A0A087WQU9_MOUSE Loading...

MAGUK p55 subfamily member 4

May play a role in retinal photoreceptors development.

AlphaFold DB , UniProt , Accession A0A087WQU9, Species MOUSE (Mus musculus, Mouse), Gene Mpp4, Length 591 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	29	Very low	241 Å²	241	159.6 Å²	159.6	100%	1.187	84%	0.84	S	S	*	*				0	100.8	0	-170.8	166.1	154.5	0	0	106.7
2	R	32.3	Very low	29.1	Very low	235 Å²	235	159.4 Å²	159.4	89%	0.887	84%	0.84	S	S	*	*			trans	58.7	117.7	-173.4	-61.8	-177.8	174.2	175.4	-2.8	114.9
3	Q	25.7	Very low	29.1	Very low	181 Å²	181	162.5 Å²	162.5	85%	0.846	85%	0.847	S	S	*	*				56.5	134.3	53.9	-68.6	-178.8	-44.1	0	0	112.2
4	S	28.7	Very low	29	Very low	88 Å²	88	162.1 Å²	162.1	62%	0.615	85%	0.847	S	S	*	*			cis	-172.7	175.4	4.2	-105.3	0	0	0	0	109
5	D	26.1	Very low	29.2	Very low	116 Å²	116	167.3 Å²	167.3	62%	0.62	85%	0.851	S	S	*	*			cis	-151.8	174	0.4	-130.4	17.2	0	0	0	114.6
6	R	31.6	Very low	29.1	Very low	229 Å²	229	162.6 Å²	162.6	86%	0.864	84%	0.844	S	S	*	*			trans	17.6	147.6	143.5	-63.7	173.6	-171.8	-128	-4.8	123.6
7	G	25.5	Very low	29.3	Very low	82 Å²	82	162.2 Å²	162.2	85%	0.845	84%	0.843	S	S	*	*			trans	164	80.3	151.3	0	0	0	0	0	115
8	A	31.4	Very low	29.4	Very low	104 Å²	104	160.1 Å²	160.1	86%	0.86	84%	0.841	S	S	*	*			trans	-109.9	108.6	163.9	0	0	0	0	0	108.3
9	E	25.4	Very low	29.6	Very low	184 Å²	184	158.2 Å²	158.2	86%	0.86	84%	0.837	S	S	*	*			trans	-150.7	119.2	174.5	-125.3	160.8	-155.4	0	0	110.4
10	L	32.4	Very low	29.8	Very low	179 Å²	179	156.1 Å²	156.1	94%	0.937	83%	0.832	S	S	*	*			trans	-96.5	103.9	171.8	-83.8	158.2	0	0	0	107.6
11	T	26.6	Very low	30	Very low	117 Å²	117	154.2 Å²	154.2	72%	0.718	83%	0.829	S	S	*	*			trans	-143.5	133.2	166.4	47	0	0	0	0	112.3
12	N	30.8	Very low	30.2	Very low	157 Å²	157	149 Å²	149	84%	0.84	81%	0.806	S	S	*	*			trans	10.2	122.1	159.8	-59.8	-16.8	0	0	0	119.4
13	E	29	Very low	30.6	Very low	199 Å²	199	143.9 Å²	143.9	93%	0.93	80%	0.803	S	S	*	*			trans	-120.7	156.5	131.3	-78.8	-150.4	142.6	0	0	110.2
14	D	27.6	Very low	31.3	Very low	158 Å²	158	144 Å²	144	85%	0.845	80%	0.804	S	S	*	*			trans	-72.8	153.7	-154.8	-80.1	-62	0	0	0	116.3	A16	D14-A16 PolarHBondContact O-N 3.23Å
15	R	32.3	Very low	32.1	Very low	240 Å²	240	145.7 Å²	145.7	91%	0.906	81%	0.806	S	S	*	*			trans	-64.7	86	156	-82.6	-179.6	167.7	172.8	-4	109.6	L17	R15-L17 PolarHBondContact O-N 2.95Å; R15-L17 VanDerWaalsContact O-N 3.15Å
16	A	28	Very low	33.5	Very low	91 Å²	91	142 Å²	142	75%	0.752	80%	0.795	S	S	*	*			trans	-60.8	113.3	155	0	0	0	0	0	108	D14	D14-A16 PolarHBondContact O-N 3.23Å
17	L	31.4	Very low	34.6	Very low	157 Å²	157	136.2 Å²	136.2	82%	0.822	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.9	135	170.3	-76.4	98.6	0	0	0	108.6	R15 T19	R15-L17 PolarHBondContact O-N 2.95Å; R15-L17 VanDerWaalsContact O-N 3.15Å; L17-T19 PolarHBondContact O-N 3.46Å
18	P	31.9	Very low	35.7	Very low	123 Å²	123	136.8 Å²	136.8	80%	0.799	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-62.8	126.2	169.3	27.1	-32.3	0	0	0	108.5
19	T	32.4	Very low	36.8	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-52.5	144	171.6	39.8	0	0	0	0	110.6	L17	L17-T19 PolarHBondContact O-N 3.46Å
20	P	33.1	Very low	38.2	Very low	115 Å²	115	126.7 Å²	126.7	75%	0.747	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-59.1	131.5	177.2	26.4	-33.9	0	0	0	109.3
21	P	35.1	Very low	39.3	Very low	117 Å²	117	123 Å²	123	76%	0.76	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.2	141.6	178.2	26.9	-31.7	0	0	0	110.4
22	D	36.1	Very low	40.8	Very low	132 Å²	132	126.2 Å²	126.2	71%	0.706	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.4	146.8	-179	-72.5	-62.3	0	0	0	113.1	E24	D22-E24 PolarHBondContact O-N 3.39Å
23	P	42.1	Very low	42	Very low	127 Å²	127	124.1 Å²	124.1	83%	0.825	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	1.6	-174.2	29.6	-36.3	0	0	0	115
24	E	39.8	Very low	43.2	Very low	184 Å²	184	115.6 Å²	115.6	86%	0.86	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.6	-176.8	-64.6	-152.3	143.2	0	0	115	D22 G26	D22-E24 PolarHBondContact O-N 3.39Å; E24-G26 VanDerWaalsContact C-N 3.27Å; E24-G26 PolarHBondContact O-N 2.95Å
25	N	45.7	Very low	44.7	Very low	124 Å²	124	114.3 Å²	114.3	66%	0.663	64%	0.635	S	S	*	*			trans	-78.7	75.2	173.2	-83.1	-40.2	0	0	0	111.8
26	G	56.3	Low	46	Very low	38 Å²	38	108.9 Å²	108.9	39%	0.392	62%	0.619	S	S	.	*			trans	-63.8	179.3	173.3	0	0	0	0	0	114.2	E24 S28 G29	E24-G26 VanDerWaalsContact C-N 3.27Å; E24-G26 PolarHBondContact O-N 2.95Å; G26-S28 PolarHBondContact O-N 3.42Å; G26-G29 PolarHBondContact O-N 3.44Å
27	L	53.2	Low	47.4	Very low	107 Å²	107	107.3 Å²	107.3	56%	0.56	60%	0.597	S	S	*	*	H	α-helix	trans	-47.3	-31.9	-177.8	-79	162.2	0	0	0	114.7	I30 L31 V67	L27-I30 PolarHBondContact O-N 2.55Å; L27-L31 WeakPolarHBondContact O-CB 3.16Å; L27-L31 WeakPolarHBondContact O-CG 3.37Å; L27-L31 PolarHBondContact O-N 3.28Å; L27-V67 HydrophobicContact CD2-CG1 3.97Å; L27-V67 HydrophobicContact CD2-CG2 3.67Å
28	S	49.5	Very low	48.5	Very low	94 Å²	94	103.1 Å²	103.1	66%	0.657	57%	0.574	S	S	*	*	H	α-helix	trans	-63.8	-38.1	177	53.7	0	0	0	0	113.7	G26 R32	G26-S28 PolarHBondContact O-N 3.42Å; S28-R32 WeakPolarHBondContact O-CB 3.42Å; S28-R32 PolarHBondContact O-N 3.45Å
29	G	53.7	Low	49.7	Very low	21 Å²	21	101.1 Å²	101.1	22%	0.216	56%	0.563	C	S	.	*	H	α-helix	trans	-67.3	-41.4	176.5	0	0	0	0	0	111.8	G26 R32 L33	G26-G29 PolarHBondContact O-N 3.44Å; G29-R32 PolarHBondContact O-N 3.46Å; G29-L33 WeakPolarHBondContact O-CG 3.32Å; G29-L33 PolarHBondContact O-N 2.88Å
30	I	56.4	Low	50.9	Low	56 Å²	56	100.7 Å²	100.7	29%	0.287	56%	0.556	S	S	.	*	H	α-helix	trans	-63.4	-47.3	176.2	-61.3	172.9	0	0	0	110.6	L27 R32 L33 L34 A63	L27-I30 PolarHBondContact O-N 2.55Å; I30-R32 VanDerWaalsContact C-N 3.31Å; I30-R32 PolarHBondContact O-N 3.44Å; I30-L33 PolarHBondContact O-N 2.95Å; I30-L34 HydrophobicContact CG2-CD1 4.17Å; I30-L34 PolarHBondContact O-N 3.05Å; I30-A63 HydrophobicContact CG2-CB 3.79Å
31	L	53.5	Low	51.9	Low	100 Å²	100	99.4 Å²	99.4	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-62.3	-34.1	177.1	-76.2	164.8	0	0	0	113.1	L27 L34 L35	L27-L31 WeakPolarHBondContact O-CB 3.16Å; L27-L31 WeakPolarHBondContact O-CG 3.37Å; L27-L31 PolarHBondContact O-N 3.28Å; L31-L34 HydrophobicContact CD2-CD1 4.37Å; L31-L34 WeakPolarHBondContact O-CB 3.36Å; L31-L35 PolarHBondContact O-N 3.14Å
32	R	58	Low	52.7	Low	185 Å²	185	104.2 Å²	104.2	70%	0.698	54%	0.543	S	S	*	.	H	α-helix	trans	-71	-38	178.1	-157.8	-178.7	79.8	173.6	3.7	112.6	S28 G29 I30 Q36	S28-R32 WeakPolarHBondContact O-CB 3.42Å; S28-R32 PolarHBondContact O-N 3.45Å; G29-R32 PolarHBondContact O-N 3.46Å; I30-R32 VanDerWaalsContact C-N 3.31Å; I30-R32 PolarHBondContact O-N 3.44Å; R32-Q36 PolarHBondContact O-N 3.49Å
33	L	57	Low	53.6	Low	114 Å²	114	102.1 Å²	102.1	60%	0.597	54%	0.539	S	S	*	.	H	α-helix	trans	-66.9	-43.4	174.8	-69.3	167.7	0	0	0	111.3	G29 I30 L35 Q36 E37	G29-L33 WeakPolarHBondContact O-CG 3.32Å; G29-L33 PolarHBondContact O-N 2.88Å; I30-L33 PolarHBondContact O-N 2.95Å; L33-L35 PolarHBondContact O-N 2.96Å; L33-Q36 PolarHBondContact O-N 2.93Å; L33-Q36 VanDerWaalsContact O-N 3.16Å; L33-E37 PolarHBondContact O-N 3.43Å
34	L	55.1	Low	54.1	Low	20 Å²	20	105.6 Å²	105.6	11%	0.105	54%	0.536	C	S	.	.	H	α-helix	trans	-48.8	-53.2	173.2	-103.6	151.5	0	0	0	112.9	I30 L31 Q36 E37 L38 W60 L64	I30-L34 HydrophobicContact CG2-CD1 4.17Å; I30-L34 PolarHBondContact O-N 3.05Å; L31-L34 HydrophobicContact CD2-CD1 4.37Å; L31-L34 WeakPolarHBondContact O-CB 3.36Å; L34-Q36 VanDerWaalsContact C-N 3.29Å; L34-Q36 PolarHBondContact O-N 3.03Å; L34-E37 PolarHBondContact O-N 3.28Å; L34-L38 VanDerWaalsContact O-CG 3.3Å; L34-L38 WeakPolarHBondContact O-CG 3.48Å; L34-L38 PolarHBondContact O-N 3.43Å; L34-L38 VanDerWaalsContact O-N 3.15Å; L34-W60 HydrophobicContact CD2-CB 3.67Å; L34-W60 HydrophobicContact CD2-CD2 4.18Å; L34-W60 HydrophobicContact CD2-CE3 3.74Å; L34-W60 HydrophobicContact CD2-CG 4.21Å; L34-W60 HydrophobicContact CG-CB 3.91Å; L34-L64 HydrophobicContact CD2-CD1 4.13Å
35	L	58.5	Low	54.7	Low	131 Å²	131	105.1 Å²	105.1	69%	0.686	54%	0.539	S	S	*	.	H	α-helix	trans	-63.8	-33.2	-178.8	-80.1	162.6	0	0	0	113.1	L31 L33	L31-L35 PolarHBondContact O-N 3.14Å; L33-L35 PolarHBondContact O-N 2.96Å
36	Q	59.1	Low	55	Low	125 Å²	125	102.7 Å²	102.7	58%	0.584	53%	0.528	S	S	*	.	H	α-helix	trans	-76.7	-38.6	-177.8	-154.1	166.9	7.4	0	0	111.5	R32 L33 L34 S39	R32-Q36 PolarHBondContact O-N 3.49Å; L33-Q36 PolarHBondContact O-N 2.93Å; L33-Q36 VanDerWaalsContact O-N 3.16Å; L34-Q36 VanDerWaalsContact C-N 3.29Å; L34-Q36 PolarHBondContact O-N 3.03Å; Q36-S39 PolarHBondContact O-OG 3.04Å
37	E	57.4	Low	55.1	Low	59 Å²	59	107.3 Å²	107.3	28%	0.276	54%	0.544	S	S	.	.	H	α-helix	trans	-74.3	-36.9	-179.5	-157.8	168.1	-134.1	0	0	112.6	L33 L34 S39 L40 F41 W60	L33-E37 PolarHBondContact O-N 3.43Å; L34-E37 PolarHBondContact O-N 3.28Å; E37-S39 PolarHBondContact O-N 3.01Å; E37-L40 PolarHBondContact O-N 3.4Å; E37-L40 VanDerWaalsContact O-N 3.14Å; E37-F41 PolarHBondContact O-N 3.34Å; E37-W60 WeakPolarHBondContact OE2-CB 3.31Å; E37-W60 PolarHBondContact OE2-N 3.32Å
38	L	55.3	Low	55.4	Low	68 Å²	68	104.4 Å²	104.4	36%	0.356	54%	0.54	S	S	.	.	H	α-helix	trans	-59.3	-32.9	174.3	-75.1	168.4	0	0	0	113.1	L34 L40 F41 W60	L34-L38 VanDerWaalsContact O-CG 3.3Å; L34-L38 WeakPolarHBondContact O-CG 3.48Å; L34-L38 PolarHBondContact O-N 3.43Å; L34-L38 VanDerWaalsContact O-N 3.15Å; L38-L40 VanDerWaalsContact C-N 3.26Å; L38-L40 PolarHBondContact O-N 3.16Å; L38-F41 PolarHBondContact O-N 2.94Å; L38-W60 HydrophobicContact CD2-CZ2 4.34Å
39	S	57.1	Low	55.7	Low	81 Å²	81	107 Å²	107	57%	0.566	55%	0.546	S	S	*	.	H	α-helix	trans	-66.4	-26	178.6	76.3	0	0	0	0	113.6	Q36 E37	Q36-S39 PolarHBondContact O-OG 3.04Å; E37-S39 PolarHBondContact O-N 3.01Å
40	L	56.6	Low	55.8	Low	117 Å²	117	109.2 Å²	109.2	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-84.7	-33.5	-179	-68.2	167.1	0	0	0	112.1	E37 L38 Y42 S43	E37-L40 PolarHBondContact O-N 3.4Å; E37-L40 VanDerWaalsContact O-N 3.14Å; L38-L40 VanDerWaalsContact C-N 3.26Å; L38-L40 PolarHBondContact O-N 3.16Å; L40-Y42 VanDerWaalsContact C-N 3.35Å; L40-Y42 PolarHBondContact O-N 3.27Å; L40-S43 PolarHBondContact O-N 2.96Å; L40-S43 PolarHBondContact O-OG 2.98Å
41	F	54.1	Low	56.1	Low	87 Å²	87	110.2 Å²	110.2	38%	0.382	56%	0.563	S	S	.	*	H	α-helix	trans	-67.7	-29.2	-177.8	-101.5	-88.3	0	0	0	114.1	E37 L38 S43 D54	E37-F41 PolarHBondContact O-N 3.34Å; L38-F41 PolarHBondContact O-N 2.94Å; F41-S43 PolarHBondContact O-N 3.39Å; F41-S43 VanDerWaalsContact O-N 3.11Å; F41-D54 HydrophobicContact CE1-CB 4.47Å; F41-D54 HydrophobicContact CZ-CB 4.35Å
42	Y	53.4	Low	56.3	Low	219 Å²	219	110.2 Å²	110.2	86%	0.859	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-8.4	177.4	-97.7	-86.3	0	0	0	114.7	L40	L40-Y42 VanDerWaalsContact C-N 3.35Å; L40-Y42 PolarHBondContact O-N 3.27Å
43	S	52.9	Low	56.8	Low	88 Å²	88	108.4 Å²	108.4	62%	0.615	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	5	-169.4	70.5	0	0	0	0	115.8	L40 F41	L40-S43 PolarHBondContact O-N 2.96Å; L40-S43 PolarHBondContact O-OG 2.98Å; F41-S43 PolarHBondContact O-N 3.39Å; F41-S43 VanDerWaalsContact O-N 3.11Å
44	R	53.3	Low	57.2	Low	199 Å²	199	106.6 Å²	106.6	75%	0.751	55%	0.548	S	S	*	.			trans	-129.2	118.3	-174	-69.5	-171.8	172.9	-172.1	-2.4	113.6	V46	R44-V46 HydrophobicContact CB-CG2 3.98Å; R44-V46 PolarHBondContact O-N 3.07Å
45	D	52.2	Low	57.8	Low	174 Å²	174	108.5 Å²	108.5	93%	0.93	56%	0.558	S	S	*	*			trans	-77.8	105.6	169.2	-175.1	20.5	0	0	0	110
46	V	52.2	Low	58.3	Low	73 Å²	73	106.5 Å²	106.5	44%	0.442	55%	0.547	S	S	.	.			trans	-144.7	139.8	-179.2	-157.2	0	0	0	0	112.6	R44 C50	R44-V46 HydrophobicContact CB-CG2 3.98Å; R44-V46 PolarHBondContact O-N 3.07Å; V46-C50 HydrophobicContact CG1-CB 4.39Å
47	N	59.3	Low	58.9	Low	136 Å²	136	106 Å²	106	73%	0.727	55%	0.545	S	S	*	.			trans	-48.2	131	-178	-153.4	-6.3	0	0	0	114.3	L49 C50 L51	N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3.17Å; N47-C50 PolarHBondContact O-N 3.09Å; N47-L51 PolarHBondContact O-N 3.31Å
48	G	58.8	Low	59.6	Low	46 Å²	46	103.3 Å²	103.3	47%	0.474	53%	0.532	S	S	.	.	H	α-helix	trans	-61.7	-21.9	-160.1	0	0	0	0	0	117.6	L52	G48-L52 PolarHBondContact O-N 3.5Å; G48-L52 VanDerWaalsContact O-N 3.12Å
49	L	55.1	Low	60.1	Low	149 Å²	149	104.1 Å²	104.1	78%	0.78	54%	0.542	S	S	*	.	H	α-helix	trans	-74.1	-35	174.6	-89.3	164.2	0	0	0	113.1	N47 Y53	N47-L49 VanDerWaalsContact C-N 3.3Å; N47-L49 PolarHBondContact O-N 3.17Å; L49-Y53 PolarHBondContact O-N 3.44Å
50	C	56.9	Low	60.6	Low	66 Å²	66	102.1 Å²	102.1	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-70.2	-43.8	173.5	-63.8	0	0	0	0	109.6	V46 N47 L52 Y53 D54	V46-C50 HydrophobicContact CG1-CB 4.39Å; N47-C50 PolarHBondContact O-N 3.09Å; C50-L52 VanDerWaalsContact C-N 3.28Å; C50-L52 PolarHBondContact O-N 3Å; C50-Y53 WeakPolarHBondContact O-CB 3.2Å; C50-Y53 PolarHBondContact O-N 3.28Å; C50-D54 WeakPolarHBondContact O-CB 3.39Å; C50-D54 VanDerWaalsContact O-CG 3.25Å; C50-D54 PolarHBondContact O-N 2.9Å
51	L	62.3	Low	61.4	Low	78 Å²	78	98.2 Å²	98.2	41%	0.408	50%	0.502	S	S	.	.	H	α-helix	trans	-57.5	-39.3	177.6	-162.7	145.8	0	0	0	112.4	N47 L55	N47-L51 PolarHBondContact O-N 3.31Å; L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 PolarHBondContact O-N 3.44Å
52	L	58.4	Low	62.4	Low	99 Å²	99	98.2 Å²	98.2	52%	0.518	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-40.3	174.2	-119.1	160.1	0	0	0	113	G48 C50 L56	G48-L52 PolarHBondContact O-N 3.5Å; G48-L52 VanDerWaalsContact O-N 3.12Å; C50-L52 VanDerWaalsContact C-N 3.28Å; C50-L52 PolarHBondContact O-N 3Å; L52-L56 HydrophobicContact CD2-CD1 3.88Å; L52-L56 HydrophobicContact CD2-CG 4.3Å; L52-L56 WeakPolarHBondContact O-CB 3.16Å; L52-L56 VanDerWaalsContact O-CG 3.27Å; L52-L56 WeakPolarHBondContact O-CG 3.2Å; L52-L56 PolarHBondContact O-N 2.96Å; L52-L56 VanDerWaalsContact O-N 3.08Å
53	Y	67.9	Low	63.3	Low	147 Å²	147	89 Å²	89	58%	0.576	47%	0.471	S	S	*	.	H	α-helix	trans	-65.8	-46.8	176.7	-175.9	-94.7	0	0	0	111.5	L49 C50 L56 H57	L49-Y53 PolarHBondContact O-N 3.44Å; C50-Y53 WeakPolarHBondContact O-CB 3.2Å; C50-Y53 PolarHBondContact O-N 3.28Å; Y53-L56 PolarHBondContact O-N 3.36Å; Y53-H57 AromaticContact CD2-CE1 3.68Å; Y53-H57 AromaticContact CD2-ND1 3.8Å; Y53-H57 AromaticContact CE1-ND1 3.94Å; Y53-H57 AromaticContact CE2-CE1 3.27Å; Y53-H57 WeakPolarHBondContact CE2-CE1 3.26Å; Y53-H57 AromaticContact CE2-ND1 3.69Å; Y53-H57 AromaticContact CG-ND1 3.98Å; Y53-H57 AromaticContact CZ-CE1 3.59Å; Y53-H57 AromaticContact CZ-ND1 3.75Å; Y53-H57 PolarHBondContact O-N 2.95Å; Y53-H57 PolarHBondContact O-ND1 2.93Å
54	D	65.6	Low	64.2	Low	76 Å²	76	88.8 Å²	88.8	41%	0.406	46%	0.463	S	S	.	.	H	α-helix	trans	-66.6	-37.6	179.6	-64.7	-24.4	0	0	0	111.6	F41 C50 S58	F41-D54 HydrophobicContact CE1-CB 4.47Å; F41-D54 HydrophobicContact CZ-CB 4.35Å; C50-D54 WeakPolarHBondContact O-CB 3.39Å; C50-D54 VanDerWaalsContact O-CG 3.25Å; C50-D54 PolarHBondContact O-N 2.9Å; D54-S58 WeakPolarHBondContact O-CA 3.5Å; D54-S58 WeakPolarHBondContact O-CB 3.34Å; D54-S58 PolarHBondContact O-N 3.23Å
55	L	67.6	Low	65.3	Low	61 Å²	61	83.5 Å²	83.5	32%	0.319	45%	0.449	S	S	.	.	H	α-helix	trans	-66.6	-44.5	175	-168.2	107.6	0	0	0	111.8	L51 H57 S58 W60 L61	L51-L55 WeakPolarHBondContact O-CB 3.44Å; L51-L55 PolarHBondContact O-N 3.44Å; L55-H57 VanDerWaalsContact C-N 3.34Å; L55-H57 PolarHBondContact O-N 3.43Å; L55-S58 VanDerWaalsContact O-CB 3.3Å; L55-S58 WeakPolarHBondContact O-CB 3.46Å; L55-S58 PolarHBondContact O-N 2.9Å; L55-S58 PolarHBondContact O-OG 3.11Å; L55-W60 HydrophobicContact CD1-CH2 4.47Å; L55-W60 HydrophobicContact CD1-CZ2 3.79Å; L55-W60 HydrophobicContact CG-CZ2 4.26Å; L55-L61 HydrophobicContact CD2-CD2 4.31Å; L55-L61 HydrophobicContact CG-CD2 4.48Å; L55-L61 WeakPolarHBondContact O-CD2 3.46Å
56	L	69.1	Low	66.3	Low	89 Å²	89	82.3 Å²	82.3	47%	0.466	44%	0.436	S	S	.	.	H	α-helix	trans	-68.4	-31.3	179.5	-73.3	171.4	0	0	0	113.2	L52 Y53 L61 Q62	L52-L56 HydrophobicContact CD2-CD1 3.88Å; L52-L56 HydrophobicContact CD2-CG 4.3Å; L52-L56 WeakPolarHBondContact O-CB 3.16Å; L52-L56 VanDerWaalsContact O-CG 3.27Å; L52-L56 WeakPolarHBondContact O-CG 3.2Å; L52-L56 PolarHBondContact O-N 2.96Å; L52-L56 VanDerWaalsContact O-N 3.08Å; Y53-L56 PolarHBondContact O-N 3.36Å; L56-L61 HydrophobicContact CD2-CD2 4.31Å; L56-Q62 PolarHBondContact O-NE2 3.03Å
57	H	71.4	Confident	67.3	Low	113 Å²	113	80.7 Å²	80.7	52%	0.523	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	0.7	173.7	-65.1	83.3	0	0	0	113.3	Y53 L55	Y53-H57 AromaticContact CD2-CE1 3.68Å; Y53-H57 AromaticContact CD2-ND1 3.8Å; Y53-H57 AromaticContact CE1-ND1 3.94Å; Y53-H57 AromaticContact CE2-CE1 3.27Å; Y53-H57 WeakPolarHBondContact CE2-CE1 3.26Å; Y53-H57 AromaticContact CE2-ND1 3.69Å; Y53-H57 AromaticContact CG-ND1 3.98Å; Y53-H57 AromaticContact CZ-CE1 3.59Å; Y53-H57 AromaticContact CZ-ND1 3.75Å; Y53-H57 PolarHBondContact O-N 2.95Å; Y53-H57 PolarHBondContact O-ND1 2.93Å; L55-H57 VanDerWaalsContact C-N 3.34Å; L55-H57 PolarHBondContact O-N 3.43Å
58	S	72.6	Confident	68	Low	3 Å²	3	80.8 Å²	80.8	2%	0.021	42%	0.417	C	S	.	.			trans	-62.7	135.3	-178	68.5	0	0	0	0	111.3	D54 L55 W60 L61 Q62	D54-S58 WeakPolarHBondContact O-CA 3.5Å; D54-S58 WeakPolarHBondContact O-CB 3.34Å; D54-S58 PolarHBondContact O-N 3.23Å; L55-S58 VanDerWaalsContact O-CB 3.3Å; L55-S58 WeakPolarHBondContact O-CB 3.46Å; L55-S58 PolarHBondContact O-N 2.9Å; L55-S58 PolarHBondContact O-OG 3.11Å; S58-W60 PolarHBondContact O-N 2.82Å; S58-W60 PolarHBondContact OG-NE1 3.25Å; S58-L61 PolarHBondContact O-N 3.3Å; S58-L61 WeakPolarHBondContact OG-CB 3.36Å; S58-L61 PolarHBondContact OG-N 3.19Å; S58-Q62 WeakPolarHBondContact O-CG 3.28Å; S58-Q62 PolarHBondContact O-N 3.27Å; S58-Q62 VanDerWaalsContact O-N 3.16Å
59	P	65.4	Low	68.8	Low	85 Å²	85	81.7 Å²	81.7	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-57.1	-37.8	178.4	-25	34.5	0	0	0	112.2	A63	P59-A63 VanDerWaalsContact O-CB 3.3Å; P59-A63 WeakPolarHBondContact O-CB 3.29Å; P59-A63 PolarHBondContact O-N 2.94Å
60	W	67.8	Low	69.5	Low	40 Å²	40	78.4 Å²	78.4	15%	0.152	40%	0.4	C	S	.	.	H	α-helix	trans	-65.6	-44.4	179.7	76.1	-102.5	0	0	0	113.6	L34 E37 L38 L55 S58 A63 L64	L34-W60 HydrophobicContact CD2-CB 3.67Å; L34-W60 HydrophobicContact CD2-CD2 4.18Å; L34-W60 HydrophobicContact CD2-CE3 3.74Å; L34-W60 HydrophobicContact CD2-CG 4.21Å; L34-W60 HydrophobicContact CG-CB 3.91Å; E37-W60 WeakPolarHBondContact OE2-CB 3.31Å; E37-W60 PolarHBondContact OE2-N 3.32Å; L38-W60 HydrophobicContact CD2-CZ2 4.34Å; L55-W60 HydrophobicContact CD1-CH2 4.47Å; L55-W60 HydrophobicContact CD1-CZ2 3.79Å; L55-W60 HydrophobicContact CG-CZ2 4.26Å; S58-W60 PolarHBondContact O-N 2.82Å; S58-W60 PolarHBondContact OG-NE1 3.25Å; W60-A63 PolarHBondContact O-N 3.2Å; W60-L64 HydrophobicContact CE3-CD1 4.46Å; W60-L64 HydrophobicContact CZ3-CD1 4.47Å; W60-L64 WeakPolarHBondContact O-CB 3.42Å; W60-L64 PolarHBondContact O-N 3.43Å
