280 R281 C282 D286 A289 R290	C280-Q284 WeakPolarHBondContact O-CG 3.46Å; C280-Q284 PolarHBondContact O-NE2 3.01Å; R281-Q284 WeakPolarHBondContact O-CG 3.4Å; C282-Q284 VanDerWaalsContact C-N 3.31Å; C282-Q284 PolarHBondContact O-N 2.82Å; Q284-D286 VanDerWaalsContact C-N 3.31Å; Q284-D286 PolarHBondContact O-N 3.18Å; Q284-A289 HydrophobicContact CB-CB 4.24Å; Q284-A289 HydrophobicContact CG-CB 4.33Å; Q284-R290 HydrophobicContact CB-CG 4.03Å; Q284-R290 VanDerWaalsContact O-CZ 3.31Å; Q284-R290 PolarHBondContact O-NE 2.85Å; Q284-R290 PolarHBondContact O-NH2 3.4Å
285	S	90.7	Very high	95.5	Very high	67 Å²	67	45.3 Å²	45.3	47%	0.469	27%	0.267	S	S	.	.	S	Bend	trans	-64.3	-38.5	176.8	-50.2	0	0	0	0	111.9	K260 P287	K260-S285 PolarHBondContact NZ-OG 2.84Å; S285-P287 WeakPolarHBondContact O-CD 3.35Å
286	D	92.4	Very high	95.5	Very high	84 Å²	84	44.9 Å²	44.9	45%	0.449	27%	0.265	S	S	.	.	S	Bend	trans	-82.8	116.4	178.4	179.5	13.8	0	0	0	109.7	Q284 A288 A289	Q284-D286 VanDerWaalsContact C-N 3.31Å; Q284-D286 PolarHBondContact O-N 3.18Å; D286-A288 PolarHBondContact O-N 3.21Å; D286-A288 PolarHBondContact OD1-N 3.48Å; D286-A289 HydrophobicContact CB-CB 4.08Å; D286-A289 PolarHBondContact O-N 2.95Å; D286-A289 VanDerWaalsContact O-N 3.13Å
287	P	93.9	Very high	95.4	Very high	26 Å²	26	42 Å²	42	17%	0.169	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-60.8	-27.6	177.4	24.7	-34.6	0	0	0	113	E220 P230 S285 A289 R290	E220-P287 HydrophobicContact CB-CG 4.48Å; E220-P287 HydrophobicContact CG-CB 4.36Å; E220-P287 HydrophobicContact CG-CG 4.19Å; P230-P287 HydrophobicContact CB-CB 3.79Å; P230-P287 HydrophobicContact CG-CB 4.39Å; S285-P287 WeakPolarHBondContact O-CD 3.35Å; P287-A289 VanDerWaalsContact C-N 3.29Å; P287-A289 PolarHBondContact O-N 3.33Å; P287-R290 PolarHBondContact O-N 2.86Å
288	A	94.7	Very high	95.2	Very high	87 Å²	87	43.8 Å²	43.8	72%	0.719	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-73.1	-22.4	178.7	0	0	0	0	0	113	D286 R290	D286-A288 PolarHBondContact O-N 3.21Å; D286-A288 PolarHBondContact OD1-N 3.48Å; A288-R290 VanDerWaalsContact C-N 3.33Å
289	A	96.3	Very high	95.1	Very high	55 Å²	55	44.5 Å²	44.5	46%	0.455	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-81.7	-13.1	176	0	0	0	0	0	112.9	Q284 D286 P287	Q284-A289 HydrophobicContact CB-CB 4.24Å; Q284-A289 HydrophobicContact CG-CB 4.33Å; D286-A289 HydrophobicContact CB-CB 4.08Å; D286-A289 PolarHBondContact O-N 2.95Å; D286-A289 VanDerWaalsContact O-N 3.13Å; P287-A289 VanDerWaalsContact C-N 3.29Å; P287-A289 PolarHBondContact O-N 3.33Å
290	R	97.3	Very high	95	Very high	16 Å²	16	54 Å²	54	6%	0.06	30%	0.295	C	S	.	.	S	Bend	trans	-76.4	134	179	-61.9	179.4	-162.8	142.7	14.1	110.1	E220 P230 I233 C282 Q284 P287 A288	E220-R290 IonicContact OE1-CZ 3.69Å; E220-R290 IonicContact OE1-NH1 3.18Å; E220-R290 PolarHBondContact OE1-NH1 2.81Å; E220-R290 IonicContact OE1-NH2 3.97Å; E220-R290 IonicContact OE2-CZ 3.17Å; E220-R290 IonicContact OE2-NH1 3.81Å; E220-R290 PolarHBondContact OE2-NH1 2.71Å; E220-R290 IonicContact OE2-NH2 3.93Å; E220-R290 PolarHBondContact OE2-NH2 3.4Å; P230-R290 PolarHBondContact O-NH1 3.33Å; I233-R290 HydrophobicContact CG2-CB 4.06Å; C282-R290 WeakPolarHBondContact O-CD 3.25Å; C282-R290 WeakPolarHBondContact O-CG 3.46Å; C282-R290 PolarHBondContact O-NE 2.74Å; Q284-R290 HydrophobicContact CB-CG 4.03Å; Q284-R290 VanDerWaalsContact O-CZ 3.31Å; Q284-R290 PolarHBondContact O-NE 2.85Å; Q284-R290 PolarHBondContact O-NH2 3.4Å; P287-R290 PolarHBondContact O-N 2.86Å; A288-R290 VanDerWaalsContact C-N 3.33Å
291	P	97.6	Very high	94.9	Very high	29 Å²	29	52 Å²	52	19%	0.188	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-67.3	155.9	174.7	29.3	-34.9	0	0	0	111	I233 R281 A295 L296	I233-P291 WeakPolarHBondContact CG2-O 3.42Å; R281-P291 HydrophobicContact CB-CG 4.1Å; R281-P291 WeakPolarHBondContact O-CD 3.5Å; P291-A295 HydrophobicContact CB-CB 3.99Å; P291-L296 HydrophobicContact CB-CD2 4.27Å; P291-L296 HydrophobicContact CB-CG 4.05Å; P291-L296 HydrophobicContact CG-CD1 4.05Å; P291-L296 HydrophobicContact CG-CD2 3.45Å; P291-L296 VanDerWaalsContact CG-CD2 3.45Å; P291-L296 HydrophobicContact CG-CG 3.59Å
292	T	97.1	Very high	94.7	Very high	87 Å²	87	46.7 Å²	46.7	53%	0.534	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-69.9	160.5	170.2	61.6	0	0	0	0	111	H294 A295 L296	T292-H294 PolarHBondContact O-N 2.83Å; T292-A295 PolarHBondContact O-N 3Å; T292-A295 WeakPolarHBondContact OG1-CB 3.45Å; T292-A295 PolarHBondContact OG1-N 2.8Å; T292-A295 VanDerWaalsContact OG1-N 3.11Å; T292-L296 PolarHBondContact O-N 3.1Å
293	A	95.9	Very high	94.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-54.2	-42.3	172.8	0	0	0	0	0	111.3	L159 L162 D163 I233 A295 L296 L297	L159-A293 HydrophobicContact CD2-CB 4.31Å; L162-A293 HydrophobicContact CB-CB 3.87Å; D163-A293 HydrophobicContact CB-CB 4.03Å; I233-A293 HydrophobicContact CD1-CB 3.98Å; A293-A295 PolarHBondContact O-N 3.32Å; A293-L296 PolarHBondContact O-N 2.9Å; A293-L297 PolarHBondContact O-N 3.21Å; A293-L297 VanDerWaalsContact O-N 3.11Å
294	H	93.7	Very high	93.5	Very high	72 Å²	72	55.4 Å²	55.4	33%	0.333	30%	0.302	S	S	.	.	H	α-helix	trans	-52.8	-54.7	170.9	-160.1	75.8	0	0	0	112.7	D163 T292 L296 L297 F298	D163-H294 VanDerWaalsContact OD1-CB 3.24Å; D163-H294 WeakPolarHBondContact OD1-CB 3.43Å; D163-H294 IonicContact OD1-CG 3.49Å; D163-H294 PolarHBondContact OD1-N 3.03Å; D163-H294 IonicContact OD1-ND1 3.19Å; D163-H294 IonicContact OD2-ND1 3.27Å; D163-H294 PolarHBondContact OD2-ND1 2.87Å; T292-H294 PolarHBondContact O-N 2.83Å; H294-L296 PolarHBondContact O-N 3.48Å; H294-L297 WeakPolarHBondContact O-CB 3.18Å; H294-L297 PolarHBondContact O-N 2.73Å; H294-L297 VanDerWaalsContact O-N 3.11Å; H294-F298 AromaticContact CD2-CE2 3.9Å; H294-F298 AromaticContact CE1-CE2 3.73Å; H294-F298 AromaticContact NE2-CE2 3.39Å; H294-F298 WeakPolarHBondContact NE2-CE2 3.28Å; H294-F298 WeakPolarHBondContact O-CD2 3.38Å
295	A	95.5	Very high	92.9	Very high	47 Å²	47	57 Å²	57	39%	0.388	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-33.5	-177.8	0	0	0	0	0	112.3	P291 T292 A293 F298 H299	P291-A295 HydrophobicContact CB-CB 3.99Å; T292-A295 PolarHBondContact O-N 3Å; T292-A295 WeakPolarHBondContact OG1-CB 3.45Å; T292-A295 PolarHBondContact OG1-N 2.8Å; T292-A295 VanDerWaalsContact OG1-N 3.11Å; A293-A295 PolarHBondContact O-N 3.32Å; A295-F298 PolarHBondContact O-N 3.4Å; A295-H299 PolarHBondContact O-N 2.64Å
296	L	96.4	Very high	92.4	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-35.4	175.5	-72.5	167.7	0	0	0	113	L159 I233 F236 L278 C282 P291 T292 A293 H294 F298 H299	L159-L296 HydrophobicContact CD1-CB 3.68Å; L159-L296 HydrophobicContact CD2-CB 3.84Å; L159-L296 HydrophobicContact CD2-CD1 3.65Å; L159-L296 HydrophobicContact CD2-CG 4.4Å; L159-L296 HydrophobicContact CG-CB 4.4Å; I233-L296 HydrophobicContact CD1-CD1 4.25Å; I233-L296 HydrophobicContact CG2-CD1 3.92Å; F236-L296 HydrophobicContact CD1-CD1 4.17Å; F236-L296 HydrophobicContact CE1-CD1 4.17Å; L278-L296 HydrophobicContact CD1-CD2 4.38Å; L278-L296 HydrophobicContact CD2-CD2 4.42Å; L278-L296 HydrophobicContact CG-CD2 3.96Å; C282-L296 VanDerWaalsContact SG-CD1 3.56Å; P291-L296 HydrophobicContact CB-CD2 4.27Å; P291-L296 HydrophobicContact CB-CG 4.05Å; P291-L296 HydrophobicContact CG-CD1 4.05Å; P291-L296 HydrophobicContact CG-CD2 3.45Å; P291-L296 VanDerWaalsContact CG-CD2 3.45Å; P291-L296 HydrophobicContact CG-CG 3.59Å; T292-L296 PolarHBondContact O-N 3.1Å; A293-L296 PolarHBondContact O-N 2.9Å; H294-L296 PolarHBondContact O-N 3.48Å; L296-F298 PolarHBondContact O-N 3.31Å; L296-H299 WeakPolarHBondContact O-CB 3.24Å; L296-H299 PolarHBondContact O-N 2.89Å
297	L	92.7	Very high	92	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-29	174.1	-71	167.2	0	0	0	112.4	I156 L159 D163 A293 H294	I156-L297 HydrophobicContact CG2-CD2 4.31Å; L159-L297 HydrophobicContact CB-CD2 3.65Å; L159-L297 HydrophobicContact CB-CG 3.94Å; L159-L297 HydrophobicContact CD1-CD2 4.45Å; D163-L297 HydrophobicContact CB-CD1 4.18Å; A293-L297 PolarHBondContact O-N 3.21Å; A293-L297 VanDerWaalsContact O-N 3.11Å; H294-L297 WeakPolarHBondContact O-CB 3.18Å; H294-L297 PolarHBondContact O-N 2.73Å; H294-L297 VanDerWaalsContact O-N 3.11Å
298	F	92.4	Very high	91.6	Very high	93 Å²	93	59.9 Å²	59.9	41%	0.408	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.8	174.8	-68.8	-87.1	0	0	0	113.8	H294 A295 L296 F303 I379	H294-F298 AromaticContact CD2-CE2 3.9Å; H294-F298 AromaticContact CE1-CE2 3.73Å; H294-F298 AromaticContact NE2-CE2 3.39Å; H294-F298 WeakPolarHBondContact NE2-CE2 3.28Å; H294-F298 WeakPolarHBondContact O-CD2 3.38Å; A295-F298 PolarHBondContact O-N 3.4Å; L296-F298 PolarHBondContact O-N 3.31Å; F298-F303 AromaticContact CD1-CD2 3.69Å; F298-F303 HydrophobicContact CD1-CD2 3.69Å; F298-F303 AromaticContact CD1-CE2 3.62Å; F298-F303 HydrophobicContact CD1-CE2 3.62Å; F298-F303 HydrophobicContact CE1-CD2 4.32Å; F298-F303 AromaticContact CE1-CE2 3.86Å; F298-F303 HydrophobicContact CE1-CE2 3.86Å; F298-F303 HydrophobicContact CG-CD2 4.4Å; F298-I379 HydrophobicContact CD1-CG2 4.34Å; F298-I379 HydrophobicContact CE1-CG2 3.4Å; F298-I379 HydrophobicContact CE2-CG2 3.87Å; F298-I379 HydrophobicContact CZ-CG2 3.12Å
299	H	95.1	Very high	91.2	Very high	16 Å²	16	61.9 Å²	61.9	7%	0.074	32%	0.32	C	S	.	.	S	Bend	trans	-65.2	139.9	176.2	-167.9	-95.1	0	0	0	110.6	D277 L278 A295 L296 A301 L302 F303	D277-H299 IonicContact OD2-CE1 3.39Å; D277-H299 PolarHBondContact OD2-CE1 3.38Å; D277-H299 IonicContact OD2-NE2 2.75Å; D277-H299 PolarHBondContact OD2-NE2 3.4Å; L278-H299 HydrophobicContact CD1-CB 4.01Å; A295-H299 PolarHBondContact O-N 2.64Å; L296-H299 WeakPolarHBondContact O-CB 3.24Å; L296-H299 PolarHBondContact O-N 2.89Å; H299-A301 VanDerWaalsContact ND1-CB 3.29Å; H299-A301 WeakPolarHBondContact ND1-CB 3.48Å; H299-A301 PolarHBondContact ND1-N 3.46Å; H299-A301 PolarHBondContact O-N 3.24Å; H299-L302 PolarHBondContact O-N 3.35Å; H299-F303 WeakPolarHBondContact O-CB 3.45Å; H299-F303 PolarHBondContact O-N 2.84Å
300	R	94	Very high	90.7	Very high	199 Å²	199	60.4 Å²	60.4	75%	0.751	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.9	-177.5	-65.1	179.6	68.6	-177	2.2	114.3	L274	L274-R300 HydrophobicContact CD1-CB 4.35Å; L274-R300 HydrophobicContact CD2-CB 4.17Å
301	A	93.8	Very high	90.1	Very high	4 Å²	4	63.6 Å²	63.6	3%	0.033	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-34.5	174.6	0	0	0	0	0	112.9	W151 K152 L274 L278 H299	W151-A301 HydrophobicContact CZ3-CB 4.45Å; K152-A301 WeakPolarHBondContact CD-O 3.3Å; K152-A301 WeakPolarHBondContact CE-O 3.47Å; K152-A301 PolarHBondContact NZ-O 2.73Å; K152-A301 VanDerWaalsContact NZ-O 3.08Å; L274-A301 HydrophobicContact CB-CB 3.9Å; L274-A301 VanDerWaalsContact O-CB 3.29Å; L274-A301 WeakPolarHBondContact O-CB 3.34Å; L278-A301 HydrophobicContact CB-CB 4.16Å; L278-A301 HydrophobicContact CD1-CB 3.9Å; H299-A301 VanDerWaalsContact ND1-CB 3.29Å; H299-A301 WeakPolarHBondContact ND1-CB 3.48Å; H299-A301 PolarHBondContact ND1-N 3.46Å; H299-A301 PolarHBondContact O-N 3.24Å
302	L	92.8	Very high	89.6	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.016	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-36.3	-173.5	-59.9	-176	0	0	0	112.8	W151 K152 C155 I156 L159 L278 H299 E304	W151-L302 HydrophobicContact CE3-CD2 4.18Å; W151-L302 HydrophobicContact CH2-CD2 4.15Å; W151-L302 HydrophobicContact CZ3-CD2 3.55Å; K152-L302 HydrophobicContact CB-CD2 4.23Å; K152-L302 HydrophobicContact CG-CD2 3.97Å; C155-L302 HydrophobicContact CB-CD1 4.21Å; C155-L302 HydrophobicContact CB-CD2 3.9Å; I156-L302 HydrophobicContact CG1-CB 4.18Å; I156-L302 HydrophobicContact CG1-CD1 4.47Å; I156-L302 HydrophobicContact CG1-CD2 4.42Å; L159-L302 HydrophobicContact CD1-CD1 3.26Å; L278-L302 HydrophobicContact CD1-CD1 3.61Å; L278-L302 HydrophobicContact CD1-CD2 4.25Å; L278-L302 HydrophobicContact CD1-CG 3.55Å; H299-L302 PolarHBondContact O-N 3.35Å; L302-E304 PolarHBondContact O-N 3.48Å; L302-E304 VanDerWaalsContact O-N 3.16Å
303	F	87.8	Confident	89	Confident	74 Å²	74	61.4 Å²	61.4	33%	0.325	31%	0.31	S	S	.	.			trans	-63.4	116	-176	-173.8	-98.6	0	0	0	110.9	F298 H299 V305 I379	F298-F303 AromaticContact CD1-CD2 3.69Å; F298-F303 HydrophobicContact CD1-CD2 3.69Å; F298-F303 AromaticContact CD1-CE2 3.62Å; F298-F303 HydrophobicContact CD1-CE2 3.62Å; F298-F303 HydrophobicContact CE1-CD2 4.32Å; F298-F303 AromaticContact CE1-CE2 3.86Å; F298-F303 HydrophobicContact CE1-CE2 3.86Å; F298-F303 HydrophobicContact CG-CD2 4.4Å; H299-F303 WeakPolarHBondContact O-CB 3.45Å; H299-F303 PolarHBondContact O-N 2.84Å; F303-V305 HydrophobicContact CE1-CG2 3.76Å; F303-V305 HydrophobicContact CZ-CG2 4.25Å; F303-I379 HydrophobicContact CD2-CD1 3.52Å; F303-I379 HydrophobicContact CE2-CD1 3.75Å
304	E	79.4	Confident	88.5	Confident	117 Å²	117	62.2 Å²	62.2	55%	0.547	31%	0.314	S	S	.	.			trans	-126.3	131.6	171.5	-68.7	-176	-176.2	0	0	108	K152 L302 P306	K152-E304 WeakPolarHBondContact CD-OE1 3.29Å; K152-E304 IonicContact NZ-OE1 3.53Å; K152-E304 PolarHBondContact NZ-OE1 3.09Å; L302-E304 PolarHBondContact O-N 3.48Å; L302-E304 VanDerWaalsContact O-N 3.16Å; E304-P306 VanDerWaalsContact O-CD 3.31Å; E304-P306 WeakPolarHBondContact O-CD 3.37Å
305	V	80.6	Confident	88.1	Confident	115 Å²	115	62.1 Å²	62.1	70%	0.697	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-72.6	120.5	175.4	179.6	0	0	0	0	107.6	F303 S307	F303-V305 HydrophobicContact CE1-CG2 3.76Å; F303-V305 HydrophobicContact CZ-CG2 4.25Å; V305-S307 PolarHBondContact O-N 2.99Å
306	P	81.3	Confident	87.6	Confident	36 Å²	36	62.3 Å²	62.3	23%	0.234	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-56	134.9	175.6	-25.6	35.7	0	0	0	110.4	E304 L310 L377 F380	E304-P306 VanDerWaalsContact O-CD 3.31Å; E304-P306 WeakPolarHBondContact O-CD 3.37Å; P306-L310 HydrophobicContact CB-CD2 4.12Å; P306-L377 HydrophobicContact CB-CD2 3.69Å; P306-L377 HydrophobicContact CG-CD2 3.5Å; P306-L377 VanDerWaalsContact CG-CD2 3.5Å; P306-F380 HydrophobicContact CG-CE2 3.82Å
307	S	84.6	Confident	86.9	Confident	61 Å²	61	64.3 Å²	64.3	43%	0.427	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-60.6	149.8	172.3	72.5	0	0	0	0	110.3	V305 R309 L310 L311	V305-S307 PolarHBondContact O-N 2.99Å; S307-R309 PolarHBondContact O-N 3.25Å; S307-R309 VanDerWaalsContact O-N 3.16Å; S307-L310 PolarHBondContact O-N 3.38Å; S307-L310 PolarHBondContact OG-N 3.37Å; S307-L310 VanDerWaalsContact OG-N 3.16Å; S307-L311 PolarHBondContact O-N 3Å
308	L	85.2	Confident	86.2	Confident	140 Å²	140	70.1 Å²	70.1	73%	0.733	35%	0.347	S	S	*	.	H	α-helix	trans	-53.8	-35.4	173.5	-71.1	173	0	0	0	111.7	L311 C312	L308-L311 PolarHBondContact O-N 3.48Å; L308-C312 PolarHBondContact O-N 2.94Å; L308-C312 PolarHBondContact O-SG 3.29Å
