A0A3Q0KM13_SCHMA Loading...

RuvB-like helicase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KM13, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 469 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	37.5	Very low	33.3	Very low	237 Å²	237	145.5 Å²	145.5	100%	1.167	83%	0.829	S	S	*	*				0	84.7	0	-68.2	-177	-170.3	0	0	106.8
2	V	33.2	Very low	32.8	Very low	127 Å²	127	140.8 Å²	140.8	77%	0.77	82%	0.822	S	S	*	*				78.5	97.8	103.5	178.7	0	0	0	0	112.4
3	N	30.5	Very low	32.5	Very low	137 Å²	137	137.3 Å²	137.3	73%	0.733	82%	0.819	S	S	*	*			trans	68.2	117.9	138.2	-60.1	-5.8	0	0	0	120.7
4	L	38.9	Very low	32.3	Very low	165 Å²	165	144.3 Å²	144.3	86%	0.864	82%	0.824	S	S	*	*				179.5	92.4	98.6	-95.9	142.2	0	0	0	110.7
5	T	30.9	Very low	32.3	Very low	137 Å²	137	146.3 Å²	146.3	84%	0.84	82%	0.823	S	S	*	*			trans	-70.5	119	152.5	41.3	0	0	0	0	108.6
6	A	35.7	Very low	32.8	Very low	86 Å²	86	147.2 Å²	147.2	71%	0.711	82%	0.823	S	S	*	*			trans	-124.3	95.5	162.4	0	0	0	0	0	108.1	V8	A6-V8 PolarHBondContact O-N 3.21Å
7	T	32.1	Very low	33	Very low	122 Å²	122	145.9 Å²	145.9	75%	0.748	82%	0.82	S	S	*	*			trans	-51.4	118.7	167.4	42.1	0	0	0	0	110.6	Q9	T7-Q9 VanDerWaalsContact C-N 3.3Å; T7-Q9 PolarHBondContact O-N 3.44Å
8	V	34.8	Very low	33.7	Very low	134 Å²	134	148.8 Å²	148.8	81%	0.812	82%	0.816	S	S	*	*			trans	-66.7	93.3	163	178.4	0	0	0	0	106.8	A6 E10	A6-V8 PolarHBondContact O-N 3.21Å; V8-E10 PolarHBondContact O-N 2.87Å
9	Q	30.4	Very low	34.5	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.822	82%	0.82	S	S	*	*			trans	-69.1	102.2	160.7	-80.6	177.3	-20.8	0	0	106.6	T7 A11	T7-Q9 VanDerWaalsContact C-N 3.3Å; T7-Q9 PolarHBondContact O-N 3.44Å; Q9-A11 VanDerWaalsContact C-N 3.31Å; Q9-A11 PolarHBondContact O-N 3.47Å
10	E	31.2	Very low	35.6	Very low	183 Å²	183	150.6 Å²	150.6	86%	0.855	82%	0.816	S	S	*	*			trans	-53.5	100.7	159.1	-77	176.7	145.4	0	0	107.5	V8 A12	V8-E10 PolarHBondContact O-N 2.87Å; E10-A12 PolarHBondContact O-N 3.25Å
11	A	30.8	Very low	37.3	Very low	96 Å²	96	154.3 Å²	154.3	79%	0.793	82%	0.818	S	S	*	*			trans	-58	111.5	168.6	0	0	0	0	0	107.1	Q9 A13	Q9-A11 VanDerWaalsContact C-N 3.31Å; Q9-A11 PolarHBondContact O-N 3.47Å; A11-A13 PolarHBondContact O-N 2.97Å
12	A	27.9	Very low	39.1	Very low	90 Å²	90	147.3 Å²	147.3	74%	0.744	79%	0.785	S	S	*	*			trans	-37.1	114.4	174.3	0	0	0	0	0	110.5	E10 R14	E10-A12 PolarHBondContact O-N 3.25Å; A12-R14 VanDerWaalsContact C-N 3.32Å; A12-R14 PolarHBondContact O-N 2.81Å
13	A	29	Very low	41.3	Very low	95 Å²	95	142.9 Å²	142.9	79%	0.785	76%	0.764	S	S	*	*			trans	-54.2	100	166.7	0	0	0	0	0	107.3	A11 E15	A11-A13 PolarHBondContact O-N 2.97Å; A13-E15 VanDerWaalsContact C-N 3.27Å; A13-E15 PolarHBondContact O-N 2.92Å
14	R	29.9	Very low	43.6	Very low	235 Å²	235	139.7 Å²	139.7	89%	0.887	76%	0.757	S	S	*	*			trans	-61.6	101.1	161	-76.7	-179.5	173.7	177	-1.9	104.9	A12 I16	A12-R14 VanDerWaalsContact C-N 3.32Å; A12-R14 PolarHBondContact O-N 2.81Å; R14-I16 PolarHBondContact O-N 2.91Å
15	E	31.7	Very low	45.7	Very low	175 Å²	175	134.4 Å²	134.4	82%	0.818	73%	0.728	S	S	*	*			trans	-44.4	116.3	164.7	-78.8	179.3	144	0	0	107.3	A13 T17	A13-E15 VanDerWaalsContact C-N 3.27Å; A13-E15 PolarHBondContact O-N 2.92Å; E15-T17 PolarHBondContact O-N 3.14Å
16	I	39.6	Very low	48.1	Very low	160 Å²	160	129.8 Å²	129.8	82%	0.821	70%	0.702	S	S	*	*			trans	-64.9	94.3	172.7	-60.8	165	0	0	0	104	R14 R18	R14-I16 PolarHBondContact O-N 2.91Å; I16-R18 PolarHBondContact O-N 3.11Å
17	T	36.8	Very low	50.5	Low	126 Å²	126	126.5 Å²	126.5	77%	0.773	67%	0.671	S	S	*	*			trans	-57.2	110.6	171.6	42.9	0	0	0	0	105.9	E15	E15-T17 PolarHBondContact O-N 3.14Å
18	R	45.2	Very low	53.2	Low	198 Å²	198	120.9 Å²	120.9	75%	0.747	64%	0.637	S	S	*	*			trans	-53.7	146.9	169	-71.9	-176.6	176.4	-177.9	-0	107	I16 E20	I16-R18 PolarHBondContact O-N 3.11Å; R18-E20 CarbonylContact O-C 3.51Å; R18-E20 PolarHBondContact O-N 2.8Å
19	I	49.6	Very low	55.6	Low	172 Å²	172	123.2 Å²	123.2	88%	0.882	63%	0.631	S	S	*	*	S	Bend	trans	-54.2	-29.2	179.9	-65	168.8	0	0	0	110.5	R21	I19-R21 PolarHBondContact O-N 2.82Å
20	E	57	Low	58.5	Low	160 Å²	160	114.9 Å²	114.9	75%	0.748	59%	0.592	S	S	*	*			trans	-63.4	98.6	168.6	-63.9	177	176.2	0	0	110.9	R18	R18-E20 CarbonylContact O-C 3.51Å; R18-E20 PolarHBondContact O-N 2.8Å
21	R	70.3	Confident	61.3	Low	229 Å²	229	106.3 Å²	106.3	86%	0.864	55%	0.552	S	S	*	*			trans	-78.3	148.6	166.3	-63.5	179.4	-174.6	168.1	2	109.2	I19 G23	I19-R21 PolarHBondContact O-N 2.82Å; R21-G23 PolarHBondContact O-N 2.92Å
22	I	76.6	Confident	64.1	Low	91 Å²	91	101.7 Å²	101.7	47%	0.467	51%	0.514	S	S	.	.			trans	-56.1	116.3	171.6	-59.4	168	0	0	0	107.9	E377 E378	I22-E377 WeakPolarHBondContact CD1-O 3.06Å; I22-E377 HydrophobicContact CG2-CG 4.05Å; I22-E378 HydrophobicContact CG2-CG 4.12Å
23	G	78.7	Confident	67.2	Low	33 Å²	33	99.2 Å²	99.2	34%	0.34	49%	0.488	S	S	.	.			trans	-106.6	171.8	-174.2	0	0	0	0	0	111.5	R21 H25 S26 R374	R21-G23 PolarHBondContact O-N 2.92Å; G23-H25 PolarHBondContact O-N 2.77Å; G23-S26 PolarHBondContact N-OG 2.96Å; G23-S26 PolarHBondContact O-N 2.82Å; G23-S26 PolarHBondContact O-OG 2.81Å; G23-R374 PolarHBondContact O-NH1 3.41Å
24	A	78.5	Confident	70.1	Confident	70 Å²	70	96.9 Å²	96.9	58%	0.579	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.8	175.2	0	0	0	0	0	113.3	R374	A24-R374 PolarHBondContact O-NH1 2.93Å; A24-R374 PolarHBondContact O-NH2 3.07Å
25	H	82.1	Confident	72.8	Confident	54 Å²	54	93.7 Å²	93.7	25%	0.25	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	14.8	179.2	-64.1	-65.5	0	0	0	114.3	G23 H27 I28 M88	G23-H25 PolarHBondContact O-N 2.77Å; H25-H27 VanDerWaalsContact C-N 3.34Å; H25-H27 PolarHBondContact O-N 3.02Å; H25-I28 HydrophobicContact CB-CD1 4Å; H25-I28 WeakPolarHBondContact O-CB 3.41Å; H25-I28 PolarHBondContact O-N 2.87Å; H25-I28 VanDerWaalsContact O-N 3.1Å; H25-M88 HydrophobicContact CB-CE 4.46Å; H25-M88 HydrophobicContact CB-SD 3.35Å; H25-M88 WeakPolarHBondContact CB-SD 3.28Å
26	S	81.9	Confident	75.5	Confident	41 Å²	41	91.6 Å²	91.6	29%	0.287	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-35.9	-176.3	60	0	0	0	0	114	G23 I28 E377	G23-S26 PolarHBondContact N-OG 2.96Å; G23-S26 PolarHBondContact O-N 2.82Å; G23-S26 PolarHBondContact O-OG 2.81Å; S26-I28 PolarHBondContact O-N 2.8Å; S26-I28 VanDerWaalsContact O-N 3.1Å; S26-E377 WeakPolarHBondContact CB-OE1 3.45Å; S26-E377 PolarHBondContact OG-OE1 2.94Å
27	H	86.9	Confident	77.7	Confident	17 Å²	17	86.9 Å²	86.9	8%	0.079	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-18.5	173.7	64.2	-55.1	0	0	0	115.2	H25 R29 G45 I373 R374 E377	H25-H27 VanDerWaalsContact C-N 3.34Å; H25-H27 PolarHBondContact O-N 3.02Å; H27-R29 PolarHBondContact O-N 3.12Å; H27-G45 PolarHBondContact CD2-O 2.82Å; H27-G45 WeakPolarHBondContact O-CA 3.47Å; H27-I373 HydrophobicContact CB-CG2 4.21Å; H27-R374 PolarHBondContact CE1-NE 3.28Å; H27-R374 VanDerWaalsContact CE1-NE 3.29Å; H27-R374 PolarHBondContact CE1-NH1 3.26Å; H27-R374 PolarHBondContact CE1-NH2 3.35Å; H27-R374 PolarHBondContact ND1-NE 3.29Å; H27-R374 PolarHBondContact ND1-NH1 3.28Å; H27-R374 PolarHBondContact NE2-NE 2.89Å; H27-R374 PolarHBondContact NE2-NH2 3.02Å; H27-E377 HydrophobicContact CB-CB 4.17Å; H27-E377 HydrophobicContact CB-CG 3.94Å; H27-E377 PolarHBondContact N-OE1 2.89Å
28	I	87.6	Confident	80.2	Confident	4 Å²	4	85.9 Å²	85.9	2%	0.021	42%	0.42	C	S	.	.			trans	-83.1	113.1	-176.1	-56.4	176.6	0	0	0	109.5	H25 S26 M46 A85	H25-I28 HydrophobicContact CB-CD1 4Å; H25-I28 WeakPolarHBondContact O-CB 3.41Å; H25-I28 PolarHBondContact O-N 2.87Å; H25-I28 VanDerWaalsContact O-N 3.1Å; S26-I28 PolarHBondContact O-N 2.8Å; S26-I28 VanDerWaalsContact O-N 3.1Å; I28-M46 HydrophobicContact CD1-SD 3.95Å; I28-M46 HydrophobicContact CG1-SD 4.09Å; I28-M46 HydrophobicContact CG2-CG 4.23Å; I28-M46 HydrophobicContact CG2-SD 3.9Å; I28-A85 VanDerWaalsContact CD1-CA 3.43Å; I28-A85 HydrophobicContact CD1-CB 3.27Å
29	R	86.3	Confident	82.4	Confident	182 Å²	182	77.4 Å²	77.4	69%	0.687	39%	0.393	S	S	*	.			trans	-107.4	-2	-179.5	-59.1	-174.2	-174.8	179.3	3.6	113.6	H27 Q44	H27-R29 PolarHBondContact O-N 3.12Å; R29-Q44 HydrophobicContact CB-CB 4.48Å; R29-Q44 PolarHBondContact N-O 3.25Å
30	G	90	Very high	84.4	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.01	38%	0.375	C	S	.	.	S	Bend	trans	163.1	-170.9	179.9	0	0	0	0	0	111.9	M46	G30-M46 WeakPolarHBondContact O-CG 3.46Å
31	L	90.9	Very high	86	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.016	37%	0.368	C	S	.	.			trans	-84.3	-10.2	179.9	-70.2	176	0	0	0	114.1	L33 R53 A56 L60 I86 M90 A93	L31-L33 HydrophobicContact CB-CD1 3.99Å; L31-L33 HydrophobicContact CB-CG 3.84Å; L31-L33 HydrophobicContact CD1-CD1 4.07Å; L31-L33 PolarHBondContact O-N 2.85Å; L31-R53 PolarHBondContact O-NE 3.34Å; L31-R53 PolarHBondContact O-NH2 2.94Å; L31-A56 HydrophobicContact CD1-CB 3.99Å; L31-A56 HydrophobicContact CD2-CB 4.2Å; L31-L60 HydrophobicContact CD1-CD2 4.39Å; L31-I86 HydrophobicContact CD2-CG2 4.35Å; L31-M90 HydrophobicContact CD1-CG 3.92Å; L31-M90 HydrophobicContact CD2-CG 4.05Å; L31-M90 HydrophobicContact CG-CG 4.36Å; L31-A93 HydrophobicContact CG-CB 4.35Å
32	G	90.4	Very high	87	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.351	C	S	.	.			trans	62.2	40.7	178.8	0	0	0	0	0	114.4	R40 R53	G32-R40 PolarHBondContact O-N 2.83Å; G32-R40 VanDerWaalsContact O-N 3.15Å; G32-R53 VanDerWaalsContact C-NH2 3.3Å; G32-R53 VanDerWaalsContact CA-NH2 3.3Å; G32-R53 PolarHBondContact O-NH2 2.86Å
33	L	91.6	Very high	87.7	Confident	38 Å²	38	65 Å²	65	20%	0.199	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-96.6	153.4	179.5	-55	176.5	0	0	0	110.9	L31 L37 E38 A39 R53	L31-L33 HydrophobicContact CB-CD1 3.99Å; L31-L33 HydrophobicContact CB-CG 3.84Å; L31-L33 HydrophobicContact CD1-CD1 4.07Å; L31-L33 PolarHBondContact O-N 2.85Å; L33-L37 HydrophobicContact CD1-CD2 4.42Å; L33-E38 WeakPolarHBondContact CA-O 3.45Å; L33-A39 HydrophobicContact CD2-CB 3.69Å; L33-R53 HydrophobicContact CD2-CB 4.16Å
34	N	90	Very high	88.1	Confident	45 Å²	45	68 Å²	68	24%	0.241	34%	0.343	C	S	.	.			trans	-81.2	172.4	167.1	-68.7	-10.6	0	0	0	111.6	D36 L37 E38 R40	N34-D36 PolarHBondContact O-N 3.08Å; N34-L37 WeakPolarHBondContact O-CA 3.32Å; N34-L37 PolarHBondContact O-N 2.95Å; N34-E38 PolarHBondContact N-O 3.36Å; N34-R40 WeakPolarHBondContact OD1-CD 3.49Å; N34-R40 VanDerWaalsContact OD1-CG 3.26Å; N34-R40 WeakPolarHBondContact OD1-CG 3.34Å; N34-R40 PolarHBondContact OD1-NE 2.8Å; N34-R40 PolarHBondContact OD1-NH2 3.5Å
35	D	86.9	Confident	88.6	Confident	169 Å²	169	65.6 Å²	65.6	90%	0.904	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.1	173	-58.5	-34.9	0	0	0	112	L37	D35-L37 PolarHBondContact O-N 3.25Å
36	D	87.7	Confident	89.1	Confident	130 Å²	130	63.3 Å²	63.3	70%	0.695	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	7.9	173.8	-56.7	-51.5	0	0	0	114.1	N34 E38	N34-D36 PolarHBondContact O-N 3.08Å; D36-E38 HydrophobicContact CB-CG 4.3Å; D36-E38 PolarHBondContact O-N 3.34Å
37	L	86.8	Confident	89.6	Confident	61 Å²	61	61.8 Å²	61.8	32%	0.319	30%	0.303	S	S	.	.	S	Bend	trans	61.1	17.2	-174.6	-59.9	169.8	0	0	0	114.7	L33 N34 D35 L58	L33-L37 HydrophobicContact CD1-CD2 4.42Å; N34-L37 WeakPolarHBondContact O-CA 3.32Å; N34-L37 PolarHBondContact O-N 2.95Å; D35-L37 PolarHBondContact O-N 3.25Å; L37-L58 HydrophobicContact CD1-CD1 4.3Å
38	E	90.1	Very high	89.9	Confident	106 Å²	106	61 Å²	61	50%	0.495	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-81.8	132.5	172.9	-62.4	-163.7	153.6	0	0	111.2	L33 N34 D36 R40	L33-E38 WeakPolarHBondContact CA-O 3.45Å; N34-E38 PolarHBondContact N-O 3.36Å; D36-E38 HydrophobicContact CB-CG 4.3Å; D36-E38 PolarHBondContact O-N 3.34Å; E38-R40 PolarHBondContact O-N 2.91Å
39	A	90	Very high	90.1	Very high	20 Å²	20	61.4 Å²	61.4	17%	0.165	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-77.4	119.2	179.2	0	0	0	0	0	110.9	L33 C50 R53	L33-A39 HydrophobicContact CD2-CB 3.69Å; A39-C50 HydrophobicContact CB-CB 4.17Å; A39-R53 HydrophobicContact CB-CB 4.01Å
40	R	91.5	Very high	90.4	Very high	138 Å²	138	54.8 Å²	54.8	52%	0.521	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-67.1	143.1	168	-66.9	-171.6	-178.4	162.1	18.9	109.7	G32 N34 E38 I42 R53	G32-R40 PolarHBondContact O-N 2.83Å; G32-R40 VanDerWaalsContact O-N 3.15Å; N34-R40 WeakPolarHBondContact OD1-CD 3.49Å; N34-R40 VanDerWaalsContact OD1-CG 3.26Å; N34-R40 WeakPolarHBondContact OD1-CG 3.34Å; N34-R40 PolarHBondContact OD1-NE 2.8Å; N34-R40 PolarHBondContact OD1-NH2 3.5Å; E38-R40 PolarHBondContact O-N 2.91Å; R40-I42 VanDerWaalsContact C-N 3.27Å; R40-I42 PolarHBondContact O-N 3.5Å; R40-R53 PolarHBondContact O-NH1 2.89Å; R40-R53 PolarHBondContact O-NH2 2.91Å; R40-R53 VanDerWaalsContact O-NH2 3.17Å
41	Q	90.2	Very high	90.6	Very high	126 Å²	126	62.5 Å²	62.5	59%	0.589	32%	0.316	S	S	*	.	S	Bend	trans	-55	-42.7	179.8	-69.4	-63.9	-11.5	0	0	112.7	V47 G48	Q41-V47 WeakPolarHBondContact O-CA 3.16Å; Q41-G48 PolarHBondContact O-N 2.8Å
42	I	91.4	Very high	90.7	Very high	101 Å²	101	62.4 Å²	62.4	52%	0.518	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	115.9	174.9	-57.8	172.2	0	0	0	107.5	R40 V47 A369 I373	R40-I42 VanDerWaalsContact C-N 3.27Å; R40-I42 PolarHBondContact O-N 3.5Å; I42-V47 HydrophobicContact CG1-CG1 4.29Å; I42-V47 HydrophobicContact CG1-CG2 4.3Å; I42-V47 HydrophobicContact CG2-CG2 4.35Å; I42-A369 HydrophobicContact CD1-CB 3.97Å; I42-I373 HydrophobicContact CG2-CD1 4Å
43	S	91.2	Very high	90.9	Very high	26 Å²	26	62.4 Å²	62.4	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	145.5	174.6	-171.3	0	0	0	0	111.7	G45 M46	S43-G45 PolarHBondContact O-N 3.45Å; S43-G45 VanDerWaalsContact O-N 3.15Å; S43-M46 PolarHBondContact N-O 3.02Å; S43-M46 PolarHBondContact O-N 3.08Å
44	Q	88.5	Confident	91	Very high	97 Å²	97	67.5 Å²	67.5	45%	0.453	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	33.4	177.4	-61.8	-177.3	-29	0	0	114.4	R29 M46	R29-Q44 HydrophobicContact CB-CB 4.48Å; R29-Q44 PolarHBondContact N-O 3.25Å; Q44-M46 PolarHBondContact O-N 3.08Å
45	G	89.1	Confident	91.1	Very high	19 Å²	19	67 Å²	67	20%	0.196	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-6.4	-178.3	0	0	0	0	0	115	H27 S43	H27-G45 PolarHBondContact CD2-O 2.82Å; H27-G45 WeakPolarHBondContact O-CA 3.47Å; S43-G45 PolarHBondContact O-N 3.45Å; S43-G45 VanDerWaalsContact O-N 3.15Å
46	M	92.4	Very high	91.3	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	137.6	176.4	-64.8	-65.5	-71.7	0	0	111	I28 G30 S43 Q44 R53 A85 I86	I28-M46 HydrophobicContact CD1-SD 3.95Å; I28-M46 HydrophobicContact CG1-SD 4.09Å; I28-M46 HydrophobicContact CG2-CG 4.23Å; I28-M46 HydrophobicContact CG2-SD 3.9Å; G30-M46 WeakPolarHBondContact O-CG 3.46Å; S43-M46 PolarHBondContact N-O 3.02Å; S43-M46 PolarHBondContact O-N 3.08Å; Q44-M46 PolarHBondContact O-N 3.08Å; M46-R53 HydrophobicContact CE-CG 4.22Å; M46-A85 HydrophobicContact CE-CB 4.39Å; M46-A85 HydrophobicContact SD-CB 4.29Å; M46-I86 HydrophobicContact CE-CG1 3.88Å
47	V	92.1	Very high	91.4	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.5	178.6	179.3	0	0	0	0	109.4	Q41 I42 E366 A369 I370 I373	Q41-V47 WeakPolarHBondContact O-CA 3.16Å; I42-V47 HydrophobicContact CG1-CG1 4.29Å; I42-V47 HydrophobicContact CG1-CG2 4.3Å; I42-V47 HydrophobicContact CG2-CG2 4.35Å; V47-E366 HydrophobicContact CG1-CB 4.16Å; V47-E366 HydrophobicContact CG1-CG 4.3Å; V47-A369 HydrophobicContact CG1-CB 3.84Å; V47-A369 HydrophobicContact CG2-CB 4.37Å; V47-I370 HydrophobicContact CB-CD1 4.45Å; V47-I370 HydrophobicContact CB-CG1 3.7Å; V47-I370 HydrophobicContact CG1-CG1 4.09Å; V47-I370 HydrophobicContact CG2-CG1 4Å; V47-I373 HydrophobicContact CG2-CD1 3.28Å
48	G	92.5	Very high	91.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	62.2	-147.9	175	0	0	0	0	0	112.3	Q41 C50 R53 E366	Q41-G48 PolarHBondContact O-N 2.8Å; G48-C50 PolarHBondContact O-N 2.81Å; G48-R53 WeakPolarHBondContact O-CD 3.2Å; G48-R53 PolarHBondContact O-NH1 3.48Å; G48-E366 WeakPolarHBondContact CA-OE1 3.49Å
49	Q	92.7	Very high	91.3	Very high	13 Å²	13	49.9 Å²	49.9	6%	0.061	25%	0.246	C	C	.	.			trans	48.3	43.2	179.1	-153.8	69	-76.5	0	0	114.1	K51 A52 R53 T81 I86 T359 D360 Y362	Q49-K51 VanDerWaalsContact C-N 3.32Å; Q49-K51 PolarHBondContact O-N 3.17Å; Q49-A52 HydrophobicContact CG-CB 3.57Å; Q49-A52 PolarHBondContact O-N 2.85Å; Q49-R53 WeakPolarHBondContact O-CB 3.31Å; Q49-R53 WeakPolarHBondContact O-CG 3.36Å; Q49-R53 PolarHBondContact O-N 2.74Å; Q49-T81 PolarHBondContact NE2-O 3.44Å; Q49-I86 HydrophobicContact CG-CD1 4.18Å; Q49-T359 VanDerWaalsContact NE2-CB 3.25Å; Q49-D360 PolarHBondContact NE2-O 3.37Å; Q49-Y362 HydrophobicContact CB-CE1 4.49Å
50	C	92.7	Very high	91	Very high	43 Å²	43	49.4 Å²	49.4	29%	0.291	24%	0.241	S	C	.	.	H	α-helix	trans	-59.2	-40.3	-169.9	-63.4	0	0	0	0	112.8	A39 G48 R54	A39-C50 HydrophobicContact CB-CB 4.17Å; G48-C50 PolarHBondContact O-N 2.81Å; C50-R54 VanDerWaalsContact O-CB 3.24Å; C50-R54 WeakPolarHBondContact O-CB 3.36Å; C50-R54 PolarHBondContact O-N 3.5Å
51	K	93.2	Very high	90.6	Very high	163 Å²	163	43.9 Å²	43.9	71%	0.709	23%	0.227	S	C	*	.	H	α-helix	trans	-65	-49.6	179.5	-67.2	179.9	-177.6	172	0	111.8	Q49 R54 A55	Q49-K51 VanDerWaalsContact C-N 3.32Å; Q49-K51 PolarHBondContact O-N 3.17Å; K51-R54 PolarHBondContact O-N 3.37Å; K51-A55 WeakPolarHBondContact O-CB 3.38Å; K51-A55 PolarHBondContact O-N 2.92Å
52	A	93.8	Very high	90.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-68.2	-38.8	-178.8	0	0	0	0	0	112	Q49 A55 A56 I86 I357 T359	Q49-A52 HydrophobicContact CG-CB 3.57Å; Q49-A52 PolarHBondContact O-N 2.85Å; A52-A55 PolarHBondContact O-N 3.44Å; A52-A56 VanDerWaalsContact O-CB 3.31Å; A52-A56 WeakPolarHBondContact O-CB 3.08Å; A52-A56 PolarHBondContact O-N 3.27Å; A52-I86 HydrophobicContact CB-CD1 3.74Å; A52-I357 HydrophobicContact CB-CG2 3.52Å; A52-T359 HydrophobicContact CB-CG2 4.33Å
53	R	94.1	Very high	89.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-41.4	176.6	-73.2	168.6	64.7	-158.7	-4.3	112.2	L31 G32 L33 A39 R40 M46 G48 Q49 A56 G57	L31-R53 PolarHBondContact O-NE 3.34Å; L31-R53 PolarHBondContact O-NH2 2.94Å; G32-R53 VanDerWaalsContact C-NH2 3.3Å; G32-R53 VanDerWaalsContact CA-NH2 3.3Å; G32-R53 PolarHBondContact O-NH2 2.86Å; L33-R53 HydrophobicContact CD2-CB 4.16Å; A39-R53 HydrophobicContact CB-CB 4.01Å; R40-R53 PolarHBondContact O-NH1 2.89Å; R40-R53 PolarHBondContact O-NH2 2.91Å; R40-R53 VanDerWaalsContact O-NH2 3.17Å; M46-R53 HydrophobicContact CE-CG 4.22Å; G48-R53 WeakPolarHBondContact O-CD 3.2Å; G48-R53 PolarHBondContact O-NH1 3.48Å; Q49-R53 WeakPolarHBondContact O-CB 3.31Å; Q49-R53 WeakPolarHBondContact O-CG 3.36Å; Q49-R53 PolarHBondContact O-N 2.74Å; R53-A56 PolarHBondContact O-N 3.25Å; R53-G57 PolarHBondContact O-N 3.37Å
54	R	93.5	Very high	88.9	Confident	145 Å²	145	44 Å²	44	55%	0.547	22%	0.216	S	C	.	.	H	α-helix	trans	-62.7	-44.4	173.7	178.8	172.6	176.9	176.8	2	111.5	C50 K51 G57 L58	C50-R54 VanDerWaalsContact O-CB 3.24Å; C50-R54 WeakPolarHBondContact O-CB 3.36Å; C50-R54 PolarHBondContact O-N 3.5Å; K51-R54 PolarHBondContact O-N 3.37Å; R54-G57 PolarHBondContact O-N 2.68Å; R54-L58 PolarHBondContact O-N 3.42Å
55	A	92.8	Very high	88.3	Confident	33 Å²	33	45 Å²	45	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-45.4	176.2	0	0	0	0	0	111.9	K51 A52 G57 L58 I59 I357	K51-A55 WeakPolarHBondContact O-CB 3.38Å; K51-A55 PolarHBondContact O-N 2.92Å; A52-A55 PolarHBondContact O-N 3.44Å; A55-G57 VanDerWaalsContact C-N 3.31Å; A55-G57 PolarHBondContact O-N 2.98Å; A55-L58 PolarHBondContact O-N 2.7Å; A55-I59 WeakPolarHBondContact O-CG1 3.43Å; A55-I59 PolarHBondContact O-N 3.1Å; A55-I357 HydrophobicContact CB-CD1 3.78Å; A55-I357 HydrophobicContact CB-CG1 3.97Å; A55-I357 HydrophobicContact CB-CG2 4.3Å
56	A	91.6	Very high	87.2	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-40.8	173.8	0	0	0	0	0	112.1	L31 A52 R53 I59 L60 I86 M90	L31-A56 HydrophobicContact CD1-CB 3.99Å; L31-A56 HydrophobicContact CD2-CB 4.2Å; A52-A56 VanDerWaalsContact O-CB 3.31Å; A52-A56 WeakPolarHBondContact O-CB 3.08Å; A52-A56 PolarHBondContact O-N 3.27Å; R53-A56 PolarHBondContact O-N 3.25Å; A56-I59 PolarHBondContact O-N 3.19Å; A56-L60 WeakPolarHBondContact O-CB 3.36Å; A56-L60 PolarHBondContact O-N 2.89Å; A56-I86 HydrophobicContact CB-CG2 3.79Å; A56-M90 HydrophobicContact CB-CG 3.84Å; A56-M90 HydrophobicContact CB-SD 3.69Å
57	G	90.3	Very high	85.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-41.4	176	0	0	0	0	0	114.5	R53 R54 A55 I59 L60 G61	R53-G57 PolarHBondContact O-N 3.37Å; R54-G57 PolarHBondContact O-N 2.68Å; A55-G57 VanDerWaalsContact C-N 3.31Å; A55-G57 PolarHBondContact O-N 2.98Å; G57-I59 VanDerWaalsContact C-N 3.3Å; G57-I59 PolarHBondContact O-N 3.22Å; G57-L60 WeakPolarHBondContact O-CB 3.48Å; G57-L60 PolarHBondContact O-N 2.95Å; G57-G61 PolarHBondContact O-N 3.47Å
58	L	88.7	Confident	84.4	Confident	91 Å²	91	56.5 Å²	56.5	48%	0.476	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-44.2	175.9	-175.1	69.7	0	0	0	110.7	L37 R54 A55 G61 M62	L37-L58 HydrophobicContact CD1-CD1 4.3Å; R54-L58 PolarHBondContact O-N 3.42Å; A55-L58 PolarHBondContact O-N 2.7Å; L58-G61 PolarHBondContact O-N 2.97Å; L58-M62 HydrophobicContact CD2-CE 4.32Å; L58-M62 HydrophobicContact CG-CE 4.11Å; L58-M62 WeakPolarHBondContact O-CG 3.41Å; L58-M62 PolarHBondContact O-N 2.93Å; L58-M62 VanDerWaalsContact O-N 3.07Å
59	I	85.8	Confident	83.1	Confident	15 Å²	15	59.2 Å²	59.2	8%	0.077	31%	0.306	C	S	.	.	H	α-helix	trans	-68.3	-40	178.6	-59.9	166.6	0	0	0	110.5	A55 A56 G57 G61 M62 I63 I73 M90 L355 I357	A55-I59 WeakPolarHBondContact O-CG1 3.43Å; A55-I59 PolarHBondContact O-N 3.1Å; A56-I59 PolarHBondContact O-N 3.19Å; G57-I59 VanDerWaalsContact C-N 3.3Å; G57-I59 PolarHBondContact O-N 3.22Å; I59-G61 VanDerWaalsContact C-N 3.29Å; I59-G61 PolarHBondContact O-N 3.01Å; I59-M62 WeakPolarHBondContact O-CB 3.31Å; I59-M62 PolarHBondContact O-N 3.19Å; I59-M62 VanDerWaalsContact O-N 3.13Å; I59-I63 HydrophobicContact CG2-CD1 3.8Å; I59-I63 HydrophobicContact CG2-CG1 4.32Å; I59-I63 WeakPolarHBondContact O-CD1 3.24Å; I59-I63 WeakPolarHBondContact O-CG1 3.47Å; I59-I63 PolarHBondContact O-N 3.28Å; I59-I73 HydrophobicContact CB-CD1 4.14Å; I59-I73 HydrophobicContact CD1-CD1 3.61Å; I59-I73 HydrophobicContact CD1-CG1 3.92Å; I59-I73 HydrophobicContact CD1-CG2 4.2Å; I59-I73 HydrophobicContact CG1-CD1 4.42Å; I59-I73 HydrophobicContact CG2-CD1 3.48Å; I59-I73 VanDerWaalsContact CG2-CD1 3.48Å; I59-I73 HydrophobicContact CG2-CG1 4.3Å; I59-M90 HydrophobicContact CG2-CE 4.43Å; I59-L355 HydrophobicContact CD1-CD1 4.32Å; I59-I357 HydrophobicContact CD1-CD1 3.91Å
60	L	83.9	Confident	81.8	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-55.9	-43.7	172.3	-167	86.6	0	0	0	112.1	L31 A56 G57 I63 R64 M90 A93 L94	L31-L60 HydrophobicContact CD1-CD2 4.39Å; A56-L60 WeakPolarHBondContact O-CB 3.36Å; A56-L60 PolarHBondContact O-N 2.89Å; G57-L60 WeakPolarHBondContact O-CB 3.48Å; G57-L60 PolarHBondContact O-N 2.95Å; L60-I63 PolarHBondContact O-N 2.98Å; L60-R64 WeakPolarHBondContact O-CG 3.48Å; L60-R64 PolarHBondContact O-N 2.83Å; L60-M90 HydrophobicContact CD1-CB 4.45Å; L60-M90 WeakPolarHBondContact CD1-O 3.42Å; L60-A93 HydrophobicContact CD1-CB 4.14Å; L60-A93 HydrophobicContact CD2-CB 3.47Å; L60-A93 VanDerWaalsContact CD2-CB 3.47Å; L60-A93 HydrophobicContact CG-CB 4.48Å; L60-L94 HydrophobicContact CD1-CB 4.4Å; L60-L94 HydrophobicContact CD1-CD1 4.37Å; L60-L94 HydrophobicContact CD1-CD2 3.33Å; L60-L94 HydrophobicContact CD1-CG 3.4Å; L60-L94 HydrophobicContact CG-CD2 3.98Å; L60-L94 HydrophobicContact CG-CG 4.5Å
61	G	83	Confident	81.1	Confident	22 Å²	22	63.5 Å²	63.5	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-46.6	174.5	0	0	0	0	0	111.9	G57 L58 I59 I63 R64 E65	G57-G61 PolarHBondContact O-N 3.47Å; L58-G61 PolarHBondContact O-N 2.97Å; I59-G61 VanDerWaalsContact C-N 3.29Å; I59-G61 PolarHBondContact O-N 3.01Å; G61-I63 VanDerWaalsContact C-N 3.3Å; G61-I63 PolarHBondContact O-N 2.71Å; G61-R64 PolarHBondContact O-N 3.11Å; G61-E65 WeakPolarHBondContact O-CG 2.9Å; G61-E65 PolarHBondContact O-N 3.01Å
62	M	79.9	Confident	80.8	Confident	73 Å²	73	55.9 Å²	55.9	36%	0.36	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-37.1	176.7	-67.3	178.3	178.4	0	0	113	L58 I59 I68	L58-M62 HydrophobicContact CD2-CE 4.32Å; L58-M62 HydrophobicContact CG-CE 4.11Å; L58-M62 WeakPolarHBondContact O-CG 3.41Å; L58-M62 PolarHBondContact O-N 2.93Å; L58-M62 VanDerWaalsContact O-N 3.07Å; I59-M62 WeakPolarHBondContact O-CB 3.31Å; I59-M62 PolarHBondContact O-N 3.19Å; I59-M62 VanDerWaalsContact O-N 3.13Å; M62-I68 HydrophobicContact CB-CD1 4Å; M62-I68 HydrophobicContact CG-CD1 4.21Å; M62-I68 HydrophobicContact SD-CD1 3.83Å
63	I	79.2	Confident	80.8	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-46.3	177.7	-65.1	158.3	0	0	0	110.2	I59 L60 G61 E65 G66 M90 L94 V323	I59-I63 HydrophobicContact CG2-CD1 3.8Å; I59-I63 HydrophobicContact CG2-CG1 4.32Å; I59-I63 WeakPolarHBondContact O-CD1 3.24Å; I59-I63 WeakPolarHBondContact O-CG1 3.47Å; I59-I63 PolarHBondContact O-N 3.28Å; L60-I63 PolarHBondContact O-N 2.98Å; G61-I63 VanDerWaalsContact C-N 3.3Å; G61-I63 PolarHBondContact O-N 2.71Å; I63-E65 VanDerWaalsContact C-N 3.29Å; I63-E65 PolarHBondContact O-N 2.53Å; I63-G66 PolarHBondContact O-N 3Å; I63-M90 HydrophobicContact CD1-CE 4.49Å; I63-L94 HydrophobicContact CB-CD2 4.25Å; I63-L94 HydrophobicContact CG2-CD1 4.44Å; I63-L94 HydrophobicContact CG2-CD2 3.77Å; I63-V323 HydrophobicContact CD1-CB 4.17Å; I63-V323 HydrophobicContact CD1-CG1 3.74Å; I63-V323 HydrophobicContact CD1-CG2 3.54Å; I63-V323 HydrophobicContact CG1-CG2 3.6Å; I63-V323 HydrophobicContact CG2-CG2 4.06Å
64	R	78.3	Confident	80.8	Confident	165 Å²	165	55.9 Å²	55.9	62%	0.623	29%	0.289	S	S	*	.	H	α-helix	trans	-63.3	-33.9	178	-75.4	176.4	170.7	-172.1	-4.5	112.8	L60 G61 G66 A93 L94	L60-R64 WeakPolarHBondContact O-CG 3.48Å; L60-R64 PolarHBondContact O-N 2.83Å; G61-R64 PolarHBondContact O-N 3.11Å; R64-G66 PolarHBondContact O-N 3.18Å; R64-A93 PolarHBondContact NH2-O 3.44Å; R64-L94 HydrophobicContact CG-CD2 4.18Å
65	E	74.3	Confident	80.9	Confident	118 Å²	118	49 Å²	49	55%	0.551	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.2	174	-73.3	-178.7	-165.6	0	0	113.1	G61 I63 K67	G61-E65 WeakPolarHBondContact O-CG 2.9Å; G61-E65 PolarHBondContact O-N 3.01Å; I63-E65 VanDerWaalsContact C-N 3.29Å; I63-E65 PolarHBondContact O-N 2.53Å; E65-K67 HydrophobicContact CB-CD 4.27Å; E65-K67 HydrophobicContact CB-CG 4.16Å; E65-K67 PolarHBondContact O-N 2.83Å; E65-K67 WeakPolarHBondContact OE2-CD 3.22Å; E65-K67 VanDerWaalsContact OE2-CE 3.28Å; E65-K67 WeakPolarHBondContact OE2-CE 3.27Å; E65-K67 IonicContact OE2-NZ 3.5Å; E65-K67 PolarHBondContact OE2-NZ 3.38Å
66	G	66.4	Low	81	Confident	61 Å²	61	47.8 Å²	47.8	63%	0.629	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	10	178.7	0	0	0	0	0	114.1	I63 R64 I68	I63-G66 PolarHBondContact O-N 3Å; R64-G66 PolarHBondContact O-N 3.18Å; G66-I68 VanDerWaalsContact C-N 3.27Å; G66-I68 PolarHBondContact O-N 3.33Å
67	K	61.4	Low	81	Confident	159 Å²	159	48.7 Å²	48.7	69%	0.691	26%	0.262	S	S	*	.			trans	-75.4	-16.2	-174.7	-75.2	179.2	-175	158.7	0	113.3	E65	E65-K67 HydrophobicContact CB-CD 4.27Å; E65-K67 HydrophobicContact CB-CG 4.16Å; E65-K67 PolarHBondContact O-N 2.83Å; E65-K67 WeakPolarHBondContact OE2-CD 3.22Å; E65-K67 VanDerWaalsContact OE2-CE 3.28Å; E65-K67 WeakPolarHBondContact OE2-CE 3.27Å; E65-K67 IonicContact OE2-NZ 3.5Å; E65-K67 PolarHBondContact OE2-NZ 3.38Å
68	I	64.9	Low	81	Confident	57 Å²	57	51.4 Å²	51.4	29%	0.292	28%	0.28	S	S	.	.			trans	-141.8	118.4	-168.2	-41.8	-177.2	0	0	0	110.5	M62 G66 R71	M62-I68 HydrophobicContact CB-CD1 4Å; M62-I68 HydrophobicContact CG-CD1 4.21Å; M62-I68 HydrophobicContact SD-CD1 3.83Å; G66-I68 VanDerWaalsContact C-N 3.27Å; G66-I68 PolarHBondContact O-N 3.33Å; I68-R71 HydrophobicContact CB-CG 4.43Å; I68-R71 HydrophobicContact CG2-CG 3.33Å
69	A	64.8	Low	81	Confident	57 Å²	57	51.6 Å²	51.6	47%	0.471	29%	0.286	S	S	.	.			trans	-101.6	160.6	164.1	0	0	0	0	0	110.1	R71 D319	A69-R71 PolarHBondContact O-N 3.1Å; A69-D319 VanDerWaalsContact CB-O 3.24Å; A69-D319 WeakPolarHBondContact CB-O 3.48Å
70	G	66.1	Low	81	Confident	19 Å²	19	52.9 Å²	52.9	20%	0.196	30%	0.303	C	S	.	.	S	Bend	trans	69.7	21.7	169.5	0	0	0	0	0	116.7	L316 A321	G70-L316 WeakPolarHBondContact CA-O 3.32Å; G70-A321 PolarHBondContact N-O 3.12Å
71	R	76.4	Confident	81.4	Confident	127 Å²	127	52.5 Å²	52.5	48%	0.479	30%	0.301	S	S	.	.			trans	-82	139.4	170.8	-70.8	-71.1	-178.4	177.9	0.1	110.8	I68 A69 L324	I68-R71 HydrophobicContact CB-CG 4.43Å; I68-R71 HydrophobicContact CG2-CG 3.33Å; A69-R71 PolarHBondContact O-N 3.1Å; R71-L324 PolarHBondContact O-N 2.89Å; R71-L324 VanDerWaalsContact O-N 3.13Å
72	A	88.3	Confident	81.7	Confident	2 Å²	2	52 Å²	52	2%	0.017	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138	172.9	0	0	0	0	0	110.3	L316 L324 L354 L355	A72-L316 HydrophobicContact CB-CD1 3.78Å; A72-L316 HydrophobicContact CB-CD2 4.17Å; A72-L324 CarbonylContact C-O 3.6Å; A72-L324 VanDerWaalsContact CA-O 3.23Å; A72-L324 WeakPolarHBondContact CA-O 3.45Å; A72-L324 HydrophobicContact CB-CB 3.97Å; A72-L324 HydrophobicContact CB-CD2 3.99Å; A72-L324 HydrophobicContact CB-CG 4.23Å; A72-L354 HydrophobicContact CB-CD2 3.26Å; A72-L354 HydrophobicContact CB-CG 4.26Å; A72-L354 WeakPolarHBondContact O-CA 3.24Å; A72-L355 PolarHBondContact O-N 2.94Å
73	I	92.8	Very high	82.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.6	-177.7	-49.2	172.9	0	0	0	107.7	I59 M90 V323 L324 I325 V326 L355 I357	I59-I73 HydrophobicContact CB-CD1 4.14Å; I59-I73 HydrophobicContact CD1-CD1 3.61Å; I59-I73 HydrophobicContact CD1-CG1 3.92Å; I59-I73 HydrophobicContact CD1-CG2 4.2Å; I59-I73 HydrophobicContact CG1-CD1 4.42Å; I59-I73 HydrophobicContact CG2-CD1 3.48Å; I59-I73 VanDerWaalsContact CG2-CD1 3.48Å; I59-I73 HydrophobicContact CG2-CG1 4.3Å; I73-M90 HydrophobicContact CD1-CE 3.83Å; I73-V323 HydrophobicContact CD1-CG1 4.25Å; I73-L324 PolarHBondContact N-O 3.06Å; I73-I325 HydrophobicContact CB-CG1 4.45Å; I73-I325 HydrophobicContact CD1-CD1 4.39Å; I73-I325 HydrophobicContact CD1-CG1 4.1Å; I73-I325 WeakPolarHBondContact O-CA 3.49Å; I73-V326 VanDerWaalsContact O-CG2 3.29Å; I73-V326 WeakPolarHBondContact O-CG2 3.47Å; I73-V326 PolarHBondContact O-N 2.96Å; I73-L355 CarbonylContact C-O 3.58Å; I73-L355 WeakPolarHBondContact CA-O 3.48Å; I73-I357 HydrophobicContact CG2-CD1 3.63Å; I73-I357 HydrophobicContact CG2-CG1 4.03Å
74	L	95	Very high	82.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.2	172.3	178.9	64.6	0	0	0	110.5	A76 V326 T328 H344 I346 L351 L354 L355 I356 I357	L74-A76 HydrophobicContact CG-CB 4.41Å; L74-V326 CarbonylContact C-O 3.58Å; L74-V326 WeakPolarHBondContact CA-O 3.27Å; L74-V326 HydrophobicContact CB-CG2 4.1Å; L74-V326 HydrophobicContact CD1-CB 4.36Å; L74-V326 HydrophobicContact CD1-CG2 3.62Å; L74-V326 HydrophobicContact CG-CG2 4.48Å; L74-T328 HydrophobicContact CD1-CG2 3.8Å; L74-T328 HydrophobicContact CG-CG2 4.44Å; L74-H344 HydrophobicContact CD2-CB 4.46Å; L74-I346 HydrophobicContact CD1-CD1 3.82Å; L74-I346 HydrophobicContact CD2-CD1 4.1Å; L74-L351 HydrophobicContact CD2-CD2 3.8Å; L74-L354 HydrophobicContact CB-CB 4.2Å; L74-L354 HydrophobicContact CB-CD1 4.25Å; L74-L354 HydrophobicContact CB-CD2 4.35Å; L74-L355 PolarHBondContact N-O 2.97Å; L74-I356 HydrophobicContact CB-CG1 4.24Å; L74-I356 HydrophobicContact CD2-CD1 4.15Å; L74-I356 HydrophobicContact CD2-CG1 4.03Å; L74-I356 HydrophobicContact CD2-CG2 4.28Å; L74-I356 HydrophobicContact CG-CG2 4.46Å; L74-I356 CarbonylContact O-C 3.51Å; L74-I356 WeakPolarHBondContact O-CA 3.29Å; L74-I357 PolarHBondContact O-N 3.05Å