61	L	72.5	Confident	70.1	Confident	35 Å²	35	80.5 Å²	80.5	18%	0.183	41%	0.406	C	S	.	.	H	α-helix	trans	-69.4	-39.1	-180	-175.9	67	0	0	0	110.5	L55 L56 S58 A63 L64 L65	L55-L61 HydrophobicContact CD2-CD2 4.31Å; L55-L61 HydrophobicContact CG-CD2 4.48Å; L55-L61 WeakPolarHBondContact O-CD2 3.46Å; L56-L61 HydrophobicContact CD2-CD2 4.31Å; S58-L61 PolarHBondContact O-N 3.3Å; S58-L61 WeakPolarHBondContact OG-CB 3.36Å; S58-L61 PolarHBondContact OG-N 3.19Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 3.18Å; L61-L64 PolarHBondContact O-N 2.94Å; L61-L65 HydrophobicContact CG-CD1 4.23Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.29Å
62	Q	76.3	Confident	70.4	Confident	86 Å²	86	80.7 Å²	80.7	40%	0.402	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-37.4	173.5	-68.4	-66.9	-29.2	0	0	112.1	L56 S58 K66	L56-Q62 PolarHBondContact O-NE2 3.03Å; S58-Q62 WeakPolarHBondContact O-CG 3.28Å; S58-Q62 PolarHBondContact O-N 3.27Å; S58-Q62 VanDerWaalsContact O-N 3.16Å; Q62-K66 WeakPolarHBondContact O-CB 3.33Å; Q62-K66 VanDerWaalsContact O-CG 3.3Å; Q62-K66 WeakPolarHBondContact O-CG 3.36Å; Q62-K66 PolarHBondContact O-N 2.94Å
63	A	71.1	Confident	70.9	Confident	25 Å²	25	83 Å²	83	21%	0.207	41%	0.406	C	S	.	.	H	α-helix	trans	-68.2	-40.9	172.9	0	0	0	0	0	112	I30 P59 W60 L61 K66 V67	I30-A63 HydrophobicContact CG2-CB 3.79Å; P59-A63 VanDerWaalsContact O-CB 3.3Å; P59-A63 WeakPolarHBondContact O-CB 3.29Å; P59-A63 PolarHBondContact O-N 2.94Å; W60-A63 PolarHBondContact O-N 3.2Å; L61-A63 VanDerWaalsContact C-N 3.32Å; L61-A63 PolarHBondContact O-N 3.18Å; A63-K66 WeakPolarHBondContact O-CB 3.32Å; A63-K66 PolarHBondContact O-N 3.44Å; A63-V67 WeakPolarHBondContact O-CG2 3.32Å; A63-V67 PolarHBondContact O-N 2.89Å
64	L	72.1	Confident	70.6	Confident	84 Å²	84	81.8 Å²	81.8	44%	0.44	41%	0.405	S	S	.	.	H	α-helix	trans	-68.3	-39	179.8	-153.2	149.7	0	0	0	111.6	L34 W60 L61 V67 Y68	L34-L64 HydrophobicContact CD2-CD1 4.13Å; W60-L64 HydrophobicContact CE3-CD1 4.46Å; W60-L64 HydrophobicContact CZ3-CD1 4.47Å; W60-L64 WeakPolarHBondContact O-CB 3.42Å; W60-L64 PolarHBondContact O-N 3.43Å; L61-L64 PolarHBondContact O-N 2.94Å; L64-V67 PolarHBondContact O-N 3.45Å; L64-Y68 WeakPolarHBondContact O-CB 3.29Å; L64-Y68 PolarHBondContact O-N 2.91Å
65	L	75.8	Confident	70.3	Confident	88 Å²	88	86.7 Å²	86.7	46%	0.461	42%	0.422	S	S	.	.	H	α-helix	trans	-61.8	-42.7	168.9	-76.3	166.2	0	0	0	111.9	L61 V67 Y68 D69	L61-L65 HydrophobicContact CG-CD1 4.23Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.29Å; L65-V67 PolarHBondContact O-N 2.91Å; L65-Y68 WeakPolarHBondContact O-CB 3.35Å; L65-Y68 PolarHBondContact O-N 3.46Å; L65-D69 WeakPolarHBondContact O-CB 3.41Å; L65-D69 PolarHBondContact O-N 3.45Å
66	K	74.1	Confident	70.1	Confident	150 Å²	150	90.3 Å²	90.3	65%	0.652	44%	0.437	S	S	*	.	H	α-helix	trans	-63.5	-37.7	174	-77.2	173.6	-178.3	177.9	0	113.1	Q62 A63 C70	Q62-K66 WeakPolarHBondContact O-CB 3.33Å; Q62-K66 VanDerWaalsContact O-CG 3.3Å; Q62-K66 WeakPolarHBondContact O-CG 3.36Å; Q62-K66 PolarHBondContact O-N 2.94Å; A63-K66 WeakPolarHBondContact O-CB 3.32Å; A63-K66 PolarHBondContact O-N 3.44Å; K66-C70 VanDerWaalsContact O-CB 3.27Å; K66-C70 WeakPolarHBondContact O-CB 3.33Å; K66-C70 PolarHBondContact O-N 3.26Å
67	V	72.4	Confident	69.7	Low	38 Å²	38	93.5 Å²	93.5	23%	0.23	45%	0.448	C	S	.	.	H	α-helix	trans	-65.3	-43.7	173.9	169.6	0	0	0	0	110.4	L27 A63 L64 L65 C70 L71	L27-V67 HydrophobicContact CD2-CG1 3.97Å; L27-V67 HydrophobicContact CD2-CG2 3.67Å; A63-V67 WeakPolarHBondContact O-CG2 3.32Å; A63-V67 PolarHBondContact O-N 2.89Å; L64-V67 PolarHBondContact O-N 3.45Å; L65-V67 PolarHBondContact O-N 2.91Å; V67-C70 PolarHBondContact O-N 3.18Å; V67-L71 HydrophobicContact CG1-CD1 3.89Å; V67-L71 HydrophobicContact CG1-CG 4.44Å; V67-L71 WeakPolarHBondContact O-CB 3.34Å; V67-L71 WeakPolarHBondContact O-CG 3.22Å; V67-L71 PolarHBondContact O-N 3.04Å
68	Y	74.1	Confident	68.9	Low	138 Å²	138	96.3 Å²	96.3	54%	0.541	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-49.7	174.4	178.8	-94.2	0	0	0	111.9	L64 L65 C70 L71 Q72	L64-Y68 WeakPolarHBondContact O-CB 3.29Å; L64-Y68 PolarHBondContact O-N 2.91Å; L65-Y68 WeakPolarHBondContact O-CB 3.35Å; L65-Y68 PolarHBondContact O-N 3.46Å; Y68-C70 VanDerWaalsContact C-N 3.28Å; Y68-C70 PolarHBondContact O-N 2.82Å; Y68-L71 PolarHBondContact O-N 3.45Å; Y68-Q72 WeakPolarHBondContact O-CB 3.35Å; Y68-Q72 PolarHBondContact O-N 2.97Å
69	D	76.1	Confident	68.3	Low	66 Å²	66	102 Å²	102	35%	0.353	49%	0.488	S	S	.	.	H	α-helix	trans	-55.1	-42.4	174.3	-117	35.6	0	0	0	112.1	L65 R73	L65-D69 WeakPolarHBondContact O-CB 3.41Å; L65-D69 PolarHBondContact O-N 3.45Å; D69-R73 WeakPolarHBondContact O-CB 3.46Å; D69-R73 VanDerWaalsContact O-CG 3.31Å; D69-R73 WeakPolarHBondContact O-CG 3.27Å; D69-R73 PolarHBondContact O-N 2.98Å; D69-R73 IonicContact OD2-CZ 3.27Å; D69-R73 VanDerWaalsContact OD2-CZ 3.27Å; D69-R73 IonicContact OD2-NH1 3.09Å; D69-R73 PolarHBondContact OD2-NH1 3.15Å; D69-R73 VanDerWaalsContact OD2-NH1 3.09Å; D69-R73 IonicContact OD2-NH2 2.62Å; D69-R73 PolarHBondContact OD2-NH2 2.84Å
70	C	70.1	Confident	68.3	Low	80 Å²	80	103.8 Å²	103.8	54%	0.541	50%	0.497	S	S	.	.	H	α-helix	trans	-68.5	-44	179.2	-163.7	0	0	0	0	111.4	K66 V67 Y68 F74	K66-C70 VanDerWaalsContact O-CB 3.27Å; K66-C70 WeakPolarHBondContact O-CB 3.33Å; K66-C70 PolarHBondContact O-N 3.26Å; V67-C70 PolarHBondContact O-N 3.18Å; Y68-C70 VanDerWaalsContact C-N 3.28Å; Y68-C70 PolarHBondContact O-N 2.82Å; C70-F74 WeakPolarHBondContact O-CB 3.37Å; C70-F74 PolarHBondContact O-N 3.21Å
71	L	68.9	Low	68.6	Low	110 Å²	110	104.2 Å²	104.2	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-37	174.7	-73.6	168.5	0	0	0	112.3	V67 Y68 F74 K75	V67-L71 HydrophobicContact CG1-CD1 3.89Å; V67-L71 HydrophobicContact CG1-CG 4.44Å; V67-L71 WeakPolarHBondContact O-CB 3.34Å; V67-L71 WeakPolarHBondContact O-CG 3.22Å; V67-L71 PolarHBondContact O-N 3.04Å; Y68-L71 PolarHBondContact O-N 3.45Å; L71-F74 PolarHBondContact O-N 2.87Å; L71-K75 PolarHBondContact O-N 3.16Å
72	Q	70.1	Confident	68.7	Low	81 Å²	81	111 Å²	111	38%	0.379	54%	0.541	S	S	.	.	H	α-helix	trans	-67.7	-47.6	177.8	-171.5	170.2	-8	0	0	111	Y68 F74 K75 E76	Y68-Q72 WeakPolarHBondContact O-CB 3.35Å; Y68-Q72 PolarHBondContact O-N 2.97Å; Q72-F74 PolarHBondContact O-N 3.43Å; Q72-K75 WeakPolarHBondContact O-CB 3.21Å; Q72-K75 PolarHBondContact O-N 2.96Å; Q72-K75 VanDerWaalsContact O-N 3.15Å; Q72-E76 WeakPolarHBondContact O-CG 3.26Å; Q72-E76 PolarHBondContact O-N 3.49Å
73	R	67.1	Low	68.9	Low	147 Å²	147	109 Å²	109	56%	0.555	54%	0.535	S	S	*	.	H	α-helix	trans	-59.6	-31.6	170.8	-70.5	176	-173.2	115.3	14.5	112.6	D69 K77	D69-R73 WeakPolarHBondContact O-CB 3.46Å; D69-R73 VanDerWaalsContact O-CG 3.31Å; D69-R73 WeakPolarHBondContact O-CG 3.27Å; D69-R73 PolarHBondContact O-N 2.98Å; D69-R73 IonicContact OD2-CZ 3.27Å; D69-R73 VanDerWaalsContact OD2-CZ 3.27Å; D69-R73 IonicContact OD2-NH1 3.09Å; D69-R73 PolarHBondContact OD2-NH1 3.15Å; D69-R73 VanDerWaalsContact OD2-NH1 3.09Å; D69-R73 IonicContact OD2-NH2 2.62Å; D69-R73 PolarHBondContact OD2-NH2 2.84Å; R73-K77 WeakPolarHBondContact O-CG 3.5Å; R73-K77 PolarHBondContact O-N 3.24Å
74	F	62.5	Low	69.6	Low	123 Å²	123	110.3 Å²	110.3	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-74.1	-38	175.9	-153.7	-91.8	0	0	0	112.2	C70 L71 Q72 K77 L79	C70-F74 WeakPolarHBondContact O-CB 3.37Å; C70-F74 PolarHBondContact O-N 3.21Å; L71-F74 PolarHBondContact O-N 2.87Å; Q72-F74 PolarHBondContact O-N 3.43Å; F74-K77 PolarHBondContact O-N 3.18Å; F74-L79 HydrophobicContact CE1-CD1 3.63Å; F74-L79 HydrophobicContact CE2-CD1 4.07Å; F74-L79 HydrophobicContact CZ-CD1 3.33Å; F74-L79 HydrophobicContact CZ-CG 4.48Å
75	K	60.3	Low	70.4	Confident	178 Å²	178	110.4 Å²	110.4	77%	0.774	54%	0.539	S	S	*	.	H	α-helix	trans	-61.4	-43.9	171.4	-106.5	-177.6	173.1	-179.1	0	112.1	L71 Q72 K77 K78	L71-K75 PolarHBondContact O-N 3.16Å; Q72-K75 WeakPolarHBondContact O-CB 3.21Å; Q72-K75 PolarHBondContact O-N 2.96Å; Q72-K75 VanDerWaalsContact O-N 3.15Å; K75-K77 VanDerWaalsContact C-N 3.31Å; K75-K77 PolarHBondContact O-N 3.44Å; K75-K78 PolarHBondContact O-N 3.1Å
76	E	61.9	Low	71	Confident	137 Å²	137	107 Å²	107	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-34.2	178.4	-74.1	172.1	-179.5	0	0	112.6	Q72 K78	Q72-E76 WeakPolarHBondContact O-CG 3.26Å; Q72-E76 PolarHBondContact O-N 3.49Å; E76-K78 PolarHBondContact O-N 3.29Å
77	K	61.3	Low	71.6	Confident	156 Å²	156	103.5 Å²	103.5	68%	0.678	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.7	179.2	-83.6	178.3	177.1	-174.5	0	115.2	R73 F74 K75 L79	R73-K77 WeakPolarHBondContact O-CG 3.5Å; R73-K77 PolarHBondContact O-N 3.24Å; F74-K77 PolarHBondContact O-N 3.18Å; K75-K77 VanDerWaalsContact C-N 3.31Å; K75-K77 PolarHBondContact O-N 3.44Å; K77-L79 PolarHBondContact O-N 2.79Å
78	K	55.2	Low	72.3	Confident	173 Å²	173	106 Å²	106	75%	0.752	52%	0.52	S	S	*	.			trans	32.3	71.5	-178.1	-75.5	-172.2	175.4	-179.3	0	112.5	K75 E76 V80	K75-K78 PolarHBondContact O-N 3.1Å; E76-K78 PolarHBondContact O-N 3.29Å; K78-V80 WeakPolarHBondContact O-CG2 3.35Å; K78-V80 PolarHBondContact O-N 3.42Å
79	L	60.4	Low	73	Confident	123 Å²	123	103.3 Å²	103.3	64%	0.644	52%	0.515	S	S	*	.			trans	-61.3	102.8	176.8	-64	-179.9	0	0	0	109.7	F74 K77	F74-L79 HydrophobicContact CE1-CD1 3.63Å; F74-L79 HydrophobicContact CE2-CD1 4.07Å; F74-L79 HydrophobicContact CZ-CD1 3.33Å; F74-L79 HydrophobicContact CZ-CG 4.48Å; K77-L79 PolarHBondContact O-N 2.79Å
80	V	65.1	Low	73.6	Confident	121 Å²	121	100.8 Å²	100.8	73%	0.733	50%	0.503	S	S	*	.			trans	-85.1	133.2	170.3	-174.2	0	0	0	0	106.9	K78 D82	K78-V80 WeakPolarHBondContact O-CG2 3.35Å; K78-V80 PolarHBondContact O-N 3.42Å; V80-D82 PolarHBondContact O-N 3.2Å
81	P	73	Confident	74.3	Confident	49 Å²	49	100 Å²	100	32%	0.318	50%	0.497	S	S	.	.			trans	-64.9	131.5	172.8	29.8	-36.6	0	0	0	109.7	T83 T84 A129	P81-T83 PolarHBondContact O-N 2.84Å; P81-T84 HydrophobicContact CG-CG2 4.23Å; P81-A129 HydrophobicContact CB-CB 3.59Å; P81-A129 HydrophobicContact CG-CB 3.64Å
82	D	74.9	Confident	75.1	Confident	178 Å²	178	99.4 Å²	99.4	95%	0.952	49%	0.492	S	S	*	.	S	Bend	trans	-63.4	-24.5	-178.2	-123	-2.9	0	0	0	112.2	V80	V80-D82 PolarHBondContact O-N 3.2Å
83	T	81.1	Confident	75.9	Confident	45 Å²	45	98.4 Å²	98.4	28%	0.276	49%	0.491	S	S	.	.			trans	-147	150.1	170.3	176.5	0	0	0	0	109.6	P81 H85 A86 L89 H125	P81-T83 PolarHBondContact O-N 2.84Å; T83-H85 PolarHBondContact OG1-N 3.3Å; T83-A86 HydrophobicContact CG2-CB 3.97Å; T83-L89 HydrophobicContact CG2-CD1 4.22Å; T83-H125 PolarHBondContact O-CE1 2.81Å; T83-H125 VanDerWaalsContact O-CE1 3.26Å
84	T	84.5	Confident	76.7	Confident	52 Å²	52	92.5 Å²	92.5	32%	0.319	47%	0.47	S	S	.	.	S	Bend	trans	-100.4	3.5	173.9	45.6	0	0	0	0	113.1	P81 A129 Q130	P81-T84 HydrophobicContact CG-CG2 4.23Å; T84-A129 HydrophobicContact CG2-CB 4.16Å; T84-Q130 PolarHBondContact O-NE2 2.91Å
85	H	89.1	Confident	77.7	Confident	86 Å²	86	94.7 Å²	94.7	40%	0.398	48%	0.482	S	S	.	.			trans	-140.3	42.5	-171.1	-58.1	91.3	0	0	0	112.3	T83 Q87 I88 L89 D126	T83-H85 PolarHBondContact OG1-N 3.3Å; H85-Q87 PolarHBondContact O-N 2.87Å; H85-I88 HydrophobicContact CB-CB 4.34Å; H85-I88 HydrophobicContact CB-CD1 4.21Å; H85-I88 HydrophobicContact CB-CG1 4.37Å; H85-I88 PolarHBondContact O-N 3.02Å; H85-L89 PolarHBondContact O-N 3.16Å; H85-D126 WeakPolarHBondContact CA-OD2 3.39Å
86	A	88.3	Confident	78.8	Confident	15 Å²	15	93.1 Å²	93.1	12%	0.124	48%	0.481	C	S	.	.	H	α-helix	trans	-61	-30.9	-178.7	0	0	0	0	0	112.9	T83 A90 L122 D126	T83-A86 HydrophobicContact CG2-CB 3.97Å; A86-A90 WeakPolarHBondContact O-CB 3.34Å; A86-A90 PolarHBondContact O-N 3.42Å; A86-L122 HydrophobicContact CB-CD2 3.79Å; A86-D126 WeakPolarHBondContact CB-OD1 3.27Å; A86-D126 VanDerWaalsContact N-CG 3.28Å; A86-D126 PolarHBondContact N-OD1 3.48Å; A86-D126 PolarHBondContact N-OD2 3.35Å
87	Q	87.8	Confident	79.7	Confident	78 Å²	78	88 Å²	88	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-67.5	-37.5	176	-174.9	178.7	-15.8	0	0	112.5	H85 C91 L122 S123 D126	H85-Q87 PolarHBondContact O-N 2.87Å; Q87-C91 PolarHBondContact O-N 3.35Å; Q87-C91 PolarHBondContact O-SG 2.95Å; Q87-L122 HydrophobicContact CB-CB 4.13Å; Q87-S123 VanDerWaalsContact OE1-CA 3.25Å; Q87-S123 PolarHBondContact OE1-OG 3.31Å; Q87-D126 VanDerWaalsContact CB-OD2 3.27Å; Q87-D126 WeakPolarHBondContact CB-OD2 3.48Å; Q87-D126 PolarHBondContact N-OD2 3.24Å
88	I	87.1	Confident	80.3	Confident	90 Å²	90	84.3 Å²	84.3	46%	0.462	45%	0.45	S	S	.	.	H	α-helix	trans	-69.2	-48.3	178	-58.7	-177	0	0	0	109.5	H85 A90 C91 E92	H85-I88 HydrophobicContact CB-CB 4.34Å; H85-I88 HydrophobicContact CB-CD1 4.21Å; H85-I88 HydrophobicContact CB-CG1 4.37Å; H85-I88 PolarHBondContact O-N 3.02Å; I88-A90 VanDerWaalsContact C-N 3.28Å; I88-A90 PolarHBondContact O-N 3.19Å; I88-C91 WeakPolarHBondContact O-CA 3.45Å; I88-C91 WeakPolarHBondContact O-CB 3.35Å; I88-C91 PolarHBondContact O-N 2.91Å; I88-E92 PolarHBondContact O-N 2.96Å
89	L	88.5	Confident	80.7	Confident	82 Å²	82	85.3 Å²	85.3	43%	0.429	46%	0.455	S	S	.	.	H	α-helix	trans	-56.9	-40.1	176.5	-67.8	168.2	0	0	0	112.2	T83 H85 C91 E92 V93	T83-L89 HydrophobicContact CG2-CD1 4.22Å; H85-L89 PolarHBondContact O-N 3.16Å; L89-C91 VanDerWaalsContact C-N 3.3Å; L89-C91 PolarHBondContact O-N 3.05Å; L89-E92 PolarHBondContact O-N 3.42Å; L89-V93 WeakPolarHBondContact O-CG2 3.5Å; L89-V93 PolarHBondContact O-N 2.96Å
90	A	87.9	Confident	80.7	Confident	13 Å²	13	84.2 Å²	84.2	11%	0.107	46%	0.464	C	S	.	.	H	α-helix	trans	-65	-31.7	174.6	0	0	0	0	0	113.3	A86 I88 L94 L113 L122	A86-A90 WeakPolarHBondContact O-CB 3.34Å; A86-A90 PolarHBondContact O-N 3.42Å; I88-A90 VanDerWaalsContact C-N 3.28Å; I88-A90 PolarHBondContact O-N 3.19Å; A90-L94 VanDerWaalsContact O-CG 3.31Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.29Å; A90-L113 HydrophobicContact CB-CD2 4.28Å; A90-L122 HydrophobicContact CB-CD1 3.54Å
91	C	85.1	Confident	80.5	Confident	63 Å²	63	79.6 Å²	79.6	43%	0.426	44%	0.436	S	S	.	.	H	α-helix	trans	-72.2	-44.1	173.8	-64.1	0	0	0	0	111.4	Q87 I88 L89 V93 L94 E95	Q87-C91 PolarHBondContact O-N 3.35Å; Q87-C91 PolarHBondContact O-SG 2.95Å; I88-C91 WeakPolarHBondContact O-CA 3.45Å; I88-C91 WeakPolarHBondContact O-CB 3.35Å; I88-C91 PolarHBondContact O-N 2.91Å; L89-C91 VanDerWaalsContact C-N 3.3Å; L89-C91 PolarHBondContact O-N 3.05Å; C91-V93 VanDerWaalsContact C-N 3.35Å; C91-V93 PolarHBondContact O-N 3.33Å; C91-L94 WeakPolarHBondContact O-CA 3.31Å; C91-L94 WeakPolarHBondContact O-CB 3.47Å; C91-L94 PolarHBondContact O-N 2.94Å; C91-E95 PolarHBondContact O-N 2.85Å
92	E	86.4	Confident	80.2	Confident	98 Å²	98	81 Å²	81	46%	0.458	46%	0.461	S	S	.	.	H	α-helix	trans	-58.6	-44.6	175	-68	175.2	-179.2	0	0	111.7	I88 L89 L94 E95 L96	I88-E92 PolarHBondContact O-N 2.96Å; L89-E92 PolarHBondContact O-N 3.42Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.15Å; E92-E95 PolarHBondContact O-N 3.28Å; E92-E95 VanDerWaalsContact O-N 3.16Å; E92-L96 WeakPolarHBondContact O-CG 3.27Å; E92-L96 PolarHBondContact O-N 3.26Å
93	V	86.1	Confident	80.6	Confident	60 Å²	60	74.2 Å²	74.2	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-41.2	173.4	170.5	0	0	0	0	111.3	L89 C91 E95 L96 L97 L113	L89-V93 WeakPolarHBondContact O-CG2 3.5Å; L89-V93 PolarHBondContact O-N 2.96Å; C91-V93 VanDerWaalsContact C-N 3.35Å; C91-V93 PolarHBondContact O-N 3.33Å; V93-E95 VanDerWaalsContact C-N 3.3Å; V93-E95 PolarHBondContact O-N 3.27Å; V93-L96 PolarHBondContact O-N 3.39Å; V93-L97 HydrophobicContact CG1-CD1 4.05Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 VanDerWaalsContact O-CG 3.26Å; V93-L97 WeakPolarHBondContact O-CG 3.38Å; V93-L97 PolarHBondContact O-N 3.19Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG1-CD1 3.85Å
94	L	85.1	Confident	80.6	Confident	22 Å²	22	76.1 Å²	76.1	12%	0.115	44%	0.44	C	S	.	.	H	α-helix	trans	-67.5	-25.8	177.1	-78.8	173.1	0	0	0	114.4	A90 C91 E92 R110 L113 Q114	A90-L94 VanDerWaalsContact O-CG 3.31Å; A90-L94 WeakPolarHBondContact O-CG 3.39Å; A90-L94 PolarHBondContact O-N 3.29Å; C91-L94 WeakPolarHBondContact O-CA 3.31Å; C91-L94 WeakPolarHBondContact O-CB 3.47Å; C91-L94 PolarHBondContact O-N 2.94Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.15Å; L94-R110 HydrophobicContact CD2-CB 4.36Å; L94-R110 HydrophobicContact CD2-CG 3.83Å; L94-R110 PolarHBondContact O-NH1 2.91Å; L94-L113 HydrophobicContact CD1-CB 3.97Å; L94-L113 HydrophobicContact CD2-CB 3.89Å; L94-L113 HydrophobicContact CD2-CD1 4.42Å; L94-L113 HydrophobicContact CG-CB 3.95Å; L94-L113 HydrophobicContact CG-CD1 4.32Å; L94-Q114 HydrophobicContact CD1-CG 3.76Å; L94-Q114 HydrophobicContact CD2-CG 3.8Å; L94-Q114 HydrophobicContact CG-CG 4.46Å
95	E	83.3	Confident	80.6	Confident	169 Å²	169	79.3 Å²	79.3	79%	0.79	45%	0.451	S	S	*	.	H	α-helix	trans	-78.7	-39.2	172.5	-68.9	-168.8	163.5	0	0	112.1	C91 E92 V93	C91-E95 PolarHBondContact O-N 2.85Å; E92-E95 PolarHBondContact O-N 3.28Å; E92-E95 VanDerWaalsContact O-N 3.16Å; V93-E95 VanDerWaalsContact C-N 3.3Å; V93-E95 PolarHBondContact O-N 3.27Å
96	L	82.5	Confident	80.3	Confident	145 Å²	145	77.7 Å²	77.7	76%	0.759	45%	0.445	S	S	*	.	H	α-helix	trans	-71	-27.2	177	-68.4	171.1	0	0	0	113.2	E92 V93 P98	E92-L96 WeakPolarHBondContact O-CG 3.27Å; E92-L96 PolarHBondContact O-N 3.26Å; V93-L96 PolarHBondContact O-N 3.39Å; L96-P98 WeakPolarHBondContact O-CD 3.32Å
97	L	81.6	Confident	80	Confident	30 Å²	30	81.9 Å²	81.9	16%	0.157	46%	0.462	C	S	.	.	S	Bend	trans	-75	113.5	175.3	-71.4	176.3	0	0	0	111.3	V93 K99 I106 L109 R110	V93-L97 HydrophobicContact CG1-CD1 4.05Å; V93-L97 HydrophobicContact CG1-CG 4.33Å; V93-L97 VanDerWaalsContact O-CG 3.26Å; V93-L97 WeakPolarHBondContact O-CG 3.38Å; V93-L97 PolarHBondContact O-N 3.19Å; L97-K99 PolarHBondContact O-N 3.4Å; L97-I106 HydrophobicContact CB-CG2 4.41Å; L97-I106 HydrophobicContact CD2-CG2 3.91Å; L97-I106 HydrophobicContact CG-CG2 4.5Å; L97-L109 HydrophobicContact CD1-CD2 4.09Å; L97-L109 HydrophobicContact CD1-CG 4.32Å; L97-R110 PolarHBondContact O-NH1 3.45Å
98	P	73.2	Confident	79.9	Confident	78 Å²	78	84.3 Å²	84.3	51%	0.506	47%	0.473	S	S	.	.			trans	-66.7	136.4	-173.9	26	-34	0	0	0	112	L96 A100 S101	L96-P98 WeakPolarHBondContact O-CD 3.32Å; P98-A100 PolarHBondContact O-N 2.96Å; P98-S101 PolarHBondContact O-N 3.09Å; P98-S101 PolarHBondContact O-OG 3.17Å
99	K	64	Low	79.9	Confident	194 Å²	194	83.9 Å²	83.9	84%	0.843	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-10.9	-176.8	-68.2	178.7	179.8	173.8	0	115.5	L97	L97-K99 PolarHBondContact O-N 3.4Å
100	A	59.7	Low	79.8	Confident	101 Å²	101	82.5 Å²	82.5	84%	0.835	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	35.9	-173.2	0	0	0	0	0	112.9	P98	P98-A100 PolarHBondContact O-N 2.96Å