309	R	85.1	Confident	85.3	Confident	129 Å²	129	70 Å²	70	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-47.3	175.4	-63.8	-174.6	-171	121	0.9	112.2	S307 L311 C312 C313 M366	S307-R309 PolarHBondContact O-N 3.25Å; S307-R309 VanDerWaalsContact O-N 3.16Å; R309-L311 VanDerWaalsContact C-N 3.31Å; R309-L311 PolarHBondContact O-N 3.26Å; R309-C312 PolarHBondContact O-N 3.06Å; R309-C313 PolarHBondContact O-N 3.43Å; R309-C313 PolarHBondContact O-SG 3.19Å; R309-M366 HydrophobicContact CB-SD 4.33Å
310	L	86	Confident	83.7	Confident	25 Å²	25	74.1 Å²	74.1	13%	0.131	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-41.1	177.8	176.3	58.8	0	0	0	110.8	P306 S307 C313 H314 V370 Y375 L377	P306-L310 HydrophobicContact CB-CD2 4.12Å; S307-L310 PolarHBondContact O-N 3.38Å; S307-L310 PolarHBondContact OG-N 3.37Å; S307-L310 VanDerWaalsContact OG-N 3.16Å; L310-C313 PolarHBondContact O-N 3.27Å; L310-H314 PolarHBondContact O-CD2 2.79Å; L310-H314 PolarHBondContact O-N 3.06Å; L310-V370 HydrophobicContact CD1-CG2 3.51Å; L310-Y375 VanDerWaalsContact CD1-CB 3.45Å; L310-Y375 HydrophobicContact CD1-CG 4.13Å; L310-L377 HydrophobicContact CD2-CD2 4.42Å; L310-L377 HydrophobicContact CG-CD2 4.49Å
311	L	85.4	Confident	81.9	Confident	82 Å²	82	69.6 Å²	69.6	43%	0.429	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.9	-170.6	63.5	0	0	0	111.5	S307 L308 R309 C313 H314 T315 L377	S307-L311 PolarHBondContact O-N 3Å; L308-L311 PolarHBondContact O-N 3.48Å; R309-L311 VanDerWaalsContact C-N 3.31Å; R309-L311 PolarHBondContact O-N 3.26Å; L311-C313 PolarHBondContact O-N 3.39Å; L311-H314 WeakPolarHBondContact O-CB 3.48Å; L311-H314 PolarHBondContact O-N 3.18Å; L311-T315 PolarHBondContact O-N 3.2Å; L311-L377 HydrophobicContact CD1-CD1 3.81Å
312	C	86	Confident	79.9	Confident	69 Å²	69	71.6 Å²	71.6	47%	0.466	39%	0.393	S	S	.	.	H	α-helix	trans	-61.7	-39.2	174.5	-65.6	0	0	0	0	112.6	L308 R309 H314 T315 L316	L308-C312 PolarHBondContact O-N 2.94Å; L308-C312 PolarHBondContact O-SG 3.29Å; R309-C312 PolarHBondContact O-N 3.06Å; C312-H314 VanDerWaalsContact C-N 3.3Å; C312-H314 PolarHBondContact O-N 3.36Å; C312-T315 WeakPolarHBondContact CA-OG1 3.48Å; C312-T315 PolarHBondContact O-N 2.77Å; C312-T315 PolarHBondContact O-OG1 3.39Å; C312-L316 VanDerWaalsContact O-CG 3.29Å; C312-L316 WeakPolarHBondContact O-CG 3.41Å; C312-L316 PolarHBondContact O-N 2.79Å
313	C	86.1	Confident	77.9	Confident	1 Å²	1	75 Å²	75	1%	0.007	42%	0.422	C	S	.	.	H	α-helix	trans	-62.9	-39.4	175.2	-64.3	0	0	0	0	111.2	R309 L310 L311 T315 L316 V317 M366 I367 V370	R309-C313 PolarHBondContact O-N 3.43Å; R309-C313 PolarHBondContact O-SG 3.19Å; L310-C313 PolarHBondContact O-N 3.27Å; L311-C313 PolarHBondContact O-N 3.39Å; C313-T315 PolarHBondContact O-N 2.78Å; C313-L316 PolarHBondContact O-N 2.87Å; C313-V317 WeakPolarHBondContact O-CG2 3.46Å; C313-V317 PolarHBondContact O-N 3.33Å; C313-M366 VanDerWaalsContact SG-SD 3.69Å; C313-I367 HydrophobicContact CB-CG1 4.26Å; C313-V370 HydrophobicContact CB-CB 4.34Å; C313-V370 HydrophobicContact CB-CG2 3.71Å
314	H	85.5	Confident	76.1	Confident	18 Å²	18	79 Å²	79	8%	0.083	45%	0.447	C	S	.	.	H	α-helix	trans	-65.8	-33.6	174.8	-90.2	-91.5	0	0	0	113.6	L310 L311 C312 R318 Y375 L377	L310-H314 PolarHBondContact O-CD2 2.79Å; L310-H314 PolarHBondContact O-N 3.06Å; L311-H314 WeakPolarHBondContact O-CB 3.48Å; L311-H314 PolarHBondContact O-N 3.18Å; C312-H314 VanDerWaalsContact C-N 3.3Å; C312-H314 PolarHBondContact O-N 3.36Å; H314-R318 VanDerWaalsContact O-CG 3.25Å; H314-R318 WeakPolarHBondContact O-CG 3.31Å; H314-R318 PolarHBondContact O-N 3.39Å; H314-Y375 PolarHBondContact CE1-O 3.24Å; H314-Y375 PolarHBondContact NE2-O 3.33Å; H314-L377 HydrophobicContact CB-CD1 3.69Å; H314-L377 VanDerWaalsContact CG-CD1 3.42Å
315	T	85.4	Confident	74.5	Confident	70 Å²	70	76.1 Å²	76.1	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-70.4	-44.6	174.2	54.8	0	0	0	0	110.6	L311 C312 C313 V317 R318 D319	L311-T315 PolarHBondContact O-N 3.2Å; C312-T315 WeakPolarHBondContact CA-OG1 3.48Å; C312-T315 PolarHBondContact O-N 2.77Å; C312-T315 PolarHBondContact O-OG1 3.39Å; C313-T315 PolarHBondContact O-N 2.78Å; T315-V317 VanDerWaalsContact C-N 3.34Å; T315-V317 PolarHBondContact O-N 3.38Å; T315-R318 PolarHBondContact O-N 3.41Å; T315-D319 PolarHBondContact O-N 3.21Å
316	L	84	Confident	72.9	Confident	51 Å²	51	78.1 Å²	78.1	27%	0.267	45%	0.446	S	S	.	.	H	α-helix	trans	-60.3	-40	177.4	-70.5	171.4	0	0	0	112.9	C312 C313 R318 C322 I367	C312-L316 VanDerWaalsContact O-CG 3.29Å; C312-L316 WeakPolarHBondContact O-CG 3.41Å; C312-L316 PolarHBondContact O-N 2.79Å; C313-L316 PolarHBondContact O-N 2.87Å; L316-R318 VanDerWaalsContact C-N 3.34Å; L316-C322 HydrophobicContact CD2-CB 3.94Å; L316-I367 HydrophobicContact CD1-CD1 4.04Å
317	V	81.6	Confident	71.2	Confident	43 Å²	43	80.3 Å²	80.3	26%	0.261	46%	0.459	S	S	.	.	H	α-helix	trans	-71.7	-27.8	178.7	170.5	0	0	0	0	112.6	C313 T315 I367 V370 R371	C313-V317 WeakPolarHBondContact O-CG2 3.46Å; C313-V317 PolarHBondContact O-N 3.33Å; T315-V317 VanDerWaalsContact C-N 3.34Å; T315-V317 PolarHBondContact O-N 3.38Å; V317-I367 HydrophobicContact CG2-CG2 3.81Å; V317-V370 HydrophobicContact CB-CG1 4.25Å; V317-V370 HydrophobicContact CG2-CB 4.35Å; V317-V370 HydrophobicContact CG2-CG1 3.93Å; V317-R371 HydrophobicContact CG1-CB 4.26Å; V317-R371 HydrophobicContact CG2-CB 4.35Å
318	R	77.2	Confident	69.4	Low	127 Å²	127	87.8 Å²	87.8	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-81.5	-36.9	179.6	-74.8	177.7	-170.6	-172.2	7.1	112.7	H314 T315 L316 S320	H314-R318 VanDerWaalsContact O-CG 3.25Å; H314-R318 WeakPolarHBondContact O-CG 3.31Å; H314-R318 PolarHBondContact O-N 3.39Å; T315-R318 PolarHBondContact O-N 3.41Å; L316-R318 VanDerWaalsContact C-N 3.34Å; R318-S320 PolarHBondContact O-N 3.42Å
319	D	74.6	Confident	67.6	Low	90 Å²	90	85.8 Å²	85.8	48%	0.481	47%	0.466	S	S	.	.			trans	-94	89.8	-177.5	-66	-23.6	0	0	0	109.2	T315 S321 C322	T315-D319 PolarHBondContact O-N 3.21Å; D319-S321 PolarHBondContact O-N 2.82Å; D319-C322 HydrophobicContact CB-CB 4.4Å; D319-C322 WeakPolarHBondContact O-CB 3.27Å; D319-C322 PolarHBondContact O-N 2.89Å
320	S	61	Low	65.8	Low	103 Å²	103	83.5 Å²	83.5	72%	0.72	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-54.8	-23.7	176.2	-51.9	0	0	0	0	113.1	R318 C322 A323	R318-S320 PolarHBondContact O-N 3.42Å; S320-C322 PolarHBondContact O-N 2.93Å; S320-A323 WeakPolarHBondContact O-CB 3.14Å; S320-A323 PolarHBondContact O-N 2.92Å
321	S	57.2	Low	64	Low	104 Å²	104	87.3 Å²	87.3	73%	0.727	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.5	174.7	57.8	0	0	0	0	114	D319	D319-S321 PolarHBondContact O-N 2.82Å
322	C	51.6	Low	62.3	Low	45 Å²	45	86.2 Å²	86.2	30%	0.304	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-87.6	-11.3	177.8	-130.6	0	0	0	0	112.6	L316 D319 S320 D324 S325	L316-C322 HydrophobicContact CD2-CB 3.94Å; D319-C322 HydrophobicContact CB-CB 4.4Å; D319-C322 WeakPolarHBondContact O-CB 3.27Å; D319-C322 PolarHBondContact O-N 2.89Å; S320-C322 PolarHBondContact O-N 2.93Å; C322-D324 VanDerWaalsContact C-N 3.35Å; C322-S325 PolarHBondContact O-OG 2.99Å
323	A	51.5	Low	60.5	Low	76 Å²	76	93.4 Å²	93.4	63%	0.628	52%	0.522	S	S	*	.	S	Bend	trans	-75.2	-24.9	179.7	0	0	0	0	0	112.9	S320	S320-A323 WeakPolarHBondContact O-CB 3.14Å; S320-A323 PolarHBondContact O-N 2.92Å
324	D	49.3	Very low	59.2	Low	157 Å²	157	94.7 Å²	94.7	84%	0.84	54%	0.535	S	S	*	.	S	Bend	trans	-96.5	-17.4	-176.4	-131	12.6	0	0	0	113.1	C322 D326	C322-D324 VanDerWaalsContact C-N 3.35Å; D324-D326 PolarHBondContact O-N 3.24Å
325	S	45	Very low	58.2	Low	57 Å²	57	99.1 Å²	99.1	40%	0.399	56%	0.559	S	S	.	*	S	Bend	trans	-73.5	108.5	156.2	52.8	0	0	0	0	106.7	C322 V327	C322-S325 PolarHBondContact O-OG 2.99Å; S325-V327 PolarHBondContact O-N 3.5Å
326	D	46.7	Very low	57.6	Low	156 Å²	156	103.3 Å²	103.3	83%	0.834	57%	0.572	S	S	*	*			trans	-45.7	83	147.4	-82.8	-38.6	0	0	0	107.2	D324 R328	D324-D326 PolarHBondContact O-N 3.24Å; D326-R328 PolarHBondContact O-N 2.8Å
327	V	47.3	Very low	57.3	Low	82 Å²	82	105.9 Å²	105.9	50%	0.497	58%	0.582	S	S	.	*			trans	-63	98.4	158.3	-178.8	0	0	0	0	100.3	S325 I329	S325-V327 PolarHBondContact O-N 3.5Å; V327-I329 HydrophobicContact CG1-CD1 4.38Å; V327-I329 HydrophobicContact CG1-CG1 4.02Å; V327-I329 PolarHBondContact O-N 2.99Å
328	R	46	Very low	57.2	Low	219 Å²	219	111.4 Å²	111.4	83%	0.826	60%	0.598	S	S	*	*			trans	-54.3	72.6	164.8	-67.1	173.6	178.5	164.5	-0.9	107.1	D326 S330	D326-R328 PolarHBondContact O-N 2.8Å; R328-S330 PolarHBondContact O-N 2.98Å
329	I	46.6	Very low	57.5	Low	97 Å²	97	109.2 Å²	109.2	50%	0.497	60%	0.595	S	S	.	*			trans	-74.8	65.2	141.2	-51.8	147.7	0	0	0	102.1	V327 S331 L363	V327-I329 HydrophobicContact CG1-CD1 4.38Å; V327-I329 HydrophobicContact CG1-CG1 4.02Å; V327-I329 PolarHBondContact O-N 2.99Å; I329-S331 PolarHBondContact O-N 2.87Å; I329-L363 HydrophobicContact CD1-CD2 3.14Å; I329-L363 HydrophobicContact CD1-CG 4.47Å; I329-L363 HydrophobicContact CG1-CD2 4.28Å
330	S	47.5	Very low	57.8	Low	81 Å²	81	109.2 Å²	109.2	57%	0.566	60%	0.595	S	S	*	*			trans	-49.8	110.7	147.5	34.5	0	0	0	0	102.6	R328 S332	R328-S330 PolarHBondContact O-N 2.98Å; S330-S332 WeakPolarHBondContact O-CA 3.45Å; S330-S332 PolarHBondContact O-N 3.03Å
331	S	47.7	Very low	58.9	Low	106 Å²	106	106.8 Å²	106.8	74%	0.741	58%	0.581	S	S	*	*			trans	-47.1	96.6	152.9	63	0	0	0	0	102.8	I329 K333	I329-S331 PolarHBondContact O-N 2.87Å; S331-K333 VanDerWaalsContact C-N 3.32Å; S331-K333 PolarHBondContact O-N 2.86Å
332	S	50	Low	60.3	Low	58 Å²	58	107.3 Å²	107.3	41%	0.406	57%	0.572	S	S	.	*			trans	-68.6	112.6	-169.3	55.5	0	0	0	0	101.4	S330 G334 Q355	S330-S332 WeakPolarHBondContact O-CA 3.45Å; S330-S332 PolarHBondContact O-N 3.03Å; S332-G334 PolarHBondContact O-N 3.12Å; S332-Q355 PolarHBondContact OG-NE2 2.91Å
333	K	49.5	Very low	61.8	Low	221 Å²	221	109.1 Å²	109.1	96%	0.961	58%	0.581	S	S	*	*			trans	-60.9	43.1	143.2	-67.3	-177.2	176.9	177.9	0	108.9	S331	S331-K333 VanDerWaalsContact C-N 3.32Å; S331-K333 PolarHBondContact O-N 2.86Å
334	G	57.5	Low	63.4	Low	28 Å²	28	110.4 Å²	110.4	29%	0.289	58%	0.581	S	S	.	*			trans	-82.6	146.2	173.3	0	0	0	0	0	106.5	S332 K336	S332-G334 PolarHBondContact O-N 3.12Å; G334-K336 PolarHBondContact O-N 3.06Å; G334-K336 VanDerWaalsContact O-N 3.1Å
335	D	65.7	Low	65	Low	110 Å²	110	107.3 Å²	107.3	59%	0.588	56%	0.562	S	S	*	*			trans	-49.1	116.9	-176.8	-166.3	-6.5	0	0	0	110.5	E337 R338	D335-E337 PolarHBondContact O-N 2.67Å; D335-E337 WeakPolarHBondContact OD1-CB 3.41Å; D335-E337 PolarHBondContact OD1-N 3.17Å; D335-R338 HydrophobicContact CB-CB 4.38Å; D335-R338 WeakPolarHBondContact O-CB 3.33Å; D335-R338 PolarHBondContact O-N 2.71Å
336	K	72.5	Confident	67	Low	159 Å²	159	111.2 Å²	111.2	69%	0.691	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-23.9	179	-73.2	-173.3	177.2	-176.2	0	111.4	G334 R354 G356	G334-K336 PolarHBondContact O-N 3.06Å; G334-K336 VanDerWaalsContact O-N 3.1Å; K336-R354 WeakPolarHBondContact O-CB 3.5Å; K336-G356 PolarHBondContact O-N 2.88Å
337	E	76.8	Confident	68.8	Low	104 Å²	104	109.1 Å²	109.1	49%	0.486	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	-8.7	179.4	-61.7	-65.4	112.7	0	0	113.6	D335 I339 R354	D335-E337 PolarHBondContact O-N 2.67Å; D335-E337 WeakPolarHBondContact OD1-CB 3.41Å; D335-E337 PolarHBondContact OD1-N 3.17Å; E337-I339 PolarHBondContact O-N 2.96Å; E337-I339 VanDerWaalsContact O-N 3.08Å; E337-R354 IonicContact OE1-NH1 2.83Å; E337-R354 PolarHBondContact OE1-NH1 3.47Å; E337-R354 VanDerWaalsContact OE1-NH1 3.15Å; E337-R354 IonicContact OE2-CZ 3.47Å; E337-R354 IonicContact OE2-NH1 2.86Å; E337-R354 PolarHBondContact OE2-NH1 3.44Å; E337-R354 IonicContact OE2-NH2 3.47Å; E337-R354 PolarHBondContact OE2-NH2 2.85Å
338	R	80.5	Confident	70.5	Confident	160 Å²	160	107.7 Å²	107.7	60%	0.604	58%	0.579	S	S	*	*			trans	-60.8	116.2	179.2	-176.2	178.7	179.8	-179.8	1.1	110	D335 L340 R354 Q355	D335-R338 HydrophobicContact CB-CB 4.38Å; D335-R338 WeakPolarHBondContact O-CB 3.33Å; D335-R338 PolarHBondContact O-N 2.71Å; R338-L340 PolarHBondContact O-N 3.35Å; R338-R354 CarbonylContact O-C 3.59Å; R338-R354 WeakPolarHBondContact O-CA 3.36Å; R338-Q355 HydrophobicContact CB-CB 4.3Å; R338-Q355 PolarHBondContact O-N 3.25Å
339	I	82.2	Confident	72.2	Confident	80 Å²	80	101 Å²	101	41%	0.41	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.8	119.5	174.5	-57.4	175.2	0	0	0	108.3	E337 A341 E342 P352 R354	E337-I339 PolarHBondContact O-N 2.96Å; E337-I339 VanDerWaalsContact O-N 3.08Å; I339-A341 WeakPolarHBondContact CG2-O 2.92Å; I339-E342 HydrophobicContact CG2-CG 3.81Å; I339-P352 HydrophobicContact CD1-CB 3.92Å; I339-P352 HydrophobicContact CG1-CB 3.97Å; I339-P352 HydrophobicContact CG2-CB 3.87Å; I339-R354 HydrophobicContact CG1-CG 4.46Å
340	L	81.6	Confident	73.9	Confident	90 Å²	90	99.5 Å²	99.5	47%	0.471	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.1	-34.4	176.2	-65.6	179.4	0	0	0	111.7	R338 C353 Q355 V358	R338-L340 PolarHBondContact O-N 3.35Å; L340-C353 PolarHBondContact N-O 2.95Å; L340-Q355 HydrophobicContact CD1-CB 4.21Å; L340-Q355 HydrophobicContact CD2-CB 4.4Å; L340-Q355 HydrophobicContact CG-CB 4.19Å; L340-V358 HydrophobicContact CD1-CG2 3.74Å
341	A	84.2	Confident	75.7	Confident	53 Å²	53	98 Å²	98	44%	0.438	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	159	177.9	0	0	0	0	0	110.6	I339 C353	I339-A341 WeakPolarHBondContact CG2-O 2.92Å; A341-C353 PolarHBondContact N-O 3.08Å; A341-C353 PolarHBondContact O-N 3.29Å
342	E	85.6	Confident	77.5	Confident	115 Å²	115	95.4 Å²	95.4	54%	0.537	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.6	171	-67.1	-174.3	171.3	0	0	110	I339 P352	I339-E342 HydrophobicContact CG2-CG 3.81Å; E342-P352 HydrophobicContact CG-CB 4.26Å
343	V	85	Confident	78.9	Confident	82 Å²	82	95.1 Å²	95.1	50%	0.497	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.8	173	-179.1	0	0	0	0	108.7	P350 S351	V343-P350 WeakPolarHBondContact O-CA 3.4Å; V343-S351 PolarHBondContact N-O 2.9Å; V343-S351 PolarHBondContact O-N 2.78Å
344	V	84.9	Confident	80.5	Confident	103 Å²	103	88.8 Å²	88.8	62%	0.624	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.7	174.3	-174.9	0	0	0	0	108.6
345	H	82.8	Confident	81.4	Confident	93 Å²	93	89.5 Å²	89.5	43%	0.431	49%	0.493	S	S	.	.			trans	-76.5	166.8	177.1	-68.4	-78.8	0	0	0	111.6	N347 G348 V349 S351	H345-N347 VanDerWaalsContact CB-OD1 3.26Å; H345-N347 WeakPolarHBondContact CB-OD1 2.99Å; H345-N347 PolarHBondContact O-N 3.39Å; H345-G348 PolarHBondContact O-N 3.43Å; H345-V349 PolarHBondContact N-O 2.95Å; H345-S351 PolarHBondContact CD2-OG 2.85Å; H345-S351 WeakPolarHBondContact NE2-CB 3.39Å; H345-S351 PolarHBondContact NE2-OG 3.19Å