75	L	95.3	Very high	83.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	109.2	167.8	-65.4	169.1	0	0	0	108.7	K83 I86 A87 I325 V326 A327 T328 I357	L75-K83 HydrophobicContact CB-CB 4.1Å; L75-K83 HydrophobicContact CB-CD 4.19Å; L75-K83 HydrophobicContact CB-CG 4.08Å; L75-K83 HydrophobicContact CD1-CB 4.49Å; L75-K83 WeakPolarHBondContact CD1-O 3.31Å; L75-K83 VanDerWaalsContact O-CD 3.24Å; L75-K83 WeakPolarHBondContact O-CD 3.43Å; L75-I86 HydrophobicContact CD1-CB 4.47Å; L75-I86 HydrophobicContact CD1-CG2 4.5Å; L75-I86 HydrophobicContact CD2-CD1 4.5Å; L75-I86 HydrophobicContact CD2-CG2 4.16Å; L75-A87 HydrophobicContact CD1-CB 4.22Å; L75-I325 HydrophobicContact CD1-CG2 3.56Å; L75-I325 HydrophobicContact CG-CG2 4.03Å; L75-V326 PolarHBondContact N-O 3Å; L75-A327 HydrophobicContact CB-CB 4.33Å; L75-A327 WeakPolarHBondContact O-CA 3.34Å; L75-T328 PolarHBondContact O-N 3.26Å; L75-I357 HydrophobicContact CD2-CB 3.95Å; L75-I357 HydrophobicContact CD2-CD1 4.39Å; L75-I357 HydrophobicContact CD2-CG2 4.01Å
76	A	94.7	Very high	84.3	Confident	8 Å²	8	37.5 Å²	37.5	7%	0.066	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.5	-177	0	0	0	0	0	111.5	L74 T328 I356 I357 S358 T359	L74-A76 HydrophobicContact CG-CB 4.41Å; A76-T328 HydrophobicContact CB-CG2 4.24Å; A76-I356 HydrophobicContact CB-CG2 3.97Å; A76-I357 PolarHBondContact N-O 3.08Å; A76-S358 CarbonylContact O-C 3.6Å; A76-S358 VanDerWaalsContact O-CA 3.28Å; A76-S358 WeakPolarHBondContact O-CA 3.3Å; A76-T359 PolarHBondContact O-N 3Å; A76-T359 PolarHBondContact O-OG1 3.37Å
77	G	92.3	Very high	85.4	Confident	19 Å²	19	34.6 Å²	34.6	20%	0.196	21%	0.209	C	C	.	.	S	Bend	trans	162.2	179.5	170.3	0	0	0	0	0	113.3	K83 T328 N329 T359	G77-K83 PolarHBondContact O-NZ 3.13Å; G77-T328 PolarHBondContact N-O 3.06Å; G77-N329 WeakPolarHBondContact O-CA 3.44Å; G77-T359 WeakPolarHBondContact CA-OG1 2.95Å
78	P	90.6	Very high	86.7	Confident	59 Å²	59	29.5 Å²	29.5	38%	0.383	19%	0.188	S	C	.	.	S	Bend	trans	-55.6	159.9	-179.6	-25.3	32.8	0	0	0	113.9	T81 K83	P78-T81 HydrophobicContact CB-CG2 3.87Å; P78-T81 HydrophobicContact CG-CG2 4.19Å; P78-T81 WeakPolarHBondContact O-CG2 3.14Å; P78-T81 PolarHBondContact O-OG1 3.46Å; P78-K83 PolarHBondContact O-NZ 3.2Å
79	P	88.3	Confident	87.8	Confident	94 Å²	94	26.8 Å²	26.8	61%	0.61	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	143.1	171.4	26.3	-33.6	0	0	0	110.9	T81	P79-T81 PolarHBondContact O-N 2.86Å
80	G	86.1	Confident	88.9	Confident	42 Å²	42	24.1 Å²	24.1	43%	0.433	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	4.8	176.6	0	0	0	0	0	116.6	G82 Y362	G80-G82 VanDerWaalsContact C-N 3.29Å; G80-G82 PolarHBondContact O-N 3.48Å; G80-Y362 WeakPolarHBondContact O-CE2 3.44Å
81	T	91	Very high	89.8	Confident	3 Å²	3	23.5 Å²	23.5	2%	0.018	15%	0.146	C	C	.	.	S	Bend	trans	-83.9	7.3	179.1	57.9	0	0	0	0	115.3	Q49 P78 P79 T359 D360 Y362	Q49-T81 PolarHBondContact NE2-O 3.44Å; P78-T81 HydrophobicContact CB-CG2 3.87Å; P78-T81 HydrophobicContact CG-CG2 4.19Å; P78-T81 WeakPolarHBondContact O-CG2 3.14Å; P78-T81 PolarHBondContact O-OG1 3.46Å; P79-T81 PolarHBondContact O-N 2.86Å; T81-T359 WeakPolarHBondContact CB-OG1 3.47Å; T81-T359 WeakPolarHBondContact OG1-CB 3.33Å; T81-T359 PolarHBondContact OG1-OG1 3.24Å; T81-D360 WeakPolarHBondContact CG2-O 3.26Å; T81-Y362 PolarHBondContact O-OH 2.84Å
82	G	90.4	Very high	90.2	Very high	13 Å²	13	20.8 Å²	20.8	13%	0.134	14%	0.138	C	C	.	.	S	Bend	trans	85.8	22.6	176.2	0	0	0	0	0	116.4	G80 A85 I86	G80-G82 VanDerWaalsContact C-N 3.29Å; G80-G82 PolarHBondContact O-N 3.48Å; G82-A85 WeakPolarHBondContact O-CB 3.49Å; G82-A85 PolarHBondContact O-N 2.71Å; G82-I86 VanDerWaalsContact O-CG1 3.31Å; G82-I86 WeakPolarHBondContact O-CG1 3.3Å; G82-I86 PolarHBondContact O-N 3.21Å
83	K	91.9	Very high	90.1	Very high	15 Å²	15	21.5 Å²	21.5	7%	0.065	14%	0.144	C	C	.	.	H	α-helix	trans	-54.5	-56.1	175	-64	-174.1	-72.1	-81	0	112.8	L75 G77 P78 A85 I86 A87 A327 T328 T359	L75-K83 HydrophobicContact CB-CB 4.1Å; L75-K83 HydrophobicContact CB-CD 4.19Å; L75-K83 HydrophobicContact CB-CG 4.08Å; L75-K83 HydrophobicContact CD1-CB 4.49Å; L75-K83 WeakPolarHBondContact CD1-O 3.31Å; L75-K83 VanDerWaalsContact O-CD 3.24Å; L75-K83 WeakPolarHBondContact O-CD 3.43Å; G77-K83 PolarHBondContact O-NZ 3.13Å; P78-K83 PolarHBondContact O-NZ 3.2Å; K83-A85 PolarHBondContact O-N 2.92Å; K83-I86 PolarHBondContact O-N 2.94Å; K83-I86 VanDerWaalsContact O-N 3.15Å; K83-A87 PolarHBondContact O-N 3.13Å; K83-A87 VanDerWaalsContact O-N 3.12Å; K83-A327 HydrophobicContact CB-CB 4.26Å; K83-A327 HydrophobicContact CD-CB 4.27Å; K83-T328 WeakPolarHBondContact CD-O 3.2Å; K83-T328 VanDerWaalsContact CE-O 3.26Å; K83-T328 WeakPolarHBondContact CE-O 3.46Å; K83-T359 HydrophobicContact CG-CG2 4.01Å
84	T	89.7	Confident	89.6	Confident	43 Å²	43	22.7 Å²	22.7	26%	0.264	15%	0.15	S	C	.	.	H	α-helix	trans	-59.8	-36.1	176.5	-41.5	0	0	0	0	111.7	A87 M88 F297 D299	T84-A87 PolarHBondContact O-N 2.89Å; T84-M88 WeakPolarHBondContact O-CB 3.47Å; T84-M88 PolarHBondContact O-N 3.42Å; T84-F297 HydrophobicContact CG2-CE1 3.81Å; T84-F297 HydrophobicContact CG2-CZ 4.18Å; T84-D299 PolarHBondContact OG1-OD2 2.84Å
85	A	91.8	Very high	88.9	Confident	8 Å²	8	23.9 Å²	23.9	7%	0.066	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-42.3	175.9	0	0	0	0	0	112.6	I28 M46 G82 K83 G89	I28-A85 VanDerWaalsContact CD1-CA 3.43Å; I28-A85 HydrophobicContact CD1-CB 3.27Å; M46-A85 HydrophobicContact CE-CB 4.39Å; M46-A85 HydrophobicContact SD-CB 4.29Å; G82-A85 WeakPolarHBondContact O-CB 3.49Å; G82-A85 PolarHBondContact O-N 2.71Å; K83-A85 PolarHBondContact O-N 2.92Å; A85-G89 PolarHBondContact O-N 3.01Å
86	I	92.7	Very high	87.9	Confident	0 Å²	0	32 Å²	32	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-44.3	176.1	-66.6	161.9	0	0	0	110.5	L31 M46 Q49 A52 A56 L75 G82 K83 M88 G89 M90 T359	L31-I86 HydrophobicContact CD2-CG2 4.35Å; M46-I86 HydrophobicContact CE-CG1 3.88Å; Q49-I86 HydrophobicContact CG-CD1 4.18Å; A52-I86 HydrophobicContact CB-CD1 3.74Å; A56-I86 HydrophobicContact CB-CG2 3.79Å; L75-I86 HydrophobicContact CD1-CB 4.47Å; L75-I86 HydrophobicContact CD1-CG2 4.5Å; L75-I86 HydrophobicContact CD2-CD1 4.5Å; L75-I86 HydrophobicContact CD2-CG2 4.16Å; G82-I86 VanDerWaalsContact O-CG1 3.31Å; G82-I86 WeakPolarHBondContact O-CG1 3.3Å; G82-I86 PolarHBondContact O-N 3.21Å; K83-I86 PolarHBondContact O-N 2.94Å; K83-I86 VanDerWaalsContact O-N 3.15Å; I86-M88 PolarHBondContact O-N 3.06Å; I86-G89 CarbonylContact O-C 3.57Å; I86-G89 PolarHBondContact O-N 3.36Å; I86-M90 HydrophobicContact CG2-SD 4.48Å; I86-M90 WeakPolarHBondContact O-CG 3.43Å; I86-M90 PolarHBondContact O-N 2.81Å; I86-T359 HydrophobicContact CD1-CG2 3.79Å
87	A	89.3	Confident	87	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-44.4	178.2	0	0	0	0	0	112	L75 K83 T84 M90 A91 F297 I325	L75-A87 HydrophobicContact CD1-CB 4.22Å; K83-A87 PolarHBondContact O-N 3.13Å; K83-A87 VanDerWaalsContact O-N 3.12Å; T84-A87 PolarHBondContact O-N 2.89Å; A87-M90 WeakPolarHBondContact O-CB 3.49Å; A87-M90 PolarHBondContact O-N 3.46Å; A87-A91 PolarHBondContact O-N 2.85Å; A87-F297 HydrophobicContact CB-CB 4.45Å; A87-F297 HydrophobicContact CB-CD1 4.46Å; A87-F297 HydrophobicContact CB-CD2 3.33Å; A87-F297 HydrophobicContact CB-CE2 3.55Å; A87-F297 HydrophobicContact CB-CG 3.83Å; A87-F297 HydrophobicContact CB-CZ 4.23Å; A87-I325 HydrophobicContact CB-CG2 4.23Å
88	M	87.3	Confident	86.3	Confident	52 Å²	52	36 Å²	36	26%	0.256	22%	0.217	S	C	.	.	H	α-helix	trans	-65.9	-38.6	174.9	-170.3	167.1	-178.7	0	0	112	H25 T84 I86 M90 A91 Q92	H25-M88 HydrophobicContact CB-CE 4.46Å; H25-M88 HydrophobicContact CB-SD 3.35Å; H25-M88 WeakPolarHBondContact CB-SD 3.28Å; T84-M88 WeakPolarHBondContact O-CB 3.47Å; T84-M88 PolarHBondContact O-N 3.42Å; I86-M88 PolarHBondContact O-N 3.06Å; M88-M90 VanDerWaalsContact C-N 3.33Å; M88-M90 PolarHBondContact O-N 3.26Å; M88-A91 PolarHBondContact O-N 3.03Å; M88-Q92 WeakPolarHBondContact O-CG 3.45Å; M88-Q92 PolarHBondContact O-N 3.31Å
89	G	89.2	Confident	86.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-38.5	173.6	0	0	0	0	0	112.9	A85 I86 A93	A85-G89 PolarHBondContact O-N 3.01Å; I86-G89 CarbonylContact O-C 3.57Å; I86-G89 PolarHBondContact O-N 3.36Å; G89-A93 WeakPolarHBondContact O-CB 3.39Å; G89-A93 PolarHBondContact O-N 2.76Å
90	M	88.6	Confident	86	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-46.1	173	-74	-179	71	0	0	111.3	L31 A56 I59 L60 I63 I73 I86 A87 M88 A93 L94 I325	L31-M90 HydrophobicContact CD1-CG 3.92Å; L31-M90 HydrophobicContact CD2-CG 4.05Å; L31-M90 HydrophobicContact CG-CG 4.36Å; A56-M90 HydrophobicContact CB-CG 3.84Å; A56-M90 HydrophobicContact CB-SD 3.69Å; I59-M90 HydrophobicContact CG2-CE 4.43Å; L60-M90 HydrophobicContact CD1-CB 4.45Å; L60-M90 WeakPolarHBondContact CD1-O 3.42Å; I63-M90 HydrophobicContact CD1-CE 4.49Å; I73-M90 HydrophobicContact CD1-CE 3.83Å; I86-M90 HydrophobicContact CG2-SD 4.48Å; I86-M90 WeakPolarHBondContact O-CG 3.43Å; I86-M90 PolarHBondContact O-N 2.81Å; A87-M90 WeakPolarHBondContact O-CB 3.49Å; A87-M90 PolarHBondContact O-N 3.46Å; M88-M90 VanDerWaalsContact C-N 3.33Å; M88-M90 PolarHBondContact O-N 3.26Å; M90-A93 CarbonylContact O-C 3.56Å; M90-A93 PolarHBondContact O-N 3.07Å; M90-L94 PolarHBondContact O-N 3.46Å; M90-I325 HydrophobicContact CB-CD1 4.48Å; M90-I325 HydrophobicContact CE-CD1 3.83Å; M90-I325 HydrophobicContact SD-CD1 3.56Å; M90-I325 VanDerWaalsContact SD-CD1 3.56Å
91	A	83.8	Confident	86.2	Confident	7 Å²	7	32.5 Å²	32.5	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-49.8	178.7	0	0	0	0	0	112.3	A87 M88 A93 L94 G95 F100	A87-A91 PolarHBondContact O-N 2.85Å; M88-A91 PolarHBondContact O-N 3.03Å; A91-A93 PolarHBondContact O-N 3.27Å; A91-L94 PolarHBondContact O-N 2.81Å; A91-L94 VanDerWaalsContact O-N 3.09Å; A91-G95 PolarHBondContact O-N 3.36Å; A91-F100 HydrophobicContact CB-CB 3.81Å; A91-F100 HydrophobicContact CB-CD1 4.36Å; A91-F100 HydrophobicContact CB-CD2 3.34Å; A91-F100 HydrophobicContact CB-CE2 3.92Å; A91-F100 HydrophobicContact CB-CG 3.58Å
92	Q	85.9	Confident	86.1	Confident	69 Å²	69	35.2 Å²	35.2	32%	0.322	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-34.5	176.2	-68	-61.9	-22.8	0	0	111.9	M88 G95	M88-Q92 WeakPolarHBondContact O-CG 3.45Å; M88-Q92 PolarHBondContact O-N 3.31Å; Q92-G95 PolarHBondContact O-N 2.83Å
93	A	85.4	Confident	86.2	Confident	17 Å²	17	35.5 Å²	35.5	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-72.4	-27.3	175.7	0	0	0	0	0	113	L31 L60 R64 G89 M90 A91 G95	L31-A93 HydrophobicContact CG-CB 4.35Å; L60-A93 HydrophobicContact CD1-CB 4.14Å; L60-A93 HydrophobicContact CD2-CB 3.47Å; L60-A93 VanDerWaalsContact CD2-CB 3.47Å; L60-A93 HydrophobicContact CG-CB 4.48Å; R64-A93 PolarHBondContact NH2-O 3.44Å; G89-A93 WeakPolarHBondContact O-CB 3.39Å; G89-A93 PolarHBondContact O-N 2.76Å; M90-A93 CarbonylContact O-C 3.56Å; M90-A93 PolarHBondContact O-N 3.07Å; A91-A93 PolarHBondContact O-N 3.27Å; A93-G95 VanDerWaalsContact C-N 3.31Å
94	L	82	Confident	86.2	Confident	26 Å²	26	35.9 Å²	35.9	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-67.5	-34.2	174.1	-74.2	173.5	0	0	0	112	L60 I63 R64 M90 A91 T98 V295	L60-L94 HydrophobicContact CD1-CB 4.4Å; L60-L94 HydrophobicContact CD1-CD1 4.37Å; L60-L94 HydrophobicContact CD1-CD2 3.33Å; L60-L94 HydrophobicContact CD1-CG 3.4Å; L60-L94 HydrophobicContact CG-CD2 3.98Å; L60-L94 HydrophobicContact CG-CG 4.5Å; I63-L94 HydrophobicContact CB-CD2 4.25Å; I63-L94 HydrophobicContact CG2-CD1 4.44Å; I63-L94 HydrophobicContact CG2-CD2 3.77Å; R64-L94 HydrophobicContact CG-CD2 4.18Å; M90-L94 PolarHBondContact O-N 3.46Å; A91-L94 PolarHBondContact O-N 2.81Å; A91-L94 VanDerWaalsContact O-N 3.09Å; L94-T98 HydrophobicContact CB-CG2 3.81Å; L94-T98 HydrophobicContact CD1-CG2 3.81Å; L94-T98 HydrophobicContact CG-CG2 4.41Å; L94-V295 HydrophobicContact CD1-CG2 3.29Å
95	G	79.8	Confident	86.1	Confident	26 Å²	26	33.9 Å²	33.9	27%	0.268	19%	0.193	S	C	.	.			trans	131.1	159.4	174.3	0	0	0	0	0	111.8	A91 Q92 A93 D97 T98	A91-G95 PolarHBondContact O-N 3.36Å; Q92-G95 PolarHBondContact O-N 2.83Å; A93-G95 VanDerWaalsContact C-N 3.31Å; G95-D97 PolarHBondContact O-N 2.85Å; G95-T98 WeakPolarHBondContact O-CB 3.29Å; G95-T98 PolarHBondContact O-N 3.18Å; G95-T98 PolarHBondContact O-OG1 3.25Å
96	H	75.3	Confident	85.9	Confident	171 Å²	171	36.5 Å²	36.5	79%	0.792	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.5	-175.2	-63.2	-63.9	0	0	0	114.2	T98	H96-T98 VanDerWaalsContact C-N 3.33Å
97	D	74.9	Confident	85.7	Confident	85 Å²	85	42.5 Å²	42.5	46%	0.455	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.1	178.7	-63.7	-9.9	0	0	0	113.4	G95 P99 R130	G95-D97 PolarHBondContact O-N 2.85Å; D97-P99 WeakPolarHBondContact O-CD 3.25Å; D97-R130 IonicContact OD2-CZ 2.95Å; D97-R130 IonicContact OD2-NE 2.71Å; D97-R130 IonicContact OD2-NH2 2.7Å; D97-R130 PolarHBondContact OD2-NH2 3.44Å
98	T	79.1	Confident	85.7	Confident	25 Å²	25	42.6 Å²	42.6	15%	0.153	24%	0.24	C	C	.	.	S	Bend	trans	-80.8	122.1	-175.6	-54.5	0	0	0	0	109.4	L94 G95 H96 F100 V292 P293	L94-T98 HydrophobicContact CB-CG2 3.81Å; L94-T98 HydrophobicContact CD1-CG2 3.81Å; L94-T98 HydrophobicContact CG-CG2 4.41Å; G95-T98 WeakPolarHBondContact O-CB 3.29Å; G95-T98 PolarHBondContact O-N 3.18Å; G95-T98 PolarHBondContact O-OG1 3.25Å; H96-T98 VanDerWaalsContact C-N 3.33Å; T98-F100 PolarHBondContact O-N 3.18Å; T98-V292 HydrophobicContact CG2-CG1 4.5Å; T98-P293 WeakPolarHBondContact CG2-O 3.23Å
99	P	84.8	Confident	85.6	Confident	21 Å²	21	43.5 Å²	43.5	14%	0.136	24%	0.242	C	C	.	.			trans	-66.8	126.2	-179.8	22.4	-26.8	0	0	0	110.4	D97 T243 G294 V295	D97-P99 WeakPolarHBondContact O-CD 3.25Å; P99-T243 HydrophobicContact CB-CG2 4.44Å; P99-G294 WeakPolarHBondContact O-CA 3.42Å; P99-V295 PolarHBondContact O-N 3.45Å
100	F	86.5	Confident	85.4	Confident	74 Å²	74	45.8 Å²	45.8	33%	0.325	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.3	171.9	177.1	-108	0	0	0	108.7	A91 T98 A102 V295 F297	A91-F100 HydrophobicContact CB-CB 3.81Å; A91-F100 HydrophobicContact CB-CD1 4.36Å; A91-F100 HydrophobicContact CB-CD2 3.34Å; A91-F100 HydrophobicContact CB-CE2 3.92Å; A91-F100 HydrophobicContact CB-CG 3.58Å; T98-F100 PolarHBondContact O-N 3.18Å; F100-A102 HydrophobicContact CD1-CB 4.46Å; F100-A102 HydrophobicContact CE1-CB 3.69Å; F100-A102 HydrophobicContact CZ-CB 4.04Å; F100-V295 HydrophobicContact CD2-CB 3.98Å; F100-V295 HydrophobicContact CD2-CG1 3.88Å; F100-V295 HydrophobicContact CE2-CG1 3.99Å; F100-F297 HydrophobicContact CE2-CB 3.6Å; F100-F297 HydrophobicContact CE2-CG 4.44Å; F100-F297 HydrophobicContact CZ-CB 3.7Å; F100-F297 HydrophobicContact CZ-CD1 4.31Å; F100-F297 HydrophobicContact CZ-CG 4.21Å
101	T	90	Very high	85.2	Confident	26 Å²	26	54.6 Å²	54.6	16%	0.16	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.1	173.4	-51.8	0	0	0	0	108	K125 S126 V295 L296 F297	T101-K125 HydrophobicContact CG2-CB 4.35Å; T101-S126 WeakPolarHBondContact CB-OG 3.46Å; T101-S126 PolarHBondContact OG1-OG 3.25Å; T101-V295 PolarHBondContact N-O 3.31Å; T101-L296 HydrophobicContact CG2-CD1 3.96Å; T101-F297 PolarHBondContact O-N 3.4Å
102	A	90.3	Very high	85.3	Confident	60 Å²	60	61.1 Å²	61.1	50%	0.496	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	134	167.8	0	0	0	0	0	109.2	F100 F297	F100-A102 HydrophobicContact CD1-CB 4.46Å; F100-A102 HydrophobicContact CE1-CB 3.69Å; F100-A102 HydrophobicContact CZ-CB 4.04Å; A102-F297 CarbonylContact C-O 3.5Å; A102-F297 WeakPolarHBondContact CA-O 3.11Å; A102-F297 HydrophobicContact CB-CD1 4.15Å
103	M	91.9	Very high	85.3	Confident	20 Å²	20	59.3 Å²	59.3	10%	0.099	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147	173.7	67.5	-173.8	-47	0	0	110.1	E107 I108 L119 A122 L296 F297 I298 D299	M103-E107 VanDerWaalsContact CA-OE2 3.32Å; M103-E107 WeakPolarHBondContact CA-OE2 3.28Å; M103-I108 HydrophobicContact CE-CD1 3.57Å; M103-I108 HydrophobicContact CE-CG1 3.23Å; M103-I108 HydrophobicContact SD-CD1 4.47Å; M103-L119 HydrophobicContact CE-CD2 4.49Å; M103-A122 HydrophobicContact CE-CB 3.91Å; M103-A122 HydrophobicContact SD-CB 3.6Å; M103-A122 VanDerWaalsContact SD-CB 3.6Å; M103-L296 HydrophobicContact CG-CD1 4.33Å; M103-L296 HydrophobicContact SD-CD1 3.81Å; M103-L296 HydrophobicContact SD-CG 4.49Å; M103-F297 PolarHBondContact N-O 2.96Å; M103-I298 HydrophobicContact CG-CB 4.22Å; M103-I298 HydrophobicContact CG-CG1 3.76Å; M103-I298 HydrophobicContact CG-CG2 4.26Å; M103-I298 CarbonylContact O-C 3.55Å; M103-I298 VanDerWaalsContact O-CA 3.32Å; M103-I298 WeakPolarHBondContact O-CA 3.26Å; M103-I298 HydrophobicContact SD-CD1 3.98Å; M103-I298 HydrophobicContact SD-CG1 3.8Å; M103-D299 PolarHBondContact O-N 3.4Å
104	A	91.7	Very high	85.6	Confident	23 Å²	23	60.7 Å²	60.7	19%	0.19	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	146.4	167.3	0	0	0	0	0	110	S106 E107	A104-S106 PolarHBondContact O-N 3.42Å; A104-E107 HydrophobicContact CB-CG 4.02Å; A104-E107 PolarHBondContact N-OE2 3.3Å; A104-E107 WeakPolarHBondContact O-CB 3.45Å; A104-E107 PolarHBondContact O-N 2.98Å
105	G	87.5	Confident	86.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.4	176.5	0	0	0	0	0	113.8	F109 D299 L304	G105-F109 WeakPolarHBondContact O-CE2 3.49Å; G105-D299 PolarHBondContact N-O 2.95Å; G105-L304 VanDerWaalsContact O-CD2 3.3Å; G105-L304 WeakPolarHBondContact O-CD2 3.48Å
106	S	88.7	Confident	86.6	Confident	63 Å²	63	64 Å²	64	44%	0.441	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-20.1	175	51.9	0	0	0	0	114.6	A104 I108 F109	A104-S106 PolarHBondContact O-N 3.42Å; S106-I108 VanDerWaalsContact C-N 3.26Å; S106-I108 PolarHBondContact O-N 3.04Å; S106-F109 WeakPolarHBondContact O-CD2 3.49Å; S106-F109 PolarHBondContact O-N 3.39Å
107	E	87.8	Confident	87.5	Confident	127 Å²	127	56.4 Å²	56.4	59%	0.593	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.2	-176.2	-72.9	168.7	179.9	0	0	113.3	M103 A104 F109	M103-E107 VanDerWaalsContact CA-OE2 3.32Å; M103-E107 WeakPolarHBondContact CA-OE2 3.28Å; A104-E107 HydrophobicContact CB-CG 4.02Å; A104-E107 PolarHBondContact N-OE2 3.3Å; A104-E107 WeakPolarHBondContact O-CB 3.45Å; A104-E107 PolarHBondContact O-N 2.98Å; E107-F109 PolarHBondContact O-N 3.37Å
108	I	88.1	Confident	88.3	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-22.8	-179.6	-67.4	156.4	0	0	0	112	M103 S106 S110 K115 A118 L119 L304	M103-I108 HydrophobicContact CE-CD1 3.57Å; M103-I108 HydrophobicContact CE-CG1 3.23Å; M103-I108 HydrophobicContact SD-CD1 4.47Å; S106-I108 VanDerWaalsContact C-N 3.26Å; S106-I108 PolarHBondContact O-N 3.04Å; I108-S110 VanDerWaalsContact C-N 3.34Å; I108-S110 PolarHBondContact O-N 2.99Å; I108-K115 HydrophobicContact CG2-CB 3.91Å; I108-K115 HydrophobicContact CG2-CG 4.28Å; I108-K115 WeakPolarHBondContact CG2-O 3.15Å; I108-A118 HydrophobicContact CG2-CB 4.16Å; I108-L119 HydrophobicContact CD1-CD2 3.47Å; I108-L119 VanDerWaalsContact CD1-CD2 3.47Å; I108-L119 HydrophobicContact CD1-CG 4.02Å; I108-L119 HydrophobicContact CG1-CD2 4.1Å; I108-L119 HydrophobicContact CG1-CG 4.33Å; I108-L119 HydrophobicContact CG2-CG 4.12Å; I108-L304 HydrophobicContact CD1-CD2 3.3Å
109	F	86.1	Confident	88.9	Confident	71 Å²	71	51.9 Å²	51.9	31%	0.311	29%	0.287	S	S	.	.			trans	-82	81.5	-179.3	-57.5	-77.1	0	0	0	110	G105 S106 E107 K115	G105-F109 WeakPolarHBondContact O-CE2 3.49Å; S106-F109 WeakPolarHBondContact O-CD2 3.49Å; S106-F109 PolarHBondContact O-N 3.39Å; E107-F109 PolarHBondContact O-N 3.37Å; F109-K115 HydrophobicContact CD1-CD 3.74Å; F109-K115 HydrophobicContact CD1-CG 4.09Å; F109-K115 HydrophobicContact CE1-CD 3.6Å; F109-K115 HydrophobicContact CE1-CG 4.33Å
110	S	84.3	Confident	89.3	Confident	49 Å²	49	52.2 Å²	52.2	34%	0.343	29%	0.289	S	S	.	.			trans	-97.2	153.2	173.3	-177.5	0	0	0	0	111.7	I108 E112	I108-S110 VanDerWaalsContact C-N 3.34Å; I108-S110 PolarHBondContact O-N 2.99Å; S110-E112 PolarHBondContact OG-N 3.46Å; S110-E112 VanDerWaalsContact OG-N 3.09Å
111	L	85.5	Confident	89.6	Confident	186 Å²	186	49.1 Å²	49.1	97%	0.974	28%	0.276	S	S	*	.	S	Bend	trans	-85	-20.5	168.8	-66.7	174.5	0	0	0	112.3
112	E	84.6	Confident	89.7	Confident	144 Å²	144	48.2 Å²	48.2	67%	0.673	27%	0.271	S	S	*	.	S	Bend	trans	-90.3	-21.6	-173.6	-63	-175	164.6	0	0	113.2	S110	S110-E112 PolarHBondContact OG-N 3.46Å; S110-E112 VanDerWaalsContact OG-N 3.09Å
113	M	87.9	Confident	89.8	Confident	31 Å²	31	46 Å²	46	15%	0.153	25%	0.25	C	C	.	.	S	Bend	trans	-143.7	151.6	-177.2	63.6	-175	73.5	0	0	111.2	E117 A118 E267	M113-E117 HydrophobicContact CB-CB 4.45Å; M113-E117 HydrophobicContact CB-CG 4.22Å; M113-A118 HydrophobicContact CG-CB 4.18Å; M113-A118 HydrophobicContact SD-CB 3.83Å; M113-E267 HydrophobicContact CB-CG 4.35Å
114	S	91.7	Very high	89.8	Confident	46 Å²	46	46 Å²	46	32%	0.322	25%	0.249	S	C	.	.			trans	-63.7	151.9	173	55.9	0	0	0	0	112.5	T116 E117 A118 E267	S114-T116 PolarHBondContact O-N 3.22Å; S114-T116 PolarHBondContact OG-OG1 3.37Å; S114-E117 WeakPolarHBondContact O-CB 3.42Å; S114-E117 PolarHBondContact O-N 3.29Å; S114-E117 VanDerWaalsContact OG-CB 3.26Å; S114-E117 WeakPolarHBondContact OG-CB 3.32Å; S114-E117 PolarHBondContact OG-N 2.98Å; S114-A118 PolarHBondContact O-N 2.86Å; S114-E267 VanDerWaalsContact CB-OE1 3.24Å; S114-E267 WeakPolarHBondContact CB-OE1 3.31Å; S114-E267 PolarHBondContact N-OE1 3.11Å; S114-E267 PolarHBondContact OG-OE1 3.48Å
115	K	91.5	Very high	89.8	Confident	58 Å²	58	48.7 Å²	48.7	25%	0.252	26%	0.256	S	S	.	.	H	α-helix	trans	-55.9	-39.2	177.9	-65.4	173	-73.8	175	0	112.3	I108 F109 L119 D305 E307	I108-K115 HydrophobicContact CG2-CB 3.91Å; I108-K115 HydrophobicContact CG2-CG 4.28Å; I108-K115 WeakPolarHBondContact CG2-O 3.15Å; F109-K115 HydrophobicContact CD1-CD 3.74Å; F109-K115 HydrophobicContact CD1-CG 4.09Å; F109-K115 HydrophobicContact CE1-CD 3.6Å; F109-K115 HydrophobicContact CE1-CG 4.33Å; K115-L119 PolarHBondContact O-N 2.86Å; K115-L119 VanDerWaalsContact O-N 3.08Å; K115-D305 WeakPolarHBondContact CD-OD2 3.4Å; K115-D305 IonicContact NZ-OD2 2.64Å; K115-D305 PolarHBondContact NZ-OD2 3.32Å; K115-E307 IonicContact NZ-OE2 2.7Å; K115-E307 PolarHBondContact NZ-OE2 3.06Å
116	T	91.5	Very high	89.9	Confident	62 Å²	62	48.7 Å²	48.7	38%	0.38	26%	0.256	S	S	.	.	H	α-helix	trans	-66.8	-38.2	176.4	46.8	0	0	0	0	112	S114 T120 F311	S114-T116 PolarHBondContact O-N 3.22Å; S114-T116 PolarHBondContact OG-OG1 3.37Å; T116-T120 WeakPolarHBondContact O-CB 3.44Å; T116-T120 PolarHBondContact O-N 3.17Å; T116-T120 PolarHBondContact O-OG1 3.23Å; T116-F311 HydrophobicContact CG2-CB 4.31Å; T116-F311 HydrophobicContact CG2-CD2 3.91Å; T116-F311 HydrophobicContact CG2-CG 4.14Å
117	E	92.3	Very high	89.9	Confident	13 Å²	13	46.1 Å²	46.1	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-68.9	-44.3	177.2	175.6	58.4	-168.3	0	0	111.2	M113 S114 L119 T120 Q121 E267 I268 R273	M113-E117 HydrophobicContact CB-CB 4.45Å; M113-E117 HydrophobicContact CB-CG 4.22Å; S114-E117 WeakPolarHBondContact O-CB 3.42Å; S114-E117 PolarHBondContact O-N 3.29Å; S114-E117 VanDerWaalsContact OG-CB 3.26Å; S114-E117 WeakPolarHBondContact OG-CB 3.32Å; S114-E117 PolarHBondContact OG-N 2.98Å; E117-L119 VanDerWaalsContact C-N 3.33Å; E117-L119 PolarHBondContact O-N 2.98Å; E117-T120 PolarHBondContact O-N 3.25Å; E117-T120 VanDerWaalsContact O-N 3.08Å; E117-Q121 WeakPolarHBondContact O-CG 3.26Å; E117-Q121 PolarHBondContact O-N 3.26Å; E117-Q121 PolarHBondContact OE1-NE2 3.39Å; E117-E267 HydrophobicContact CG-CB 4.29Å; E117-E267 HydrophobicContact CG-CG 4.14Å; E117-I268 PolarHBondContact OE1-N 2.79Å; E117-R273 IonicContact OE1-CZ 3.31Å; E117-R273 IonicContact OE1-NH1 3.94Å; E117-R273 IonicContact OE1-NH2 3.8Å; E117-R273 PolarHBondContact OE1-NH2 3.34Å; E117-R273 IonicContact OE2-CZ 3.03Å; E117-R273 VanDerWaalsContact OE2-CZ 3.28Å; E117-R273 IonicContact OE2-NH1 2.85Å; E117-R273 PolarHBondContact OE2-NH1 3.1Å; E117-R273 IonicContact OE2-NH2 2.76Å; E117-R273 PolarHBondContact OE2-NH2 3.41Å
118	A	92.4	Very high	90	Very high	14 Å²	14	40.1 Å²	40.1	12%	0.116	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-44.5	175.1	0	0	0	0	0	112.1	I108 M113 S114 Q121 A122	I108-A118 HydrophobicContact CG2-CB 4.16Å; M113-A118 HydrophobicContact CG-CB 4.18Å; M113-A118 HydrophobicContact SD-CB 3.83Å; S114-A118 PolarHBondContact O-N 2.86Å; A118-Q121 PolarHBondContact O-N 2.91Å; A118-A122 PolarHBondContact O-N 2.9Å
119	L	92.4	Very high	90.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-43.7	172.8	-79.1	174	0	0	0	111.9	M103 I108 K115 E117 Q121 A122 F123 I298 C308 F311 L312	M103-L119 HydrophobicContact CE-CD2 4.49Å; I108-L119 HydrophobicContact CD1-CD2 3.47Å; I108-L119 VanDerWaalsContact CD1-CD2 3.47Å; I108-L119 HydrophobicContact CD1-CG 4.02Å; I108-L119 HydrophobicContact CG1-CD2 4.1Å; I108-L119 HydrophobicContact CG1-CG 4.33Å; I108-L119 HydrophobicContact CG2-CG 4.12Å; K115-L119 PolarHBondContact O-N 2.86Å; K115-L119 VanDerWaalsContact O-N 3.08Å; E117-L119 VanDerWaalsContact C-N 3.33Å; E117-L119 PolarHBondContact O-N 2.98Å; L119-Q121 VanDerWaalsContact C-N 3.31Å; L119-Q121 PolarHBondContact O-N 2.96Å; L119-A122 WeakPolarHBondContact O-CB 3.38Å; L119-A122 PolarHBondContact O-N 2.81Å; L119-A122 VanDerWaalsContact O-N 3.16Å; L119-F123 VanDerWaalsContact O-CD2 3.24Å; L119-F123 WeakPolarHBondContact O-CD2 3.48Å; L119-F123 PolarHBondContact O-N 3.43Å; L119-I298 HydrophobicContact CD2-CD1 4.42Å; L119-C308 HydrophobicContact CD1-CB 3.81Å; L119-F311 HydrophobicContact CB-CD1 3.86Å; L119-F311 HydrophobicContact CB-CE1 3.74Å; L119-F311 HydrophobicContact CD1-CD1 3.86Å; L119-L312 HydrophobicContact CD1-CD2 4.47Å; L119-L312 HydrophobicContact CD1-CG 4.37Å; L119-L312 HydrophobicContact CD2-CD2 4.11Å
120	T	92.8	Very high	90.4	Very high	29 Å²	29	39.1 Å²	39.1	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-41.1	179.3	-50.9	0	0	0	0	111.6	T116 E117 F123 R124 F311	T116-T120 WeakPolarHBondContact O-CB 3.44Å; T116-T120 PolarHBondContact O-N 3.17Å; T116-T120 PolarHBondContact O-OG1 3.23Å; E117-T120 PolarHBondContact O-N 3.25Å; E117-T120 VanDerWaalsContact O-N 3.08Å; T120-F123 PolarHBondContact O-N 2.91Å; T120-R124 WeakPolarHBondContact O-CG 3.48Å; T120-R124 PolarHBondContact O-N 3.41Å; T120-F311 WeakPolarHBondContact OG1-CZ 3.24Å
121	Q	91.8	Very high	90.7	Very high	9 Å²	9	38.1 Å²	38.1	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-42.2	174.7	-68.2	-175.8	14.4	0	0	111.6	E117 A118 L119 F123 R124 K125 H245 T265 G266	E117-Q121 WeakPolarHBondContact O-CG 3.26Å; E117-Q121 PolarHBondContact O-N 3.26Å; E117-Q121 PolarHBondContact OE1-NE2 3.39Å; A118-Q121 PolarHBondContact O-N 2.91Å; L119-Q121 VanDerWaalsContact C-N 3.31Å; L119-Q121 PolarHBondContact O-N 2.96Å; Q121-F123 PolarHBondContact O-N 2.91Å; Q121-R124 PolarHBondContact O-N 3.23Å; Q121-K125 WeakPolarHBondContact O-CB 3.44Å; Q121-K125 VanDerWaalsContact O-CG 3.27Å; Q121-K125 WeakPolarHBondContact O-CG 3.36Å; Q121-K125 PolarHBondContact O-N 3.19Å; Q121-H245 PolarHBondContact OE1-CE1 2.98Å; Q121-T265 PolarHBondContact NE2-OG1 2.62Å; Q121-G266 PolarHBondContact NE2-O 2.85Å
122	A	92.6	Very high	90.8	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-44.5	176.2	0	0	0	0	0	112	M103 A118 L119 R124 K125 S126 L296	M103-A122 HydrophobicContact CE-CB 3.91Å; M103-A122 HydrophobicContact SD-CB 3.6Å; M103-A122 VanDerWaalsContact SD-CB 3.6Å; A118-A122 PolarHBondContact O-N 2.9Å; L119-A122 WeakPolarHBondContact O-CB 3.38Å; L119-A122 PolarHBondContact O-N 2.81Å; L119-A122 VanDerWaalsContact O-N 3.16Å; A122-R124 PolarHBondContact O-N 3.06Å; A122-K125 PolarHBondContact O-N 3.27Å; A122-S126 PolarHBondContact O-N 3.44Å; A122-S126 PolarHBondContact O-OG 2.93Å; A122-L296 HydrophobicContact CB-CD1 3.91Å; A122-L296 HydrophobicContact CB-CD2 4.3Å
123	F	92.3	Very high	90.7	Very high	13 Å²	13	32.5 Å²	32.5	6%	0.057	16%	0.161	C	C	.	.	H	α-helix	trans	-59.1	-45.6	174	-88.8	-111	0	0	0	111.9	L119 T120 Q121 S126 I127 L296 L312 A315 L316 P322	L119-F123 VanDerWaalsContact O-CD2 3.24Å; L119-F123 WeakPolarHBondContact O-CD2 3.48Å; L119-F123 PolarHBondContact O-N 3.43Å; T120-F123 PolarHBondContact O-N 2.91Å; Q121-F123 PolarHBondContact O-N 2.91Å; F123-S126 PolarHBondContact O-N 3.06Å; F123-I127 WeakPolarHBondContact O-CD1 3.22Å; F123-I127 WeakPolarHBondContact O-CG1 3.41Å; F123-L296 HydrophobicContact CD2-CD2 3.44Å; F123-L296 VanDerWaalsContact CD2-CD2 3.44Å; F123-L296 HydrophobicContact CE2-CD2 3.47Å; F123-L296 VanDerWaalsContact CE2-CD2 3.47Å; F123-L296 HydrophobicContact CG-CD2 4.15Å; F123-L296 HydrophobicContact CZ-CD2 4.2Å; F123-L312 HydrophobicContact CE2-CD2 3.33Å; F123-L312 HydrophobicContact CZ-CD2 3.55Å; F123-A315 HydrophobicContact CD1-CB 4.25Å; F123-A315 HydrophobicContact CE1-CB 3.88Å; F123-A315 HydrophobicContact CZ-CB 4.08Å; F123-L316 HydrophobicContact CE1-CD2 4.32Å; F123-L316 HydrophobicContact CZ-CD2 4.49Å; F123-P322 VanDerWaalsContact CD1-CD 3.49Å; F123-P322 HydrophobicContact CD1-CG 3.88Å; F123-P322 HydrophobicContact CE1-CG 4.37Å; F123-P322 HydrophobicContact CG-CG 4.32Å
124	R	92.1	Very high	90.5	Very high	19 Å²	19	38.2 Å²	38.2	7%	0.072	19%	0.188	C	C	.	.	H	α-helix	trans	-74.8	-24.9	-178.3	-66.8	-172.9	71.5	88.3	-11.8	113.9	T120 Q121 A122 S126 L244 H245 D248 N277	T120-R124 WeakPolarHBondContact O-CG 3.48Å; T120-R124 PolarHBondContact O-N 3.41Å; Q121-R124 PolarHBondContact O-N 3.23Å; A122-R124 PolarHBondContact O-N 3.06Å; R124-S126 VanDerWaalsContact C-N 3.31Å; R124-L244 HydrophobicContact CB-CB 4.15Å; R124-L244 PolarHBondContact O-N 3.21Å; R124-H245 HydrophobicContact CB-CB 3.96Å; R124-H245 PolarHBondContact O-N 3.3Å; R124-D248 VanDerWaalsContact CD-OD2 3.23Å; R124-D248 WeakPolarHBondContact CD-OD2 3.16Å; R124-D248 IonicContact CZ-OD1 3.4Å; R124-D248 IonicContact CZ-OD2 2.93Å; R124-D248 IonicContact NE-OD1 3.85Å; R124-D248 PolarHBondContact NE-OD1 3.38Å; R124-D248 IonicContact NE-OD2 3.74Å; R124-D248 PolarHBondContact NE-OD2 3.16Å; R124-D248 IonicContact NH2-OD1 3.06Å; R124-D248 PolarHBondContact NH2-OD1 3.15Å; R124-D248 IonicContact NH2-OD2 3.99Å; R124-N277 PolarHBondContact NH1-OD1 2.93Å; R124-N277 PolarHBondContact NH2-OD1 2.83Å
125	K	91.8	Very high	90.1	Very high	81 Å²	81	37.1 Å²	37.1	35%	0.352	18%	0.181	S	C	.	.	H	α-helix	trans	-69.3	-30.1	169.7	-76.5	175.3	-178.1	176.7	0	111.9	T101 Q121 A122 I127 T243 H245	T101-K125 HydrophobicContact CG2-CB 4.35Å; Q121-K125 WeakPolarHBondContact O-CB 3.44Å; Q121-K125 VanDerWaalsContact O-CG 3.27Å; Q121-K125 WeakPolarHBondContact O-CG 3.36Å; Q121-K125 PolarHBondContact O-N 3.19Å; A122-K125 PolarHBondContact O-N 3.27Å; K125-I127 VanDerWaalsContact C-N 3.26Å; K125-I127 PolarHBondContact O-N 3.18Å; K125-T243 VanDerWaalsContact O-CG2 3.23Å; K125-T243 WeakPolarHBondContact O-CG2 3.23Å; K125-H245 HydrophobicContact CB-CB 4.43Å; K125-H245 WeakPolarHBondContact CE-CD2 3.42Å; K125-H245 WeakPolarHBondContact CE-NE2 3.02Å; K125-H245 HydrophobicContact CG-CB 3.59Å
126	S	89.8	Confident	90.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	7.3	178.1	-58.7	0	0	0	0	114.2	T101 A122 F123 R124 G294 L296	T101-S126 WeakPolarHBondContact CB-OG 3.46Å; T101-S126 PolarHBondContact OG1-OG 3.25Å; A122-S126 PolarHBondContact O-N 3.44Å; A122-S126 PolarHBondContact O-OG 2.93Å; F123-S126 PolarHBondContact O-N 3.06Å; R124-S126 VanDerWaalsContact C-N 3.31Å; S126-G294 CarbonylContact O-C 3.58Å; S126-G294 WeakPolarHBondContact O-CA 3.37Å; S126-G294 PolarHBondContact O-N 2.8Å; S126-L296 WeakPolarHBondContact OG-CB 3.36Å
127	I	89.2	Confident	90.1	Very high	9 Å²	9	35 Å²	35	5%	0.046	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116	176.7	-56.4	155.9	0	0	0	108	F123 K125 T243 L244 I291 M320 P322	F123-I127 WeakPolarHBondContact O-CD1 3.22Å; F123-I127 WeakPolarHBondContact O-CG1 3.41Å; K125-I127 VanDerWaalsContact C-N 3.26Å; K125-I127 PolarHBondContact O-N 3.18Å; I127-T243 CarbonylContact O-C 3.55Å; I127-T243 VanDerWaalsContact O-CA 3.28Å; I127-T243 WeakPolarHBondContact O-CA 3.38Å; I127-L244 HydrophobicContact CB-CD1 3.79Å; I127-L244 HydrophobicContact CB-CG 4.01Å; I127-L244 HydrophobicContact CD1-CD1 3.76Å; I127-L244 HydrophobicContact CG1-CD1 4.41Å; I127-L244 HydrophobicContact CG2-CD1 3.55Å; I127-L244 HydrophobicContact CG2-CG 3.85Å; I127-L244 PolarHBondContact O-N 3.01Å; I127-I291 HydrophobicContact CG2-CG2 3.92Å; I127-M320 WeakPolarHBondContact CD1-O 3.43Å; I127-P322 HydrophobicContact CG1-CB 4.27Å