101	S	61.9	Low	79.7	Confident	23 Å²	23	88.6 Å²	88.6	16%	0.161	49%	0.487	C	S	.	.			trans	-78.8	130.5	170.2	34.3	0	0	0	0	110.7	P98 S103 I106 Q107	P98-S101 PolarHBondContact O-N 3.09Å; P98-S101 PolarHBondContact O-OG 3.17Å; S101-S103 VanDerWaalsContact C-N 3.31Å; S101-S103 PolarHBondContact O-N 3.01Å; S101-I106 WeakPolarHBondContact OG-CG2 3.3Å; S101-Q107 PolarHBondContact O-NE2 3.28Å
102	G	67.4	Low	79.9	Confident	80 Å²	80	88.8 Å²	88.8	83%	0.825	49%	0.486	S	S	*	.			trans	-84.9	7.4	-177.9	0	0	0	0	0	115.5
103	S	81.5	Confident	80	Confident	35 Å²	35	85.7 Å²	85.7	25%	0.245	47%	0.472	C	S	.	.			trans	-84.3	130.1	174.8	136.5	0	0	0	0	109.4	S101 E105 I106 Q107	S101-S103 VanDerWaalsContact C-N 3.31Å; S101-S103 PolarHBondContact O-N 3.01Å; S103-E105 VanDerWaalsContact C-N 3.27Å; S103-E105 WeakPolarHBondContact CB-OE2 3.49Å; S103-E105 PolarHBondContact O-N 3.23Å; S103-E105 PolarHBondContact OG-N 3.33Å; S103-E105 PolarHBondContact OG-OE2 3.25Å; S103-I106 PolarHBondContact O-N 2.83Å; S103-I106 PolarHBondContact OG-N 3.42Å; S103-Q107 PolarHBondContact O-N 3.24Å
104	P	82.3	Confident	80.1	Confident	84 Å²	84	86.8 Å²	86.8	55%	0.545	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-32.4	178.4	26	-33	0	0	0	112	I106 Q107 E108	P104-I106 VanDerWaalsContact C-N 3.35Å; P104-I106 PolarHBondContact O-N 3.07Å; P104-Q107 PolarHBondContact O-N 2.89Å; P104-Q107 VanDerWaalsContact O-N 3.14Å; P104-E108 PolarHBondContact O-N 3.32Å
105	E	84.9	Confident	80.4	Confident	120 Å²	120	86.6 Å²	86.6	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-64.5	-38.4	-179.5	-52.5	77	-167.8	0	0	111.7	S103 Q107 E108 L109	S103-E105 VanDerWaalsContact C-N 3.27Å; S103-E105 WeakPolarHBondContact CB-OE2 3.49Å; S103-E105 PolarHBondContact O-N 3.23Å; S103-E105 PolarHBondContact OG-N 3.33Å; S103-E105 PolarHBondContact OG-OE2 3.25Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-E108 PolarHBondContact O-N 2.88Å; E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 PolarHBondContact O-N 3.39Å
106	I	82.7	Confident	80.7	Confident	51 Å²	51	83.6 Å²	83.6	26%	0.262	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-35.4	175.6	-65.2	170	0	0	0	111	L97 S101 S103 P104 R110	L97-I106 HydrophobicContact CB-CG2 4.41Å; L97-I106 HydrophobicContact CD2-CG2 3.91Å; L97-I106 HydrophobicContact CG-CG2 4.5Å; S101-I106 WeakPolarHBondContact OG-CG2 3.3Å; S103-I106 PolarHBondContact O-N 2.83Å; S103-I106 PolarHBondContact OG-N 3.42Å; P104-I106 VanDerWaalsContact C-N 3.35Å; P104-I106 PolarHBondContact O-N 3.07Å; I106-R110 WeakPolarHBondContact O-CB 3.47Å; I106-R110 PolarHBondContact O-N 2.88Å
107	Q	80.6	Confident	81	Confident	103 Å²	103	83 Å²	83	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-69.8	-40.4	176	-64.8	-175	10.9	0	0	111.6	S101 S103 P104 E105 R110 Q111	S101-Q107 PolarHBondContact O-NE2 3.28Å; S103-Q107 PolarHBondContact O-N 3.24Å; P104-Q107 PolarHBondContact O-N 2.89Å; P104-Q107 VanDerWaalsContact O-N 3.14Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; Q107-R110 PolarHBondContact O-N 3.48Å; Q107-Q111 WeakPolarHBondContact O-CG 3.3Å; Q107-Q111 PolarHBondContact O-N 3.2Å
108	E	86.5	Confident	81.4	Confident	129 Å²	129	82.7 Å²	82.7	60%	0.603	46%	0.463	S	S	*	.	H	α-helix	trans	-61.7	-52.8	174.5	-175.7	176.7	-172.7	0	0	111.5	P104 E105 R110 Q111 V112	P104-E108 PolarHBondContact O-N 3.32Å; E105-E108 PolarHBondContact O-N 2.88Å; E108-R110 VanDerWaalsContact C-N 3.26Å; E108-R110 PolarHBondContact O-N 3.22Å; E108-Q111 WeakPolarHBondContact O-CB 3.4Å; E108-Q111 PolarHBondContact O-N 2.88Å; E108-V112 WeakPolarHBondContact O-CG2 3.47Å; E108-V112 PolarHBondContact O-N 2.85Å
109	L	87.1	Confident	82.1	Confident	81 Å²	81	83.3 Å²	83.3	42%	0.424	46%	0.458	S	S	.	.	H	α-helix	trans	-57.6	-40.2	177.5	179.4	61.1	0	0	0	111.8	L97 E105 V112 L113	L97-L109 HydrophobicContact CD1-CD2 4.09Å; L97-L109 HydrophobicContact CD1-CG 4.32Å; E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 PolarHBondContact O-N 3.39Å; L109-V112 PolarHBondContact O-N 2.8Å; L109-L113 HydrophobicContact CD1-CD1 3.95Å; L109-L113 HydrophobicContact CD1-CG 4.04Å; L109-L113 HydrophobicContact CG-CD1 4.06Å; L109-L113 HydrophobicContact CG-CG 4.49Å; L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CG 3.36Å; L109-L113 PolarHBondContact O-N 3.48Å
110	R	85.7	Confident	83.2	Confident	54 Å²	54	77 Å²	77	20%	0.204	44%	0.442	C	S	.	.	H	α-helix	trans	-64.5	-40.3	175.5	-172.5	-178.7	-174.3	88	9.1	112	L94 L97 I106 Q107 E108 Q114	L94-R110 HydrophobicContact CD2-CB 4.36Å; L94-R110 HydrophobicContact CD2-CG 3.83Å; L94-R110 PolarHBondContact O-NH1 2.91Å; L97-R110 PolarHBondContact O-NH1 3.45Å; I106-R110 WeakPolarHBondContact O-CB 3.47Å; I106-R110 PolarHBondContact O-N 2.88Å; Q107-R110 PolarHBondContact O-N 3.48Å; E108-R110 VanDerWaalsContact C-N 3.26Å; E108-R110 PolarHBondContact O-N 3.22Å; R110-Q114 WeakPolarHBondContact O-CB 3.41Å; R110-Q114 WeakPolarHBondContact O-CG 3.3Å; R110-Q114 PolarHBondContact O-N 3.03Å
111	Q	85.7	Confident	84.7	Confident	140 Å²	140	78.1 Å²	78.1	65%	0.654	43%	0.433	S	S	*	.	H	α-helix	trans	-65.5	-45.7	175.3	-75.3	-179.5	16.4	0	0	111.7	Q107 E108 Q114 A115	Q107-Q111 WeakPolarHBondContact O-CG 3.3Å; Q107-Q111 PolarHBondContact O-N 3.2Å; E108-Q111 WeakPolarHBondContact O-CB 3.4Å; E108-Q111 PolarHBondContact O-N 2.88Å; Q111-Q114 PolarHBondContact O-N 2.73Å; Q111-A115 PolarHBondContact O-N 2.71Å
112	V	90.1	Very high	86.1	Confident	67 Å²	67	79 Å²	79	41%	0.406	44%	0.436	S	S	.	.	H	α-helix	trans	-60.5	-53.1	178.2	173.5	0	0	0	0	111	E108 L109 Q114 A115 C118	E108-V112 WeakPolarHBondContact O-CG2 3.47Å; E108-V112 PolarHBondContact O-N 2.85Å; L109-V112 PolarHBondContact O-N 2.8Å; V112-Q114 VanDerWaalsContact C-N 3.25Å; V112-Q114 PolarHBondContact O-N 2.96Å; V112-A115 VanDerWaalsContact O-CB 3.28Å; V112-A115 WeakPolarHBondContact O-CB 3.3Å; V112-A115 PolarHBondContact O-N 3.37Å; V112-A115 VanDerWaalsContact O-N 3.09Å; V112-C118 VanDerWaalsContact O-CB 3.29Å; V112-C118 WeakPolarHBondContact O-CB 3.47Å; V112-C118 PolarHBondContact O-SG 3.27Å
113	L	88.4	Confident	87.1	Confident	33 Å²	33	77.5 Å²	77.5	17%	0.173	41%	0.413	C	S	.	.	H	α-helix	trans	-65.4	-26.8	179.3	-68.4	177.9	0	0	0	113.1	A90 V93 L94 L109	A90-L113 HydrophobicContact CB-CD2 4.28Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG1-CD1 3.85Å; L94-L113 HydrophobicContact CD1-CB 3.97Å; L94-L113 HydrophobicContact CD2-CB 3.89Å; L94-L113 HydrophobicContact CD2-CD1 4.42Å; L94-L113 HydrophobicContact CG-CB 3.95Å; L94-L113 HydrophobicContact CG-CD1 4.32Å; L109-L113 HydrophobicContact CD1-CD1 3.95Å; L109-L113 HydrophobicContact CD1-CG 4.04Å; L109-L113 HydrophobicContact CG-CD1 4.06Å; L109-L113 HydrophobicContact CG-CG 4.49Å; L109-L113 WeakPolarHBondContact O-CB 3.44Å; L109-L113 WeakPolarHBondContact O-CG 3.36Å; L109-L113 PolarHBondContact O-N 3.48Å
114	Q	87.6	Confident	87.4	Confident	84 Å²	84	78.3 Å²	78.3	39%	0.393	42%	0.422	S	S	.	.	H	α-helix	trans	-81.1	-18.2	174.7	-73.5	-177.1	-3.5	0	0	113.9	L94 R110 Q111 V112 K119	L94-Q114 HydrophobicContact CD1-CG 3.76Å; L94-Q114 HydrophobicContact CD2-CG 3.8Å; L94-Q114 HydrophobicContact CG-CG 4.46Å; R110-Q114 WeakPolarHBondContact O-CB 3.41Å; R110-Q114 WeakPolarHBondContact O-CG 3.3Å; R110-Q114 PolarHBondContact O-N 3.03Å; Q111-Q114 PolarHBondContact O-N 2.73Å; V112-Q114 VanDerWaalsContact C-N 3.25Å; V112-Q114 PolarHBondContact O-N 2.96Å; Q114-K119 WeakPolarHBondContact O-CE 3.18Å; Q114-K119 PolarHBondContact O-NZ 2.67Å
115	A	92.3	Very high	87.7	Confident	17 Å²	17	78 Å²	78	14%	0.14	41%	0.413	C	S	.	.	S	Bend	trans	-63.6	141	-175.3	0	0	0	0	0	112.1	Q111 V112 H117 C118 K119	Q111-A115 PolarHBondContact O-N 2.71Å; V112-A115 VanDerWaalsContact O-CB 3.28Å; V112-A115 WeakPolarHBondContact O-CB 3.3Å; V112-A115 PolarHBondContact O-N 3.37Å; V112-A115 VanDerWaalsContact O-N 3.09Å; A115-H117 VanDerWaalsContact C-N 3.27Å; A115-H117 VanDerWaalsContact CB-CE1 3.46Å; A115-H117 WeakPolarHBondContact CB-CE1 3.36Å; A115-H117 PolarHBondContact O-N 3.16Å; A115-C118 PolarHBondContact O-N 3.45Å; A115-K119 PolarHBondContact O-N 3.4Å; A115-K119 VanDerWaalsContact O-N 3.11Å
116	P	88.4	Confident	88	Confident	107 Å²	107	72.7 Å²	72.7	70%	0.695	39%	0.388	S	S	*	.	H	α-helix	trans	-64.5	-31.5	-173.5	24.9	-34.1	0	0	0	112.8	A120	P116-A120 WeakPolarHBondContact O-CB 3.38Å; P116-A120 PolarHBondContact O-N 3.31Å
117	H	90.1	Very high	88	Confident	131 Å²	131	72.7 Å²	72.7	61%	0.606	39%	0.391	S	S	*	.	H	α-helix	trans	-69.6	-40.9	177.5	54.4	-100.1	0	0	0	112.4	A115 A120 L121	A115-H117 VanDerWaalsContact C-N 3.27Å; A115-H117 VanDerWaalsContact CB-CE1 3.46Å; A115-H117 WeakPolarHBondContact CB-CE1 3.36Å; A115-H117 PolarHBondContact O-N 3.16Å; H117-A120 PolarHBondContact O-N 2.85Å; H117-L121 WeakPolarHBondContact O-CB 3.38Å; H117-L121 PolarHBondContact O-N 3.41Å
118	C	88.7	Confident	88.1	Confident	25 Å²	25	72.3 Å²	72.3	17%	0.169	40%	0.395	C	S	.	.	H	α-helix	trans	-66.2	-40.4	174.8	-75	0	0	0	0	111.6	V112 A115 L121 L122	V112-C118 VanDerWaalsContact O-CB 3.29Å; V112-C118 WeakPolarHBondContact O-CB 3.47Å; V112-C118 PolarHBondContact O-SG 3.27Å; A115-C118 PolarHBondContact O-N 3.45Å; C118-L121 PolarHBondContact O-N 3.04Å; C118-L122 VanDerWaalsContact O-CG 3.29Å; C118-L122 WeakPolarHBondContact O-CG 3.41Å; C118-L122 PolarHBondContact O-N 3.15Å
119	K	88.6	Confident	88	Confident	91 Å²	91	66.9 Å²	66.9	40%	0.396	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-44	174.3	-72.2	174.8	175.5	158	0	112.6	Q114 A115 L121 L122 S123	Q114-K119 WeakPolarHBondContact O-CE 3.18Å; Q114-K119 PolarHBondContact O-NZ 2.67Å; A115-K119 PolarHBondContact O-N 3.4Å; A115-K119 VanDerWaalsContact O-N 3.11Å; K119-L121 VanDerWaalsContact C-N 3.33Å; K119-L122 PolarHBondContact O-N 3.26Å; K119-S123 WeakPolarHBondContact O-CB 3.27Å; K119-S123 PolarHBondContact O-N 3.23Å
120	A	87.3	Confident	87.7	Confident	61 Å²	61	67.6 Å²	67.6	50%	0.504	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-39	175.6	0	0	0	0	0	112	P116 H117 S123 A124	P116-A120 WeakPolarHBondContact O-CB 3.38Å; P116-A120 PolarHBondContact O-N 3.31Å; H117-A120 PolarHBondContact O-N 2.85Å; A120-S123 PolarHBondContact O-N 3.31Å; A120-A124 WeakPolarHBondContact O-CB 3.46Å; A120-A124 PolarHBondContact O-N 3.16Å
121	L	90.8	Very high	87.2	Confident	125 Å²	125	71.3 Å²	71.3	65%	0.654	39%	0.391	S	S	*	.	H	α-helix	trans	-65	-45	176.4	-177.7	64.7	0	0	0	112.3	H117 C118 K119 A124 H125	H117-L121 WeakPolarHBondContact O-CB 3.38Å; H117-L121 PolarHBondContact O-N 3.41Å; C118-L121 PolarHBondContact O-N 3.04Å; K119-L121 VanDerWaalsContact C-N 3.33Å; L121-A124 PolarHBondContact O-N 3.19Å; L121-H125 WeakPolarHBondContact O-CB 3.34Å; L121-H125 PolarHBondContact O-N 2.92Å
122	L	90.8	Very high	86.3	Confident	41 Å²	41	69.4 Å²	69.4	22%	0.215	39%	0.386	C	S	.	.	H	α-helix	trans	-66.2	-37.9	176.6	-68.2	168.7	0	0	0	112	A86 Q87 A90 C118 K119 H125 D126	A86-L122 HydrophobicContact CB-CD2 3.79Å; Q87-L122 HydrophobicContact CB-CB 4.13Å; A90-L122 HydrophobicContact CB-CD1 3.54Å; C118-L122 VanDerWaalsContact O-CG 3.29Å; C118-L122 WeakPolarHBondContact O-CG 3.41Å; C118-L122 PolarHBondContact O-N 3.15Å; K119-L122 PolarHBondContact O-N 3.26Å; L122-H125 WeakPolarHBondContact O-CB 3.42Å; L122-H125 PolarHBondContact O-N 3.48Å; L122-D126 PolarHBondContact O-N 3.03Å
123	S	88.5	Confident	85.3	Confident	48 Å²	48	72 Å²	72	34%	0.336	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-47.7	174.1	-176.6	0	0	0	0	111.8	Q87 K119 A120 H125 D126 T127	Q87-S123 VanDerWaalsContact OE1-CA 3.25Å; Q87-S123 PolarHBondContact OE1-OG 3.31Å; K119-S123 WeakPolarHBondContact O-CB 3.27Å; K119-S123 PolarHBondContact O-N 3.23Å; A120-S123 PolarHBondContact O-N 3.31Å; S123-H125 VanDerWaalsContact C-N 3.32Å; S123-H125 PolarHBondContact O-N 2.88Å; S123-D126 PolarHBondContact O-N 2.85Å; S123-T127 PolarHBondContact O-N 3.42Å; S123-T127 PolarHBondContact O-OG1 3.08Å
124	A	87.3	Confident	84	Confident	53 Å²	53	75.9 Å²	75.9	44%	0.438	41%	0.409	S	S	.	.	H	α-helix	trans	-64.4	-36.7	176.9	0	0	0	0	0	112.4	A120 L121 V128	A120-A124 WeakPolarHBondContact O-CB 3.46Å; A120-A124 PolarHBondContact O-N 3.16Å; L121-A124 PolarHBondContact O-N 3.19Å; A124-V128 WeakPolarHBondContact O-CG2 3.43Å; A124-V128 PolarHBondContact O-N 3.28Å; A124-V128 VanDerWaalsContact O-N 3.1Å
125	H	89.8	Confident	82.5	Confident	76 Å²	76	77.5 Å²	77.5	35%	0.352	43%	0.427	S	S	.	.	H	α-helix	trans	-57.7	-50.8	170.4	168.7	-84.9	0	0	0	111	T83 L121 L122 S123 T127 V128 A129	T83-H125 PolarHBondContact O-CE1 2.81Å; T83-H125 VanDerWaalsContact O-CE1 3.26Å; L121-H125 WeakPolarHBondContact O-CB 3.34Å; L121-H125 PolarHBondContact O-N 2.92Å; L122-H125 WeakPolarHBondContact O-CB 3.42Å; L122-H125 PolarHBondContact O-N 3.48Å; S123-H125 VanDerWaalsContact C-N 3.32Å; S123-H125 PolarHBondContact O-N 2.88Å; H125-T127 PolarHBondContact O-N 2.72Å; H125-V128 PolarHBondContact O-N 3.39Å; H125-A129 VanDerWaalsContact O-CB 3.22Å; H125-A129 WeakPolarHBondContact O-CB 3.49Å; H125-A129 PolarHBondContact O-N 3.11Å
126	D	90.6	Very high	80.8	Confident	9 Å²	9	84.3 Å²	84.3	5%	0.048	46%	0.46	C	S	.	.	H	α-helix	trans	-66.2	-39.2	-177.2	-70.4	-4.4	0	0	0	111.8	H85 A86 Q87 L122 S123 V128 A129 Q130	H85-D126 WeakPolarHBondContact CA-OD2 3.39Å; A86-D126 WeakPolarHBondContact CB-OD1 3.27Å; A86-D126 VanDerWaalsContact N-CG 3.28Å; A86-D126 PolarHBondContact N-OD1 3.48Å; A86-D126 PolarHBondContact N-OD2 3.35Å; Q87-D126 VanDerWaalsContact CB-OD2 3.27Å; Q87-D126 WeakPolarHBondContact CB-OD2 3.48Å; Q87-D126 PolarHBondContact N-OD2 3.24Å; L122-D126 PolarHBondContact O-N 3.03Å; S123-D126 PolarHBondContact O-N 2.85Å; D126-V128 PolarHBondContact O-N 2.93Å; D126-A129 PolarHBondContact O-N 3.16Å; D126-Q130 VanDerWaalsContact O-CB 3.26Å; D126-Q130 WeakPolarHBondContact O-CB 3.32Å; D126-Q130 WeakPolarHBondContact O-CG 3.14Å; D126-Q130 PolarHBondContact O-N 3.48Å
127	T	83.4	Confident	79	Confident	51 Å²	51	86.4 Å²	86.4	31%	0.313	46%	0.464	S	S	.	.	H	α-helix	trans	-57.7	-44.2	171.3	-57.3	0	0	0	0	112.3	S123 H125 K131 D132	S123-T127 PolarHBondContact O-N 3.42Å; S123-T127 PolarHBondContact O-OG1 3.08Å; H125-T127 PolarHBondContact O-N 2.72Å; T127-K131 PolarHBondContact O-N 3.14Å; T127-K131 VanDerWaalsContact O-N 3.16Å; T127-D132 HydrophobicContact CG2-CB 4.3Å; T127-D132 PolarHBondContact O-N 3.35Å
128	V	82.6	Confident	77.6	Confident	95 Å²	95	85.1 Å²	85.1	58%	0.576	47%	0.468	S	S	*	.	H	α-helix	trans	-70.8	-40	177.9	173.1	0	0	0	0	111.4	A124 H125 D126 K131 F133	A124-V128 WeakPolarHBondContact O-CG2 3.43Å; A124-V128 PolarHBondContact O-N 3.28Å; A124-V128 VanDerWaalsContact O-N 3.1Å; H125-V128 PolarHBondContact O-N 3.39Å; D126-V128 PolarHBondContact O-N 2.93Å; V128-K131 PolarHBondContact O-N 2.83Å; V128-F133 HydrophobicContact CG1-CE1 4.39Å
129	A	83.4	Confident	75.9	Confident	16 Å²	16	89.9 Å²	89.9	13%	0.132	50%	0.499	C	S	.	.	H	α-helix	trans	-67.7	-37.4	-179.7	0	0	0	0	0	112.6	P81 T84 H125 D126 K131	P81-A129 HydrophobicContact CB-CB 3.59Å; P81-A129 HydrophobicContact CG-CB 3.64Å; T84-A129 HydrophobicContact CG2-CB 4.16Å; H125-A129 VanDerWaalsContact O-CB 3.22Å; H125-A129 WeakPolarHBondContact O-CB 3.49Å; H125-A129 PolarHBondContact O-N 3.11Å; D126-A129 PolarHBondContact O-N 3.16Å; A129-K131 VanDerWaalsContact C-N 3.31Å
130	Q	81.9	Confident	74	Confident	96 Å²	96	92.1 Å²	92.1	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-81.1	-9.3	175.5	-65.4	174.8	18.8	0	0	113.2	T84 D126 D132	T84-Q130 PolarHBondContact O-NE2 2.91Å; D126-Q130 VanDerWaalsContact O-CB 3.26Å; D126-Q130 WeakPolarHBondContact O-CB 3.32Å; D126-Q130 WeakPolarHBondContact O-CG 3.14Å; D126-Q130 PolarHBondContact O-N 3.48Å; Q130-D132 PolarHBondContact O-N 2.73Å
131	K	74.5	Confident	72.9	Confident	131 Å²	131	93.8 Å²	93.8	57%	0.57	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	25.4	-173.3	-54	-177.2	176.5	-173.7	0	115.1	T127 V128 A129 F133 E134	T127-K131 PolarHBondContact O-N 3.14Å; T127-K131 VanDerWaalsContact O-N 3.16Å; V128-K131 PolarHBondContact O-N 2.83Å; A129-K131 VanDerWaalsContact C-N 3.31Å; K131-F133 HydrophobicContact CB-CE1 4.23Å; K131-F133 HydrophobicContact CG-CE1 4.45Å; K131-F133 PolarHBondContact O-N 3.37Å; K131-E134 PolarHBondContact O-N 3.03Å
132	D	67.4	Low	71.1	Confident	100 Å²	100	95.7 Å²	95.7	54%	0.535	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	31.7	-179.7	-162.6	37	0	0	0	112.8	T127 Q130	T127-D132 HydrophobicContact CG2-CB 4.3Å; T127-D132 PolarHBondContact O-N 3.35Å; Q130-D132 PolarHBondContact O-N 2.73Å
133	F	67.9	Low	69.3	Low	123 Å²	123	101 Å²	101	54%	0.539	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.8	-10.5	173	62.5	-98.6	0	0	0	112.2	V128 K131	V128-F133 HydrophobicContact CG1-CE1 4.39Å; K131-F133 HydrophobicContact CB-CE1 4.23Å; K131-F133 HydrophobicContact CG-CE1 4.45Å; K131-F133 PolarHBondContact O-N 3.37Å
134	E	62.4	Low	67.5	Low	113 Å²	113	102.5 Å²	102.5	53%	0.528	56%	0.563	S	S	.	*	S	Bend	trans	-84.3	136	173.3	-65.6	-176.9	174.4	0	0	109.6	K131 L136	K131-E134 PolarHBondContact O-N 3.03Å; E134-L136 PolarHBondContact O-N 3.27Å
135	P	55.3	Low	65.9	Low	118 Å²	118	103.4 Å²	103.4	77%	0.766	56%	0.564	S	S	*	*			trans	-66	118.6	-178.5	26.3	-33.6	0	0	0	110.6	L137	P135-L137 PolarHBondContact O-N 3.12Å
136	L	55.9	Low	64.1	Low	160 Å²	160	108.5 Å²	108.5	84%	0.838	59%	0.594	S	S	*	*			trans	-61.2	103.9	178.1	-67.1	173.4	0	0	0	110.8	E134	E134-L136 PolarHBondContact O-N 3.27Å
137	L	52	Low	62.3	Low	151 Å²	151	113 Å²	113	79%	0.791	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-68.8	145.8	168.5	-67.9	172.9	0	0	0	109.6	P135	P135-L137 PolarHBondContact O-N 3.12Å
138	P	59.7	Low	61	Low	104 Å²	104	116.5 Å²	116.5	68%	0.675	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-56.9	141.5	170.3	-21.2	32.1	0	0	0	110.8	L140	P138-L140 PolarHBondContact O-N 3.23Å
139	P	53.3	Low	60.2	Low	126 Å²	126	117.3 Å²	117.3	82%	0.818	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-60.4	130.5	176	25.4	-33	0	0	0	109.6
140	L	49.4	Very low	59.6	Low	137 Å²	137	120.6 Å²	120.6	72%	0.717	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-65.8	141.8	175.7	-69.4	167.3	0	0	0	109.5	P138 I144	P138-L140 PolarHBondContact O-N 3.23Å; L140-I144 HydrophobicContact CB-CD1 4.11Å; L140-I144 HydrophobicContact CD2-CD1 3.96Å; L140-I144 HydrophobicContact CG-CD1 4.44Å
141	P	63.6	Low	59.6	Low	97 Å²	97	119.8 Å²	119.8	63%	0.63	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-60.8	140.3	174.4	-22.1	33	0	0	0	111.9	N143	P141-N143 PolarHBondContact O-N 2.94Å
142	D	54.2	Low	60.2	Low	164 Å²	164	117.4 Å²	117.4	88%	0.877	65%	0.648	S	S	*	*	S	Bend	trans	-65.3	9.8	-175.1	-56.7	-62.5	0	0	0	115.9
143	N	52	Low	61.2	Low	154 Å²	154	118.3 Å²	118.3	82%	0.824	65%	0.652	S	S	*	*			trans	-133.7	51.4	-176.9	-69.5	-78.3	0	0	0	111.8	P141	P141-N143 PolarHBondContact O-N 2.94Å