346	S	85.3	Confident	81.5	Confident	138 Å²	138	86.4 Å²	86.4	97%	0.965	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.1	-179.4	55	0	0	0	0	114.4	G348	S346-G348 VanDerWaalsContact C-N 3.3Å
347	N	85.6	Confident	81.5	Confident	112 Å²	112	83.9 Å²	83.9	60%	0.599	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.3	173.2	63.9	-1	0	0	0	113.5	H345 V349	H345-N347 VanDerWaalsContact CB-OD1 3.26Å; H345-N347 WeakPolarHBondContact CB-OD1 2.99Å; H345-N347 PolarHBondContact O-N 3.39Å; N347-V349 PolarHBondContact O-N 2.79Å; N347-V349 PolarHBondContact OD1-N 3.42Å; N347-V349 VanDerWaalsContact OD1-N 3.12Å
348	G	82.3	Confident	81.1	Confident	52 Å²	52	81.8 Å²	81.8	54%	0.536	48%	0.475	S	S	.	.	S	Bend	trans	76.7	2.4	-179.9	0	0	0	0	0	114.9	H345 S346 P350	H345-G348 PolarHBondContact O-N 3.43Å; S346-G348 VanDerWaalsContact C-N 3.3Å; G348-P350 WeakPolarHBondContact O-CD 3.31Å
349	V	82.4	Confident	80.5	Confident	80 Å²	80	77.8 Å²	77.8	49%	0.485	48%	0.476	S	S	.	.			trans	-87.4	117.3	-179.6	-176	0	0	0	0	109.3	H345 N347	H345-V349 PolarHBondContact N-O 2.95Å; N347-V349 PolarHBondContact O-N 2.79Å; N347-V349 PolarHBondContact OD1-N 3.42Å; N347-V349 VanDerWaalsContact OD1-N 3.12Å
350	P	82.2	Confident	79.6	Confident	65 Å²	65	79.2 Å²	79.2	42%	0.422	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	132.1	173.3	27.6	-31.3	0	0	0	110	V343 G348	V343-P350 WeakPolarHBondContact O-CA 3.4Å; G348-P350 WeakPolarHBondContact O-CD 3.31Å
351	S	84.7	Confident	78.9	Confident	49 Å²	49	78 Å²	78	34%	0.343	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	107.9	172.5	-66.8	0	0	0	0	109.1	V343 H345	V343-S351 PolarHBondContact N-O 2.9Å; V343-S351 PolarHBondContact O-N 2.78Å; H345-S351 PolarHBondContact CD2-OG 2.85Å; H345-S351 WeakPolarHBondContact NE2-CB 3.39Å; H345-S351 PolarHBondContact NE2-OG 3.19Å
352	P	85.9	Confident	78.5	Confident	52 Å²	52	80 Å²	80	34%	0.338	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133.7	-179.6	29.2	-33	0	0	0	110.8	I339 E342	I339-P352 HydrophobicContact CD1-CB 3.92Å; I339-P352 HydrophobicContact CG1-CB 3.97Å; I339-P352 HydrophobicContact CG2-CB 3.87Å; E342-P352 HydrophobicContact CG-CB 4.26Å
353	C	80.6	Confident	78.2	Confident	51 Å²	51	76.5 Å²	76.5	35%	0.345	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.6	166.1	179.7	0	0	0	0	107.8	L340 A341	L340-C353 PolarHBondContact N-O 2.95Å; A341-C353 PolarHBondContact N-O 3.08Å; A341-C353 PolarHBondContact O-N 3.29Å
354	R	82.9	Confident	77.9	Confident	88 Å²	88	78.5 Å²	78.5	33%	0.332	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	160.4	-176.4	-60.9	171.7	173.3	-163.5	-11.6	110.8	K336 E337 R338 I339 G356 D357	K336-R354 WeakPolarHBondContact O-CB 3.5Å; E337-R354 IonicContact OE1-NH1 2.83Å; E337-R354 PolarHBondContact OE1-NH1 3.47Å; E337-R354 VanDerWaalsContact OE1-NH1 3.15Å; E337-R354 IonicContact OE2-CZ 3.47Å; E337-R354 IonicContact OE2-NH1 2.86Å; E337-R354 PolarHBondContact OE2-NH1 3.44Å; E337-R354 IonicContact OE2-NH2 3.47Å; E337-R354 PolarHBondContact OE2-NH2 2.85Å; R338-R354 CarbonylContact O-C 3.59Å; R338-R354 WeakPolarHBondContact O-CA 3.36Å; I339-R354 HydrophobicContact CG1-CG 4.46Å; R354-G356 PolarHBondContact O-N 2.91Å; R354-D357 WeakPolarHBondContact CB-OD2 3.45Å; R354-D357 PolarHBondContact N-OD2 3.02Å; R354-D357 WeakPolarHBondContact O-CB 3.25Å; R354-D357 PolarHBondContact O-N 3.32Å
355	Q	74.8	Confident	77.8	Confident	44 Å²	44	79.3 Å²	79.3	21%	0.206	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-58.5	-34.6	175.8	-176.7	158.1	45.5	0	0	112.4	S332 R338 L340 D357 V358	S332-Q355 PolarHBondContact OG-NE2 2.91Å; R338-Q355 HydrophobicContact CB-CB 4.3Å; R338-Q355 PolarHBondContact O-N 3.25Å; L340-Q355 HydrophobicContact CD1-CB 4.21Å; L340-Q355 HydrophobicContact CD2-CB 4.4Å; L340-Q355 HydrophobicContact CG-CB 4.19Å; Q355-D357 VanDerWaalsContact C-N 3.25Å; Q355-D357 PolarHBondContact O-N 2.79Å; Q355-V358 PolarHBondContact O-N 3.07Å
356	G	69	Low	77.9	Confident	45 Å²	45	76.8 Å²	76.8	46%	0.464	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-67.1	-19.2	173.9	0	0	0	0	0	115.2	K336 R354 V358	K336-G356 PolarHBondContact O-N 2.88Å; R354-G356 PolarHBondContact O-N 2.91Å; G356-V358 VanDerWaalsContact C-N 3.33Å
357	D	72.7	Confident	77.9	Confident	106 Å²	106	71.9 Å²	71.9	57%	0.567	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-81.7	-15.7	179.9	-57.4	-33.3	0	0	0	112.1	R354 Q355 A359	R354-D357 WeakPolarHBondContact CB-OD2 3.45Å; R354-D357 PolarHBondContact N-OD2 3.02Å; R354-D357 WeakPolarHBondContact O-CB 3.25Å; R354-D357 PolarHBondContact O-N 3.32Å; Q355-D357 VanDerWaalsContact C-N 3.25Å; Q355-D357 PolarHBondContact O-N 2.79Å; D357-A359 PolarHBondContact O-N 3.41Å
358	V	68.1	Low	77.8	Confident	60 Å²	60	70.5 Å²	70.5	36%	0.364	43%	0.429	S	S	.	.	S	Bend	trans	-81.2	113.2	177.3	-174.3	0	0	0	0	108.6	L340 Q355 G356 A360	L340-V358 HydrophobicContact CD1-CG2 3.74Å; Q355-V358 PolarHBondContact O-N 3.07Å; G356-V358 VanDerWaalsContact C-N 3.33Å; V358-A360 PolarHBondContact O-N 2.96Å
359	A	66.8	Low	77.9	Confident	76 Å²	76	69.4 Å²	69.4	63%	0.628	41%	0.41	S	S	*	.			trans	-49.6	129.4	174.9	0	0	0	0	0	110.5	D357 V361	D357-A359 PolarHBondContact O-N 3.41Å; A359-V361 PolarHBondContact O-N 2.97Å
360	A	64.7	Low	78	Confident	110 Å²	110	66 Å²	66	91%	0.909	39%	0.39	S	S	*	.			trans	-61.3	108	172.1	0	0	0	0	0	107.9	V358	V358-A360 PolarHBondContact O-N 2.96Å
361	V	65.9	Low	78.1	Confident	63 Å²	63	70.2 Å²	70.2	38%	0.382	40%	0.397	S	S	.	.			trans	-97.2	126	174.2	-179.9	0	0	0	0	106.6	A359 L363 M366	A359-V361 PolarHBondContact O-N 2.97Å; V361-L363 VanDerWaalsContact C-N 3.29Å; V361-L363 PolarHBondContact O-N 3.25Å; V361-M366 HydrophobicContact CG1-CE 3.55Å
362	D	76.5	Confident	77.9	Confident	97 Å²	97	72 Å²	72	52%	0.519	40%	0.403	S	S	.	.			trans	-68.2	92.2	166.7	-173.7	-15.7	0	0	0	107.9	D364 K365 M366	D362-D364 VanDerWaalsContact C-N 3.34Å; D362-D364 PolarHBondContact OD1-N 2.75Å; D362-K365 HydrophobicContact CB-CB 3.93Å; D362-K365 WeakPolarHBondContact OD1-CB 3.4Å; D362-K365 PolarHBondContact OD1-N 3.47Å; D362-K365 WeakPolarHBondContact OD2-CB 3.24Å; D362-M366 PolarHBondContact O-N 2.83Å; D362-M366 VanDerWaalsContact O-N 3.07Å
363	L	78.3	Confident	77.5	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.209	40%	0.401	C	S	.	.	H	α-helix	trans	-70.8	-34.9	-175.6	-165.7	75.9	0	0	0	110.9	I329 V361 K365 M366 I367	I329-L363 HydrophobicContact CD1-CD2 3.14Å; I329-L363 HydrophobicContact CD1-CG 4.47Å; I329-L363 HydrophobicContact CG1-CD2 4.28Å; V361-L363 VanDerWaalsContact C-N 3.29Å; V361-L363 PolarHBondContact O-N 3.25Å; L363-K365 VanDerWaalsContact C-N 3.3Å; L363-K365 PolarHBondContact O-N 2.77Å; L363-M366 HydrophobicContact CD1-SD 4.48Å; L363-M366 CarbonylContact O-C 3.59Å; L363-M366 WeakPolarHBondContact O-CA 3.34Å; L363-M366 WeakPolarHBondContact O-CB 3.43Å; L363-M366 PolarHBondContact O-N 3.21Å; L363-I367 HydrophobicContact CD2-CD1 4Å; L363-I367 HydrophobicContact CG-CD1 3.95Å; L363-I367 HydrophobicContact CG-CG1 4.25Å; L363-I367 WeakPolarHBondContact O-CG1 3.42Å; L363-I367 PolarHBondContact O-N 2.83Å
364	D	79.5	Confident	77.4	Confident	124 Å²	124	69.9 Å²	69.9	66%	0.663	39%	0.392	S	S	*	.	H	α-helix	trans	-59.8	-46.7	177	-61.7	-32.8	0	0	0	109.7	D362 M366 I367 E368	D362-D364 VanDerWaalsContact C-N 3.34Å; D362-D364 PolarHBondContact OD1-N 2.75Å; D364-M366 VanDerWaalsContact C-N 3.33Å; D364-M366 PolarHBondContact O-N 2.83Å; D364-I367 PolarHBondContact O-N 2.78Å; D364-E368 WeakPolarHBondContact O-CB 3.49Å; D364-E368 PolarHBondContact O-N 3.39Å
365	K	83.9	Confident	77.2	Confident	121 Å²	121	70.9 Å²	70.9	53%	0.526	40%	0.396	S	S	.	.	H	α-helix	trans	-59.6	-41.5	171.4	-175.4	-176.2	177.9	-172.4	0	112.5	D362 L363 E368 D369	D362-K365 HydrophobicContact CB-CB 3.93Å; D362-K365 WeakPolarHBondContact OD1-CB 3.4Å; D362-K365 PolarHBondContact OD1-N 3.47Å; D362-K365 WeakPolarHBondContact OD2-CB 3.24Å; L363-K365 VanDerWaalsContact C-N 3.3Å; L363-K365 PolarHBondContact O-N 2.77Å; K365-E368 PolarHBondContact O-N 3.37Å; K365-D369 VanDerWaalsContact O-CB 3.25Å; K365-D369 WeakPolarHBondContact O-CB 3.47Å; K365-D369 PolarHBondContact O-N 3.47Å
366	M	83.6	Confident	77.2	Confident	40 Å²	40	70.6 Å²	70.6	20%	0.197	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-41.4	178.7	-172.2	174.8	-69.9	0	0	112.3	R309 C313 V361 D362 L363 D364 D369 V370	R309-M366 HydrophobicContact CB-SD 4.33Å; C313-M366 VanDerWaalsContact SG-SD 3.69Å; V361-M366 HydrophobicContact CG1-CE 3.55Å; D362-M366 PolarHBondContact O-N 2.83Å; D362-M366 VanDerWaalsContact O-N 3.07Å; L363-M366 HydrophobicContact CD1-SD 4.48Å; L363-M366 CarbonylContact O-C 3.59Å; L363-M366 WeakPolarHBondContact O-CA 3.34Å; L363-M366 WeakPolarHBondContact O-CB 3.43Å; L363-M366 PolarHBondContact O-N 3.21Å; D364-M366 VanDerWaalsContact C-N 3.33Å; D364-M366 PolarHBondContact O-N 2.83Å; M366-D369 PolarHBondContact O-N 3.37Å; M366-V370 VanDerWaalsContact O-CG2 3.3Å; M366-V370 WeakPolarHBondContact O-CG2 3.33Å; M366-V370 PolarHBondContact O-N 3.26Å
367	I	85.3	Confident	77.6	Confident	35 Å²	35	69 Å²	69	18%	0.179	38%	0.379	C	S	.	.	H	α-helix	trans	-63.7	-44.2	176.6	-70.4	167.8	0	0	0	109.7	C313 L316 V317 L363 D364 V370 R371	C313-I367 HydrophobicContact CB-CG1 4.26Å; L316-I367 HydrophobicContact CD1-CD1 4.04Å; V317-I367 HydrophobicContact CG2-CG2 3.81Å; L363-I367 HydrophobicContact CD2-CD1 4Å; L363-I367 HydrophobicContact CG-CD1 3.95Å; L363-I367 HydrophobicContact CG-CG1 4.25Å; L363-I367 WeakPolarHBondContact O-CG1 3.42Å; L363-I367 PolarHBondContact O-N 2.83Å; D364-I367 PolarHBondContact O-N 2.78Å; I367-V370 WeakPolarHBondContact O-CB 3.33Å; I367-V370 PolarHBondContact O-N 2.98Å; I367-R371 WeakPolarHBondContact O-CB 3.48Å; I367-R371 PolarHBondContact O-N 2.81Å
368	E	83.6	Confident	77.4	Confident	83 Å²	83	64.6 Å²	64.6	39%	0.388	36%	0.356	S	S	.	.	H	α-helix	trans	-65.2	-43	176.4	-172.1	55.5	-150.6	0	0	111.7	D364 K365 V370 R371 N372	D364-E368 WeakPolarHBondContact O-CB 3.49Å; D364-E368 PolarHBondContact O-N 3.39Å; K365-E368 PolarHBondContact O-N 3.37Å; E368-V370 VanDerWaalsContact C-N 3.3Å; E368-V370 PolarHBondContact O-N 2.97Å; E368-R371 WeakPolarHBondContact O-CB 3.47Å; E368-R371 PolarHBondContact O-N 3.39Å; E368-N372 WeakPolarHBondContact O-CB 3.34Å; E368-N372 PolarHBondContact O-N 3.49Å; E368-N372 PolarHBondContact O-ND2 3.15Å; E368-N372 VanDerWaalsContact O-ND2 3.08Å; E368-N372 PolarHBondContact OE1-ND2 3.39Å
369	D	84.4	Confident	77.2	Confident	29 Å²	29	63.6 Å²	63.6	16%	0.155	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-39.8	173.4	-76.3	-8.4	0	0	0	111	K365 M366 G373 I374 Y375	K365-D369 VanDerWaalsContact O-CB 3.25Å; K365-D369 WeakPolarHBondContact O-CB 3.47Å; K365-D369 PolarHBondContact O-N 3.47Å; M366-D369 PolarHBondContact O-N 3.37Å; D369-G373 PolarHBondContact O-N 2.97Å; D369-I374 HydrophobicContact CB-CB 4.08Å; D369-I374 HydrophobicContact CB-CD1 4Å; D369-I374 HydrophobicContact CB-CG1 4.39Å; D369-I374 VanDerWaalsContact O-CB 3.24Å; D369-I374 WeakPolarHBondContact O-CB 3.29Å; D369-I374 WeakPolarHBondContact O-CG1 3.38Å; D369-I374 PolarHBondContact O-N 2.96Å; D369-I374 WeakPolarHBondContact OD1-CD1 3.4Å; D369-Y375 HydrophobicContact CB-CD2 3.88Å; D369-Y375 HydrophobicContact CB-CE2 3.71Å
370	V	85.4	Confident	76.8	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.048	35%	0.346	C	S	.	.	H	α-helix	trans	-65.2	-45.2	173.8	167.7	0	0	0	0	111.4	L310 C313 V317 M366 I367 E368 N372 G373	L310-V370 HydrophobicContact CD1-CG2 3.51Å; C313-V370 HydrophobicContact CB-CB 4.34Å; C313-V370 HydrophobicContact CB-CG2 3.71Å; V317-V370 HydrophobicContact CB-CG1 4.25Å; V317-V370 HydrophobicContact CG2-CB 4.35Å; V317-V370 HydrophobicContact CG2-CG1 3.93Å; M366-V370 VanDerWaalsContact O-CG2 3.3Å; M366-V370 WeakPolarHBondContact O-CG2 3.33Å; M366-V370 PolarHBondContact O-N 3.26Å; I367-V370 WeakPolarHBondContact O-CB 3.33Å; I367-V370 PolarHBondContact O-N 2.98Å; E368-V370 VanDerWaalsContact C-N 3.3Å; E368-V370 PolarHBondContact O-N 2.97Å; V370-N372 VanDerWaalsContact C-N 3.3Å; V370-N372 PolarHBondContact O-N 3.49Å; V370-G373 WeakPolarHBondContact O-CA 3.25Å; V370-G373 PolarHBondContact O-N 3.18Å
371	R	82.5	Confident	76.5	Confident	153 Å²	153	66.8 Å²	66.8	58%	0.577	32%	0.324	S	S	*	.	H	α-helix	trans	-60.3	-40.5	177.8	-176.9	178.7	-76.9	-160.1	-3	111.4	V317 I367 E368 G373	V317-R371 HydrophobicContact CG1-CB 4.26Å; V317-R371 HydrophobicContact CG2-CB 4.35Å; I367-R371 WeakPolarHBondContact O-CB 3.48Å; I367-R371 PolarHBondContact O-N 2.81Å; E368-R371 WeakPolarHBondContact O-CB 3.47Å; E368-R371 PolarHBondContact O-N 3.39Å; R371-G373 PolarHBondContact O-N 3.33Å
372	N	80.7	Confident	75.8	Confident	86 Å²	86	74.3 Å²	74.3	46%	0.46	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	7	175.2	-67.2	-39.6	0	0	0	113.9	N187 E368 V370 I374	N187-N372 PolarHBondContact ND2-O 2.61Å; E368-N372 WeakPolarHBondContact O-CB 3.34Å; E368-N372 PolarHBondContact O-N 3.49Å; E368-N372 PolarHBondContact O-ND2 3.15Å; E368-N372 VanDerWaalsContact O-ND2 3.08Å; E368-N372 PolarHBondContact OE1-ND2 3.39Å; V370-N372 VanDerWaalsContact C-N 3.3Å; V370-N372 PolarHBondContact O-N 3.49Å; N372-I374 VanDerWaalsContact C-N 3.32Å; N372-I374 HydrophobicContact CB-CG1 4.36Å; N372-I374 PolarHBondContact O-N 2.76Å
373	G	77.4	Confident	74.4	Confident	29 Å²	29	77.9 Å²	77.9	30%	0.299	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	13.3	172.7	0	0	0	0	0	115.2	L189 D369 V370 R371 Y375 P376	L189-G373 WeakPolarHBondContact CD1-O 3.45Å; D369-G373 PolarHBondContact O-N 2.97Å; V370-G373 WeakPolarHBondContact O-CA 3.25Å; V370-G373 PolarHBondContact O-N 3.18Å; R371-G373 PolarHBondContact O-N 3.33Å; G373-Y375 VanDerWaalsContact C-N 3.3Å; G373-Y375 PolarHBondContact O-N 3.05Å; G373-P376 VanDerWaalsContact O-CD 3.28Å; G373-P376 WeakPolarHBondContact O-CD 3.38Å
374	I	79.8	Confident	72.5	Confident	31 Å²	31	83.4 Å²	83.4	16%	0.159	38%	0.381	C	S	.	.	S	Bend	trans	-65.1	-33	-175.7	-60.9	-174.9	0	0	0	112.2	N187 D369 N372 P376	N187-I374 HydrophobicContact CB-CD1 4.21Å; N187-I374 HydrophobicContact CB-CG1 4.01Å; D369-I374 HydrophobicContact CB-CB 4.08Å; D369-I374 HydrophobicContact CB-CD1 4Å; D369-I374 HydrophobicContact CB-CG1 4.39Å; D369-I374 VanDerWaalsContact O-CB 3.24Å; D369-I374 WeakPolarHBondContact O-CB 3.29Å; D369-I374 WeakPolarHBondContact O-CG1 3.38Å; D369-I374 PolarHBondContact O-N 2.96Å; D369-I374 WeakPolarHBondContact OD1-CD1 3.4Å; N372-I374 VanDerWaalsContact C-N 3.32Å; N372-I374 HydrophobicContact CB-CG1 4.36Å; N372-I374 PolarHBondContact O-N 2.76Å; I374-P376 VanDerWaalsContact C-CD 3.44Å; I374-P376 WeakPolarHBondContact O-CD 3.38Å