128	G	90	Very high	90.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	144.6	178.9	0	0	0	0	0	110.9	V292	G128-V292 PolarHBondContact N-O 3.39Å; G128-V292 PolarHBondContact O-N 3.16Å
129	V	91.6	Very high	90.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113	169.7	-176.4	0	0	0	0	106.6	I131 V242 L244 I247 V280 A289	V129-I131 HydrophobicContact CG1-CG1 3.95Å; V129-V242 PolarHBondContact N-O 3.32Å; V129-V242 PolarHBondContact O-N 3Å; V129-L244 HydrophobicContact CG2-CD2 3.51Å; V129-L244 HydrophobicContact CG2-CG 4.18Å; V129-I247 HydrophobicContact CB-CD1 4.38Å; V129-I247 HydrophobicContact CG2-CD1 4.27Å; V129-V280 HydrophobicContact CG2-CG1 4.09Å; V129-V280 HydrophobicContact CG2-CG2 4.48Å; V129-A289 HydrophobicContact CG1-CB 3.74Å
130	R	90.8	Very high	90.2	Very high	52 Å²	52	36.6 Å²	36.6	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	108.1	175.5	-177.7	-173.9	-75	148.6	-7.9	108.3	D97 V239 H240 A289 E290 V292	D97-R130 IonicContact OD2-CZ 2.95Å; D97-R130 IonicContact OD2-NE 2.71Å; D97-R130 IonicContact OD2-NH2 2.7Å; D97-R130 PolarHBondContact OD2-NH2 3.44Å; R130-V239 HydrophobicContact CG-CG1 3.26Å; R130-H240 CarbonylContact C-O 3.49Å; R130-H240 WeakPolarHBondContact CA-O 3.45Å; R130-A289 CarbonylContact O-C 3.6Å; R130-A289 VanDerWaalsContact O-CA 3.28Å; R130-A289 WeakPolarHBondContact O-CA 3.45Å; R130-E290 HydrophobicContact CB-CB 4.35Å; R130-E290 IonicContact CZ-OE2 3.28Å; R130-E290 PolarHBondContact N-O 2.81Å; R130-E290 IonicContact NH1-OE2 2.81Å; R130-E290 PolarHBondContact NH1-OE2 2.82Å; R130-E290 PolarHBondContact O-N 2.77Å; R130-V292 HydrophobicContact CB-CG2 4.17Å
131	I	90.6	Very high	90.2	Very high	28 Å²	28	35.2 Å²	35.2	14%	0.144	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.4	178.8	-53	175.4	0	0	0	107.7	V129 E133 V239 H240 W283 A289	V129-I131 HydrophobicContact CG1-CG1 3.95Å; I131-E133 HydrophobicContact CG2-CG 3.96Å; I131-V239 WeakPolarHBondContact O-CA 3.41Å; I131-H240 PolarHBondContact N-O 3.41Å; I131-H240 PolarHBondContact O-N 2.81Å; I131-W283 HydrophobicContact CD1-CZ3 4.25Å; I131-A289 HydrophobicContact CG1-CB 4.31Å
132	K	86.6	Confident	90.3	Very high	104 Å²	104	34.8 Å²	34.8	45%	0.452	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.1	175.9	-62.9	-179.8	174.1	-171.8	0	108.4	E237 V239 K288	K132-E237 WeakPolarHBondContact CD-OE1 3.48Å; K132-V239 HydrophobicContact CG-CG2 4.29Å; K132-K288 PolarHBondContact N-O 2.92Å
133	E	83.7	Confident	90.3	Very high	107 Å²	107	35.9 Å²	35.9	50%	0.5	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.2	177.7	-63.5	-172.6	169.6	0	0	109.9	I131 E237 V238	I131-E133 HydrophobicContact CG2-CG 3.96Å; E133-E237 WeakPolarHBondContact O-CA 3.38Å; E133-V238 PolarHBondContact N-O 2.82Å; E133-V238 PolarHBondContact O-N 3.27Å
134	E	84.1	Confident	90.3	Very high	152 Å²	152	39.8 Å²	39.8	71%	0.71	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.5	170.1	-66.8	-172.4	174.6	0	0	109.2
135	A	83.3	Confident	90.2	Very high	23 Å²	23	40.9 Å²	40.9	19%	0.19	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.3	175.3	0	0	0	0	0	110.6	I137 K236	A135-I137 HydrophobicContact CB-CG2 4.35Å; A135-K236 PolarHBondContact N-O 3.46Å; A135-K236 PolarHBondContact O-N 3.35Å
136	E	89.8	Confident	90.2	Very high	44 Å²	44	40.9 Å²	40.9	21%	0.206	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	108.7	167.8	-64.6	-160.5	154.4	0	0	109.2	K197 Q233 R235	E136-K197 HydrophobicContact CB-CB 4.32Å; E136-K197 HydrophobicContact CB-CD 4.25Å; E136-K197 VanDerWaalsContact O-CB 3.27Å; E136-K197 WeakPolarHBondContact O-CB 3.41Å; E136-K197 PolarHBondContact O-N 3Å; E136-K197 WeakPolarHBondContact OE2-CD 3.4Å; E136-K197 IonicContact OE2-NZ 2.62Å; E136-K197 PolarHBondContact OE2-NZ 2.85Å; E136-Q233 PolarHBondContact OE2-NE2 2.94Å; E136-Q233 VanDerWaalsContact OE2-NE2 3.11Å; E136-R235 HydrophobicContact CG-CG 4.28Å; E136-R235 IonicContact OE1-CZ 3.45Å; E136-R235 IonicContact OE1-NE 3.14Å; E136-R235 PolarHBondContact OE1-NE 2.96Å; E136-R235 VanDerWaalsContact OE1-NE 3.14Å; E136-R235 IonicContact OE1-NH2 2.91Å; E136-R235 PolarHBondContact OE1-NH2 3.38Å
137	I	91.5	Very high	90.1	Very high	32 Å²	32	43.4 Å²	43.4	16%	0.164	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.3	179.4	60.9	171.2	0	0	0	110.4	A135 I195 K234 K236	A135-I137 HydrophobicContact CB-CG2 4.35Å; I137-I195 CarbonylContact C-O 3.35Å; I137-I195 WeakPolarHBondContact CA-O 3.42Å; I137-K234 HydrophobicContact CG1-CB 4.15Å; I137-K234 WeakPolarHBondContact CG1-O 3.19Å; I137-K234 PolarHBondContact N-O 3.15Å; I137-K234 PolarHBondContact O-N 2.97Å; I137-K234 VanDerWaalsContact O-O 3.13Å; I137-K236 HydrophobicContact CD1-CB 3.98Å; I137-K236 HydrophobicContact CD1-CD 3.95Å; I137-K236 HydrophobicContact CG1-CB 4.31Å
138	I	93.1	Very high	89.9	Confident	16 Å²	16	48.5 Å²	48.5	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.3	171.9	-59.7	173.6	0	0	0	107.3	L163 Y172 T194 I195 L232 Q233	I138-L163 HydrophobicContact CG2-CD1 3.83Å; I138-Y172 HydrophobicContact CD1-CE1 4.25Å; I138-T194 CarbonylContact O-C 3.58Å; I138-T194 WeakPolarHBondContact O-CA 3.44Å; I138-I195 HydrophobicContact CB-CB 4.28Å; I138-I195 PolarHBondContact N-O 3.28Å; I138-I195 PolarHBondContact O-N 3.27Å; I138-L232 CarbonylContact C-O 3.58Å; I138-L232 VanDerWaalsContact CA-O 3.31Å; I138-L232 WeakPolarHBondContact CA-O 3.39Å; I138-L232 HydrophobicContact CG2-CD2 3.45Å; I138-L232 VanDerWaalsContact CG2-CD2 3.45Å; I138-L232 HydrophobicContact CG2-CG 3.73Å; I138-Q233 HydrophobicContact CG1-CB 4.45Å; I138-Q233 HydrophobicContact CG1-CG 4.33Å
139	E	93.2	Very high	89.5	Confident	44 Å²	44	57.2 Å²	57.2	21%	0.206	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.5	-177.5	-175.5	-174.1	-160	0	0	109.7	T194 P228 L232 K234	E139-T194 HydrophobicContact CB-CG2 4.11Å; E139-T194 HydrophobicContact CG-CG2 3.82Å; E139-P228 HydrophobicContact CG-CB 3.89Å; E139-P228 HydrophobicContact CG-CG 3.68Å; E139-L232 PolarHBondContact N-O 2.76Å; E139-L232 VanDerWaalsContact O-CD1 3.24Å; E139-L232 WeakPolarHBondContact O-CD1 3.46Å; E139-K234 IonicContact OE2-NZ 2.8Å; E139-K234 PolarHBondContact OE2-NZ 3.06Å
140	G	93.6	Very high	88.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	165.4	-179.5	0	0	0	0	0	114.4	I193	G140-I193 PolarHBondContact N-O 3.47Å; G140-I193 PolarHBondContact O-N 3.47Å
141	E	93.6	Very high	88.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.2	167.4	-176.2	-174.1	140.1	0	0	110.1	V143 L163 K164 V192 S208 C227	E141-V143 PolarHBondContact O-N 3.13Å; E141-L163 CarbonylContact O-C 3.6Å; E141-L163 WeakPolarHBondContact O-CA 3.23Å; E141-K164 HydrophobicContact CB-CG 3.97Å; E141-K164 PolarHBondContact N-O 2.73Å; E141-K164 PolarHBondContact O-N 3.31Å; E141-K164 WeakPolarHBondContact OE1-CE 3.24Å; E141-K164 IonicContact OE1-NZ 3.02Å; E141-K164 PolarHBondContact OE1-NZ 2.96Å; E141-K164 VanDerWaalsContact OE2-CE 3.22Å; E141-K164 WeakPolarHBondContact OE2-CE 3.5Å; E141-K164 IonicContact OE2-NZ 2.8Å; E141-K164 PolarHBondContact OE2-NZ 2.92Å; E141-V192 HydrophobicContact CB-CG2 4.39Å; E141-S208 VanDerWaalsContact CD-OG 3.32Å; E141-S208 WeakPolarHBondContact OE2-CB 2.98Å; E141-S208 PolarHBondContact OE2-OG 3.24Å; E141-C227 PolarHBondContact OE2-SG 3.17Å
142	V	93.5	Very high	87.3	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	113.3	175.1	-177.9	0	0	0	0	110	V145 L161 L163 V187 A189 G190 D191 I193	V142-V145 HydrophobicContact CG1-CG2 3.4Å; V142-L161 HydrophobicContact CG1-CD1 3.82Å; V142-L161 HydrophobicContact CG2-CD1 4.39Å; V142-L163 HydrophobicContact CB-CD2 4.37Å; V142-L163 HydrophobicContact CG2-CD2 3.74Å; V142-V187 HydrophobicContact CG2-CG1 3.82Å; V142-A189 CarbonylContact O-C 3.6Å; V142-G190 PolarHBondContact O-N 3.07Å; V142-D191 WeakPolarHBondContact CG2-O 3.36Å; V142-D191 PolarHBondContact N-O 3.32Å; V142-I193 HydrophobicContact CG2-CD1 3.6Å; V142-I193 HydrophobicContact CG2-CG1 3.79Å; V142-I193 HydrophobicContact CG2-CG2 4.13Å
143	V	92.5	Very high	86.5	Confident	30 Å²	30	64.4 Å²	64.4	18%	0.182	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-49.6	175.2	-178.4	0	0	0	0	110.2	E141 T162 K164 A189 R211	E141-V143 PolarHBondContact O-N 3.13Å; V143-T162 HydrophobicContact CB-CG2 3.92Å; V143-T162 HydrophobicContact CG1-CG2 4.46Å; V143-T162 HydrophobicContact CG2-CG2 4.22Å; V143-T162 PolarHBondContact N-O 3.19Å; V143-K164 HydrophobicContact CG2-CB 3.76Å; V143-K164 HydrophobicContact CG2-CD 3.55Å; V143-K164 HydrophobicContact CG2-CG 3.5Å; V143-K164 VanDerWaalsContact CG2-CG 3.5Å; V143-A189 WeakPolarHBondContact O-CB 3.45Å; V143-R211 PolarHBondContact O-NH1 3.19Å; V143-R211 PolarHBondContact O-NH2 2.97Å; V143-R211 VanDerWaalsContact O-NH2 3.08Å
144	E	91.4	Very high	85.5	Confident	95 Å²	95	64.6 Å²	64.6	44%	0.444	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	147.2	-174.9	-171	174.8	-156.3	0	0	110.9	L146 T162	E144-L146 HydrophobicContact CG-CD2 4.31Å; E144-L146 HydrophobicContact CG-CG 4.14Å; E144-L146 WeakPolarHBondContact OE1-CD2 3.43Å; E144-T162 PolarHBondContact O-N 3.37Å
145	V	90.3	Very high	84.7	Confident	42 Å²	42	59.7 Å²	59.7	26%	0.255	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	111.7	173.7	-169.1	0	0	0	0	108.5	V142 I147 L161	V142-V145 HydrophobicContact CG1-CG2 3.4Å; V145-I147 HydrophobicContact CG1-CD1 4.1Å; V145-I147 HydrophobicContact CG1-CG1 4.08Å; V145-L161 HydrophobicContact CB-CD1 4.5Å; V145-L161 HydrophobicContact CG1-CD1 4.47Å; V145-L161 HydrophobicContact CG2-CD1 3.72Å
146	L	91.2	Very high	84.3	Confident	80 Å²	80	61.7 Å²	61.7	42%	0.419	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.4	176.1	-64.5	170.4	0	0	0	108.7	E144 G159 K160	E144-L146 HydrophobicContact CG-CD2 4.31Å; E144-L146 HydrophobicContact CG-CG 4.14Å; E144-L146 WeakPolarHBondContact OE1-CD2 3.43Å; L146-G159 CarbonylContact O-C 3.47Å; L146-G159 WeakPolarHBondContact O-CA 3.38Å; L146-K160 HydrophobicContact CB-CB 4.36Å; L146-K160 PolarHBondContact N-O 3.47Å; L146-K160 PolarHBondContact O-N 2.88Å
147	I	88	Confident	83.9	Confident	54 Å²	54	62.5 Å²	62.5	28%	0.277	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	109.8	178.3	-60.8	166.8	0	0	0	108.2	V145 R149 I179	V145-I147 HydrophobicContact CG1-CD1 4.1Å; V145-I147 HydrophobicContact CG1-CG1 4.08Å; I147-R149 HydrophobicContact CG2-CG 4.35Å; I147-I179 HydrophobicContact CD1-CG2 4.02Å; I147-I179 HydrophobicContact CG1-CG2 4.26Å; I147-I179 HydrophobicContact CG2-CG2 3.8Å
148	D	86.2	Confident	83.6	Confident	115 Å²	115	66 Å²	66	62%	0.615	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.5	175.6	-65.9	-32.5	0	0	0	109.5	I158	D148-I158 PolarHBondContact N-O 3.31Å
149	R	81.2	Confident	83.4	Confident	183 Å²	183	65.3 Å²	65.3	69%	0.691	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-100.8	124.2	174.8	-65.8	-175.9	-171.4	-174.5	3.1	109.4	I147 A151	I147-R149 HydrophobicContact CG2-CG 4.35Å; R149-A151 PolarHBondContact O-N 3.37Å
150	P	78.6	Confident	83.4	Confident	46 Å²	46	68.2 Å²	68.2	30%	0.299	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-63.4	131.3	176.7	23.5	-30.5	0	0	0	110.4	T152 G153	P150-T152 PolarHBondContact O-N 2.92Å; P150-T152 VanDerWaalsContact O-N 3.13Å; P150-G153 PolarHBondContact O-N 3.28Å
151	A	75.3	Confident	83.4	Confident	112 Å²	112	68.2 Å²	68.2	93%	0.926	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.3	-175.3	0	0	0	0	0	113.7	R149 G153	R149-A151 PolarHBondContact O-N 3.37Å; A151-G153 PolarHBondContact O-N 3.29Å
152	T	73.7	Confident	83.4	Confident	108 Å²	108	69 Å²	69	66%	0.663	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.8	179.2	52	0	0	0	0	113.7	P150 T154	P150-T152 PolarHBondContact O-N 2.92Å; P150-T152 VanDerWaalsContact O-N 3.13Å; T152-T154 PolarHBondContact O-N 2.79Å; T152-T154 PolarHBondContact O-OG1 3.32Å; T152-T154 VanDerWaalsContact O-OG1 3.06Å; T152-T154 PolarHBondContact OG1-O 2.76Å; T152-T154 VanDerWaalsContact OG1-O 3.13Å
153	G	68.2	Low	83.5	Confident	70 Å²	70	69 Å²	69	72%	0.722	41%	0.409	S	S	*	.	S	Bend	trans	66.7	-4.8	-176.3	0	0	0	0	0	114.6	P150 A151	P150-G153 PolarHBondContact O-N 3.28Å; A151-G153 PolarHBondContact O-N 3.29Å
154	T	64	Low	83.5	Confident	110 Å²	110	70 Å²	70	68%	0.675	41%	0.411	S	S	*	.			trans	-125.8	107.7	-176.1	39.1	0	0	0	0	108	T152	T152-T154 PolarHBondContact O-N 2.79Å; T152-T154 PolarHBondContact O-OG1 3.32Å; T152-T154 VanDerWaalsContact O-OG1 3.06Å; T152-T154 PolarHBondContact OG1-O 2.76Å; T152-T154 VanDerWaalsContact OG1-O 3.13Å
155	G	67.7	Low	83.6	Confident	50 Å²	50	65.9 Å²	65.9	52%	0.515	39%	0.393	S	S	.	.	S	Bend	trans	159.1	157.4	179.5	0	0	0	0	0	111.9	K157	G155-K157 PolarHBondContact O-N 2.95Å
156	A	73.6	Confident	83.6	Confident	65 Å²	65	67.9 Å²	67.9	54%	0.537	41%	0.405	S	S	.	.			trans	-65.8	126.4	175.5	0	0	0	0	0	109.4	I158	A156-I158 PolarHBondContact O-N 2.91Å
157	K	82.3	Confident	83.6	Confident	61 Å²	61	70.9 Å²	70.9	27%	0.265	42%	0.417	S	S	.	.			trans	-67.5	131.8	168.5	-57.2	174	-165.3	160	0	107.6	G155 I179 D180	G155-K157 PolarHBondContact O-N 2.95Å; K157-I179 HydrophobicContact CB-CD1 3.72Å; K157-I179 HydrophobicContact CB-CG2 4.34Å; K157-I179 HydrophobicContact CD-CG2 3.91Å; K157-I179 VanDerWaalsContact O-CD1 3.31Å; K157-I179 WeakPolarHBondContact O-CD1 3.38Å; K157-D180 IonicContact NZ-OD1 3.95Å; K157-D180 PolarHBondContact NZ-OD1 3.13Å
158	I	85.4	Confident	83.8	Confident	105 Å²	105	72.1 Å²	72.1	54%	0.538	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.2	171.2	-59	172.3	0	0	0	106.2	D148 A156	D148-I158 PolarHBondContact N-O 3.31Å; A156-I158 PolarHBondContact O-N 2.91Å
159	G	88.4	Confident	84.1	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.01	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	166.9	178.6	0	0	0	0	0	112.2	L146 L174	L146-G159 CarbonylContact O-C 3.47Å; L146-G159 WeakPolarHBondContact O-CA 3.38Å; G159-L174 PolarHBondContact N-O 3.48Å; G159-L174 PolarHBondContact O-N 2.98Å
160	K	93.1	Very high	84.7	Confident	105 Å²	105	65.3 Å²	65.3	46%	0.457	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.1	172	-65.7	-173.6	175	-176.7	0	109.3	L146 V171 Y172 D173	L146-K160 HydrophobicContact CB-CB 4.36Å; L146-K160 PolarHBondContact N-O 3.47Å; L146-K160 PolarHBondContact O-N 2.88Å; K160-V171 HydrophobicContact CB-CG1 4.23Å; K160-V171 HydrophobicContact CD-CG1 4.42Å; K160-Y172 CarbonylContact C-O 3.57Å; K160-Y172 WeakPolarHBondContact CA-O 3.45Å; K160-D173 WeakPolarHBondContact CE-OD1 3.39Å
161	L	93.1	Very high	85.4	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.2	177.4	179.9	65.9	0	0	0	109.2	V142 V145 L163 V171 Y172 L174 I193 I195	V142-L161 HydrophobicContact CG1-CD1 3.82Å; V142-L161 HydrophobicContact CG2-CD1 4.39Å; V145-L161 HydrophobicContact CB-CD1 4.5Å; V145-L161 HydrophobicContact CG1-CD1 4.47Å; V145-L161 HydrophobicContact CG2-CD1 3.72Å; L161-L163 HydrophobicContact CD1-CD2 4.33Å; L161-L163 HydrophobicContact CD2-CD1 4.04Å; L161-L163 HydrophobicContact CD2-CD2 4.08Å; L161-L163 HydrophobicContact CD2-CG 4.01Å; L161-L163 HydrophobicContact CG-CD2 4.08Å; L161-L163 HydrophobicContact CG-CG 3.98Å; L161-V171 WeakPolarHBondContact O-CA 3.45Å; L161-Y172 PolarHBondContact N-O 2.6Å; L161-Y172 PolarHBondContact O-N 2.9Å; L161-L174 HydrophobicContact CB-CD1 3.85Å; L161-L174 HydrophobicContact CB-CD2 3.82Å; L161-L174 HydrophobicContact CB-CG 3.86Å; L161-L174 HydrophobicContact CD2-CD2 4.13Å; L161-I193 HydrophobicContact CD2-CD1 4.37Å; L161-I195 HydrophobicContact CD2-CD1 3.98Å
162	T	94.4	Very high	86.3	Confident	15 Å²	15	65.5 Å²	65.5	9%	0.092	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	118.6	174.8	-52.1	0	0	0	0	109	V143 E144 E169 T170 V171	V143-T162 HydrophobicContact CB-CG2 3.92Å; V143-T162 HydrophobicContact CG1-CG2 4.46Å; V143-T162 HydrophobicContact CG2-CG2 4.22Å; V143-T162 PolarHBondContact N-O 3.19Å; E144-T162 PolarHBondContact O-N 3.37Å; T162-E169 HydrophobicContact CG2-CG 3.94Å; T162-E169 WeakPolarHBondContact CG2-OE1 3.46Å; T162-T170 WeakPolarHBondContact CA-O 3.24Å; T162-V171 HydrophobicContact CG2-CG2 4.1Å
163	L	94.4	Very high	87.2	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.8	178.1	-65	176.3	0	0	0	110.4	I138 E141 V142 L161 E169 T170 Y172 I193 I195 L232	I138-L163 HydrophobicContact CG2-CD1 3.83Å; E141-L163 CarbonylContact O-C 3.6Å; E141-L163 WeakPolarHBondContact O-CA 3.23Å; V142-L163 HydrophobicContact CB-CD2 4.37Å; V142-L163 HydrophobicContact CG2-CD2 3.74Å; L161-L163 HydrophobicContact CD1-CD2 4.33Å; L161-L163 HydrophobicContact CD2-CD1 4.04Å; L161-L163 HydrophobicContact CD2-CD2 4.08Å; L161-L163 HydrophobicContact CD2-CG 4.01Å; L161-L163 HydrophobicContact CG-CD2 4.08Å; L161-L163 HydrophobicContact CG-CG 3.98Å; L163-E169 WeakPolarHBondContact O-CA 3.38Å; L163-T170 PolarHBondContact N-O 2.97Å; L163-T170 PolarHBondContact O-N 3.42Å; L163-Y172 HydrophobicContact CD1-CD2 4.09Å; L163-Y172 HydrophobicContact CD1-CE2 4.11Å; L163-Y172 HydrophobicContact CG-CD2 4.49Å; L163-I193 HydrophobicContact CD2-CD1 4.13Å; L163-I193 HydrophobicContact CD2-CG1 4.2Å; L163-I195 HydrophobicContact CD1-CD1 4.35Å; L163-L232 HydrophobicContact CB-CD1 3.82Å; L163-L232 HydrophobicContact CB-CD2 3.87Å; L163-L232 HydrophobicContact CD1-CD2 3.97Å
164	K	93.1	Very high	88.3	Confident	50 Å²	50	63.5 Å²	63.5	22%	0.217	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.1	174.4	71.5	175.1	176.5	-179.8	0	112.5	E141 V143 M168 E169	E141-K164 HydrophobicContact CB-CG 3.97Å; E141-K164 PolarHBondContact N-O 2.73Å; E141-K164 PolarHBondContact O-N 3.31Å; E141-K164 WeakPolarHBondContact OE1-CE 3.24Å; E141-K164 IonicContact OE1-NZ 3.02Å; E141-K164 PolarHBondContact OE1-NZ 2.96Å; E141-K164 VanDerWaalsContact OE2-CE 3.22Å; E141-K164 WeakPolarHBondContact OE2-CE 3.5Å; E141-K164 IonicContact OE2-NZ 2.8Å; E141-K164 PolarHBondContact OE2-NZ 2.92Å; V143-K164 HydrophobicContact CG2-CB 3.76Å; V143-K164 HydrophobicContact CG2-CD 3.55Å; V143-K164 HydrophobicContact CG2-CG 3.5Å; V143-K164 VanDerWaalsContact CG2-CG 3.5Å; K164-M168 CarbonylContact C-O 3.59Å; K164-M168 WeakPolarHBondContact CA-O 3.49Å; K164-E169 HydrophobicContact CB-CB 4.14Å; K164-E169 HydrophobicContact CB-CG 4.09Å
165	T	93.1	Very high	89.4	Confident	10 Å²	10	60.3 Å²	60.3	6%	0.061	34%	0.336	C	S	.	.			trans	-111.4	-173.8	161.3	58.6	0	0	0	0	108.6	E167 M168 P228 G230 L232	T165-E167 PolarHBondContact O-N 3.09Å; T165-E167 PolarHBondContact OG1-N 3.43Å; T165-M168 PolarHBondContact N-O 3.18Å; T165-M168 WeakPolarHBondContact OG1-CG 3.3Å; T165-M168 PolarHBondContact OG1-N 3.03Å; T165-M168 PolarHBondContact OG1-O 3.43Å; T165-P228 WeakPolarHBondContact CA-O 3.23Å; T165-P228 VanDerWaalsContact CB-O 3.31Å; T165-P228 WeakPolarHBondContact CB-O 3.23Å; T165-G230 WeakPolarHBondContact CB-O 3.44Å; T165-G230 WeakPolarHBondContact CG2-O 3.44Å; T165-G230 PolarHBondContact OG1-O 3.01Å; T165-L232 HydrophobicContact CG2-CB 4.09Å; T165-L232 HydrophobicContact CG2-CD1 3.5Å; T165-L232 HydrophobicContact CG2-CG 4.33Å
166	T	90.5	Very high	90.4	Very high	83 Å²	83	62.8 Å²	62.8	51%	0.509	33%	0.334	S	S	.	.	S	Bend	trans	-67.2	-22.9	169.2	54.7	0	0	0	0	113.4	C227 P228 E229	T166-C227 HydrophobicContact CG2-CB 4.05Å; T166-P228 PolarHBondContact N-O 2.73Å; T166-P228 VanDerWaalsContact N-O 3.12Å; T166-E229 HydrophobicContact CG2-CG 4.09Å; T166-E229 WeakPolarHBondContact OG1-CA 3.46Å
167	E	90.7	Very high	91.1	Very high	144 Å²	144	68.2 Å²	68.2	67%	0.673	35%	0.346	S	S	*	.	S	Bend	trans	-108.7	-31.7	-171.8	-66.9	179.6	-169.5	0	0	113.8	T165 G230	T165-E167 PolarHBondContact O-N 3.09Å; T165-E167 PolarHBondContact OG1-N 3.43Å; E167-G230 WeakPolarHBondContact OE2-CA 3.22Å
168	M	91.9	Very high	91.4	Very high	79 Å²	79	67.4 Å²	67.4	39%	0.389	34%	0.343	S	S	.	.			trans	-144.5	150.3	-173.7	65	-177.2	-53.1	0	0	113.2	K164 T165 T170 E231 L232	K164-M168 CarbonylContact C-O 3.59Å; K164-M168 WeakPolarHBondContact CA-O 3.49Å; T165-M168 PolarHBondContact N-O 3.18Å; T165-M168 WeakPolarHBondContact OG1-CG 3.3Å; T165-M168 PolarHBondContact OG1-N 3.03Å; T165-M168 PolarHBondContact OG1-O 3.43Å; M168-T170 HydrophobicContact CE-CG2 3.74Å; M168-E231 HydrophobicContact SD-CB 4.31Å; M168-L232 HydrophobicContact CG-CB 4.44Å; M168-L232 HydrophobicContact SD-CB 4.16Å; M168-L232 PolarHBondContact SD-N 3.47Å; M168-L232 VanDerWaalsContact SD-N 3.44Å
169	E	93.6	Very high	91.5	Very high	121 Å²	121	62.5 Å²	62.5	57%	0.565	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.8	173.9	-177.4	173.3	-178.4	0	0	109.4	T162 L163 K164	T162-E169 HydrophobicContact CG2-CG 3.94Å; T162-E169 WeakPolarHBondContact CG2-OE1 3.46Å; L163-E169 WeakPolarHBondContact O-CA 3.38Å; K164-E169 HydrophobicContact CB-CB 4.14Å; K164-E169 HydrophobicContact CB-CG 4.09Å
170	T	93.6	Very high	91.5	Very high	35 Å²	35	65.5 Å²	65.5	22%	0.215	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.1	-176.3	56.1	0	0	0	0	111.2	T162 L163 M168 Y172 L232	T162-T170 WeakPolarHBondContact CA-O 3.24Å; L163-T170 PolarHBondContact N-O 2.97Å; L163-T170 PolarHBondContact O-N 3.42Å; M168-T170 HydrophobicContact CE-CG2 3.74Å; T170-Y172 WeakPolarHBondContact OG1-CE2 3.43Å; T170-L232 WeakPolarHBondContact OG1-CD2 3.28Å
171	V	94.1	Very high	91.4	Very high	90 Å²	90	62.5 Å²	62.5	55%	0.545	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.6	178	-175.7	0	0	0	0	108.8	K160 L161 T162	K160-V171 HydrophobicContact CB-CG1 4.23Å; K160-V171 HydrophobicContact CD-CG1 4.42Å; L161-V171 WeakPolarHBondContact O-CA 3.45Å; T162-V171 HydrophobicContact CG2-CG2 4.1Å
172	Y	92.7	Very high	91.3	Very high	71 Å²	71	62.7 Å²	62.7	28%	0.278	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133	176.2	-68.8	-85	0	0	0	110.9	I138 K160 L161 L163 T170 L232	I138-Y172 HydrophobicContact CD1-CE1 4.25Å; K160-Y172 CarbonylContact C-O 3.57Å; K160-Y172 WeakPolarHBondContact CA-O 3.45Å; L161-Y172 PolarHBondContact N-O 2.6Å; L161-Y172 PolarHBondContact O-N 2.9Å; L163-Y172 HydrophobicContact CD1-CD2 4.09Å; L163-Y172 HydrophobicContact CD1-CE2 4.11Å; L163-Y172 HydrophobicContact CG-CD2 4.49Å; T170-Y172 WeakPolarHBondContact OG1-CE2 3.43Å; Y172-L232 HydrophobicContact CE2-CD2 3.37Å; Y172-L232 WeakPolarHBondContact OH-CD2 3.45Å
173	D	92.8	Very high	91.1	Very high	124 Å²	124	65.3 Å²	65.3	66%	0.663	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	130.1	167.6	-65.4	-46.6	0	0	0	109.8	K160	K160-D173 WeakPolarHBondContact CE-OD1 3.39Å
174	L	91	Very high	90.9	Very high	12 Å²	12	73.2 Å²	73.2	6%	0.063	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128	-176	-61.5	174.8	0	0	0	111.3	G159 L161 M178 I179 L182	G159-L174 PolarHBondContact N-O 3.48Å; G159-L174 PolarHBondContact O-N 2.98Å; L161-L174 HydrophobicContact CB-CD1 3.85Å; L161-L174 HydrophobicContact CB-CD2 3.82Å; L161-L174 HydrophobicContact CB-CG 3.86Å; L161-L174 HydrophobicContact CD2-CD2 4.13Å; L174-M178 HydrophobicContact CD2-CB 4.17Å; L174-I179 HydrophobicContact CB-CD1 4.3Å; L174-I179 HydrophobicContact CB-CG1 3.82Å; L174-I179 HydrophobicContact CD1-CG1 4.22Å; L174-L182 HydrophobicContact CD1-CD1 3.39Å; L174-L182 HydrophobicContact CD2-CD1 4.06Å; L174-L182 HydrophobicContact CG-CD1 4.36Å
175	G	88.5	Confident	90.6	Very high	44 Å²	44	74.9 Å²	74.9	45%	0.454	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-80.4	166.7	166.7	0	0	0	0	0	113	K177 M178 I179	G175-K177 PolarHBondContact O-N 2.84Å; G175-M178 PolarHBondContact O-N 3.15Å; G175-M178 VanDerWaalsContact O-N 3.08Å; G175-I179 WeakPolarHBondContact O-CG1 3.21Å; G175-I179 PolarHBondContact O-N 2.92Å; G175-I179 VanDerWaalsContact O-N 3.08Å
176	Q	88	Confident	90.4	Very high	102 Å²	102	82.2 Å²	82.2	48%	0.477	42%	0.417	S	S	.	.	H	α-helix	trans	-52.8	-45.2	-177	-174.9	175.7	-2.5	0	0	113.9	M178 I179 D180	Q176-M178 VanDerWaalsContact C-N 3.32Å; Q176-M178 PolarHBondContact O-N 3.14Å; Q176-I179 PolarHBondContact O-N 2.87Å; Q176-D180 PolarHBondContact O-N 3.01Å
177	K	87.6	Confident	90.3	Very high	179 Å²	179	79.1 Å²	79.1	78%	0.778	40%	0.398	S	S	*	.	H	α-helix	trans	-62	-37.4	179.6	-66.8	-175.5	179.6	-179.6	0	113	G175 S181	G175-K177 PolarHBondContact O-N 2.84Å; K177-S181 PolarHBondContact O-N 3.22Å; K177-S181 VanDerWaalsContact O-N 3.1Å; K177-S181 PolarHBondContact O-OG 3.31Å
178	M	88.9	Confident	90.2	Very high	44 Å²	44	76.4 Å²	76.4	22%	0.217	39%	0.385	C	S	.	.	H	α-helix	trans	-72.1	-39.7	178.1	-71.8	-58.6	-67.6	0	0	111.1	L174 G175 Q176 D180 S181 L182 I195 I202	L174-M178 HydrophobicContact CD2-CB 4.17Å; G175-M178 PolarHBondContact O-N 3.15Å; G175-M178 VanDerWaalsContact O-N 3.08Å; Q176-M178 VanDerWaalsContact C-N 3.32Å; Q176-M178 PolarHBondContact O-N 3.14Å; M178-D180 VanDerWaalsContact C-N 3.33Å; M178-D180 PolarHBondContact O-N 3.3Å; M178-S181 PolarHBondContact O-N 3.26Å; M178-L182 WeakPolarHBondContact O-CB 3.48Å; M178-L182 WeakPolarHBondContact O-CG 3.42Å; M178-L182 PolarHBondContact O-N 3.32Å; M178-I195 HydrophobicContact CE-CD1 4.3Å; M178-I195 HydrophobicContact CE-CG2 3.66Å; M178-I202 HydrophobicContact CE-CD1 3.7Å; M178-I202 HydrophobicContact CE-CG1 4Å
179	I	88.9	Confident	90	Very high	1 Å²	1	74.2 Å²	74.2	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-60.9	-43.9	175.3	-65.4	167.9	0	0	0	110.8	I147 K157 L174 G175 Q176 S181 L182 T183	I147-I179 HydrophobicContact CD1-CG2 4.02Å; I147-I179 HydrophobicContact CG1-CG2 4.26Å; I147-I179 HydrophobicContact CG2-CG2 3.8Å; K157-I179 HydrophobicContact CB-CD1 3.72Å; K157-I179 HydrophobicContact CB-CG2 4.34Å; K157-I179 HydrophobicContact CD-CG2 3.91Å; K157-I179 VanDerWaalsContact O-CD1 3.31Å; K157-I179 WeakPolarHBondContact O-CD1 3.38Å; L174-I179 HydrophobicContact CB-CD1 4.3Å; L174-I179 HydrophobicContact CB-CG1 3.82Å; L174-I179 HydrophobicContact CD1-CG1 4.22Å; G175-I179 WeakPolarHBondContact O-CG1 3.21Å; G175-I179 PolarHBondContact O-N 2.92Å; G175-I179 VanDerWaalsContact O-N 3.08Å; Q176-I179 PolarHBondContact O-N 2.87Å; I179-S181 VanDerWaalsContact C-N 3.32Å; I179-S181 PolarHBondContact O-N 2.96Å; I179-L182 PolarHBondContact O-N 3.18Å; I179-T183 WeakPolarHBondContact O-CB 3.37Å; I179-T183 PolarHBondContact O-N 3.43Å; I179-T183 PolarHBondContact O-OG1 3.1Å
180	D	88.5	Confident	89.7	Confident	65 Å²	65	68.5 Å²	68.5	35%	0.348	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-36	178.2	-65.8	-27.6	0	0	0	111.3	K157 Q176 M178 T183 K184	K157-D180 IonicContact NZ-OD1 3.95Å; K157-D180 PolarHBondContact NZ-OD1 3.13Å; Q176-D180 PolarHBondContact O-N 3.01Å; M178-D180 VanDerWaalsContact C-N 3.33Å; M178-D180 PolarHBondContact O-N 3.3Å; D180-T183 PolarHBondContact O-N 3.19Å; D180-K184 WeakPolarHBondContact O-CB 3.34Å; D180-K184 PolarHBondContact O-N 3.22Å
181	S	90.5	Very high	89.6	Confident	41 Å²	41	66.9 Å²	66.9	29%	0.287	34%	0.344	S	S	.	.	H	α-helix	trans	-68.1	-43.6	174.8	-58.2	0	0	0	0	112.8	K177 M178 I179 T183 K184 E185	K177-S181 PolarHBondContact O-N 3.22Å; K177-S181 VanDerWaalsContact O-N 3.1Å; K177-S181 PolarHBondContact O-OG 3.31Å; M178-S181 PolarHBondContact O-N 3.26Å; I179-S181 VanDerWaalsContact C-N 3.32Å; I179-S181 PolarHBondContact O-N 2.96Å; S181-T183 VanDerWaalsContact C-N 3.3Å; S181-T183 PolarHBondContact O-N 3.31Å; S181-K184 PolarHBondContact O-N 3.38Å; S181-E185 PolarHBondContact O-N 2.81Å
182	L	90.8	Very high	89.5	Confident	6 Å²	6	62.6 Å²	62.6	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-40.3	173.4	-75.3	168.1	0	0	0	111.6	L174 M178 I179 K186 V187 I193 I202	L174-L182 HydrophobicContact CD1-CD1 3.39Å; L174-L182 HydrophobicContact CD2-CD1 4.06Å; L174-L182 HydrophobicContact CG-CD1 4.36Å; M178-L182 WeakPolarHBondContact O-CB 3.48Å; M178-L182 WeakPolarHBondContact O-CG 3.42Å; M178-L182 PolarHBondContact O-N 3.32Å; I179-L182 PolarHBondContact O-N 3.18Å; L182-K186 PolarHBondContact O-N 2.62Å; L182-V187 HydrophobicContact CD2-CB 3.87Å; L182-V187 HydrophobicContact CD2-CG1 4.07Å; L182-V187 HydrophobicContact CD2-CG2 3.81Å; L182-V187 PolarHBondContact O-N 2.74Å; L182-V187 VanDerWaalsContact O-N 3.16Å; L182-I193 HydrophobicContact CD2-CD1 4.34Å; L182-I202 HydrophobicContact CB-CD1 4.32Å; L182-I202 HydrophobicContact CD2-CD1 3.43Å; L182-I202 VanDerWaalsContact CD2-CD1 3.43Å; L182-I202 HydrophobicContact CD2-CG2 4.34Å; L182-I202 HydrophobicContact CG-CD1 3.44Å; L182-I202 VanDerWaalsContact CG-CD1 3.44Å
183	T	88.9	Confident	89.5	Confident	69 Å²	69	59.2 Å²	59.2	42%	0.423	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-40.3	177.9	-54.8	0	0	0	0	111	I179 D180 S181 K186	I179-T183 WeakPolarHBondContact O-CB 3.37Å; I179-T183 PolarHBondContact O-N 3.43Å; I179-T183 PolarHBondContact O-OG1 3.1Å; D180-T183 PolarHBondContact O-N 3.19Å; S181-T183 VanDerWaalsContact C-N 3.3Å; S181-T183 PolarHBondContact O-N 3.31Å; T183-K186 PolarHBondContact O-N 3.07Å
184	K	90.4	Very high	89.6	Confident	167 Å²	167	54.6 Å²	54.6	73%	0.726	28%	0.281	S	S	*	.	H	α-helix	trans	-62.2	-44.8	177.5	-174.7	-177.7	177.2	-173.9	0	111.9	D180 S181 K186	D180-K184 WeakPolarHBondContact O-CB 3.34Å; D180-K184 PolarHBondContact O-N 3.22Å; S181-K184 PolarHBondContact O-N 3.38Å; K184-K186 PolarHBondContact O-N 3.17Å
185	E	88.3	Confident	89.7	Confident	85 Å²	85	54.6 Å²	54.6	40%	0.397	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-2.2	178.1	-65.7	-57.1	137.2	0	0	113.6	S181 V187	S181-E185 PolarHBondContact O-N 2.81Å; E185-V187 VanDerWaalsContact C-N 3.27Å; E185-V187 HydrophobicContact CB-CG2 3.99Å; E185-V187 PolarHBondContact O-N 3.41Å
186	K	88.1	Confident	89.7	Confident	164 Å²	164	54.5 Å²	54.5	71%	0.713	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	44.3	-179.3	-60.9	-179.2	178.6	178.2	0	112.9	L182 T183 K184 Q188	L182-K186 PolarHBondContact O-N 2.62Å; T183-K186 PolarHBondContact O-N 3.07Å; K184-K186 PolarHBondContact O-N 3.17Å; K186-Q188 PolarHBondContact O-N 3.38Å
187	V	89.6	Confident	89.7	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.109	27%	0.27	C	S	.	.			trans	-65.9	130.6	179.6	178.8	0	0	0	0	110.3	V142 L182 E185 D191 I193 I202	V142-V187 HydrophobicContact CG2-CG1 3.82Å; L182-V187 HydrophobicContact CD2-CB 3.87Å; L182-V187 HydrophobicContact CD2-CG1 4.07Å; L182-V187 HydrophobicContact CD2-CG2 3.81Å; L182-V187 PolarHBondContact O-N 2.74Å; L182-V187 VanDerWaalsContact O-N 3.16Å; E185-V187 VanDerWaalsContact C-N 3.27Å; E185-V187 HydrophobicContact CB-CG2 3.99Å; E185-V187 PolarHBondContact O-N 3.41Å; V187-D191 HydrophobicContact CG1-CB 4.46Å; V187-I193 HydrophobicContact CG1-CD1 4.32Å; V187-I193 HydrophobicContact CG1-CG2 3.83Å; V187-I193 HydrophobicContact CG2-CG2 4.15Å; V187-I202 HydrophobicContact CG2-CG2 4.24Å
188	Q	86.6	Confident	89.6	Confident	87 Å²	87	51.1 Å²	51.1	41%	0.407	26%	0.264	S	S	.	.			trans	-121.4	161.9	178.1	-66.8	-175.8	-19.2	0	0	111.6	K186 G190 D191	K186-Q188 PolarHBondContact O-N 3.38Å; Q188-G190 PolarHBondContact O-N 2.92Å; Q188-D191 PolarHBondContact N-OD2 3.21Å; Q188-D191 WeakPolarHBondContact O-CB 3.47Å; Q188-D191 PolarHBondContact O-N 3Å
189	A	89	Confident	89.4	Confident	33 Å²	33	52.5 Å²	52.5	27%	0.273	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	122.9	172.6	0	0	0	0	0	109.9	V142 V143 Y215	V142-A189 CarbonylContact O-C 3.6Å; V143-A189 WeakPolarHBondContact O-CB 3.45Å; A189-Y215 PolarHBondContact O-OH 3.06Å
190	G	87.2	Confident	89.2	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.021	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	-4.5	-174.5	0	0	0	0	0	114.8	V142 Q188 S208	V142-G190 PolarHBondContact O-N 3.07Å; Q188-G190 PolarHBondContact O-N 2.92Å; G190-S208 WeakPolarHBondContact O-CB 3.28Å; G190-S208 PolarHBondContact O-N 2.98Å