144	I	50.7	Low	62.2	Low	79 Å²	79	112.6 Å²	112.6	41%	0.405	63%	0.627	S	S	.	*			trans	-102	119.5	162.5	-52.4	173.6	0	0	0	106.6	L140 E148	L140-I144 HydrophobicContact CB-CD1 4.11Å; L140-I144 HydrophobicContact CD2-CD1 3.96Å; L140-I144 HydrophobicContact CG-CD1 4.44Å; I144-E148 HydrophobicContact CG2-CB 4.34Å
145	P	54.3	Low	63.4	Low	72 Å²	72	110.2 Å²	110.2	47%	0.468	62%	0.622	S	S	.	*			trans	-66.7	137.7	173	27.7	-32.1	0	0	0	109.9	S147 E148	P145-S147 PolarHBondContact O-N 3.14Å; P145-E148 HydrophobicContact CG-CG 4.11Å; P145-E148 PolarHBondContact O-N 3.33Å; P145-E148 VanDerWaalsContact O-N 3.16Å
146	D	51.1	Low	64.9	Low	182 Å²	182	104.9 Å²	104.9	97%	0.973	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	9.7	-174.8	-66.7	-52.3	0	0	0	115.8
147	S	52.8	Low	66.3	Low	105 Å²	105	102.1 Å²	102.1	73%	0.734	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	4.7	178	78.9	0	0	0	0	114.8	P145 E149	P145-S147 PolarHBondContact O-N 3.14Å; S147-E149 PolarHBondContact O-N 3.22Å
148	E	56.8	Low	67.7	Low	124 Å²	124	96.8 Å²	96.8	58%	0.579	55%	0.547	S	S	*	.			trans	-81	97.6	173.9	-81.2	-172.4	167.9	0	0	111.3	I144 P145	I144-E148 HydrophobicContact CG2-CB 4.34Å; P145-E148 HydrophobicContact CG-CG 4.11Å; P145-E148 PolarHBondContact O-N 3.33Å; P145-E148 VanDerWaalsContact O-N 3.16Å
149	E	65.4	Low	68.6	Low	112 Å²	112	95.4 Å²	95.4	52%	0.523	53%	0.534	S	S	.	.			trans	-53.9	136.8	166.4	-61.4	-175.7	143.4	0	0	109.8	S147 M151 I231	S147-E149 PolarHBondContact O-N 3.22Å; E149-M151 WeakPolarHBondContact O-CG 3.29Å; E149-M151 PolarHBondContact O-N 3.4Å; E149-I231 HydrophobicContact CB-CD1 4.11Å; E149-I231 HydrophobicContact CB-CG1 4.33Å; E149-I231 HydrophobicContact CB-CG2 3.87Å; E149-I231 WeakPolarHBondContact OE2-CD1 3.35Å
150	A	71.8	Confident	69.6	Low	85 Å²	85	99.2 Å²	99.2	70%	0.702	54%	0.541	S	S	*	.			trans	-64.5	103	-171.5	0	0	0	0	0	112.5	P232	A150-P232 WeakPolarHBondContact O-CD 3.14Å
151	M	81.9	Confident	70.7	Confident	79 Å²	79	96.7 Å²	96.7	39%	0.389	53%	0.526	S	S	.	.			trans	-85.8	135.6	-176.4	-68.9	163.7	-155.8	0	0	112.6	E149 K229 V230 I231	E149-M151 WeakPolarHBondContact O-CG 3.29Å; E149-M151 PolarHBondContact O-N 3.4Å; M151-K229 HydrophobicContact CB-CG 4.31Å; M151-K229 HydrophobicContact SD-CD 4.29Å; M151-K229 WeakPolarHBondContact SD-CE 3.48Å; M151-K229 HydrophobicContact SD-CG 4.35Å; M151-V230 CarbonylContact C-O 3.57Å; M151-V230 WeakPolarHBondContact CA-O 3.22Å; M151-I231 HydrophobicContact CE-CD1 4.19Å; M151-I231 HydrophobicContact CE-CG1 4.5Å; M151-I231 HydrophobicContact CG-CD1 4.34Å; M151-I231 HydrophobicContact CG-CG1 3.65Å
152	R	87	Confident	71.6	Confident	80 Å²	80	96.4 Å²	96.4	30%	0.302	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.6	171.5	-177.5	179	65.2	-153.9	-8.7	109.7	V154 L192 D197 V230	R152-V154 HydrophobicContact CG-CG2 3.99Å; R152-L192 VanDerWaalsContact CZ-O 3.24Å; R152-L192 PolarHBondContact NH2-O 3.01Å; R152-D197 IonicContact NH2-OD2 2.73Å; R152-D197 PolarHBondContact NH2-OD2 2.74Å; R152-V230 HydrophobicContact CB-CG2 4.13Å; R152-V230 PolarHBondContact N-O 2.95Å; R152-V230 WeakPolarHBondContact O-CG2 3.4Å; R152-V230 PolarHBondContact O-N 3.03Å
153	I	87.7	Confident	73.1	Confident	120 Å²	120	89.6 Å²	89.6	62%	0.615	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.4	168.3	-58.5	176.1	0	0	0	108.6	F228	I153-F228 CarbonylContact C-O 3.56Å; I153-F228 WeakPolarHBondContact CA-O 3.4Å
154	V	88.1	Confident	74.8	Confident	2 Å²	2	82.6 Å²	82.6	1%	0.012	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.1	-178	171.9	0	0	0	0	109.3	R152 L156 L192 L193 M227 F228 V230	R152-V154 HydrophobicContact CG-CG2 3.99Å; V154-L156 HydrophobicContact CG1-CD2 4.22Å; V154-L156 HydrophobicContact CG1-CG 4.16Å; V154-L192 HydrophobicContact CB-CB 4.42Å; V154-L192 HydrophobicContact CG1-CB 3.42Å; V154-L192 VanDerWaalsContact CG1-CB 3.42Å; V154-L192 HydrophobicContact CG1-CD1 3.96Å; V154-L192 HydrophobicContact CG1-CG 4.35Å; V154-L192 HydrophobicContact CG2-CB 4.21Å; V154-L192 WeakPolarHBondContact CG2-O 3.02Å; V154-L193 HydrophobicContact CB-CD2 4.18Å; V154-L193 HydrophobicContact CG1-CD2 4.08Å; V154-L193 HydrophobicContact CG1-CG 4.02Å; V154-L193 HydrophobicContact CG2-CD2 4.01Å; V154-M227 CarbonylContact O-C 3.58Å; V154-M227 WeakPolarHBondContact O-CA 3.44Å; V154-F228 HydrophobicContact CB-CB 4.29Å; V154-F228 PolarHBondContact N-O 2.97Å; V154-F228 PolarHBondContact O-N 2.79Å; V154-V230 HydrophobicContact CG2-CG2 4.02Å
155	C	88.2	Confident	76.7	Confident	64 Å²	64	80.6 Å²	80.6	43%	0.432	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122	179	-56.4	0	0	0	0	110.2	T225 I226	C155-T225 HydrophobicContact CB-CG2 4.08Å; C155-I226 CarbonylContact C-O 3.47Å; C155-I226 WeakPolarHBondContact CA-O 3.26Å
156	L	87.1	Confident	78.4	Confident	6 Å²	6	78 Å²	78	3%	0.031	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.7	177	-60.9	-177.9	0	0	0	110.2	V154 K158 V187 S190 L192 L193 I226 F228	V154-L156 HydrophobicContact CG1-CD2 4.22Å; V154-L156 HydrophobicContact CG1-CG 4.16Å; L156-K158 PolarHBondContact O-N 2.89Å; L156-V187 HydrophobicContact CD1-CG2 3.78Å; L156-S190 VanDerWaalsContact CD2-CB 3.44Å; L156-S190 WeakPolarHBondContact CD2-OG 3.48Å; L156-L192 HydrophobicContact CD2-CD1 4.34Å; L156-L193 HydrophobicContact CD1-CD1 3.97Å; L156-I226 PolarHBondContact N-O 2.93Å; L156-I226 PolarHBondContact O-N 3.19Å; L156-F228 HydrophobicContact CB-CE2 4.36Å; L156-F228 HydrophobicContact CD1-CD2 4.29Å; L156-F228 HydrophobicContact CD1-CE2 3.86Å; L156-F228 HydrophobicContact CG-CD2 4.39Å; L156-F228 HydrophobicContact CG-CE2 4.23Å
157	V	85.8	Confident	80.2	Confident	102 Å²	102	71 Å²	71	62%	0.618	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	104.8	174.2	-176.6	0	0	0	0	108.9
158	K	82	Confident	82	Confident	38 Å²	38	70.5 Å²	70.5	17%	0.165	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.9	178.5	-174.1	-177.2	163.3	-156	0	110.6	L156 L163 L219 A220 S222 G224 I226	L156-K158 PolarHBondContact O-N 2.89Å; K158-L163 HydrophobicContact CB-CD2 3.99Å; K158-L163 HydrophobicContact CD-CD2 4.45Å; K158-L163 HydrophobicContact CG-CD2 3.97Å; K158-L219 PolarHBondContact NZ-O 2.87Å; K158-A220 PolarHBondContact NZ-O 2.78Å; K158-S222 PolarHBondContact NZ-O 2.67Å; K158-G224 WeakPolarHBondContact CB-O 3.39Å; K158-G224 PolarHBondContact N-O 2.99Å; K158-I226 HydrophobicContact CB-CD1 3.82Å; K158-I226 HydrophobicContact CB-CG1 4.12Å; K158-I226 HydrophobicContact CD-CD1 3.5Å; K158-I226 HydrophobicContact CG-CD1 4.23Å
159	N	77.9	Confident	83.5	Confident	75 Å²	75	69.9 Å²	69.9	40%	0.401	37%	0.369	S	S	.	.			trans	-95.3	-160	171.2	66.2	1.3	0	0	0	110.3	Q161 L186	N159-Q161 PolarHBondContact O-N 3.29Å; N159-Q161 WeakPolarHBondContact OD1-CA 3.41Å; N159-Q161 VanDerWaalsContact OD1-CB 3.31Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.46Å; N159-Q161 PolarHBondContact OD1-N 3.19Å; N159-Q161 PolarHBondContact OD1-O 2.99Å; N159-L186 WeakPolarHBondContact OD1-CD1 3.16Å
160	Q	73.4	Confident	84.5	Confident	206 Å²	206	68 Å²	68	96%	0.963	36%	0.359	S	S	*	.	S	Bend	trans	-76.2	-2.9	175.8	-65.5	-177.3	-0.1	0	0	114.1
161	Q	74.1	Confident	85	Confident	85 Å²	85	70.9 Å²	70.9	40%	0.397	36%	0.358	S	S	.	.	S	Bend	trans	-96.3	158.5	178.3	-65.8	178.6	-34.7	0	0	111.1	N159	N159-Q161 PolarHBondContact O-N 3.29Å; N159-Q161 WeakPolarHBondContact OD1-CA 3.41Å; N159-Q161 VanDerWaalsContact OD1-CB 3.31Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.46Å; N159-Q161 PolarHBondContact OD1-N 3.19Å; N159-Q161 PolarHBondContact OD1-O 2.99Å
162	P	81.2	Confident	84.9	Confident	90 Å²	90	74 Å²	74	58%	0.584	38%	0.376	S	S	*	.			trans	-60.3	152.2	169.2	26.6	-35.6	0	0	0	111.3	G164	P162-G164 PolarHBondContact O-N 2.72Å
163	L	86.3	Confident	84.7	Confident	22 Å²	22	74 Å²	74	12%	0.115	39%	0.385	C	S	.	.			trans	-63	-24	-179.2	-68.2	175.7	0	0	0	113.1	K158 L186 V187 L219 I226 F228	K158-L163 HydrophobicContact CB-CD2 3.99Å; K158-L163 HydrophobicContact CD-CD2 4.45Å; K158-L163 HydrophobicContact CG-CD2 3.97Å; L163-L186 HydrophobicContact CD2-CB 4.49Å; L163-L186 HydrophobicContact CD2-CD1 3.96Å; L163-L186 PolarHBondContact O-N 2.67Å; L163-V187 HydrophobicContact CB-CG2 3.99Å; L163-V187 WeakPolarHBondContact O-CG2 3.46Å; L163-V187 PolarHBondContact O-N 3.05Å; L163-L219 HydrophobicContact CD1-CD2 4.16Å; L163-I226 HydrophobicContact CD1-CD1 4.42Å; L163-F228 HydrophobicContact CD1-CE2 4.23Å; L163-F228 HydrophobicContact CD1-CZ 3.7Å
164	G	87.4	Confident	84.5	Confident	6 Å²	6	69 Å²	69	6%	0.062	36%	0.362	C	S	.	.	S	Bend	trans	80.1	44.9	-179.7	0	0	0	0	0	113.3	P162 I182	P162-G164 PolarHBondContact O-N 2.72Å; G164-I182 WeakPolarHBondContact O-CB 3.37Å; G164-I182 PolarHBondContact O-N 3.29Å
165	A	90.1	Very high	84.5	Confident	38 Å²	38	70.2 Å²	70.2	31%	0.314	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150	165.3	0	0	0	0	0	109.4	V178 R180 V187	A165-V178 HydrophobicContact CB-CG1 4.39Å; A165-R180 CarbonylContact C-O 3.5Å; A165-R180 VanDerWaalsContact CA-O 3.29Å; A165-R180 WeakPolarHBondContact CA-O 3.42Å; A165-R180 WeakPolarHBondContact CB-O 3.48Å; A165-V187 HydrophobicContact CB-CB 4.22Å; A165-V187 HydrophobicContact CB-CG1 4.13Å; A165-V187 HydrophobicContact CB-CG2 3.93Å
166	T	89.4	Confident	84.6	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.098	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	142.4	171.5	59.6	0	0	0	0	109.4	A179 R180 I182 C249 A252	T166-A179 WeakPolarHBondContact O-CB 3.46Å; T166-A179 PolarHBondContact O-N 2.92Å; T166-R180 PolarHBondContact N-O 3.33Å; T166-R180 PolarHBondContact O-N 2.86Å; T166-R180 VanDerWaalsContact OG1-CB 3.3Å; T166-R180 WeakPolarHBondContact OG1-CB 3.41Å; T166-R180 PolarHBondContact OG1-N 3.15Å; T166-I182 HydrophobicContact CG2-CD1 4.49Å; T166-C249 HydrophobicContact CG2-CB 3.94Å; T166-A252 HydrophobicContact CG2-CB 4.2Å
167	I	90.8	Very high	84.8	Confident	36 Å²	36	68.5 Å²	68.5	19%	0.185	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	153.2	176.3	56.6	169.2	0	0	0	110.6	I176 L177 L199 P212 V215 I216	I167-I176 HydrophobicContact CB-CG2 4.09Å; I167-I176 HydrophobicContact CD1-CG2 4.02Å; I167-I176 HydrophobicContact CG2-CG2 4.41Å; I167-L177 CarbonylContact C-O 3.59Å; I167-L177 WeakPolarHBondContact CA-O 3.35Å; I167-L199 HydrophobicContact CG2-CD1 3.56Å; I167-P212 HydrophobicContact CD1-CB 4.1Å; I167-P212 HydrophobicContact CG1-CB 4.23Å; I167-V215 HydrophobicContact CD1-CB 3.82Å; I167-V215 HydrophobicContact CD1-CG1 3.82Å; I167-I216 HydrophobicContact CD1-CG1 4.29Å
168	K	88.8	Confident	85	Confident	94 Å²	94	63.8 Å²	63.8	41%	0.409	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.4	172.7	68.6	-177.5	-179.6	177.6	0	110.3	L177 A179	K168-L177 HydrophobicContact CG-CB 4.31Å; K168-L177 PolarHBondContact N-O 2.81Å; K168-L177 PolarHBondContact O-N 2.79Å; K168-A179 HydrophobicContact CB-CB 3.93Å; K168-A179 HydrophobicContact CD-CB 3.85Å; K168-A179 HydrophobicContact CG-CB 3.8Å
169	R	88.9	Confident	85.2	Confident	112 Å²	112	62.9 Å²	62.9	42%	0.423	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	135.3	168.6	-166.4	169	175.8	-149	-10.3	109.6	G174 D175 I176 D211 P212	R169-G174 WeakPolarHBondContact CG-O 3.44Å; R169-G174 PolarHBondContact NE-O 3.27Å; R169-D175 CarbonylContact C-O 3.59Å; R169-D175 WeakPolarHBondContact CA-O 3.44Å; R169-I176 HydrophobicContact CB-CD1 4Å; R169-I176 HydrophobicContact CG-CD1 4.1Å; R169-D211 IonicContact CZ-OD1 3.26Å; R169-D211 IonicContact NE-OD1 2.73Å; R169-D211 IonicContact NH1-OD1 2.9Å; R169-D211 PolarHBondContact NH1-OD1 3Å; R169-P212 HydrophobicContact CB-CG 3.95Å
170	H	86.1	Confident	85.7	Confident	71 Å²	71	60.2 Å²	60.2	33%	0.329	31%	0.31	S	S	.	.			trans	-79.8	125.1	177.3	-174.4	-122.5	0	0	0	110.3	I172 T173 G174 D175 L177	H170-I172 PolarHBondContact O-N 3.33Å; H170-I172 VanDerWaalsContact O-N 3.13Å; H170-T173 PolarHBondContact ND1-N 3.26Å; H170-T173 PolarHBondContact ND1-OG1 3.09Å; H170-G174 WeakPolarHBondContact O-CA 3.35Å; H170-G174 PolarHBondContact O-N 3.05Å; H170-D175 HydrophobicContact CB-CB 4.35Å; H170-D175 PolarHBondContact N-O 2.66Å; H170-L177 HydrophobicContact CB-CD1 4.03Å; H170-L177 HydrophobicContact CB-CG 4.42Å
171	E	81.9	Confident	86.6	Confident	146 Å²	146	51.8 Å²	51.8	68%	0.682	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-34.9	-171.6	-64.3	171.4	179.7	0	0	114.1	K242	E171-K242 VanDerWaalsContact CD-NZ 3.32Å; E171-K242 IonicContact OE1-NZ 2.7Å; E171-K242 PolarHBondContact OE1-NZ 2.97Å; E171-K242 VanDerWaalsContact OE1-NZ 3.16Å; E171-K242 IonicContact OE2-NZ 3.87Å; E171-K242 PolarHBondContact OE2-NZ 2.85Å
172	I	81.4	Confident	87.3	Confident	146 Å²	146	48.2 Å²	48.2	75%	0.749	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-44.3	-169.6	-56.3	174.8	0	0	0	112.1	H170	H170-I172 PolarHBondContact O-N 3.33Å; H170-I172 VanDerWaalsContact O-N 3.13Å
173	T	82.9	Confident	87.6	Confident	80 Å²	80	46.2 Å²	46.2	49%	0.491	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-15.5	-176.5	61.4	0	0	0	0	113.1	H170 D175	H170-T173 PolarHBondContact ND1-N 3.26Å; H170-T173 PolarHBondContact ND1-OG1 3.09Å; T173-D175 VanDerWaalsContact CB-OD2 3.25Å; T173-D175 WeakPolarHBondContact CB-OD2 3.41Å; T173-D175 PolarHBondContact O-N 3.11Å; T173-D175 WeakPolarHBondContact OG1-CB 3.35Å; T173-D175 PolarHBondContact OG1-OD2 2.89Å
174	G	82.8	Confident	87.6	Confident	14 Å²	14	46.1 Å²	46.1	14%	0.144	24%	0.244	C	C	.	.			trans	74.9	-0.5	-174.3	0	0	0	0	0	114.7	R169 H170	R169-G174 WeakPolarHBondContact CG-O 3.44Å; R169-G174 PolarHBondContact NE-O 3.27Å; H170-G174 WeakPolarHBondContact O-CA 3.35Å; H170-G174 PolarHBondContact O-N 3.05Å
175	D	87.6	Confident	87.6	Confident	28 Å²	28	46 Å²	46	15%	0.15	24%	0.243	C	C	.	.			trans	-63.1	146.8	-178.7	-69.4	-46.7	0	0	0	113.1	R169 H170 T173 L177 K198	R169-D175 CarbonylContact C-O 3.59Å; R169-D175 WeakPolarHBondContact CA-O 3.44Å; H170-D175 HydrophobicContact CB-CB 4.35Å; H170-D175 PolarHBondContact N-O 2.66Å; T173-D175 VanDerWaalsContact CB-OD2 3.25Å; T173-D175 WeakPolarHBondContact CB-OD2 3.41Å; T173-D175 PolarHBondContact O-N 3.11Å; T173-D175 WeakPolarHBondContact OG1-CB 3.35Å; T173-D175 PolarHBondContact OG1-OD2 2.89Å; D175-L177 HydrophobicContact CB-CD2 4.28Å; D175-K198 HydrophobicContact CB-CD 4.26Å; D175-K198 VanDerWaalsContact CG-CE 3.4Å; D175-K198 WeakPolarHBondContact OD1-CE 3.46Å; D175-K198 IonicContact OD1-NZ 2.67Å; D175-K198 PolarHBondContact OD1-NZ 3.17Å; D175-K198 IonicContact OD2-NZ 3.91Å; D175-K198 PolarHBondContact OD2-NZ 3.21Å
176	I	90.4	Very high	87.4	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119	170.7	-59.6	-61.8	0	0	0	109.5	I167 R169 L199 V207 P212 V215	I167-I176 HydrophobicContact CB-CG2 4.09Å; I167-I176 HydrophobicContact CD1-CG2 4.02Å; I167-I176 HydrophobicContact CG2-CG2 4.41Å; R169-I176 HydrophobicContact CB-CD1 4Å; R169-I176 HydrophobicContact CG-CD1 4.1Å; I176-L199 HydrophobicContact CB-CB 4.44Å; I176-L199 HydrophobicContact CG2-CB 4.22Å; I176-L199 HydrophobicContact CG2-CD1 3.87Å; I176-L199 PolarHBondContact O-N 2.82Å; I176-V207 HydrophobicContact CB-CG2 4.26Å; I176-V207 HydrophobicContact CG1-CG2 4.46Å; I176-P212 HydrophobicContact CD1-CG 4.05Å; I176-V215 HydrophobicContact CG1-CG2 4.34Å
177	L	90.9	Very high	87.4	Confident	31 Å²	31	45.4 Å²	45.4	16%	0.162	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	144.5	-178.9	-55.7	-179.9	0	0	0	110.7	I167 K168 H170 D175 A179 K198	I167-L177 CarbonylContact C-O 3.59Å; I167-L177 WeakPolarHBondContact CA-O 3.35Å; K168-L177 HydrophobicContact CG-CB 4.31Å; K168-L177 PolarHBondContact N-O 2.81Å; K168-L177 PolarHBondContact O-N 2.79Å; H170-L177 HydrophobicContact CB-CD1 4.03Å; H170-L177 HydrophobicContact CB-CG 4.42Å; D175-L177 HydrophobicContact CB-CD2 4.28Å; L177-A179 PolarHBondContact O-N 2.74Å; L177-K198 HydrophobicContact CD2-CB 3.63Å; L177-K198 HydrophobicContact CD2-CG 4.11Å
178	V	90.4	Very high	87.3	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	112.9	166.6	-178.8	0	0	0	0	108.4	A165 V181 Y194 G196 D197 L199	A165-V178 HydrophobicContact CB-CG1 4.39Å; V178-V181 HydrophobicContact CG1-CG2 4.43Å; V178-Y194 WeakPolarHBondContact CB-O 3.48Å; V178-Y194 WeakPolarHBondContact CG1-O 3.23Å; V178-G196 PolarHBondContact O-N 3.02Å; V178-D197 HydrophobicContact CG2-CB 4.23Å; V178-D197 PolarHBondContact N-O 3.32Å; V178-L199 HydrophobicContact CG2-CD1 3.95Å; V178-L199 HydrophobicContact CG2-CG 4.29Å
179	A	87.3	Confident	87.2	Confident	19 Å²	19	50.6 Å²	50.6	16%	0.157	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-36.1	-176.9	0	0	0	0	0	112.9	T166 K168 L177	T166-A179 WeakPolarHBondContact O-CB 3.46Å; T166-A179 PolarHBondContact O-N 2.92Å; K168-A179 HydrophobicContact CB-CB 3.93Å; K168-A179 HydrophobicContact CD-CB 3.85Å; K168-A179 HydrophobicContact CG-CB 3.8Å; L177-A179 PolarHBondContact O-N 2.74Å
180	R	88.5	Confident	87.1	Confident	19 Å²	19	47.2 Å²	47.2	7%	0.072	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	147.4	-177.6	-161	-174.4	-59.4	-122.7	-8.1	110.3	A165 T166 D269 W272	A165-R180 CarbonylContact C-O 3.5Å; A165-R180 VanDerWaalsContact CA-O 3.29Å; A165-R180 WeakPolarHBondContact CA-O 3.42Å; A165-R180 WeakPolarHBondContact CB-O 3.48Å; T166-R180 PolarHBondContact N-O 3.33Å; T166-R180 PolarHBondContact O-N 2.86Å; T166-R180 VanDerWaalsContact OG1-CB 3.3Å; T166-R180 WeakPolarHBondContact OG1-CB 3.41Å; T166-R180 PolarHBondContact OG1-N 3.15Å; R180-D269 IonicContact CZ-OD2 2.71Å; R180-D269 IonicContact NH1-OD2 2.67Å; R180-D269 PolarHBondContact NH1-OD2 3.08Å; R180-D269 IonicContact NH2-OD2 3.9Å; R180-D269 PolarHBondContact NH2-OD2 3.05Å; R180-W272 PolarHBondContact NH1-O 3.43Å
181	V	90.6	Very high	87.1	Confident	28 Å²	28	45.4 Å²	45.4	17%	0.17	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.8	166.5	177.7	0	0	0	0	108.8	V178 V187 E188 Q274	V178-V181 HydrophobicContact CG1-CG2 4.43Å; V181-V187 HydrophobicContact CG1-CB 4.44Å; V181-V187 HydrophobicContact CG1-CG1 3.89Å; V181-V187 HydrophobicContact CG2-CG1 3.94Å; V181-E188 HydrophobicContact CG1-CB 3.73Å; V181-E188 HydrophobicContact CG1-CG 4.46Å; V181-Q274 PolarHBondContact O-NE2 3.43Å
182	I	89.8	Confident	87.4	Confident	10 Å²	10	42 Å²	42	5%	0.051	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-98.2	126.4	-177.7	-57	-61.4	0	0	0	109.9	G164 T166 G185 Q274 C284 A285 L287	G164-I182 WeakPolarHBondContact O-CB 3.37Å; G164-I182 PolarHBondContact O-N 3.29Å; T166-I182 HydrophobicContact CG2-CD1 4.49Å; I182-G185 PolarHBondContact O-N 2.87Å; I182-G185 VanDerWaalsContact O-N 3.09Å; I182-Q274 VanDerWaalsContact CA-OE1 3.31Å; I182-C284 HydrophobicContact CG2-CB 4.2Å; I182-A285 HydrophobicContact CG2-CB 4.37Å; I182-A285 WeakPolarHBondContact CG2-O 3.38Å; I182-L287 HydrophobicContact CD1-CD2 4.29Å