375	Y	79	Confident	70.2	Confident	108 Å²	108	82 Å²	82	42%	0.424	38%	0.381	S	S	.	.	S	Bend	trans	-119.5	67.9	178.4	-60.2	-74.5	0	0	0	111	L310 H314 D369 G373	L310-Y375 VanDerWaalsContact CD1-CB 3.45Å; L310-Y375 HydrophobicContact CD1-CG 4.13Å; H314-Y375 PolarHBondContact CE1-O 3.24Å; H314-Y375 PolarHBondContact NE2-O 3.33Å; D369-Y375 HydrophobicContact CB-CD2 3.88Å; D369-Y375 HydrophobicContact CB-CE2 3.71Å; G373-Y375 VanDerWaalsContact C-N 3.3Å; G373-Y375 PolarHBondContact O-N 3.05Å
376	P	74.6	Confident	68	Low	39 Å²	39	86.3 Å²	86.3	25%	0.253	39%	0.394	S	S	.	.			trans	-71.3	136.8	-176.1	29.5	-29.8	0	0	0	110.7	W160 G373 I374 T378	W160-P376 HydrophobicContact CH2-CB 4.29Å; W160-P376 HydrophobicContact CZ3-CB 3.81Å; W160-P376 HydrophobicContact CZ3-CG 4.34Å; G373-P376 VanDerWaalsContact O-CD 3.28Å; G373-P376 WeakPolarHBondContact O-CD 3.38Å; I374-P376 VanDerWaalsContact C-CD 3.44Å; I374-P376 WeakPolarHBondContact O-CD 3.38Å; P376-T378 HydrophobicContact CB-CG2 3.83Å; P376-T378 HydrophobicContact CG-CG2 3.64Å; P376-T378 PolarHBondContact O-N 3.08Å
377	L	77.2	Confident	65.5	Low	11 Å²	11	92.7 Å²	92.7	6%	0.058	42%	0.423	C	S	.	.			trans	-79.4	65.9	169.7	-66.5	178.1	0	0	0	109.8	P306 L310 L311 H314 I379 F380	P306-L377 HydrophobicContact CB-CD2 3.69Å; P306-L377 HydrophobicContact CG-CD2 3.5Å; P306-L377 VanDerWaalsContact CG-CD2 3.5Å; L310-L377 HydrophobicContact CD2-CD2 4.42Å; L310-L377 HydrophobicContact CG-CD2 4.49Å; L311-L377 HydrophobicContact CD1-CD1 3.81Å; H314-L377 HydrophobicContact CB-CD1 3.69Å; H314-L377 VanDerWaalsContact CG-CD1 3.42Å; L377-I379 VanDerWaalsContact C-N 3.3Å; L377-I379 PolarHBondContact O-N 3.45Å; L377-F380 HydrophobicContact CB-CD2 4.3Å; L377-F380 HydrophobicContact CD2-CD2 4.45Å; L377-F380 PolarHBondContact O-N 2.87Å
378	T	69.1	Low	63.1	Low	13 Å²	13	93.9 Å²	93.9	8%	0.08	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-40.3	-170.7	59.3	0	0	0	0	112.8	I156 W160 P376 F380	I156-T378 HydrophobicContact CG2-CG2 3.81Å; W160-T378 HydrophobicContact CD2-CG2 3.63Å; W160-T378 HydrophobicContact CE3-CG2 3.17Å; W160-T378 HydrophobicContact CG-CG2 4.25Å; W160-T378 HydrophobicContact CH2-CG2 4.23Å; W160-T378 HydrophobicContact CZ3-CG2 3.53Å; W160-T378 PolarHBondContact NE1-O 3.15Å; P376-T378 HydrophobicContact CB-CG2 3.83Å; P376-T378 HydrophobicContact CG-CG2 3.64Å; P376-T378 PolarHBondContact O-N 3.08Å; T378-F380 PolarHBondContact O-N 2.98Å
379	I	62.1	Low	60.4	Low	39 Å²	39	94.6 Å²	94.6	20%	0.2	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-28.9	-173.5	-60	176.5	0	0	0	112.8	F298 F303 L377	F298-I379 HydrophobicContact CD1-CG2 4.34Å; F298-I379 HydrophobicContact CE1-CG2 3.4Å; F298-I379 HydrophobicContact CE2-CG2 3.87Å; F298-I379 HydrophobicContact CZ-CG2 3.12Å; F303-I379 HydrophobicContact CD2-CD1 3.52Å; F303-I379 HydrophobicContact CE2-CD1 3.75Å; L377-I379 VanDerWaalsContact C-N 3.3Å; L377-I379 PolarHBondContact O-N 3.45Å
380	F	59.8	Low	57.6	Low	133 Å²	133	98.4 Å²	98.4	58%	0.583	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-14.5	-173.6	-62.8	-79.1	0	0	0	113.5	P306 L377 T378 R382	P306-F380 HydrophobicContact CG-CE2 3.82Å; L377-F380 HydrophobicContact CB-CD2 4.3Å; L377-F380 HydrophobicContact CD2-CD2 4.45Å; L377-F380 PolarHBondContact O-N 2.87Å; T378-F380 PolarHBondContact O-N 2.98Å; F380-R382 PolarHBondContact O-N 2.9Å
381	R	58.4	Low	54.8	Low	120 Å²	120	104 Å²	104	45%	0.453	50%	0.502	S	S	.	.			trans	-94.3	70.4	180	-80.5	-169.7	164.7	-178.4	-1.2	110.8	W160 R383	W160-R381 HydrophobicContact CZ2-CB 4.23Å; R381-R383 VanDerWaalsContact C-N 3.33Å; R381-R383 PolarHBondContact O-N 3.2Å; R381-R383 VanDerWaalsContact O-N 3.1Å
382	R	50.4	Low	52	Low	222 Å²	222	107.6 Å²	107.6	84%	0.838	52%	0.515	S	S	*	.			trans	-77.3	90.3	160.2	-159.1	175.3	171.6	177.3	-3.4	107.3	F380 L384	F380-R382 PolarHBondContact O-N 2.9Å; R382-L384 PolarHBondContact O-N 2.94Å; R382-L384 VanDerWaalsContact O-N 3.1Å
383	R	47.8	Very low	49.4	Very low	171 Å²	171	106.2 Å²	106.2	65%	0.645	52%	0.521	S	S	*	.			trans	-61.6	115.6	164.6	-85.2	-170.7	176.4	175.7	-0.4	105.4	D99 R381 S385	D99-R383 IonicContact OD2-NH1 3.82Å; D99-R383 PolarHBondContact OD2-NH1 3.16Å; R381-R383 VanDerWaalsContact C-N 3.33Å; R381-R383 PolarHBondContact O-N 3.2Å; R381-R383 VanDerWaalsContact O-N 3.1Å; R383-S385 PolarHBondContact O-N 2.95Å
384	L	37.1	Very low	47.1	Very low	157 Å²	157	110.6 Å²	110.6	82%	0.822	54%	0.544	S	S	*	.			trans	-44.4	126.9	168	-79.2	146.3	0	0	0	107.3	R382 R386	R382-L384 PolarHBondContact O-N 2.94Å; R382-L384 VanDerWaalsContact O-N 3.1Å; L384-R386 PolarHBondContact O-N 2.86Å
385	S	33.3	Very low	44.5	Very low	93 Å²	93	112 Å²	112	65%	0.65	57%	0.567	S	S	*	*			trans	-39.5	102.2	174.1	47.5	0	0	0	0	109.2	R383 Q387	R383-S385 PolarHBondContact O-N 2.95Å; S385-Q387 VanDerWaalsContact C-N 3.28Å; S385-Q387 PolarHBondContact O-N 3.28Å
386	R	36.3	Very low	42	Very low	213 Å²	213	113.9 Å²	113.9	80%	0.804	59%	0.589	S	S	*	*			trans	-66.6	103.6	160.4	-79.5	-174.9	173.3	-172.1	-4.8	103.2	L384 I388	L384-R386 PolarHBondContact O-N 2.86Å; R386-I388 PolarHBondContact O-N 3.4Å
387	Q	32.3	Very low	39.8	Very low	174 Å²	174	116.8 Å²	116.8	81%	0.813	62%	0.617	S	S	*	*			trans	-48.8	118	161.3	-79.7	-176.6	-33.9	0	0	105.4	S385 S389	S385-Q387 VanDerWaalsContact C-N 3.28Å; S385-Q387 PolarHBondContact O-N 3.28Å; Q387-S389 PolarHBondContact O-N 3.24Å
388	I	34.7	Very low	37.5	Very low	59 Å²	59	120.3 Å²	120.3	30%	0.303	64%	0.642	S	S	.	*			trans	-65.8	94.5	172.2	-67	176.2	0	0	0	105	K97 F168 R386 V390	K97-I388 HydrophobicContact CB-CD1 4.29Å; K97-I388 HydrophobicContact CD-CG2 3.44Å; K97-I388 VanDerWaalsContact CD-CG2 3.44Å; F168-I388 HydrophobicContact CD1-CD1 4.1Å; F168-I388 HydrophobicContact CE1-CD1 3.45Å; F168-I388 VanDerWaalsContact CE1-CD1 3.45Å; F168-I388 HydrophobicContact CE1-CG1 4.01Å; F168-I388 HydrophobicContact CZ-CD1 4.37Å; R386-I388 PolarHBondContact O-N 3.4Å; I388-V390 PolarHBondContact O-N 3.13Å; I388-V390 VanDerWaalsContact O-N 3.11Å
389	S	26.9	Very low	35.7	Very low	98 Å²	98	125.7 Å²	125.7	69%	0.685	68%	0.677	S	S	*	*			trans	-63.6	114.2	169.2	-69.2	0	0	0	0	107.6	Q387 V391	Q387-S389 PolarHBondContact O-N 3.24Å; S389-V391 VanDerWaalsContact C-N 3.33Å; S389-V391 PolarHBondContact O-N 3.32Å
390	V	26	Very low	34.3	Very low	109 Å²	109	129 Å²	129	66%	0.661	70%	0.699	S	S	*	*			trans	-71.5	92.8	169.3	-179.8	0	0	0	0	106.7	I388 R392	I388-V390 PolarHBondContact O-N 3.13Å; I388-V390 VanDerWaalsContact O-N 3.11Å; V390-R392 HydrophobicContact CG1-CG 4.34Å; V390-R392 PolarHBondContact O-N 3.48Å
391	V	25.1	Very low	32.8	Very low	127 Å²	127	129.8 Å²	129.8	77%	0.77	71%	0.71	S	S	*	*			trans	-74.7	102	159.2	-178.6	0	0	0	0	105.7	S389 G393	S389-V391 VanDerWaalsContact C-N 3.33Å; S389-V391 PolarHBondContact O-N 3.32Å; V391-G393 PolarHBondContact O-N 3.33Å; V391-G393 VanDerWaalsContact O-N 3.09Å
392	R	24	Very low	31.5	Very low	228 Å²	228	129.1 Å²	129.1	86%	0.86	73%	0.73	S	S	*	*			trans	-61.8	104.4	165.1	-87.7	179.5	174.5	170.6	-1.9	107.2	V390	V390-R392 HydrophobicContact CG1-CG 4.34Å; V390-R392 PolarHBondContact O-N 3.48Å
393	G	25.5	Very low	30.5	Very low	56 Å²	56	124.3 Å²	124.3	58%	0.577	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-64.8	145.2	157.4	0	0	0	0	0	109.2	V391 G395	V391-G393 PolarHBondContact O-N 3.33Å; V391-G393 VanDerWaalsContact O-N 3.09Å; G393-G395 PolarHBondContact O-N 3.11Å
394	P	29.3	Very low	29.7	Very low	122 Å²	122	124.6 Å²	124.6	79%	0.792	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.6	138.2	175.4	21.7	-21.4	0	0	0	109.6
395	G	26.4	Very low	29.6	Very low	61 Å²	61	125.1 Å²	125.1	63%	0.629	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-67.4	163.1	-171.1	0	0	0	0	0	115	G393	G393-G395 PolarHBondContact O-N 3.11Å
396	T	26.5	Very low	29.7	Very low	147 Å²	147	126.7 Å²	126.7	90%	0.902	74%	0.742	S	S	*	*			trans	55	103.1	142.8	62.6	0	0	0	0	117.8
397	A	28.6	Very low	29.5	Very low	100 Å²	100	123 Å²	123	83%	0.826	74%	0.738	S	S	*	*			trans	-148.1	105.3	133.3	0	0	0	0	0	108.9
398	S	27.3	Very low	29.6	Very low	84 Å²	84	124 Å²	124	59%	0.587	74%	0.743	S	S	*	*			trans	-62.2	136.8	160.9	-167	0	0	0	0	108.1	V400	S398-V400 VanDerWaalsContact C-N 3.32Å; S398-V400 PolarHBondContact O-N 2.82Å
399	P	31.7	Very low	29.4	Very low	127 Å²	127	127 Å²	127	83%	0.825	76%	0.764	S	S	*	*			trans	-78.9	89.9	168	28.1	-21.5	0	0	0	107.7
400	V	32	Very low	29.8	Very low	109 Å²	109	130.4 Å²	130.4	66%	0.661	78%	0.775	S	S	*	*			trans	-105	95.9	160.6	-167.7	0	0	0	0	105.5	S398	S398-V400 VanDerWaalsContact C-N 3.32Å; S398-V400 PolarHBondContact O-N 2.82Å
401	D	28.7	Very low	30.1	Very low	149 Å²	149	129.2 Å²	129.2	80%	0.797	78%	0.784	S	S	*	*			trans	172.3	86.1	146.8	-89.9	-18.4	0	0	0	109.2
402	A	30.7	Very low	30.4	Very low	106 Å²	106	126.8 Å²	126.8	88%	0.876	79%	0.785	S	S	*	*			trans	-128	75.7	156.7	0	0	0	0	0	107
403	T	29.6	Very low	30.7	Very low	120 Å²	120	121.9 Å²	121.9	74%	0.736	79%	0.786	S	S	*	*			trans	-133.1	140.2	166.8	-9.8	0	0	0	0	107.8
404	E	32.3	Very low	31.2	Very low	178 Å²	178	124.4 Å²	124.4	83%	0.832	80%	0.795	S	S	*	*			trans	84.5	105.2	-173.7	-49.1	-173	172	0	0	112.1
405	L	34.5	Very low	31.4	Very low	168 Å²	168	125.7 Å²	125.7	88%	0.88	80%	0.8	S	S	*	*				-152.7	131	55.1	-77.3	154.3	0	0	0	111.7
406	T	35	Very low	31.7	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	80%	0.801	S	S	*	*			trans	-67.7	147.9	173.8	43	0	0	0	0	114.1
407	D	31.4	Very low	32	Very low	135 Å²	135	126.7 Å²	126.7	72%	0.722	80%	0.801	S	S	*	*			trans	46.5	111.4	144.5	-81.7	-24.2	0	0	0	119.6
408	Q	34.4	Very low	32.2	Very low	197 Å²	197	130 Å²	130	92%	0.921	80%	0.804	S	S	*	*				-164.4	109.6	111.4	-103.3	160.2	85.7	0	0	111.7
409	T	32	Very low	32.2	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	82%	0.817	S	S	*	*			trans	-70.5	125	160.1	36.4	0	0	0	0	109.3
410	N	35.1	Very low	32.2	Very low	170 Å²	170	134.5 Å²	134.5	91%	0.909	82%	0.818	S	S	*	*			trans	-171.3	137.4	136.7	-98.3	-28.2	0	0	0	111.6
411	G	31.6	Very low	32.2	Very low	84 Å²	84	134.6 Å²	134.6	87%	0.866	82%	0.823	S	S	*	*			trans	-69.3	163.9	-171.8	0	0	0	0	0	115
412	G	31.3	Very low	32.7	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	83%	0.826	S	S	*	*			trans	169.4	93.8	171.9	0	0	0	0	0	110.7
413	S	31	Very low	33.2	Very low	125 Å²	125	137.2 Å²	137.2	87%	0.874	82%	0.817	S	S	*	*			trans	-63.5	131.3	173	61.4	0	0	0	0	111.5
414	S	36.7	Very low	34.4	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	82%	0.824	S	S	*	*			trans	-161.7	121.2	145	54.4	0	0	0	0	110.6
415	T	33.1	Very low	36.3	Very low	148 Å²	148	137.6 Å²	137.6	91%	0.908	81%	0.806	S	S	*	*			trans	-31.3	131.6	159.9	49.4	0	0	0	0	114.5
416	G	32.1	Very low	38.3	Very low	63 Å²	63	134.7 Å²	134.7	65%	0.649	80%	0.797	S	S	*	*			trans	-179.5	100.6	170.6	0	0	0	0	0	111.5
417	D	32.8	Very low	40.6	Very low	166 Å²	166	133.9 Å²	133.9	89%	0.888	79%	0.794	S	S	*	*			trans	66.1	105.5	144	-50.3	-29.2	0	0	0	120.3	E419	D417-E419 PolarHBondContact O-N 2.79Å
418	L	32	Very low	43.3	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	76%	0.763	S	S	*	*			trans	-54	121.4	150	-75.1	130.1	0	0	0	109.7
419	E	29	Very low	45.7	Very low	186 Å²	186	122.8 Å²	122.8	87%	0.869	74%	0.743	S	S	*	*			trans	175.5	133.5	137.6	-97.1	167.2	-167.9	0	0	109.5	D417	D417-E419 PolarHBondContact O-N 2.79Å
420	S	30	Very low	48.2	Very low	120 Å²	120	117.5 Å²	117.5	84%	0.839	71%	0.71	S	S	*	*			trans	78.3	72.9	171.9	71.6	0	0	0	0	119.6
421	S	32.3	Very low	50.8	Low	110 Å²	110	113.9 Å²	113.9	77%	0.769	68%	0.683	S	S	*	*			trans	-108.4	94.2	139.8	70.6	0	0	0	0	107.4	N423	S421-N423 PolarHBondContact O-N 3.27Å
422	E	40.4	Very low	53.6	Low	184 Å²	184	110.6 Å²	110.6	86%	0.86	65%	0.647	S	S	*	*			trans	-53.8	125.7	170.2	-81.1	-178.2	144	0	0	108.9	Q424	E422-Q424 VanDerWaalsContact C-N 3.33Å; E422-Q424 PolarHBondContact O-N 3.14Å
423	N	40.3	Very low	56.3	Low	127 Å²	127	110.9 Å²	110.9	68%	0.679	63%	0.633	S	S	*	*			trans	-56.6	89.7	179	-75.9	-26.7	0	0	0	110.6	S421 Y425	S421-N423 PolarHBondContact O-N 3.27Å; N423-Y425 HydrophobicContact CB-CE2 4.41Å; N423-Y425 PolarHBondContact O-N 2.75Å
424	Q	56.2	Low	59.1	Low	189 Å²	189	110.3 Å²	110.3	88%	0.883	62%	0.616	S	S	*	*			trans	-80.1	105.4	167.1	-114.6	175.2	14.8	0	0	107.7	E422	E422-Q424 VanDerWaalsContact C-N 3.33Å; E422-Q424 PolarHBondContact O-N 3.14Å
425	Y	70.9	Confident	61.8	Low	117 Å²	117	106.6 Å²	106.6	46%	0.459	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-66.2	142.6	169.5	-65.7	-86.4	0	0	0	108.8	N423 L484	N423-Y425 HydrophobicContact CB-CE2 4.41Å; N423-Y425 PolarHBondContact O-N 2.75Å; Y425-L484 WeakPolarHBondContact CB-O 3.17Å; Y425-L484 HydrophobicContact CD2-CD2 3.76Å; Y425-L484 HydrophobicContact CE2-CD2 3.4Å; Y425-L484 VanDerWaalsContact CE2-CD2 3.4Å
426	P	76.2	Confident	64.6	Low	106 Å²	106	102.5 Å²	102.5	69%	0.688	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-58	138.8	176	22.7	-31.1	0	0	0	110
427	P	83.2	Confident	67.5	Low	108 Å²	108	100.4 Å²	100.4	70%	0.701	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-66.4	140.9	-175.7	26.8	-34.3	0	0	0	111.4	T429	P427-T429 PolarHBondContact O-N 3.01Å
428	E	87.9	Confident	70.2	Confident	17 Å²	17	96.1 Å²	96.1	8%	0.079	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-72.8	117.9	174.3	-176.6	56.8	-94.9	0	0	110.1	R430 F456 R462 G485 S488	E428-R430 WeakPolarHBondContact OE1-CB 3.42Å; E428-R430 IonicContact OE1-CZ 3.47Å; E428-R430 PolarHBondContact OE1-N 2.67Å; E428-R430 VanDerWaalsContact OE1-N 3.14Å; E428-R430 IonicContact OE1-NE 3.76Å; E428-R430 PolarHBondContact OE1-NE 2.67Å; E428-R430 IonicContact OE1-NH2 2.63Å; E428-R430 PolarHBondContact OE1-NH2 3.02Å; E428-R430 IonicContact OE2-CZ 2.59Å; E428-R430 IonicContact OE2-NE 3.42Å; E428-R430 IonicContact OE2-NH2 2.96Å; E428-R430 PolarHBondContact OE2-NH2 3Å; E428-F456 HydrophobicContact CG-CE1 4.35Å; E428-R462 IonicContact OE2-CZ 3.12Å; E428-R462 IonicContact OE2-NH1 3.16Å; E428-R462 PolarHBondContact OE2-NH1 3.45Å; E428-R462 IonicContact OE2-NH2 3.83Å; E428-R462 PolarHBondContact OE2-NH2 3.48Å; E428-R462 VanDerWaalsContact OE2-NH2 3.11Å; E428-G485 WeakPolarHBondContact CB-O 3.36Å; E428-S488 WeakPolarHBondContact O-CA 3.23Å; E428-S488 WeakPolarHBondContact O-CB 3.32Å; E428-S488 PolarHBondContact O-OG 3.18Å
429	T	85.2	Confident	72.9	Confident	82 Å²	82	88.5 Å²	88.5	50%	0.503	48%	0.479	S	S	.	.			trans	-95.8	-13.9	-177.2	56.1	0	0	0	0	112.6	P427	P427-T429 PolarHBondContact O-N 3.01Å