191	D	90.4	Very high	89.3	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	143.8	170	-69.5	-36	0	0	0	110.8	V142 V187 Q188 I193 R204 G206 R207	V142-D191 WeakPolarHBondContact CG2-O 3.36Å; V142-D191 PolarHBondContact N-O 3.32Å; V187-D191 HydrophobicContact CG1-CB 4.46Å; Q188-D191 PolarHBondContact N-OD2 3.21Å; Q188-D191 WeakPolarHBondContact O-CB 3.47Å; Q188-D191 PolarHBondContact O-N 3Å; D191-I193 HydrophobicContact CB-CG2 4.26Å; D191-R204 HydrophobicContact CB-CG 4.46Å; D191-R204 IonicContact OD1-CZ 2.73Å; D191-R204 VanDerWaalsContact OD1-CZ 3.3Å; D191-R204 IonicContact OD1-NE 3.87Å; D191-R204 PolarHBondContact OD1-NE 3.22Å; D191-R204 IonicContact OD1-NH2 4Å; D191-R204 PolarHBondContact OD1-NH2 3.34Å; D191-R204 IonicContact OD2-CZ 3.65Å; D191-R204 IonicContact OD2-NE 2.98Å; D191-R204 PolarHBondContact OD2-NE 3.26Å; D191-R204 IonicContact OD2-NH2 2.67Å; D191-G206 CarbonylContact C-O 3.53Å; D191-G206 WeakPolarHBondContact CA-O 3.5Å; D191-R207 WeakPolarHBondContact OD1-CG 3.2Å; D191-R207 IonicContact OD1-NE 3.45Å; D191-R207 PolarHBondContact OD1-NE 3.46Å
192	V	92.6	Very high	89.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.8	168.2	-176.5	0	0	0	0	107.8	E141 L205 G206 P228	E141-V192 HydrophobicContact CB-CG2 4.39Å; V192-L205 HydrophobicContact CG1-CD1 4.2Å; V192-L205 PolarHBondContact O-N 3.42Å; V192-G206 PolarHBondContact N-O 3.42Å; V192-G206 PolarHBondContact O-N 2.96Å; V192-P228 HydrophobicContact CG1-CG 3.67Å
193	I	93.9	Very high	89.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.8	-175.2	66.9	173.5	0	0	0	111.4	G140 V142 L161 L163 L182 V187 D191 I195 I202 T203	G140-I193 PolarHBondContact N-O 3.47Å; G140-I193 PolarHBondContact O-N 3.47Å; V142-I193 HydrophobicContact CG2-CD1 3.6Å; V142-I193 HydrophobicContact CG2-CG1 3.79Å; V142-I193 HydrophobicContact CG2-CG2 4.13Å; L161-I193 HydrophobicContact CD2-CD1 4.37Å; L163-I193 HydrophobicContact CD2-CD1 4.13Å; L163-I193 HydrophobicContact CD2-CG1 4.2Å; L182-I193 HydrophobicContact CD2-CD1 4.34Å; V187-I193 HydrophobicContact CG1-CD1 4.32Å; V187-I193 HydrophobicContact CG1-CG2 3.83Å; V187-I193 HydrophobicContact CG2-CG2 4.15Å; D191-I193 HydrophobicContact CB-CG2 4.26Å; I193-I195 HydrophobicContact CD1-CD1 3.95Å; I193-I195 HydrophobicContact CD1-CG1 4.05Å; I193-I195 HydrophobicContact CG1-CG1 4.45Å; I193-I202 HydrophobicContact CB-CG2 4.31Å; I193-I202 HydrophobicContact CD1-CG2 4.26Å; I193-T203 WeakPolarHBondContact CA-O 3.33Å
194	T	93	Very high	89.5	Confident	27 Å²	27	58.9 Å²	58.9	17%	0.166	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.8	166.8	47.9	0	0	0	0	108.8	I138 E139 I202 T203 L205	I138-T194 CarbonylContact O-C 3.58Å; I138-T194 WeakPolarHBondContact O-CA 3.44Å; E139-T194 HydrophobicContact CB-CG2 4.11Å; E139-T194 HydrophobicContact CG-CG2 3.82Å; T194-I202 WeakPolarHBondContact O-CA 2.94Å; T194-T203 PolarHBondContact N-O 3.41Å; T194-T203 PolarHBondContact O-N 2.99Å; T194-T203 WeakPolarHBondContact OG1-CB 3.42Å; T194-T203 PolarHBondContact OG1-O 2.87Å; T194-L205 HydrophobicContact CG2-CD1 3.66Å; T194-L205 HydrophobicContact CG2-CD2 4.29Å; T194-L205 HydrophobicContact CG2-CG 4.02Å
195	I	93	Very high	89.5	Confident	13 Å²	13	54 Å²	54	7%	0.067	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.3	176.7	-56.8	176.1	0	0	0	107.2	I137 I138 L161 L163 M178 I193 K197 I202	I137-I195 CarbonylContact C-O 3.35Å; I137-I195 WeakPolarHBondContact CA-O 3.42Å; I138-I195 HydrophobicContact CB-CB 4.28Å; I138-I195 PolarHBondContact N-O 3.28Å; I138-I195 PolarHBondContact O-N 3.27Å; L161-I195 HydrophobicContact CD2-CD1 3.98Å; L163-I195 HydrophobicContact CD1-CD1 4.35Å; M178-I195 HydrophobicContact CE-CD1 4.3Å; M178-I195 HydrophobicContact CE-CG2 3.66Å; I193-I195 HydrophobicContact CD1-CD1 3.95Å; I193-I195 HydrophobicContact CD1-CG1 4.05Å; I193-I195 HydrophobicContact CG1-CG1 4.45Å; I195-K197 PolarHBondContact O-N 3.49Å; I195-I202 HydrophobicContact CG1-CG1 4.3Å; I195-I202 HydrophobicContact CG1-CG2 4.4Å
196	D	90.3	Very high	89.5	Confident	42 Å²	42	50.2 Å²	50.2	23%	0.225	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	112.6	169.8	-179.7	40.6	0	0	0	109.1	P198 S199 G200 K201	D196-P198 VanDerWaalsContact OD1-CD 3.27Å; D196-P198 WeakPolarHBondContact OD1-CD 3.45Å; D196-S199 WeakPolarHBondContact CB-OG 3.43Å; D196-S199 WeakPolarHBondContact OD2-CB 3.26Å; D196-S199 PolarHBondContact OD2-N 3.06Å; D196-S199 PolarHBondContact OD2-OG 3.27Å; D196-G200 VanDerWaalsContact O-CA 3.32Å; D196-G200 WeakPolarHBondContact O-CA 3.49Å; D196-G200 PolarHBondContact O-N 3.04Å; D196-K201 PolarHBondContact N-O 3.5Å
197	K	87.1	Confident	89.5	Confident	109 Å²	109	43.7 Å²	43.7	47%	0.474	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-39.8	-169.4	-175.9	-179.2	172.7	-169	0	113.2	E136 I195 Q233	E136-K197 HydrophobicContact CB-CB 4.32Å; E136-K197 HydrophobicContact CB-CD 4.25Å; E136-K197 VanDerWaalsContact O-CB 3.27Å; E136-K197 WeakPolarHBondContact O-CB 3.41Å; E136-K197 PolarHBondContact O-N 3Å; E136-K197 WeakPolarHBondContact OE2-CD 3.4Å; E136-K197 IonicContact OE2-NZ 2.62Å; E136-K197 PolarHBondContact OE2-NZ 2.85Å; I195-K197 PolarHBondContact O-N 3.49Å; K197-Q233 VanDerWaalsContact NZ-NE2 3.15Å
198	P	85.1	Confident	89.3	Confident	101 Å²	101	42.9 Å²	42.9	66%	0.656	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-43.6	176.8	-20.6	35.1	0	0	0	113.7	D196	D196-P198 VanDerWaalsContact OD1-CD 3.27Å; D196-P198 WeakPolarHBondContact OD1-CD 3.45Å
199	S	84.4	Confident	89.1	Confident	73 Å²	73	44.3 Å²	44.3	51%	0.51	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-20.5	-177.1	71.2	0	0	0	0	114	D196 K201	D196-S199 WeakPolarHBondContact CB-OG 3.43Å; D196-S199 WeakPolarHBondContact OD2-CB 3.26Å; D196-S199 PolarHBondContact OD2-N 3.06Å; D196-S199 PolarHBondContact OD2-OG 3.27Å; S199-K201 PolarHBondContact O-N 3.07Å; S199-K201 VanDerWaalsContact OG-CB 3.26Å; S199-K201 WeakPolarHBondContact OG-CB 3.17Å; S199-K201 PolarHBondContact OG-N 3.25Å
200	G	86.3	Confident	88.4	Confident	20 Å²	20	47 Å²	47	21%	0.206	25%	0.25	C	C	.	.			trans	68.9	11.5	-170.8	0	0	0	0	0	113.4	D196	D196-G200 VanDerWaalsContact O-CA 3.32Å; D196-G200 WeakPolarHBondContact O-CA 3.49Å; D196-G200 PolarHBondContact O-N 3.04Å
201	K	89.9	Confident	87.6	Confident	139 Å²	139	49.9 Å²	49.9	60%	0.604	26%	0.26	S	S	*	.			trans	-74.7	128.7	179.3	-173.3	179.7	177.4	-176.1	0	109.9	D196 S199	D196-K201 PolarHBondContact N-O 3.5Å; S199-K201 PolarHBondContact O-N 3.07Å; S199-K201 VanDerWaalsContact OG-CB 3.26Å; S199-K201 WeakPolarHBondContact OG-CB 3.17Å; S199-K201 PolarHBondContact OG-N 3.25Å
202	I	92.9	Very high	86.6	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.036	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127	177.9	-51.3	-177.6	0	0	0	107.8	M178 L182 V187 I193 T194 I195	M178-I202 HydrophobicContact CE-CD1 3.7Å; M178-I202 HydrophobicContact CE-CG1 4Å; L182-I202 HydrophobicContact CB-CD1 4.32Å; L182-I202 HydrophobicContact CD2-CD1 3.43Å; L182-I202 VanDerWaalsContact CD2-CD1 3.43Å; L182-I202 HydrophobicContact CD2-CG2 4.34Å; L182-I202 HydrophobicContact CG-CD1 3.44Å; L182-I202 VanDerWaalsContact CG-CD1 3.44Å; V187-I202 HydrophobicContact CG2-CG2 4.24Å; I193-I202 HydrophobicContact CB-CG2 4.31Å; I193-I202 HydrophobicContact CD1-CG2 4.26Å; T194-I202 WeakPolarHBondContact O-CA 2.94Å; I195-I202 HydrophobicContact CG1-CG1 4.3Å; I195-I202 HydrophobicContact CG1-CG2 4.4Å
203	T	91.7	Very high	85.4	Confident	62 Å²	62	62.6 Å²	62.6	38%	0.38	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120	176.1	-50.5	0	0	0	0	109.1	I193 T194 L205	I193-T203 WeakPolarHBondContact CA-O 3.33Å; T194-T203 PolarHBondContact N-O 3.41Å; T194-T203 PolarHBondContact O-N 2.99Å; T194-T203 WeakPolarHBondContact OG1-CB 3.42Å; T194-T203 PolarHBondContact OG1-O 2.87Å; T203-L205 PolarHBondContact O-N 2.86Å
204	R	90.7	Very high	84.2	Confident	88 Å²	88	68 Å²	68	33%	0.332	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	112.5	175.5	-176.2	-177	178.3	-151.3	1.5	109.6	D191	D191-R204 HydrophobicContact CB-CG 4.46Å; D191-R204 IonicContact OD1-CZ 2.73Å; D191-R204 VanDerWaalsContact OD1-CZ 3.3Å; D191-R204 IonicContact OD1-NE 3.87Å; D191-R204 PolarHBondContact OD1-NE 3.22Å; D191-R204 IonicContact OD1-NH2 4Å; D191-R204 PolarHBondContact OD1-NH2 3.34Å; D191-R204 IonicContact OD2-CZ 3.65Å; D191-R204 IonicContact OD2-NE 2.98Å; D191-R204 PolarHBondContact OD2-NE 3.26Å; D191-R204 IonicContact OD2-NH2 2.67Å
205	L	89.5	Confident	82.7	Confident	63 Å²	63	69.9 Å²	69.9	33%	0.33	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-45.6	178.2	-62.5	-177.7	0	0	0	110.6	V192 T194 T203 I225	V192-L205 HydrophobicContact CG1-CD1 4.2Å; V192-L205 PolarHBondContact O-N 3.42Å; T194-L205 HydrophobicContact CG2-CD1 3.66Å; T194-L205 HydrophobicContact CG2-CD2 4.29Å; T194-L205 HydrophobicContact CG2-CG 4.02Å; T203-L205 PolarHBondContact O-N 2.86Å; L205-I225 HydrophobicContact CB-CD1 3.63Å; L205-I225 WeakPolarHBondContact O-CD1 3.22Å
206	G	89	Confident	81.2	Confident	6 Å²	6	77.6 Å²	77.6	6%	0.062	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-163.5	-175.6	0	0	0	0	0	112.3	D191 V192 K223	D191-G206 CarbonylContact C-O 3.53Å; D191-G206 WeakPolarHBondContact CA-O 3.5Å; V192-G206 PolarHBondContact N-O 3.42Å; V192-G206 PolarHBondContact O-N 2.96Å; G206-K223 CarbonylContact C-O 3.47Å; G206-K223 VanDerWaalsContact CA-O 3.24Å; G206-K223 WeakPolarHBondContact CA-O 3.39Å
207	R	86.3	Confident	79.7	Confident	27 Å²	27	80 Å²	80	10%	0.102	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	143.6	174.5	-82	-176.5	173.3	-174.1	1.7	111.3	D191 K223 F224 I225	D191-R207 WeakPolarHBondContact OD1-CG 3.2Å; D191-R207 IonicContact OD1-NE 3.45Å; D191-R207 PolarHBondContact OD1-NE 3.46Å; R207-K223 PolarHBondContact N-O 3.37Å; R207-F224 HydrophobicContact CB-CD1 3.99Å; R207-F224 HydrophobicContact CB-CE1 4.13Å; R207-F224 CarbonylContact O-C 3.59Å; R207-F224 VanDerWaalsContact O-CA 3.22Å; R207-F224 WeakPolarHBondContact O-CA 3.5Å; R207-I225 PolarHBondContact O-N 3.26Å
208	S	85.5	Confident	78.7	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.007	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.4	173.5	-177	0	0	0	0	110.8	E141 G190 T210 R211 I225 C227	E141-S208 VanDerWaalsContact CD-OG 3.32Å; E141-S208 WeakPolarHBondContact OE2-CB 2.98Å; E141-S208 PolarHBondContact OE2-OG 3.24Å; G190-S208 WeakPolarHBondContact O-CB 3.28Å; G190-S208 PolarHBondContact O-N 2.98Å; S208-T210 PolarHBondContact O-N 3.27Å; S208-T210 PolarHBondContact OG-N 2.86Å; S208-T210 PolarHBondContact OG-OG1 2.97Å; S208-R211 PolarHBondContact O-N 3.11Å; S208-I225 WeakPolarHBondContact CA-O 3.45Å; S208-C227 PolarHBondContact OG-SG 2.79Å
209	F	82.3	Confident	77.9	Confident	118 Å²	118	75.3 Å²	75.3	52%	0.518	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-59.1	-30.7	173.3	-81.8	-81.9	0	0	0	112.7	R211 A212 F224 I225 Q226	F209-R211 VanDerWaalsContact C-N 3.3Å; F209-R211 PolarHBondContact O-N 3.08Å; F209-A212 VanDerWaalsContact O-CB 3.3Å; F209-A212 WeakPolarHBondContact O-CB 3.47Å; F209-A212 PolarHBondContact O-N 2.8Å; F209-F224 HydrophobicContact CD1-CB 3.86Å; F209-F224 HydrophobicContact CD1-CG 4.47Å; F209-F224 HydrophobicContact CD2-CB 4.14Å; F209-F224 HydrophobicContact CE1-CB 3.52Å; F209-F224 HydrophobicContact CE1-CG 4.34Å; F209-F224 HydrophobicContact CE2-CB 3.82Å; F209-F224 WeakPolarHBondContact CE2-O 3.24Å; F209-F224 HydrophobicContact CG-CB 4.16Å; F209-F224 HydrophobicContact CZ-CB 3.5Å; F209-F224 VanDerWaalsContact CZ-CB 3.5Å; F209-I225 WeakPolarHBondContact CD2-O 3.31Å; F209-I225 PolarHBondContact N-O 3.26Å; F209-Q226 HydrophobicContact CD2-CG 4.07Å; F209-Q226 HydrophobicContact CE2-CG 4.23Å
210	T	75.9	Confident	77.2	Confident	90 Å²	90	76.2 Å²	76.2	55%	0.552	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-66.2	-32.4	-175.3	59.1	0	0	0	0	112.9	S208	S208-T210 PolarHBondContact O-N 3.27Å; S208-T210 PolarHBondContact OG-N 2.86Å; S208-T210 PolarHBondContact OG-OG1 2.97Å
211	R	70.7	Confident	76.4	Confident	62 Å²	62	84.1 Å²	84.1	23%	0.234	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-101.1	11.8	177.9	-66.9	-161.3	178.1	165.3	0.5	113.9	V143 S208 F209 R213 D214	V143-R211 PolarHBondContact O-NH1 3.19Å; V143-R211 PolarHBondContact O-NH2 2.97Å; V143-R211 VanDerWaalsContact O-NH2 3.08Å; S208-R211 PolarHBondContact O-N 3.11Å; F209-R211 VanDerWaalsContact C-N 3.3Å; F209-R211 PolarHBondContact O-N 3.08Å; R211-R213 PolarHBondContact O-N 3.08Å; R211-D214 PolarHBondContact O-N 2.97Å
212	A	68.6	Low	75.7	Confident	34 Å²	34	79.4 Å²	79.4	28%	0.281	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-61.1	-25.4	177.5	0	0	0	0	0	112.8	F209 F224	F209-A212 VanDerWaalsContact O-CB 3.3Å; F209-A212 WeakPolarHBondContact O-CB 3.47Å; F209-A212 PolarHBondContact O-N 2.8Å; A212-F224 HydrophobicContact CB-CD1 3.86Å; A212-F224 HydrophobicContact CB-CE1 3.4Å; A212-F224 HydrophobicContact CB-CZ 4.01Å
213	R	68.1	Low	75.2	Confident	233 Å²	233	86.5 Å²	86.5	88%	0.879	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-80.2	-18.9	-178.7	-66	-175.6	178.9	-178.4	0.4	114.3	R211 Y215	R211-R213 PolarHBondContact O-N 3.08Å; R213-Y215 VanDerWaalsContact C-N 3.28Å; R213-Y215 PolarHBondContact O-N 3.32Å
214	D	67.7	Low	74.9	Confident	112 Å²	112	86.9 Å²	86.9	60%	0.599	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-84.3	-4	-172	-60.1	-26	0	0	0	113	R211	R211-D214 PolarHBondContact O-N 2.97Å
215	Y	62.5	Low	74.8	Confident	68 Å²	68	85.3 Å²	85.3	27%	0.267	46%	0.464	S	S	.	.			trans	-117.3	107.1	-176	-71	-83.3	0	0	0	111.3	A189 R213 A217	A189-Y215 PolarHBondContact O-OH 3.06Å; R213-Y215 VanDerWaalsContact C-N 3.28Å; R213-Y215 PolarHBondContact O-N 3.32Å; Y215-A217 PolarHBondContact O-N 2.97Å
216	D	60.3	Low	74.9	Confident	175 Å²	175	89.2 Å²	89.2	94%	0.936	48%	0.48	S	S	*	.	S	Bend	trans	-63.8	-24.3	179.3	-69.9	-28.4	0	0	0	113.8
217	A	60.2	Low	74.8	Confident	91 Å²	91	90.3 Å²	90.3	75%	0.752	49%	0.487	S	S	*	.			trans	-133.5	89.9	-179	0	0	0	0	0	111.5	Y215	Y215-A217 PolarHBondContact O-N 2.97Å
218	T	65.9	Low	75	Confident	64 Å²	64	89.5 Å²	89.5	39%	0.393	49%	0.485	S	S	.	.			trans	-88.1	122.9	168.6	39	0	0	0	0	110.7	F224	T218-F224 HydrophobicContact CG2-CZ 4.08Å
219	G	68.5	Low	75.3	Confident	48 Å²	48	96.2 Å²	96.2	50%	0.495	52%	0.516	S	S	.	.			trans	-62.4	142.8	170.8	0	0	0	0	0	110.7	Q221 T222	G219-Q221 PolarHBondContact O-N 3.27Å; G219-T222 WeakPolarHBondContact O-CB 3.28Å; G219-T222 PolarHBondContact O-N 3.29Å; G219-T222 PolarHBondContact O-OG1 3.48Å
220	G	68.1	Low	75.6	Confident	92 Å²	92	91.4 Å²	91.4	95%	0.948	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-4.6	-175.9	0	0	0	0	0	116
221	Q	71	Confident	76.4	Confident	187 Å²	187	93.8 Å²	93.8	87%	0.874	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	0.4	173.9	-62.3	-156.9	-3.8	0	0	114.2	G219 K223	G219-Q221 PolarHBondContact O-N 3.27Å; Q221-K223 PolarHBondContact O-N 2.83Å
222	T	75.2	Confident	77.3	Confident	39 Å²	39	90.9 Å²	90.9	24%	0.239	49%	0.494	C	S	.	.			trans	-71.2	114.3	178.4	49.9	0	0	0	0	110.1	G219	G219-T222 WeakPolarHBondContact O-CB 3.28Å; G219-T222 PolarHBondContact O-N 3.29Å; G219-T222 PolarHBondContact O-OG1 3.48Å
223	K	82.1	Confident	78.3	Confident	157 Å²	157	92.8 Å²	92.8	68%	0.683	50%	0.497	S	S	*	.			trans	-86.8	128.9	173.7	-67	-177.3	-180	179.9	0	109.1	G206 R207 Q221	G206-K223 CarbonylContact C-O 3.47Å; G206-K223 VanDerWaalsContact CA-O 3.24Å; G206-K223 WeakPolarHBondContact CA-O 3.39Å; R207-K223 PolarHBondContact N-O 3.37Å; Q221-K223 PolarHBondContact O-N 2.83Å
224	F	85.4	Confident	79.4	Confident	69 Å²	69	84.7 Å²	84.7	30%	0.303	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	132	171.9	-64.2	-79.6	0	0	0	110	R207 F209 A212 T218	R207-F224 HydrophobicContact CB-CD1 3.99Å; R207-F224 HydrophobicContact CB-CE1 4.13Å; R207-F224 CarbonylContact O-C 3.59Å; R207-F224 VanDerWaalsContact O-CA 3.22Å; R207-F224 WeakPolarHBondContact O-CA 3.5Å; F209-F224 HydrophobicContact CD1-CB 3.86Å; F209-F224 HydrophobicContact CD1-CG 4.47Å; F209-F224 HydrophobicContact CD2-CB 4.14Å; F209-F224 HydrophobicContact CE1-CB 3.52Å; F209-F224 HydrophobicContact CE1-CG 4.34Å; F209-F224 HydrophobicContact CE2-CB 3.82Å; F209-F224 WeakPolarHBondContact CE2-O 3.24Å; F209-F224 HydrophobicContact CG-CB 4.16Å; F209-F224 HydrophobicContact CZ-CB 3.5Å; F209-F224 VanDerWaalsContact CZ-CB 3.5Å; A212-F224 HydrophobicContact CB-CD1 3.86Å; A212-F224 HydrophobicContact CB-CE1 3.4Å; A212-F224 HydrophobicContact CB-CZ 4.01Å; T218-F224 HydrophobicContact CG2-CZ 4.08Å
225	I	89.1	Confident	80.4	Confident	56 Å²	56	88 Å²	88	29%	0.287	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148.6	-175.8	-56.7	-177.5	0	0	0	107.9	L205 R207 S208 F209	L205-I225 HydrophobicContact CB-CD1 3.63Å; L205-I225 WeakPolarHBondContact O-CD1 3.22Å; R207-I225 PolarHBondContact O-N 3.26Å; S208-I225 WeakPolarHBondContact CA-O 3.45Å; F209-I225 WeakPolarHBondContact CD2-O 3.31Å; F209-I225 PolarHBondContact N-O 3.26Å
226	Q	90.2	Very high	81.5	Confident	144 Å²	144	90.4 Å²	90.4	67%	0.673	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-72.1	157	175.1	-68.3	177.7	-15	0	0	111	F209	F209-Q226 HydrophobicContact CD2-CG 4.07Å; F209-Q226 HydrophobicContact CE2-CG 4.23Å
227	C	88.3	Confident	82.7	Confident	30 Å²	30	87.5 Å²	87.5	20%	0.203	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-60.4	133.4	172.8	-54.7	0	0	0	0	109.3	E141 T166 S208	E141-C227 PolarHBondContact OE2-SG 3.17Å; T166-C227 HydrophobicContact CG2-CB 4.05Å; S208-C227 PolarHBondContact OG-SG 2.79Å
228	P	90.1	Very high	83.8	Confident	10 Å²	10	85.1 Å²	85.1	7%	0.065	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-58.4	140.2	174.6	-23.2	33.3	0	0	0	111.4	E139 T165 T166 V192	E139-P228 HydrophobicContact CG-CB 3.89Å; E139-P228 HydrophobicContact CG-CG 3.68Å; T165-P228 WeakPolarHBondContact CA-O 3.23Å; T165-P228 VanDerWaalsContact CB-O 3.31Å; T165-P228 WeakPolarHBondContact CB-O 3.23Å; T166-P228 PolarHBondContact N-O 2.73Å; T166-P228 VanDerWaalsContact N-O 3.12Å; V192-P228 HydrophobicContact CG1-CG 3.67Å
229	E	90.3	Very high	84.8	Confident	141 Å²	141	85.2 Å²	85.2	66%	0.659	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-95.1	157.9	175.5	-61.9	-177.8	168.4	0	0	111.5	T166 K234	T166-E229 HydrophobicContact CG2-CG 4.09Å; T166-E229 WeakPolarHBondContact OG1-CA 3.46Å; E229-K234 WeakPolarHBondContact O-CE 3.46Å; E229-K234 PolarHBondContact O-NZ 3.38Å
230	G	90.4	Very high	85.7	Confident	18 Å²	18	87.1 Å²	87.1	19%	0.186	44%	0.437	C	S	.	.	S	Bend	trans	80.2	-158.6	177.6	0	0	0	0	0	114.5	T165 E167	T165-G230 WeakPolarHBondContact CB-O 3.44Å; T165-G230 WeakPolarHBondContact CG2-O 3.44Å; T165-G230 PolarHBondContact OG1-O 3.01Å; E167-G230 WeakPolarHBondContact OE2-CA 3.22Å
231	E	91.1	Very high	86.7	Confident	139 Å²	139	85.6 Å²	85.6	65%	0.65	41%	0.41	S	S	*	.			trans	-65.2	144.3	178	-62.9	-176	173.7	0	0	112.1	M168 K234	M168-E231 HydrophobicContact SD-CB 4.31Å; E231-K234 WeakPolarHBondContact O-CE 3.49Å; E231-K234 WeakPolarHBondContact O-CG 3.42Å
232	L	89.6	Confident	87.7	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.005	38%	0.379	C	S	.	.	S	Bend	trans	-69	-37.3	-179.8	-164	93.2	0	0	0	112.4	I138 E139 L163 T165 M168 T170 Y172	I138-L232 CarbonylContact C-O 3.58Å; I138-L232 VanDerWaalsContact CA-O 3.31Å; I138-L232 WeakPolarHBondContact CA-O 3.39Å; I138-L232 HydrophobicContact CG2-CD2 3.45Å; I138-L232 VanDerWaalsContact CG2-CD2 3.45Å; I138-L232 HydrophobicContact CG2-CG 3.73Å; E139-L232 PolarHBondContact N-O 2.76Å; E139-L232 VanDerWaalsContact O-CD1 3.24Å; E139-L232 WeakPolarHBondContact O-CD1 3.46Å; L163-L232 HydrophobicContact CB-CD1 3.82Å; L163-L232 HydrophobicContact CB-CD2 3.87Å; L163-L232 HydrophobicContact CD1-CD2 3.97Å; T165-L232 HydrophobicContact CG2-CB 4.09Å; T165-L232 HydrophobicContact CG2-CD1 3.5Å; T165-L232 HydrophobicContact CG2-CG 4.33Å; M168-L232 HydrophobicContact CG-CB 4.44Å; M168-L232 HydrophobicContact SD-CB 4.16Å; M168-L232 PolarHBondContact SD-N 3.47Å; M168-L232 VanDerWaalsContact SD-N 3.44Å; T170-L232 WeakPolarHBondContact OG1-CD2 3.28Å; Y172-L232 HydrophobicContact CE2-CD2 3.37Å; Y172-L232 WeakPolarHBondContact OH-CD2 3.45Å
233	Q	91.2	Very high	88.6	Confident	74 Å²	74	77.7 Å²	77.7	35%	0.346	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.8	178.4	-173.5	179.3	-14.9	0	0	109.1	E136 I138 K197	E136-Q233 PolarHBondContact OE2-NE2 2.94Å; E136-Q233 VanDerWaalsContact OE2-NE2 3.11Å; I138-Q233 HydrophobicContact CG1-CB 4.45Å; I138-Q233 HydrophobicContact CG1-CG 4.33Å; K197-Q233 VanDerWaalsContact NZ-NE2 3.15Å
234	K	89.5	Confident	89.1	Confident	64 Å²	64	70.2 Å²	70.2	28%	0.278	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.5	-178.7	-59.9	176.8	-174.1	172	0	109.9	I137 E139 E229 E231	I137-K234 HydrophobicContact CG1-CB 4.15Å; I137-K234 WeakPolarHBondContact CG1-O 3.19Å; I137-K234 PolarHBondContact N-O 3.15Å; I137-K234 PolarHBondContact O-N 2.97Å; I137-K234 VanDerWaalsContact O-O 3.13Å; E139-K234 IonicContact OE2-NZ 2.8Å; E139-K234 PolarHBondContact OE2-NZ 3.06Å; E229-K234 WeakPolarHBondContact O-CE 3.46Å; E229-K234 PolarHBondContact O-NZ 3.38Å; E231-K234 WeakPolarHBondContact O-CE 3.49Å; E231-K234 WeakPolarHBondContact O-CG 3.42Å
235	R	89.1	Confident	89.4	Confident	181 Å²	181	67.3 Å²	67.3	68%	0.683	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.1	166.8	-69.8	-173.3	172.2	-174.9	-2.2	108.5	E136	E136-R235 HydrophobicContact CG-CG 4.28Å; E136-R235 IonicContact OE1-CZ 3.45Å; E136-R235 IonicContact OE1-NE 3.14Å; E136-R235 PolarHBondContact OE1-NE 2.96Å; E136-R235 VanDerWaalsContact OE1-NE 3.14Å; E136-R235 IonicContact OE1-NH2 2.91Å; E136-R235 PolarHBondContact OE1-NH2 3.38Å
236	K	85.5	Confident	89.5	Confident	119 Å²	119	67.9 Å²	67.9	52%	0.517	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.4	178.8	-174.5	174	175.8	175.8	0	109	A135 I137 V238	A135-K236 PolarHBondContact N-O 3.46Å; A135-K236 PolarHBondContact O-N 3.35Å; I137-K236 HydrophobicContact CD1-CB 3.98Å; I137-K236 HydrophobicContact CD1-CD 3.95Å; I137-K236 HydrophobicContact CG1-CB 4.31Å; K236-V238 HydrophobicContact CD-CG2 4.41Å; K236-V238 HydrophobicContact CG-CG2 4.15Å; K236-V238 PolarHBondContact O-N 2.74Å
237	E	85.3	Confident	89.6	Confident	113 Å²	113	61.7 Å²	61.7	53%	0.528	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	121.6	167.9	-169.2	-178.2	174.1	0	0	108.2	K132 E133	K132-E237 WeakPolarHBondContact CD-OE1 3.48Å; E133-E237 WeakPolarHBondContact O-CA 3.38Å
238	V	83.9	Confident	89.9	Confident	41 Å²	41	60.3 Å²	60.3	25%	0.248	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.2	174.8	-170.4	0	0	0	0	107.7	E133 K236 H240	E133-V238 PolarHBondContact N-O 2.82Å; E133-V238 PolarHBondContact O-N 3.27Å; K236-V238 HydrophobicContact CD-CG2 4.41Å; K236-V238 HydrophobicContact CG-CG2 4.15Å; K236-V238 PolarHBondContact O-N 2.74Å; V238-H240 WeakPolarHBondContact CG1-CE1 3.36Å; V238-H240 WeakPolarHBondContact CG1-NE2 3.47Å
239	V	86.8	Confident	89.9	Confident	66 Å²	66	59.8 Å²	59.8	40%	0.4	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.2	177.3	-175.9	0	0	0	0	108	R130 I131 K132	R130-V239 HydrophobicContact CG-CG1 3.26Å; I131-V239 WeakPolarHBondContact O-CA 3.41Å; K132-V239 HydrophobicContact CG-CG2 4.29Å
240	H	88.5	Confident	90	Very high	88 Å²	88	56.7 Å²	56.7	41%	0.407	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123	176.5	-68.5	-60.9	0	0	0	109.6	R130 I131 V238 V242	R130-H240 CarbonylContact C-O 3.49Å; R130-H240 WeakPolarHBondContact CA-O 3.45Å; I131-H240 PolarHBondContact N-O 3.41Å; I131-H240 PolarHBondContact O-N 2.81Å; V238-H240 WeakPolarHBondContact CG1-CE1 3.36Å; V238-H240 WeakPolarHBondContact CG1-NE2 3.47Å; H240-V242 HydrophobicContact CB-CG2 4.48Å
241	T	88.8	Confident	90	Very high	60 Å²	60	59.8 Å²	59.8	37%	0.368	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	114.8	171.2	-53	0	0	0	0	108.2
242	V	92.1	Very high	89.9	Confident	37 Å²	37	55.2 Å²	55.2	22%	0.224	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141	-179.6	-173.8	0	0	0	0	108.5	V129 H240 E246 I247	V129-V242 PolarHBondContact N-O 3.32Å; V129-V242 PolarHBondContact O-N 3Å; H240-V242 HydrophobicContact CB-CG2 4.48Å; V242-E246 HydrophobicContact CG1-CB 3.73Å; V242-E246 WeakPolarHBondContact CG1-OE2 3.47Å; V242-I247 HydrophobicContact CG1-CD1 4.44Å; V242-I247 HydrophobicContact CG1-CG1 3.82Å
243	T	92.6	Very high	89.6	Confident	23 Å²	23	59.7 Å²	59.7	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	154.2	177.7	64.6	0	0	0	0	111.7	P99 K125 I127 H245 E246 I247	P99-T243 HydrophobicContact CB-CG2 4.44Å; K125-T243 VanDerWaalsContact O-CG2 3.23Å; K125-T243 WeakPolarHBondContact O-CG2 3.23Å; I127-T243 CarbonylContact O-C 3.55Å; I127-T243 VanDerWaalsContact O-CA 3.28Å; I127-T243 WeakPolarHBondContact O-CA 3.38Å; T243-H245 PolarHBondContact O-N 2.87Å; T243-E246 PolarHBondContact N-OE2 2.98Å; T243-E246 PolarHBondContact O-N 3.3Å; T243-E246 VanDerWaalsContact O-N 3.11Å; T243-E246 VanDerWaalsContact OG1-CD 3.27Å; T243-E246 VanDerWaalsContact OG1-CG 3.23Å; T243-E246 WeakPolarHBondContact OG1-CG 3.23Å; T243-E246 PolarHBondContact OG1-N 3.01Å; T243-E246 PolarHBondContact OG1-OE2 2.67Å; T243-E246 VanDerWaalsContact OG1-OE2 3.08Å; T243-I247 WeakPolarHBondContact O-CG1 3.38Å; T243-I247 PolarHBondContact O-N 2.73Å
244	L	92.7	Very high	89	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.2	-35.5	175.4	-71.3	-176.1	0	0	0	112.3	R124 I127 V129 I247 D248 V280 M320	R124-L244 HydrophobicContact CB-CB 4.15Å; R124-L244 PolarHBondContact O-N 3.21Å; I127-L244 HydrophobicContact CB-CD1 3.79Å; I127-L244 HydrophobicContact CB-CG 4.01Å; I127-L244 HydrophobicContact CD1-CD1 3.76Å; I127-L244 HydrophobicContact CG1-CD1 4.41Å; I127-L244 HydrophobicContact CG2-CD1 3.55Å; I127-L244 HydrophobicContact CG2-CG 3.85Å; I127-L244 PolarHBondContact O-N 3.01Å; V129-L244 HydrophobicContact CG2-CD2 3.51Å; V129-L244 HydrophobicContact CG2-CG 4.18Å; L244-I247 HydrophobicContact CD2-CD1 4.45Å; L244-I247 PolarHBondContact O-N 3.45Å; L244-D248 VanDerWaalsContact O-CG 3.27Å; L244-D248 PolarHBondContact O-N 3.42Å; L244-V280 HydrophobicContact CD2-CG1 4.31Å; L244-V280 HydrophobicContact CD2-CG2 3.83Å; L244-M320 HydrophobicContact CD1-CE 4.1Å
245	H	92.2	Very high	88.3	Confident	9 Å²	9	66.4 Å²	66.4	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-40.4	176.2	175.7	70.3	0	0	0	112.4	Q121 R124 K125 T243 I247 D248 V249	Q121-H245 PolarHBondContact OE1-CE1 2.98Å; R124-H245 HydrophobicContact CB-CB 3.96Å; R124-H245 PolarHBondContact O-N 3.3Å; K125-H245 HydrophobicContact CB-CB 4.43Å; K125-H245 WeakPolarHBondContact CE-CD2 3.42Å; K125-H245 WeakPolarHBondContact CE-NE2 3.02Å; K125-H245 HydrophobicContact CG-CB 3.59Å; T243-H245 PolarHBondContact O-N 2.87Å; H245-I247 VanDerWaalsContact C-N 3.32Å; H245-I247 PolarHBondContact O-N 2.83Å; H245-D248 WeakPolarHBondContact O-CB 3.44Å; H245-D248 PolarHBondContact O-N 2.9Å; H245-V249 WeakPolarHBondContact O-CG2 3.24Å; H245-V249 PolarHBondContact O-N 3.26Å
246	E	92.1	Very high	87.7	Confident	68 Å²	68	57.9 Å²	57.9	32%	0.318	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-41.8	176.8	-74.4	163.1	157.9	0	0	111.5	V242 T243 D248 V249 I250 L260	V242-E246 HydrophobicContact CG1-CB 3.73Å; V242-E246 WeakPolarHBondContact CG1-OE2 3.47Å; T243-E246 PolarHBondContact N-OE2 2.98Å; T243-E246 PolarHBondContact O-N 3.3Å; T243-E246 VanDerWaalsContact O-N 3.11Å; T243-E246 VanDerWaalsContact OG1-CD 3.27Å; T243-E246 VanDerWaalsContact OG1-CG 3.23Å; T243-E246 WeakPolarHBondContact OG1-CG 3.23Å; T243-E246 PolarHBondContact OG1-N 3.01Å; T243-E246 PolarHBondContact OG1-OE2 2.67Å; T243-E246 VanDerWaalsContact OG1-OE2 3.08Å; E246-D248 VanDerWaalsContact C-N 3.35Å; E246-D248 PolarHBondContact O-N 3.24Å; E246-V249 PolarHBondContact O-N 3.2Å; E246-I250 WeakPolarHBondContact O-CB 3.44Å; E246-I250 WeakPolarHBondContact O-CD1 3.41Å; E246-I250 WeakPolarHBondContact O-CG1 3.27Å; E246-I250 PolarHBondContact O-N 3.46Å; E246-L260 HydrophobicContact CB-CD1 4.27Å; E246-L260 HydrophobicContact CB-CD2 4.2Å; E246-L260 HydrophobicContact CG-CD1 4.16Å; E246-L260 HydrophobicContact CG-CD2 3.9Å
247	I	92.5	Very high	87.5	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-44	176	-59.2	171.2	0	0	0	110.3	V129 V242 T243 L244 H245 V249 I250 N251 I276	V129-I247 HydrophobicContact CB-CD1 4.38Å; V129-I247 HydrophobicContact CG2-CD1 4.27Å; V242-I247 HydrophobicContact CG1-CD1 4.44Å; V242-I247 HydrophobicContact CG1-CG1 3.82Å; T243-I247 WeakPolarHBondContact O-CG1 3.38Å; T243-I247 PolarHBondContact O-N 2.73Å; L244-I247 HydrophobicContact CD2-CD1 4.45Å; L244-I247 PolarHBondContact O-N 3.45Å; H245-I247 VanDerWaalsContact C-N 3.32Å; H245-I247 PolarHBondContact O-N 2.83Å; I247-V249 PolarHBondContact O-N 2.79Å; I247-I250 PolarHBondContact O-N 2.83Å; I247-N251 WeakPolarHBondContact CG2-ND2 3.33Å; I247-N251 PolarHBondContact O-N 2.79Å; I247-N251 PolarHBondContact O-ND2 3.45Å; I247-I276 HydrophobicContact CB-CG2 4.24Å; I247-I276 HydrophobicContact CG2-CD1 3.84Å; I247-I276 HydrophobicContact CG2-CG1 4.12Å; I247-I276 HydrophobicContact CG2-CG2 3.62Å
248	D	92.7	Very high	87.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-49.3	176.8	-68.2	-9.6	0	0	0	111.9	R124 L244 H245 E246 I250 N251 S252 I268 R273	R124-D248 VanDerWaalsContact CD-OD2 3.23Å; R124-D248 WeakPolarHBondContact CD-OD2 3.16Å; R124-D248 IonicContact CZ-OD1 3.4Å; R124-D248 IonicContact CZ-OD2 2.93Å; R124-D248 IonicContact NE-OD1 3.85Å; R124-D248 PolarHBondContact NE-OD1 3.38Å; R124-D248 IonicContact NE-OD2 3.74Å; R124-D248 PolarHBondContact NE-OD2 3.16Å; R124-D248 IonicContact NH2-OD1 3.06Å; R124-D248 PolarHBondContact NH2-OD1 3.15Å; R124-D248 IonicContact NH2-OD2 3.99Å; L244-D248 VanDerWaalsContact O-CG 3.27Å; L244-D248 PolarHBondContact O-N 3.42Å; H245-D248 WeakPolarHBondContact O-CB 3.44Å; H245-D248 PolarHBondContact O-N 2.9Å; E246-D248 VanDerWaalsContact C-N 3.35Å; E246-D248 PolarHBondContact O-N 3.24Å; D248-I250 PolarHBondContact O-N 3.23Å; D248-N251 PolarHBondContact O-N 2.94Å; D248-S252 VanDerWaalsContact O-CB 3.28Å; D248-S252 WeakPolarHBondContact O-CB 3.47Å; D248-S252 PolarHBondContact O-N 3.47Å; D248-I268 HydrophobicContact CB-CD1 3.84Å; D248-I268 HydrophobicContact CB-CG2 4.43Å; D248-R273 IonicContact OD2-NE 2.91Å; D248-R273 PolarHBondContact OD2-NE 3.1Å
249	V	91.7	Very high	87.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-43.6	-176.5	173.5	0	0	0	0	110.3	H245 E246 I247 N251 S252 G256 A259 L260 T265 I268	H245-V249 WeakPolarHBondContact O-CG2 3.24Å; H245-V249 PolarHBondContact O-N 3.26Å; E246-V249 PolarHBondContact O-N 3.2Å; I247-V249 PolarHBondContact O-N 2.79Å; V249-N251 VanDerWaalsContact C-N 3.32Å; V249-N251 PolarHBondContact O-N 2.98Å; V249-S252 PolarHBondContact O-N 3.01Å; V249-S252 PolarHBondContact O-OG 3.38Å; V249-G256 WeakPolarHBondContact CG1-O 3.44Å; V249-A259 HydrophobicContact CG1-CB 3.79Å; V249-L260 HydrophobicContact CB-CD2 3.64Å; V249-L260 HydrophobicContact CB-CG 4.48Å; V249-L260 HydrophobicContact CG1-CD2 3.68Å; V249-L260 HydrophobicContact CG1-CG 4.11Å; V249-L260 HydrophobicContact CG2-CD2 4.04Å; V249-T265 HydrophobicContact CG1-CG2 4.07Å; V249-T265 HydrophobicContact CG2-CG2 3.62Å; V249-I268 HydrophobicContact CG2-CD1 3.71Å
250	I	91.6	Very high	87.2	Confident	75 Å²	75	54.4 Å²	54.4	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-41.2	177.9	-70.1	166.9	0	0	0	111.2	E246 I247 D248 L260	E246-I250 WeakPolarHBondContact O-CB 3.44Å; E246-I250 WeakPolarHBondContact O-CD1 3.41Å; E246-I250 WeakPolarHBondContact O-CG1 3.27Å; E246-I250 PolarHBondContact O-N 3.46Å; I247-I250 PolarHBondContact O-N 2.83Å; D248-I250 PolarHBondContact O-N 3.23Å; I250-L260 HydrophobicContact CD1-CD1 4.03Å; I250-L260 HydrophobicContact CG1-CD1 4.01Å
251	N	90.4	Very high	86.8	Confident	84 Å²	84	58.7 Å²	58.7	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-82.7	-16.4	-179.4	-70.2	-75.7	0	0	0	113.5	I247 D248 V249 V272 I276	I247-N251 WeakPolarHBondContact CG2-ND2 3.33Å; I247-N251 PolarHBondContact O-N 2.79Å; I247-N251 PolarHBondContact O-ND2 3.45Å; D248-N251 PolarHBondContact O-N 2.94Å; V249-N251 VanDerWaalsContact C-N 3.32Å; V249-N251 PolarHBondContact O-N 2.98Å; N251-V272 HydrophobicContact CB-CG1 4.33Å; N251-I276 HydrophobicContact CB-CD1 3.99Å; N251-I276 WeakPolarHBondContact ND2-CD1 3.16Å