183	H	88	Confident	87.7	Confident	49 Å²	49	35.5 Å²	35.5	23%	0.227	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	142.5	-177.4	-70.1	69.1	0	0	0	111.7	G185 E188 V265 D266 Q274 C284 A285	H183-G185 PolarHBondContact O-N 2.93Å; H183-E188 WeakPolarHBondContact CA-OE1 3.38Å; H183-E188 IonicContact CD2-OE1 3.68Å; H183-E188 PolarHBondContact CD2-OE1 2.88Å; H183-E188 IonicContact CG-OE1 3.32Å; H183-E188 VanDerWaalsContact CG-OE1 3.31Å; H183-E188 IonicContact NE2-OE1 3.22Å; H183-V265 HydrophobicContact CB-CB 4.37Å; H183-V265 HydrophobicContact CB-CG1 3.66Å; H183-D266 WeakPolarHBondContact CE1-CB 3.4Å; H183-D266 IonicContact CE1-OD2 3.79Å; H183-D266 PolarHBondContact CE1-OD2 3.43Å; H183-D266 IonicContact ND1-OD2 2.89Å; H183-Q274 PolarHBondContact ND1-NE2 2.84Å; H183-Q274 VanDerWaalsContact ND1-NE2 3.17Å; H183-Q274 PolarHBondContact ND1-OE1 2.89Å; H183-C284 WeakPolarHBondContact O-CA 3.47Å; H183-A285 HydrophobicContact CB-CB 4.1Å; H183-A285 PolarHBondContact O-N 3.27Å
184	G	85.6	Confident	88	Confident	20 Å²	20	37.6 Å²	37.6	21%	0.206	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-2.1	-171.5	0	0	0	0	0	114.6	E188 R189	G184-E188 WeakPolarHBondContact CA-OE2 3.23Å; G184-E188 PolarHBondContact N-OE2 2.77Å; G184-R189 VanDerWaalsContact O-CZ 3.24Å; G184-R189 PolarHBondContact O-NE 3.43Å; G184-R189 PolarHBondContact O-NH2 2.97Å
185	G	87	Confident	88.3	Confident	4 Å²	4	38.9 Å²	38.9	4%	0.041	21%	0.207	C	C	.	.	S	Bend	trans	-74.4	168	177.3	0	0	0	0	0	114.6	I182 H183 V187 R189	I182-G185 PolarHBondContact O-N 2.87Å; I182-G185 VanDerWaalsContact O-N 3.09Å; H183-G185 PolarHBondContact O-N 2.93Å; G185-V187 VanDerWaalsContact C-N 3.32Å; G185-R189 VanDerWaalsContact O-CG 3.23Å; G185-R189 WeakPolarHBondContact O-CG 3.42Å; G185-R189 PolarHBondContact O-N 3.46Å
186	L	87.1	Confident	88.2	Confident	39 Å²	39	38.5 Å²	38.5	20%	0.204	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-38	173.9	-73	170.9	0	0	0	112	N159 L163 R189 S190	N159-L186 WeakPolarHBondContact OD1-CD1 3.16Å; L163-L186 HydrophobicContact CD2-CB 4.49Å; L163-L186 HydrophobicContact CD2-CD1 3.96Å; L163-L186 PolarHBondContact O-N 2.67Å; L186-R189 PolarHBondContact O-N 2.84Å; L186-S190 WeakPolarHBondContact O-CB 3.17Å; L186-S190 PolarHBondContact O-N 2.71Å
187	V	89.8	Confident	88.2	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-52.1	179.5	169.4	0	0	0	0	111	L156 L163 A165 V181 G185 S190 G191 L193	L156-V187 HydrophobicContact CD1-CG2 3.78Å; L163-V187 HydrophobicContact CB-CG2 3.99Å; L163-V187 WeakPolarHBondContact O-CG2 3.46Å; L163-V187 PolarHBondContact O-N 3.05Å; A165-V187 HydrophobicContact CB-CB 4.22Å; A165-V187 HydrophobicContact CB-CG1 4.13Å; A165-V187 HydrophobicContact CB-CG2 3.93Å; V181-V187 HydrophobicContact CG1-CB 4.44Å; V181-V187 HydrophobicContact CG1-CG1 3.89Å; V181-V187 HydrophobicContact CG2-CG1 3.94Å; G185-V187 VanDerWaalsContact C-N 3.32Å; V187-S190 PolarHBondContact O-N 3.5Å; V187-S190 PolarHBondContact O-OG 2.86Å; V187-G191 PolarHBondContact O-N 3.3Å; V187-L193 HydrophobicContact CG1-CB 3.85Å; V187-L193 HydrophobicContact CG1-CD1 4.49Å; V187-L193 HydrophobicContact CG2-CD1 4.37Å
188	E	87.9	Confident	88.2	Confident	73 Å²	73	39.6 Å²	39.6	34%	0.341	21%	0.213	S	C	.	.	H	α-helix	trans	-57.7	-52.6	176.4	-175.3	-160.2	-132.1	0	0	111.5	V181 H183 G184 S190 G191	V181-E188 HydrophobicContact CG1-CB 3.73Å; V181-E188 HydrophobicContact CG1-CG 4.46Å; H183-E188 WeakPolarHBondContact CA-OE1 3.38Å; H183-E188 IonicContact CD2-OE1 3.68Å; H183-E188 PolarHBondContact CD2-OE1 2.88Å; H183-E188 IonicContact CG-OE1 3.32Å; H183-E188 VanDerWaalsContact CG-OE1 3.31Å; H183-E188 IonicContact NE2-OE1 3.22Å; G184-E188 WeakPolarHBondContact CA-OE2 3.23Å; G184-E188 PolarHBondContact N-OE2 2.77Å; E188-S190 PolarHBondContact O-N 3.19Å; E188-S190 VanDerWaalsContact O-N 3.09Å; E188-G191 PolarHBondContact O-N 2.8Å
189	R	87	Confident	88.2	Confident	166 Å²	166	39.9 Å²	39.9	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-59.7	-24.8	-178.3	-67.7	175.3	-157.9	-160.2	7.2	113.5	G184 G185 L186	G184-R189 VanDerWaalsContact O-CZ 3.24Å; G184-R189 PolarHBondContact O-NE 3.43Å; G184-R189 PolarHBondContact O-NH2 2.97Å; G185-R189 VanDerWaalsContact O-CG 3.23Å; G185-R189 WeakPolarHBondContact O-CG 3.42Å; G185-R189 PolarHBondContact O-N 3.46Å; L186-R189 PolarHBondContact O-N 2.84Å
190	S	87.2	Confident	88.4	Confident	41 Å²	41	40.3 Å²	40.3	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-77.7	-32.3	175.4	77.9	0	0	0	0	113.2	L156 L186 V187 E188 L192	L156-S190 VanDerWaalsContact CD2-CB 3.44Å; L156-S190 WeakPolarHBondContact CD2-OG 3.48Å; L186-S190 WeakPolarHBondContact O-CB 3.17Å; L186-S190 PolarHBondContact O-N 2.71Å; V187-S190 PolarHBondContact O-N 3.5Å; V187-S190 PolarHBondContact O-OG 2.86Å; E188-S190 PolarHBondContact O-N 3.19Å; E188-S190 VanDerWaalsContact O-N 3.09Å; S190-L192 WeakPolarHBondContact O-CG 3.25Å; S190-L192 PolarHBondContact O-N 2.89Å; S190-L192 PolarHBondContact OG-N 2.84Å; S190-L192 VanDerWaalsContact OG-N 3.11Å
191	G	86	Confident	88.5	Confident	33 Å²	33	42 Å²	42	34%	0.34	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	15.2	-169.2	0	0	0	0	0	114.8	V187 E188 Y194	V187-G191 PolarHBondContact O-N 3.3Å; E188-G191 PolarHBondContact O-N 2.8Å; G191-Y194 VanDerWaalsContact O-CE2 3.29Å; G191-Y194 WeakPolarHBondContact O-CE2 3.32Å; G191-Y194 VanDerWaalsContact O-CZ 3.29Å; G191-Y194 PolarHBondContact O-OH 3.1Å
192	L	86.4	Confident	88.4	Confident	73 Å²	73	40.8 Å²	40.8	38%	0.382	22%	0.216	S	C	.	.			trans	-100	-12.3	-172.2	-57.5	-177.6	0	0	0	115	R152 V154 L156 S190	R152-L192 VanDerWaalsContact CZ-O 3.24Å; R152-L192 PolarHBondContact NH2-O 3.01Å; V154-L192 HydrophobicContact CB-CB 4.42Å; V154-L192 HydrophobicContact CG1-CB 3.42Å; V154-L192 VanDerWaalsContact CG1-CB 3.42Å; V154-L192 HydrophobicContact CG1-CD1 3.96Å; V154-L192 HydrophobicContact CG1-CG 4.35Å; V154-L192 HydrophobicContact CG2-CB 4.21Å; V154-L192 WeakPolarHBondContact CG2-O 3.02Å; L156-L192 HydrophobicContact CD2-CD1 4.34Å; S190-L192 WeakPolarHBondContact O-CG 3.25Å; S190-L192 PolarHBondContact O-N 2.89Å; S190-L192 PolarHBondContact OG-N 2.84Å; S190-L192 VanDerWaalsContact OG-N 3.11Å
193	L	89.5	Confident	88.3	Confident	10 Å²	10	43.2 Å²	43.2	5%	0.052	23%	0.229	C	C	.	.			trans	-131.7	141.5	174.9	-62.4	174.2	0	0	0	110.7	V154 L156 V187 F228 V230	V154-L193 HydrophobicContact CB-CD2 4.18Å; V154-L193 HydrophobicContact CG1-CD2 4.08Å; V154-L193 HydrophobicContact CG1-CG 4.02Å; V154-L193 HydrophobicContact CG2-CD2 4.01Å; L156-L193 HydrophobicContact CD1-CD1 3.97Å; V187-L193 HydrophobicContact CG1-CB 3.85Å; V187-L193 HydrophobicContact CG1-CD1 4.49Å; V187-L193 HydrophobicContact CG2-CD1 4.37Å; L193-F228 HydrophobicContact CD1-CD2 4.38Å; L193-V230 HydrophobicContact CD2-CB 4.42Å; L193-V230 HydrophobicContact CD2-CG1 3.71Å; L193-V230 HydrophobicContact CD2-CG2 4.01Å
194	Y	88.5	Confident	88	Confident	124 Å²	124	43.7 Å²	43.7	49%	0.486	25%	0.248	S	C	.	.			trans	-124.8	155.1	-175	-63	-95.1	0	0	0	111.1	V178 G191 G196 D197	V178-Y194 WeakPolarHBondContact CB-O 3.48Å; V178-Y194 WeakPolarHBondContact CG1-O 3.23Å; G191-Y194 VanDerWaalsContact O-CE2 3.29Å; G191-Y194 WeakPolarHBondContact O-CE2 3.32Å; G191-Y194 VanDerWaalsContact O-CZ 3.29Å; G191-Y194 PolarHBondContact O-OH 3.1Å; Y194-G196 PolarHBondContact O-N 3.39Å; Y194-D197 PolarHBondContact N-OD2 2.99Å; Y194-D197 WeakPolarHBondContact O-CB 3.33Å; Y194-D197 PolarHBondContact O-N 3.26Å; Y194-D197 VanDerWaalsContact O-N 3.15Å
195	A	88.2	Confident	88.1	Confident	41 Å²	41	46.2 Å²	46.2	34%	0.339	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	126	171.5	0	0	0	0	0	109.8
196	G	86.7	Confident	88.2	Confident	21 Å²	21	48.7 Å²	48.7	22%	0.216	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.2	-18.4	-171.7	0	0	0	0	0	114.8	V178 Y194 K198	V178-G196 PolarHBondContact O-N 3.02Å; Y194-G196 PolarHBondContact O-N 3.39Å; G196-K198 PolarHBondContact O-N 3.48Å
197	D	89.5	Confident	88.2	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.011	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-61.3	132.9	177.7	-73.6	-12.6	0	0	0	110.8	R152 V178 Y194 P232 V233	R152-D197 IonicContact NH2-OD2 2.73Å; R152-D197 PolarHBondContact NH2-OD2 2.74Å; V178-D197 HydrophobicContact CG2-CB 4.23Å; V178-D197 PolarHBondContact N-O 3.32Å; Y194-D197 PolarHBondContact N-OD2 2.99Å; Y194-D197 WeakPolarHBondContact O-CB 3.33Å; Y194-D197 PolarHBondContact O-N 3.26Å; Y194-D197 VanDerWaalsContact O-N 3.15Å; D197-P232 WeakPolarHBondContact OD1-CA 3.01Å; D197-V233 PolarHBondContact OD1-N 2.89Å
198	K	90.6	Very high	88	Confident	53 Å²	53	54.2 Å²	54.2	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	125	176.7	170.4	172.3	168.4	166.9	0	109.9	D175 L177 G196 V230 I231	D175-K198 HydrophobicContact CB-CD 4.26Å; D175-K198 VanDerWaalsContact CG-CE 3.4Å; D175-K198 WeakPolarHBondContact OD1-CE 3.46Å; D175-K198 IonicContact OD1-NZ 2.67Å; D175-K198 PolarHBondContact OD1-NZ 3.17Å; D175-K198 IonicContact OD2-NZ 3.91Å; D175-K198 PolarHBondContact OD2-NZ 3.21Å; L177-K198 HydrophobicContact CD2-CB 3.63Å; L177-K198 HydrophobicContact CD2-CG 4.11Å; G196-K198 PolarHBondContact O-N 3.48Å; K198-V230 CarbonylContact O-C 3.56Å; K198-V230 WeakPolarHBondContact O-CA 3.36Å; K198-V230 WeakPolarHBondContact O-CB 3.47Å; K198-I231 HydrophobicContact CB-CB 4.25Å; K198-I231 HydrophobicContact CD-CD1 4.22Å; K198-I231 PolarHBondContact N-O 2.82Å; K198-I231 PolarHBondContact O-N 3.19Å
199	L	90.9	Very high	87.8	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.052	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.3	176.1	-71.6	152.6	0	0	0	109	I167 I176 V178 V207 F228 V230	I167-L199 HydrophobicContact CG2-CD1 3.56Å; I176-L199 HydrophobicContact CB-CB 4.44Å; I176-L199 HydrophobicContact CG2-CB 4.22Å; I176-L199 HydrophobicContact CG2-CD1 3.87Å; I176-L199 PolarHBondContact O-N 2.82Å; V178-L199 HydrophobicContact CG2-CD1 3.95Å; V178-L199 HydrophobicContact CG2-CG 4.29Å; L199-V207 HydrophobicContact CB-CG2 3.97Å; L199-V207 WeakPolarHBondContact O-CG2 3.43Å; L199-F228 HydrophobicContact CD2-CB 4.39Å; L199-F228 HydrophobicContact CD2-CD1 3.45Å; L199-F228 VanDerWaalsContact CD2-CD1 3.45Å; L199-F228 HydrophobicContact CD2-CE1 4.08Å; L199-F228 HydrophobicContact CD2-CG 4.28Å; L199-V230 HydrophobicContact CD2-CG1 3.73Å; L199-V230 HydrophobicContact CG-CG1 4.35Å
200	V	90.9	Very high	87.8	Confident	28 Å²	28	47.1 Å²	47.1	17%	0.17	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-47.3	-178.9	-172	0	0	0	0	110.7	S206 V207 K229 I231	V200-S206 WeakPolarHBondContact O-CA 3.36Å; V200-V207 PolarHBondContact O-N 2.82Å; V200-K229 WeakPolarHBondContact CB-O 3.48Å; V200-K229 PolarHBondContact N-O 2.75Å; V200-I231 HydrophobicContact CG2-CD1 3.5Å; V200-I231 VanDerWaalsContact CG2-CD1 3.5Å; V200-I231 HydrophobicContact CG2-CG1 3.73Å
201	E	90.8	Very high	87.8	Confident	56 Å²	56	48 Å²	48	26%	0.262	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.5	176.2	-62.5	163.7	-153.1	0	0	111.6	V205 F228 K229	E201-V205 CarbonylContact C-O 3.59Å; E201-V205 VanDerWaalsContact CA-O 3.24Å; E201-V205 WeakPolarHBondContact CA-O 3.48Å; E201-F228 WeakPolarHBondContact O-CA 3.29Å; E201-K229 HydrophobicContact CB-CB 3.83Å; E201-K229 HydrophobicContact CB-CD 4.32Å; E201-K229 HydrophobicContact CG-CB 4.39Å; E201-K229 HydrophobicContact CG-CD 4.04Å; E201-K229 PolarHBondContact N-O 3.32Å; E201-K229 PolarHBondContact O-N 3.3Å; E201-K229 VanDerWaalsContact OE1-CD 3.23Å; E201-K229 WeakPolarHBondContact OE1-CD 3.48Å; E201-K229 WeakPolarHBondContact OE1-CE 3.15Å; E201-K229 IonicContact OE1-NZ 3.88Å; E201-K229 PolarHBondContact OE1-NZ 3.09Å; E201-K229 WeakPolarHBondContact OE2-CD 3.46Å; E201-K229 IonicContact OE2-NZ 2.79Å
202	V	90	Very high	87.9	Confident	1 Å²	1	48 Å²	48	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	118.1	170.7	178.6	0	0	0	0	108	G204 V205 V207 V215 I218 L219 I226 M227 F228	V202-G204 PolarHBondContact O-N 2.71Å; V202-G204 VanDerWaalsContact O-N 3.16Å; V202-V205 PolarHBondContact N-O 3.16Å; V202-V205 WeakPolarHBondContact O-CB 3.43Å; V202-V205 PolarHBondContact O-N 3.5Å; V202-V207 HydrophobicContact CB-CG1 4.24Å; V202-V207 HydrophobicContact CG2-CG1 3.7Å; V202-V215 HydrophobicContact CG2-CG1 4.39Å; V202-I218 HydrophobicContact CG1-CG2 4.22Å; V202-L219 HydrophobicContact CG1-CD2 3.56Å; V202-L219 HydrophobicContact CG1-CG 4.25Å; V202-I226 HydrophobicContact CG1-CG2 4.07Å; V202-M227 WeakPolarHBondContact CA-O 3.33Å; V202-F228 HydrophobicContact CG1-CE1 4.28Å; V202-F228 HydrophobicContact CG2-CD1 3.84Å; V202-F228 HydrophobicContact CG2-CE1 3.9Å
203	N	86.8	Confident	88	Confident	61 Å²	61	52 Å²	52	33%	0.326	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	33.6	-176.9	-70.7	-19.3	0	0	0	114.3	V205 S222 I226 M227	N203-V205 VanDerWaalsContact C-N 3.3Å; N203-V205 PolarHBondContact O-N 2.94Å; N203-S222 PolarHBondContact ND2-OG 3.2Å; N203-S222 VanDerWaalsContact ND2-OG 3.08Å; N203-I226 VanDerWaalsContact OD1-CA 3.32Å; N203-I226 WeakPolarHBondContact OD1-CA 3.4Å; N203-M227 PolarHBondContact N-O 2.63Å; N203-M227 PolarHBondContact OD1-N 3.13Å
204	G	82.8	Confident	88	Confident	60 Å²	60	55.9 Å²	55.9	62%	0.619	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	3	-177.6	0	0	0	0	0	115	V202	V202-G204 PolarHBondContact O-N 2.71Å; V202-G204 VanDerWaalsContact O-N 3.16Å
205	V	86.5	Confident	88	Confident	72 Å²	72	50 Å²	50	44%	0.436	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.9	169.6	-175.2	0	0	0	0	108.3	E201 V202 N203 I218	E201-V205 CarbonylContact C-O 3.59Å; E201-V205 VanDerWaalsContact CA-O 3.24Å; E201-V205 WeakPolarHBondContact CA-O 3.48Å; V202-V205 PolarHBondContact N-O 3.16Å; V202-V205 WeakPolarHBondContact O-CB 3.43Å; V202-V205 PolarHBondContact O-N 3.5Å; N203-V205 VanDerWaalsContact C-N 3.3Å; N203-V205 PolarHBondContact O-N 2.94Å; V205-I218 HydrophobicContact CG1-CD1 4.24Å
206	S	88.5	Confident	87.9	Confident	56 Å²	56	52.3 Å²	52.3	39%	0.392	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	136.8	172.2	-179.3	0	0	0	0	110.4	V200 E208	V200-S206 WeakPolarHBondContact O-CA 3.36Å; S206-E208 WeakPolarHBondContact OG-CB 3.24Å; S206-E208 PolarHBondContact OG-N 2.94Å
207	V	88.6	Confident	87.9	Confident	1 Å²	1	57 Å²	57	1%	0.006	32%	0.318	C	S	.	.			trans	-98.5	4.1	173.6	-59.2	0	0	0	0	113.2	I176 L199 V200 V202 G209 L210 V215	I176-V207 HydrophobicContact CB-CG2 4.26Å; I176-V207 HydrophobicContact CG1-CG2 4.46Å; L199-V207 HydrophobicContact CB-CG2 3.97Å; L199-V207 WeakPolarHBondContact O-CG2 3.43Å; V200-V207 PolarHBondContact O-N 2.82Å; V202-V207 HydrophobicContact CB-CG1 4.24Å; V202-V207 HydrophobicContact CG2-CG1 3.7Å; V207-G209 PolarHBondContact O-N 2.83Å; V207-L210 HydrophobicContact CB-CD1 4.4Å; V207-L210 HydrophobicContact CG1-CD1 4.4Å; V207-L210 PolarHBondContact O-N 2.75Å; V207-V215 HydrophobicContact CB-CG2 3.99Å; V207-V215 HydrophobicContact CG1-CG1 4.1Å; V207-V215 HydrophobicContact CG1-CG2 3.88Å
208	E	85.4	Confident	87.8	Confident	156 Å²	156	58.8 Å²	58.8	73%	0.729	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	128.5	175.9	-170.3	176.8	-168.8	0	0	110.9	S206 L210	S206-E208 WeakPolarHBondContact OG-CB 3.24Å; S206-E208 PolarHBondContact OG-N 2.94Å; E208-L210 PolarHBondContact O-N 2.88Å
209	G	82.3	Confident	87.6	Confident	53 Å²	53	57.6 Å²	57.6	55%	0.546	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	-4.8	-179.1	0	0	0	0	0	115.9	V207	V207-G209 PolarHBondContact O-N 2.83Å
210	L	87.2	Confident	87.3	Confident	37 Å²	37	60.2 Å²	60.2	19%	0.194	35%	0.347	C	S	.	.			trans	-76.1	153.2	173.1	-57.2	-170.9	0	0	0	111.3	V207 E208 Q214 V215 I218	V207-L210 HydrophobicContact CB-CD1 4.4Å; V207-L210 HydrophobicContact CG1-CD1 4.4Å; V207-L210 PolarHBondContact O-N 2.75Å; E208-L210 PolarHBondContact O-N 2.88Å; L210-Q214 HydrophobicContact CB-CB 4.47Å; L210-V215 HydrophobicContact CB-CG2 4.05Å; L210-V215 HydrophobicContact CD1-CG2 4.24Å; L210-I218 HydrophobicContact CD1-CD1 3.9Å
211	D	88.4	Confident	86.9	Confident	61 Å²	61	65.6 Å²	65.6	33%	0.326	37%	0.372	S	S	.	.			trans	-86.2	152.9	167.8	-66.4	-58.3	0	0	0	111.5	R169 E213 Q214 V215	R169-D211 IonicContact CZ-OD1 3.26Å; R169-D211 IonicContact NE-OD1 2.73Å; R169-D211 IonicContact NH1-OD1 2.9Å; R169-D211 PolarHBondContact NH1-OD1 3Å; D211-E213 PolarHBondContact O-N 2.92Å; D211-E213 VanDerWaalsContact O-N 3.11Å; D211-Q214 HydrophobicContact CB-CG 4.39Å; D211-Q214 WeakPolarHBondContact O-CB 3.44Å; D211-Q214 PolarHBondContact O-N 3.18Å; D211-Q214 PolarHBondContact OD2-NE2 2.86Å; D211-V215 PolarHBondContact O-N 3.38Å
212	P	88.3	Confident	86.5	Confident	31 Å²	31	63.9 Å²	63.9	20%	0.201	37%	0.366	C	S	.	.	H	α-helix	trans	-52.7	-37.1	-176.9	-28.9	36.3	0	0	0	114.2	I167 R169 I176 Q214 V215 I216	I167-P212 HydrophobicContact CD1-CB 4.1Å; I167-P212 HydrophobicContact CG1-CB 4.23Å; R169-P212 HydrophobicContact CB-CG 3.95Å; I176-P212 HydrophobicContact CD1-CG 4.05Å; P212-Q214 VanDerWaalsContact C-N 3.3Å; P212-Q214 PolarHBondContact O-N 2.93Å; P212-V215 PolarHBondContact O-N 3.18Å; P212-I216 WeakPolarHBondContact O-CD1 3.29Å; P212-I216 VanDerWaalsContact O-CG1 3.25Å; P212-I216 WeakPolarHBondContact O-CG1 3.49Å; P212-I216 PolarHBondContact O-N 3.05Å
213	E	88.6	Confident	85.9	Confident	159 Å²	159	69.2 Å²	69.2	74%	0.743	40%	0.402	S	S	*	.	H	α-helix	trans	-60	-38.3	177.5	-65.3	160.8	-166.7	0	0	112.4	D211 I216 H217	D211-E213 PolarHBondContact O-N 2.92Å; D211-E213 VanDerWaalsContact O-N 3.11Å; E213-I216 PolarHBondContact O-N 3.39Å; E213-H217 PolarHBondContact O-N 3.32Å
214	Q	89	Confident	85.8	Confident	90 Å²	90	68 Å²	68	42%	0.421	40%	0.403	S	S	.	.	H	α-helix	trans	-71.3	-40.6	179.1	-53.2	177.4	36.9	0	0	110.4	L210 D211 P212 H217 I218	L210-Q214 HydrophobicContact CB-CB 4.47Å; D211-Q214 HydrophobicContact CB-CG 4.39Å; D211-Q214 WeakPolarHBondContact O-CB 3.44Å; D211-Q214 PolarHBondContact O-N 3.18Å; D211-Q214 PolarHBondContact OD2-NE2 2.86Å; P212-Q214 VanDerWaalsContact C-N 3.3Å; P212-Q214 PolarHBondContact O-N 2.93Å; Q214-H217 WeakPolarHBondContact O-CB 3.49Å; Q214-H217 PolarHBondContact O-N 3.17Å; Q214-I218 WeakPolarHBondContact O-CG1 3.24Å; Q214-I218 PolarHBondContact O-N 2.77Å
215	V	87.9	Confident	86	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-41.1	173.8	-176.4	0	0	0	0	111.1	I167 I176 V202 V207 L210 D211 P212 H217 I218 L219	I167-V215 HydrophobicContact CD1-CB 3.82Å; I167-V215 HydrophobicContact CD1-CG1 3.82Å; I176-V215 HydrophobicContact CG1-CG2 4.34Å; V202-V215 HydrophobicContact CG2-CG1 4.39Å; V207-V215 HydrophobicContact CB-CG2 3.99Å; V207-V215 HydrophobicContact CG1-CG1 4.1Å; V207-V215 HydrophobicContact CG1-CG2 3.88Å; L210-V215 HydrophobicContact CB-CG2 4.05Å; L210-V215 HydrophobicContact CD1-CG2 4.24Å; D211-V215 PolarHBondContact O-N 3.38Å; P212-V215 PolarHBondContact O-N 3.18Å; V215-H217 VanDerWaalsContact C-N 3.31Å; V215-H217 PolarHBondContact O-N 3.25Å; V215-I218 PolarHBondContact O-N 2.64Å; V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 WeakPolarHBondContact O-CB 3.34Å; V215-L219 WeakPolarHBondContact O-CG 3.3Å; V215-L219 PolarHBondContact O-N 2.87Å