430	R	85.2	Confident	75.6	Confident	10 Å²	10	85 Å²	85	4%	0.038	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-83.9	140.4	-175.1	-66.2	169.9	-67.9	-160.1	-9.3	112.1	E63 E428 F456 Q457 D458 S488	E63-R430 IonicContact OE1-CZ 2.66Å; E63-R430 IonicContact OE1-NH1 3.54Å; E63-R430 PolarHBondContact OE1-NH1 2.98Å; E63-R430 IonicContact OE1-NH2 3.21Å; E63-R430 PolarHBondContact OE1-NH2 3.31Å; E63-R430 IonicContact OE2-CZ 3.56Å; E63-R430 IonicContact OE2-NH1 2.74Å; E63-R430 PolarHBondContact OE2-NH1 3.34Å; E63-R430 IonicContact OE2-NH2 3.61Å; E428-R430 WeakPolarHBondContact OE1-CB 3.42Å; E428-R430 IonicContact OE1-CZ 3.47Å; E428-R430 PolarHBondContact OE1-N 2.67Å; E428-R430 VanDerWaalsContact OE1-N 3.14Å; E428-R430 IonicContact OE1-NE 3.76Å; E428-R430 PolarHBondContact OE1-NE 2.67Å; E428-R430 IonicContact OE1-NH2 2.63Å; E428-R430 PolarHBondContact OE1-NH2 3.02Å; E428-R430 IonicContact OE2-CZ 2.59Å; E428-R430 IonicContact OE2-NE 3.42Å; E428-R430 IonicContact OE2-NH2 2.96Å; E428-R430 PolarHBondContact OE2-NH2 3Å; R430-F456 HydrophobicContact CB-CB 4.21Å; R430-F456 HydrophobicContact CB-CD1 3.72Å; R430-F456 HydrophobicContact CB-CE1 4.5Å; R430-F456 HydrophobicContact CB-CG 4.25Å; R430-Q457 HydrophobicContact CB-CG 4.41Å; R430-D458 WeakPolarHBondContact CD-OD2 3.49Å; R430-D458 IonicContact NE-OD2 2.75Å; R430-D458 IonicContact NH1-OD2 3.27Å; R430-D458 PolarHBondContact NH1-OD2 3.15Å; R430-D458 VanDerWaalsContact NH1-OD2 3.17Å; R430-S488 WeakPolarHBondContact O-CB 3.47Å
431	R	90.4	Very high	78	Confident	93 Å²	93	83.8 Å²	83.8	35%	0.351	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-81.3	135.8	173.6	-57.5	-58	-59.6	-92.3	1.4	111.5	F456 Q457 N490 D491	R431-F456 CarbonylContact O-C 3.57Å; R431-F456 WeakPolarHBondContact O-CA 3.19Å; R431-Q457 PolarHBondContact O-N 2.9Å; R431-N490 PolarHBondContact NH2-O 2.8Å; R431-D491 VanDerWaalsContact CA-OD2 3.24Å; R431-D491 WeakPolarHBondContact CA-OD2 3.33Å; R431-D491 IonicContact CZ-OD1 3.68Å; R431-D491 IonicContact NE-OD1 2.79Å; R431-D491 PolarHBondContact NE-OD1 3.07Å; R431-D491 IonicContact NE-OD2 2.8Å; R431-D491 PolarHBondContact NE-OD2 3.49Å; R431-D491 IonicContact NH2-OD1 3.81Å; R431-D491 PolarHBondContact NH2-OD1 2.74Å
432	V	89.7	Confident	80.4	Confident	16 Å²	16	79.4 Å²	79.4	10%	0.097	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.9	169.9	178.9	0	0	0	0	108.9	M435 F454 F456 D491 M494	V432-M435 HydrophobicContact CG1-CB 4Å; V432-M435 HydrophobicContact CG1-CG 4.41Å; V432-F454 HydrophobicContact CG1-CD1 4.03Å; V432-F454 HydrophobicContact CG2-CD1 3.94Å; V432-F454 HydrophobicContact CG2-CE1 4.47Å; V432-F456 HydrophobicContact CG2-CD1 4.09Å; V432-F456 HydrophobicContact CG2-CE1 3.68Å; V432-F456 HydrophobicContact CG2-CZ 4.35Å; V432-D491 HydrophobicContact CG2-CB 4.32Å; V432-D491 PolarHBondContact N-OD2 3.1Å; V432-M494 HydrophobicContact CB-CE 3.75Å; V432-M494 HydrophobicContact CG1-CE 3.82Å
433	V	88.3	Confident	82	Confident	81 Å²	81	79.1 Å²	79.1	49%	0.491	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-29.5	177.3	-176.6	0	0	0	0	111.4	R455 Q457	V433-R455 PolarHBondContact N-O 2.97Å; V433-Q457 HydrophobicContact CG2-CB 3.95Å
434	E	89.6	Confident	83.4	Confident	114 Å²	114	75.2 Å²	75.2	53%	0.533	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	141	177.8	176.1	176.4	-162.5	0	0	108.8	R455	E434-R455 HydrophobicContact CB-CB 4.18Å; E434-R455 PolarHBondContact N-O 2.9Å; E434-R455 PolarHBondContact O-N 3.26Å; E434-R455 IonicContact OE2-CZ 3.31Å; E434-R455 VanDerWaalsContact OE2-CZ 3.26Å; E434-R455 IonicContact OE2-NE 3.98Å; E434-R455 PolarHBondContact OE2-NE 2.85Å; E434-R455 IonicContact OE2-NH2 2.91Å; E434-R455 PolarHBondContact OE2-NH2 2.98Å
435	M	93.9	Very high	83.8	Confident	32 Å²	32	76.8 Å²	76.8	16%	0.158	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	157.6	173.7	67.2	172	-68	0	0	112.2	V432 M453 F454 M494 V495 T498	V432-M435 HydrophobicContact CG1-CB 4Å; V432-M435 HydrophobicContact CG1-CG 4.41Å; M435-M453 CarbonylContact C-O 3.59Å; M435-M453 WeakPolarHBondContact CA-O 3.47Å; M435-M453 WeakPolarHBondContact CB-O 3.33Å; M435-F454 HydrophobicContact CB-CD1 3.88Å; M435-F454 HydrophobicContact CB-CE1 4.21Å; M435-F454 HydrophobicContact CE-CE1 4.01Å; M435-F454 HydrophobicContact SD-CE1 4.25Å; M435-M494 HydrophobicContact CG-SD 4.02Å; M435-M494 HydrophobicContact SD-CE 4.2Å; M435-M494 HydrophobicContact SD-SD 3.45Å; M435-V495 HydrophobicContact CE-CB 4.34Å; M435-V495 HydrophobicContact CE-CG1 3.91Å; M435-V495 HydrophobicContact CE-CG2 4.41Å; M435-V495 HydrophobicContact SD-CB 4.15Å; M435-V495 HydrophobicContact SD-CG1 4.33Å; M435-V495 HydrophobicContact SD-CG2 3.77Å; M435-T498 VanDerWaalsContact CE-CB 3.46Å; M435-T498 HydrophobicContact CE-CG2 3.56Å; M435-T498 HydrophobicContact CG-CG2 4.15Å; M435-T498 HydrophobicContact SD-CG2 4.07Å
436	S	91.2	Very high	83.9	Confident	62 Å²	62	75.5 Å²	75.5	43%	0.434	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	145.4	167.4	59.1	0	0	0	0	110	M453	S436-M453 PolarHBondContact N-O 2.82Å; S436-M453 PolarHBondContact O-N 3.42Å
437	A	92.2	Very high	84.1	Confident	18 Å²	18	71.3 Å²	71.3	15%	0.149	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.1	175.2	0	0	0	0	0	109.4	L450 T451 L452 T498 I499 S502	A437-L450 HydrophobicContact CB-CD1 4.34Å; A437-T451 CarbonylContact C-O 3.49Å; A437-T451 WeakPolarHBondContact CA-O 3.4Å; A437-L452 HydrophobicContact CB-CD2 3.58Å; A437-T498 HydrophobicContact CB-CG2 4.28Å; A437-I499 HydrophobicContact CB-CG1 4.39Å; A437-S502 VanDerWaalsContact C-OG 3.28Å; A437-S502 WeakPolarHBondContact O-CB 3.2Å; A437-S502 PolarHBondContact O-OG 3.01Å
438	D	90	Very high	84.2	Confident	77 Å²	77	68.3 Å²	68.3	41%	0.412	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.1	177.5	-172.8	31.6	0	0	0	109.7	K440 T451	D438-K440 WeakPolarHBondContact OD2-CE 3.38Å; D438-K440 IonicContact OD2-NZ 2.71Å; D438-T451 PolarHBondContact N-O 2.59Å; D438-T451 PolarHBondContact O-N 2.81Å
439	V	89.2	Confident	84.2	Confident	10 Å²	10	69.9 Å²	69.9	6%	0.061	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.1	-178.9	178.8	0	0	0	0	108.9	K448 M449 L450 F468 M503 Y506	V439-K448 HydrophobicContact CG1-CB 4.13Å; V439-K448 HydrophobicContact CG1-CD 4.43Å; V439-M449 CarbonylContact C-O 3.57Å; V439-M449 VanDerWaalsContact CA-O 3.32Å; V439-M449 WeakPolarHBondContact CA-O 3.38Å; V439-L450 HydrophobicContact CG2-CD1 3.76Å; V439-F468 HydrophobicContact CG1-CE1 4.04Å; V439-F468 HydrophobicContact CG1-CZ 3.92Å; V439-F468 HydrophobicContact CG2-CE1 4.35Å; V439-F468 HydrophobicContact CG2-CZ 4.37Å; V439-M503 HydrophobicContact CG2-CG 4.31Å; V439-Y506 HydrophobicContact CB-CD2 4.15Å; V439-Y506 HydrophobicContact CB-CG 4.32Å; V439-Y506 HydrophobicContact CG1-CD1 4.43Å; V439-Y506 HydrophobicContact CG1-CD2 3.85Å; V439-Y506 HydrophobicContact CG1-CE2 4.39Å; V439-Y506 HydrophobicContact CG1-CG 3.88Å; V439-Y506 VanDerWaalsContact O-CD2 3.26Å; V439-Y506 WeakPolarHBondContact O-CD2 3.32Å
440	K	85.5	Confident	84.5	Confident	112 Å²	112	66.6 Å²	66.6	49%	0.487	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	156.1	178.7	-67.2	-173.3	-170.8	173.3	0	111.2	D438 S442 M449	D438-K440 WeakPolarHBondContact OD2-CE 3.38Å; D438-K440 IonicContact OD2-NZ 2.71Å; K440-S442 PolarHBondContact O-N 2.87Å; K440-M449 HydrophobicContact CB-CB 4.44Å; K440-M449 PolarHBondContact N-O 2.81Å; K440-M449 PolarHBondContact O-N 3.4Å
441	P	81.2	Confident	84.8	Confident	94 Å²	94	67.4 Å²	67.4	61%	0.61	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	135.2	168.3	25.2	-32.5	0	0	0	110.1
442	S	80.9	Confident	84.9	Confident	19 Å²	19	63.3 Å²	63.3	13%	0.133	35%	0.347	C	S	.	.			trans	-83.7	158.7	166.7	168	0	0	0	0	109.6	K440 S444 A447 E467	K440-S442 PolarHBondContact O-N 2.87Å; S442-S444 PolarHBondContact O-N 3.01Å; S442-S444 PolarHBondContact OG-N 3.24Å; S442-S444 VanDerWaalsContact OG-N 3.11Å; S442-S444 PolarHBondContact OG-OG 3.3Å; S442-S444 VanDerWaalsContact OG-OG 3.05Å; S442-A447 WeakPolarHBondContact CB-O 3.22Å; S442-E467 PolarHBondContact OG-OE1 3.29Å
443	D	73.9	Confident	85	Confident	178 Å²	178	67.1 Å²	67.1	95%	0.952	36%	0.364	S	S	*	.	S	Bend	trans	-62	-20.6	169.6	-69.4	-32.7	0	0	0	112
444	S	69.6	Low	85.1	Confident	45 Å²	45	63.5 Å²	63.5	32%	0.315	34%	0.342	S	S	.	.	S	Bend	trans	-84.7	128.8	174.9	69.3	0	0	0	0	111.4	S442 S446 A447	S442-S444 PolarHBondContact O-N 3.01Å; S442-S444 PolarHBondContact OG-N 3.24Å; S442-S444 VanDerWaalsContact OG-N 3.11Å; S442-S444 PolarHBondContact OG-OG 3.3Å; S442-S444 VanDerWaalsContact OG-OG 3.05Å; S444-S446 PolarHBondContact O-N 2.89Å; S444-A447 PolarHBondContact O-N 3.04Å; S444-A447 VanDerWaalsContact OG-CB 3.23Å; S444-A447 WeakPolarHBondContact OG-CB 3.46Å
445	K	66.3	Low	85.1	Confident	222 Å²	222	60.7 Å²	60.7	97%	0.965	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-9.5	-173.6	-72.1	-172.9	176.6	-176.8	0	115.7
446	S	72.4	Confident	84.7	Confident	89 Å²	89	59.1 Å²	59.1	62%	0.622	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	8.5	-172.4	59.1	0	0	0	0	113.8	S444	S444-S446 PolarHBondContact O-N 2.89Å
447	A	79.7	Confident	84.3	Confident	18 Å²	18	60.9 Å²	60.9	15%	0.149	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	157.8	177.2	0	0	0	0	0	111.3	S442 S444 E467 F468	S442-A447 WeakPolarHBondContact CB-O 3.22Å; S444-A447 PolarHBondContact O-N 3.04Å; S444-A447 VanDerWaalsContact OG-CB 3.23Å; S444-A447 WeakPolarHBondContact OG-CB 3.46Å; A447-E467 HydrophobicContact CB-CB 4.28Å; A447-F468 WeakPolarHBondContact CA-O 3.42Å
448	K	85.6	Confident	83.5	Confident	46 Å²	46	60.5 Å²	60.5	20%	0.2	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.6	173	-66.1	176.3	-173.7	175.3	0	107.7	V439 E467 F468 E470 Y506	V439-K448 HydrophobicContact CG1-CB 4.13Å; V439-K448 HydrophobicContact CG1-CD 4.43Å; K448-E467 CarbonylContact O-C 3.57Å; K448-E467 WeakPolarHBondContact O-CA 3.36Å; K448-F468 HydrophobicContact CB-CD1 4.08Å; K448-F468 HydrophobicContact CB-CD2 4.5Å; K448-F468 HydrophobicContact CB-CE1 3.47Å; K448-F468 VanDerWaalsContact CB-CE1 3.47Å; K448-F468 HydrophobicContact CB-CE2 3.92Å; K448-F468 HydrophobicContact CB-CZ 3.4Å; K448-F468 HydrophobicContact CD-CE2 4.11Å; K448-F468 HydrophobicContact CD-CZ 3.94Å; K448-F468 HydrophobicContact CG-CZ 4.26Å; K448-F468 PolarHBondContact N-O 3.02Å; K448-F468 VanDerWaalsContact O-CD1 3.23Å; K448-F468 WeakPolarHBondContact O-CD1 3.43Å; K448-F468 PolarHBondContact O-N 3.35Å; K448-E470 WeakPolarHBondContact CE-OE1 3.21Å; K448-E470 IonicContact NZ-OE1 3.48Å; K448-E470 PolarHBondContact NZ-OE1 2.6Å; K448-Y506 HydrophobicContact CD-CD1 4.35Å; K448-Y506 HydrophobicContact CD-CE1 4.23Å
449	M	88.3	Confident	82.5	Confident	50 Å²	50	58.8 Å²	58.8	25%	0.246	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124.1	176.6	-170	67.5	68.6	0	0	108.7	V439 K440 V465 E467	V439-M449 CarbonylContact C-O 3.57Å; V439-M449 VanDerWaalsContact CA-O 3.32Å; V439-M449 WeakPolarHBondContact CA-O 3.38Å; K440-M449 HydrophobicContact CB-CB 4.44Å; K440-M449 PolarHBondContact N-O 2.81Å; K440-M449 PolarHBondContact O-N 3.4Å; M449-V465 HydrophobicContact CG-CG1 4.1Å; M449-V465 HydrophobicContact SD-CG1 3.59Å; M449-V465 VanDerWaalsContact SD-CG1 3.59Å; M449-E467 HydrophobicContact CE-CG 3.52Å; M449-E467 WeakPolarHBondContact CE-OE1 3.49Å; M449-E467 HydrophobicContact SD-CG 3.83Å
450	L	91.1	Very high	81.9	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.068	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.2	173.1	179	64.4	0	0	0	109.5	A437 V439 L452 V465 G466 F468 L477 I499	A437-L450 HydrophobicContact CB-CD1 4.34Å; V439-L450 HydrophobicContact CG2-CD1 3.76Å; L450-L452 HydrophobicContact CD1-CD2 3.85Å; L450-L452 HydrophobicContact CD1-CG 4.44Å; L450-L452 HydrophobicContact CD2-CD1 4.13Å; L450-L452 HydrophobicContact CD2-CD2 4.02Å; L450-L452 HydrophobicContact CD2-CG 4.09Å; L450-L452 HydrophobicContact CG-CD2 3.9Å; L450-L452 HydrophobicContact CG-CG 3.97Å; L450-V465 WeakPolarHBondContact O-CA 3.39Å; L450-G466 PolarHBondContact N-O 2.91Å; L450-G466 PolarHBondContact O-N 3.19Å; L450-F468 HydrophobicContact CB-CD1 3.64Å; L450-F468 HydrophobicContact CB-CE1 3.72Å; L450-L477 HydrophobicContact CD2-CD1 3.99Å; L450-I499 HydrophobicContact CD2-CD1 4.32Å; L450-I499 HydrophobicContact CD2-CG2 4.2Å
451	T	90.9	Very high	81.9	Confident	27 Å²	27	60 Å²	60	17%	0.166	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.4	170.8	-58.4	0	0	0	0	108.8	A437 D438 E463 L464 V465	A437-T451 CarbonylContact C-O 3.49Å; A437-T451 WeakPolarHBondContact CA-O 3.4Å; D438-T451 PolarHBondContact N-O 2.59Å; D438-T451 PolarHBondContact O-N 2.81Å; T451-E463 HydrophobicContact CG2-CG 4.43Å; T451-L464 CarbonylContact C-O 3.56Å; T451-L464 WeakPolarHBondContact CA-O 3.35Å; T451-V465 HydrophobicContact CG2-CG2 4.13Å
452	L	92.5	Very high	82.1	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130	175.5	-56.4	174	0	0	0	109.4	A437 L450 F454 E463 L464 L481 I499	A437-L452 HydrophobicContact CB-CD2 3.58Å; L450-L452 HydrophobicContact CD1-CD2 3.85Å; L450-L452 HydrophobicContact CD1-CG 4.44Å; L450-L452 HydrophobicContact CD2-CD1 4.13Å; L450-L452 HydrophobicContact CD2-CD2 4.02Å; L450-L452 HydrophobicContact CD2-CG 4.09Å; L450-L452 HydrophobicContact CG-CD2 3.9Å; L450-L452 HydrophobicContact CG-CG 3.97Å; L452-F454 HydrophobicContact CB-CD2 4.33Å; L452-F454 HydrophobicContact CB-CE2 3.54Å; L452-F454 HydrophobicContact CB-CZ 3.92Å; L452-F454 HydrophobicContact CD1-CE2 4.08Å; L452-F454 HydrophobicContact CD1-CZ 3.96Å; L452-F454 HydrophobicContact CG-CE2 4.41Å; L452-F454 HydrophobicContact CG-CZ 4.45Å; L452-E463 CarbonylContact O-C 3.57Å; L452-E463 WeakPolarHBondContact O-CA 3.35Å; L452-L464 HydrophobicContact CB-CB 4.27Å; L452-L464 PolarHBondContact N-O 3.5Å; L452-L464 PolarHBondContact O-N 2.96Å; L452-L481 HydrophobicContact CD1-CD1 3.63Å; L452-I499 HydrophobicContact CD1-CD1 4.01Å; L452-I499 HydrophobicContact CD2-CD1 3.96Å; L452-I499 HydrophobicContact CD2-CG1 3.76Å
453	M	91.9	Very high	82.7	Confident	95 Å²	95	62.8 Å²	62.8	47%	0.468	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.6	170.5	-59.9	-177.4	69.3	0	0	109	M435 S436 R462	M435-M453 CarbonylContact C-O 3.59Å; M435-M453 WeakPolarHBondContact CA-O 3.47Å; M435-M453 WeakPolarHBondContact CB-O 3.33Å; S436-M453 PolarHBondContact N-O 2.82Å; S436-M453 PolarHBondContact O-N 3.42Å; M453-R462 WeakPolarHBondContact CA-O 3.46Å