252	S	88.1	Confident	86.6	Confident	43 Å²	43	59.6 Å²	59.6	30%	0.301	31%	0.309	S	S	.	.	H	α-helix	trans	-75.4	-27.2	178.6	73.7	0	0	0	0	113.8	D248 V249	D248-S252 VanDerWaalsContact O-CB 3.28Å; D248-S252 WeakPolarHBondContact O-CB 3.47Å; D248-S252 PolarHBondContact O-N 3.47Å; V249-S252 PolarHBondContact O-N 3.01Å; V249-S252 PolarHBondContact O-OG 3.38Å
253	R	83.3	Confident	85.9	Confident	94 Å²	94	60 Å²	60	36%	0.355	32%	0.32	S	S	.	.	S	Bend	trans	-135	145.1	-175.3	-61.2	-176.1	-173.2	-164.7	3.3	110.9	Q255 G256 D264 T265	R253-Q255 PolarHBondContact O-N 2.74Å; R253-Q255 VanDerWaalsContact O-N 3.07Å; R253-G256 PolarHBondContact O-N 3.37Å; R253-D264 IonicContact CZ-OD2 3.46Å; R253-D264 PolarHBondContact NH1-O 2.99Å; R253-D264 IonicContact NH1-OD1 3.55Å; R253-D264 IonicContact NH1-OD2 3.44Å; R253-D264 PolarHBondContact NH1-OD2 3.45Å; R253-D264 PolarHBondContact NH2-O 2.8Å; R253-D264 IonicContact NH2-OD1 3.41Å; R253-D264 PolarHBondContact NH2-OD1 2.95Å; R253-D264 IonicContact NH2-OD2 2.74Å; R253-T265 VanDerWaalsContact NH2-C 3.28Å; R253-T265 PolarHBondContact NH2-O 3.12Å
254	T	78.8	Confident	85.3	Confident	156 Å²	156	62.9 Å²	62.9	96%	0.957	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.7	-179.4	48.5	0	0	0	0	114.9
255	Q	76.5	Confident	84.6	Confident	124 Å²	124	63.4 Å²	63.4	58%	0.579	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	44.4	170.9	-66.2	-173.3	-15.4	0	0	110.9	R253 F257 L258	R253-Q255 PolarHBondContact O-N 2.74Å; R253-Q255 VanDerWaalsContact O-N 3.07Å; Q255-F257 HydrophobicContact CB-CE1 4.08Å; Q255-F257 HydrophobicContact CG-CE1 4.39Å; Q255-F257 PolarHBondContact O-N 3.41Å; Q255-F257 VanDerWaalsContact O-N 3.08Å; Q255-L258 PolarHBondContact O-N 2.98Å
256	G	75.7	Confident	84.2	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-20.5	-174.3	0	0	0	0	0	115.1	V249 R253 L258 A259 L260	V249-G256 WeakPolarHBondContact CG1-O 3.44Å; R253-G256 PolarHBondContact O-N 3.37Å; G256-L258 PolarHBondContact O-N 3.37Å; G256-A259 VanDerWaalsContact O-CB 3.31Å; G256-A259 WeakPolarHBondContact O-CB 3.23Å; G256-A259 PolarHBondContact O-N 3.22Å; G256-L260 PolarHBondContact O-N 3.29Å
257	F	82	Confident	83.9	Confident	111 Å²	111	66.2 Å²	66.2	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-28.5	177.3	71.2	-90.2	0	0	0	113.2	Q255 F261	Q255-F257 HydrophobicContact CB-CE1 4.08Å; Q255-F257 HydrophobicContact CG-CE1 4.39Å; Q255-F257 PolarHBondContact O-N 3.41Å; Q255-F257 VanDerWaalsContact O-N 3.08Å; F257-F261 WeakPolarHBondContact O-CD2 3.12Å; F257-F261 WeakPolarHBondContact O-CE2 3.5Å
258	L	82.3	Confident	83.8	Confident	94 Å²	94	66 Å²	66	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-70.9	-33.8	174.3	-72.1	166.7	0	0	0	111.8	Q255 G256 L260 F261 S262	Q255-L258 PolarHBondContact O-N 2.98Å; G256-L258 PolarHBondContact O-N 3.37Å; L258-L260 PolarHBondContact O-N 3.21Å; L258-F261 PolarHBondContact O-N 3.48Å; L258-F261 VanDerWaalsContact O-N 3.11Å; L258-S262 PolarHBondContact O-N 2.95Å; L258-S262 PolarHBondContact O-OG 3.18Å
259	A	82.3	Confident	83.8	Confident	5 Å²	5	73.2 Å²	73.2	4%	0.041	39%	0.387	C	S	.	.	H	α-helix	trans	-66.3	-28.3	179.7	0	0	0	0	0	112.5	V249 G256 F261 S262 G263	V249-A259 HydrophobicContact CG1-CB 3.79Å; G256-A259 VanDerWaalsContact O-CB 3.31Å; G256-A259 WeakPolarHBondContact O-CB 3.23Å; G256-A259 PolarHBondContact O-N 3.22Å; A259-F261 PolarHBondContact O-N 3.27Å; A259-S262 WeakPolarHBondContact CA-OG 3.18Å; A259-S262 PolarHBondContact O-N 3.18Å; A259-G263 PolarHBondContact O-N 2.97Å
260	L	83.6	Confident	83.7	Confident	55 Å²	55	77 Å²	77	29%	0.288	41%	0.413	S	S	.	.	H	α-helix	trans	-59.7	-35.2	172.5	-62.8	178.1	0	0	0	112.4	E246 V249 I250 G256 L258	E246-L260 HydrophobicContact CB-CD1 4.27Å; E246-L260 HydrophobicContact CB-CD2 4.2Å; E246-L260 HydrophobicContact CG-CD1 4.16Å; E246-L260 HydrophobicContact CG-CD2 3.9Å; V249-L260 HydrophobicContact CB-CD2 3.64Å; V249-L260 HydrophobicContact CB-CG 4.48Å; V249-L260 HydrophobicContact CG1-CD2 3.68Å; V249-L260 HydrophobicContact CG1-CG 4.11Å; V249-L260 HydrophobicContact CG2-CD2 4.04Å; I250-L260 HydrophobicContact CD1-CD1 4.03Å; I250-L260 HydrophobicContact CG1-CD1 4.01Å; G256-L260 PolarHBondContact O-N 3.29Å; L258-L260 PolarHBondContact O-N 3.21Å
261	F	81.8	Confident	83.8	Confident	178 Å²	178	79.6 Å²	79.6	78%	0.781	42%	0.424	S	S	*	.	H	α-helix	trans	-91	-30.6	-179.5	-60.7	-72.7	0	0	0	112.9	F257 L258 A259	F257-F261 WeakPolarHBondContact O-CD2 3.12Å; F257-F261 WeakPolarHBondContact O-CE2 3.5Å; L258-F261 PolarHBondContact O-N 3.48Å; L258-F261 VanDerWaalsContact O-N 3.11Å; A259-F261 PolarHBondContact O-N 3.27Å
262	S	82.6	Confident	83.9	Confident	80 Å²	80	76.9 Å²	76.9	56%	0.559	41%	0.41	S	S	*	.	H	α-helix	trans	-81.5	-21.6	179.7	67.7	0	0	0	0	113.5	L258 A259 D264	L258-S262 PolarHBondContact O-N 2.95Å; L258-S262 PolarHBondContact O-OG 3.18Å; A259-S262 WeakPolarHBondContact CA-OG 3.18Å; A259-S262 PolarHBondContact O-N 3.18Å; S262-D264 PolarHBondContact O-N 3.15Å; S262-D264 PolarHBondContact OG-N 2.88Å
263	G	78.4	Confident	84.1	Confident	44 Å²	44	76 Å²	76	45%	0.454	40%	0.4	S	S	.	.			trans	76.8	-6.7	-172.9	0	0	0	0	0	114	A259 T265	A259-G263 PolarHBondContact O-N 2.97Å; G263-T265 PolarHBondContact O-N 3.4Å
264	D	79.3	Confident	84.6	Confident	85 Å²	85	75.6 Å²	75.6	46%	0.455	41%	0.405	S	S	.	.			trans	-77.8	64.5	174	174.7	29.1	0	0	0	110.1	R253 S262	R253-D264 IonicContact CZ-OD2 3.46Å; R253-D264 PolarHBondContact NH1-O 2.99Å; R253-D264 IonicContact NH1-OD1 3.55Å; R253-D264 IonicContact NH1-OD2 3.44Å; R253-D264 PolarHBondContact NH1-OD2 3.45Å; R253-D264 PolarHBondContact NH2-O 2.8Å; R253-D264 IonicContact NH2-OD1 3.41Å; R253-D264 PolarHBondContact NH2-OD1 2.95Å; R253-D264 IonicContact NH2-OD2 2.74Å; S262-D264 PolarHBondContact O-N 3.15Å; S262-D264 PolarHBondContact OG-N 2.88Å
265	T	79.6	Confident	85.3	Confident	10 Å²	10	74.4 Å²	74.4	6%	0.061	39%	0.389	C	S	.	.			trans	-80.1	-32.5	172.6	61.8	0	0	0	0	110.5	Q121 V249 R253 G263	Q121-T265 PolarHBondContact NE2-OG1 2.62Å; V249-T265 HydrophobicContact CG1-CG2 4.07Å; V249-T265 HydrophobicContact CG2-CG2 3.62Å; R253-T265 VanDerWaalsContact NH2-C 3.28Å; R253-T265 PolarHBondContact NH2-O 3.12Å; G263-T265 PolarHBondContact O-N 3.4Å
266	G	82	Confident	86	Confident	20 Å²	20	68.9 Å²	68.9	21%	0.206	36%	0.363	C	S	.	.			trans	60.9	-160.1	-168	0	0	0	0	0	111.7	Q121	Q121-G266 PolarHBondContact NE2-O 2.85Å
267	E	87.5	Confident	86.8	Confident	116 Å²	116	71.3 Å²	71.3	54%	0.542	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-87	125.1	174	-55.8	-162.1	141.6	0	0	111	M113 S114 E117	M113-E267 HydrophobicContact CB-CG 4.35Å; S114-E267 VanDerWaalsContact CB-OE1 3.24Å; S114-E267 WeakPolarHBondContact CB-OE1 3.31Å; S114-E267 PolarHBondContact N-OE1 3.11Å; S114-E267 PolarHBondContact OG-OE1 3.48Å; E117-E267 HydrophobicContact CG-CB 4.29Å; E117-E267 HydrophobicContact CG-CG 4.14Å
268	I	90.1	Very high	87.4	Confident	11 Å²	11	73 Å²	73	6%	0.056	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-90.1	130.3	179.8	-55	176.6	0	0	0	109.4	E117 D248 V249 V272 R273	E117-I268 PolarHBondContact OE1-N 2.79Å; D248-I268 HydrophobicContact CB-CD1 3.84Å; D248-I268 HydrophobicContact CB-CG2 4.43Å; V249-I268 HydrophobicContact CG2-CD1 3.71Å; I268-V272 HydrophobicContact CG2-CB 4.37Å; I268-R273 HydrophobicContact CG2-CG 4.42Å
269	K	91.6	Very high	87.9	Confident	150 Å²	150	72.5 Å²	72.5	65%	0.652	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-60.4	137.7	176.7	-65.1	-175.8	178.7	-175.8	0	111.3	E271 V272	K269-E271 VanDerWaalsContact C-N 3.27Å; K269-E271 PolarHBondContact O-N 2.93Å; K269-V272 HydrophobicContact CB-CG2 4.39Å; K269-V272 PolarHBondContact O-N 2.86Å
270	S	90.9	Very high	88.3	Confident	79 Å²	79	72.3 Å²	72.3	55%	0.552	38%	0.377	S	S	*	.	H	α-helix	trans	-58.9	-36.1	177.6	55.6	0	0	0	0	113	V272 R273 D274	S270-V272 PolarHBondContact O-N 3.48Å; S270-R273 WeakPolarHBondContact O-CA 3.4Å; S270-R273 WeakPolarHBondContact O-CB 3.31Å; S270-R273 PolarHBondContact O-N 3.02Å; S270-D274 PolarHBondContact O-N 3.37Å
271	E	93.1	Very high	88.7	Confident	131 Å²	131	71.7 Å²	71.7	61%	0.612	38%	0.38	S	S	*	.	H	α-helix	trans	-55	-39.3	177.8	-64.6	172.5	-178.9	0	0	112.6	K269 Q275	K269-E271 VanDerWaalsContact C-N 3.27Å; K269-E271 PolarHBondContact O-N 2.93Å; E271-Q275 VanDerWaalsContact O-CG 3.3Å; E271-Q275 WeakPolarHBondContact O-CG 3.18Å; E271-Q275 PolarHBondContact O-N 3.37Å; E271-Q275 VanDerWaalsContact O-N 3.1Å
272	V	92.9	Very high	89.2	Confident	27 Å²	27	68.3 Å²	68.3	16%	0.164	37%	0.366	C	S	.	.	H	α-helix	trans	-67	-43.3	177.5	179.3	0	0	0	0	109.6	N251 I268 K269 S270 D274 Q275 I276	N251-V272 HydrophobicContact CB-CG1 4.33Å; I268-V272 HydrophobicContact CG2-CB 4.37Å; K269-V272 HydrophobicContact CB-CG2 4.39Å; K269-V272 PolarHBondContact O-N 2.86Å; S270-V272 PolarHBondContact O-N 3.48Å; V272-D274 VanDerWaalsContact C-N 3.34Å; V272-D274 PolarHBondContact O-N 3.4Å; V272-Q275 PolarHBondContact O-N 3.03Å; V272-I276 HydrophobicContact CG1-CG1 4.46Å; V272-I276 WeakPolarHBondContact O-CG1 3.22Å; V272-I276 PolarHBondContact O-N 3.4Å
273	R	92.1	Very high	89.7	Confident	23 Å²	23	67.3 Å²	67.3	9%	0.087	35%	0.35	C	S	.	.	H	α-helix	trans	-61.9	-41.8	178.8	-64	-175.3	163.4	148.8	5.2	112	E117 D248 I268 S270 I276 N277	E117-R273 IonicContact OE1-CZ 3.31Å; E117-R273 IonicContact OE1-NH1 3.94Å; E117-R273 IonicContact OE1-NH2 3.8Å; E117-R273 PolarHBondContact OE1-NH2 3.34Å; E117-R273 IonicContact OE2-CZ 3.03Å; E117-R273 VanDerWaalsContact OE2-CZ 3.28Å; E117-R273 IonicContact OE2-NH1 2.85Å; E117-R273 PolarHBondContact OE2-NH1 3.1Å; E117-R273 IonicContact OE2-NH2 2.76Å; E117-R273 PolarHBondContact OE2-NH2 3.41Å; D248-R273 IonicContact OD2-NE 2.91Å; D248-R273 PolarHBondContact OD2-NE 3.1Å; I268-R273 HydrophobicContact CG2-CG 4.42Å; S270-R273 WeakPolarHBondContact O-CA 3.4Å; S270-R273 WeakPolarHBondContact O-CB 3.31Å; S270-R273 PolarHBondContact O-N 3.02Å; R273-I276 PolarHBondContact O-N 2.92Å; R273-N277 WeakPolarHBondContact O-CB 3.48Å; R273-N277 PolarHBondContact O-N 2.81Å; R273-N277 PolarHBondContact O-ND2 3Å; R273-N277 PolarHBondContact O-OD1 3.06Å
274	D	92.7	Very high	90.2	Very high	87 Å²	87	73 Å²	73	47%	0.465	36%	0.358	S	S	.	.	H	α-helix	trans	-65.5	-42	178.5	-64.9	-26.7	0	0	0	111.2	S270 V272 I276 N277 H278	S270-D274 PolarHBondContact O-N 3.37Å; V272-D274 VanDerWaalsContact C-N 3.34Å; V272-D274 PolarHBondContact O-N 3.4Å; D274-I276 VanDerWaalsContact C-N 3.35Å; D274-I276 PolarHBondContact O-N 2.93Å; D274-N277 PolarHBondContact O-N 2.82Å; D274-H278 PolarHBondContact O-CD2 3.09Å; D274-H278 PolarHBondContact O-N 3.02Å
275	Q	93.6	Very high	90.8	Very high	131 Å²	131	77.2 Å²	77.2	61%	0.612	38%	0.375	S	S	*	.	H	α-helix	trans	-60.2	-43	172.4	-71.8	174.2	6.7	0	0	112.2	E271 V272 H278 K279	E271-Q275 VanDerWaalsContact O-CG 3.3Å; E271-Q275 WeakPolarHBondContact O-CG 3.18Å; E271-Q275 PolarHBondContact O-N 3.37Å; E271-Q275 VanDerWaalsContact O-N 3.1Å; V272-Q275 PolarHBondContact O-N 3.03Å; Q275-H278 PolarHBondContact O-N 2.9Å; Q275-K279 WeakPolarHBondContact O-CB 3.46Å; Q275-K279 PolarHBondContact O-N 3.37Å
276	I	92.9	Very high	91.3	Very high	8 Å²	8	81.3 Å²	81.3	4%	0.041	39%	0.393	C	S	.	.	H	α-helix	trans	-65	-41.6	176.3	-65.3	-45	0	0	0	111.2	I247 N251 V272 R273 D274 H278 K279 V280	I247-I276 HydrophobicContact CB-CG2 4.24Å; I247-I276 HydrophobicContact CG2-CD1 3.84Å; I247-I276 HydrophobicContact CG2-CG1 4.12Å; I247-I276 HydrophobicContact CG2-CG2 3.62Å; N251-I276 HydrophobicContact CB-CD1 3.99Å; N251-I276 WeakPolarHBondContact ND2-CD1 3.16Å; V272-I276 HydrophobicContact CG1-CG1 4.46Å; V272-I276 WeakPolarHBondContact O-CG1 3.22Å; V272-I276 PolarHBondContact O-N 3.4Å; R273-I276 PolarHBondContact O-N 2.92Å; D274-I276 VanDerWaalsContact C-N 3.35Å; D274-I276 PolarHBondContact O-N 2.93Å; I276-H278 VanDerWaalsContact C-N 3.33Å; I276-H278 PolarHBondContact O-N 3.18Å; I276-K279 PolarHBondContact O-N 3.35Å; I276-V280 HydrophobicContact CG2-CG2 4.07Å; I276-V280 WeakPolarHBondContact O-CB 3.35Å; I276-V280 VanDerWaalsContact O-CG2 3.28Å; I276-V280 WeakPolarHBondContact O-CG2 3.4Å; I276-V280 PolarHBondContact O-N 2.96Å
277	N	92.4	Very high	91.6	Very high	52 Å²	52	83.2 Å²	83.2	28%	0.278	41%	0.414	S	S	.	.	H	α-helix	trans	-60.5	-44	177.2	-65.5	-20.8	0	0	0	111.2	R124 R273 D274 V280 A281	R124-N277 PolarHBondContact NH1-OD1 2.93Å; R124-N277 PolarHBondContact NH2-OD1 2.83Å; R273-N277 WeakPolarHBondContact O-CB 3.48Å; R273-N277 PolarHBondContact O-N 2.81Å; R273-N277 PolarHBondContact O-ND2 3Å; R273-N277 PolarHBondContact O-OD1 3.06Å; D274-N277 PolarHBondContact O-N 2.82Å; N277-V280 PolarHBondContact O-N 3.16Å; N277-A281 WeakPolarHBondContact O-CB 3.43Å; N277-A281 PolarHBondContact O-N 3.34Å
278	H	93.1	Very high	91.7	Very high	146 Å²	146	82.9 Å²	82.9	68%	0.676	41%	0.41	S	S	*	.	H	α-helix	trans	-61.8	-44	174.6	-76.1	-55	0	0	0	112.5	D274 Q275 I276 A281 E282	D274-H278 PolarHBondContact O-CD2 3.09Å; D274-H278 PolarHBondContact O-N 3.02Å; Q275-H278 PolarHBondContact O-N 2.9Å; I276-H278 VanDerWaalsContact C-N 3.33Å; I276-H278 PolarHBondContact O-N 3.18Å; H278-A281 WeakPolarHBondContact O-CB 3.45Å; H278-A281 PolarHBondContact O-N 2.97Å; H278-E282 PolarHBondContact O-N 3.34Å
279	K	92.7	Very high	91.7	Very high	84 Å²	84	82.9 Å²	82.9	37%	0.365	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-39.2	179.2	-166.7	177.3	-169.3	-173	0	112.8	Q275 I276 A281 E282 W283	Q275-K279 WeakPolarHBondContact O-CB 3.46Å; Q275-K279 PolarHBondContact O-N 3.37Å; I276-K279 PolarHBondContact O-N 3.35Å; K279-A281 VanDerWaalsContact C-N 3.34Å; K279-E282 PolarHBondContact O-N 3.11Å; K279-W283 HydrophobicContact CD-CH2 4.16Å; K279-W283 HydrophobicContact CD-CZ2 3.84Å; K279-W283 HydrophobicContact CG-CD2 4.28Å; K279-W283 HydrophobicContact CG-CH2 4.44Å; K279-W283 HydrophobicContact CG-CZ2 3.99Å; K279-W283 VanDerWaalsContact O-CG 3.3Å; K279-W283 PolarHBondContact O-N 3.2Å
280	V	91.8	Very high	91.5	Very high	1 Å²	1	80.3 Å²	80.3	1%	0.006	40%	0.402	C	S	.	.	H	α-helix	trans	-68.8	-35.7	176.4	172.2	0	0	0	0	110.9	V129 L244 I276 N277 W283 R284 I291	V129-V280 HydrophobicContact CG2-CG1 4.09Å; V129-V280 HydrophobicContact CG2-CG2 4.48Å; L244-V280 HydrophobicContact CD2-CG1 4.31Å; L244-V280 HydrophobicContact CD2-CG2 3.83Å; I276-V280 HydrophobicContact CG2-CG2 4.07Å; I276-V280 WeakPolarHBondContact O-CB 3.35Å; I276-V280 VanDerWaalsContact O-CG2 3.28Å; I276-V280 WeakPolarHBondContact O-CG2 3.4Å; I276-V280 PolarHBondContact O-N 2.96Å; N277-V280 PolarHBondContact O-N 3.16Å; V280-W283 HydrophobicContact CG2-CE3 4.22Å; V280-W283 HydrophobicContact CG2-CZ3 4.42Å; V280-W283 PolarHBondContact O-N 3.22Å; V280-R284 WeakPolarHBondContact O-CB 3.44Å; V280-R284 PolarHBondContact O-N 3.4Å; V280-I291 HydrophobicContact CG1-CD1 3.94Å; V280-I291 HydrophobicContact CG1-CG1 4.03Å
281	A	91.5	Very high	91.4	Very high	42 Å²	42	78.2 Å²	78.2	35%	0.347	38%	0.384	S	S	.	.	H	α-helix	trans	-63.1	-44.8	172	0	0	0	0	0	111.6	N277 H278 K279 R284 E285	N277-A281 WeakPolarHBondContact O-CB 3.43Å; N277-A281 PolarHBondContact O-N 3.34Å; H278-A281 WeakPolarHBondContact O-CB 3.45Å; H278-A281 PolarHBondContact O-N 2.97Å; K279-A281 VanDerWaalsContact C-N 3.34Å; A281-R284 WeakPolarHBondContact O-CB 3.48Å; A281-R284 PolarHBondContact O-N 3.41Å; A281-E285 WeakPolarHBondContact O-CG 3.49Å; A281-E285 PolarHBondContact O-N 3.37Å
282	E	93.4	Very high	91	Very high	108 Å²	108	72.8 Å²	72.8	51%	0.505	36%	0.36	S	S	.	.	H	α-helix	trans	-59.4	-47.2	174.5	-174	-178.6	-175.7	0	0	111.6	H278 K279 R284 E285 E286	H278-E282 PolarHBondContact O-N 3.34Å; K279-E282 PolarHBondContact O-N 3.11Å; E282-R284 VanDerWaalsContact C-N 3.25Å; E282-R284 PolarHBondContact O-N 3.19Å; E282-E285 PolarHBondContact O-N 3.3Å; E282-E285 VanDerWaalsContact O-N 3.1Å; E282-E286 WeakPolarHBondContact O-CG 3.47Å; E282-E286 PolarHBondContact O-N 3.46Å
283	W	91.8	Very high	90.5	Very high	59 Å²	59	74.3 Å²	74.3	22%	0.223	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-31.2	177.3	-69	-19.8	0	0	0	114	I131 K279 V280 G287 K288 A289	I131-W283 HydrophobicContact CD1-CZ3 4.25Å; K279-W283 HydrophobicContact CD-CH2 4.16Å; K279-W283 HydrophobicContact CD-CZ2 3.84Å; K279-W283 HydrophobicContact CG-CD2 4.28Å; K279-W283 HydrophobicContact CG-CH2 4.44Å; K279-W283 HydrophobicContact CG-CZ2 3.99Å; K279-W283 VanDerWaalsContact O-CG 3.3Å; K279-W283 PolarHBondContact O-N 3.2Å; V280-W283 HydrophobicContact CG2-CE3 4.22Å; V280-W283 HydrophobicContact CG2-CZ3 4.42Å; V280-W283 PolarHBondContact O-N 3.22Å; W283-G287 PolarHBondContact O-N 2.86Å; W283-K288 PolarHBondContact O-N 3.39Å; W283-A289 HydrophobicContact CB-CB 3.74Å; W283-A289 PolarHBondContact O-N 3.33Å; W283-A289 VanDerWaalsContact O-N 3.11Å
284	R	89.3	Confident	90.1	Very high	164 Å²	164	73.2 Å²	73.2	62%	0.619	37%	0.366	S	S	*	.	H	α-helix	trans	-69.8	-42.5	173.3	-178.7	-173.1	176.6	-171.7	-0.1	111.1	V280 A281 E282 G287 A289	V280-R284 WeakPolarHBondContact O-CB 3.44Å; V280-R284 PolarHBondContact O-N 3.4Å; A281-R284 WeakPolarHBondContact O-CB 3.48Å; A281-R284 PolarHBondContact O-N 3.41Å; E282-R284 VanDerWaalsContact C-N 3.25Å; E282-R284 PolarHBondContact O-N 3.19Å; R284-G287 PolarHBondContact O-N 2.99Å; R284-A289 WeakPolarHBondContact CA-O 3.4Å
285	E	91.6	Very high	89.9	Confident	173 Å²	173	69.1 Å²	69.1	81%	0.808	34%	0.344	S	S	*	.	H	α-helix	trans	-65.9	-38.1	176.9	-72.2	179.5	-176.7	0	0	112.2	A281 E282 G287	A281-E285 WeakPolarHBondContact O-CG 3.49Å; A281-E285 PolarHBondContact O-N 3.37Å; E282-E285 PolarHBondContact O-N 3.3Å; E282-E285 VanDerWaalsContact O-N 3.1Å; E285-G287 PolarHBondContact O-N 2.88Å
286	E	91.4	Very high	89.8	Confident	95 Å²	95	62.9 Å²	62.9	44%	0.444	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12	174.1	-67.6	-174.8	128.3	0	0	113.5	E282 K288	E282-E286 WeakPolarHBondContact O-CG 3.47Å; E282-E286 PolarHBondContact O-N 3.46Å; E286-K288 HydrophobicContact CB-CD 4.34Å; E286-K288 HydrophobicContact CB-CG 4.09Å; E286-K288 PolarHBondContact O-N 2.7Å; E286-K288 IonicContact OE1-NZ 3.25Å; E286-K288 PolarHBondContact OE1-NZ 3.08Å; E286-K288 VanDerWaalsContact OE2-CD 3.29Å; E286-K288 WeakPolarHBondContact OE2-CD 3.43Å; E286-K288 VanDerWaalsContact OE2-CE 3.25Å; E286-K288 WeakPolarHBondContact OE2-CE 3.48Å; E286-K288 IonicContact OE2-NZ 2.74Å; E286-K288 PolarHBondContact OE2-NZ 2.89Å
287	G	88	Confident	89.8	Confident	61 Å²	61	62.7 Å²	62.7	63%	0.629	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.7	-175.7	0	0	0	0	0	114.8	W283 R284 E285	W283-G287 PolarHBondContact O-N 2.86Å; R284-G287 PolarHBondContact O-N 2.99Å; E285-G287 PolarHBondContact O-N 2.88Å
288	K	87.9	Confident	89.9	Confident	109 Å²	109	60.2 Å²	60.2	47%	0.474	30%	0.301	S	S	.	.	S	Bend	trans	-78.3	-25.3	176.8	-65.4	-178.7	-168.9	150.5	0	112.6	K132 W283 E286	K132-K288 PolarHBondContact N-O 2.92Å; W283-K288 PolarHBondContact O-N 3.39Å; E286-K288 HydrophobicContact CB-CD 4.34Å; E286-K288 HydrophobicContact CB-CG 4.09Å; E286-K288 PolarHBondContact O-N 2.7Å; E286-K288 IonicContact OE1-NZ 3.25Å; E286-K288 PolarHBondContact OE1-NZ 3.08Å; E286-K288 VanDerWaalsContact OE2-CD 3.29Å; E286-K288 WeakPolarHBondContact OE2-CD 3.43Å; E286-K288 VanDerWaalsContact OE2-CE 3.25Å; E286-K288 WeakPolarHBondContact OE2-CE 3.48Å; E286-K288 IonicContact OE2-NZ 2.74Å; E286-K288 PolarHBondContact OE2-NZ 2.89Å
289	A	90.2	Very high	89.9	Confident	10 Å²	10	55.3 Å²	55.3	8%	0.083	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.5	179.8	0	0	0	0	0	112.7	V129 R130 I131 W283 R284	V129-A289 HydrophobicContact CG1-CB 3.74Å; R130-A289 CarbonylContact O-C 3.6Å; R130-A289 VanDerWaalsContact O-CA 3.28Å; R130-A289 WeakPolarHBondContact O-CA 3.45Å; I131-A289 HydrophobicContact CG1-CB 4.31Å; W283-A289 HydrophobicContact CB-CB 3.74Å; W283-A289 PolarHBondContact O-N 3.33Å; W283-A289 VanDerWaalsContact O-N 3.11Å; R284-A289 WeakPolarHBondContact CA-O 3.4Å
290	E	89	Confident	89.8	Confident	96 Å²	96	55.3 Å²	55.3	45%	0.449	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.5	173.6	-177.8	-176	-163.9	0	0	109.2	R130	R130-E290 HydrophobicContact CB-CB 4.35Å; R130-E290 IonicContact CZ-OE2 3.28Å; R130-E290 PolarHBondContact N-O 2.81Å; R130-E290 IonicContact NH1-OE2 2.81Å; R130-E290 PolarHBondContact NH1-OE2 2.82Å; R130-E290 PolarHBondContact O-N 2.77Å
291	I	87.6	Confident	89.9	Confident	36 Å²	36	55.3 Å²	55.3	19%	0.185	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.5	177.3	-56.7	171.4	0	0	0	108.1	I127 V280 M320	I127-I291 HydrophobicContact CG2-CG2 3.92Å; V280-I291 HydrophobicContact CG1-CD1 3.94Å; V280-I291 HydrophobicContact CG1-CG1 4.03Å; I291-M320 HydrophobicContact CD1-CE 3.65Å; I291-M320 HydrophobicContact CD1-SD 3.92Å; I291-M320 HydrophobicContact CG2-CE 4.36Å
292	V	84.3	Confident	89.9	Confident	16 Å²	16	54 Å²	54	10%	0.097	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.5	177.6	-177	0	0	0	0	108.2	T98 G128 R130 G294	T98-V292 HydrophobicContact CG2-CG1 4.5Å; G128-V292 PolarHBondContact N-O 3.39Å; G128-V292 PolarHBondContact O-N 3.16Å; R130-V292 HydrophobicContact CB-CG2 4.17Å; V292-G294 PolarHBondContact O-N 3Å
293	P	82.3	Confident	89.9	Confident	60 Å²	60	52 Å²	52	39%	0.39	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.5	175.2	28.5	-32.5	0	0	0	109.3	T98	T98-P293 WeakPolarHBondContact CG2-O 3.23Å
294	G	85.4	Confident	90	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.			trans	-98.6	-167.7	174.1	0	0	0	0	0	113.3	P99 S126 V292 V323	P99-G294 WeakPolarHBondContact O-CA 3.42Å; S126-G294 CarbonylContact O-C 3.58Å; S126-G294 WeakPolarHBondContact O-CA 3.37Å; S126-G294 PolarHBondContact O-N 2.8Å; V292-G294 PolarHBondContact O-N 3Å; G294-V323 PolarHBondContact O-N 2.93Å
295	V	87.2	Confident	90.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.3	-175.9	174.2	0	0	0	0	109.6	L94 P99 F100 T101 V323 I325	L94-V295 HydrophobicContact CD1-CG2 3.29Å; P99-V295 PolarHBondContact O-N 3.45Å; F100-V295 HydrophobicContact CD2-CB 3.98Å; F100-V295 HydrophobicContact CD2-CG1 3.88Å; F100-V295 HydrophobicContact CE2-CG1 3.99Å; T101-V295 PolarHBondContact N-O 3.31Å; V295-V323 WeakPolarHBondContact CA-O 3.34Å; V295-V323 HydrophobicContact CG2-CB 4.26Å; V295-I325 HydrophobicContact CG1-CD1 3.58Å; V295-I325 HydrophobicContact CG1-CG1 3.92Å
296	L	92.2	Very high	90.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	110.5	169.2	-178.4	58	0	0	0	108.9	T101 M103 A122 F123 S126 I298 P322 V323 L324 I325	T101-L296 HydrophobicContact CG2-CD1 3.96Å; M103-L296 HydrophobicContact CG-CD1 4.33Å; M103-L296 HydrophobicContact SD-CD1 3.81Å; M103-L296 HydrophobicContact SD-CG 4.49Å; A122-L296 HydrophobicContact CB-CD1 3.91Å; A122-L296 HydrophobicContact CB-CD2 4.3Å; F123-L296 HydrophobicContact CD2-CD2 3.44Å; F123-L296 VanDerWaalsContact CD2-CD2 3.44Å; F123-L296 HydrophobicContact CE2-CD2 3.47Å; F123-L296 VanDerWaalsContact CE2-CD2 3.47Å; F123-L296 HydrophobicContact CG-CD2 4.15Å; F123-L296 HydrophobicContact CZ-CD2 4.2Å; S126-L296 WeakPolarHBondContact OG-CB 3.36Å; L296-I298 HydrophobicContact CD2-CD1 4.4Å; L296-I298 HydrophobicContact CG-CG1 4.19Å; L296-P322 HydrophobicContact CB-CG 4.31Å; L296-V323 PolarHBondContact N-O 3.3Å; L296-L324 HydrophobicContact CB-CD1 4.29Å; L296-L324 HydrophobicContact CD2-CD1 4.03Å; L296-L324 HydrophobicContact CG-CD1 4.06Å; L296-I325 PolarHBondContact O-N 3.42Å
297	F	93.4	Very high	90.2	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.8	174.7	177	-111.4	0	0	0	110.9	T84 A87 F100 T101 A102 M103 D299 I325 A327	T84-F297 HydrophobicContact CG2-CE1 3.81Å; T84-F297 HydrophobicContact CG2-CZ 4.18Å; A87-F297 HydrophobicContact CB-CB 4.45Å; A87-F297 HydrophobicContact CB-CD1 4.46Å; A87-F297 HydrophobicContact CB-CD2 3.33Å; A87-F297 HydrophobicContact CB-CE2 3.55Å; A87-F297 HydrophobicContact CB-CG 3.83Å; A87-F297 HydrophobicContact CB-CZ 4.23Å; F100-F297 HydrophobicContact CE2-CB 3.6Å; F100-F297 HydrophobicContact CE2-CG 4.44Å; F100-F297 HydrophobicContact CZ-CB 3.7Å; F100-F297 HydrophobicContact CZ-CD1 4.31Å; F100-F297 HydrophobicContact CZ-CG 4.21Å; T101-F297 PolarHBondContact O-N 3.4Å; A102-F297 CarbonylContact C-O 3.5Å; A102-F297 WeakPolarHBondContact CA-O 3.11Å; A102-F297 HydrophobicContact CB-CD1 4.15Å; M103-F297 PolarHBondContact N-O 2.96Å; F297-D299 HydrophobicContact CE1-CB 3.65Å; F297-D299 HydrophobicContact CZ-CB 3.89Å; F297-I325 CarbonylContact C-O 3.51Å; F297-I325 VanDerWaalsContact CA-O 3.26Å; F297-I325 WeakPolarHBondContact CA-O 3.48Å; F297-I325 HydrophobicContact CD2-CB 4.05Å; F297-I325 HydrophobicContact CD2-CG2 3.82Å; F297-I325 WeakPolarHBondContact CD2-O 3.42Å; F297-I325 HydrophobicContact CE2-CG2 4.25Å; F297-A327 HydrophobicContact CE2-CB 3.74Å; F297-A327 HydrophobicContact CZ-CB 3.87Å
298	I	94.1	Very high	90.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	107.1	174.1	-49.2	-173.1	0	0	0	108.9	M103 L119 L296 V301 L324 I325 V326 A327	M103-I298 HydrophobicContact CG-CB 4.22Å; M103-I298 HydrophobicContact CG-CG1 3.76Å; M103-I298 HydrophobicContact CG-CG2 4.26Å; M103-I298 CarbonylContact O-C 3.55Å; M103-I298 VanDerWaalsContact O-CA 3.32Å; M103-I298 WeakPolarHBondContact O-CA 3.26Å; M103-I298 HydrophobicContact SD-CD1 3.98Å; M103-I298 HydrophobicContact SD-CG1 3.8Å; L119-I298 HydrophobicContact CD2-CD1 4.42Å; L296-I298 HydrophobicContact CD2-CD1 4.4Å; L296-I298 HydrophobicContact CG-CG1 4.19Å; I298-V301 HydrophobicContact CG2-CB 4.39Å; I298-V301 HydrophobicContact CG2-CG2 4.29Å; I298-L324 HydrophobicContact CD1-CD1 3.74Å; I298-L324 HydrophobicContact CG1-CD1 3.88Å; I298-I325 PolarHBondContact N-O 3.36Å; I298-V326 HydrophobicContact CB-CG1 4.09Å; I298-V326 HydrophobicContact CD1-CG1 4.43Å; I298-V326 HydrophobicContact CG1-CG1 4.44Å; I298-V326 CarbonylContact O-C 3.57Å; I298-V326 WeakPolarHBondContact O-CA 3.28Å; I298-A327 PolarHBondContact O-N 3.31Å
299	D	92.3	Very high	90.7	Very high	43 Å²	43	30.2 Å²	30.2	23%	0.23	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	153.3	172.2	-146	-16.9	0	0	0	110.9	T84 M103 G105 F297 V301	T84-D299 PolarHBondContact OG1-OD2 2.84Å; M103-D299 PolarHBondContact O-N 3.4Å; G105-D299 PolarHBondContact N-O 2.95Å; F297-D299 HydrophobicContact CE1-CB 3.65Å; F297-D299 HydrophobicContact CZ-CB 3.89Å; D299-V301 VanDerWaalsContact C-N 3.28Å; D299-V301 PolarHBondContact O-N 2.95Å
300	E	91.8	Very high	90.8	Very high	85 Å²	85	32.8 Å²	32.8	40%	0.397	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	45.1	179.9	-56.5	-169.3	159.6	0	0	114.1	H302 M303 A327	E300-H302 PolarHBondContact O-N 2.83Å; E300-M303 HydrophobicContact CB-CG 4.28Å; E300-M303 WeakPolarHBondContact O-CB 3.46Å; E300-M303 PolarHBondContact O-N 2.97Å; E300-A327 PolarHBondContact N-O 2.91Å
301	V	93.7	Very high	91	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-56.4	-24.4	-174.1	74.9	0	0	0	0	113.9	I298 D299 M303 L304 F309 V326 A327 I346	I298-V301 HydrophobicContact CG2-CB 4.39Å; I298-V301 HydrophobicContact CG2-CG2 4.29Å; D299-V301 VanDerWaalsContact C-N 3.28Å; D299-V301 PolarHBondContact O-N 2.95Å; V301-M303 PolarHBondContact O-N 2.89Å; V301-M303 VanDerWaalsContact O-N 3.08Å; V301-L304 HydrophobicContact CG2-CD1 3.68Å; V301-L304 HydrophobicContact CG2-CG 4.25Å; V301-L304 WeakPolarHBondContact O-CB 3.37Å; V301-L304 VanDerWaalsContact O-CG 3.29Å; V301-L304 WeakPolarHBondContact O-CG 3.12Å; V301-L304 PolarHBondContact O-N 2.83Å; V301-F309 HydrophobicContact CG2-CE1 3.87Å; V301-F309 HydrophobicContact CG2-CZ 4.37Å; V301-F309 WeakPolarHBondContact O-CZ 3.28Å; V301-V326 HydrophobicContact CB-CB 3.97Å; V301-V326 HydrophobicContact CB-CG1 4.25Å; V301-V326 HydrophobicContact CG1-CB 4.08Å; V301-V326 HydrophobicContact CG2-CB 3.9Å; V301-V326 HydrophobicContact CG2-CG1 3.69Å; V301-A327 WeakPolarHBondContact CG1-O 3.29Å; V301-A327 PolarHBondContact N-O 3.03Å; V301-I346 HydrophobicContact CG1-CD1 3.68Å; V301-I346 HydrophobicContact CG1-CG1 4.16Å
302	H	92.1	Very high	91.2	Very high	16 Å²	16	29.1 Å²	29.1	7%	0.074	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-62.5	-12.8	175.7	64.1	-88.3	0	0	0	113.9	E300 L304 N329 R330 H344	E300-H302 PolarHBondContact O-N 2.83Å; H302-L304 VanDerWaalsContact C-N 3.33Å; H302-N329 PolarHBondContact CE1-OD1 3.4Å; H302-R330 HydrophobicContact CB-CB 4.43Å; H302-R330 HydrophobicContact CB-CG 4.06Å; H302-R330 WeakPolarHBondContact CD2-CG 3.36Å; H302-R330 VanDerWaalsContact CG-CG 3.45Å; H302-R330 WeakPolarHBondContact NE2-CG 3.48Å; H302-R330 PolarHBondContact NE2-NE 2.87Å; H302-H344 WeakPolarHBondContact CB-O 3.07Å
303	M	92.2	Very high	91.5	Very high	65 Å²	65	28.9 Å²	28.9	32%	0.32	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-81.4	-10.5	174.8	-66.6	-59.8	-68.2	0	0	113.6	E300 V301 R336	E300-M303 HydrophobicContact CB-CG 4.28Å; E300-M303 WeakPolarHBondContact O-CB 3.46Å; E300-M303 PolarHBondContact O-N 2.97Å; V301-M303 PolarHBondContact O-N 2.89Å; V301-M303 VanDerWaalsContact O-N 3.08Å; M303-R336 WeakPolarHBondContact O-CD 3.43Å; M303-R336 PolarHBondContact O-NH1 3.28Å
304	L	93.3	Very high	91.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-71.1	151.6	173.7	-58.6	-174.1	0	0	0	111.5	G105 I108 V301 H302 C308 F309 L312 R336	G105-L304 VanDerWaalsContact O-CD2 3.3Å; G105-L304 WeakPolarHBondContact O-CD2 3.48Å; I108-L304 HydrophobicContact CD1-CD2 3.3Å; V301-L304 HydrophobicContact CG2-CD1 3.68Å; V301-L304 HydrophobicContact CG2-CG 4.25Å; V301-L304 WeakPolarHBondContact O-CB 3.37Å; V301-L304 VanDerWaalsContact O-CG 3.29Å; V301-L304 WeakPolarHBondContact O-CG 3.12Å; V301-L304 PolarHBondContact O-N 2.83Å; H302-L304 VanDerWaalsContact C-N 3.33Å; L304-C308 HydrophobicContact CB-CB 4.07Å; L304-C308 HydrophobicContact CD1-CB 4.39Å; L304-C308 HydrophobicContact CD2-CB 4.49Å; L304-F309 HydrophobicContact CB-CD2 4.44Å; L304-F309 HydrophobicContact CB-CE1 4.19Å; L304-F309 HydrophobicContact CB-CE2 3.92Å; L304-F309 HydrophobicContact CB-CZ 3.8Å; L304-F309 HydrophobicContact CD1-CD1 4.48Å; L304-F309 HydrophobicContact CD1-CE1 4.11Å; L304-L312 HydrophobicContact CD1-CD1 3.81Å; L304-R336 WeakPolarHBondContact O-CB 3.26Å
305	D	92.4	Very high	92.1	Very high	17 Å²	17	36.4 Å²	36.4	9%	0.091	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-89.4	170	171.6	63.1	25.3	0	0	0	112.4	K115 E307 C308 F309 R336	K115-D305 WeakPolarHBondContact CD-OD2 3.4Å; K115-D305 IonicContact NZ-OD2 2.64Å; K115-D305 PolarHBondContact NZ-OD2 3.32Å; D305-E307 PolarHBondContact O-N 3.46Å; D305-E307 PolarHBondContact OD1-N 3.35Å; D305-C308 WeakPolarHBondContact O-CB 3.29Å; D305-C308 PolarHBondContact O-N 2.7Å; D305-C308 WeakPolarHBondContact OD1-CB 3.42Å; D305-C308 PolarHBondContact OD1-N 3.37Å; D305-C308 PolarHBondContact OD1-SG 3.14Å; D305-F309 WeakPolarHBondContact O-CD2 3.47Å; D305-F309 PolarHBondContact O-N 3Å; D305-F309 VanDerWaalsContact O-N 3.15Å; D305-R336 WeakPolarHBondContact CA-O 3.42Å
306	I	91.9	Very high	92.1	Very high	67 Å²	67	37 Å²	37	34%	0.344	18%	0.179	S	C	.	.	H	α-helix	trans	-61.4	-28.7	179.9	-171.5	162	0	0	0	113.7	F309 S310 I335 R336 T338	I306-F309 PolarHBondContact O-N 3.3Å; I306-S310 WeakPolarHBondContact O-CB 3.37Å; I306-S310 PolarHBondContact O-N 2.89Å; I306-S310 PolarHBondContact O-OG 3.48Å; I306-I335 HydrophobicContact CB-CG2 4.46Å; I306-R336 PolarHBondContact N-O 2.99Å; I306-T338 HydrophobicContact CB-CG2 3.9Å; I306-T338 HydrophobicContact CD1-CG2 3.58Å; I306-T338 HydrophobicContact CG1-CG2 4.34Å; I306-T338 HydrophobicContact CG2-CG2 3.89Å
307	E	92	Very high	91.8	Very high	120 Å²	120	43 Å²	43	56%	0.561	21%	0.207	S	C	*	.	H	α-helix	trans	-68.5	-45	177.7	-65.2	175.4	176.9	0	0	110.7	K115 D305 F309 S310 F311	K115-E307 IonicContact NZ-OE2 2.7Å; K115-E307 PolarHBondContact NZ-OE2 3.06Å; D305-E307 PolarHBondContact O-N 3.46Å; D305-E307 PolarHBondContact OD1-N 3.35Å; E307-F309 PolarHBondContact O-N 3.2Å; E307-S310 PolarHBondContact O-N 3.39Å; E307-F311 PolarHBondContact O-N 2.9Å