216	I	87.3	Confident	86.1	Confident	89 Å²	89	65.7 Å²	65.7	46%	0.456	38%	0.378	S	S	.	.	H	α-helix	trans	-61	-40.2	173.5	-69.8	161.9	0	0	0	110.7	I167 P212 E213 L219 A220	I167-I216 HydrophobicContact CD1-CG1 4.29Å; P212-I216 WeakPolarHBondContact O-CD1 3.29Å; P212-I216 VanDerWaalsContact O-CG1 3.25Å; P212-I216 WeakPolarHBondContact O-CG1 3.49Å; P212-I216 PolarHBondContact O-N 3.05Å; E213-I216 PolarHBondContact O-N 3.39Å; I216-L219 PolarHBondContact O-N 2.86Å; I216-A220 VanDerWaalsContact O-CB 3.29Å; I216-A220 WeakPolarHBondContact O-CB 3.44Å; I216-A220 PolarHBondContact O-N 3.4Å
217	H	85.8	Confident	86.2	Confident	120 Å²	120	67.7 Å²	67.7	56%	0.556	38%	0.382	S	S	*	.	H	α-helix	trans	-64	-45.8	176.4	-167.6	70.1	0	0	0	112.7	E213 Q214 V215 L219 A220 M221	E213-H217 PolarHBondContact O-N 3.32Å; Q214-H217 WeakPolarHBondContact O-CB 3.49Å; Q214-H217 PolarHBondContact O-N 3.17Å; V215-H217 VanDerWaalsContact C-N 3.31Å; V215-H217 PolarHBondContact O-N 3.25Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.24Å; H217-A220 WeakPolarHBondContact O-CB 3.32Å; H217-A220 PolarHBondContact O-N 2.61Å; H217-A220 VanDerWaalsContact O-N 3.14Å; H217-M221 PolarHBondContact NE2-SD 3.31Å; H217-M221 WeakPolarHBondContact O-CG 3.44Å; H217-M221 PolarHBondContact O-N 2.78Å
218	I	86.7	Confident	86.3	Confident	40 Å²	40	68 Å²	68	21%	0.205	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-45.5	174.2	-66.3	164	0	0	0	110.6	V202 V205 L210 Q214 V215 S222	V202-I218 HydrophobicContact CG1-CG2 4.22Å; V205-I218 HydrophobicContact CG1-CD1 4.24Å; L210-I218 HydrophobicContact CD1-CD1 3.9Å; Q214-I218 WeakPolarHBondContact O-CG1 3.24Å; Q214-I218 PolarHBondContact O-N 2.77Å; V215-I218 PolarHBondContact O-N 2.64Å; I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.3Å; I218-S222 VanDerWaalsContact O-N 3.1Å; I218-S222 PolarHBondContact O-OG 3.47Å
219	L	86.6	Confident	86.5	Confident	27 Å²	27	63.5 Å²	63.5	14%	0.141	36%	0.362	C	S	.	.	H	α-helix	trans	-65.7	-35.9	176.5	-72.6	173	0	0	0	112.4	K158 L163 V202 V215 I216 H217 S222 I226 F228	K158-L219 PolarHBondContact NZ-O 2.87Å; L163-L219 HydrophobicContact CD1-CD2 4.16Å; V202-L219 HydrophobicContact CG1-CD2 3.56Å; V202-L219 HydrophobicContact CG1-CG 4.25Å; V215-L219 HydrophobicContact CG1-CD1 4.21Å; V215-L219 WeakPolarHBondContact O-CB 3.34Å; V215-L219 WeakPolarHBondContact O-CG 3.3Å; V215-L219 PolarHBondContact O-N 2.87Å; I216-L219 PolarHBondContact O-N 2.86Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.24Å; L219-S222 PolarHBondContact O-N 3.27Å; L219-I226 HydrophobicContact CD2-CD1 3.92Å; L219-I226 HydrophobicContact CD2-CG2 3.92Å; L219-F228 HydrophobicContact CD1-CE1 4.5Å; L219-F228 HydrophobicContact CD2-CE1 3.8Å; L219-F228 HydrophobicContact CD2-CZ 3.64Å
220	A	84.2	Confident	87	Confident	66 Å²	66	61 Å²	61	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-44.8	178.3	0	0	0	0	0	111.8	K158 I216 H217 S222	K158-A220 PolarHBondContact NZ-O 2.78Å; I216-A220 VanDerWaalsContact O-CB 3.29Å; I216-A220 WeakPolarHBondContact O-CB 3.44Å; I216-A220 PolarHBondContact O-N 3.4Å; H217-A220 WeakPolarHBondContact O-CB 3.32Å; H217-A220 PolarHBondContact O-N 2.61Å; H217-A220 VanDerWaalsContact O-N 3.14Å; A220-S222 VanDerWaalsContact C-N 3.29Å; A220-S222 PolarHBondContact O-N 2.73Å
221	M	82.6	Confident	87	Confident	140 Å²	140	60.3 Å²	60.3	69%	0.69	33%	0.332	S	S	*	.	H	α-helix	trans	-68.8	-25.3	176	-65.8	-179.8	78.5	0	0	113.4	H217	H217-M221 PolarHBondContact NE2-SD 3.31Å; H217-M221 WeakPolarHBondContact O-CG 3.44Å; H217-M221 PolarHBondContact O-N 2.78Å
222	S	82.9	Confident	86.9	Confident	20 Å²	20	59.6 Å²	59.6	14%	0.14	33%	0.33	C	S	.	.			trans	-73.8	135.9	178.5	-63	0	0	0	0	112.2	K158 N203 I218 L219 A220	K158-S222 PolarHBondContact NZ-O 2.67Å; N203-S222 PolarHBondContact ND2-OG 3.2Å; N203-S222 VanDerWaalsContact ND2-OG 3.08Å; I218-S222 WeakPolarHBondContact O-CB 3.43Å; I218-S222 PolarHBondContact O-N 3.3Å; I218-S222 VanDerWaalsContact O-N 3.1Å; I218-S222 PolarHBondContact O-OG 3.47Å; L219-S222 PolarHBondContact O-N 3.27Å; A220-S222 VanDerWaalsContact C-N 3.29Å; A220-S222 PolarHBondContact O-N 2.73Å
223	C	78.1	Confident	86.4	Confident	114 Å²	114	60.8 Å²	60.8	77%	0.77	34%	0.337	S	S	*	.			trans	-131.7	153.3	176.5	64.4	0	0	0	0	111.4
224	G	84.7	Confident	85.1	Confident	34 Å²	34	59.6 Å²	59.6	35%	0.351	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.2	-140.7	-175.3	0	0	0	0	0	112.6	K158 I226	K158-G224 WeakPolarHBondContact CB-O 3.39Å; K158-G224 PolarHBondContact N-O 2.99Å; G224-I226 PolarHBondContact O-N 3.16Å
225	T	86.7	Confident	83.2	Confident	84 Å²	84	58.4 Å²	58.4	52%	0.515	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	119.9	-178.7	-52	0	0	0	0	111.1	C155	C155-T225 HydrophobicContact CB-CG2 4.08Å
226	I	89.1	Confident	81.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.6	170.3	-58.3	-175.5	0	0	0	108.6	C155 L156 K158 L163 V202 N203 L219 G224 F228	C155-I226 CarbonylContact C-O 3.47Å; C155-I226 WeakPolarHBondContact CA-O 3.26Å; L156-I226 PolarHBondContact N-O 2.93Å; L156-I226 PolarHBondContact O-N 3.19Å; K158-I226 HydrophobicContact CB-CD1 3.82Å; K158-I226 HydrophobicContact CB-CG1 4.12Å; K158-I226 HydrophobicContact CD-CD1 3.5Å; K158-I226 HydrophobicContact CG-CD1 4.23Å; L163-I226 HydrophobicContact CD1-CD1 4.42Å; V202-I226 HydrophobicContact CG1-CG2 4.07Å; N203-I226 VanDerWaalsContact OD1-CA 3.32Å; N203-I226 WeakPolarHBondContact OD1-CA 3.4Å; L219-I226 HydrophobicContact CD2-CD1 3.92Å; L219-I226 HydrophobicContact CD2-CG2 3.92Å; G224-I226 PolarHBondContact O-N 3.16Å; I226-F228 HydrophobicContact CB-CE2 4.04Å; I226-F228 HydrophobicContact CB-CZ 4.47Å; I226-F228 HydrophobicContact CG2-CD2 4.07Å; I226-F228 HydrophobicContact CG2-CE1 4.23Å; I226-F228 HydrophobicContact CG2-CE2 3.45Å; I226-F228 VanDerWaalsContact CG2-CE2 3.45Å; I226-F228 HydrophobicContact CG2-CZ 3.56Å
227	M	88.9	Confident	79	Confident	98 Å²	98	63.2 Å²	63.2	48%	0.483	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.1	174	-56.3	-160	-60.2	0	0	110.2	V154 V202 N203	V154-M227 CarbonylContact O-C 3.58Å; V154-M227 WeakPolarHBondContact O-CA 3.44Å; V202-M227 WeakPolarHBondContact CA-O 3.33Å; N203-M227 PolarHBondContact N-O 2.63Å; N203-M227 PolarHBondContact OD1-N 3.13Å
228	F	91.4	Very high	76.8	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.035	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133	174.5	-63.3	-87	0	0	0	109	I153 V154 L156 L163 L193 L199 E201 V202 L219 I226 V230	I153-F228 CarbonylContact C-O 3.56Å; I153-F228 WeakPolarHBondContact CA-O 3.4Å; V154-F228 HydrophobicContact CB-CB 4.29Å; V154-F228 PolarHBondContact N-O 2.97Å; V154-F228 PolarHBondContact O-N 2.79Å; L156-F228 HydrophobicContact CB-CE2 4.36Å; L156-F228 HydrophobicContact CD1-CD2 4.29Å; L156-F228 HydrophobicContact CD1-CE2 3.86Å; L156-F228 HydrophobicContact CG-CD2 4.39Å; L156-F228 HydrophobicContact CG-CE2 4.23Å; L163-F228 HydrophobicContact CD1-CE2 4.23Å; L163-F228 HydrophobicContact CD1-CZ 3.7Å; L193-F228 HydrophobicContact CD1-CD2 4.38Å; L199-F228 HydrophobicContact CD2-CB 4.39Å; L199-F228 HydrophobicContact CD2-CD1 3.45Å; L199-F228 VanDerWaalsContact CD2-CD1 3.45Å; L199-F228 HydrophobicContact CD2-CE1 4.08Å; L199-F228 HydrophobicContact CD2-CG 4.28Å; E201-F228 WeakPolarHBondContact O-CA 3.29Å; V202-F228 HydrophobicContact CG1-CE1 4.28Å; V202-F228 HydrophobicContact CG2-CD1 3.84Å; V202-F228 HydrophobicContact CG2-CE1 3.9Å; L219-F228 HydrophobicContact CD1-CE1 4.5Å; L219-F228 HydrophobicContact CD2-CE1 3.8Å; L219-F228 HydrophobicContact CD2-CZ 3.64Å; I226-F228 HydrophobicContact CB-CE2 4.04Å; I226-F228 HydrophobicContact CB-CZ 4.47Å; I226-F228 HydrophobicContact CG2-CD2 4.07Å; I226-F228 HydrophobicContact CG2-CE1 4.23Å; I226-F228 HydrophobicContact CG2-CE2 3.45Å; I226-F228 VanDerWaalsContact CG2-CE2 3.45Å; I226-F228 HydrophobicContact CG2-CZ 3.56Å; F228-V230 HydrophobicContact CB-CG1 4.02Å
229	K	90.3	Very high	74.5	Confident	62 Å²	62	65.9 Å²	65.9	27%	0.27	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.6	165.2	-168	177.9	171.8	-179.2	0	106.6	M151 V200 E201	M151-K229 HydrophobicContact CB-CG 4.31Å; M151-K229 HydrophobicContact SD-CD 4.29Å; M151-K229 WeakPolarHBondContact SD-CE 3.48Å; M151-K229 HydrophobicContact SD-CG 4.35Å; V200-K229 WeakPolarHBondContact CB-O 3.48Å; V200-K229 PolarHBondContact N-O 2.75Å; E201-K229 HydrophobicContact CB-CB 3.83Å; E201-K229 HydrophobicContact CB-CD 4.32Å; E201-K229 HydrophobicContact CG-CB 4.39Å; E201-K229 HydrophobicContact CG-CD 4.04Å; E201-K229 PolarHBondContact N-O 3.32Å; E201-K229 PolarHBondContact O-N 3.3Å; E201-K229 VanDerWaalsContact OE1-CD 3.23Å; E201-K229 WeakPolarHBondContact OE1-CD 3.48Å; E201-K229 WeakPolarHBondContact OE1-CE 3.15Å; E201-K229 IonicContact OE1-NZ 3.88Å; E201-K229 PolarHBondContact OE1-NZ 3.09Å; E201-K229 WeakPolarHBondContact OE2-CD 3.46Å; E201-K229 IonicContact OE2-NZ 2.79Å
230	V	91.6	Very high	72.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.1	-174.3	-59	0	0	0	0	112	M151 R152 V154 L193 K198 L199 F228	M151-V230 CarbonylContact C-O 3.57Å; M151-V230 WeakPolarHBondContact CA-O 3.22Å; R152-V230 HydrophobicContact CB-CG2 4.13Å; R152-V230 PolarHBondContact N-O 2.95Å; R152-V230 WeakPolarHBondContact O-CG2 3.4Å; R152-V230 PolarHBondContact O-N 3.03Å; V154-V230 HydrophobicContact CG2-CG2 4.02Å; L193-V230 HydrophobicContact CD2-CB 4.42Å; L193-V230 HydrophobicContact CD2-CG1 3.71Å; L193-V230 HydrophobicContact CD2-CG2 4.01Å; K198-V230 CarbonylContact O-C 3.56Å; K198-V230 WeakPolarHBondContact O-CA 3.36Å; K198-V230 WeakPolarHBondContact O-CB 3.47Å; L199-V230 HydrophobicContact CD2-CG1 3.73Å; L199-V230 HydrophobicContact CG-CG1 4.35Å; F228-V230 HydrophobicContact CB-CG1 4.02Å
231	I	89.1	Confident	70.2	Confident	22 Å²	22	70.4 Å²	70.4	11%	0.113	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.7	168.4	-61.9	161.2	0	0	0	105.6	E149 M151 K198 V200	E149-I231 HydrophobicContact CB-CD1 4.11Å; E149-I231 HydrophobicContact CB-CG1 4.33Å; E149-I231 HydrophobicContact CB-CG2 3.87Å; E149-I231 WeakPolarHBondContact OE2-CD1 3.35Å; M151-I231 HydrophobicContact CE-CD1 4.19Å; M151-I231 HydrophobicContact CE-CG1 4.5Å; M151-I231 HydrophobicContact CG-CD1 4.34Å; M151-I231 HydrophobicContact CG-CG1 3.65Å; K198-I231 HydrophobicContact CB-CB 4.25Å; K198-I231 HydrophobicContact CD-CD1 4.22Å; K198-I231 PolarHBondContact N-O 2.82Å; K198-I231 PolarHBondContact O-N 3.19Å; V200-I231 HydrophobicContact CG2-CD1 3.5Å; V200-I231 VanDerWaalsContact CG2-CD1 3.5Å; V200-I231 HydrophobicContact CG2-CG1 3.73Å
232	P	84.4	Confident	68.1	Low	46 Å²	46	71.1 Å²	71.1	30%	0.299	44%	0.439	S	S	.	.			trans	-70	144.5	-175.4	30.4	-33.7	0	0	0	110.2	A150 D197 S234	A150-P232 WeakPolarHBondContact O-CD 3.14Å; D197-P232 WeakPolarHBondContact OD1-CA 3.01Å; P232-S234 PolarHBondContact O-N 2.89Å
233	V	78.6	Confident	66	Low	57 Å²	57	76.2 Å²	76.2	35%	0.345	46%	0.463	S	S	.	.			trans	-68.8	125.7	-179.6	75.7	0	0	0	0	110.9	D197 A235	D197-V233 PolarHBondContact OD1-N 2.89Å; V233-A235 WeakPolarHBondContact CG2-O 3.45Å; V233-A235 PolarHBondContact O-N 2.89Å; V233-A235 VanDerWaalsContact O-N 3.14Å
234	S	60.4	Low	64.4	Low	134 Å²	134	76.8 Å²	76.8	94%	0.937	46%	0.458	S	S	*	.	S	Bend	trans	-66.2	-16.8	-172.3	-59.6	0	0	0	0	114.4	P232	P232-S234 PolarHBondContact O-N 2.89Å
235	A	50.9	Low	62.9	Low	64 Å²	64	77.2 Å²	77.2	53%	0.529	45%	0.454	S	S	.	.	S	Bend	trans	-151.1	143.1	170.1	0	0	0	0	0	108.5	V233	V233-A235 WeakPolarHBondContact CG2-O 3.45Å; V233-A235 PolarHBondContact O-N 2.89Å; V233-A235 VanDerWaalsContact O-N 3.14Å
236	P	43.3	Very low	62	Low	116 Å²	116	78.7 Å²	78.7	75%	0.753	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-60.1	125	177.5	24.9	-33.3	0	0	0	109.6	V238	P236-V238 PolarHBondContact O-N 2.92Å
237	P	42.8	Very low	61.1	Low	76 Å²	76	81 Å²	81	49%	0.494	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-67.4	120.3	-178	25.6	-32.9	0	0	0	110	S239	P237-S239 PolarHBondContact O-N 2.83Å
238	V	39	Very low	60.3	Low	131 Å²	131	79.7 Å²	79.7	79%	0.794	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-54.9	129.1	160.8	-178.4	0	0	0	0	106.8	P236 S240	P236-V238 PolarHBondContact O-N 2.92Å; V238-S240 PolarHBondContact O-N 3.24Å
239	S	39.3	Very low	59.5	Low	84 Å²	84	81 Å²	81	59%	0.587	48%	0.48	S	S	*	.			trans	-70.4	75	-168.4	-168.3	0	0	0	0	113	P237	P237-S239 PolarHBondContact O-N 2.83Å
240	S	36.1	Very low	58.9	Low	111 Å²	111	85.7 Å²	85.7	78%	0.776	50%	0.504	S	S	*	.			trans	-98.8	61.6	171.1	65.5	0	0	0	0	109.9	V238 K242	V238-S240 PolarHBondContact O-N 3.24Å; S240-K242 PolarHBondContact O-N 3.35Å
241	Q	43.7	Very low	58.4	Low	78 Å²	78	93.1 Å²	93.1	36%	0.364	54%	0.544	S	S	.	.			trans	-68.3	127.7	166.9	-61.3	-163.8	0.7	0	0	108.6	M243	Q241-M243 PolarHBondContact O-N 2.85Å
242	K	38.7	Very low	58.1	Low	154 Å²	154	92.9 Å²	92.9	67%	0.67	55%	0.546	S	S	*	.			trans	-56	138.5	169.2	-79.2	179.7	179.8	175.2	0	108.6	E171 S240 D244	E171-K242 VanDerWaalsContact CD-NZ 3.32Å; E171-K242 IonicContact OE1-NZ 2.7Å; E171-K242 PolarHBondContact OE1-NZ 2.97Å; E171-K242 VanDerWaalsContact OE1-NZ 3.16Å; E171-K242 IonicContact OE2-NZ 3.87Å; E171-K242 PolarHBondContact OE2-NZ 2.85Å; S240-K242 PolarHBondContact O-N 3.35Å; K242-D244 PolarHBondContact O-N 2.88Å
243	M	39.6	Very low	58.2	Low	128 Å²	128	91.9 Å²	91.9	63%	0.631	54%	0.543	S	S	*	.			trans	-80.3	76.3	-167.7	-66.3	165.8	52.7	0	0	113	Q241 R296	Q241-M243 PolarHBondContact O-N 2.85Å; M243-R296 VanDerWaalsContact CE-NH1 3.32Å
244	D	42.9	Very low	58.7	Low	125 Å²	125	90.9 Å²	90.9	67%	0.668	54%	0.536	S	S	*	.			trans	-78.2	138.2	165.5	-89.6	-42.9	0	0	0	111.9	K242 D246	K242-D244 PolarHBondContact O-N 2.88Å; D244-D246 VanDerWaalsContact C-N 3.31Å; D244-D246 PolarHBondContact O-N 2.93Å
245	P	54.2	Low	60.1	Low	43 Å²	43	89.5 Å²	89.5	28%	0.279	52%	0.524	S	S	.	.	S	Bend	trans	-83.4	-1.5	-173.8	-12.3	31.5	0	0	0	115.1	K297	P245-K297 VanDerWaalsContact CB-NZ 3.32Å; P245-K297 WeakPolarHBondContact O-CE 3.25Å; P245-K297 PolarHBondContact O-NZ 3.46Å
246	D	67.3	Low	61.9	Low	115 Å²	115	89.9 Å²	89.9	62%	0.615	51%	0.514	S	S	*	.	S	Bend	trans	-108.5	169.8	-171.5	-64.7	-24.6	0	0	0	111.3	D244 P248 W272 K297	D244-D246 VanDerWaalsContact C-N 3.31Å; D244-D246 PolarHBondContact O-N 2.93Å; D246-P248 WeakPolarHBondContact O-CD 3.44Å; D246-W272 PolarHBondContact O-NE1 3.03Å; D246-K297 IonicContact OD1-NZ 3.18Å
247	I	70.1	Confident	63.9	Low	50 Å²	50	90.7 Å²	90.7	26%	0.256	51%	0.511	S	S	.	.			trans	-70.9	125.1	-175.4	-168.8	170.6	0	0	0	110.9	C249 M250 G253 W272	I247-C249 PolarHBondContact O-N 2.82Å; I247-M250 HydrophobicContact CG2-CB 4.41Å; I247-M250 HydrophobicContact CG2-CE 4.44Å; I247-M250 HydrophobicContact CG2-CG 3.56Å; I247-G253 VanDerWaalsContact CD1-CA 3.5Å; I247-W272 VanDerWaalsContact CA-CZ2 3.44Å; I247-W272 HydrophobicContact CB-CH2 3.6Å; I247-W272 HydrophobicContact CB-CZ2 3.89Å; I247-W272 HydrophobicContact CB-CZ3 4.14Å; I247-W272 HydrophobicContact CD1-CH2 4.24Å; I247-W272 HydrophobicContact CD1-CZ3 3.95Å; I247-W272 HydrophobicContact CG1-CE3 4.23Å; I247-W272 HydrophobicContact CG1-CH2 3.76Å; I247-W272 HydrophobicContact CG1-CZ2 4.24Å; I247-W272 HydrophobicContact CG1-CZ3 3.75Å
248	P	72.1	Confident	65.8	Low	69 Å²	69	93.1 Å²	93.1	45%	0.448	51%	0.514	S	S	.	.	S	Bend	trans	-61.5	-22.1	-174.5	-27.1	35	0	0	0	114.6	D246 W272	D246-P248 WeakPolarHBondContact O-CD 3.44Å; P248-W272 HydrophobicContact CG-CG 4.1Å
249	C	75.7	Confident	67.7	Low	37 Å²	37	90 Å²	90	25%	0.25	51%	0.508	C	S	.	.			trans	-157	118.7	172.7	175.7	0	0	0	0	108.1	T166 I247 A252	T166-C249 HydrophobicContact CG2-CB 3.94Å; I247-C249 PolarHBondContact O-N 2.82Å; C249-A252 HydrophobicContact CB-CB 3.87Å; C249-A252 PolarHBondContact O-N 3.08Å
250	M	77.1	Confident	70	Confident	159 Å²	159	88.8 Å²	88.8	78%	0.783	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-62.9	-41.6	-179.6	-77.5	-169.2	165.8	0	0	112.3	I247 A252 G253	I247-M250 HydrophobicContact CG2-CB 4.41Å; I247-M250 HydrophobicContact CG2-CE 4.44Å; I247-M250 HydrophobicContact CG2-CG 3.56Å; M250-A252 PolarHBondContact O-N 2.77Å; M250-G253 PolarHBondContact O-N 2.92Å
251	D	80.6	Confident	72.7	Confident	157 Å²	157	86 Å²	86	84%	0.84	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-65.7	-20.4	179.3	-58.2	-32.7	0	0	0	113.3
252	A	83.9	Confident	75	Confident	17 Å²	17	83.6 Å²	83.6	14%	0.14	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-87.7	-6.9	174.2	0	0	0	0	0	113	T166 C249 M250 G286 L287	T166-A252 HydrophobicContact CG2-CB 4.2Å; C249-A252 HydrophobicContact CB-CB 3.87Å; C249-A252 PolarHBondContact O-N 3.08Å; M250-A252 PolarHBondContact O-N 2.77Å; A252-G286 CarbonylContact O-C 3.42Å; A252-G286 VanDerWaalsContact O-CA 3.23Å; A252-G286 WeakPolarHBondContact O-CA 3.45Å; A252-L287 HydrophobicContact CB-CD1 3.98Å; A252-L287 HydrophobicContact CB-CG 4.11Å; A252-L287 PolarHBondContact O-N 2.62Å
253	G	86.7	Confident	77.6	Confident	24 Å²	24	80 Å²	80	25%	0.247	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-70.7	135.4	-178.8	0	0	0	0	0	113	I247 M250 P255	I247-G253 VanDerWaalsContact CD1-CA 3.5Å; M250-G253 PolarHBondContact O-N 2.92Å; G253-P255 WeakPolarHBondContact O-CD 3.47Å
254	L	89.3	Confident	80.1	Confident	36 Å²	36	76.6 Å²	76.6	19%	0.188	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-87	116.6	173.3	-173.9	70	0	0	0	110	F256 L262 A275 L287 I288	L254-F256 WeakPolarHBondContact O-CD1 3.37Å; L254-F256 PolarHBondContact O-N 2.87Å; L254-L262 HydrophobicContact CD2-CD2 3.96Å; L254-A275 HydrophobicContact CD2-CB 4.3Å; L254-L287 PolarHBondContact N-O 2.73Å; L254-I288 HydrophobicContact CB-CG2 3.83Å; L254-I288 HydrophobicContact CD2-CG2 3.93Å; L254-I288 HydrophobicContact CG-CG2 4.43Å
255	P	88.5	Confident	82.4	Confident	105 Å²	105	73.6 Å²	73.6	68%	0.682	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-79	121	174.7	30.2	-33.3	0	0	0	110.9	G253 K277	G253-P255 WeakPolarHBondContact O-CD 3.47Å; P255-K277 WeakPolarHBondContact O-CE 3.43Å; P255-K277 PolarHBondContact O-NZ 2.82Å