454	F	91.2	Very high	83.5	Confident	5 Å²	5	55.8 Å²	55.8	2%	0.022	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142.7	177.2	-59	-82.3	0	0	0	110.6	V432 M435 L452 F456 H461 R462 L464 V487 V495	V432-F454 HydrophobicContact CG1-CD1 4.03Å; V432-F454 HydrophobicContact CG2-CD1 3.94Å; V432-F454 HydrophobicContact CG2-CE1 4.47Å; M435-F454 HydrophobicContact CB-CD1 3.88Å; M435-F454 HydrophobicContact CB-CE1 4.21Å; M435-F454 HydrophobicContact CE-CE1 4.01Å; M435-F454 HydrophobicContact SD-CE1 4.25Å; L452-F454 HydrophobicContact CB-CD2 4.33Å; L452-F454 HydrophobicContact CB-CE2 3.54Å; L452-F454 HydrophobicContact CB-CZ 3.92Å; L452-F454 HydrophobicContact CD1-CE2 4.08Å; L452-F454 HydrophobicContact CD1-CZ 3.96Å; L452-F454 HydrophobicContact CG-CE2 4.41Å; L452-F454 HydrophobicContact CG-CZ 4.45Å; F454-F456 HydrophobicContact CB-CD2 4.21Å; F454-F456 HydrophobicContact CB-CE2 3.61Å; F454-F456 HydrophobicContact CB-CZ 3.94Å; F454-F456 HydrophobicContact CG-CE2 4.35Å; F454-F456 HydrophobicContact CG-CZ 4.26Å; F454-H461 WeakPolarHBondContact O-CA 3.44Å; F454-R462 HydrophobicContact CB-CB 4.38Å; F454-R462 PolarHBondContact N-O 3.35Å; F454-R462 PolarHBondContact O-N 3.05Å; F454-L464 HydrophobicContact CD2-CD1 4.45Å; F454-L464 HydrophobicContact CE2-CD1 3.8Å; F454-L464 HydrophobicContact CE2-CG 4.25Å; F454-V487 HydrophobicContact CE1-CG2 4.2Å; F454-V487 HydrophobicContact CZ-CG2 3.97Å; F454-V495 HydrophobicContact CE1-CG1 4.11Å; F454-V495 HydrophobicContact CE1-CG2 4.07Å; F454-V495 HydrophobicContact CZ-CG1 4.21Å
455	R	88.9	Confident	84.5	Confident	55 Å²	55	57.9 Å²	57.9	21%	0.208	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.4	160.2	-175.6	176.6	60.1	76.8	3.9	108.9	V433 E434 L460	V433-R455 PolarHBondContact N-O 2.97Å; E434-R455 HydrophobicContact CB-CB 4.18Å; E434-R455 PolarHBondContact N-O 2.9Å; E434-R455 PolarHBondContact O-N 3.26Å; E434-R455 IonicContact OE2-CZ 3.31Å; E434-R455 VanDerWaalsContact OE2-CZ 3.26Å; E434-R455 IonicContact OE2-NE 3.98Å; E434-R455 PolarHBondContact OE2-NE 2.85Å; E434-R455 IonicContact OE2-NH2 2.91Å; E434-R455 PolarHBondContact OE2-NH2 2.98Å; R455-L460 WeakPolarHBondContact CA-O 3.47Å
456	F	86.9	Confident	85.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	170.2	-179.5	-66.7	-85.8	0	0	0	112.4	E428 R430 R431 V432 F454 D458 N459 L460 R462	E428-F456 HydrophobicContact CG-CE1 4.35Å; R430-F456 HydrophobicContact CB-CB 4.21Å; R430-F456 HydrophobicContact CB-CD1 3.72Å; R430-F456 HydrophobicContact CB-CE1 4.5Å; R430-F456 HydrophobicContact CB-CG 4.25Å; R431-F456 CarbonylContact O-C 3.57Å; R431-F456 WeakPolarHBondContact O-CA 3.19Å; V432-F456 HydrophobicContact CG2-CD1 4.09Å; V432-F456 HydrophobicContact CG2-CE1 3.68Å; V432-F456 HydrophobicContact CG2-CZ 4.35Å; F454-F456 HydrophobicContact CB-CD2 4.21Å; F454-F456 HydrophobicContact CB-CE2 3.61Å; F454-F456 HydrophobicContact CB-CZ 3.94Å; F454-F456 HydrophobicContact CG-CE2 4.35Å; F454-F456 HydrophobicContact CG-CZ 4.26Å; F456-D458 WeakPolarHBondContact CB-OD1 3.4Å; F456-D458 PolarHBondContact O-N 2.64Å; F456-N459 WeakPolarHBondContact O-CA 3.28Å; F456-N459 PolarHBondContact O-N 3.4Å; F456-L460 HydrophobicContact CB-CB 4.37Å; F456-L460 HydrophobicContact CD2-CB 4.2Å; F456-L460 HydrophobicContact CD2-CD2 4.23Å; F456-L460 PolarHBondContact N-O 2.84Å; F456-R462 HydrophobicContact CE2-CB 3.81Å
457	Q	81.9	Confident	86.3	Confident	99 Å²	99	50 Å²	50	46%	0.463	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27	-179.3	65.2	-174.7	-0.9	0	0	115	R430 R431 V433 N459	R430-Q457 HydrophobicContact CB-CG 4.41Å; R431-Q457 PolarHBondContact O-N 2.9Å; V433-Q457 HydrophobicContact CG2-CB 3.95Å; Q457-N459 PolarHBondContact O-N 2.6Å
458	D	75	Confident	86.7	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.053	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	9.1	173.2	63.4	-1.8	0	0	0	112.6	R37 W38 R430 F456 L460	R37-D458 IonicContact CZ-OD2 3.51Å; R37-D458 IonicContact NH1-OD1 3.17Å; R37-D458 IonicContact NH1-OD2 3.44Å; R37-D458 PolarHBondContact NH1-OD2 2.95Å; W38-D458 HydrophobicContact CH2-CB 4.25Å; R430-D458 WeakPolarHBondContact CD-OD2 3.49Å; R430-D458 IonicContact NE-OD2 2.75Å; R430-D458 IonicContact NH1-OD2 3.27Å; R430-D458 PolarHBondContact NH1-OD2 3.15Å; R430-D458 VanDerWaalsContact NH1-OD2 3.17Å; F456-D458 WeakPolarHBondContact CB-OD1 3.4Å; F456-D458 PolarHBondContact O-N 2.64Å; D458-L460 PolarHBondContact O-N 2.79Å; D458-L460 VanDerWaalsContact OD1-CB 3.31Å; D458-L460 WeakPolarHBondContact OD1-CB 3.36Å; D458-L460 PolarHBondContact OD1-N 2.76Å
459	N	69.7	Low	86.7	Confident	40 Å²	40	49 Å²	49	21%	0.214	25%	0.252	C	S	.	.			trans	60.2	24.3	-173.7	-56.4	-70.9	0	0	0	114.4	F456 Q457 H461	F456-N459 WeakPolarHBondContact O-CA 3.28Å; F456-N459 PolarHBondContact O-N 3.4Å; Q457-N459 PolarHBondContact O-N 2.6Å; N459-H461 PolarHBondContact O-N 3.04Å
460	L	77.3	Confident	86.2	Confident	11 Å²	11	53.3 Å²	53.3	6%	0.058	27%	0.272	C	S	.	.			trans	-65	131.7	163.6	-169	81.6	0	0	0	109	E63 L64 R455 F456 D458	E63-L460 HydrophobicContact CB-CD1 4.5Å; E63-L460 WeakPolarHBondContact OE2-CD1 3.25Å; E63-L460 WeakPolarHBondContact OE2-CD2 3.13Å; L64-L460 HydrophobicContact CD2-CD1 3.8Å; L64-L460 HydrophobicContact CG-CD1 4.13Å; R455-L460 WeakPolarHBondContact CA-O 3.47Å; F456-L460 HydrophobicContact CB-CB 4.37Å; F456-L460 HydrophobicContact CD2-CB 4.2Å; F456-L460 HydrophobicContact CD2-CD2 4.23Å; F456-L460 PolarHBondContact N-O 2.84Å; D458-L460 PolarHBondContact O-N 2.79Å; D458-L460 VanDerWaalsContact OD1-CB 3.31Å; D458-L460 WeakPolarHBondContact OD1-CB 3.36Å; D458-L460 PolarHBondContact OD1-N 2.76Å
461	H	83.7	Confident	85.9	Confident	136 Å²	136	57.8 Å²	57.8	63%	0.63	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.7	166.5	-68	-90.1	0	0	0	108.6	F454 N459	F454-H461 WeakPolarHBondContact O-CA 3.44Å; N459-H461 PolarHBondContact O-N 3.04Å
462	R	87.3	Confident	85.7	Confident	44 Å²	44	60.1 Å²	60.1	17%	0.166	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.7	175.7	-175.2	178.7	-74.2	165.5	-3.7	108.6	E428 M453 F454 F456 L464 F486	E428-R462 IonicContact OE2-CZ 3.12Å; E428-R462 IonicContact OE2-NH1 3.16Å; E428-R462 PolarHBondContact OE2-NH1 3.45Å; E428-R462 IonicContact OE2-NH2 3.83Å; E428-R462 PolarHBondContact OE2-NH2 3.48Å; E428-R462 VanDerWaalsContact OE2-NH2 3.11Å; M453-R462 WeakPolarHBondContact CA-O 3.46Å; F454-R462 HydrophobicContact CB-CB 4.38Å; F454-R462 PolarHBondContact N-O 3.35Å; F454-R462 PolarHBondContact O-N 3.05Å; F456-R462 HydrophobicContact CE2-CB 3.81Å; R462-L464 HydrophobicContact CG-CD2 3.94Å; R462-L464 HydrophobicContact CG-CG 4.15Å; R462-F486 PolarHBondContact NH1-O 3.25Å
463	E	92	Very high	85.6	Confident	129 Å²	129	63.9 Å²	63.9	60%	0.603	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.4	170.7	-175.4	176.6	-175	0	0	107.7	T451 L452 V465	T451-E463 HydrophobicContact CG2-CG 4.43Å; L452-E463 CarbonylContact O-C 3.57Å; L452-E463 WeakPolarHBondContact O-CA 3.35Å; E463-V465 HydrophobicContact CG-CG2 4.15Å
464	L	91.4	Very high	85.6	Confident	30 Å²	30	60 Å²	60	16%	0.157	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.3	173	-56.7	179	0	0	0	107.8	T451 L452 F454 R462 L481 F486	T451-L464 CarbonylContact C-O 3.56Å; T451-L464 WeakPolarHBondContact CA-O 3.35Å; L452-L464 HydrophobicContact CB-CB 4.27Å; L452-L464 PolarHBondContact N-O 3.5Å; L452-L464 PolarHBondContact O-N 2.96Å; F454-L464 HydrophobicContact CD2-CD1 4.45Å; F454-L464 HydrophobicContact CE2-CD1 3.8Å; F454-L464 HydrophobicContact CE2-CG 4.25Å; R462-L464 HydrophobicContact CG-CD2 3.94Å; R462-L464 HydrophobicContact CG-CG 4.15Å; L464-L481 HydrophobicContact CD1-CD2 3.67Å; L464-F486 HydrophobicContact CD1-CB 3.9Å; L464-F486 HydrophobicContact CD1-CD1 4.28Å; L464-F486 HydrophobicContact CD1-CD2 4.36Å; L464-F486 HydrophobicContact CD1-CG 3.94Å; L464-F486 HydrophobicContact CD2-CD1 4Å; L464-F486 HydrophobicContact CD2-CE1 4.06Å; L464-F486 HydrophobicContact CD2-CG 4.4Å
465	V	91.1	Very high	85.6	Confident	89 Å²	89	64.6 Å²	64.6	54%	0.539	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.5	176.1	-176.9	0	0	0	0	107.2	M449 L450 T451 E463	M449-V465 HydrophobicContact CG-CG1 4.1Å; M449-V465 HydrophobicContact SD-CG1 3.59Å; M449-V465 VanDerWaalsContact SD-CG1 3.59Å; L450-V465 WeakPolarHBondContact O-CA 3.39Å; T451-V465 HydrophobicContact CG2-CG2 4.13Å; E463-V465 HydrophobicContact CG-CG2 4.15Å
466	G	87	Confident	85.8	Confident	33 Å²	33	63.8 Å²	63.8	34%	0.34	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	150.2	-178.4	0	0	0	0	0	112	L450	L450-G466 PolarHBondContact N-O 2.91Å; L450-G466 PolarHBondContact O-N 3.19Å
467	E	88.9	Confident	86	Confident	112 Å²	112	64.7 Å²	64.7	52%	0.523	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	142.5	170.1	-63.6	-170.8	151.4	0	0	109.9	S442 A447 K448 M449	S442-E467 PolarHBondContact OG-OE1 3.29Å; A447-E467 HydrophobicContact CB-CB 4.28Å; K448-E467 CarbonylContact O-C 3.57Å; K448-E467 WeakPolarHBondContact O-CA 3.36Å; M449-E467 HydrophobicContact CE-CG 3.52Å; M449-E467 WeakPolarHBondContact CE-OE1 3.49Å; M449-E467 HydrophobicContact SD-CG 3.83Å
468	F	88.5	Confident	86.6	Confident	6 Å²	6	60 Å²	60	3%	0.026	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	147.4	172.9	71	-84.2	0	0	0	110.6	V439 A447 K448 L450 E472 L477 M503	V439-F468 HydrophobicContact CG1-CE1 4.04Å; V439-F468 HydrophobicContact CG1-CZ 3.92Å; V439-F468 HydrophobicContact CG2-CE1 4.35Å; V439-F468 HydrophobicContact CG2-CZ 4.37Å; A447-F468 WeakPolarHBondContact CA-O 3.42Å; K448-F468 HydrophobicContact CB-CD1 4.08Å; K448-F468 HydrophobicContact CB-CD2 4.5Å; K448-F468 HydrophobicContact CB-CE1 3.47Å; K448-F468 VanDerWaalsContact CB-CE1 3.47Å; K448-F468 HydrophobicContact CB-CE2 3.92Å; K448-F468 HydrophobicContact CB-CZ 3.4Å; K448-F468 HydrophobicContact CD-CE2 4.11Å; K448-F468 HydrophobicContact CD-CZ 3.94Å; K448-F468 HydrophobicContact CG-CZ 4.26Å; K448-F468 PolarHBondContact N-O 3.02Å; K448-F468 VanDerWaalsContact O-CD1 3.23Å; K448-F468 WeakPolarHBondContact O-CD1 3.43Å; K448-F468 PolarHBondContact O-N 3.35Å; L450-F468 HydrophobicContact CB-CD1 3.64Å; L450-F468 HydrophobicContact CB-CE1 3.72Å; F468-E472 WeakPolarHBondContact CA-OE2 3.24Å; F468-E472 VanDerWaalsContact CB-OE2 3.25Å; F468-E472 WeakPolarHBondContact CB-OE2 3.35Å; F468-L477 HydrophobicContact CB-CD1 4.17Å; F468-L477 HydrophobicContact CB-CD2 3.94Å; F468-L477 HydrophobicContact CD2-CD1 4.38Å; F468-L477 HydrophobicContact CG-CD1 4.16Å; F468-M503 HydrophobicContact CD2-CE 3.95Å; F468-M503 HydrophobicContact CE2-CE 3.34Å; F468-M503 HydrophobicContact CZ-CE 3.97Å; F468-M503 HydrophobicContact CZ-CG 4.27Å
469	A	85.1	Confident	87.4	Confident	38 Å²	38	62.8 Å²	62.8	31%	0.314	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	153.6	177.1	0	0	0	0	0	111.1	S471 E472	A469-S471 PolarHBondContact O-N 2.73Å; A469-E472 HydrophobicContact CB-CG 4.23Å; A469-E472 PolarHBondContact N-OE2 3.39Å; A469-E472 WeakPolarHBondContact O-CB 3.26Å; A469-E472 PolarHBondContact O-N 3.42Å
470	E	78.9	Confident	88.4	Confident	141 Å²	141	64.9 Å²	64.9	66%	0.659	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.1	179	-62.2	-162.4	136.1	0	0	114.4	K448 E472	K448-E470 WeakPolarHBondContact CE-OE1 3.21Å; K448-E470 IonicContact NZ-OE1 3.48Å; K448-E470 PolarHBondContact NZ-OE1 2.6Å; E470-E472 VanDerWaalsContact C-N 3.33Å
471	S	83.6	Confident	89.1	Confident	107 Å²	107	65.4 Å²	65.4	75%	0.748	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.8	175.9	53.5	0	0	0	0	113.9	A469	A469-S471 PolarHBondContact O-N 2.73Å
472	E	86.9	Confident	89.5	Confident	75 Å²	75	60.1 Å²	60.1	35%	0.35	33%	0.334	S	S	.	.			trans	-79.4	139.5	-176.1	-66.4	-178	125.3	0	0	111	F468 A469 E470 L477 M503	F468-E472 WeakPolarHBondContact CA-OE2 3.24Å; F468-E472 VanDerWaalsContact CB-OE2 3.25Å; F468-E472 WeakPolarHBondContact CB-OE2 3.35Å; A469-E472 HydrophobicContact CB-CG 4.23Å; A469-E472 PolarHBondContact N-OE2 3.39Å; A469-E472 WeakPolarHBondContact O-CB 3.26Å; A469-E472 PolarHBondContact O-N 3.42Å; E470-E472 VanDerWaalsContact C-N 3.33Å; E472-L477 HydrophobicContact CB-CD2 4.37Å; E472-M503 WeakPolarHBondContact O-CE 3.25Å
473	T	90.9	Very high	89.6	Confident	87 Å²	87	65.1 Å²	65.1	53%	0.534	35%	0.352	S	S	.	.			trans	-100.7	151.1	-179.9	62.9	0	0	0	0	109.7	H475 G476 L477	T473-H475 PolarHBondContact O-N 3.21Å; T473-G476 PolarHBondContact O-N 2.92Å; T473-G476 PolarHBondContact OG1-N 3.19Å; T473-L477 PolarHBondContact O-N 2.76Å
474	A	91.1	Very high	89.4	Confident	12 Å²	12	60.8 Å²	60.8	10%	0.099	33%	0.333	C	S	.	.	H	α-helix	trans	-51.5	-41	175.2	0	0	0	0	0	112.2	L477 V478 A496 I499 A500 M503	A474-L477 PolarHBondContact O-N 3.5Å; A474-V478 WeakPolarHBondContact O-CG2 3.48Å; A474-V478 PolarHBondContact O-N 3.35Å; A474-A496 WeakPolarHBondContact CB-O 3.34Å; A474-I499 HydrophobicContact CB-CB 4.04Å; A474-I499 HydrophobicContact CB-CG2 3.74Å; A474-A500 HydrophobicContact CB-CB 3.83Å; A474-M503 HydrophobicContact CB-SD 3.96Å
475	H	92.5	Very high	89.2	Confident	103 Å²	103	60 Å²	60	48%	0.477	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-42.1	177.8	-159.5	69.2	0	0	0	112.5	T473 L477 V478 E479	T473-H475 PolarHBondContact O-N 3.21Å; H475-L477 PolarHBondContact O-N 2.89Å; H475-V478 PolarHBondContact O-N 3.5Å; H475-E479 IonicContact NE2-OE1 3.5Å; H475-E479 WeakPolarHBondContact O-CG 3.43Å; H475-E479 PolarHBondContact O-N 3.36Å
476	G	91.3	Very high	89.1	Confident	37 Å²	37	59 Å²	59	38%	0.381	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-41.6	175.2	0	0	0	0	0	112.9	T473 V478 E479 E480	T473-G476 PolarHBondContact O-N 2.92Å; T473-G476 PolarHBondContact OG1-N 3.19Å; G476-V478 VanDerWaalsContact C-N 3.34Å; G476-V478 PolarHBondContact O-N 3.31Å; G476-E479 PolarHBondContact O-N 2.86Å; G476-E480 PolarHBondContact O-N 3.24Å
477	L	92.5	Very high	89.2	Confident	20 Å²	20	57.5 Å²	57.5	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-41.6	175.3	-65.6	174.4	0	0	0	111.3	L450 F468 E472 T473 A474 H475 E480 L481 I499	L450-L477 HydrophobicContact CD2-CD1 3.99Å; F468-L477 HydrophobicContact CB-CD1 4.17Å; F468-L477 HydrophobicContact CB-CD2 3.94Å; F468-L477 HydrophobicContact CD2-CD1 4.38Å; F468-L477 HydrophobicContact CG-CD1 4.16Å; E472-L477 HydrophobicContact CB-CD2 4.37Å; T473-L477 PolarHBondContact O-N 2.76Å; A474-L477 PolarHBondContact O-N 3.5Å; H475-L477 PolarHBondContact O-N 2.89Å; L477-E480 PolarHBondContact O-N 2.95Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.5Å; L477-I499 HydrophobicContact CD1-CG2 4.32Å
478	V	93.5	Very high	89.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-70.3	-37.9	178.6	178.7	0	0	0	0	112.8	A474 H475 G476 E480 L481 V482 R492 V495 A496 I499	A474-V478 WeakPolarHBondContact O-CG2 3.48Å; A474-V478 PolarHBondContact O-N 3.35Å; H475-V478 PolarHBondContact O-N 3.5Å; G476-V478 VanDerWaalsContact C-N 3.34Å; G476-V478 PolarHBondContact O-N 3.31Å; V478-E480 PolarHBondContact O-N 3.36Å; V478-L481 PolarHBondContact O-N 3.01Å; V478-L481 VanDerWaalsContact O-N 3.09Å; V478-V482 HydrophobicContact CG1-CG2 4.21Å; V478-V482 WeakPolarHBondContact O-CG2 3.26Å; V478-V482 PolarHBondContact O-N 2.86Å; V478-R492 HydrophobicContact CG1-CB 4.36Å; V478-R492 HydrophobicContact CG1-CG 3.8Å; V478-V495 HydrophobicContact CG1-CB 4.4Å; V478-V495 HydrophobicContact CG1-CG1 4.47Å; V478-V495 HydrophobicContact CG2-CB 4.19Å; V478-V495 HydrophobicContact CG2-CG1 3.73Å; V478-A496 HydrophobicContact CB-CB 4.33Å; V478-A496 HydrophobicContact CG2-CB 3.92Å; V478-I499 HydrophobicContact CG2-CD1 3.74Å