308	C	93.7	Very high	91.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-45.3	172.5	-73.6	0	0	0	0	111.6	L119 L304 D305 S310 F311 L312	L119-C308 HydrophobicContact CD1-CB 3.81Å; L304-C308 HydrophobicContact CB-CB 4.07Å; L304-C308 HydrophobicContact CD1-CB 4.39Å; L304-C308 HydrophobicContact CD2-CB 4.49Å; D305-C308 WeakPolarHBondContact O-CB 3.29Å; D305-C308 PolarHBondContact O-N 2.7Å; D305-C308 WeakPolarHBondContact OD1-CB 3.42Å; D305-C308 PolarHBondContact OD1-N 3.37Å; D305-C308 PolarHBondContact OD1-SG 3.14Å; C308-S310 PolarHBondContact O-N 3.26Å; C308-F311 PolarHBondContact O-N 3.3Å; C308-L312 VanDerWaalsContact O-CG 3.29Å; C308-L312 WeakPolarHBondContact O-CG 3.43Å; C308-L312 PolarHBondContact O-N 3.27Å
309	F	93.5	Very high	90.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-40.8	178	-70.9	-57.3	0	0	0	112.8	V301 L304 D305 I306 E307 F311 L312 N313 I335 I346 P347 L350	V301-F309 HydrophobicContact CG2-CE1 3.87Å; V301-F309 HydrophobicContact CG2-CZ 4.37Å; V301-F309 WeakPolarHBondContact O-CZ 3.28Å; L304-F309 HydrophobicContact CB-CD2 4.44Å; L304-F309 HydrophobicContact CB-CE1 4.19Å; L304-F309 HydrophobicContact CB-CE2 3.92Å; L304-F309 HydrophobicContact CB-CZ 3.8Å; L304-F309 HydrophobicContact CD1-CD1 4.48Å; L304-F309 HydrophobicContact CD1-CE1 4.11Å; D305-F309 WeakPolarHBondContact O-CD2 3.47Å; D305-F309 PolarHBondContact O-N 3Å; D305-F309 VanDerWaalsContact O-N 3.15Å; I306-F309 PolarHBondContact O-N 3.3Å; E307-F309 PolarHBondContact O-N 3.2Å; F309-F311 VanDerWaalsContact C-N 3.32Å; F309-F311 PolarHBondContact O-N 2.81Å; F309-L312 HydrophobicContact CD1-CD1 4.27Å; F309-L312 PolarHBondContact O-N 3.48Å; F309-N313 PolarHBondContact O-N 2.85Å; F309-I335 HydrophobicContact CD2-CG2 4.17Å; F309-I335 HydrophobicContact CE2-CG2 4.07Å; F309-I346 HydrophobicContact CD1-CG2 4.32Å; F309-I346 HydrophobicContact CE1-CB 4.47Å; F309-I346 HydrophobicContact CE1-CG1 4.15Å; F309-I346 HydrophobicContact CE1-CG2 4.03Å; F309-I346 HydrophobicContact CZ-CB 4.47Å; F309-I346 HydrophobicContact CZ-CG1 4.09Å; F309-I346 HydrophobicContact CZ-CG2 4.47Å; F309-P347 HydrophobicContact CB-CG 3.66Å; F309-P347 VanDerWaalsContact CD2-CD 3.43Å; F309-P347 HydrophobicContact CD2-CG 3.95Å; F309-P347 HydrophobicContact CG-CG 3.86Å; F309-L350 HydrophobicContact CD1-CD2 3.48Å; F309-L350 VanDerWaalsContact CD1-CD2 3.48Å; F309-L350 HydrophobicContact CE1-CD2 4.05Å; F309-L350 HydrophobicContact CG-CD2 4.46Å
310	S	92.7	Very high	89.9	Confident	64 Å²	64	51.9 Å²	51.9	45%	0.448	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-39.7	176.4	-57	0	0	0	0	111.6	I306 E307 C308 R314	I306-S310 WeakPolarHBondContact O-CB 3.37Å; I306-S310 PolarHBondContact O-N 2.89Å; I306-S310 PolarHBondContact O-OG 3.48Å; E307-S310 PolarHBondContact O-N 3.39Å; C308-S310 PolarHBondContact O-N 3.26Å; S310-R314 PolarHBondContact O-N 3.44Å
311	F	92.5	Very high	89.6	Confident	54 Å²	54	48.2 Å²	48.2	24%	0.237	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-46	173.8	179.1	-94	0	0	0	112.1	T116 L119 T120 E307 C308 F309 N313 R314 A315	T116-F311 HydrophobicContact CG2-CB 4.31Å; T116-F311 HydrophobicContact CG2-CD2 3.91Å; T116-F311 HydrophobicContact CG2-CG 4.14Å; L119-F311 HydrophobicContact CB-CD1 3.86Å; L119-F311 HydrophobicContact CB-CE1 3.74Å; L119-F311 HydrophobicContact CD1-CD1 3.86Å; T120-F311 WeakPolarHBondContact OG1-CZ 3.24Å; E307-F311 PolarHBondContact O-N 2.9Å; C308-F311 PolarHBondContact O-N 3.3Å; F309-F311 VanDerWaalsContact C-N 3.32Å; F309-F311 PolarHBondContact O-N 2.81Å; F311-N313 VanDerWaalsContact C-N 3.29Å; F311-N313 PolarHBondContact O-N 3.05Å; F311-R314 PolarHBondContact O-N 3.39Å; F311-A315 HydrophobicContact CD1-CB 4.47Å; F311-A315 HydrophobicContact CE1-CB 4.07Å; F311-A315 HydrophobicContact CZ-CB 4.4Å; F311-A315 WeakPolarHBondContact O-CB 3.32Å; F311-A315 PolarHBondContact O-N 3.49Å
312	L	92.4	Very high	89.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-42.7	177.3	-73.4	174.3	0	0	0	111.7	L119 F123 L304 C308 F309 R314 A315 L316 L324 L350	L119-L312 HydrophobicContact CD1-CD2 4.47Å; L119-L312 HydrophobicContact CD1-CG 4.37Å; L119-L312 HydrophobicContact CD2-CD2 4.11Å; F123-L312 HydrophobicContact CE2-CD2 3.33Å; F123-L312 HydrophobicContact CZ-CD2 3.55Å; L304-L312 HydrophobicContact CD1-CD1 3.81Å; C308-L312 VanDerWaalsContact O-CG 3.29Å; C308-L312 WeakPolarHBondContact O-CG 3.43Å; C308-L312 PolarHBondContact O-N 3.27Å; F309-L312 HydrophobicContact CD1-CD1 4.27Å; F309-L312 PolarHBondContact O-N 3.48Å; L312-R314 VanDerWaalsContact C-N 3.33Å; L312-R314 PolarHBondContact O-N 3.29Å; L312-A315 PolarHBondContact O-N 3.49Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 VanDerWaalsContact O-CG 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.41Å; L312-L316 PolarHBondContact O-N 2.93Å; L312-L324 HydrophobicContact CD2-CD2 4.4Å; L312-L350 HydrophobicContact CD1-CD2 4.48Å
313	N	90.6	Very high	89.1	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.064	24%	0.24	C	C	.	.	H	α-helix	trans	-56.5	-47.2	177	-87.5	-29.3	0	0	0	112	F309 F311 D349 L350 R353	F309-N313 PolarHBondContact O-N 2.85Å; F311-N313 VanDerWaalsContact C-N 3.29Å; F311-N313 PolarHBondContact O-N 3.05Å; N313-D349 PolarHBondContact ND2-OD2 3.48Å; N313-L350 WeakPolarHBondContact OD1-CA 3.14Å; N313-L350 WeakPolarHBondContact OD1-CB 3.35Å; N313-L350 WeakPolarHBondContact OD1-CD1 3.26Å; N313-R353 PolarHBondContact O-NH1 3.26Å
314	R	90.4	Very high	89.1	Confident	197 Å²	197	44.6 Å²	44.6	74%	0.743	23%	0.225	S	C	*	.	H	α-helix	trans	-70	-40	177.8	-175	177.4	174.6	-177.9	-2.4	112.4	S310 F311 L312 L316 E317	S310-R314 PolarHBondContact O-N 3.44Å; F311-R314 PolarHBondContact O-N 3.39Å; L312-R314 VanDerWaalsContact C-N 3.33Å; L312-R314 PolarHBondContact O-N 3.29Å; R314-L316 VanDerWaalsContact C-N 3.3Å; R314-L316 PolarHBondContact O-N 2.6Å; R314-E317 WeakPolarHBondContact O-CB 3.4Å; R314-E317 PolarHBondContact O-N 3.48Å
315	A	89.3	Confident	89.1	Confident	20 Å²	20	44.6 Å²	44.6	17%	0.165	23%	0.225	C	C	.	.	H	α-helix	trans	-65.4	-34	-177.7	0	0	0	0	0	112.6	F123 F311 L312 E317 S318	F123-A315 HydrophobicContact CD1-CB 4.25Å; F123-A315 HydrophobicContact CE1-CB 3.88Å; F123-A315 HydrophobicContact CZ-CB 4.08Å; F311-A315 HydrophobicContact CD1-CB 4.47Å; F311-A315 HydrophobicContact CE1-CB 4.07Å; F311-A315 HydrophobicContact CZ-CB 4.4Å; F311-A315 WeakPolarHBondContact O-CB 3.32Å; F311-A315 PolarHBondContact O-N 3.49Å; L312-A315 PolarHBondContact O-N 3.49Å; A315-E317 PolarHBondContact O-N 3.31Å; A315-S318 PolarHBondContact O-N 3Å
316	L	88.3	Confident	89.2	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.063	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.1	176.9	-72.5	168.7	0	0	0	114.1	G70 A72 F123 L312 R314 S318 L324 L350	G70-L316 WeakPolarHBondContact CA-O 3.32Å; A72-L316 HydrophobicContact CB-CD1 3.78Å; A72-L316 HydrophobicContact CB-CD2 4.17Å; F123-L316 HydrophobicContact CE1-CD2 4.32Å; F123-L316 HydrophobicContact CZ-CD2 4.49Å; L312-L316 WeakPolarHBondContact O-CB 3.42Å; L312-L316 VanDerWaalsContact O-CG 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.41Å; L312-L316 PolarHBondContact O-N 2.93Å; R314-L316 VanDerWaalsContact C-N 3.3Å; R314-L316 PolarHBondContact O-N 2.6Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-L324 HydrophobicContact CD1-CD2 3.95Å; L316-L324 HydrophobicContact CD2-CB 3.83Å; L316-L324 HydrophobicContact CD2-CD2 4.01Å; L316-L324 HydrophobicContact CG-CD2 4.33Å; L316-L350 HydrophobicContact CD1-CD1 3.86Å
317	E	86.1	Confident	89.4	Confident	127 Å²	127	40.6 Å²	40.6	59%	0.593	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.5	177	-66.8	172.8	-174.8	0	0	112.8	R314 A315 R353	R314-E317 WeakPolarHBondContact O-CB 3.4Å; R314-E317 PolarHBondContact O-N 3.48Å; A315-E317 PolarHBondContact O-N 3.31Å; E317-R353 IonicContact OE1-CZ 3.26Å; E317-R353 VanDerWaalsContact OE1-CZ 3.25Å; E317-R353 IonicContact OE1-NH1 3.3Å; E317-R353 PolarHBondContact OE1-NH1 3.08Å; E317-R353 IonicContact OE1-NH2 3.76Å; E317-R353 PolarHBondContact OE1-NH2 2.74Å
318	S	84	Confident	89.5	Confident	51 Å²	51	35 Å²	35	36%	0.357	18%	0.178	S	C	.	.	S	Bend	trans	-69.7	136.2	175.6	-179.8	0	0	0	0	110.8	A315 L316 M320 A321	A315-S318 PolarHBondContact O-N 3Å; L316-S318 VanDerWaalsContact C-N 3.27Å; S318-M320 PolarHBondContact O-N 3.36Å; S318-M320 PolarHBondContact OG-N 3.4Å; S318-M320 VanDerWaalsContact OG-N 3.14Å; S318-A321 WeakPolarHBondContact O-CB 3.4Å; S318-A321 PolarHBondContact O-N 2.94Å
319	D	77.6	Confident	89.4	Confident	136 Å²	136	37.8 Å²	37.8	73%	0.727	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	-29.4	163.4	48	-16.4	0	0	0	114.1	A69	A69-D319 VanDerWaalsContact CB-O 3.24Å; A69-D319 WeakPolarHBondContact CB-O 3.48Å
320	M	78.4	Confident	89.2	Confident	46 Å²	46	43.8 Å²	43.8	23%	0.227	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	8.6	178.4	-63.9	-71.9	-87.1	0	0	113	I127 L244 I291 S318	I127-M320 WeakPolarHBondContact CD1-O 3.43Å; L244-M320 HydrophobicContact CD1-CE 4.1Å; I291-M320 HydrophobicContact CD1-CE 3.65Å; I291-M320 HydrophobicContact CD1-SD 3.92Å; I291-M320 HydrophobicContact CG2-CE 4.36Å; S318-M320 PolarHBondContact O-N 3.36Å; S318-M320 PolarHBondContact OG-N 3.4Å; S318-M320 VanDerWaalsContact OG-N 3.14Å
321	A	85	Confident	89.1	Confident	8 Å²	8	42.9 Å²	42.9	7%	0.066	22%	0.217	C	C	.	.			trans	-69.3	129.8	-177.8	0	0	0	0	0	112	G70 S318	G70-A321 PolarHBondContact N-O 3.12Å; S318-A321 WeakPolarHBondContact O-CB 3.4Å; S318-A321 PolarHBondContact O-N 2.94Å
322	P	88	Confident	89.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.			trans	-68	169.1	174.4	33.6	-36.2	0	0	0	110.4	F123 I127 L296 L324	F123-P322 VanDerWaalsContact CD1-CD 3.49Å; F123-P322 HydrophobicContact CD1-CG 3.88Å; F123-P322 HydrophobicContact CE1-CG 4.37Å; F123-P322 HydrophobicContact CG-CG 4.32Å; I127-P322 HydrophobicContact CG1-CB 4.27Å; L296-P322 HydrophobicContact CB-CG 4.31Å; P322-L324 PolarHBondContact O-N 3.4Å
323	V	87.6	Confident	89.1	Confident	6 Å²	6	48 Å²	48	4%	0.036	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	113.4	173.7	179.5	0	0	0	0	108.3	I63 I73 G294 V295 L296 I325	I63-V323 HydrophobicContact CD1-CB 4.17Å; I63-V323 HydrophobicContact CD1-CG1 3.74Å; I63-V323 HydrophobicContact CD1-CG2 3.54Å; I63-V323 HydrophobicContact CG1-CG2 3.6Å; I63-V323 HydrophobicContact CG2-CG2 4.06Å; I73-V323 HydrophobicContact CD1-CG1 4.25Å; G294-V323 PolarHBondContact O-N 2.93Å; V295-V323 WeakPolarHBondContact CA-O 3.34Å; V295-V323 HydrophobicContact CG2-CB 4.26Å; L296-V323 PolarHBondContact N-O 3.3Å; V323-I325 HydrophobicContact CG1-CG1 4.29Å
324	L	92.1	Very high	89.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.7	178.2	176.9	64.3	0	0	0	109.8	R71 A72 I73 L296 I298 L312 L316 P322 V326	R71-L324 PolarHBondContact O-N 2.89Å; R71-L324 VanDerWaalsContact O-N 3.13Å; A72-L324 CarbonylContact C-O 3.6Å; A72-L324 VanDerWaalsContact CA-O 3.23Å; A72-L324 WeakPolarHBondContact CA-O 3.45Å; A72-L324 HydrophobicContact CB-CB 3.97Å; A72-L324 HydrophobicContact CB-CD2 3.99Å; A72-L324 HydrophobicContact CB-CG 4.23Å; I73-L324 PolarHBondContact N-O 3.06Å; L296-L324 HydrophobicContact CB-CD1 4.29Å; L296-L324 HydrophobicContact CD2-CD1 4.03Å; L296-L324 HydrophobicContact CG-CD1 4.06Å; I298-L324 HydrophobicContact CD1-CD1 3.74Å; I298-L324 HydrophobicContact CG1-CD1 3.88Å; L312-L324 HydrophobicContact CD2-CD2 4.4Å; L316-L324 HydrophobicContact CD1-CD2 3.95Å; L316-L324 HydrophobicContact CD2-CB 3.83Å; L316-L324 HydrophobicContact CD2-CD2 4.01Å; L316-L324 HydrophobicContact CG-CD2 4.33Å; P322-L324 PolarHBondContact O-N 3.4Å; L324-V326 HydrophobicContact CD1-CG1 3.88Å; L324-V326 HydrophobicContact CD2-CG1 4.04Å; L324-V326 HydrophobicContact CG-CG1 3.88Å
325	I	92.9	Very high	89.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	112.6	170.8	-54	-176.8	0	0	0	107.6	I73 L75 A87 M90 V295 L296 F297 I298 V323	I73-I325 HydrophobicContact CB-CG1 4.45Å; I73-I325 HydrophobicContact CD1-CD1 4.39Å; I73-I325 HydrophobicContact CD1-CG1 4.1Å; I73-I325 WeakPolarHBondContact O-CA 3.49Å; L75-I325 HydrophobicContact CD1-CG2 3.56Å; L75-I325 HydrophobicContact CG-CG2 4.03Å; A87-I325 HydrophobicContact CB-CG2 4.23Å; M90-I325 HydrophobicContact CB-CD1 4.48Å; M90-I325 HydrophobicContact CE-CD1 3.83Å; M90-I325 HydrophobicContact SD-CD1 3.56Å; M90-I325 VanDerWaalsContact SD-CD1 3.56Å; V295-I325 HydrophobicContact CG1-CD1 3.58Å; V295-I325 HydrophobicContact CG1-CG1 3.92Å; L296-I325 PolarHBondContact O-N 3.42Å; F297-I325 CarbonylContact C-O 3.51Å; F297-I325 VanDerWaalsContact CA-O 3.26Å; F297-I325 WeakPolarHBondContact CA-O 3.48Å; F297-I325 HydrophobicContact CD2-CB 4.05Å; F297-I325 HydrophobicContact CD2-CG2 3.82Å; F297-I325 WeakPolarHBondContact CD2-O 3.42Å; F297-I325 HydrophobicContact CE2-CG2 4.25Å; I298-I325 PolarHBondContact N-O 3.36Å; V323-I325 HydrophobicContact CG1-CG1 4.29Å
326	V	94.5	Very high	89.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.4	175.9	-69.5	0	0	0	0	109.5	I73 L74 L75 I298 V301 L324 L354	I73-V326 VanDerWaalsContact O-CG2 3.29Å; I73-V326 WeakPolarHBondContact O-CG2 3.47Å; I73-V326 PolarHBondContact O-N 2.96Å; L74-V326 CarbonylContact C-O 3.58Å; L74-V326 WeakPolarHBondContact CA-O 3.27Å; L74-V326 HydrophobicContact CB-CG2 4.1Å; L74-V326 HydrophobicContact CD1-CB 4.36Å; L74-V326 HydrophobicContact CD1-CG2 3.62Å; L74-V326 HydrophobicContact CG-CG2 4.48Å; L75-V326 PolarHBondContact N-O 3Å; I298-V326 HydrophobicContact CB-CG1 4.09Å; I298-V326 HydrophobicContact CD1-CG1 4.43Å; I298-V326 HydrophobicContact CG1-CG1 4.44Å; I298-V326 CarbonylContact O-C 3.57Å; I298-V326 WeakPolarHBondContact O-CA 3.28Å; V301-V326 HydrophobicContact CB-CB 3.97Å; V301-V326 HydrophobicContact CB-CG1 4.25Å; V301-V326 HydrophobicContact CG1-CB 4.08Å; V301-V326 HydrophobicContact CG2-CB 3.9Å; V301-V326 HydrophobicContact CG2-CG1 3.69Å; L324-V326 HydrophobicContact CD1-CG1 3.88Å; L324-V326 HydrophobicContact CD2-CG1 4.04Å; L324-V326 HydrophobicContact CG-CG1 3.88Å; V326-L354 HydrophobicContact CG2-CD1 4.18Å; V326-L354 HydrophobicContact CG2-CD2 3.7Å
327	A	95	Very high	89.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.7	176.1	0	0	0	0	0	112	L75 K83 F297 I298 E300 V301	L75-A327 HydrophobicContact CB-CB 4.33Å; L75-A327 WeakPolarHBondContact O-CA 3.34Å; K83-A327 HydrophobicContact CB-CB 4.26Å; K83-A327 HydrophobicContact CD-CB 4.27Å; F297-A327 HydrophobicContact CE2-CB 3.74Å; F297-A327 HydrophobicContact CZ-CB 3.87Å; I298-A327 PolarHBondContact O-N 3.31Å; E300-A327 PolarHBondContact N-O 2.91Å; V301-A327 WeakPolarHBondContact CG1-O 3.29Å; V301-A327 PolarHBondContact N-O 3.03Å
328	T	94.3	Very high	89.9	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.5	175	-169.6	0	0	0	0	111.4	L74 L75 A76 G77 K83 R330 H344	L74-T328 HydrophobicContact CD1-CG2 3.8Å; L74-T328 HydrophobicContact CG-CG2 4.44Å; L75-T328 PolarHBondContact O-N 3.26Å; A76-T328 HydrophobicContact CB-CG2 4.24Å; G77-T328 PolarHBondContact N-O 3.06Å; K83-T328 WeakPolarHBondContact CD-O 3.2Å; K83-T328 VanDerWaalsContact CE-O 3.26Å; K83-T328 WeakPolarHBondContact CE-O 3.46Å; T328-R330 PolarHBondContact OG1-N 3.18Å; T328-H344 HydrophobicContact CG2-CB 3.77Å; T328-H344 PolarHBondContact OG1-O 2.87Å
329	N	91.8	Very high	90.2	Very high	60 Å²	60	50.6 Å²	50.6	32%	0.321	27%	0.271	S	S	.	.			trans	-112.2	3.5	170.2	62.3	-13.5	0	0	0	112.4	G77 H302	G77-N329 WeakPolarHBondContact O-CA 3.44Å; H302-N329 PolarHBondContact CE1-OD1 3.4Å
330	R	90.7	Very high	90.8	Very high	125 Å²	125	52.7 Å²	52.7	47%	0.472	27%	0.27	S	S	.	.			trans	-91.1	141.9	179.1	-61.9	-61.7	-173.2	163.5	-2.5	111	H302 T328 T333 H344	H302-R330 HydrophobicContact CB-CB 4.43Å; H302-R330 HydrophobicContact CB-CG 4.06Å; H302-R330 WeakPolarHBondContact CD2-CG 3.36Å; H302-R330 VanDerWaalsContact CG-CG 3.45Å; H302-R330 WeakPolarHBondContact NE2-CG 3.48Å; H302-R330 PolarHBondContact NE2-NE 2.87Å; T328-R330 PolarHBondContact OG1-N 3.18Å; R330-T333 HydrophobicContact CB-CG2 3.83Å; R330-T333 HydrophobicContact CG-CG2 4.14Å; R330-H344 PolarHBondContact O-ND1 2.8Å
331	G	90.4	Very high	91.4	Very high	46 Å²	46	57.5 Å²	57.5	47%	0.474	29%	0.292	S	S	.	.	S	Bend	trans	-83.4	-125.7	167.4	0	0	0	0	0	110.3	T333 H344	G331-T333 PolarHBondContact O-N 2.91Å; G331-H344 WeakPolarHBondContact O-CA 3.29Å; G331-H344 PolarHBondContact O-N 3.44Å
332	I	92.5	Very high	91.8	Very high	125 Å²	125	57.5 Å²	57.5	64%	0.641	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.2	174.5	-60.1	173	0	0	0	108.9	Q341	I332-Q341 HydrophobicContact CG2-CB 4.06Å
333	T	92.5	Very high	92	Very high	35 Å²	35	60.7 Å²	60.7	22%	0.215	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.8	179.8	49.5	0	0	0	0	111.7	R330 G331 S342 G345	R330-T333 HydrophobicContact CB-CG2 3.83Å; R330-T333 HydrophobicContact CG-CG2 4.14Å; G331-T333 PolarHBondContact O-N 2.91Å; T333-S342 PolarHBondContact N-O 2.97Å; T333-S342 PolarHBondContact O-N 3.18Å; T333-S342 VanDerWaalsContact O-O 3.08Å; T333-G345 WeakPolarHBondContact OG1-CA 3.45Å; T333-G345 PolarHBondContact OG1-N 3.24Å
334	R	93.7	Very high	92.3	Very high	140 Å²	140	62.4 Å²	62.4	53%	0.528	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.8	175.1	-179.4	178.2	160.1	157	11.6	110.5	T338 N339 Y340	R334-T338 WeakPolarHBondContact CG-O 3.43Å; R334-T338 PolarHBondContact NE-O 3.3Å; R334-T338 PolarHBondContact NH2-O 3.05Å; R334-N339 PolarHBondContact NH1-OD1 2.98Å; R334-N339 PolarHBondContact NH2-OD1 2.85Å; R334-Y340 WeakPolarHBondContact CA-O 3.37Å
335	I	93.1	Very high	92.3	Very high	10 Å²	10	62.4 Å²	62.4	5%	0.051	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-72.3	129.3	173.2	-53.4	169.4	0	0	0	108	I306 F309 G337 T338 Y340 S342 P347	I306-I335 HydrophobicContact CB-CG2 4.46Å; F309-I335 HydrophobicContact CD2-CG2 4.17Å; F309-I335 HydrophobicContact CE2-CG2 4.07Å; I335-G337 PolarHBondContact O-N 3.03Å; I335-T338 PolarHBondContact O-N 3.21Å; I335-T338 VanDerWaalsContact O-O 3.12Å; I335-T338 PolarHBondContact O-OG1 3.03Å; I335-T338 VanDerWaalsContact O-OG1 3.14Å; I335-Y340 PolarHBondContact N-O 3.49Å; I335-Y340 VanDerWaalsContact N-O 3.08Å; I335-S342 WeakPolarHBondContact CD1-OG 3.45Å; I335-S342 WeakPolarHBondContact CG1-OG 3.48Å; I335-P347 HydrophobicContact CD1-CB 3.78Å; I335-P347 HydrophobicContact CD1-CG 4.38Å
336	R	90.6	Very high	92.3	Very high	109 Å²	109	62.4 Å²	62.4	41%	0.411	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-58.5	133.2	179.7	-167.2	179.7	179.1	179.3	-3.5	110.4	M303 L304 D305 I306	M303-R336 WeakPolarHBondContact O-CD 3.43Å; M303-R336 PolarHBondContact O-NH1 3.28Å; L304-R336 WeakPolarHBondContact O-CB 3.26Å; D305-R336 WeakPolarHBondContact CA-O 3.42Å; I306-R336 PolarHBondContact N-O 2.99Å
337	G	89.9	Confident	92.2	Very high	69 Å²	69	63 Å²	63	71%	0.711	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-8.4	-175.7	0	0	0	0	0	115.4	I335	I335-G337 PolarHBondContact O-N 3.03Å
338	T	92.4	Very high	92.1	Very high	19 Å²	19	69 Å²	69	12%	0.117	35%	0.354	C	S	.	.	S	Bend	trans	-125.3	166.5	176.9	79.1	0	0	0	0	111	I306 R334 I335 Y340	I306-T338 HydrophobicContact CB-CG2 3.9Å; I306-T338 HydrophobicContact CD1-CG2 3.58Å; I306-T338 HydrophobicContact CG1-CG2 4.34Å; I306-T338 HydrophobicContact CG2-CG2 3.89Å; R334-T338 WeakPolarHBondContact CG-O 3.43Å; R334-T338 PolarHBondContact NE-O 3.3Å; R334-T338 PolarHBondContact NH2-O 3.05Å; I335-T338 PolarHBondContact O-N 3.21Å; I335-T338 VanDerWaalsContact O-O 3.12Å; I335-T338 PolarHBondContact O-OG1 3.03Å; I335-T338 VanDerWaalsContact O-OG1 3.14Å; T338-Y340 PolarHBondContact OG1-N 3.14Å
339	N	91.1	Very high	91.9	Very high	127 Å²	127	72.9 Å²	72.9	68%	0.679	38%	0.375	S	S	*	.	S	Bend	trans	-90.9	-2.2	172.2	-69.6	-28.8	0	0	0	113.4	R334	R334-N339 PolarHBondContact NH1-OD1 2.98Å; R334-N339 PolarHBondContact NH2-OD1 2.85Å
340	Y	89.7	Confident	91.8	Very high	180 Å²	180	70 Å²	70	71%	0.706	36%	0.359	S	S	*	.			trans	-87.3	138.5	-172	-58.6	-75.5	0	0	0	111.4	R334 I335 T338	R334-Y340 WeakPolarHBondContact CA-O 3.37Å; I335-Y340 PolarHBondContact N-O 3.49Å; I335-Y340 VanDerWaalsContact N-O 3.08Å; T338-Y340 PolarHBondContact OG1-N 3.14Å
341	Q	92.3	Very high	91.8	Very high	148 Å²	148	65.1 Å²	65.1	69%	0.692	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	140.5	170.8	-65.7	-174.5	-1.2	0	0	110	I332	I332-Q341 HydrophobicContact CG2-CB 4.06Å
342	S	92.8	Very high	91.8	Very high	8 Å²	8	69.8 Å²	69.8	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.6	176.5	59.7	0	0	0	0	110.1	T333 I335 H344 G345 I346	T333-S342 PolarHBondContact N-O 2.97Å; T333-S342 PolarHBondContact O-N 3.18Å; T333-S342 VanDerWaalsContact O-O 3.08Å; I335-S342 WeakPolarHBondContact CD1-OG 3.45Å; I335-S342 WeakPolarHBondContact CG1-OG 3.48Å; S342-H344 PolarHBondContact O-N 3.34Å; S342-G345 PolarHBondContact O-N 3.14Å; S342-G345 WeakPolarHBondContact OG-CA 3.25Å; S342-I346 VanDerWaalsContact CB-O 3.25Å; S342-I346 WeakPolarHBondContact CB-O 3.38Å; S342-I346 PolarHBondContact OG-N 3.47Å; S342-I346 PolarHBondContact OG-O 3.45Å; S342-I346 VanDerWaalsContact OG-O 3.14Å
343	P	93.1	Very high	91.6	Very high	66 Å²	66	69 Å²	69	43%	0.429	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	135.4	167	-21.6	33.5	0	0	0	110.2	G345 I346 L351	P343-G345 PolarHBondContact O-N 2.97Å; P343-I346 PolarHBondContact O-N 3.31Å; P343-L351 HydrophobicContact CB-CD1 4.11Å; P343-L351 HydrophobicContact CG-CD1 4.48Å
344	H	93.2	Very high	91.5	Very high	42 Å²	42	68 Å²	68	19%	0.194	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	1.3	178.8	-57.4	-50.5	0	0	0	116.9	L74 H302 T328 R330 G331 S342 I346	L74-H344 HydrophobicContact CD2-CB 4.46Å; H302-H344 WeakPolarHBondContact CB-O 3.07Å; T328-H344 HydrophobicContact CG2-CB 3.77Å; T328-H344 PolarHBondContact OG1-O 2.87Å; R330-H344 PolarHBondContact O-ND1 2.8Å; G331-H344 WeakPolarHBondContact O-CA 3.29Å; G331-H344 PolarHBondContact O-N 3.44Å; S342-H344 PolarHBondContact O-N 3.34Å; H344-I346 VanDerWaalsContact C-N 3.27Å; H344-I346 HydrophobicContact CB-CD1 4.18Å; H344-I346 HydrophobicContact CB-CG1 4.2Å
345	G	91.1	Very high	91.4	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	21.4	-171.2	0	0	0	0	0	113.4	T333 S342 P343	T333-G345 WeakPolarHBondContact OG1-CA 3.45Å; T333-G345 PolarHBondContact OG1-N 3.24Å; S342-G345 PolarHBondContact O-N 3.14Å; S342-G345 WeakPolarHBondContact OG-CA 3.25Å; P343-G345 PolarHBondContact O-N 2.97Å
346	I	93.4	Very high	91.4	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.354	C	S	.	.			trans	-115.4	134.6	-178.9	-55.9	176.3	0	0	0	108.4	L74 V301 F309 S342 P343 H344 L350 L351 L354	L74-I346 HydrophobicContact CD1-CD1 3.82Å; L74-I346 HydrophobicContact CD2-CD1 4.1Å; V301-I346 HydrophobicContact CG1-CD1 3.68Å; V301-I346 HydrophobicContact CG1-CG1 4.16Å; F309-I346 HydrophobicContact CD1-CG2 4.32Å; F309-I346 HydrophobicContact CE1-CB 4.47Å; F309-I346 HydrophobicContact CE1-CG1 4.15Å; F309-I346 HydrophobicContact CE1-CG2 4.03Å; F309-I346 HydrophobicContact CZ-CB 4.47Å; F309-I346 HydrophobicContact CZ-CG1 4.09Å; F309-I346 HydrophobicContact CZ-CG2 4.47Å; S342-I346 VanDerWaalsContact CB-O 3.25Å; S342-I346 WeakPolarHBondContact CB-O 3.38Å; S342-I346 PolarHBondContact OG-N 3.47Å; S342-I346 PolarHBondContact OG-O 3.45Å; S342-I346 VanDerWaalsContact OG-O 3.14Å; P343-I346 PolarHBondContact O-N 3.31Å; H344-I346 VanDerWaalsContact C-N 3.27Å; H344-I346 HydrophobicContact CB-CD1 4.18Å; H344-I346 HydrophobicContact CB-CG1 4.2Å; I346-L350 HydrophobicContact CG2-CB 3.96Å; I346-L350 HydrophobicContact CG2-CD2 3.9Å; I346-L350 HydrophobicContact CG2-CG 4.11Å; I346-L351 HydrophobicContact CB-CD1 4.34Å; I346-L351 HydrophobicContact CB-CD2 3.86Å; I346-L351 HydrophobicContact CB-CG 3.85Å; I346-L351 HydrophobicContact CD1-CD2 4.05Å; I346-L351 HydrophobicContact CG1-CD2 4.49Å; I346-L351 HydrophobicContact CG2-CD2 4.02Å; I346-L351 HydrophobicContact CG2-CG 3.84Å; I346-L351 WeakPolarHBondContact O-CD1 3.36Å; I346-L354 HydrophobicContact CD1-CD1 4.31Å; I346-L354 HydrophobicContact CG2-CD1 4.44Å
347	P	93.3	Very high	91.6	Very high	14 Å²	14	64.5 Å²	64.5	9%	0.091	34%	0.337	C	S	.	.			trans	-63.1	148.9	175.8	25.8	-31.4	0	0	0	111.9	F309 I335 D349 L350 L351	F309-P347 HydrophobicContact CB-CG 3.66Å; F309-P347 VanDerWaalsContact CD2-CD 3.43Å; F309-P347 HydrophobicContact CD2-CG 3.95Å; F309-P347 HydrophobicContact CG-CG 3.86Å; I335-P347 HydrophobicContact CD1-CB 3.78Å; I335-P347 HydrophobicContact CD1-CG 4.38Å; P347-D349 VanDerWaalsContact C-OD1 3.25Å; P347-D349 WeakPolarHBondContact CB-OD1 3.12Å; P347-D349 WeakPolarHBondContact CG-OD1 3.39Å; P347-D349 PolarHBondContact O-N 3.15Å; P347-L350 PolarHBondContact O-N 2.97Å; P347-L351 PolarHBondContact O-N 2.87Å; P347-L351 VanDerWaalsContact O-N 3.11Å
348	I	91.4	Very high	91.8	Very high	126 Å²	126	64.9 Å²	64.9	65%	0.646	33%	0.329	S	S	*	.	H	α-helix	trans	-63.5	-30.4	-167.7	-60.3	168.3	0	0	0	111.7	L351 D352	I348-L351 PolarHBondContact O-N 3.28Å; I348-D352 WeakPolarHBondContact O-CB 3.45Å; I348-D352 PolarHBondContact O-N 3.24Å
349	D	90.3	Very high	91.9	Very high	81 Å²	81	64.1 Å²	64.1	43%	0.433	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-43.9	176.6	59.4	-18.4	0	0	0	113.1	N313 P347	N313-D349 PolarHBondContact ND2-OD2 3.48Å; P347-D349 VanDerWaalsContact C-OD1 3.25Å; P347-D349 WeakPolarHBondContact CB-OD1 3.12Å; P347-D349 WeakPolarHBondContact CG-OD1 3.39Å; P347-D349 PolarHBondContact O-N 3.15Å
350	L	90.6	Very high	92	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-76.8	-37.6	174.7	-178.2	62.5	0	0	0	111	F309 L312 N313 L316 I346 P347 D352 R353 L354	F309-L350 HydrophobicContact CD1-CD2 3.48Å; F309-L350 VanDerWaalsContact CD1-CD2 3.48Å; F309-L350 HydrophobicContact CE1-CD2 4.05Å; F309-L350 HydrophobicContact CG-CD2 4.46Å; L312-L350 HydrophobicContact CD1-CD2 4.48Å; N313-L350 WeakPolarHBondContact OD1-CA 3.14Å; N313-L350 WeakPolarHBondContact OD1-CB 3.35Å; N313-L350 WeakPolarHBondContact OD1-CD1 3.26Å; L316-L350 HydrophobicContact CD1-CD1 3.86Å; I346-L350 HydrophobicContact CG2-CB 3.96Å; I346-L350 HydrophobicContact CG2-CD2 3.9Å; I346-L350 HydrophobicContact CG2-CG 4.11Å; P347-L350 PolarHBondContact O-N 2.97Å; L350-D352 VanDerWaalsContact C-N 3.29Å; L350-D352 PolarHBondContact O-N 2.96Å; L350-R353 PolarHBondContact O-N 3.02Å; L350-R353 VanDerWaalsContact O-N 3.09Å; L350-L354 HydrophobicContact CD1-CD1 4.47Å; L350-L354 HydrophobicContact CD1-CG 4.41Å; L350-L354 HydrophobicContact CD2-CD1 4.39Å; L350-L354 HydrophobicContact CG-CD1 3.81Å; L350-L354 HydrophobicContact CG-CG 4.25Å; L350-L354 WeakPolarHBondContact O-CD1 3.47Å; L350-L354 VanDerWaalsContact O-CG 3.23Å; L350-L354 WeakPolarHBondContact O-CG 3.39Å; L350-L354 PolarHBondContact O-N 3.28Å
351	L	91.1	Very high	92.1	Very high	22 Å²	22	57.5 Å²	57.5	12%	0.115	31%	0.308	C	S	.	.	H	α-helix	trans	-58.2	-39.3	176.7	-76.1	176.6	0	0	0	112.8	L74 P343 I346 P347 I348 R353 L354	L74-L351 HydrophobicContact CD2-CD2 3.8Å; P343-L351 HydrophobicContact CB-CD1 4.11Å; P343-L351 HydrophobicContact CG-CD1 4.48Å; I346-L351 HydrophobicContact CB-CD1 4.34Å; I346-L351 HydrophobicContact CB-CD2 3.86Å; I346-L351 HydrophobicContact CB-CG 3.85Å; I346-L351 HydrophobicContact CD1-CD2 4.05Å; I346-L351 HydrophobicContact CG1-CD2 4.49Å; I346-L351 HydrophobicContact CG2-CD2 4.02Å; I346-L351 HydrophobicContact CG2-CG 3.84Å; I346-L351 WeakPolarHBondContact O-CD1 3.36Å; P347-L351 PolarHBondContact O-N 2.87Å; P347-L351 VanDerWaalsContact O-N 3.11Å; I348-L351 PolarHBondContact O-N 3.28Å; L351-R353 PolarHBondContact O-N 3.47Å; L351-L354 HydrophobicContact CD2-CD1 4.23Å; L351-L354 PolarHBondContact O-N 3.39Å; L351-L354 VanDerWaalsContact O-N 3.16Å
352	D	89.3	Confident	92.2	Very high	145 Å²	145	52.4 Å²	52.4	78%	0.775	28%	0.283	S	S	*	.	H	α-helix	trans	-66.7	-24.6	178.6	-164.5	47	0	0	0	112.7	I348 L350	I348-D352 WeakPolarHBondContact O-CB 3.45Å; I348-D352 PolarHBondContact O-N 3.24Å; L350-D352 VanDerWaalsContact C-N 3.29Å; L350-D352 PolarHBondContact O-N 2.96Å
353	R	88.3	Confident	92.2	Very high	109 Å²	109	55.8 Å²	55.8	41%	0.411	30%	0.303	S	S	.	.	H	α-helix	trans	-85.4	-17.2	175.4	-65.3	-179.7	176.5	-158.2	-3.5	113.4	N313 E317 L350 L351	N313-R353 PolarHBondContact O-NH1 3.26Å; E317-R353 IonicContact OE1-CZ 3.26Å; E317-R353 VanDerWaalsContact OE1-CZ 3.25Å; E317-R353 IonicContact OE1-NH1 3.3Å; E317-R353 PolarHBondContact OE1-NH1 3.08Å; E317-R353 IonicContact OE1-NH2 3.76Å; E317-R353 PolarHBondContact OE1-NH2 2.74Å; L350-R353 PolarHBondContact O-N 3.02Å; L350-R353 VanDerWaalsContact O-N 3.09Å; L351-R353 PolarHBondContact O-N 3.47Å
354	L	90.8	Very high	92.2	Very high	12 Å²	12	56 Å²	56	6%	0.063	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.3	-173.8	-73.7	164.3	0	0	0	111.9	A72 L74 V326 I346 L350 L351	A72-L354 HydrophobicContact CB-CD2 3.26Å; A72-L354 HydrophobicContact CB-CG 4.26Å; A72-L354 WeakPolarHBondContact O-CA 3.24Å; L74-L354 HydrophobicContact CB-CB 4.2Å; L74-L354 HydrophobicContact CB-CD1 4.25Å; L74-L354 HydrophobicContact CB-CD2 4.35Å; V326-L354 HydrophobicContact CG2-CD1 4.18Å; V326-L354 HydrophobicContact CG2-CD2 3.7Å; I346-L354 HydrophobicContact CD1-CD1 4.31Å; I346-L354 HydrophobicContact CG2-CD1 4.44Å; L350-L354 HydrophobicContact CD1-CD1 4.47Å; L350-L354 HydrophobicContact CD1-CG 4.41Å; L350-L354 HydrophobicContact CD2-CD1 4.39Å; L350-L354 HydrophobicContact CG-CD1 3.81Å; L350-L354 HydrophobicContact CG-CG 4.25Å; L350-L354 WeakPolarHBondContact O-CD1 3.47Å; L350-L354 VanDerWaalsContact O-CG 3.23Å; L350-L354 WeakPolarHBondContact O-CG 3.39Å; L350-L354 PolarHBondContact O-N 3.28Å; L351-L354 HydrophobicContact CD2-CD1 4.23Å; L351-L354 PolarHBondContact O-N 3.39Å; L351-L354 VanDerWaalsContact O-N 3.16Å
355	L	91.2	Very high	92.3	Very high	83 Å²	83	62.1 Å²	62.1	44%	0.435	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114	164.5	-65.2	178.9	0	0	0	109.7	I59 A72 I73 L74	I59-L355 HydrophobicContact CD1-CD1 4.32Å; A72-L355 PolarHBondContact O-N 2.94Å; I73-L355 CarbonylContact C-O 3.58Å; I73-L355 WeakPolarHBondContact CA-O 3.48Å; L74-L355 PolarHBondContact N-O 2.97Å
356	I	93.1	Very high	92.4	Very high	92 Å²	92	64 Å²	64	47%	0.472	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	119.1	-177.6	-49.1	-176.9	0	0	0	110.3	L74 A76	L74-I356 HydrophobicContact CB-CG1 4.24Å; L74-I356 HydrophobicContact CD2-CD1 4.15Å; L74-I356 HydrophobicContact CD2-CG1 4.03Å; L74-I356 HydrophobicContact CD2-CG2 4.28Å; L74-I356 HydrophobicContact CG-CG2 4.46Å; L74-I356 CarbonylContact O-C 3.51Å; L74-I356 WeakPolarHBondContact O-CA 3.29Å; A76-I356 HydrophobicContact CB-CG2 3.97Å
357	I	94.4	Very high	92.4	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.062	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.7	170.7	-60.7	177.6	0	0	0	107.9	A52 A55 I59 I73 L74 L75 A76	A52-I357 HydrophobicContact CB-CG2 3.52Å; A55-I357 HydrophobicContact CB-CD1 3.78Å; A55-I357 HydrophobicContact CB-CG1 3.97Å; A55-I357 HydrophobicContact CB-CG2 4.3Å; I59-I357 HydrophobicContact CD1-CD1 3.91Å; I73-I357 HydrophobicContact CG2-CD1 3.63Å; I73-I357 HydrophobicContact CG2-CG1 4.03Å; L74-I357 PolarHBondContact O-N 3.05Å; L75-I357 HydrophobicContact CD2-CB 3.95Å; L75-I357 HydrophobicContact CD2-CD1 4.39Å; L75-I357 HydrophobicContact CD2-CG2 4.01Å; A76-I357 PolarHBondContact N-O 3.08Å
358	S	94.6	Very high	92.5	Very high	76 Å²	76	66.6 Å²	66.6	53%	0.531	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.6	174.9	59.8	0	0	0	0	111.5	A76	A76-S358 CarbonylContact O-C 3.6Å; A76-S358 VanDerWaalsContact O-CA 3.28Å; A76-S358 WeakPolarHBondContact O-CA 3.3Å