256	F	89.7	Confident	84.1	Confident	73 Å²	73	72.4 Å²	72.4	32%	0.32	41%	0.407	S	S	.	.			trans	-137.9	157.7	178	65.9	-89.7	0	0	0	112.8	L254 D260 L262 I288 Y368	L254-F256 WeakPolarHBondContact O-CD1 3.37Å; L254-F256 PolarHBondContact O-N 2.87Å; F256-D260 VanDerWaalsContact CA-OD2 3.27Å; F256-D260 WeakPolarHBondContact CA-OD2 3.41Å; F256-D260 HydrophobicContact CB-CB 4.15Å; F256-D260 WeakPolarHBondContact CB-OD2 3.23Å; F256-L262 HydrophobicContact CB-CD1 4.43Å; F256-L262 HydrophobicContact CB-CD2 4.11Å; F256-L262 HydrophobicContact CD1-CD1 4.06Å; F256-L262 HydrophobicContact CD2-CD1 4.16Å; F256-L262 HydrophobicContact CE1-CD1 4.37Å; F256-L262 HydrophobicContact CE2-CD1 4.44Å; F256-L262 HydrophobicContact CG-CD1 3.96Å; F256-I288 HydrophobicContact CD1-CG2 3.91Å; F256-I288 HydrophobicContact CE1-CB 3.99Å; F256-I288 HydrophobicContact CE1-CG2 3.6Å; F256-Y368 HydrophobicContact CE2-CE1 4.03Å; F256-Y368 AromaticContact CZ-CE1 3.88Å; F256-Y368 HydrophobicContact CZ-CE1 3.88Å
257	L	85.9	Confident	85.2	Confident	133 Å²	133	72.2 Å²	72.2	70%	0.696	40%	0.402	S	S	*	.			trans	-108.7	163.3	175.8	-63	179.4	0	0	0	111.3	G259 D260	L257-G259 PolarHBondContact O-N 3.45Å; L257-D260 PolarHBondContact N-OD2 2.83Å; L257-D260 WeakPolarHBondContact O-CB 3.34Å; L257-D260 PolarHBondContact O-N 3.36Å
258	K	80.7	Confident	86	Confident	127 Å²	127	76.8 Å²	76.8	55%	0.552	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	117	173.8	-175.2	174	-178.4	172.2	0	109.3	Q548	K258-Q548 VanDerWaalsContact CE-CB 3.4Å
259	G	79.9	Confident	86.6	Confident	65 Å²	65	74.2 Å²	74.2	67%	0.67	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.8	-7.7	-174.8	0	0	0	0	0	115	L257 I261	L257-G259 PolarHBondContact O-N 3.45Å; G259-I261 PolarHBondContact O-N 3.47Å
260	D	88.1	Confident	87	Confident	58 Å²	58	75.6 Å²	75.6	31%	0.31	42%	0.423	S	S	.	.			trans	-64.7	132	170.3	-78	-5.3	0	0	0	110.4	F256 L257 L262 K277	F256-D260 VanDerWaalsContact CA-OD2 3.27Å; F256-D260 WeakPolarHBondContact CA-OD2 3.41Å; F256-D260 HydrophobicContact CB-CB 4.15Å; F256-D260 WeakPolarHBondContact CB-OD2 3.23Å; L257-D260 PolarHBondContact N-OD2 2.83Å; L257-D260 WeakPolarHBondContact O-CB 3.34Å; L257-D260 PolarHBondContact O-N 3.36Å; D260-L262 HydrophobicContact CB-CD2 4.35Å; D260-K277 VanDerWaalsContact OD2-CE 3.24Å; D260-K277 WeakPolarHBondContact OD2-CE 3.46Å; D260-K277 IonicContact OD2-NZ 3.27Å; D260-K277 PolarHBondContact OD2-NZ 3.25Å
261	I	91.5	Very high	87.4	Confident	52 Å²	52	69.6 Å²	69.6	27%	0.267	40%	0.395	S	S	.	.			trans	-87.8	117.2	175.9	-43.7	-59	0	0	0	109.9	G259 I278 V371 W579	G259-I261 PolarHBondContact O-N 3.47Å; I261-I278 HydrophobicContact CB-CD1 4.17Å; I261-I278 HydrophobicContact CG2-CD1 3.51Å; I261-I278 HydrophobicContact CG2-CG1 4.37Å; I261-I278 PolarHBondContact O-N 2.89Å; I261-V371 HydrophobicContact CD1-CG2 4.43Å; I261-V371 HydrophobicContact CG2-CG2 3.94Å; I261-W579 HydrophobicContact CD1-CB 4.34Å; I261-W579 HydrophobicContact CD1-CG 4.21Å; I261-W579 HydrophobicContact CG1-CD2 4.37Å; I261-W579 HydrophobicContact CG1-CG 4.06Å; I261-W579 HydrophobicContact CG2-CD2 4.05Å; I261-W579 HydrophobicContact CG2-CE3 4.26Å; I261-W579 HydrophobicContact CG2-CH2 4.37Å; I261-W579 HydrophobicContact CG2-CZ2 4.17Å; I261-W579 HydrophobicContact CG2-CZ3 4.41Å
262	L	92.9	Very high	87.8	Confident	29 Å²	29	63.1 Å²	63.1	15%	0.152	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	-177.9	-54	-177.1	0	0	0	110.2	L254 F256 D260 A275 K277 I288 Y368	L254-L262 HydrophobicContact CD2-CD2 3.96Å; F256-L262 HydrophobicContact CB-CD1 4.43Å; F256-L262 HydrophobicContact CB-CD2 4.11Å; F256-L262 HydrophobicContact CD1-CD1 4.06Å; F256-L262 HydrophobicContact CD2-CD1 4.16Å; F256-L262 HydrophobicContact CE1-CD1 4.37Å; F256-L262 HydrophobicContact CE2-CD1 4.44Å; F256-L262 HydrophobicContact CG-CD1 3.96Å; D260-L262 HydrophobicContact CB-CD2 4.35Å; L262-A275 HydrophobicContact CB-CB 4.42Å; L262-K277 HydrophobicContact CD2-CG 3.88Å; L262-I288 HydrophobicContact CD1-CD1 4Å; L262-I288 HydrophobicContact CD1-CG2 4.3Å; L262-Y368 HydrophobicContact CD1-CE1 4.45Å
263	Q	93.1	Very high	88.2	Confident	78 Å²	78	63.4 Å²	63.4	36%	0.364	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.2	164.3	-177.6	175.7	31.4	0	0	108.3	A275 R276 I278	Q263-A275 CarbonylContact O-C 3.54Å; Q263-A275 VanDerWaalsContact O-CA 3.22Å; Q263-A275 WeakPolarHBondContact O-CA 3.28Å; Q263-A275 WeakPolarHBondContact O-CB 3.47Å; Q263-R276 HydrophobicContact CB-CG 4.17Å; Q263-R276 PolarHBondContact N-O 3.05Å; Q263-R276 PolarHBondContact O-N 2.82Å; Q263-R276 VanDerWaalsContact OE1-CZ 3.27Å; Q263-I278 HydrophobicContact CB-CG1 4.28Å
264	I	92.9	Very high	88.5	Confident	57 Å²	57	62.4 Å²	62.4	29%	0.292	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.6	169.9	-47.5	-55.9	0	0	0	108.4	Q267 W273 A275 I288	I264-Q267 HydrophobicContact CG2-CG 3.49Å; I264-Q267 VanDerWaalsContact CG2-CG 3.49Å; I264-W273 HydrophobicContact CD1-CE3 4.48Å; I264-A275 HydrophobicContact CD1-CB 3.85Å; I264-I288 HydrophobicContact CD1-CD1 3.65Å
265	V	91.3	Very high	88.7	Confident	61 Å²	61	60.7 Å²	60.7	37%	0.37	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-37.5	-179.6	-170.7	0	0	0	0	110.8	H183 Q274 R276	H183-V265 HydrophobicContact CB-CB 4.37Å; H183-V265 HydrophobicContact CB-CG1 3.66Å; V265-Q274 PolarHBondContact N-O 2.93Å; V265-R276 HydrophobicContact CG2-CG 4.31Å
266	D	89.4	Confident	88.9	Confident	18 Å²	18	58.8 Å²	58.8	10%	0.096	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	130.5	-177.1	173	25	0	0	0	111.4	H183 N268 W273 Q274	H183-D266 WeakPolarHBondContact CE1-CB 3.4Å; H183-D266 IonicContact CE1-OD2 3.79Å; H183-D266 PolarHBondContact CE1-OD2 3.43Å; H183-D266 IonicContact ND1-OD2 2.89Å; D266-N268 VanDerWaalsContact OD1-CB 3.24Å; D266-N268 WeakPolarHBondContact OD1-CB 3.46Å; D266-N268 VanDerWaalsContact OD1-CG 3.27Å; D266-N268 PolarHBondContact OD1-N 3.3Å; D266-N268 PolarHBondContact OD1-ND2 3.11Å; D266-W273 WeakPolarHBondContact O-CA 3.38Å; D266-W273 WeakPolarHBondContact O-CB 3.42Å; D266-Q274 HydrophobicContact CB-CB 3.98Å; D266-Q274 HydrophobicContact CB-CG 3.95Å; D266-Q274 PolarHBondContact N-O 2.84Å; D266-Q274 PolarHBondContact O-N 2.86Å; D266-Q274 PolarHBondContact OD2-NE2 3.27Å
267	Q	90.3	Very high	88.9	Confident	111 Å²	111	57.6 Å²	57.6	52%	0.519	31%	0.31	S	S	.	.			trans	-120.2	6.8	178.7	-59.8	-173.4	26.3	0	0	113.2	I264 D269 W273	I264-Q267 HydrophobicContact CG2-CG 3.49Å; I264-Q267 VanDerWaalsContact CG2-CG 3.49Å; Q267-D269 PolarHBondContact O-N 2.94Å; Q267-W273 HydrophobicContact CB-CG 4.46Å; Q267-W273 HydrophobicContact CG-CD2 4.08Å; Q267-W273 HydrophobicContact CG-CG 4.26Å; Q267-W273 HydrophobicContact CG-CZ2 4.36Å
268	N	86.6	Confident	89	Confident	146 Å²	146	53.3 Å²	53.3	78%	0.781	29%	0.287	S	S	*	.			trans	-62.5	-25.3	-174.7	-70.7	-57	0	0	0	113.4	D266	D266-N268 VanDerWaalsContact OD1-CB 3.24Å; D266-N268 WeakPolarHBondContact OD1-CB 3.46Å; D266-N268 VanDerWaalsContact OD1-CG 3.27Å; D266-N268 PolarHBondContact OD1-N 3.3Å; D266-N268 PolarHBondContact OD1-ND2 3.11Å
269	D	84	Confident	89	Confident	16 Å²	16	52.4 Å²	52.4	9%	0.086	30%	0.297	C	S	.	.	S	Bend	trans	-87.1	123.8	172.6	-176.8	-44.8	0	0	0	110.8	R180 Q267 L271 W272 W273	R180-D269 IonicContact CZ-OD2 2.71Å; R180-D269 IonicContact NH1-OD2 2.67Å; R180-D269 PolarHBondContact NH1-OD2 3.08Å; R180-D269 IonicContact NH2-OD2 3.9Å; R180-D269 PolarHBondContact NH2-OD2 3.05Å; Q267-D269 PolarHBondContact O-N 2.94Å; D269-L271 VanDerWaalsContact C-N 3.25Å; D269-L271 PolarHBondContact O-N 2.98Å; D269-L271 WeakPolarHBondContact OD1-CA 3.21Å; D269-L271 PolarHBondContact OD1-N 3.12Å; D269-W272 WeakPolarHBondContact CB-O 3.39Å; D269-W272 PolarHBondContact OD1-N 3.22Å; D269-W273 PolarHBondContact O-NE1 2.92Å
270	A	84.9	Confident	88.9	Confident	65 Å²	65	52.8 Å²	52.8	54%	0.537	28%	0.283	S	S	.	.	S	Bend	trans	-66.9	-18.6	-177.2	0	0	0	0	0	114.7	S290	A270-S290 WeakPolarHBondContact O-CB 3.45Å; A270-S290 PolarHBondContact O-OG 3.26Å
271	L	85.9	Confident	88.2	Confident	34 Å²	34	54 Å²	54	18%	0.178	29%	0.29	C	S	.	.	S	Bend	trans	-113.5	-32.2	-176.3	-61.2	-178.5	0	0	0	113.6	D269 S290 L293	D269-L271 VanDerWaalsContact C-N 3.25Å; D269-L271 PolarHBondContact O-N 2.98Å; D269-L271 WeakPolarHBondContact OD1-CA 3.21Å; D269-L271 PolarHBondContact OD1-N 3.12Å; L271-S290 WeakPolarHBondContact CA-OG 3.1Å; L271-S290 WeakPolarHBondContact O-CB 3.42Å; L271-S290 PolarHBondContact O-N 3.19Å; L271-S290 PolarHBondContact O-OG 3.47Å; L271-L293 HydrophobicContact CB-CB 4.48Å; L271-L293 HydrophobicContact CB-CD2 4.49Å; L271-L293 HydrophobicContact CD2-CB 4.18Å; L271-L293 HydrophobicContact CD2-CD1 4.39Å; L271-L293 WeakPolarHBondContact O-CB 3.31Å; L271-L293 VanDerWaalsContact O-CD2 3.31Å; L271-L293 WeakPolarHBondContact O-CD2 3.48Å
272	W	88.8	Confident	87.1	Confident	21 Å²	21	57.1 Å²	57.1	8%	0.08	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	97.5	-171.1	-71	101.6	0	0	0	112.5	R180 D246 I247 P248 D269 L287 I288 P289 L293	R180-W272 PolarHBondContact NH1-O 3.43Å; D246-W272 PolarHBondContact O-NE1 3.03Å; I247-W272 VanDerWaalsContact CA-CZ2 3.44Å; I247-W272 HydrophobicContact CB-CH2 3.6Å; I247-W272 HydrophobicContact CB-CZ2 3.89Å; I247-W272 HydrophobicContact CB-CZ3 4.14Å; I247-W272 HydrophobicContact CD1-CH2 4.24Å; I247-W272 HydrophobicContact CD1-CZ3 3.95Å; I247-W272 HydrophobicContact CG1-CE3 4.23Å; I247-W272 HydrophobicContact CG1-CH2 3.76Å; I247-W272 HydrophobicContact CG1-CZ2 4.24Å; I247-W272 HydrophobicContact CG1-CZ3 3.75Å; P248-W272 HydrophobicContact CG-CG 4.1Å; D269-W272 WeakPolarHBondContact CB-O 3.39Å; D269-W272 PolarHBondContact OD1-N 3.22Å; W272-L287 HydrophobicContact CE3-CB 4.15Å; W272-I288 CarbonylContact C-O 3.55Å; W272-I288 WeakPolarHBondContact CA-O 3.19Å; W272-P289 HydrophobicContact CE3-CG 4.48Å; W272-P289 HydrophobicContact CH2-CG 3.94Å; W272-P289 HydrophobicContact CZ3-CB 4.31Å; W272-P289 HydrophobicContact CZ3-CG 3.7Å; W272-L293 HydrophobicContact CD2-CD2 4.17Å; W272-L293 HydrophobicContact CH2-CD2 4.17Å; W272-L293 HydrophobicContact CZ2-CD2 3.5Å
273	W	92.7	Very high	86.4	Confident	23 Å²	23	59.8 Å²	59.8	9%	0.087	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	155.7	177.8	-65.3	-15.4	0	0	0	111.9	I264 D266 Q267 D269 L287 I288 N291 Y368	I264-W273 HydrophobicContact CD1-CE3 4.48Å; D266-W273 WeakPolarHBondContact O-CA 3.38Å; D266-W273 WeakPolarHBondContact O-CB 3.42Å; Q267-W273 HydrophobicContact CB-CG 4.46Å; Q267-W273 HydrophobicContact CG-CD2 4.08Å; Q267-W273 HydrophobicContact CG-CG 4.26Å; Q267-W273 HydrophobicContact CG-CZ2 4.36Å; D269-W273 PolarHBondContact O-NE1 2.92Å; W273-L287 WeakPolarHBondContact O-CA 3.29Å; W273-I288 HydrophobicContact CB-CG1 3.96Å; W273-I288 PolarHBondContact N-O 3.41Å; W273-I288 PolarHBondContact O-N 2.72Å; W273-N291 HydrophobicContact CH2-CB 3.82Å; W273-N291 WeakPolarHBondContact CH2-ND2 3.29Å; W273-N291 HydrophobicContact CZ2-CB 4.26Å; W273-N291 HydrophobicContact CZ3-CB 4.43Å; W273-Y368 HydrophobicContact CE3-CD2 4.44Å; W273-Y368 HydrophobicContact CE3-CE2 4.37Å; W273-Y368 HydrophobicContact CZ3-CD2 4.01Å; W273-Y368 HydrophobicContact CZ3-CE2 4.35Å
274	Q	92.6	Very high	86	Confident	3 Å²	3	57.7 Å²	57.7	1%	0.014	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.6	170.9	-42	-168.5	32.1	0	0	109.8	V181 I182 H183 V265 D266 A285 G286 L287	V181-Q274 PolarHBondContact O-NE2 3.43Å; I182-Q274 VanDerWaalsContact CA-OE1 3.31Å; H183-Q274 PolarHBondContact ND1-NE2 2.84Å; H183-Q274 VanDerWaalsContact ND1-NE2 3.17Å; H183-Q274 PolarHBondContact ND1-OE1 2.89Å; V265-Q274 PolarHBondContact N-O 2.93Å; D266-Q274 HydrophobicContact CB-CB 3.98Å; D266-Q274 HydrophobicContact CB-CG 3.95Å; D266-Q274 PolarHBondContact N-O 2.84Å; D266-Q274 PolarHBondContact O-N 2.86Å; D266-Q274 PolarHBondContact OD2-NE2 3.27Å; Q274-A285 HydrophobicContact CB-CB 3.97Å; Q274-G286 WeakPolarHBondContact CA-O 3.45Å; Q274-L287 HydrophobicContact CG-CD2 4.13Å
275	A	93.3	Very high	85.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	166.3	-179.4	0	0	0	0	0	111.4	L254 L262 Q263 I264 A285 G286 I288	L254-A275 HydrophobicContact CD2-CB 4.3Å; L262-A275 HydrophobicContact CB-CB 4.42Å; Q263-A275 CarbonylContact O-C 3.54Å; Q263-A275 VanDerWaalsContact O-CA 3.22Å; Q263-A275 WeakPolarHBondContact O-CA 3.28Å; Q263-A275 WeakPolarHBondContact O-CB 3.47Å; I264-A275 HydrophobicContact CD1-CB 3.85Å; A275-A285 CarbonylContact O-C 3.56Å; A275-A285 WeakPolarHBondContact O-CA 3.32Å; A275-G286 PolarHBondContact N-O 2.73Å; A275-G286 PolarHBondContact O-N 3.05Å; A275-I288 HydrophobicContact CB-CD1 3.67Å; A275-I288 HydrophobicContact CB-CG1 4.07Å; A275-I288 HydrophobicContact CB-CG2 4.23Å
276	R	91.6	Very high	85.8	Confident	65 Å²	65	52.8 Å²	52.8	25%	0.245	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	154.2	171.2	62.2	-176.7	178.5	-169.3	-7.2	110.8	Q263 V265 L281	Q263-R276 HydrophobicContact CB-CG 4.17Å; Q263-R276 PolarHBondContact N-O 3.05Å; Q263-R276 PolarHBondContact O-N 2.82Å; Q263-R276 VanDerWaalsContact OE1-CZ 3.27Å; V265-R276 HydrophobicContact CG2-CG 4.31Å; R276-L281 HydrophobicContact CG-CD2 4.39Å; R276-L281 PolarHBondContact NH1-O 3.49Å
277	K	90.8	Very high	85.8	Confident	48 Å²	48	52 Å²	52	21%	0.209	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	141.2	172.2	-67.3	-168.5	-179.9	-169.7	0	110.1	P255 D260 L262 S279 D280	P255-K277 WeakPolarHBondContact O-CE 3.43Å; P255-K277 PolarHBondContact O-NZ 2.82Å; D260-K277 VanDerWaalsContact OD2-CE 3.24Å; D260-K277 WeakPolarHBondContact OD2-CE 3.46Å; D260-K277 IonicContact OD2-NZ 3.27Å; D260-K277 PolarHBondContact OD2-NZ 3.25Å; L262-K277 HydrophobicContact CD2-CG 3.88Å; K277-S279 PolarHBondContact O-N 3.29Å; K277-D280 PolarHBondContact O-N 2.91Å
278	I	87	Confident	85.9	Confident	42 Å²	42	46.8 Å²	46.8	22%	0.215	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-65	-23.7	178.4	-66.6	-173.9	0	0	0	112.2	I261 Q263 D280 L281 W579	I261-I278 HydrophobicContact CB-CD1 4.17Å; I261-I278 HydrophobicContact CG2-CD1 3.51Å; I261-I278 HydrophobicContact CG2-CG1 4.37Å; I261-I278 PolarHBondContact O-N 2.89Å; Q263-I278 HydrophobicContact CB-CG1 4.28Å; I278-D280 VanDerWaalsContact C-N 3.31Å; I278-D280 PolarHBondContact O-N 3.4Å; I278-L281 WeakPolarHBondContact O-CG 3.31Å; I278-W579 HydrophobicContact CD1-CH2 3.4Å; I278-W579 VanDerWaalsContact CD1-CH2 3.4Å; I278-W579 HydrophobicContact CD1-CZ2 3.34Å; I278-W579 HydrophobicContact CD1-CZ3 4.39Å; I278-W579 HydrophobicContact CG2-CZ2 4.39Å
279	S	80.6	Confident	86.1	Confident	109 Å²	109	41.1 Å²	41.1	76%	0.762	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-65.4	-31.4	172.2	-48.8	0	0	0	0	113.4	K277	K277-S279 PolarHBondContact O-N 3.29Å
280	D	79.1	Confident	86.3	Confident	72 Å²	72	40.4 Å²	40.4	39%	0.385	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-122.5	43.8	-161.8	-58	-46.8	0	0	0	112.5	K277 I278 T282 I283	K277-D280 PolarHBondContact O-N 2.91Å; I278-D280 VanDerWaalsContact C-N 3.31Å; I278-D280 PolarHBondContact O-N 3.4Å; D280-T282 PolarHBondContact O-N 2.98Å; D280-I283 HydrophobicContact CB-CD1 3.93Å; D280-I283 HydrophobicContact CB-CG1 4.21Å; D280-I283 PolarHBondContact O-N 2.91Å
281	L	72.9	Confident	86.4	Confident	85 Å²	85	39 Å²	39	45%	0.445	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-15.5	-174.8	-61.8	176.4	0	0	0	114.9	R276 I278	R276-L281 HydrophobicContact CG-CD2 4.39Å; R276-L281 PolarHBondContact NH1-O 3.49Å; I278-L281 WeakPolarHBondContact O-CG 3.31Å
282	T	69.3	Low	86.2	Confident	116 Å²	116	43.7 Å²	43.7	71%	0.712	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.1	178	51.8	0	0	0	0	114.2	D280	D280-T282 PolarHBondContact O-N 2.98Å
283	I	77.9	Confident	86	Confident	86 Å²	86	43 Å²	43	44%	0.441	23%	0.234	S	C	.	.	S	Bend	trans	-88	153.6	179.2	-50.7	-175.6	0	0	0	109	D280	D280-I283 HydrophobicContact CB-CD1 3.93Å; D280-I283 HydrophobicContact CB-CG1 4.21Å; D280-I283 PolarHBondContact O-N 2.91Å
284	C	83.4	Confident	85.5	Confident	34 Å²	34	44.1 Å²	44.1	23%	0.23	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-60.2	158.3	168.2	59.5	0	0	0	0	111.1	I182 H183	I182-C284 HydrophobicContact CG2-CB 4.2Å; H183-C284 WeakPolarHBondContact O-CA 3.47Å
285	A	89.9	Confident	84.8	Confident	7 Å²	7	48 Å²	48	6%	0.058	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-61.3	156	172	0	0	0	0	0	111.1	I182 H183 Q274 A275	I182-A285 HydrophobicContact CG2-CB 4.37Å; I182-A285 WeakPolarHBondContact CG2-O 3.38Å; H183-A285 HydrophobicContact CB-CB 4.1Å; H183-A285 PolarHBondContact O-N 3.27Å; Q274-A285 HydrophobicContact CB-CB 3.97Å; A275-A285 CarbonylContact O-C 3.56Å; A275-A285 WeakPolarHBondContact O-CA 3.32Å
286	G	90.2	Very high	84.1	Confident	7 Å²	7	51.5 Å²	51.5	7%	0.072	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	163.7	166.9	0	0	0	0	0	110.9	A252 Q274 A275	A252-G286 CarbonylContact O-C 3.42Å; A252-G286 VanDerWaalsContact O-CA 3.23Å; A252-G286 WeakPolarHBondContact O-CA 3.45Å; Q274-G286 WeakPolarHBondContact CA-O 3.45Å; A275-G286 PolarHBondContact N-O 2.73Å; A275-G286 PolarHBondContact O-N 3.05Å
287	L	90.9	Very high	83.4	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.8	179.8	-59.6	-178.4	0	0	0	110.6	I182 A252 L254 W272 W273 Q274	I182-L287 HydrophobicContact CD1-CD2 4.29Å; A252-L287 HydrophobicContact CB-CD1 3.98Å; A252-L287 HydrophobicContact CB-CG 4.11Å; A252-L287 PolarHBondContact O-N 2.62Å; L254-L287 PolarHBondContact N-O 2.73Å; W272-L287 HydrophobicContact CE3-CB 4.15Å; W273-L287 WeakPolarHBondContact O-CA 3.29Å; Q274-L287 HydrophobicContact CG-CD2 4.13Å
288	I	91.8	Very high	82.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.6	167.6	66.6	171.6	0	0	0	109.9	L254 F256 L262 I264 W272 W273 A275 S290 Y368	L254-I288 HydrophobicContact CB-CG2 3.83Å; L254-I288 HydrophobicContact CD2-CG2 3.93Å; L254-I288 HydrophobicContact CG-CG2 4.43Å; F256-I288 HydrophobicContact CD1-CG2 3.91Å; F256-I288 HydrophobicContact CE1-CB 3.99Å; F256-I288 HydrophobicContact CE1-CG2 3.6Å; L262-I288 HydrophobicContact CD1-CD1 4Å; L262-I288 HydrophobicContact CD1-CG2 4.3Å; I264-I288 HydrophobicContact CD1-CD1 3.65Å; W272-I288 CarbonylContact C-O 3.55Å; W272-I288 WeakPolarHBondContact CA-O 3.19Å; W273-I288 HydrophobicContact CB-CG1 3.96Å; W273-I288 PolarHBondContact N-O 3.41Å; W273-I288 PolarHBondContact O-N 2.72Å; A275-I288 HydrophobicContact CB-CD1 3.67Å; A275-I288 HydrophobicContact CB-CG1 4.07Å; A275-I288 HydrophobicContact CB-CG2 4.23Å; I288-S290 PolarHBondContact O-N 2.99Å; I288-Y368 HydrophobicContact CD1-CE1 4.17Å; I288-Y368 HydrophobicContact CD1-CE2 4.3Å
289	P	90.6	Very high	81.5	Confident	28 Å²	28	59.7 Å²	59.7	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	137.5	172.8	-24.2	34.8	0	0	0	110.9	W272 L293 L294 Y368	W272-P289 HydrophobicContact CE3-CG 4.48Å; W272-P289 HydrophobicContact CH2-CG 3.94Å; W272-P289 HydrophobicContact CZ3-CB 4.31Å; W272-P289 HydrophobicContact CZ3-CG 3.7Å; P289-L293 HydrophobicContact CB-CD2 4.03Å; P289-L293 HydrophobicContact CB-CG 4.47Å; P289-L294 HydrophobicContact CB-CD1 4.01Å; P289-L294 HydrophobicContact CB-CD2 3.78Å; P289-L294 HydrophobicContact CB-CG 3.67Å; P289-L294 HydrophobicContact CG-CD2 4.3Å; P289-Y368 WeakPolarHBondContact O-CE2 3.21Å; P289-Y368 PolarHBondContact O-OH 3.17Å