479	E	92	Very high	89.5	Confident	69 Å²	69	56.3 Å²	56.3	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-56.9	-39.9	172.8	-73.5	-61.7	135.6	0	0	111	H475 G476 V482 R483 R492	H475-E479 IonicContact NE2-OE1 3.5Å; H475-E479 WeakPolarHBondContact O-CG 3.43Å; H475-E479 PolarHBondContact O-N 3.36Å; G476-E479 PolarHBondContact O-N 2.86Å; E479-V482 PolarHBondContact O-N 3.47Å; E479-R483 VanDerWaalsContact O-CB 3.26Å; E479-R483 WeakPolarHBondContact O-CB 2.92Å; E479-R483 PolarHBondContact O-N 3.32Å; E479-R492 VanDerWaalsContact OE1-CD 3.28Å; E479-R492 WeakPolarHBondContact OE1-CD 3.07Å; E479-R492 IonicContact OE1-CZ 3Å; E479-R492 IonicContact OE1-NE 2.91Å; E479-R492 PolarHBondContact OE1-NE 3.5Å; E479-R492 IonicContact OE1-NH1 3.28Å; E479-R492 PolarHBondContact OE1-NH1 2.91Å; E479-R492 IonicContact OE2-CZ 2.64Å; E479-R492 IonicContact OE2-NH1 3.12Å; E479-R492 PolarHBondContact OE2-NH1 3.36Å
480	E	91	Very high	89.8	Confident	83 Å²	83	60.1 Å²	60.1	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-44.9	173.6	-174.7	165.8	-152.8	0	0	112.2	G476 L477 V478 V482 R483 L484	G476-E480 PolarHBondContact O-N 3.24Å; L477-E480 PolarHBondContact O-N 2.95Å; V478-E480 PolarHBondContact O-N 3.36Å; E480-V482 VanDerWaalsContact C-N 3.31Å; E480-V482 PolarHBondContact O-N 2.63Å; E480-R483 PolarHBondContact O-N 3.19Å; E480-R483 IonicContact OE1-NH2 2.67Å; E480-R483 PolarHBondContact OE1-NH2 3.42Å; E480-L484 HydrophobicContact CG-CD1 3.67Å; E480-L484 HydrophobicContact CG-CG 4.08Å; E480-L484 WeakPolarHBondContact O-CB 3.35Å; E480-L484 VanDerWaalsContact O-CG 3.24Å; E480-L484 WeakPolarHBondContact O-CG 3.47Å; E480-L484 PolarHBondContact O-N 2.94Å
481	L	92.5	Very high	90.5	Very high	22 Å²	22	53.7 Å²	53.7	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-38.9	176.3	-68.2	175.2	0	0	0	112.7	L452 L464 L477 V478 G485 F486 V487 I499	L452-L481 HydrophobicContact CD1-CD1 3.63Å; L464-L481 HydrophobicContact CD1-CD2 3.67Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.5Å; V478-L481 PolarHBondContact O-N 3.01Å; V478-L481 VanDerWaalsContact O-N 3.09Å; L481-G485 PolarHBondContact O-N 2.99Å; L481-F486 HydrophobicContact CB-CB 4.38Å; L481-F486 HydrophobicContact CD2-CB 4.11Å; L481-F486 HydrophobicContact CD2-CD2 4.01Å; L481-F486 HydrophobicContact CD2-CG 4.43Å; L481-F486 WeakPolarHBondContact O-CB 3.41Å; L481-F486 PolarHBondContact O-N 3.48Å; L481-V487 HydrophobicContact CB-CB 4.31Å; L481-V487 HydrophobicContact CB-CG2 3.97Å; L481-V487 HydrophobicContact CD1-CG2 4.23Å; L481-V487 PolarHBondContact O-N 2.78Å; L481-I499 HydrophobicContact CD1-CD1 4.38Å
482	V	92	Very high	90.9	Very high	26 Å²	26	52 Å²	52	16%	0.158	27%	0.265	C	S	.	.	H	α-helix	trans	-68.9	-45.8	176.1	173.8	0	0	0	0	110.4	V478 E479 E480 L484 G485 V487 D489 R492	V478-V482 HydrophobicContact CG1-CG2 4.21Å; V478-V482 WeakPolarHBondContact O-CG2 3.26Å; V478-V482 PolarHBondContact O-N 2.86Å; E479-V482 PolarHBondContact O-N 3.47Å; E480-V482 VanDerWaalsContact C-N 3.31Å; E480-V482 PolarHBondContact O-N 2.63Å; V482-L484 VanDerWaalsContact C-N 3.29Å; V482-L484 PolarHBondContact O-N 3.09Å; V482-G485 PolarHBondContact O-N 3.04Å; V482-V487 HydrophobicContact CG2-CB 4.32Å; V482-V487 HydrophobicContact CG2-CG1 4.38Å; V482-D489 HydrophobicContact CG1-CB 4.34Å; V482-R492 HydrophobicContact CG2-CB 4.44Å; V482-R492 HydrophobicContact CG2-CG 4.37Å
483	R	89.2	Confident	91.2	Very high	149 Å²	149	55.8 Å²	55.8	56%	0.562	28%	0.283	S	S	*	.	H	α-helix	trans	-61.4	-35.9	178.2	-174.4	-175.7	67.1	85.1	1.1	112.8	E479 E480 G485	E479-R483 VanDerWaalsContact O-CB 3.26Å; E479-R483 WeakPolarHBondContact O-CB 2.92Å; E479-R483 PolarHBondContact O-N 3.32Å; E480-R483 PolarHBondContact O-N 3.19Å; E480-R483 IonicContact OE1-NH2 2.67Å; E480-R483 PolarHBondContact OE1-NH2 3.42Å; R483-G485 VanDerWaalsContact C-N 3.25Å; R483-G485 PolarHBondContact O-N 3.32Å
484	L	88.1	Confident	91.4	Very high	38 Å²	38	55.1 Å²	55.1	20%	0.199	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-1	176.8	-65.1	178.1	0	0	0	113.1	Y425 E480 V482 F486	Y425-L484 WeakPolarHBondContact CB-O 3.17Å; Y425-L484 HydrophobicContact CD2-CD2 3.76Å; Y425-L484 HydrophobicContact CE2-CD2 3.4Å; Y425-L484 VanDerWaalsContact CE2-CD2 3.4Å; E480-L484 HydrophobicContact CG-CD1 3.67Å; E480-L484 HydrophobicContact CG-CG 4.08Å; E480-L484 WeakPolarHBondContact O-CB 3.35Å; E480-L484 VanDerWaalsContact O-CG 3.24Å; E480-L484 WeakPolarHBondContact O-CG 3.47Å; E480-L484 PolarHBondContact O-N 2.94Å; V482-L484 VanDerWaalsContact C-N 3.29Å; V482-L484 PolarHBondContact O-N 3.09Å; L484-F486 HydrophobicContact CB-CD2 3.57Å; L484-F486 HydrophobicContact CB-CE2 3.68Å; L484-F486 HydrophobicContact CD1-CD2 4.22Å; L484-F486 HydrophobicContact CD1-CE2 3.91Å; L484-F486 HydrophobicContact CG-CE2 4.44Å
485	G	85.8	Confident	91.5	Very high	12 Å²	12	54.5 Å²	54.5	12%	0.124	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	26.5	179	0	0	0	0	0	113.7	E428 L481 V482 R483	E428-G485 WeakPolarHBondContact CB-O 3.36Å; L481-G485 PolarHBondContact O-N 2.99Å; V482-G485 PolarHBondContact O-N 3.04Å; R483-G485 VanDerWaalsContact C-N 3.25Å; R483-G485 PolarHBondContact O-N 3.32Å
486	F	88.9	Confident	91.6	Very high	70 Å²	70	50 Å²	50	31%	0.307	25%	0.25	S	C	.	.	S	Bend	trans	-91.5	-24.6	176.6	-70.4	-56.6	0	0	0	114.2	R462 L464 L481 L484	R462-F486 PolarHBondContact NH1-O 3.25Å; L464-F486 HydrophobicContact CD1-CB 3.9Å; L464-F486 HydrophobicContact CD1-CD1 4.28Å; L464-F486 HydrophobicContact CD1-CD2 4.36Å; L464-F486 HydrophobicContact CD1-CG 3.94Å; L464-F486 HydrophobicContact CD2-CD1 4Å; L464-F486 HydrophobicContact CD2-CE1 4.06Å; L464-F486 HydrophobicContact CD2-CG 4.4Å; L481-F486 HydrophobicContact CB-CB 4.38Å; L481-F486 HydrophobicContact CD2-CB 4.11Å; L481-F486 HydrophobicContact CD2-CD2 4.01Å; L481-F486 HydrophobicContact CD2-CG 4.43Å; L481-F486 WeakPolarHBondContact O-CB 3.41Å; L481-F486 PolarHBondContact O-N 3.48Å; L484-F486 HydrophobicContact CB-CD2 3.57Å; L484-F486 HydrophobicContact CB-CE2 3.68Å; L484-F486 HydrophobicContact CD1-CD2 4.22Å; L484-F486 HydrophobicContact CD1-CE2 3.91Å; L484-F486 HydrophobicContact CG-CE2 4.44Å
487	V	90.8	Very high	91.6	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	26%	0.258	C	S	.	.	S	Bend	trans	-135.9	138.4	-177	174.3	0	0	0	0	109	F454 L481 V482 D491 V495	F454-V487 HydrophobicContact CE1-CG2 4.2Å; F454-V487 HydrophobicContact CZ-CG2 3.97Å; L481-V487 HydrophobicContact CB-CB 4.31Å; L481-V487 HydrophobicContact CB-CG2 3.97Å; L481-V487 HydrophobicContact CD1-CG2 4.23Å; L481-V487 PolarHBondContact O-N 2.78Å; V482-V487 HydrophobicContact CG2-CB 4.32Å; V482-V487 HydrophobicContact CG2-CG1 4.38Å; V487-D491 HydrophobicContact CG1-CB 4.13Å; V487-V495 HydrophobicContact CG1-CB 4.42Å; V487-V495 HydrophobicContact CG1-CG2 3.79Å; V487-V495 HydrophobicContact CG2-CG1 4.49Å
488	S	91.5	Very high	91.6	Very high	5 Å²	5	54.1 Å²	54.1	4%	0.035	27%	0.265	C	S	.	.			trans	-67.8	142.4	176.3	-170.3	0	0	0	0	110.7	E428 R430 N490 D491 R492	E428-S488 WeakPolarHBondContact O-CA 3.23Å; E428-S488 WeakPolarHBondContact O-CB 3.32Å; E428-S488 PolarHBondContact O-OG 3.18Å; R430-S488 WeakPolarHBondContact O-CB 3.47Å; S488-N490 PolarHBondContact O-N 2.83Å; S488-N490 VanDerWaalsContact O-N 3.07Å; S488-D491 PolarHBondContact O-N 3.2Å; S488-R492 PolarHBondContact O-N 3.48Å
489	D	92	Very high	91.6	Very high	88 Å²	88	54.1 Å²	54.1	47%	0.471	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-54.7	-32.1	176.5	-164.5	42.3	0	0	0	112.8	V482 D491 R492	V482-D489 HydrophobicContact CG1-CB 4.34Å; D489-D491 VanDerWaalsContact C-N 3.25Å; D489-D491 PolarHBondContact O-N 3.37Å; D489-R492 WeakPolarHBondContact O-CB 3.26Å; D489-R492 PolarHBondContact O-N 2.87Å; D489-R492 IonicContact OD1-CZ 2.73Å; D489-R492 IonicContact OD1-NE 3.67Å; D489-R492 PolarHBondContact OD1-NE 3.42Å; D489-R492 IonicContact OD1-NH2 3.85Å; D489-R492 PolarHBondContact OD1-NH2 2.94Å; D489-R492 IonicContact OD2-NH2 3.59Å
490	N	91.8	Very high	91.5	Very high	118 Å²	118	52.8 Å²	52.8	63%	0.631	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-70.5	-15.8	178.1	-64.3	-62.2	0	0	0	114.7	R431 S488	R431-N490 PolarHBondContact NH2-O 2.8Å; S488-N490 PolarHBondContact O-N 2.83Å; S488-N490 VanDerWaalsContact O-N 3.07Å
491	D	92.8	Very high	91.5	Very high	6 Å²	6	54 Å²	54	3%	0.032	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-105.6	1	-179.9	-65.8	-34.9	0	0	0	112.2	R431 V432 V487 S488 D489 E493 M494 V495	R431-D491 VanDerWaalsContact CA-OD2 3.24Å; R431-D491 WeakPolarHBondContact CA-OD2 3.33Å; R431-D491 IonicContact CZ-OD1 3.68Å; R431-D491 IonicContact NE-OD1 2.79Å; R431-D491 PolarHBondContact NE-OD1 3.07Å; R431-D491 IonicContact NE-OD2 2.8Å; R431-D491 PolarHBondContact NE-OD2 3.49Å; R431-D491 IonicContact NH2-OD1 3.81Å; R431-D491 PolarHBondContact NH2-OD1 2.74Å; V432-D491 HydrophobicContact CG2-CB 4.32Å; V432-D491 PolarHBondContact N-OD2 3.1Å; V487-D491 HydrophobicContact CG1-CB 4.13Å; S488-D491 PolarHBondContact O-N 3.2Å; D489-D491 VanDerWaalsContact C-N 3.25Å; D489-D491 PolarHBondContact O-N 3.37Å; D491-E493 PolarHBondContact O-N 2.91Å; D491-M494 HydrophobicContact CB-CE 4.11Å; D491-M494 PolarHBondContact O-N 3.5Å; D491-V495 HydrophobicContact CB-CG2 4.32Å; D491-V495 WeakPolarHBondContact O-CG2 3.46Å; D491-V495 PolarHBondContact O-N 3.39Å
492	R	92.6	Very high	91.3	Very high	72 Å²	72	53.8 Å²	53.8	27%	0.272	28%	0.275	S	S	.	.	H	α-helix	trans	-49.1	-52.4	-175.3	-173.7	-163.9	-69.5	-154.2	1.1	113	V478 E479 V482 S488 D489 A496	V478-R492 HydrophobicContact CG1-CB 4.36Å; V478-R492 HydrophobicContact CG1-CG 3.8Å; E479-R492 VanDerWaalsContact OE1-CD 3.28Å; E479-R492 WeakPolarHBondContact OE1-CD 3.07Å; E479-R492 IonicContact OE1-CZ 3Å; E479-R492 IonicContact OE1-NE 2.91Å; E479-R492 PolarHBondContact OE1-NE 3.5Å; E479-R492 IonicContact OE1-NH1 3.28Å; E479-R492 PolarHBondContact OE1-NH1 2.91Å; E479-R492 IonicContact OE2-CZ 2.64Å; E479-R492 IonicContact OE2-NH1 3.12Å; E479-R492 PolarHBondContact OE2-NH1 3.36Å; V482-R492 HydrophobicContact CG2-CB 4.44Å; V482-R492 HydrophobicContact CG2-CG 4.37Å; S488-R492 PolarHBondContact O-N 3.48Å; D489-R492 WeakPolarHBondContact O-CB 3.26Å; D489-R492 PolarHBondContact O-N 2.87Å; D489-R492 IonicContact OD1-CZ 2.73Å; D489-R492 IonicContact OD1-NE 3.67Å; D489-R492 PolarHBondContact OD1-NE 3.42Å; D489-R492 IonicContact OD1-NH2 3.85Å; D489-R492 PolarHBondContact OD1-NH2 2.94Å; D489-R492 IonicContact OD2-NH2 3.59Å; R492-A496 WeakPolarHBondContact O-CB 3.44Å; R492-A496 PolarHBondContact O-N 3.22Å
493	E	93	Very high	91.1	Very high	154 Å²	154	54.7 Å²	54.7	72%	0.72	28%	0.278	S	S	*	.	H	α-helix	trans	-64.1	-47.7	-177.6	-66.4	-173.6	162.7	0	0	112.1	D491 V495 A496 D497	D491-E493 PolarHBondContact O-N 2.91Å; E493-V495 VanDerWaalsContact C-N 3.35Å; E493-V495 PolarHBondContact O-N 3.42Å; E493-A496 PolarHBondContact O-N 3.33Å; E493-A496 VanDerWaalsContact O-N 3.15Å; E493-D497 PolarHBondContact O-N 3.09Å
494	M	93.7	Very high	90.9	Very high	72 Å²	72	50.2 Å²	50.2	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-39.2	-177.7	178.5	-84.1	-59.8	0	0	112.5	V432 M435 D491 T498	V432-M494 HydrophobicContact CB-CE 3.75Å; V432-M494 HydrophobicContact CG1-CE 3.82Å; M435-M494 HydrophobicContact CG-SD 4.02Å; M435-M494 HydrophobicContact SD-CE 4.2Å; M435-M494 HydrophobicContact SD-SD 3.45Å; D491-M494 HydrophobicContact CB-CE 4.11Å; D491-M494 PolarHBondContact O-N 3.5Å; M494-T498 PolarHBondContact O-N 3.14Å; M494-T498 PolarHBondContact O-OG1 3.05Å
495	V	93.8	Very high	90.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-40.9	175.2	179.1	0	0	0	0	110.6	M435 F454 V478 V487 D491 E493 D497 T498 I499	M435-V495 HydrophobicContact CE-CB 4.34Å; M435-V495 HydrophobicContact CE-CG1 3.91Å; M435-V495 HydrophobicContact CE-CG2 4.41Å; M435-V495 HydrophobicContact SD-CB 4.15Å; M435-V495 HydrophobicContact SD-CG1 4.33Å; M435-V495 HydrophobicContact SD-CG2 3.77Å; F454-V495 HydrophobicContact CE1-CG1 4.11Å; F454-V495 HydrophobicContact CE1-CG2 4.07Å; F454-V495 HydrophobicContact CZ-CG1 4.21Å; V478-V495 HydrophobicContact CG1-CB 4.4Å; V478-V495 HydrophobicContact CG1-CG1 4.47Å; V478-V495 HydrophobicContact CG2-CB 4.19Å; V478-V495 HydrophobicContact CG2-CG1 3.73Å; V487-V495 HydrophobicContact CG1-CB 4.42Å; V487-V495 HydrophobicContact CG1-CG2 3.79Å; V487-V495 HydrophobicContact CG2-CG1 4.49Å; D491-V495 HydrophobicContact CB-CG2 4.32Å; D491-V495 WeakPolarHBondContact O-CG2 3.46Å; D491-V495 PolarHBondContact O-N 3.39Å; E493-V495 VanDerWaalsContact C-N 3.35Å; E493-V495 PolarHBondContact O-N 3.42Å; V495-D497 PolarHBondContact O-N 3.33Å; V495-T498 PolarHBondContact O-N 2.78Å; V495-I499 HydrophobicContact CG1-CD1 3.95Å; V495-I499 HydrophobicContact CG1-CG1 4.48Å; V495-I499 WeakPolarHBondContact O-CG1 3.43Å; V495-I499 PolarHBondContact O-N 3.23Å
496	A	94.3	Very high	89.7	Confident	8 Å²	8	56.3 Å²	56.3	7%	0.066	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-43.4	179.4	0	0	0	0	0	111.6	A474 V478 R492 E493 T498 I499 A500	A474-A496 WeakPolarHBondContact CB-O 3.34Å; V478-A496 HydrophobicContact CB-CB 4.33Å; V478-A496 HydrophobicContact CG2-CB 3.92Å; R492-A496 WeakPolarHBondContact O-CB 3.44Å; R492-A496 PolarHBondContact O-N 3.22Å; E493-A496 PolarHBondContact O-N 3.33Å; E493-A496 VanDerWaalsContact O-N 3.15Å; A496-T498 PolarHBondContact O-N 3.01Å; A496-I499 PolarHBondContact O-N 3.01Å; A496-A500 WeakPolarHBondContact O-CB 3.43Å; A496-A500 PolarHBondContact O-N 3.5Å
497	D	92.8	Very high	88.4	Confident	104 Å²	104	54.7 Å²	54.7	56%	0.556	30%	0.299	S	S	*	.	H	α-helix	trans	-61.2	-44.9	176.9	-71.2	-17.8	0	0	0	111.5	E493 V495 I499 A500 D501	E493-D497 PolarHBondContact O-N 3.09Å; V495-D497 PolarHBondContact O-N 3.33Å; D497-I499 VanDerWaalsContact C-N 3.35Å; D497-I499 PolarHBondContact O-N 2.86Å; D497-A500 PolarHBondContact O-N 2.8Å; D497-D501 PolarHBondContact O-N 2.99Å
498	T	91.8	Very high	86.5	Confident	39 Å²	39	59.8 Å²	59.8	24%	0.239	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-37.9	-179.2	-53.1	0	0	0	0	112.2	M435 A437 M494 V495 A496 S502	M435-T498 VanDerWaalsContact CE-CB 3.46Å; M435-T498 HydrophobicContact CE-CG2 3.56Å; M435-T498 HydrophobicContact CG-CG2 4.15Å; M435-T498 HydrophobicContact SD-CG2 4.07Å; A437-T498 HydrophobicContact CB-CG2 4.28Å; M494-T498 PolarHBondContact O-N 3.14Å; M494-T498 PolarHBondContact O-OG1 3.05Å; V495-T498 PolarHBondContact O-N 2.78Å; A496-T498 PolarHBondContact O-N 3.01Å; T498-S502 PolarHBondContact O-N 3.21Å