359	T	94	Very high	92.6	Very high	4 Å²	4	61.5 Å²	61.5	3%	0.025	32%	0.323	C	S	.	.			trans	-106.5	130.4	171.2	58.4	0	0	0	0	110.4	Q49 A52 A76 G77 T81 K83 I86	Q49-T359 VanDerWaalsContact NE2-CB 3.25Å; A52-T359 HydrophobicContact CB-CG2 4.33Å; A76-T359 PolarHBondContact O-N 3Å; A76-T359 PolarHBondContact O-OG1 3.37Å; G77-T359 WeakPolarHBondContact CA-OG1 2.95Å; T81-T359 WeakPolarHBondContact CB-OG1 3.47Å; T81-T359 WeakPolarHBondContact OG1-CB 3.33Å; T81-T359 PolarHBondContact OG1-OG1 3.24Å; K83-T359 HydrophobicContact CG-CG2 4.01Å; I86-T359 HydrophobicContact CD1-CG2 3.79Å
360	D	93.2	Very high	92.8	Very high	82 Å²	82	58.4 Å²	58.4	44%	0.439	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-89.1	159	176.9	-60.2	-40.7	0	0	0	111.6	Q49 T81	Q49-D360 PolarHBondContact NE2-O 3.37Å; T81-D360 WeakPolarHBondContact CG2-O 3.26Å
361	S	92.6	Very high	92.9	Very high	86 Å²	86	58.4 Å²	58.4	60%	0.601	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-68.2	141.6	171.4	-63.8	0	0	0	0	111
362	Y	93.7	Very high	93.1	Very high	41 Å²	41	62.1 Å²	62.1	16%	0.161	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-70	144.6	179.9	-65.9	-67.8	0	0	0	112.6	Q49 G80 T81 E366 I370 L399	Q49-Y362 HydrophobicContact CB-CE1 4.49Å; G80-Y362 WeakPolarHBondContact O-CE2 3.44Å; T81-Y362 PolarHBondContact O-OH 2.84Å; Y362-E366 WeakPolarHBondContact CA-OE2 3.28Å; Y362-E366 HydrophobicContact CD1-CB 4.02Å; Y362-I370 HydrophobicContact CD1-CD1 3.9Å; Y362-I370 HydrophobicContact CD2-CD1 4.04Å; Y362-I370 HydrophobicContact CE1-CD1 3.88Å; Y362-I370 HydrophobicContact CE2-CD1 4.03Å; Y362-I370 HydrophobicContact CG-CD1 3.98Å; Y362-L399 HydrophobicContact CD2-CD2 4.08Å; Y362-L399 HydrophobicContact CE2-CD2 4.08Å
363	T	93.8	Very high	93.3	Very high	78 Å²	78	56.4 Å²	56.4	48%	0.479	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-79.1	161.5	170.4	61.9	0	0	0	0	111.6	K365 E366 I367	T363-K365 VanDerWaalsContact C-N 3.27Å; T363-K365 PolarHBondContact O-N 2.7Å; T363-E366 PolarHBondContact N-OE2 2.99Å; T363-E366 PolarHBondContact O-N 3.37Å; T363-E366 VanDerWaalsContact OG1-CD 3.28Å; T363-E366 VanDerWaalsContact OG1-CG 3.28Å; T363-E366 WeakPolarHBondContact OG1-CG 3.47Å; T363-E366 PolarHBondContact OG1-N 3.36Å; T363-E366 PolarHBondContact OG1-OE2 2.96Å; T363-I367 WeakPolarHBondContact O-CG1 3.48Å; T363-I367 PolarHBondContact O-N 3.01Å
364	D	93.3	Very high	93.5	Very high	71 Å²	71	51.9 Å²	51.9	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-51	-45.4	177.2	-179.5	82.8	0	0	0	112.6	E366 I367 Q368 T391 M395	D364-E366 PolarHBondContact O-N 3.25Å; D364-I367 PolarHBondContact O-N 2.97Å; D364-Q368 PolarHBondContact O-N 3.49Å; D364-T391 WeakPolarHBondContact O-CG2 3.42Å; D364-T391 WeakPolarHBondContact OD1-CG2 3.48Å; D364-M395 HydrophobicContact CB-SD 3.61Å
365	K	93.8	Very high	93.6	Very high	171 Å²	171	51.6 Å²	51.6	74%	0.743	27%	0.273	S	S	*	.	H	α-helix	trans	-63.1	-39.9	178	-65.1	-176	178.7	-178.6	0	112.7	T363 A369	T363-K365 VanDerWaalsContact C-N 3.27Å; T363-K365 PolarHBondContact O-N 2.7Å; K365-A369 WeakPolarHBondContact O-CB 3.3Å; K365-A369 PolarHBondContact O-N 2.78Å; K365-A369 VanDerWaalsContact O-N 3.12Å
366	E	93.9	Very high	93.6	Very high	38 Å²	38	53.4 Å²	53.4	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-70.2	-41.5	177.4	-70.5	166.6	144.9	0	0	111	V47 G48 Y362 T363 D364 Q368 A369 I370	V47-E366 HydrophobicContact CG1-CB 4.16Å; V47-E366 HydrophobicContact CG1-CG 4.3Å; G48-E366 WeakPolarHBondContact CA-OE1 3.49Å; Y362-E366 WeakPolarHBondContact CA-OE2 3.28Å; Y362-E366 HydrophobicContact CD1-CB 4.02Å; T363-E366 PolarHBondContact N-OE2 2.99Å; T363-E366 PolarHBondContact O-N 3.37Å; T363-E366 VanDerWaalsContact OG1-CD 3.28Å; T363-E366 VanDerWaalsContact OG1-CG 3.28Å; T363-E366 WeakPolarHBondContact OG1-CG 3.47Å; T363-E366 PolarHBondContact OG1-N 3.36Å; T363-E366 PolarHBondContact OG1-OE2 2.96Å; D364-E366 PolarHBondContact O-N 3.25Å; E366-Q368 VanDerWaalsContact C-N 3.35Å; E366-Q368 PolarHBondContact O-N 3.25Å; E366-A369 PolarHBondContact O-N 2.83Å; E366-I370 WeakPolarHBondContact O-CD1 3.41Å; E366-I370 WeakPolarHBondContact O-CG1 3.46Å; E366-I370 PolarHBondContact O-N 2.9Å
367	I	94.1	Very high	93.5	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-47.7	175.4	-68	169.9	0	0	0	110.1	T363 D364 A369 I370 L371 T391 M395 L399	T363-I367 WeakPolarHBondContact O-CG1 3.48Å; T363-I367 PolarHBondContact O-N 3.01Å; D364-I367 PolarHBondContact O-N 2.97Å; I367-A369 VanDerWaalsContact C-N 3.32Å; I367-A369 PolarHBondContact O-N 3.02Å; I367-I370 PolarHBondContact O-N 3.47Å; I367-L371 HydrophobicContact CG2-CD1 3.89Å; I367-L371 HydrophobicContact CG2-CG 4.33Å; I367-L371 VanDerWaalsContact O-CG 3.29Å; I367-L371 WeakPolarHBondContact O-CG 3.33Å; I367-L371 PolarHBondContact O-N 2.96Å; I367-T391 HydrophobicContact CB-CG2 4.27Å; I367-T391 HydrophobicContact CG2-CG2 3.99Å; I367-M395 HydrophobicContact CD1-CG 3.74Å; I367-L399 HydrophobicContact CG2-CD1 4.19Å
368	Q	94.8	Very high	93.2	Very high	58 Å²	58	52.5 Å²	52.5	27%	0.271	27%	0.272	S	S	.	.	H	α-helix	trans	-57.9	-45.4	177.9	-169.4	-179.3	16.3	0	0	111.6	D364 E366 L371 K372 L387 T391	D364-Q368 PolarHBondContact O-N 3.49Å; E366-Q368 VanDerWaalsContact C-N 3.35Å; E366-Q368 PolarHBondContact O-N 3.25Å; Q368-L371 PolarHBondContact O-N 2.74Å; Q368-K372 WeakPolarHBondContact O-CB 3.4Å; Q368-K372 PolarHBondContact O-N 3.28Å; Q368-L387 HydrophobicContact CG-CD1 4.48Å; Q368-L387 HydrophobicContact CG-CD2 3.88Å; Q368-L387 HydrophobicContact CG-CG 3.95Å; Q368-T391 HydrophobicContact CB-CG2 3.96Å
369	A	94.1	Very high	93	Very high	19 Å²	19	55.3 Å²	55.3	16%	0.157	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-39	177.6	0	0	0	0	0	112.6	I42 V47 K365 E366 I367 K372 I373	I42-A369 HydrophobicContact CD1-CB 3.97Å; V47-A369 HydrophobicContact CG1-CB 3.84Å; V47-A369 HydrophobicContact CG2-CB 4.37Å; K365-A369 WeakPolarHBondContact O-CB 3.3Å; K365-A369 PolarHBondContact O-N 2.78Å; K365-A369 VanDerWaalsContact O-N 3.12Å; E366-A369 PolarHBondContact O-N 2.83Å; I367-A369 VanDerWaalsContact C-N 3.32Å; I367-A369 PolarHBondContact O-N 3.02Å; A369-K372 PolarHBondContact O-N 3Å; A369-I373 WeakPolarHBondContact O-CG1 3.43Å; A369-I373 PolarHBondContact O-N 3.38Å
370	I	93.4	Very high	93	Very high	15 Å²	15	55.6 Å²	55.6	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-47	175	-67.4	161.1	0	0	0	110.4	V47 Y362 E366 I367 K372 I373 R374 L399	V47-I370 HydrophobicContact CB-CD1 4.45Å; V47-I370 HydrophobicContact CB-CG1 3.7Å; V47-I370 HydrophobicContact CG1-CG1 4.09Å; V47-I370 HydrophobicContact CG2-CG1 4Å; Y362-I370 HydrophobicContact CD1-CD1 3.9Å; Y362-I370 HydrophobicContact CD2-CD1 4.04Å; Y362-I370 HydrophobicContact CE1-CD1 3.88Å; Y362-I370 HydrophobicContact CE2-CD1 4.03Å; Y362-I370 HydrophobicContact CG-CD1 3.98Å; E366-I370 WeakPolarHBondContact O-CD1 3.41Å; E366-I370 WeakPolarHBondContact O-CG1 3.46Å; E366-I370 PolarHBondContact O-N 2.9Å; I367-I370 PolarHBondContact O-N 3.47Å; I370-K372 VanDerWaalsContact C-N 3.29Å; I370-K372 PolarHBondContact O-N 3.37Å; I370-I373 PolarHBondContact O-N 3.02Å; I370-R374 WeakPolarHBondContact O-CG 3.42Å; I370-R374 PolarHBondContact O-N 3.32Å; I370-L399 HydrophobicContact CB-CD1 4.5Å; I370-L399 HydrophobicContact CD1-CD2 3.97Å; I370-L399 HydrophobicContact CG2-CD1 4.07Å; I370-L399 HydrophobicContact CG2-CD2 4.1Å
371	L	94.1	Very high	93	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-39	178.6	-67.1	171.3	0	0	0	111.4	I367 Q368 R374 C375 L387 L390 L399 A402 I403 I406	I367-L371 HydrophobicContact CG2-CD1 3.89Å; I367-L371 HydrophobicContact CG2-CG 4.33Å; I367-L371 VanDerWaalsContact O-CG 3.29Å; I367-L371 WeakPolarHBondContact O-CG 3.33Å; I367-L371 PolarHBondContact O-N 2.96Å; Q368-L371 PolarHBondContact O-N 2.74Å; L371-R374 WeakPolarHBondContact O-CB 3.48Å; L371-R374 PolarHBondContact O-N 3.5Å; L371-C375 PolarHBondContact O-N 3.41Å; L371-C375 PolarHBondContact O-SG 2.87Å; L371-L387 HydrophobicContact CB-CD1 3.87Å; L371-L390 HydrophobicContact CD1-CB 4.28Å; L371-L390 HydrophobicContact CD1-CD2 4.04Å; L371-L390 HydrophobicContact CD1-CG 3.86Å; L371-L390 HydrophobicContact CD2-CD2 4.09Å; L371-L390 HydrophobicContact CD2-CG 4.4Å; L371-L390 HydrophobicContact CG-CD2 4.44Å; L371-L399 HydrophobicContact CD2-CD1 4.17Å; L371-L399 HydrophobicContact CG-CD1 4.44Å; L371-A402 HydrophobicContact CD2-CB 3.88Å; L371-I403 HydrophobicContact CD2-CG1 4.16Å; L371-I406 HydrophobicContact CD2-CD1 3.95Å
372	K	94.3	Very high	93.1	Very high	100 Å²	100	54.5 Å²	54.5	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-60.5	-47.9	175.2	-175.1	170.9	-179.3	165.5	0	112.4	Q368 A369 I370 R374 C375 E376	Q368-K372 WeakPolarHBondContact O-CB 3.4Å; Q368-K372 PolarHBondContact O-N 3.28Å; A369-K372 PolarHBondContact O-N 3Å; I370-K372 VanDerWaalsContact C-N 3.29Å; I370-K372 PolarHBondContact O-N 3.37Å; K372-R374 PolarHBondContact O-N 3.36Å; K372-C375 WeakPolarHBondContact O-CB 3.31Å; K372-C375 PolarHBondContact O-N 2.78Å; K372-E376 WeakPolarHBondContact CE-OE1 3.45Å; K372-E376 WeakPolarHBondContact O-CG 3.43Å; K372-E376 PolarHBondContact O-N 3.37Å
373	I	93.3	Very high	93.1	Very high	26 Å²	26	53.5 Å²	53.5	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-34.6	176.1	-67.2	170.8	0	0	0	111.1	H27 I42 V47 A369 I370 E376 E377	H27-I373 HydrophobicContact CB-CG2 4.21Å; I42-I373 HydrophobicContact CG2-CD1 4Å; V47-I373 HydrophobicContact CG2-CD1 3.28Å; A369-I373 WeakPolarHBondContact O-CG1 3.43Å; A369-I373 PolarHBondContact O-N 3.38Å; I370-I373 PolarHBondContact O-N 3.02Å; I373-E376 PolarHBondContact O-N 3.33Å; I373-E377 WeakPolarHBondContact O-CB 3.48Å; I373-E377 PolarHBondContact O-N 2.7Å
374	R	92.7	Very high	93.1	Very high	14 Å²	14	55.5 Å²	55.5	5%	0.053	27%	0.273	C	S	.	.	H	α-helix	trans	-69.7	-39.6	175.7	-69.3	-59.3	-172.9	138.5	19.2	113.6	G23 A24 H27 I370 L371 K372 E376 E377 E378 I403 I406	G23-R374 PolarHBondContact O-NH1 3.41Å; A24-R374 PolarHBondContact O-NH1 2.93Å; A24-R374 PolarHBondContact O-NH2 3.07Å; H27-R374 PolarHBondContact CE1-NE 3.28Å; H27-R374 VanDerWaalsContact CE1-NE 3.29Å; H27-R374 PolarHBondContact CE1-NH1 3.26Å; H27-R374 PolarHBondContact CE1-NH2 3.35Å; H27-R374 PolarHBondContact ND1-NE 3.29Å; H27-R374 PolarHBondContact ND1-NH1 3.28Å; H27-R374 PolarHBondContact NE2-NE 2.89Å; H27-R374 PolarHBondContact NE2-NH2 3.02Å; I370-R374 WeakPolarHBondContact O-CG 3.42Å; I370-R374 PolarHBondContact O-N 3.32Å; L371-R374 WeakPolarHBondContact O-CB 3.48Å; L371-R374 PolarHBondContact O-N 3.5Å; K372-R374 PolarHBondContact O-N 3.36Å; R374-E376 VanDerWaalsContact C-N 3.29Å; R374-E377 PolarHBondContact O-N 3.36Å; R374-E378 WeakPolarHBondContact O-CB 3.35Å; R374-E378 PolarHBondContact O-N 2.92Å; R374-I403 HydrophobicContact CG-CD1 4.3Å; R374-I403 HydrophobicContact CG-CG1 4.2Å; R374-I406 HydrophobicContact CB-CD1 3.74Å
375	C	92.9	Very high	93.2	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.034	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-41	172	-67.6	0	0	0	0	111.2	L371 K372 E378 D379 V380 I382	L371-C375 PolarHBondContact O-N 3.41Å; L371-C375 PolarHBondContact O-SG 2.87Å; K372-C375 WeakPolarHBondContact O-CB 3.31Å; K372-C375 PolarHBondContact O-N 2.78Å; C375-E378 PolarHBondContact O-N 3.35Å; C375-D379 PolarHBondContact O-N 3.42Å; C375-D379 VanDerWaalsContact O-N 3.14Å; C375-V380 HydrophobicContact CB-CB 4.47Å; C375-V380 WeakPolarHBondContact CB-O 3Å; C375-V380 PolarHBondContact O-N 2.64Å; C375-I382 HydrophobicContact CB-CG2 4.17Å
376	E	91.8	Very high	93.2	Very high	122 Å²	122	49 Å²	49	57%	0.57	25%	0.246	S	C	*	.	H	α-helix	trans	-64.6	-42.1	175.7	-70.3	172.2	-169	0	0	112.3	K372 I373 R374 D379	K372-E376 WeakPolarHBondContact CE-OE1 3.45Å; K372-E376 WeakPolarHBondContact O-CG 3.43Å; K372-E376 PolarHBondContact O-N 3.37Å; I373-E376 PolarHBondContact O-N 3.33Å; R374-E376 VanDerWaalsContact C-N 3.29Å; E376-D379 PolarHBondContact O-N 3.41Å
377	E	89.8	Confident	93.2	Very high	49 Å²	49	47.4 Å²	47.4	23%	0.229	24%	0.239	C	C	.	.	H	α-helix	trans	-70.3	-32.2	178.7	-178.8	76.1	-179.4	0	0	113.1	I22 S26 H27 I373 R374 D379	I22-E377 WeakPolarHBondContact CD1-O 3.06Å; I22-E377 HydrophobicContact CG2-CG 4.05Å; S26-E377 WeakPolarHBondContact CB-OE1 3.45Å; S26-E377 PolarHBondContact OG-OE1 2.94Å; H27-E377 HydrophobicContact CB-CB 4.17Å; H27-E377 HydrophobicContact CB-CG 3.94Å; H27-E377 PolarHBondContact N-OE1 2.89Å; I373-E377 WeakPolarHBondContact O-CB 3.48Å; I373-E377 PolarHBondContact O-N 2.7Å; R374-E377 PolarHBondContact O-N 3.36Å; E377-D379 VanDerWaalsContact C-N 3.34Å
378	E	89.6	Confident	93.3	Very high	35 Å²	35	50.7 Å²	50.7	16%	0.164	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	3.9	177.1	-71.6	-175.8	-154.8	0	0	113.6	I22 R374 C375 V380 T407	I22-E378 HydrophobicContact CG2-CG 4.12Å; R374-E378 WeakPolarHBondContact O-CB 3.35Å; R374-E378 PolarHBondContact O-N 2.92Å; C375-E378 PolarHBondContact O-N 3.35Å; E378-V380 VanDerWaalsContact C-N 3.35Å; E378-V380 HydrophobicContact CB-CG2 3.71Å; E378-V380 WeakPolarHBondContact O-CG2 3.41Å; E378-V380 PolarHBondContact O-N 3.29Å; E378-T407 PolarHBondContact OE1-OG1 3.3Å; E378-T407 WeakPolarHBondContact OE2-CB 3.49Å; E378-T407 PolarHBondContact OE2-OG1 3.27Å
379	D	90.7	Very high	93.3	Very high	136 Å²	136	49.9 Å²	49.9	73%	0.727	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	51.7	-173.6	-65.9	-47.4	0	0	0	112.3	C375 E376 E377	C375-D379 PolarHBondContact O-N 3.42Å; C375-D379 VanDerWaalsContact O-N 3.14Å; E376-D379 PolarHBondContact O-N 3.41Å; E377-D379 VanDerWaalsContact C-N 3.34Å
380	V	92.3	Very high	93.3	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.055	25%	0.252	C	S	.	.			trans	-113.6	111.7	-179.6	-172.8	0	0	0	0	111.1	C375 E378 I382 I406 N410 V421	C375-V380 HydrophobicContact CB-CB 4.47Å; C375-V380 WeakPolarHBondContact CB-O 3Å; C375-V380 PolarHBondContact O-N 2.64Å; E378-V380 VanDerWaalsContact C-N 3.35Å; E378-V380 HydrophobicContact CB-CG2 3.71Å; E378-V380 WeakPolarHBondContact O-CG2 3.41Å; E378-V380 PolarHBondContact O-N 3.29Å; V380-I382 PolarHBondContact O-N 2.7Å; V380-I406 HydrophobicContact CB-CG2 4.2Å; V380-I406 HydrophobicContact CG1-CG2 4.28Å; V380-I406 HydrophobicContact CG2-CG2 4.05Å; V380-N410 HydrophobicContact CG1-CB 3.88Å; V380-N410 HydrophobicContact CG2-CB 3.97Å; V380-N410 WeakPolarHBondContact CG2-ND2 3.37Å; V380-V421 HydrophobicContact CG1-CG2 3.64Å
381	D	94	Very high	93.4	Very high	114 Å²	114	48.5 Å²	48.5	61%	0.61	25%	0.249	S	C	*	.			trans	-72.9	117	169.4	-65.1	-38.1	0	0	0	109.9	E420 V421	D381-E420 HydrophobicContact CB-CB 4.45Å; D381-E420 HydrophobicContact CB-CG 4.47Å; D381-E420 CarbonylContact O-C 3.59Å; D381-E420 WeakPolarHBondContact O-CA 3.39Å; D381-V421 PolarHBondContact O-N 3.35Å
382	I	93.9	Very high	93.4	Very high	31 Å²	31	56.6 Å²	56.6	16%	0.159	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-120.4	137.8	179.4	-170.6	167.6	0	0	0	110.2	C375 V380 A386 L387 L390 V421 I426	C375-I382 HydrophobicContact CB-CG2 4.17Å; V380-I382 PolarHBondContact O-N 2.7Å; I382-A386 HydrophobicContact CD1-CB 4.15Å; I382-A386 HydrophobicContact CG1-CB 3.69Å; I382-L387 HydrophobicContact CD1-CB 4.4Å; I382-L390 HydrophobicContact CD1-CD2 4.15Å; I382-V421 HydrophobicContact CB-CB 4.48Å; I382-V421 HydrophobicContact CG1-CB 4.3Å; I382-I426 HydrophobicContact CD1-CD1 4.12Å
383	S	94.9	Very high	93.4	Very high	21 Å²	21	52.5 Å²	52.5	15%	0.147	26%	0.262	C	S	.	.			trans	-72.7	148.6	174.9	80.1	0	0	0	0	112.2	D385 A386 L387 E420 V421	S383-D385 PolarHBondContact O-N 3.19Å; S383-A386 CarbonylContact O-C 3.56Å; S383-A386 WeakPolarHBondContact O-CA 3.22Å; S383-A386 WeakPolarHBondContact O-CB 3.37Å; S383-A386 PolarHBondContact O-N 2.95Å; S383-A386 VanDerWaalsContact OG-CB 3.31Å; S383-A386 WeakPolarHBondContact OG-CB 3.46Å; S383-A386 PolarHBondContact OG-N 3.33Å; S383-L387 PolarHBondContact O-N 3.41Å; S383-E420 WeakPolarHBondContact CA-OE1 3.36Å; S383-E420 WeakPolarHBondContact CB-OE1 3.44Å; S383-E420 PolarHBondContact N-OE1 3.21Å; S383-V421 PolarHBondContact N-O 2.59Å; S383-V421 VanDerWaalsContact N-O 3.07Å
384	E	94	Very high	93.3	Very high	120 Å²	120	51.5 Å²	51.5	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-56.7	-40	179.3	-69	-64.5	157.4	0	0	111.8	A386 L387 V388	E384-A386 VanDerWaalsContact C-N 3.32Å; E384-A386 PolarHBondContact O-N 3.3Å; E384-L387 PolarHBondContact O-N 2.74Å; E384-V388 WeakPolarHBondContact O-CG2 3.37Å; E384-V388 PolarHBondContact O-N 2.64Å
385	D	94.4	Very high	93.2	Very high	104 Å²	104	56 Å²	56	56%	0.556	28%	0.281	S	S	*	.	H	α-helix	trans	-59.4	-41.7	173.1	-79.9	-3.8	0	0	0	112.4	S383 V389	S383-D385 PolarHBondContact O-N 3.19Å; D385-V389 WeakPolarHBondContact O-CG2 3.37Å; D385-V389 PolarHBondContact O-N 3.42Å
386	A	94.5	Very high	93.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-69.2	-39	179.4	0	0	0	0	0	110.9	I382 S383 E384 V389 L390 I426	I382-A386 HydrophobicContact CD1-CB 4.15Å; I382-A386 HydrophobicContact CG1-CB 3.69Å; S383-A386 CarbonylContact O-C 3.56Å; S383-A386 WeakPolarHBondContact O-CA 3.22Å; S383-A386 WeakPolarHBondContact O-CB 3.37Å; S383-A386 PolarHBondContact O-N 2.95Å; S383-A386 VanDerWaalsContact OG-CB 3.31Å; S383-A386 WeakPolarHBondContact OG-CB 3.46Å; S383-A386 PolarHBondContact OG-N 3.33Å; E384-A386 VanDerWaalsContact C-N 3.32Å; E384-A386 PolarHBondContact O-N 3.3Å; A386-V389 PolarHBondContact O-N 3.23Å; A386-L390 WeakPolarHBondContact O-CB 3.4Å; A386-L390 PolarHBondContact O-N 2.96Å; A386-I426 HydrophobicContact CB-CD1 3.68Å; A386-I426 VanDerWaalsContact O-CD1 3.3Å; A386-I426 WeakPolarHBondContact O-CD1 3.49Å
387	L	94.8	Very high	93.1	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-40.8	175.7	-176.2	63.2	0	0	0	112.2	Q368 L371 I382 S383 E384 L390 T391	Q368-L387 HydrophobicContact CG-CD1 4.48Å; Q368-L387 HydrophobicContact CG-CD2 3.88Å; Q368-L387 HydrophobicContact CG-CG 3.95Å; L371-L387 HydrophobicContact CB-CD1 3.87Å; I382-L387 HydrophobicContact CD1-CB 4.4Å; S383-L387 PolarHBondContact O-N 3.41Å; E384-L387 PolarHBondContact O-N 2.74Å; L387-L390 PolarHBondContact O-N 3.07Å; L387-T391 WeakPolarHBondContact O-CB 3.46Å; L387-T391 PolarHBondContact O-N 2.89Å; L387-T391 PolarHBondContact O-OG1 3.5Å
388	V	95.5	Very high	93.1	Very high	82 Å²	82	59.1 Å²	59.1	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-43.6	174.6	172.2	0	0	0	0	111.2	E384 T391 R392	E384-V388 WeakPolarHBondContact O-CG2 3.37Å; E384-V388 PolarHBondContact O-N 2.64Å; V388-T391 PolarHBondContact O-N 2.94Å; V388-R392 PolarHBondContact O-N 3.09Å; V388-R392 VanDerWaalsContact O-N 3.08Å
389	V	94.3	Very high	93.2	Very high	41 Å²	41	58.7 Å²	58.7	25%	0.248	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-43.8	176.1	173	0	0	0	0	110.9	D385 A386 T391 R392 I393 I426	D385-V389 WeakPolarHBondContact O-CG2 3.37Å; D385-V389 PolarHBondContact O-N 3.42Å; A386-V389 PolarHBondContact O-N 3.23Å; V389-T391 VanDerWaalsContact C-N 3.35Å; V389-T391 PolarHBondContact O-N 3Å; V389-R392 PolarHBondContact O-N 3.1Å; V389-I393 HydrophobicContact CG1-CD1 4.1Å; V389-I393 WeakPolarHBondContact O-CG1 3.5Å; V389-I393 PolarHBondContact O-N 3.26Å; V389-I426 HydrophobicContact CG1-CG2 4.31Å
390	L	94.7	Very high	93.3	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-39.9	179	-167.9	63.4	0	0	0	112.2	L371 I382 A386 L387 I393 G394 A402 L405 I406 I426	L371-L390 HydrophobicContact CD1-CB 4.28Å; L371-L390 HydrophobicContact CD1-CD2 4.04Å; L371-L390 HydrophobicContact CD1-CG 3.86Å; L371-L390 HydrophobicContact CD2-CD2 4.09Å; L371-L390 HydrophobicContact CD2-CG 4.4Å; L371-L390 HydrophobicContact CG-CD2 4.44Å; I382-L390 HydrophobicContact CD1-CD2 4.15Å; A386-L390 WeakPolarHBondContact O-CB 3.4Å; A386-L390 PolarHBondContact O-N 2.96Å; L387-L390 PolarHBondContact O-N 3.07Å; L390-I393 WeakPolarHBondContact O-CB 3.4Å; L390-I393 PolarHBondContact O-N 3.16Å; L390-G394 PolarHBondContact O-N 3.44Å; L390-A402 HydrophobicContact CD1-CB 4.28Å; L390-A402 HydrophobicContact CG-CB 4.42Å; L390-L405 HydrophobicContact CD1-CB 3.85Å; L390-L405 HydrophobicContact CD1-CD1 4.07Å; L390-I406 HydrophobicContact CD2-CD1 4.17Å; L390-I406 HydrophobicContact CD2-CG1 3.59Å; L390-I426 HydrophobicContact CB-CD1 4.13Å; L390-I426 HydrophobicContact CD1-CD1 4.5Å; L390-I426 HydrophobicContact CD1-CG2 4.39Å
391	T	95	Very high	93.3	Very high	3 Å²	3	61 Å²	61	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-45.1	176.4	-56.5	0	0	0	0	110.6	D364 I367 Q368 L387 V388 V389 I393 G394 M395	D364-T391 WeakPolarHBondContact O-CG2 3.42Å; D364-T391 WeakPolarHBondContact OD1-CG2 3.48Å; I367-T391 HydrophobicContact CB-CG2 4.27Å; I367-T391 HydrophobicContact CG2-CG2 3.99Å; Q368-T391 HydrophobicContact CB-CG2 3.96Å; L387-T391 WeakPolarHBondContact O-CB 3.46Å; L387-T391 PolarHBondContact O-N 2.89Å; L387-T391 PolarHBondContact O-OG1 3.5Å; V388-T391 PolarHBondContact O-N 2.94Å; V389-T391 VanDerWaalsContact C-N 3.35Å; V389-T391 PolarHBondContact O-N 3Å; T391-I393 VanDerWaalsContact C-N 3.33Å; T391-I393 PolarHBondContact O-N 3.22Å; T391-G394 PolarHBondContact O-N 3.36Å; T391-G394 VanDerWaalsContact O-N 3.14Å; T391-M395 PolarHBondContact O-N 2.95Å
392	R	94.6	Very high	93.3	Very high	169 Å²	169	55.6 Å²	55.6	64%	0.638	27%	0.272	S	S	*	.	H	α-helix	trans	-60.2	-41.2	174.4	-177.1	177.9	-77.6	-178.8	-4	112.1	V388 V389 M395 Q396	V388-R392 PolarHBondContact O-N 3.09Å; V388-R392 VanDerWaalsContact O-N 3.08Å; V389-R392 PolarHBondContact O-N 3.1Å; R392-M395 PolarHBondContact O-N 3.38Å; R392-Q396 WeakPolarHBondContact O-CG 3.43Å; R392-Q396 PolarHBondContact O-N 3.14Å; R392-Q396 VanDerWaalsContact O-N 3.16Å
393	I	93.3	Very high	93.3	Very high	15 Å²	15	55.4 Å²	55.4	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-44.8	174.5	-66.7	166.8	0	0	0	110.3	V389 L390 T391 M395 Q396 T397 Y401 L405 I426 Y430	V389-I393 HydrophobicContact CG1-CD1 4.1Å; V389-I393 WeakPolarHBondContact O-CG1 3.5Å; V389-I393 PolarHBondContact O-N 3.26Å; L390-I393 WeakPolarHBondContact O-CB 3.4Å; L390-I393 PolarHBondContact O-N 3.16Å; T391-I393 VanDerWaalsContact C-N 3.33Å; T391-I393 PolarHBondContact O-N 3.22Å; I393-M395 VanDerWaalsContact C-N 3.3Å; I393-M395 PolarHBondContact O-N 3.1Å; I393-Q396 PolarHBondContact O-N 3.26Å; I393-T397 WeakPolarHBondContact O-CB 3.45Å; I393-T397 PolarHBondContact O-N 3.19Å; I393-T397 PolarHBondContact O-OG1 3.15Å; I393-Y401 HydrophobicContact CG2-CD1 4.04Å; I393-Y401 HydrophobicContact CG2-CE1 3.94Å; I393-L405 HydrophobicContact CD1-CD1 4.3Å; I393-L405 HydrophobicContact CG2-CD1 3.88Å; I393-I426 HydrophobicContact CD1-CG2 3.82Å; I393-Y430 HydrophobicContact CD1-CD2 4.02Å; I393-Y430 HydrophobicContact CD1-CE2 4.49Å; I393-Y430 HydrophobicContact CD1-CG 4.42Å; I393-Y430 HydrophobicContact CG1-CD2 4.43Å; I393-Y430 HydrophobicContact CG1-CE2 4.43Å; I393-Y430 HydrophobicContact CG2-CD2 4.2Å; I393-Y430 HydrophobicContact CG2-CE2 4.03Å
394	G	91.5	Very high	93.2	Very high	5 Å²	5	59.8 Å²	59.8	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-33.5	179.1	0	0	0	0	0	114	L390 T391	L390-G394 PolarHBondContact O-N 3.44Å; T391-G394 PolarHBondContact O-N 3.36Å; T391-G394 VanDerWaalsContact O-N 3.14Å
395	M	91.6	Very high	93.2	Very high	107 Å²	107	54.2 Å²	54.2	53%	0.527	26%	0.263	S	S	.	.	H	α-helix	trans	-70.8	-40.7	172.8	-79.1	-165.5	72.4	0	0	113.6	D364 I367 T391 R392 I393	D364-M395 HydrophobicContact CB-SD 3.61Å; I367-M395 HydrophobicContact CD1-CG 3.74Å; T391-M395 PolarHBondContact O-N 2.95Å; R392-M395 PolarHBondContact O-N 3.38Å; I393-M395 VanDerWaalsContact C-N 3.3Å; I393-M395 PolarHBondContact O-N 3.1Å
396	Q	90.6	Very high	93.2	Very high	145 Å²	145	49.5 Å²	49.5	68%	0.678	24%	0.238	S	C	*	.	H	α-helix	trans	-78.1	-26.8	-176.9	-71.5	-179.5	-21.4	0	0	112.9	R392 I393	R392-Q396 WeakPolarHBondContact O-CG 3.43Å; R392-Q396 PolarHBondContact O-N 3.14Å; R392-Q396 VanDerWaalsContact O-N 3.16Å; I393-Q396 PolarHBondContact O-N 3.26Å
397	T	90.4	Very high	93.1	Very high	41 Å²	41	52.4 Å²	52.4	25%	0.252	26%	0.256	S	S	.	.	S	Bend	trans	-114.2	-110.3	-175.4	61.8	0	0	0	0	110.6	I393 Y401 D435	I393-T397 WeakPolarHBondContact O-CB 3.45Å; I393-T397 PolarHBondContact O-N 3.19Å; I393-T397 PolarHBondContact O-OG1 3.15Å; T397-Y401 HydrophobicContact CG2-CD1 4.38Å; T397-Y401 WeakPolarHBondContact OG1-CD1 3.4Å; T397-D435 HydrophobicContact CG2-CB 3.98Å
398	S	91.5	Very high	93	Very high	56 Å²	56	53.9 Å²	53.9	39%	0.392	27%	0.265	S	S	.	.			trans	-139.8	150.3	172.6	69.8	0	0	0	0	110.4	R400 Y401 A402	S398-R400 PolarHBondContact O-N 3.39Å; S398-Y401 PolarHBondContact O-N 3.41Å; S398-Y401 VanDerWaalsContact O-N 3.14Å; S398-Y401 WeakPolarHBondContact OG-CB 3.3Å; S398-Y401 PolarHBondContact OG-N 3.29Å; S398-A402 PolarHBondContact O-N 3.04Å; S398-A402 VanDerWaalsContact O-N 3.1Å
399	L	91.7	Very high	93	Very high	26 Å²	26	50 Å²	50	14%	0.136	24%	0.242	C	C	.	.	H	α-helix	trans	-57.5	-36.3	173.7	179.7	62.2	0	0	0	111.8	Y362 I367 I370 L371 Y401 A402 I403	Y362-L399 HydrophobicContact CD2-CD2 4.08Å; Y362-L399 HydrophobicContact CE2-CD2 4.08Å; I367-L399 HydrophobicContact CG2-CD1 4.19Å; I370-L399 HydrophobicContact CB-CD1 4.5Å; I370-L399 HydrophobicContact CD1-CD2 3.97Å; I370-L399 HydrophobicContact CG2-CD1 4.07Å; I370-L399 HydrophobicContact CG2-CD2 4.1Å; L371-L399 HydrophobicContact CD2-CD1 4.17Å; L371-L399 HydrophobicContact CG-CD1 4.44Å; L399-Y401 PolarHBondContact O-N 3.21Å; L399-A402 PolarHBondContact O-N 3.33Å; L399-I403 HydrophobicContact CD1-CD1 4.34Å; L399-I403 HydrophobicContact CD1-CG1 4.41Å; L399-I403 HydrophobicContact CG-CD1 4.03Å; L399-I403 VanDerWaalsContact O-CG1 3.28Å; L399-I403 WeakPolarHBondContact O-CG1 3.05Å; L399-I403 PolarHBondContact O-N 3.08Å
400	R	91.5	Very high	93	Very high	175 Å²	175	49.2 Å²	49.2	66%	0.66	24%	0.236	S	C	*	.	H	α-helix	trans	-60.2	-45.1	177	-177	-178.4	-67.6	158.2	-5.1	111.7	S398 I403 Q404	S398-R400 PolarHBondContact O-N 3.39Å; R400-I403 PolarHBondContact O-N 3.14Å; R400-Q404 WeakPolarHBondContact O-CG 3.31Å; R400-Q404 PolarHBondContact O-N 2.85Å; R400-Q404 VanDerWaalsContact O-N 3.15Å
401	Y	93.6	Very high	92.9	Very high	20 Å²	20	54.3 Å²	54.3	8%	0.078	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-44.1	177.8	179.5	-105.7	0	0	0	111.2	I393 T397 S398 L399 I403 Q404 L405 Y430 F433 D435 R438	I393-Y401 HydrophobicContact CG2-CD1 4.04Å; I393-Y401 HydrophobicContact CG2-CE1 3.94Å; T397-Y401 HydrophobicContact CG2-CD1 4.38Å; T397-Y401 WeakPolarHBondContact OG1-CD1 3.4Å; S398-Y401 PolarHBondContact O-N 3.41Å; S398-Y401 VanDerWaalsContact O-N 3.14Å; S398-Y401 WeakPolarHBondContact OG-CB 3.3Å; S398-Y401 PolarHBondContact OG-N 3.29Å; L399-Y401 PolarHBondContact O-N 3.21Å; Y401-I403 VanDerWaalsContact C-N 3.33Å; Y401-I403 PolarHBondContact O-N 2.88Å; Y401-Q404 PolarHBondContact O-N 3.45Å; Y401-L405 HydrophobicContact CD1-CD1 4.05Å; Y401-L405 HydrophobicContact CD1-CG 4.42Å; Y401-L405 HydrophobicContact CE1-CD1 3.62Å; Y401-L405 HydrophobicContact CE1-CD2 4.4Å; Y401-L405 HydrophobicContact CE1-CG 4.11Å; Y401-L405 WeakPolarHBondContact O-CG 3.35Å; Y401-L405 PolarHBondContact O-N 2.82Å; Y401-Y430 AromaticContact CE1-CD2 4Å; Y401-Y430 HydrophobicContact CE1-CD2 4Å; Y401-Y430 AromaticContact CE1-CE2 3.99Å; Y401-Y430 HydrophobicContact CE1-CE2 3.99Å; Y401-F433 PolarHBondContact OH-O 3.04Å; Y401-D435 HydrophobicContact CD1-CB 4.25Å; Y401-D435 HydrophobicContact CD2-CB 4.3Å; Y401-D435 HydrophobicContact CE1-CB 4.07Å; Y401-D435 HydrophobicContact CE2-CB 4.13Å; Y401-D435 HydrophobicContact CG-CB 4.36Å; Y401-R438 PolarHBondContact OH-NH2 3.19Å; Y401-R438 VanDerWaalsContact OH-NH2 3.07Å
402	A	93.8	Very high	92.9	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-38.4	175.8	0	0	0	0	0	113.1	L371 L390 S398 L399 L405 I406	L371-A402 HydrophobicContact CD2-CB 3.88Å; L390-A402 HydrophobicContact CD1-CB 4.28Å; L390-A402 HydrophobicContact CG-CB 4.42Å; S398-A402 PolarHBondContact O-N 3.04Å; S398-A402 VanDerWaalsContact O-N 3.1Å; L399-A402 PolarHBondContact O-N 3.33Å; A402-L405 WeakPolarHBondContact O-CB 3.12Å; A402-L405 PolarHBondContact O-N 3.23Å; A402-I406 PolarHBondContact O-N 3.41Å
403	I	92.6	Very high	92.8	Very high	27 Å²	27	47.3 Å²	47.3	14%	0.138	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-44.5	175.2	-67	168.1	0	0	0	110.9	L371 R374 L399 R400 Y401 L405 I406	L371-I403 HydrophobicContact CD2-CG1 4.16Å; R374-I403 HydrophobicContact CG-CD1 4.3Å; R374-I403 HydrophobicContact CG-CG1 4.2Å; L399-I403 HydrophobicContact CD1-CD1 4.34Å; L399-I403 HydrophobicContact CD1-CG1 4.41Å; L399-I403 HydrophobicContact CG-CD1 4.03Å; L399-I403 VanDerWaalsContact O-CG1 3.28Å; L399-I403 WeakPolarHBondContact O-CG1 3.05Å; L399-I403 PolarHBondContact O-N 3.08Å; R400-I403 PolarHBondContact O-N 3.14Å; Y401-I403 VanDerWaalsContact C-N 3.33Å; Y401-I403 PolarHBondContact O-N 2.88Å; I403-L405 PolarHBondContact O-N 3.21Å; I403-I406 VanDerWaalsContact O-CB 3.3Å; I403-I406 WeakPolarHBondContact O-CB 3.43Å; I403-I406 PolarHBondContact O-N 3.29Å
404	Q	92.9	Very high	92.8	Very high	113 Å²	113	54.3 Å²	54.3	53%	0.528	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-30.4	177.1	-69.8	172.8	-13.1	0	0	112.9	R400 Y401 I406 T408	R400-Q404 WeakPolarHBondContact O-CG 3.31Å; R400-Q404 PolarHBondContact O-N 2.85Å; R400-Q404 VanDerWaalsContact O-N 3.15Å; Y401-Q404 PolarHBondContact O-N 3.45Å; Q404-I406 VanDerWaalsContact C-N 3.27Å; Q404-I406 PolarHBondContact O-N 3.13Å; Q404-T408 PolarHBondContact O-N 3.48Å; Q404-T408 PolarHBondContact O-OG1 3.41Å
405	L	94.2	Very high	92.9	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-27.8	173.6	-69.7	-179.1	0	0	0	112.6	L390 I393 Y401 A402 I403 T408 A409 V429 Y430	L390-L405 HydrophobicContact CD1-CB 3.85Å; L390-L405 HydrophobicContact CD1-CD1 4.07Å; I393-L405 HydrophobicContact CD1-CD1 4.3Å; I393-L405 HydrophobicContact CG2-CD1 3.88Å; Y401-L405 HydrophobicContact CD1-CD1 4.05Å; Y401-L405 HydrophobicContact CD1-CG 4.42Å; Y401-L405 HydrophobicContact CE1-CD1 3.62Å; Y401-L405 HydrophobicContact CE1-CD2 4.4Å; Y401-L405 HydrophobicContact CE1-CG 4.11Å; Y401-L405 WeakPolarHBondContact O-CG 3.35Å; Y401-L405 PolarHBondContact O-N 2.82Å; A402-L405 WeakPolarHBondContact O-CB 3.12Å; A402-L405 PolarHBondContact O-N 3.23Å; I403-L405 PolarHBondContact O-N 3.21Å; L405-T408 VanDerWaalsContact CA-OG1 3.31Å; L405-T408 WeakPolarHBondContact CA-OG1 3.38Å; L405-T408 PolarHBondContact O-OG1 2.88Å; L405-A409 WeakPolarHBondContact O-CB 3.49Å; L405-A409 PolarHBondContact O-N 3.31Å; L405-V429 HydrophobicContact CD2-CB 4.26Å; L405-V429 HydrophobicContact CD2-CG1 3.31Å; L405-Y430 HydrophobicContact CD1-CD2 4.38Å
406	I	93.9	Very high	92.9	Very high	5 Å²	5	63.5 Å²	63.5	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-54.9	177.4	-62.2	171.1	0	0	0	109.8	L371 R374 V380 L390 A402 I403 Q404 T408 A409 N410	L371-I406 HydrophobicContact CD2-CD1 3.95Å; R374-I406 HydrophobicContact CB-CD1 3.74Å; V380-I406 HydrophobicContact CB-CG2 4.2Å; V380-I406 HydrophobicContact CG1-CG2 4.28Å; V380-I406 HydrophobicContact CG2-CG2 4.05Å; L390-I406 HydrophobicContact CD2-CD1 4.17Å; L390-I406 HydrophobicContact CD2-CG1 3.59Å; A402-I406 PolarHBondContact O-N 3.41Å; I403-I406 VanDerWaalsContact O-CB 3.3Å; I403-I406 WeakPolarHBondContact O-CB 3.43Å; I403-I406 PolarHBondContact O-N 3.29Å; Q404-I406 VanDerWaalsContact C-N 3.27Å; Q404-I406 PolarHBondContact O-N 3.13Å; I406-T408 VanDerWaalsContact C-N 3.32Å; I406-T408 PolarHBondContact O-N 3.47Å; I406-A409 PolarHBondContact O-N 3.33Å; I406-N410 WeakPolarHBondContact O-CB 3.37Å; I406-N410 PolarHBondContact O-N 3.12Å
407	T	92.5	Very high	93	Very high	61 Å²	61	66 Å²	66	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-42.9	-178	-41.7	0	0	0	0	111.3	E378 N410 L411	E378-T407 PolarHBondContact OE1-OG1 3.3Å; E378-T407 WeakPolarHBondContact OE2-CB 3.49Å; E378-T407 PolarHBondContact OE2-OG1 3.27Å; T407-N410 PolarHBondContact O-N 3.15Å; T407-L411 WeakPolarHBondContact O-CG 3.43Å; T407-L411 PolarHBondContact O-N 2.85Å; T407-L411 VanDerWaalsContact O-N 3.13Å