499	I	92.5	Very high	84.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-44.7	174.2	-67.2	175.5	0	0	0	110	A437 L450 L452 A474 L477 V478 L481 V495 A496 D497 D501 S502 M503	A437-I499 HydrophobicContact CB-CG1 4.39Å; L450-I499 HydrophobicContact CD2-CD1 4.32Å; L450-I499 HydrophobicContact CD2-CG2 4.2Å; L452-I499 HydrophobicContact CD1-CD1 4.01Å; L452-I499 HydrophobicContact CD2-CD1 3.96Å; L452-I499 HydrophobicContact CD2-CG1 3.76Å; A474-I499 HydrophobicContact CB-CB 4.04Å; A474-I499 HydrophobicContact CB-CG2 3.74Å; L477-I499 HydrophobicContact CD1-CG2 4.32Å; V478-I499 HydrophobicContact CG2-CD1 3.74Å; L481-I499 HydrophobicContact CD1-CD1 4.38Å; V495-I499 HydrophobicContact CG1-CD1 3.95Å; V495-I499 HydrophobicContact CG1-CG1 4.48Å; V495-I499 WeakPolarHBondContact O-CG1 3.43Å; V495-I499 PolarHBondContact O-N 3.23Å; A496-I499 PolarHBondContact O-N 3.01Å; D497-I499 VanDerWaalsContact C-N 3.35Å; D497-I499 PolarHBondContact O-N 2.86Å; I499-D501 VanDerWaalsContact C-N 3.33Å; I499-D501 PolarHBondContact O-N 2.81Å; I499-S502 PolarHBondContact O-N 3.31Å; I499-M503 HydrophobicContact CG2-CG 4.21Å; I499-M503 HydrophobicContact CG2-SD 3.77Å; I499-M503 VanDerWaalsContact O-CG 3.26Å; I499-M503 WeakPolarHBondContact O-CG 3.32Å; I499-M503 PolarHBondContact O-N 3.21Å
500	A	91.5	Very high	82.7	Confident	41 Å²	41	61.6 Å²	61.6	34%	0.339	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-42.6	178.5	0	0	0	0	0	112.2	A474 A496 D497 S502 M503 A504	A474-A500 HydrophobicContact CB-CB 3.83Å; A496-A500 WeakPolarHBondContact O-CB 3.43Å; A496-A500 PolarHBondContact O-N 3.5Å; D497-A500 PolarHBondContact O-N 2.8Å; A500-S502 PolarHBondContact O-N 3.26Å; A500-M503 PolarHBondContact O-N 3.35Å; A500-A504 WeakPolarHBondContact O-CB 3.48Å; A500-A504 PolarHBondContact O-N 3.45Å
501	D	90.1	Very high	80.8	Confident	108 Å²	108	59 Å²	59	58%	0.578	33%	0.331	S	S	*	.	H	α-helix	trans	-61.1	-43.7	176	-79.3	-15.5	0	0	0	111.9	D497 I499 A504 H505	D497-D501 PolarHBondContact O-N 2.99Å; I499-D501 VanDerWaalsContact C-N 3.33Å; I499-D501 PolarHBondContact O-N 2.81Å; D501-A504 PolarHBondContact O-N 3.46Å; D501-H505 PolarHBondContact O-N 3.31Å
502	S	88.1	Confident	78.8	Confident	19 Å²	19	62.5 Å²	62.5	13%	0.133	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-42.8	177.8	-167.1	0	0	0	0	112	A437 T498 I499 A500 A504 H505 Y506	A437-S502 VanDerWaalsContact C-OG 3.28Å; A437-S502 WeakPolarHBondContact O-CB 3.2Å; A437-S502 PolarHBondContact O-OG 3.01Å; T498-S502 PolarHBondContact O-N 3.21Å; I499-S502 PolarHBondContact O-N 3.31Å; A500-S502 PolarHBondContact O-N 3.26Å; S502-A504 VanDerWaalsContact C-N 3.32Å; S502-A504 PolarHBondContact O-N 3.46Å; S502-H505 PolarHBondContact O-N 3Å; S502-Y506 PolarHBondContact O-N 3.12Å; S502-Y506 VanDerWaalsContact O-N 3.09Å
503	M	88.2	Confident	76.9	Confident	45 Å²	45	61.7 Å²	61.7	22%	0.222	36%	0.361	C	S	.	.	H	α-helix	trans	-61.8	-38.8	174.2	-67.3	171.8	92.9	0	0	112.1	V439 F468 E472 A474 I499 A500 G507	V439-M503 HydrophobicContact CG2-CG 4.31Å; F468-M503 HydrophobicContact CD2-CE 3.95Å; F468-M503 HydrophobicContact CE2-CE 3.34Å; F468-M503 HydrophobicContact CZ-CE 3.97Å; F468-M503 HydrophobicContact CZ-CG 4.27Å; E472-M503 WeakPolarHBondContact O-CE 3.25Å; A474-M503 HydrophobicContact CB-SD 3.96Å; I499-M503 HydrophobicContact CG2-CG 4.21Å; I499-M503 HydrophobicContact CG2-SD 3.77Å; I499-M503 VanDerWaalsContact O-CG 3.26Å; I499-M503 WeakPolarHBondContact O-CG 3.32Å; I499-M503 PolarHBondContact O-N 3.21Å; A500-M503 PolarHBondContact O-N 3.35Å; M503-G507 PolarHBondContact O-N 2.58Å
504	A	84.4	Confident	74.9	Confident	54 Å²	54	60.6 Å²	60.6	45%	0.446	36%	0.356	S	S	.	.	H	α-helix	trans	-70.6	-39.2	178.2	0	0	0	0	0	112.5	A500 D501 S502 Y506 G507 L508	A500-A504 WeakPolarHBondContact O-CB 3.48Å; A500-A504 PolarHBondContact O-N 3.45Å; D501-A504 PolarHBondContact O-N 3.46Å; S502-A504 VanDerWaalsContact C-N 3.32Å; S502-A504 PolarHBondContact O-N 3.46Å; A504-Y506 VanDerWaalsContact C-N 3.32Å; A504-Y506 PolarHBondContact O-N 3.22Å; A504-G507 PolarHBondContact O-N 2.76Å; A504-L508 PolarHBondContact O-N 3.29Å; A504-L508 VanDerWaalsContact O-N 3.14Å
505	H	78.8	Confident	73	Confident	137 Å²	137	64.4 Å²	64.4	63%	0.634	37%	0.371	S	S	*	.	H	α-helix	trans	-63.7	-37.7	175.3	-85.3	25.5	0	0	0	112.4	D501 S502 L508 A509	D501-H505 PolarHBondContact O-N 3.31Å; S502-H505 PolarHBondContact O-N 3Å; H505-L508 PolarHBondContact O-N 3.16Å; H505-A509 PolarHBondContact O-N 2.81Å
506	Y	71.6	Confident	71.2	Confident	42 Å²	42	70.9 Å²	70.9	17%	0.165	40%	0.401	C	S	.	.	H	α-helix	trans	-59.2	-46.3	172.6	-171.1	-90.6	0	0	0	111.8	V439 K448 S502 A504 L508 A509 D510	V439-Y506 HydrophobicContact CB-CD2 4.15Å; V439-Y506 HydrophobicContact CB-CG 4.32Å; V439-Y506 HydrophobicContact CG1-CD1 4.43Å; V439-Y506 HydrophobicContact CG1-CD2 3.85Å; V439-Y506 HydrophobicContact CG1-CE2 4.39Å; V439-Y506 HydrophobicContact CG1-CG 3.88Å; V439-Y506 VanDerWaalsContact O-CD2 3.26Å; V439-Y506 WeakPolarHBondContact O-CD2 3.32Å; K448-Y506 HydrophobicContact CD-CD1 4.35Å; K448-Y506 HydrophobicContact CD-CE1 4.23Å; S502-Y506 PolarHBondContact O-N 3.12Å; S502-Y506 VanDerWaalsContact O-N 3.09Å; A504-Y506 VanDerWaalsContact C-N 3.32Å; A504-Y506 PolarHBondContact O-N 3.22Å; Y506-L508 VanDerWaalsContact C-N 3.32Å; Y506-L508 PolarHBondContact O-N 2.94Å; Y506-A509 PolarHBondContact O-N 3.25Å; Y506-D510 WeakPolarHBondContact CE1-OD2 3.15Å; Y506-D510 PolarHBondContact O-N 3.47Å; Y506-D510 VanDerWaalsContact O-N 3.12Å
507	G	61	Low	69.4	Low	36 Å²	36	77.2 Å²	77.2	37%	0.371	43%	0.427	S	S	.	.	H	α-helix	trans	-63.6	-32.3	178.3	0	0	0	0	0	114.3	M503 A504 T511	M503-G507 PolarHBondContact O-N 2.58Å; A504-G507 PolarHBondContact O-N 2.76Å; G507-T511 WeakPolarHBondContact O-CG2 3.45Å; G507-T511 PolarHBondContact O-N 2.91Å
508	L	51.5	Low	67.6	Low	108 Å²	108	77.4 Å²	77.4	57%	0.565	43%	0.427	S	S	*	.	H	α-helix	trans	-72.6	-39.7	174	-79.3	157.9	0	0	0	111.9	A504 H505 Y506 T511 V512	A504-L508 PolarHBondContact O-N 3.29Å; A504-L508 VanDerWaalsContact O-N 3.14Å; H505-L508 PolarHBondContact O-N 3.16Å; Y506-L508 VanDerWaalsContact C-N 3.32Å; Y506-L508 PolarHBondContact O-N 2.94Å; L508-T511 PolarHBondContact O-N 2.92Å; L508-T511 PolarHBondContact O-OG1 2.87Å; L508-V512 WeakPolarHBondContact O-CG2 3.4Å; L508-V512 PolarHBondContact O-N 3.05Å; L508-V512 VanDerWaalsContact O-N 3.16Å
509	A	51	Low	66	Low	58 Å²	58	82.4 Å²	82.4	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-63.5	-41	178.8	0	0	0	0	0	112.2	H505 Y506 T511 V512 A513	H505-A509 PolarHBondContact O-N 2.81Å; Y506-A509 PolarHBondContact O-N 3.25Å; A509-T511 PolarHBondContact O-N 3.41Å; A509-V512 PolarHBondContact O-N 3.11Å; A509-A513 WeakPolarHBondContact O-CB 3.41Å; A509-A513 PolarHBondContact O-N 2.96Å
510	D	51.7	Low	64.2	Low	72 Å²	72	85.1 Å²	85.1	39%	0.385	47%	0.465	S	S	.	.	H	α-helix	trans	-61.7	-41.3	175.2	-80.3	-19.8	0	0	0	111.8	Y506 V512 A513 E514	Y506-D510 WeakPolarHBondContact CE1-OD2 3.15Å; Y506-D510 PolarHBondContact O-N 3.47Å; Y506-D510 VanDerWaalsContact O-N 3.12Å; D510-V512 PolarHBondContact O-N 3.06Å; D510-A513 PolarHBondContact O-N 3.48Å; D510-E514 WeakPolarHBondContact O-CB 3.37Å; D510-E514 WeakPolarHBondContact O-CG 3.47Å; D510-E514 PolarHBondContact O-N 3.42Å
511	T	50.9	Low	62.7	Low	64 Å²	64	87.6 Å²	87.6	39%	0.393	47%	0.473	S	S	.	.	H	α-helix	trans	-70.3	-27.6	179	61.8	0	0	0	0	114.2	G507 L508 A509 K515	G507-T511 WeakPolarHBondContact O-CG2 3.45Å; G507-T511 PolarHBondContact O-N 2.91Å; L508-T511 PolarHBondContact O-N 2.92Å; L508-T511 PolarHBondContact O-OG1 2.87Å; A509-T511 PolarHBondContact O-N 3.41Å; T511-K515 WeakPolarHBondContact O-CB 3.47Å; T511-K515 WeakPolarHBondContact O-CG 3.34Å; T511-K515 PolarHBondContact O-N 3.34Å
512	V	52.3	Low	61.1	Low	79 Å²	79	88.7 Å²	88.7	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-76.9	-43.3	175	176.3	0	0	0	0	109.9	L508 A509 D510 E514 K515 E516	L508-V512 WeakPolarHBondContact O-CG2 3.4Å; L508-V512 PolarHBondContact O-N 3.05Å; L508-V512 VanDerWaalsContact O-N 3.16Å; A509-V512 PolarHBondContact O-N 3.11Å; D510-V512 PolarHBondContact O-N 3.06Å; V512-E514 PolarHBondContact O-N 3.03Å; V512-K515 PolarHBondContact O-N 3.5Å; V512-E516 PolarHBondContact O-N 2.9Å
513	A	51.8	Low	59.5	Low	56 Å²	56	94.1 Å²	94.1	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-40.3	175.9	0	0	0	0	0	112.3	A509 D510 E516 K517	A509-A513 WeakPolarHBondContact O-CB 3.41Å; A509-A513 PolarHBondContact O-N 2.96Å; D510-A513 PolarHBondContact O-N 3.48Å; A513-E516 PolarHBondContact O-N 3.45Å; A513-K517 WeakPolarHBondContact O-CB 3.35Å; A513-K517 PolarHBondContact O-N 3.34Å
514	E	52.1	Low	57.9	Low	131 Å²	131	98.6 Å²	98.6	61%	0.612	52%	0.521	S	S	*	.	H	α-helix	trans	-65.5	-41	174	-78.9	-171.5	151.2	0	0	112.3	D510 V512 K517 L518	D510-E514 WeakPolarHBondContact O-CB 3.37Å; D510-E514 WeakPolarHBondContact O-CG 3.47Å; D510-E514 PolarHBondContact O-N 3.42Å; V512-E514 PolarHBondContact O-N 3.03Å; E514-K517 PolarHBondContact O-N 3.35Å; E514-L518 WeakPolarHBondContact O-CB 3.44Å; E514-L518 WeakPolarHBondContact O-CD1 3.43Å; E514-L518 PolarHBondContact O-N 3.19Å
515	K	52.8	Low	56.5	Low	152 Å²	152	99.2 Å²	99.2	66%	0.661	53%	0.526	S	S	*	.	H	α-helix	trans	-68.1	-33.7	177.6	-81.5	179.1	-180	174.4	0	113.4	T511 V512 K519	T511-K515 WeakPolarHBondContact O-CB 3.47Å; T511-K515 WeakPolarHBondContact O-CG 3.34Å; T511-K515 PolarHBondContact O-N 3.34Å; V512-K515 PolarHBondContact O-N 3.5Å; K515-K519 WeakPolarHBondContact O-CB 3.37Å; K515-K519 PolarHBondContact O-N 3.03Å
516	E	56.2	Low	55.3	Low	136 Å²	136	100 Å²	100	64%	0.636	54%	0.535	S	S	*	.	H	α-helix	trans	-71.7	-37.1	174.1	-73.3	-169.1	155.5	0	0	111.6	V512 A513 K519 S520	V512-E516 PolarHBondContact O-N 2.9Å; A513-E516 PolarHBondContact O-N 3.45Å; E516-K519 PolarHBondContact O-N 3.29Å; E516-S520 PolarHBondContact O-N 3.3Å; E516-S520 PolarHBondContact O-OG 3.02Å
517	K	55.9	Low	54.5	Low	140 Å²	140	102.2 Å²	102.2	61%	0.609	56%	0.557	S	S	*	*	H	α-helix	trans	-69.4	-40.4	176.6	-159.3	176.6	-176.3	-174.5	0	113	A513 E514 K519 S520 D521	A513-K517 WeakPolarHBondContact O-CB 3.35Å; A513-K517 PolarHBondContact O-N 3.34Å; E514-K517 PolarHBondContact O-N 3.35Å; K517-K519 VanDerWaalsContact C-N 3.3Å; K517-K519 PolarHBondContact O-N 3.19Å; K517-S520 WeakPolarHBondContact CA-OG 3.49Å; K517-S520 PolarHBondContact O-N 2.9Å; K517-S520 PolarHBondContact O-OG 3.37Å; K517-D521 VanDerWaalsContact O-CG 3.31Å; K517-D521 PolarHBondContact O-N 3.06Å
518	L	56.6	Low	53.8	Low	108 Å²	108	107.5 Å²	107.5	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-63.4	-35.7	172.2	-94.3	135.1	0	0	0	112.1	E514 E522	E514-L518 WeakPolarHBondContact O-CB 3.44Å; E514-L518 WeakPolarHBondContact O-CD1 3.43Å; E514-L518 PolarHBondContact O-N 3.19Å; L518-E522 WeakPolarHBondContact O-CB 3.28Å; L518-E522 WeakPolarHBondContact O-CG 3.45Å; L518-E522 PolarHBondContact O-N 2.79Å
519	K	56.5	Low	53.8	Low	144 Å²	144	108.1 Å²	108.1	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-68.5	-37.1	174.2	-101	179.3	174.1	178.6	0	113.2	K515 E516 K517 L523	K515-K519 WeakPolarHBondContact O-CB 3.37Å; K515-K519 PolarHBondContact O-N 3.03Å; E516-K519 PolarHBondContact O-N 3.29Å; K517-K519 VanDerWaalsContact C-N 3.3Å; K517-K519 PolarHBondContact O-N 3.19Å; K519-L523 WeakPolarHBondContact O-CB 3.46Å; K519-L523 WeakPolarHBondContact O-CD1 3.38Å; K519-L523 VanDerWaalsContact O-CG 3.28Å; K519-L523 WeakPolarHBondContact O-CG 3.46Å; K519-L523 PolarHBondContact O-N 3.49Å
520	S	56.4	Low	53.7	Low	58 Å²	58	115 Å²	115	41%	0.406	62%	0.624	S	S	.	*	H	α-helix	trans	-69.3	-38.2	175.5	50.2	0	0	0	0	111.9	E516 K517 L523 E524	E516-S520 PolarHBondContact O-N 3.3Å; E516-S520 PolarHBondContact O-OG 3.02Å; K517-S520 WeakPolarHBondContact CA-OG 3.49Å; K517-S520 PolarHBondContact O-N 2.9Å; K517-S520 PolarHBondContact O-OG 3.37Å; S520-L523 PolarHBondContact O-N 3.24Å; S520-E524 PolarHBondContact O-N 3Å
521	D	58.6	Low	53.8	Low	93 Å²	93	117.1 Å²	117.1	50%	0.497	64%	0.635	S	S	.	*	H	α-helix	trans	-72.6	-34.9	179.6	-67.5	-6.4	0	0	0	111.9	K517 E524 A525	K517-D521 VanDerWaalsContact O-CG 3.31Å; K517-D521 PolarHBondContact O-N 3.06Å; D521-E524 PolarHBondContact O-N 3.24Å; D521-A525 WeakPolarHBondContact O-CB 3.23Å; D521-A525 PolarHBondContact O-N 3.07Å
522	E	56	Low	53.9	Low	131 Å²	131	119.9 Å²	119.9	61%	0.612	65%	0.648	S	S	*	*	H	α-helix	trans	-67.1	-35.4	171.7	-80.2	-176.4	152.2	0	0	112.5	L518 D526	L518-E522 WeakPolarHBondContact O-CB 3.28Å; L518-E522 WeakPolarHBondContact O-CG 3.45Å; L518-E522 PolarHBondContact O-N 2.79Å; E522-D526 PolarHBondContact O-N 3.43Å
523	L	55.3	Low	54	Low	133 Å²	133	122.2 Å²	122.2	70%	0.696	66%	0.658	S	S	*	*	H	α-helix	trans	-73.5	-30.2	176.9	-76.7	165.2	0	0	0	113	K519 S520	K519-L523 WeakPolarHBondContact O-CB 3.46Å; K519-L523 WeakPolarHBondContact O-CD1 3.38Å; K519-L523 VanDerWaalsContact O-CG 3.28Å; K519-L523 WeakPolarHBondContact O-CG 3.46Å; K519-L523 PolarHBondContact O-N 3.49Å; S520-L523 PolarHBondContact O-N 3.24Å
524	E	53.7	Low	54.1	Low	138 Å²	138	126.1 Å²	126.1	65%	0.645	67%	0.669	S	S	*	*	H	α-helix	trans	-74.6	-36.6	172	-79.7	-166	158.3	0	0	112	S520 D521 S527	S520-E524 PolarHBondContact O-N 3Å; D521-E524 PolarHBondContact O-N 3.24Å; E524-S527 PolarHBondContact O-N 3.5Å; E524-S527 PolarHBondContact O-OG 3.39Å
525	A	55	Low	54.2	Low	67 Å²	67	125.8 Å²	125.8	55%	0.554	67%	0.673	S	S	*	*	H	α-helix	trans	-68.8	-34	-180	0	0	0	0	0	114	D521 S527	D521-A525 WeakPolarHBondContact O-CB 3.23Å; D521-A525 PolarHBondContact O-N 3.07Å; A525-S527 VanDerWaalsContact C-N 3.28Å; A525-S527 PolarHBondContact O-N 2.86Å
526	D	55.3	Low	54.3	Low	153 Å²	153	124 Å²	124	82%	0.818	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-5.1	178.8	-101.1	-6.3	0	0	0	113.8	E522	E522-D526 PolarHBondContact O-N 3.43Å
527	S	53.6	Low	54.2	Low	90 Å²	90	123.1 Å²	123.1	63%	0.629	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	1.8	177.5	74.9	0	0	0	0	114.3	E524 A525	E524-S527 PolarHBondContact O-N 3.5Å; E524-S527 PolarHBondContact O-OG 3.39Å; A525-S527 VanDerWaalsContact C-N 3.28Å; A525-S527 PolarHBondContact O-N 2.86Å
528	L	46.5	Very low	54.1	Low	147 Å²	147	121.8 Å²	121.8	77%	0.77	68%	0.681	S	S	*	*			trans	-121.4	59.3	-172.8	-88	151.1	0	0	0	112.4
529	V	50.8	Low	53.9	Low	121 Å²	121	123 Å²	123	73%	0.733	69%	0.691	S	S	*	*			trans	-137.7	130.4	164.5	-176.8	0	0	0	0	106.9
530	P	48.7	Very low	53.6	Low	201 Å²	201	121.1 Å²	121.1	100%	1.305	70%	0.697	S	S	*	*			trans	-68.2	0	-145.7	25.9	-36.4	0	0	0	117.6

Retrieved 530 of 530 residues in 1007.8 ms (Link to these results)

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