408	T	94.3	Very high	93	Very high	35 Å²	35	65 Å²	65	22%	0.215	30%	0.303	C	S	.	.	H	α-helix	trans	-73.1	-35.1	-179.3	48.1	0	0	0	0	112.6	Q404 L405 I406 L411 V412 V429 F433	Q404-T408 PolarHBondContact O-N 3.48Å; Q404-T408 PolarHBondContact O-OG1 3.41Å; L405-T408 VanDerWaalsContact CA-OG1 3.31Å; L405-T408 WeakPolarHBondContact CA-OG1 3.38Å; L405-T408 PolarHBondContact O-OG1 2.88Å; I406-T408 VanDerWaalsContact C-N 3.32Å; I406-T408 PolarHBondContact O-N 3.47Å; T408-L411 PolarHBondContact O-N 2.93Å; T408-V412 WeakPolarHBondContact O-CG2 3.48Å; T408-V412 PolarHBondContact O-N 2.71Å; T408-V412 VanDerWaalsContact O-N 3.08Å; T408-V429 WeakPolarHBondContact OG1-CG1 3.34Å; T408-F433 HydrophobicContact CG2-CE2 4.08Å; T408-F433 HydrophobicContact CG2-CZ 4.43Å
409	A	94.7	Very high	92.9	Very high	2 Å²	2	70.1 Å²	70.1	2%	0.017	33%	0.325	C	S	.	.	H	α-helix	trans	-67.7	-37.3	173.5	0	0	0	0	0	111.8	L405 I406 L411 V412 C413 V421 I426 V429	L405-A409 WeakPolarHBondContact O-CB 3.49Å; L405-A409 PolarHBondContact O-N 3.31Å; I406-A409 PolarHBondContact O-N 3.33Å; A409-L411 VanDerWaalsContact C-N 3.35Å; A409-L411 PolarHBondContact O-N 3.08Å; A409-V412 PolarHBondContact O-N 3.31Å; A409-C413 WeakPolarHBondContact O-CB 3.44Å; A409-C413 PolarHBondContact O-N 2.84Å; A409-V421 HydrophobicContact CB-CG1 3.72Å; A409-I426 HydrophobicContact CB-CG1 4.11Å; A409-V429 HydrophobicContact CB-CG2 4.22Å
410	N	93.4	Very high	93	Very high	23 Å²	23	73.8 Å²	73.8	12%	0.123	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-44	171.3	-172.8	15.1	0	0	0	111.4	V380 I406 T407 V412 C413 R414 V421	V380-N410 HydrophobicContact CG1-CB 3.88Å; V380-N410 HydrophobicContact CG2-CB 3.97Å; V380-N410 WeakPolarHBondContact CG2-ND2 3.37Å; I406-N410 WeakPolarHBondContact O-CB 3.37Å; I406-N410 PolarHBondContact O-N 3.12Å; T407-N410 PolarHBondContact O-N 3.15Å; N410-V412 VanDerWaalsContact C-N 3.35Å; N410-V412 PolarHBondContact O-N 2.92Å; N410-C413 WeakPolarHBondContact O-CB 3.42Å; N410-C413 PolarHBondContact O-N 3.21Å; N410-R414 WeakPolarHBondContact O-CB 3.01Å; N410-R414 WeakPolarHBondContact O-CG 3.48Å; N410-R414 PolarHBondContact O-N 2.82Å; N410-R414 PolarHBondContact OD1-NE 3.45Å; N410-V421 HydrophobicContact CB-CG2 4.49Å
411	L	93.7	Very high	93.2	Very high	109 Å²	109	65.6 Å²	65.6	57%	0.571	31%	0.311	S	S	*	.	H	α-helix	trans	-61.5	-40.4	175.9	-70	173.6	0	0	0	112.8	T407 T408 A409 K415	T407-L411 WeakPolarHBondContact O-CG 3.43Å; T407-L411 PolarHBondContact O-N 2.85Å; T407-L411 VanDerWaalsContact O-N 3.13Å; T408-L411 PolarHBondContact O-N 2.93Å; A409-L411 VanDerWaalsContact C-N 3.35Å; A409-L411 PolarHBondContact O-N 3.08Å; L411-K415 WeakPolarHBondContact O-CB 3.33Å; L411-K415 PolarHBondContact O-N 3.1Å
412	V	94.3	Very high	93.2	Very high	25 Å²	25	65.8 Å²	65.8	15%	0.152	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-40.7	175.2	174.2	0	0	0	0	111.2	T408 A409 N410 K415 R416 D425 K428 V429	T408-V412 WeakPolarHBondContact O-CG2 3.48Å; T408-V412 PolarHBondContact O-N 2.71Å; T408-V412 VanDerWaalsContact O-N 3.08Å; A409-V412 PolarHBondContact O-N 3.31Å; N410-V412 VanDerWaalsContact C-N 3.35Å; N410-V412 PolarHBondContact O-N 2.92Å; V412-K415 WeakPolarHBondContact O-CB 3.11Å; V412-K415 PolarHBondContact O-N 2.94Å; V412-R416 PolarHBondContact O-N 2.92Å; V412-D425 HydrophobicContact CG1-CB 4.26Å; V412-K428 HydrophobicContact CG1-CD 4Å; V412-V429 HydrophobicContact CB-CG2 4.24Å; V412-V429 HydrophobicContact CG2-CG2 3.62Å
413	C	93.5	Very high	93.2	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.007	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-48.7	175.5	-171.7	0	0	0	0	111.5	A409 N410 K415 R416 K417 G418 E420 V421	A409-C413 WeakPolarHBondContact O-CB 3.44Å; A409-C413 PolarHBondContact O-N 2.84Å; N410-C413 WeakPolarHBondContact O-CB 3.42Å; N410-C413 PolarHBondContact O-N 3.21Å; C413-K415 VanDerWaalsContact C-N 3.28Å; C413-K415 PolarHBondContact O-N 3.06Å; C413-R416 CarbonylContact O-C 3.56Å; C413-R416 WeakPolarHBondContact O-CG 3.37Å; C413-R416 PolarHBondContact O-N 3.32Å; C413-R416 VanDerWaalsContact O-N 3.1Å; C413-R416 PolarHBondContact SG-NH2 3.18Å; C413-R416 VanDerWaalsContact SG-NH2 3.41Å; C413-K417 PolarHBondContact O-N 3.2Å; C413-G418 PolarHBondContact O-N 2.99Å; C413-G418 VanDerWaalsContact SG-C 3.59Å; C413-E420 VanDerWaalsContact SG-C 3.58Å; C413-E420 PolarHBondContact SG-O 3.32Å; C413-V421 HydrophobicContact CB-CG2 3.9Å
414	R	93.2	Very high	93.3	Very high	162 Å²	162	74.8 Å²	74.8	61%	0.611	36%	0.356	S	S	*	.	H	α-helix	trans	-59.6	-38.3	174.5	-72.1	179.5	178.8	-160.9	-2.4	111.9	N410 R416 K417	N410-R414 WeakPolarHBondContact O-CB 3.01Å; N410-R414 WeakPolarHBondContact O-CG 3.48Å; N410-R414 PolarHBondContact O-N 2.82Å; N410-R414 PolarHBondContact OD1-NE 3.45Å; R414-R416 VanDerWaalsContact C-N 3.33Å; R414-R416 PolarHBondContact O-N 3.5Å; R414-K417 WeakPolarHBondContact O-CA 3.42Å; R414-K417 PolarHBondContact O-N 2.99Å
415	K	93.2	Very high	93.4	Very high	185 Å²	185	69.8 Å²	69.8	80%	0.804	33%	0.332	S	S	*	.	H	α-helix	trans	-64.9	-33.7	176.5	-170.5	172.3	-178.1	173.4	0	113	L411 V412 C413 K417	L411-K415 WeakPolarHBondContact O-CB 3.33Å; L411-K415 PolarHBondContact O-N 3.1Å; V412-K415 WeakPolarHBondContact O-CB 3.11Å; V412-K415 PolarHBondContact O-N 2.94Å; C413-K415 VanDerWaalsContact C-N 3.28Å; C413-K415 PolarHBondContact O-N 3.06Å; K415-K417 PolarHBondContact O-N 3.43Å
416	R	92.2	Very high	93.4	Very high	120 Å²	120	69.7 Å²	69.7	45%	0.453	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	2.5	171.4	67.3	171.2	177.4	120.2	11.4	113.7	V412 C413 R414 G418 E420 S422 D425	V412-R416 PolarHBondContact O-N 2.92Å; C413-R416 CarbonylContact O-C 3.56Å; C413-R416 WeakPolarHBondContact O-CG 3.37Å; C413-R416 PolarHBondContact O-N 3.32Å; C413-R416 VanDerWaalsContact O-N 3.1Å; C413-R416 PolarHBondContact SG-NH2 3.18Å; C413-R416 VanDerWaalsContact SG-NH2 3.41Å; R414-R416 VanDerWaalsContact C-N 3.33Å; R414-R416 PolarHBondContact O-N 3.5Å; R416-G418 PolarHBondContact O-N 3.08Å; R416-E420 PolarHBondContact NH2-O 3.14Å; R416-S422 PolarHBondContact NH2-OG 2.66Å; R416-D425 WeakPolarHBondContact CD-OD1 3.27Å; R416-D425 IonicContact CZ-OD1 3.78Å; R416-D425 IonicContact CZ-OD2 3.07Å; R416-D425 VanDerWaalsContact NE-CG 3.3Å; R416-D425 IonicContact NE-OD1 2.92Å; R416-D425 PolarHBondContact NE-OD1 2.66Å; R416-D425 IonicContact NE-OD2 2.92Å; R416-D425 PolarHBondContact NE-OD2 3.3Å; R416-D425 IonicContact NH2-OD2 2.71Å; R416-D425 PolarHBondContact NH2-OD2 3.42Å
417	K	91.6	Very high	93.4	Very high	196 Å²	196	76.9 Å²	76.9	85%	0.852	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	31.4	-171.9	-53.5	-179	179.5	-179.7	0	113.1	C413 R414 K415	C413-K417 PolarHBondContact O-N 3.2Å; R414-K417 WeakPolarHBondContact O-CA 3.42Å; R414-K417 PolarHBondContact O-N 2.99Å; K415-K417 PolarHBondContact O-N 3.43Å
418	G	89.7	Confident	93.4	Very high	21 Å²	21	79.7 Å²	79.7	22%	0.216	37%	0.366	C	S	.	.			trans	-80.6	153.4	171.7	0	0	0	0	0	111	C413 R416	C413-G418 PolarHBondContact O-N 2.99Å; C413-G418 VanDerWaalsContact SG-C 3.59Å; R416-G418 PolarHBondContact O-N 3.08Å
419	L	90.5	Very high	93.4	Very high	163 Å²	163	78 Å²	78	85%	0.853	36%	0.356	S	S	*	.	S	Bend	trans	-91.2	-38.5	173.4	-64	173.6	0	0	0	111.5
420	E	94.3	Very high	93.4	Very high	103 Å²	103	81 Å²	81	48%	0.481	37%	0.367	S	S	.	.	S	Bend	trans	-118.2	130.9	-174.2	-177.5	-173.4	-169.8	0	0	110.8	D381 S383 C413 R416 S422	D381-E420 HydrophobicContact CB-CB 4.45Å; D381-E420 HydrophobicContact CB-CG 4.47Å; D381-E420 CarbonylContact O-C 3.59Å; D381-E420 WeakPolarHBondContact O-CA 3.39Å; S383-E420 WeakPolarHBondContact CA-OE1 3.36Å; S383-E420 WeakPolarHBondContact CB-OE1 3.44Å; S383-E420 PolarHBondContact N-OE1 3.21Å; C413-E420 VanDerWaalsContact SG-C 3.58Å; C413-E420 PolarHBondContact SG-O 3.32Å; R416-E420 PolarHBondContact NH2-O 3.14Å; E420-S422 PolarHBondContact O-N 2.85Å
421	V	94.6	Very high	93.3	Very high	3 Å²	3	84 Å²	84	2%	0.018	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-65.5	122.9	178.1	178.3	0	0	0	0	110.3	V380 D381 I382 S383 A409 N410 C413 D425 I426	V380-V421 HydrophobicContact CG1-CG2 3.64Å; D381-V421 PolarHBondContact O-N 3.35Å; I382-V421 HydrophobicContact CB-CB 4.48Å; I382-V421 HydrophobicContact CG1-CB 4.3Å; S383-V421 PolarHBondContact N-O 2.59Å; S383-V421 VanDerWaalsContact N-O 3.07Å; A409-V421 HydrophobicContact CB-CG1 3.72Å; N410-V421 HydrophobicContact CB-CG2 4.49Å; C413-V421 HydrophobicContact CB-CG2 3.9Å; V421-D425 HydrophobicContact CG1-CB 4.18Å; V421-I426 HydrophobicContact CG1-CD1 4.48Å; V421-I426 HydrophobicContact CG1-CG1 4.07Å
422	S	94.4	Very high	93.3	Very high	24 Å²	24	84.1 Å²	84.1	17%	0.168	39%	0.391	C	S	.	.			trans	-100.1	164.9	-178.5	70.1	0	0	0	0	112.2	R416 E420 E424 D425 I426	R416-S422 PolarHBondContact NH2-OG 2.66Å; E420-S422 PolarHBondContact O-N 2.85Å; S422-E424 PolarHBondContact O-N 3.34Å; S422-E424 VanDerWaalsContact O-N 3.15Å; S422-D425 PolarHBondContact N-OD2 3.04Å; S422-D425 WeakPolarHBondContact O-CB 3.49Å; S422-D425 PolarHBondContact O-N 3.37Å; S422-D425 VanDerWaalsContact O-N 3.12Å; S422-D425 PolarHBondContact OG-OD2 2.95Å; S422-I426 PolarHBondContact O-N 2.82Å
423	K	94.5	Very high	93.3	Very high	83 Å²	83	88.1 Å²	88.1	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-56	-29.3	173	68	-172.4	175.7	-164.1	0	113.5	R427	K423-R427 VanDerWaalsContact O-CG 3.3Å; K423-R427 WeakPolarHBondContact O-CG 3.5Å; K423-R427 PolarHBondContact O-N 2.96Å; K423-R427 VanDerWaalsContact O-N 3.1Å
424	E	93.6	Very high	93.2	Very high	134 Å²	134	93.1 Å²	93.1	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-72.2	-37.5	179.9	-64.1	-178.7	-178.6	0	0	111.5	S422 R427 K428	S422-E424 PolarHBondContact O-N 3.34Å; S422-E424 VanDerWaalsContact O-N 3.15Å; E424-R427 PolarHBondContact O-N 3.28Å; E424-K428 WeakPolarHBondContact O-CB 3.38Å; E424-K428 PolarHBondContact O-N 3.07Å
425	D	94.4	Very high	93.2	Very high	7 Å²	7	86.1 Å²	86.1	4%	0.037	41%	0.405	C	S	.	.	H	α-helix	trans	-63.4	-47.1	175.8	-58.7	-52.4	0	0	0	110.4	V412 R416 V421 S422 R427 K428 V429	V412-D425 HydrophobicContact CG1-CB 4.26Å; R416-D425 WeakPolarHBondContact CD-OD1 3.27Å; R416-D425 IonicContact CZ-OD1 3.78Å; R416-D425 IonicContact CZ-OD2 3.07Å; R416-D425 VanDerWaalsContact NE-CG 3.3Å; R416-D425 IonicContact NE-OD1 2.92Å; R416-D425 PolarHBondContact NE-OD1 2.66Å; R416-D425 IonicContact NE-OD2 2.92Å; R416-D425 PolarHBondContact NE-OD2 3.3Å; R416-D425 IonicContact NH2-OD2 2.71Å; R416-D425 PolarHBondContact NH2-OD2 3.42Å; V421-D425 HydrophobicContact CG1-CB 4.18Å; S422-D425 PolarHBondContact N-OD2 3.04Å; S422-D425 WeakPolarHBondContact O-CB 3.49Å; S422-D425 PolarHBondContact O-N 3.37Å; S422-D425 VanDerWaalsContact O-N 3.12Å; S422-D425 PolarHBondContact OG-OD2 2.95Å; D425-R427 PolarHBondContact O-N 3.42Å; D425-K428 WeakPolarHBondContact O-CB 3.3Å; D425-K428 PolarHBondContact O-N 3.1Å; D425-V429 WeakPolarHBondContact O-CG2 3.46Å; D425-V429 PolarHBondContact O-N 3.45Å
426	I	94.3	Very high	93.1	Very high	2 Å²	2	85.3 Å²	85.3	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-61	-45.3	178.1	-62.1	-177.8	0	0	0	110.9	I382 A386 V389 L390 I393 A409 V421 S422 K428 V429 Y430	I382-I426 HydrophobicContact CD1-CD1 4.12Å; A386-I426 HydrophobicContact CB-CD1 3.68Å; A386-I426 VanDerWaalsContact O-CD1 3.3Å; A386-I426 WeakPolarHBondContact O-CD1 3.49Å; V389-I426 HydrophobicContact CG1-CG2 4.31Å; L390-I426 HydrophobicContact CB-CD1 4.13Å; L390-I426 HydrophobicContact CD1-CD1 4.5Å; L390-I426 HydrophobicContact CD1-CG2 4.39Å; I393-I426 HydrophobicContact CD1-CG2 3.82Å; A409-I426 HydrophobicContact CB-CG1 4.11Å; V421-I426 HydrophobicContact CG1-CD1 4.48Å; V421-I426 HydrophobicContact CG1-CG1 4.07Å; S422-I426 PolarHBondContact O-N 2.82Å; I426-K428 VanDerWaalsContact C-N 3.31Å; I426-K428 PolarHBondContact O-N 3.48Å; I426-V429 PolarHBondContact O-N 3.38Å; I426-Y430 VanDerWaalsContact O-CB 3.27Å; I426-Y430 WeakPolarHBondContact O-CB 3.38Å; I426-Y430 PolarHBondContact O-N 2.96Å
427	R	93.7	Very high	93	Very high	155 Å²	155	82.3 Å²	82.3	59%	0.585	41%	0.406	S	S	*	.	H	α-helix	trans	-60.9	-41.6	176.7	-75.9	175.6	-176.8	175	0.2	112	K423 E424 D425 Y430 S431	K423-R427 VanDerWaalsContact O-CG 3.3Å; K423-R427 WeakPolarHBondContact O-CG 3.5Å; K423-R427 PolarHBondContact O-N 2.96Å; K423-R427 VanDerWaalsContact O-N 3.1Å; E424-R427 PolarHBondContact O-N 3.28Å; D425-R427 PolarHBondContact O-N 3.42Å; R427-Y430 PolarHBondContact O-N 2.64Å; R427-S431 PolarHBondContact O-N 2.77Å
428	K	93.8	Very high	92.9	Very high	121 Å²	121	76.2 Å²	76.2	53%	0.526	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-47.9	176.6	-176.2	171.1	179.6	175.8	0	111	V412 E424 D425 I426 Y430 S431 L432	V412-K428 HydrophobicContact CG1-CD 4Å; E424-K428 WeakPolarHBondContact O-CB 3.38Å; E424-K428 PolarHBondContact O-N 3.07Å; D425-K428 WeakPolarHBondContact O-CB 3.3Å; D425-K428 PolarHBondContact O-N 3.1Å; I426-K428 VanDerWaalsContact C-N 3.31Å; I426-K428 PolarHBondContact O-N 3.48Å; K428-Y430 PolarHBondContact O-N 3.23Å; K428-S431 PolarHBondContact O-N 2.86Å; K428-S431 PolarHBondContact O-OG 3.43Å; K428-L432 HydrophobicContact CG-CD1 4.48Å; K428-L432 WeakPolarHBondContact O-CG 3.35Å; K428-L432 PolarHBondContact O-N 3.42Å
429	V	94.6	Very high	93	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-43.4	176	177.9	0	0	0	0	111.5	L405 T408 A409 V412 D425 I426 S431 L432 F433	L405-V429 HydrophobicContact CD2-CB 4.26Å; L405-V429 HydrophobicContact CD2-CG1 3.31Å; T408-V429 WeakPolarHBondContact OG1-CG1 3.34Å; A409-V429 HydrophobicContact CB-CG2 4.22Å; V412-V429 HydrophobicContact CB-CG2 4.24Å; V412-V429 HydrophobicContact CG2-CG2 3.62Å; D425-V429 WeakPolarHBondContact O-CG2 3.46Å; D425-V429 PolarHBondContact O-N 3.45Å; I426-V429 PolarHBondContact O-N 3.38Å; V429-S431 PolarHBondContact O-N 2.92Å; V429-L432 WeakPolarHBondContact O-CB 3.33Å; V429-L432 PolarHBondContact O-N 2.9Å; V429-F433 HydrophobicContact CG1-CD2 3.68Å; V429-F433 HydrophobicContact CG1-CE2 4.11Å; V429-F433 PolarHBondContact O-N 3.2Å
430	Y	93.5	Very high	93	Very high	63 Å²	63	72.4 Å²	72.4	25%	0.247	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-30.1	178	-174.7	-98.8	0	0	0	113.1	I393 Y401 L405 I426 R427 K428 F433 R438	I393-Y430 HydrophobicContact CD1-CD2 4.02Å; I393-Y430 HydrophobicContact CD1-CE2 4.49Å; I393-Y430 HydrophobicContact CD1-CG 4.42Å; I393-Y430 HydrophobicContact CG1-CD2 4.43Å; I393-Y430 HydrophobicContact CG1-CE2 4.43Å; I393-Y430 HydrophobicContact CG2-CD2 4.2Å; I393-Y430 HydrophobicContact CG2-CE2 4.03Å; Y401-Y430 AromaticContact CE1-CD2 4Å; Y401-Y430 HydrophobicContact CE1-CD2 4Å; Y401-Y430 AromaticContact CE1-CE2 3.99Å; Y401-Y430 HydrophobicContact CE1-CE2 3.99Å; L405-Y430 HydrophobicContact CD1-CD2 4.38Å; I426-Y430 VanDerWaalsContact O-CB 3.27Å; I426-Y430 WeakPolarHBondContact O-CB 3.38Å; I426-Y430 PolarHBondContact O-N 2.96Å; R427-Y430 PolarHBondContact O-N 2.64Å; K428-Y430 PolarHBondContact O-N 3.23Å; Y430-F433 VanDerWaalsContact O-O 3.1Å; Y430-R438 VanDerWaalsContact CE2-NH2 3.26Å; Y430-R438 PolarHBondContact O-NH1 3.41Å; Y430-R438 PolarHBondContact O-NH2 2.9Å; Y430-R438 PolarHBondContact OH-NE 2.65Å
431	S	92.5	Very high	92.8	Very high	86 Å²	86	72.3 Å²	72.3	60%	0.601	36%	0.36	S	S	*	.	H	α-helix	trans	-74.2	-27.4	171.5	70.9	0	0	0	0	113.7	R427 K428 V429	R427-S431 PolarHBondContact O-N 2.77Å; K428-S431 PolarHBondContact O-N 2.86Å; K428-S431 PolarHBondContact O-OG 3.43Å; V429-S431 PolarHBondContact O-N 2.92Å
432	L	93.8	Very high	92.6	Very high	113 Å²	113	76 Å²	76	59%	0.592	38%	0.376	S	S	*	.	H	α-helix	trans	-83.3	-38.4	-179.2	-70.1	170.4	0	0	0	112.5	K428 V429	K428-L432 HydrophobicContact CG-CD1 4.48Å; K428-L432 WeakPolarHBondContact O-CG 3.35Å; K428-L432 PolarHBondContact O-N 3.42Å; V429-L432 WeakPolarHBondContact O-CB 3.33Å; V429-L432 PolarHBondContact O-N 2.9Å
433	F	94.3	Very high	92.3	Very high	108 Å²	108	78.5 Å²	78.5	47%	0.474	39%	0.388	S	S	.	.	S	Bend	trans	-111.4	121.9	-177.2	-60.9	-76.9	0	0	0	110.4	Y401 T408 V429 Y430 R438	Y401-F433 PolarHBondContact OH-O 3.04Å; T408-F433 HydrophobicContact CG2-CE2 4.08Å; T408-F433 HydrophobicContact CG2-CZ 4.43Å; V429-F433 HydrophobicContact CG1-CD2 3.68Å; V429-F433 HydrophobicContact CG1-CE2 4.11Å; V429-F433 PolarHBondContact O-N 3.2Å; Y430-F433 VanDerWaalsContact O-O 3.1Å; F433-R438 PolarHBondContact O-NH2 3.11Å
434	M	90.2	Very high	91.9	Very high	106 Å²	106	80.9 Å²	80.9	52%	0.522	40%	0.398	S	S	.	.			trans	-82.1	145.3	174.7	-63	-174.4	-70.8	0	0	110.7
435	D	92.7	Very high	91.7	Very high	15 Å²	15	81.6 Å²	81.6	8%	0.08	40%	0.401	C	S	.	.			trans	-86.1	171.5	167	66.6	-61.7	0	0	0	110.5	T397 Y401 A437 R438 S439	T397-D435 HydrophobicContact CG2-CB 3.98Å; Y401-D435 HydrophobicContact CD1-CB 4.25Å; Y401-D435 HydrophobicContact CD2-CB 4.3Å; Y401-D435 HydrophobicContact CE1-CB 4.07Å; Y401-D435 HydrophobicContact CE2-CB 4.13Å; Y401-D435 HydrophobicContact CG-CB 4.36Å; D435-A437 VanDerWaalsContact C-N 3.32Å; D435-A437 PolarHBondContact O-N 3.4Å; D435-A437 WeakPolarHBondContact OD2-CB 3.33Å; D435-A437 PolarHBondContact OD2-N 2.95Å; D435-R438 PolarHBondContact O-N 3.25Å; D435-R438 VanDerWaalsContact OD1-CB 3.26Å; D435-R438 WeakPolarHBondContact OD1-CB 3.42Å; D435-R438 WeakPolarHBondContact OD1-CD 3.46Å; D435-R438 WeakPolarHBondContact OD1-CG 3.43Å; D435-R438 IonicContact OD1-CZ 3.45Å; D435-R438 IonicContact OD1-NE 2.65Å; D435-R438 PolarHBondContact OD1-NE 3.33Å; D435-R438 IonicContact OD1-NH2 3.39Å; D435-R438 PolarHBondContact OD1-NH2 2.65Å; D435-S439 WeakPolarHBondContact O-CB 3.26Å; D435-S439 PolarHBondContact O-N 3.26Å
436	E	90.9	Very high	91.3	Very high	168 Å²	168	85.8 Å²	85.8	79%	0.785	42%	0.417	S	S	*	.	H	α-helix	trans	-57.4	-41.2	-177.6	-174	-172.8	170.9	0	0	112.8	S439 T440	E436-S439 PolarHBondContact O-N 3.39Å; E436-T440 WeakPolarHBondContact O-CB 3.17Å; E436-T440 PolarHBondContact O-N 2.89Å; E436-T440 PolarHBondContact O-OG1 2.88Å
437	A	90.6	Very high	90.7	Very high	58 Å²	58	88.9 Å²	88.9	48%	0.479	43%	0.432	S	S	.	.	H	α-helix	trans	-70.4	-46.3	-177.1	0	0	0	0	0	111.5	D435 S439 T440 L441	D435-A437 VanDerWaalsContact C-N 3.32Å; D435-A437 PolarHBondContact O-N 3.4Å; D435-A437 WeakPolarHBondContact OD2-CB 3.33Å; D435-A437 PolarHBondContact OD2-N 2.95Å; A437-S439 VanDerWaalsContact C-N 3.32Å; A437-S439 PolarHBondContact O-N 3.22Å; A437-T440 PolarHBondContact O-N 3.21Å; A437-L441 WeakPolarHBondContact O-CG 3.45Å; A437-L441 PolarHBondContact O-N 3.49Å
438	R	90.8	Very high	90	Very high	68 Å²	68	90.8 Å²	90.8	26%	0.257	45%	0.447	S	S	.	.	H	α-helix	trans	-61.6	-40.6	173.2	-75.7	-170.7	-69.4	160.1	3.4	111.8	Y401 Y430 F433 D435 T440 L441 F442	Y401-R438 PolarHBondContact OH-NH2 3.19Å; Y401-R438 VanDerWaalsContact OH-NH2 3.07Å; Y430-R438 VanDerWaalsContact CE2-NH2 3.26Å; Y430-R438 PolarHBondContact O-NH1 3.41Å; Y430-R438 PolarHBondContact O-NH2 2.9Å; Y430-R438 PolarHBondContact OH-NE 2.65Å; F433-R438 PolarHBondContact O-NH2 3.11Å; D435-R438 PolarHBondContact O-N 3.25Å; D435-R438 VanDerWaalsContact OD1-CB 3.26Å; D435-R438 WeakPolarHBondContact OD1-CB 3.42Å; D435-R438 WeakPolarHBondContact OD1-CD 3.46Å; D435-R438 WeakPolarHBondContact OD1-CG 3.43Å; D435-R438 IonicContact OD1-CZ 3.45Å; D435-R438 IonicContact OD1-NE 2.65Å; D435-R438 PolarHBondContact OD1-NE 3.33Å; D435-R438 IonicContact OD1-NH2 3.39Å; D435-R438 PolarHBondContact OD1-NH2 2.65Å; R438-T440 VanDerWaalsContact C-N 3.34Å; R438-T440 PolarHBondContact O-N 3.37Å; R438-L441 PolarHBondContact O-N 2.92Å; R438-F442 WeakPolarHBondContact O-CB 3.41Å; R438-F442 PolarHBondContact O-N 2.99Å
439	S	91.3	Very high	89.7	Confident	42 Å²	42	92.1 Å²	92.1	29%	0.294	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-41	176.7	-170.3	0	0	0	0	111.6	D435 E436 A437 F442 L443	D435-S439 WeakPolarHBondContact O-CB 3.26Å; D435-S439 PolarHBondContact O-N 3.26Å; E436-S439 PolarHBondContact O-N 3.39Å; A437-S439 VanDerWaalsContact C-N 3.32Å; A437-S439 PolarHBondContact O-N 3.22Å; S439-F442 PolarHBondContact O-N 3.42Å; S439-L443 VanDerWaalsContact O-CG 3.27Å; S439-L443 WeakPolarHBondContact O-CG 3.19Å; S439-L443 PolarHBondContact O-N 3.02Å
440	T	90.2	Very high	89.2	Confident	61 Å²	61	96.2 Å²	96.2	37%	0.374	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-39.7	178.4	-58.3	0	0	0	0	111.5	E436 A437 R438 L443 K444	E436-T440 WeakPolarHBondContact O-CB 3.17Å; E436-T440 PolarHBondContact O-N 2.89Å; E436-T440 PolarHBondContact O-OG1 2.88Å; A437-T440 PolarHBondContact O-N 3.21Å; R438-T440 VanDerWaalsContact C-N 3.34Å; R438-T440 PolarHBondContact O-N 3.37Å; T440-L443 PolarHBondContact O-N 3.27Å; T440-K444 WeakPolarHBondContact O-CG 3.43Å; T440-K444 PolarHBondContact O-N 3.47Å; T440-K444 VanDerWaalsContact O-N 3.11Å
441	L	90.4	Very high	88.7	Confident	101 Å²	101	100.6 Å²	100.6	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-46.5	174.6	-72.7	167.9	0	0	0	111.2	A437 R438 L443 K444 E445	A437-L441 WeakPolarHBondContact O-CG 3.45Å; A437-L441 PolarHBondContact O-N 3.49Å; R438-L441 PolarHBondContact O-N 2.92Å; L441-L443 VanDerWaalsContact C-N 3.33Å; L441-L443 PolarHBondContact O-N 3.38Å; L441-K444 WeakPolarHBondContact O-CB 3.27Å; L441-K444 PolarHBondContact O-N 3.02Å; L441-K444 VanDerWaalsContact O-N 3.1Å; L441-E445 PolarHBondContact O-N 2.97Å
442	F	89.4	Confident	88	Confident	80 Å²	80	105.6 Å²	105.6	35%	0.351	51%	0.509	S	S	.	.	H	α-helix	trans	-58.3	-44.5	175.5	-174.6	-92.9	0	0	0	111.8	R438 S439 K444 E445 Y446 F450	R438-F442 WeakPolarHBondContact O-CB 3.41Å; R438-F442 PolarHBondContact O-N 2.99Å; S439-F442 PolarHBondContact O-N 3.42Å; F442-K444 VanDerWaalsContact C-N 3.26Å; F442-K444 PolarHBondContact O-N 2.9Å; F442-E445 PolarHBondContact O-N 3.3Å; F442-Y446 HydrophobicContact CD1-CD2 4.16Å; F442-Y446 AromaticContact CD2-CD2 3.82Å; F442-Y446 HydrophobicContact CD2-CD2 3.82Å; F442-Y446 AromaticContact CD2-CE2 3.65Å; F442-Y446 HydrophobicContact CD2-CE2 3.65Å; F442-Y446 AromaticContact CE1-CD2 3.91Å; F442-Y446 HydrophobicContact CE1-CD2 3.91Å; F442-Y446 HydrophobicContact CE1-CE2 4.37Å; F442-Y446 HydrophobicContact CE1-CG 4.45Å; F442-Y446 AromaticContact CE2-CD2 3.56Å; F442-Y446 HydrophobicContact CE2-CD2 3.56Å; F442-Y446 AromaticContact CE2-CE2 3.2Å; F442-Y446 HydrophobicContact CE2-CE2 3.2Å; F442-Y446 HydrophobicContact CG-CD2 4.12Å; F442-Y446 HydrophobicContact CG-CE2 4.41Å; F442-Y446 AromaticContact CZ-CD2 3.6Å; F442-Y446 HydrophobicContact CZ-CD2 3.6Å; F442-Y446 AromaticContact CZ-CE2 3.61Å; F442-Y446 HydrophobicContact CZ-CE2 3.61Å; F442-Y446 HydrophobicContact CZ-CG 4.27Å; F442-Y446 WeakPolarHBondContact O-CD2 3.46Å; F442-Y446 PolarHBondContact O-N 3.05Å; F442-F450 HydrophobicContact CE1-CZ 4.4Å
443	L	88.4	Confident	86.7	Confident	78 Å²	78	102.6 Å²	102.6	41%	0.408	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-33.1	176.5	-71.9	175.6	0	0	0	113.1	S439 T440 L441 Q447 F450	S439-L443 VanDerWaalsContact O-CG 3.27Å; S439-L443 WeakPolarHBondContact O-CG 3.19Å; S439-L443 PolarHBondContact O-N 3.02Å; T440-L443 PolarHBondContact O-N 3.27Å; L441-L443 VanDerWaalsContact C-N 3.33Å; L441-L443 PolarHBondContact O-N 3.38Å; L443-Q447 WeakPolarHBondContact O-CA 3.37Å; L443-Q447 PolarHBondContact O-N 3.18Å; L443-F450 HydrophobicContact CD2-CD1 4.3Å; L443-F450 HydrophobicContact CD2-CD2 3.82Å; L443-F450 HydrophobicContact CD2-CE1 3.91Å; L443-F450 HydrophobicContact CD2-CE2 3.37Å; L443-F450 HydrophobicContact CD2-CG 4.28Å; L443-F450 HydrophobicContact CD2-CZ 3.45Å; L443-F450 VanDerWaalsContact CD2-CZ 3.45Å
444	K	86.7	Confident	85.1	Confident	132 Å²	132	106.2 Å²	106.2	57%	0.574	51%	0.512	S	S	*	.	H	α-helix	trans	-72.4	-39	175.5	-73.4	177.4	178.5	-176.1	0	112.4	T440 L441 F442 Q447	T440-K444 WeakPolarHBondContact O-CG 3.43Å; T440-K444 PolarHBondContact O-N 3.47Å; T440-K444 VanDerWaalsContact O-N 3.11Å; L441-K444 WeakPolarHBondContact O-CB 3.27Å; L441-K444 PolarHBondContact O-N 3.02Å; L441-K444 VanDerWaalsContact O-N 3.1Å; F442-K444 VanDerWaalsContact C-N 3.26Å; F442-K444 PolarHBondContact O-N 2.9Å; K444-Q447 WeakPolarHBondContact O-CB 3.36Å; K444-Q447 PolarHBondContact O-N 3.1Å
445	E	88.5	Confident	83.6	Confident	150 Å²	150	106.9 Å²	106.9	70%	0.701	52%	0.517	S	S	*	.	H	α-helix	trans	-66.2	-41.6	178.3	-71.9	176.3	178.1	0	0	111.7	L441 F442 Q447	L441-E445 PolarHBondContact O-N 2.97Å; F442-E445 PolarHBondContact O-N 3.3Å; E445-Q447 VanDerWaalsContact C-N 3.32Å; E445-Q447 PolarHBondContact O-N 3.17Å
446	Y	86.3	Confident	81.6	Confident	94 Å²	94	111 Å²	111	37%	0.369	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	23.8	-179.5	-66.1	-88.1	0	0	0	112.6	F442 Q448 E449 F450	F442-Y446 HydrophobicContact CD1-CD2 4.16Å; F442-Y446 AromaticContact CD2-CD2 3.82Å; F442-Y446 HydrophobicContact CD2-CD2 3.82Å; F442-Y446 AromaticContact CD2-CE2 3.65Å; F442-Y446 HydrophobicContact CD2-CE2 3.65Å; F442-Y446 AromaticContact CE1-CD2 3.91Å; F442-Y446 HydrophobicContact CE1-CD2 3.91Å; F442-Y446 HydrophobicContact CE1-CE2 4.37Å; F442-Y446 HydrophobicContact CE1-CG 4.45Å; F442-Y446 AromaticContact CE2-CD2 3.56Å; F442-Y446 HydrophobicContact CE2-CD2 3.56Å; F442-Y446 AromaticContact CE2-CE2 3.2Å; F442-Y446 HydrophobicContact CE2-CE2 3.2Å; F442-Y446 HydrophobicContact CG-CD2 4.12Å; F442-Y446 HydrophobicContact CG-CE2 4.41Å; F442-Y446 AromaticContact CZ-CD2 3.6Å; F442-Y446 HydrophobicContact CZ-CD2 3.6Å; F442-Y446 AromaticContact CZ-CE2 3.61Å; F442-Y446 HydrophobicContact CZ-CE2 3.61Å; F442-Y446 HydrophobicContact CZ-CG 4.27Å; F442-Y446 WeakPolarHBondContact O-CD2 3.46Å; F442-Y446 PolarHBondContact O-N 3.05Å; Y446-Q448 PolarHBondContact O-N 3.03Å; Y446-E449 PolarHBondContact O-N 3.41Å; Y446-F450 WeakPolarHBondContact O-CD2 3.37Å
447	Q	81.2	Confident	79.4	Confident	68 Å²	68	112 Å²	112	32%	0.318	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.6	-34.1	-175.6	-172.7	179.1	-8.6	0	0	111.9	L443 K444 E445 E449 N453	L443-Q447 WeakPolarHBondContact O-CA 3.37Å; L443-Q447 PolarHBondContact O-N 3.18Å; K444-Q447 WeakPolarHBondContact O-CB 3.36Å; K444-Q447 PolarHBondContact O-N 3.1Å; E445-Q447 VanDerWaalsContact C-N 3.32Å; E445-Q447 PolarHBondContact O-N 3.17Å; Q447-E449 VanDerWaalsContact C-N 3.28Å; Q447-E449 PolarHBondContact O-N 3.21Å; Q447-N453 HydrophobicContact CG-CB 3.44Å; Q447-N453 VanDerWaalsContact CG-CB 3.44Å; Q447-N453 PolarHBondContact NE2-O 3.35Å; Q447-N453 PolarHBondContact O-ND2 3.16Å; Q447-N453 PolarHBondContact O-OD1 2.85Å
448	Q	80.5	Confident	77	Confident	195 Å²	195	116.7 Å²	116.7	91%	0.911	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-19.4	-179.6	-64.3	-178.5	-2.1	0	0	114.5	Y446	Y446-Q448 PolarHBondContact O-N 3.03Å
449	E	86.5	Confident	74.2	Confident	149 Å²	149	121.7 Å²	121.7	70%	0.696	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-20.9	-178.5	-61.6	-175.6	-177.5	0	0	112.7	Y446 Q447	Y446-E449 PolarHBondContact O-N 3.41Å; Q447-E449 VanDerWaalsContact C-N 3.28Å; Q447-E449 PolarHBondContact O-N 3.21Å
450	F	85.6	Confident	71.5	Confident	85 Å²	85	125.3 Å²	125.3	37%	0.373	62%	0.615	S	S	.	*	S	Bend	trans	-81.5	167.1	177.1	-66	-66.1	0	0	0	111.5	F442 L443 Y446 N453	F442-F450 HydrophobicContact CE1-CZ 4.4Å; L443-F450 HydrophobicContact CD2-CD1 4.3Å; L443-F450 HydrophobicContact CD2-CD2 3.82Å; L443-F450 HydrophobicContact CD2-CE1 3.91Å; L443-F450 HydrophobicContact CD2-CE2 3.37Å; L443-F450 HydrophobicContact CD2-CG 4.28Å; L443-F450 HydrophobicContact CD2-CZ 3.45Å; L443-F450 VanDerWaalsContact CD2-CZ 3.45Å; Y446-F450 WeakPolarHBondContact O-CD2 3.37Å; F450-N453 WeakPolarHBondContact CB-OD1 3.17Å; F450-N453 PolarHBondContact O-ND2 2.83Å; F450-N453 PolarHBondContact O-OD1 2.96Å
451	M	81.8	Confident	68.8	Low	155 Å²	155	127.3 Å²	127.3	76%	0.764	63%	0.632	S	S	*	*	S	Bend	trans	-99.2	147.4	177.1	-65.6	-159.7	-66.2	0	0	110.9	N453	M451-N453 PolarHBondContact N-OD1 3.22Å; M451-N453 PolarHBondContact O-OD1 3.06Å
452	F	79.1	Confident	66	Low	191 Å²	191	130.7 Å²	130.7	84%	0.838	65%	0.648	S	S	*	*			trans	65.5	38.1	176.3	-48.7	-74.5	0	0	0	115	E454	F452-E454 PolarHBondContact O-N 3.02Å
453	N	66.3	Low	63.5	Low	51 Å²	51	132 Å²	132	27%	0.273	67%	0.668	S	S	.	*			trans	-83.1	34.7	-171.5	-28.5	-60.5	0	0	0	114.4	Q447 F450 M451 I455	Q447-N453 HydrophobicContact CG-CB 3.44Å; Q447-N453 VanDerWaalsContact CG-CB 3.44Å; Q447-N453 PolarHBondContact NE2-O 3.35Å; Q447-N453 PolarHBondContact O-ND2 3.16Å; Q447-N453 PolarHBondContact O-OD1 2.85Å; F450-N453 WeakPolarHBondContact CB-OD1 3.17Å; F450-N453 PolarHBondContact O-ND2 2.83Å; F450-N453 PolarHBondContact O-OD1 2.96Å; M451-N453 PolarHBondContact N-OD1 3.22Å; M451-N453 PolarHBondContact O-OD1 3.06Å; N453-I455 PolarHBondContact O-N 3.47Å
454	E	59.5	Low	60.7	Low	183 Å²	183	131.4 Å²	131.4	86%	0.855	68%	0.681	S	S	*	*			trans	-75.6	54.2	176	-62.9	-177	176.8	0	0	110.9	F452 S456	F452-E454 PolarHBondContact O-N 3.02Å; E454-S456 PolarHBondContact O-N 3.5Å; E454-S456 VanDerWaalsContact O-N 3.16Å
455	I	58.4	Low	58.3	Low	121 Å²	121	132.5 Å²	132.5	62%	0.621	69%	0.693	S	S	*	*			trans	-76.8	101.5	166.6	-58.4	175.5	0	0	0	106.2	N453 E457	N453-I455 PolarHBondContact O-N 3.47Å; I455-E457 PolarHBondContact O-N 3.2Å
456	S	51.5	Low	55.7	Low	100 Å²	100	135 Å²	135	70%	0.699	70%	0.701	S	S	*	*			trans	-58	126.7	169.1	-15.4	0	0	0	0	108	E454 I458	E454-S456 PolarHBondContact O-N 3.5Å; E454-S456 VanDerWaalsContact O-N 3.16Å; S456-I458 PolarHBondContact O-N 3.43Å
457	E	43.8	Very low	53.3	Low	189 Å²	189	137 Å²	137	88%	0.883	72%	0.718	S	S	*	*			trans	-50.2	108.3	174	-70	179.9	159.6	0	0	109.7	I455 Q459	I455-E457 PolarHBondContact O-N 3.2Å; E457-Q459 PolarHBondContact O-N 3.4Å
458	I	41.6	Very low	51.1	Low	158 Å²	158	141 Å²	141	81%	0.81	74%	0.741	S	S	*	*			trans	-68.9	104.4	171.2	-61.3	173.4	0	0	0	105.9	S456	S456-I458 PolarHBondContact O-N 3.43Å
459	Q	30.9	Very low	49.2	Very low	173 Å²	173	140.4 Å²	140.4	81%	0.808	77%	0.769	S	S	*	*			trans	-52.6	130.6	172.2	-74	-178	-18.4	0	0	109.6	E457 S461	E457-Q459 PolarHBondContact O-N 3.4Å; Q459-S461 PolarHBondContact O-N 2.69Å
460	P	34.8	Very low	47.3	Very low	117 Å²	117	140 Å²	140	76%	0.76	77%	0.773	S	S	*	*			trans	-63.8	122.3	174.4	25.2	-30.2	0	0	0	108.8	I462	P460-I462 PolarHBondContact O-N 2.67Å
461	S	33.5	Very low	45.3	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	79%	0.794	S	S	*	*			trans	-56.6	111.2	173.5	52.1	0	0	0	0	109.7	Q459 S463	Q459-S461 PolarHBondContact O-N 2.69Å; S461-S463 VanDerWaalsContact C-N 3.3Å; S461-S463 PolarHBondContact O-N 3.36Å
462	I	33	Very low	43.3	Very low	171 Å²	171	142.2 Å²	142.2	88%	0.877	80%	0.796	S	S	*	*			trans	-64.3	93.9	167.6	-58.7	170.3	0	0	0	106.6	P460	P460-I462 PolarHBondContact O-N 2.67Å
463	S	35.6	Very low	41.2	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	79%	0.793	S	S	*	*			trans	-92.6	108.8	163	39.3	0	0	0	0	106.4	S461	S461-S463 VanDerWaalsContact C-N 3.3Å; S461-S463 PolarHBondContact O-N 3.36Å
464	G	30.5	Very low	39.6	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	83%	0.826	S	S	*	*			trans	-70.3	131.3	176.5	0	0	0	0	0	110.6
465	D	36.2	Very low	38.3	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	82%	0.824	S	S	*	*			trans	-113.1	98.6	150.9	-92.5	-31.7	0	0	0	108.2	L467	D465-L467 PolarHBondContact O-N 2.91Å
466	K	33.1	Very low	36.9	Very low	202 Å²	202	143.8 Å²	143.8	88%	0.878	84%	0.839	S	S	*	*			trans	-68.2	106.2	147.8	-76.4	178.6	175	178.8	0	106.3
467	L	36.3	Very low	35.7	Very low	137 Å²	137	147.2 Å²	147.2	72%	0.717	85%	0.849	S	S	*	*			trans	-163.5	95.2	155.2	-103.3	134.4	0	0	0	111.2	D465	D465-L467 PolarHBondContact O-N 2.91Å
468	N	34.2	Very low	35.1	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	85%	0.846	S	S	*	*			trans	70.6	128.3	136.8	-61.5	-11.4	0	0	0	121.8
469	A	41.1	Very low	34.5	Very low	183 Å²	183	142.4 Å²	142.4	100%	1.512	85%	0.85	S	S	*	*			trans	82.9	0	165.6	0	0	0	0	0	117

Retrieved 469 of 469 residues in 639.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).