290	S	88.9	Confident	80.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.			trans	-72.7	164.7	175.9	80.8	0	0	0	0	112.4	A270 L271 I288 H292 L293 L294	A270-S290 WeakPolarHBondContact O-CB 3.45Å; A270-S290 PolarHBondContact O-OG 3.26Å; L271-S290 WeakPolarHBondContact CA-OG 3.1Å; L271-S290 WeakPolarHBondContact O-CB 3.42Å; L271-S290 PolarHBondContact O-N 3.19Å; L271-S290 PolarHBondContact O-OG 3.47Å; I288-S290 PolarHBondContact O-N 2.99Å; S290-H292 PolarHBondContact O-N 3.25Å; S290-H292 PolarHBondContact OG-N 3.05Å; S290-H292 VanDerWaalsContact OG-N 3.12Å; S290-L293 PolarHBondContact O-N 3.39Å; S290-L293 PolarHBondContact OG-N 2.9Å; S290-L294 WeakPolarHBondContact O-CG 3.48Å; S290-L294 PolarHBondContact O-N 2.83Å
291	N	86.1	Confident	80	Confident	35 Å²	35	60.9 Å²	60.9	19%	0.187	29%	0.294	C	S	.	.	H	α-helix	trans	-53.6	-34.6	168.1	-89.8	-23.2	0	0	0	112.9	W273 K295 P367 Y368	W273-N291 HydrophobicContact CH2-CB 3.82Å; W273-N291 WeakPolarHBondContact CH2-ND2 3.29Å; W273-N291 HydrophobicContact CZ2-CB 4.26Å; W273-N291 HydrophobicContact CZ3-CB 4.43Å; N291-K295 VanDerWaalsContact O-CB 3.29Å; N291-K295 WeakPolarHBondContact O-CB 3.47Å; N291-K295 WeakPolarHBondContact O-CD 3.46Å; N291-K295 WeakPolarHBondContact O-CG 3.31Å; N291-K295 PolarHBondContact O-N 3.37Å; N291-K295 VanDerWaalsContact O-N 3.08Å; N291-P367 VanDerWaalsContact OD1-CD 3.23Å; N291-P367 WeakPolarHBondContact OD1-CD 3.2Å; N291-P367 VanDerWaalsContact OD1-CG 3.28Å; N291-P367 WeakPolarHBondContact OD1-CG 3.11Å; N291-Y368 WeakPolarHBondContact OD1-CD2 3.45Å
292	H	82.6	Confident	78.9	Confident	134 Å²	134	66.1 Å²	66.1	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-73.6	-43.7	178.9	-70.2	-96.7	0	0	0	112.2	S290 K295 R296	S290-H292 PolarHBondContact O-N 3.25Å; S290-H292 PolarHBondContact OG-N 3.05Å; S290-H292 VanDerWaalsContact OG-N 3.12Å; H292-K295 PolarHBondContact O-N 3.25Å; H292-R296 VanDerWaalsContact O-CB 3.32Å; H292-R296 WeakPolarHBondContact O-CB 3.2Å; H292-R296 PolarHBondContact O-N 3.06Å
293	L	83.8	Confident	77.6	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-44.8	178.1	178.2	57.4	0	0	0	111	L271 W272 P289 S290 R296 K297	L271-L293 HydrophobicContact CB-CB 4.48Å; L271-L293 HydrophobicContact CB-CD2 4.49Å; L271-L293 HydrophobicContact CD2-CB 4.18Å; L271-L293 HydrophobicContact CD2-CD1 4.39Å; L271-L293 WeakPolarHBondContact O-CB 3.31Å; L271-L293 VanDerWaalsContact O-CD2 3.31Å; L271-L293 WeakPolarHBondContact O-CD2 3.48Å; W272-L293 HydrophobicContact CD2-CD2 4.17Å; W272-L293 HydrophobicContact CH2-CD2 4.17Å; W272-L293 HydrophobicContact CZ2-CD2 3.5Å; P289-L293 HydrophobicContact CB-CD2 4.03Å; P289-L293 HydrophobicContact CB-CG 4.47Å; S290-L293 PolarHBondContact O-N 3.39Å; S290-L293 PolarHBondContact OG-N 2.9Å; L293-R296 WeakPolarHBondContact O-CB 3.29Å; L293-R296 PolarHBondContact O-N 3.4Å; L293-K297 HydrophobicContact CD1-CG 4.21Å; L293-K297 WeakPolarHBondContact O-CG 3.23Å; L293-K297 PolarHBondContact O-N 3.3Å
294	L	81.7	Confident	76	Confident	46 Å²	46	71 Å²	71	24%	0.241	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-44.8	178.7	-69.4	173	0	0	0	112.3	P289 S290 R296 K297 Q298 P367 Y368	P289-L294 HydrophobicContact CB-CD1 4.01Å; P289-L294 HydrophobicContact CB-CD2 3.78Å; P289-L294 HydrophobicContact CB-CG 3.67Å; P289-L294 HydrophobicContact CG-CD2 4.3Å; S290-L294 WeakPolarHBondContact O-CG 3.48Å; S290-L294 PolarHBondContact O-N 2.83Å; L294-R296 PolarHBondContact O-N 3.01Å; L294-K297 PolarHBondContact O-N 3.36Å; L294-Q298 WeakPolarHBondContact O-CB 3.4Å; L294-Q298 VanDerWaalsContact O-CG 3.3Å; L294-Q298 WeakPolarHBondContact O-CG 3.46Å; L294-Q298 PolarHBondContact O-N 2.79Å; L294-P367 HydrophobicContact CB-CB 4.24Å; L294-P367 HydrophobicContact CB-CG 3.69Å; L294-P367 HydrophobicContact CD1-CB 3.66Å; L294-P367 HydrophobicContact CD1-CG 3.51Å; L294-P367 HydrophobicContact CG-CG 4.25Å; L294-Y368 HydrophobicContact CD1-CE2 3.78Å
295	K	79	Confident	73.7	Confident	86 Å²	86	74.8 Å²	74.8	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-30.6	173.6	-74.2	173.9	-179.4	179.9	0	112.6	N291 H292 R299 G365	N291-K295 VanDerWaalsContact O-CB 3.29Å; N291-K295 WeakPolarHBondContact O-CB 3.47Å; N291-K295 WeakPolarHBondContact O-CD 3.46Å; N291-K295 WeakPolarHBondContact O-CG 3.31Å; N291-K295 PolarHBondContact O-N 3.37Å; N291-K295 VanDerWaalsContact O-N 3.08Å; H292-K295 PolarHBondContact O-N 3.25Å; K295-R299 WeakPolarHBondContact O-CG 3.45Å; K295-R299 PolarHBondContact O-N 2.68Å; K295-R299 PolarHBondContact O-NE 2.92Å; K295-G365 WeakPolarHBondContact CE-O 3.4Å
296	R	78.6	Confident	71	Confident	73 Å²	73	79 Å²	79	28%	0.275	36%	0.362	S	S	.	.	H	α-helix	trans	-68.4	-56.6	172.5	178.6	-179	171.6	-167	-4.8	111.2	M243 H292 L293 L294 Q298 R299 E300	M243-R296 VanDerWaalsContact CE-NH1 3.32Å; H292-R296 VanDerWaalsContact O-CB 3.32Å; H292-R296 WeakPolarHBondContact O-CB 3.2Å; H292-R296 PolarHBondContact O-N 3.06Å; L293-R296 WeakPolarHBondContact O-CB 3.29Å; L293-R296 PolarHBondContact O-N 3.4Å; L294-R296 PolarHBondContact O-N 3.01Å; R296-Q298 VanDerWaalsContact C-N 3.28Å; R296-Q298 PolarHBondContact O-N 3.14Å; R296-R299 PolarHBondContact O-N 3.1Å; R296-E300 HydrophobicContact CG-CG 4.47Å; R296-E300 WeakPolarHBondContact CG-OE1 3.48Å; R296-E300 IonicContact CZ-OE1 2.83Å; R296-E300 IonicContact NE-OE1 2.71Å; R296-E300 PolarHBondContact NE-OE1 3.46Å; R296-E300 IonicContact NH2-OE1 2.75Å; R296-E300 PolarHBondContact NH2-OE1 3.29Å; R296-E300 WeakPolarHBondContact O-CG 3.4Å; R296-E300 PolarHBondContact O-N 2.95Å
297	K	75.8	Confident	68.3	Low	83 Å²	83	89 Å²	89	36%	0.361	40%	0.399	S	S	.	.	H	α-helix	trans	-58.5	-38.4	179.4	-69.3	-83	-171.3	165.6	0	111.9	P245 D246 L293 L294 E300 F301	P245-K297 VanDerWaalsContact CB-NZ 3.32Å; P245-K297 WeakPolarHBondContact O-CE 3.25Å; P245-K297 PolarHBondContact O-NZ 3.46Å; D246-K297 IonicContact OD1-NZ 3.18Å; L293-K297 HydrophobicContact CD1-CG 4.21Å; L293-K297 WeakPolarHBondContact O-CG 3.23Å; L293-K297 PolarHBondContact O-N 3.3Å; L294-K297 PolarHBondContact O-N 3.36Å; K297-E300 PolarHBondContact O-N 2.82Å; K297-F301 WeakPolarHBondContact O-CB 3.34Å; K297-F301 PolarHBondContact O-N 2.83Å
298	Q	70.3	Confident	65.2	Low	89 Å²	89	96.3 Å²	96.3	42%	0.416	43%	0.433	S	S	.	.	H	α-helix	trans	-58.5	-54.2	171.2	-77.6	176.9	-6.7	0	0	111.2	L294 R296 E300 F301 W302	L294-Q298 WeakPolarHBondContact O-CB 3.4Å; L294-Q298 VanDerWaalsContact O-CG 3.3Å; L294-Q298 WeakPolarHBondContact O-CG 3.46Å; L294-Q298 PolarHBondContact O-N 2.79Å; R296-Q298 VanDerWaalsContact C-N 3.28Å; R296-Q298 PolarHBondContact O-N 3.14Å; Q298-E300 VanDerWaalsContact C-N 3.34Å; Q298-E300 PolarHBondContact O-N 2.86Å; Q298-F301 WeakPolarHBondContact O-CA 3.26Å; Q298-F301 WeakPolarHBondContact O-CB 3.14Å; Q298-F301 PolarHBondContact O-N 3.42Å; Q298-F301 VanDerWaalsContact O-N 3.1Å; Q298-W302 PolarHBondContact O-N 3.21Å
299	R	69.1	Low	62.1	Low	155 Å²	155	101 Å²	101	59%	0.585	46%	0.464	S	S	*	.	H	α-helix	trans	-57.8	-45	178.3	-76.3	-177.1	-65.4	-171.3	4.1	112.1	K295 R296 F301 W302 W303	K295-R299 WeakPolarHBondContact O-CG 3.45Å; K295-R299 PolarHBondContact O-N 2.68Å; K295-R299 PolarHBondContact O-NE 2.92Å; R296-R299 PolarHBondContact O-N 3.1Å; R299-F301 VanDerWaalsContact C-N 3.29Å; R299-F301 PolarHBondContact O-N 3Å; R299-W302 PolarHBondContact O-N 3.42Å; R299-W303 PolarHBondContact O-N 3.36Å
300	E	66.2	Low	59.2	Low	78 Å²	78	107.7 Å²	107.7	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-56.8	-42.2	175.2	-70.5	168.6	170.3	0	0	111.4	R296 K297 Q298 W303 S304	R296-E300 HydrophobicContact CG-CG 4.47Å; R296-E300 WeakPolarHBondContact CG-OE1 3.48Å; R296-E300 IonicContact CZ-OE1 2.83Å; R296-E300 IonicContact NE-OE1 2.71Å; R296-E300 PolarHBondContact NE-OE1 3.46Å; R296-E300 IonicContact NH2-OE1 2.75Å; R296-E300 PolarHBondContact NH2-OE1 3.29Å; R296-E300 WeakPolarHBondContact O-CG 3.4Å; R296-E300 PolarHBondContact O-N 2.95Å; K297-E300 PolarHBondContact O-N 2.82Å; Q298-E300 VanDerWaalsContact C-N 3.34Å; Q298-E300 PolarHBondContact O-N 2.86Å; E300-W303 PolarHBondContact O-N 3.06Å; E300-S304 WeakPolarHBondContact O-CB 3.45Å; E300-S304 PolarHBondContact O-N 2.7Å; E300-S304 VanDerWaalsContact O-N 3.08Å
301	F	61.4	Low	56.1	Low	127 Å²	127	113.8 Å²	113.8	56%	0.557	53%	0.529	S	S	*	.	H	α-helix	trans	-63.3	-46.8	172.8	-178.6	-95.8	0	0	0	112.8	K297 Q298 R299 W303 S304 Q305	K297-F301 WeakPolarHBondContact O-CB 3.34Å; K297-F301 PolarHBondContact O-N 2.83Å; Q298-F301 WeakPolarHBondContact O-CA 3.26Å; Q298-F301 WeakPolarHBondContact O-CB 3.14Å; Q298-F301 PolarHBondContact O-N 3.42Å; Q298-F301 VanDerWaalsContact O-N 3.1Å; R299-F301 VanDerWaalsContact C-N 3.29Å; R299-F301 PolarHBondContact O-N 3Å; F301-W303 VanDerWaalsContact C-N 3.31Å; F301-W303 PolarHBondContact O-N 2.71Å; F301-S304 WeakPolarHBondContact CA-OG 3.32Å; F301-S304 PolarHBondContact O-N 2.96Å; F301-S304 VanDerWaalsContact O-N 3.1Å; F301-S304 PolarHBondContact O-OG 2.75Å; F301-Q305 HydrophobicContact CE1-CG 4.39Å; F301-Q305 PolarHBondContact O-N 2.97Å
302	W	50.5	Low	53.1	Low	195 Å²	195	118.1 Å²	118.1	74%	0.739	56%	0.561	S	S	*	*	H	α-helix	trans	-58	-40.3	176	-75.4	103.5	0	0	0	112.3	Q298 R299 S304	Q298-W302 PolarHBondContact O-N 3.21Å; R299-W302 PolarHBondContact O-N 3.42Å; W302-S304 VanDerWaalsContact C-N 3.33Å
303	W	41.7	Very low	50.5	Low	223 Å²	223	119.1 Å²	119.1	85%	0.845	57%	0.57	S	S	*	*	H	α-helix	trans	-74.6	-19.6	177.1	-64.9	121.3	0	0	0	114	R299 E300 F301	R299-W303 PolarHBondContact O-N 3.36Å; E300-W303 PolarHBondContact O-N 3.06Å; F301-W303 VanDerWaalsContact C-N 3.31Å; F301-W303 PolarHBondContact O-N 2.71Å
304	S	43.8	Very low	47.7	Very low	83 Å²	83	128.1 Å²	128.1	58%	0.58	61%	0.609	S	S	*	*	H	α-helix	trans	-83.9	-12.1	178.1	73.4	0	0	0	0	114.4	E300 F301 W302	E300-S304 WeakPolarHBondContact O-CB 3.45Å; E300-S304 PolarHBondContact O-N 2.7Å; E300-S304 VanDerWaalsContact O-N 3.08Å; F301-S304 WeakPolarHBondContact CA-OG 3.32Å; F301-S304 PolarHBondContact O-N 2.96Å; F301-S304 VanDerWaalsContact O-N 3.1Å; F301-S304 PolarHBondContact O-OG 2.75Å; W302-S304 VanDerWaalsContact C-N 3.33Å
305	Q	35.9	Very low	44.8	Very low	112 Å²	112	130.4 Å²	130.4	52%	0.523	63%	0.628	S	S	.	*	S	Bend	trans	-80.2	125.3	178.8	-70.3	-91.2	-25.3	0	0	110.5	F301 Y307	F301-Q305 HydrophobicContact CE1-CG 4.39Å; F301-Q305 PolarHBondContact O-N 2.97Å; Q305-Y307 PolarHBondContact O-N 3.26Å
306	P	32.7	Very low	42.2	Very low	97 Å²	97	132.2 Å²	132.2	63%	0.63	65%	0.647	S	S	*	*			trans	-65.3	130.9	170.9	27.3	-32.9	0	0	0	110	Q308	P306-Q308 PolarHBondContact O-N 2.97Å
307	Y	32.1	Very low	39.6	Very low	217 Å²	217	139.6 Å²	139.6	85%	0.851	68%	0.675	S	S	*	*			trans	-58.4	102	-178.5	-172.3	-91.3	0	0	0	111.4	Q305 P309	Q305-Y307 PolarHBondContact O-N 3.26Å; Y307-P309 WeakPolarHBondContact O-CD 3.49Å
308	Q	26.4	Very low	37.1	Very low	155 Å²	155	140 Å²	140	72%	0.724	69%	0.693	S	S	*	*			trans	-94.1	111.7	175.6	-69.7	-160.4	-6.6	0	0	110.7	P306 H310	P306-Q308 PolarHBondContact O-N 2.97Å; Q308-H310 PolarHBondContact O-N 3.21Å
309	P	26.6	Very low	35.2	Very low	100 Å²	100	144.8 Å²	144.8	65%	0.649	71%	0.713	S	S	*	*			trans	-68.8	114	170.9	28.2	-32.5	0	0	0	109.3	Y307 T311	Y307-P309 WeakPolarHBondContact O-CD 3.49Å; P309-T311 PolarHBondContact O-N 2.88Å; P309-T311 VanDerWaalsContact O-N 3.11Å
310	H	30.5	Very low	33.2	Very low	168 Å²	168	145 Å²	145	78%	0.778	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-57.4	117.2	-178	-68.3	-62.5	0	0	0	111.9	Q308 C312	Q308-H310 PolarHBondContact O-N 3.21Å; H310-C312 PolarHBondContact O-N 3.44Å
311	T	24.1	Very low	31.3	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.5	121.4	-172.4	-32.7	0	0	0	0	111.2	P309 L313	P309-T311 PolarHBondContact O-N 2.88Å; P309-T311 VanDerWaalsContact O-N 3.11Å; T311-L313 PolarHBondContact O-N 3.02Å
312	C	23.1	Very low	29.6	Very low	125 Å²	125	152.1 Å²	152.1	85%	0.845	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-75	123.8	-179.8	-59.1	0	0	0	0	110.9	H310	H310-C312 PolarHBondContact O-N 3.44Å
313	L	27.7	Very low	28.6	Very low	155 Å²	155	149.6 Å²	149.6	81%	0.812	76%	0.764	S	S	*	*			trans	-119.6	151.7	178.1	-92.8	158.4	0	0	0	113.1	T311	T311-L313 PolarHBondContact O-N 3.02Å
314	K	23.8	Very low	27.8	Very low	196 Å²	196	142 Å²	142	85%	0.852	75%	0.754	S	S	*	*			trans	-90.8	152.9	-148.3	-64.8	171.2	179.1	172.8	0	114.3
315	S	22.6	Very low	27.2	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	76%	0.762	S	S	*	*			trans	-77.6	134.7	175.8	134.2	0	0	0	0	112.8
316	T	23.2	Very low	26.8	Very low	124 Å²	124	141.2 Å²	141.2	76%	0.761	76%	0.758	S	S	*	*			trans	-109.4	124.1	161.4	-44.3	0	0	0	0	110.4	K344	T316-K344 PolarHBondContact O-NZ 2.9Å
317	R	24.3	Very low	26.6	Very low	228 Å²	228	145.1 Å²	145.1	86%	0.86	77%	0.768	S	S	*	*			trans	-87.9	130.6	175.3	-84.2	178.1	164	171.9	-5.9	110.1
318	A	24	Very low	26.4	Very low	91 Å²	91	143 Å²	143	75%	0.752	76%	0.763	S	S	*	*			trans	-122.4	134.6	154.4	0	0	0	0	0	106.9
319	K	29.3	Very low	26.4	Very low	191 Å²	191	146.1 Å²	146.1	83%	0.83	77%	0.774	S	S	*	*			trans	-83.6	165.5	171.4	-66.3	-179.3	174.8	-175.4	0	108.8
320	D	26.7	Very low	26.6	Very low	158 Å²	158	144.3 Å²	144.3	85%	0.845	76%	0.756	S	S	*	*				-173.8	151.7	126.6	-89.1	-17.9	0	0	0	111.7
321	E	26.4	Very low	26.8	Very low	170 Å²	170	141.9 Å²	141.9	79%	0.794	75%	0.748	S	S	*	*			trans	-110.6	-172.6	-174.3	-69.3	-175	151.4	0	0	112
322	F	25.3	Very low	27.1	Very low	185 Å²	185	137.8 Å²	137.8	81%	0.811	73%	0.727	S	S	*	*			trans	88.5	155.5	166.7	-83.2	-90.7	0	0	0	120.3
323	V	30.8	Very low	27.9	Very low	143 Å²	143	132.6 Å²	132.6	87%	0.867	69%	0.694	S	S	*	*			trans	-130.1	144.4	-150.8	173.8	0	0	0	0	109.3
324	G	25.3	Very low	28.5	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	67%	0.667	S	S	*	*			trans	-151	127.1	168.1	0	0	0	0	0	110
325	D	31	Very low	29.6	Very low	137 Å²	137	121.6 Å²	121.6	73%	0.733	64%	0.638	S	S	*	*			trans	-90.7	157.1	-177	-171.7	24.2	0	0	0	112
326	G	26.8	Very low	30.9	Very low	43 Å²	43	120 Å²	120	44%	0.443	62%	0.618	S	S	.	*			trans	173.4	95.2	-177.9	0	0	0	0	0	113.5	K328	G326-K328 PolarHBondContact O-N 3.24Å
327	Q	29.5	Very low	31.8	Very low	179 Å²	179	114.8 Å²	114.8	84%	0.836	59%	0.587	S	S	*	*			trans	-65.4	125.5	178.4	-69.6	177.3	-23.1	0	0	113
328	K	28	Very low	32.9	Very low	172 Å²	172	104.4 Å²	104.4	75%	0.748	55%	0.548	S	S	*	.			trans	-144.4	153.6	153.8	-71.7	-165.5	177.8	178.9	0	109.7	G326 F330	G326-K328 PolarHBondContact O-N 3.24Å; K328-F330 WeakPolarHBondContact O-CD2 3.29Å; K328-F330 WeakPolarHBondContact O-CE1 3.5Å; K328-F330 WeakPolarHBondContact O-CE2 3.44Å; K328-F330 WeakPolarHBondContact O-CZ 3.35Å; K328-F330 PolarHBondContact O-N 2.96Å
329	F	25.9	Very low	34.2	Very low	220 Å²	220	101.9 Å²	101.9	97%	0.965	52%	0.519	S	S	*	.			trans	-59.8	129.9	-175	-66.9	-97.3	0	0	0	112.3
330	F	30.9	Very low	34.6	Very low	63 Å²	63	96.1 Å²	96.1	28%	0.276	50%	0.497	S	S	.	.			trans	-111	140.4	178.4	-57.3	-57	0	0	0	111.2	K328 Y424 R429	K328-F330 WeakPolarHBondContact O-CD2 3.29Å; K328-F330 WeakPolarHBondContact O-CE1 3.5Å; K328-F330 WeakPolarHBondContact O-CE2 3.44Å; K328-F330 WeakPolarHBondContact O-CZ 3.35Å; K328-F330 PolarHBondContact O-N 2.96Å; F330-Y424 HydrophobicContact CE2-CD2 4.42Å; F330-Y424 HydrophobicContact CE2-CE2 4.34Å; F330-R429 PolarHBondContact O-NH1 3.45Å; F330-R429 PolarHBondContact O-NH2 2.86Å
331	I	34	Very low	35.3	Very low	117 Å²	117	89.1 Å²	89.1	60%	0.6	46%	0.46	S	S	*	.			trans	-94.9	139.8	168.4	-60.7	173.5	0	0	0	107.7	F334	I331-F334 HydrophobicContact CB-CD2 4.05Å; I331-F334 HydrophobicContact CB-CE2 4.4Å; I331-F334 HydrophobicContact CG2-CD2 3.96Å; I331-F334 HydrophobicContact CG2-CE2 3.85Å
332	A	30.2	Very low	36.5	Very low	42 Å²	42	83.9 Å²	83.9	35%	0.347	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	149.4	-179.5	0	0	0	0	0	112.3	F334 R429	A332-F334 WeakPolarHBondContact O-CD2 3.3Å; A332-F334 WeakPolarHBondContact O-CE2 3.42Å; A332-F334 PolarHBondContact O-N 3.42Å; A332-R429 HydrophobicContact CB-CG 3.75Å; A332-R429 WeakPolarHBondContact CB-O 3.39Å
333	G	40.3	Very low	37.2	Very low	15 Å²	15	84.4 Å²	84.4	16%	0.155	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	6.1	173.3	0	0	0	0	0	117.9	R429	G333-R429 PolarHBondContact N-O 2.88Å
334	F	40.3	Very low	37.7	Very low	54 Å²	54	84.8 Å²	84.8	24%	0.237	42%	0.42	C	S	.	.			trans	-103.9	-3.9	179.2	-70.7	-62.6	0	0	0	116.8	I331 A332 R399 R400 I403	I331-F334 HydrophobicContact CB-CD2 4.05Å; I331-F334 HydrophobicContact CB-CE2 4.4Å; I331-F334 HydrophobicContact CG2-CD2 3.96Å; I331-F334 HydrophobicContact CG2-CE2 3.85Å; A332-F334 WeakPolarHBondContact O-CD2 3.3Å; A332-F334 WeakPolarHBondContact O-CE2 3.42Å; A332-F334 PolarHBondContact O-N 3.42Å; F334-R399 HydrophobicContact CE1-CG 4.4Å; F334-R400 HydrophobicContact CD1-CB 3.7Å; F334-R400 HydrophobicContact CD1-CG 3.95Å; F334-R400 HydrophobicContact CE1-CB 3.78Å; F334-R400 HydrophobicContact CE1-CG 4.25Å; F334-R400 HydrophobicContact CG-CG 4.37Å; F334-I403 HydrophobicContact CE1-CD1 4.16Å; F334-I403 HydrophobicContact CE2-CB 4.36Å; F334-I403 HydrophobicContact CE2-CG2 3.89Å; F334-I403 HydrophobicContact CZ-CB 3.62Å; F334-I403 HydrophobicContact CZ-CD1 3.66Å; F334-I403 HydrophobicContact CZ-CG1 4.2Å; F334-I403 HydrophobicContact CZ-CG2 3.61Å
335	R	47.2	Very low	38.1	Very low	66 Å²	66	84.4 Å²	84.4	25%	0.249	41%	0.407	C	S	.	.	S	Bend	trans	-91.9	121.9	175.9	-72.6	-166.5	164.1	-79.1	6.5	110.3	Y431 D520	R335-Y431 PolarHBondContact O-OH 3.09Å; R335-D520 IonicContact NH1-OD1 3.96Å; R335-D520 PolarHBondContact NH1-OD1 3.42Å
336	R	48.8	Very low	38.4	Very low	59 Å²	59	85.8 Å²	85.8	22%	0.223	41%	0.409	C	S	.	.			trans	44.6	94.7	178.2	-42.8	178.4	174	178.2	-3.1	115.1	L340 Y431 D520	R336-L340 HydrophobicContact CG-CD1 4.2Å; R336-Y431 WeakPolarHBondContact CB-OH 3.35Å; R336-D520 IonicContact CZ-OD2 3.21Å; R336-D520 IonicContact NE-OD2 2.67Å; R336-D520 PolarHBondContact NE-OD2 2.86Å; R336-D520 IonicContact NH2-OD2 2.62Å; R336-D520 PolarHBondContact NH2-OD2 2.92Å
337	S	43.4	Very low	38.9	Very low	16 Å²	16	90.7 Å²	90.7	11%	0.112	42%	0.419	C	S	.	.			trans	-48.2	147.4	143.6	59.1	0	0	0	0	110.2	R339 N396 D479	S337-R339 PolarHBondContact O-N 3.06Å; S337-N396 VanDerWaalsContact CB-OD1 3.3Å; S337-N396 WeakPolarHBondContact CB-OD1 3.29Å; S337-N396 PolarHBondContact OG-ND2 3.25Å; S337-N396 PolarHBondContact OG-OD1 3Å; S337-D479 VanDerWaalsContact CB-OD1 3.27Å; S337-D479 WeakPolarHBondContact CB-OD1 3.12Å; S337-D479 VanDerWaalsContact CB-OD2 3.31Å; S337-D479 WeakPolarHBondContact CB-OD2 3.43Å
338	M	47.7	Very low	39.4	Very low	10 Å²	10	86.7 Å²	86.7	5%	0.049	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-52.7	-19.5	179.9	-74.8	-60.2	-65.9	0	0	115.1	L340 C341 R342 E450 Y459	M338-L340 PolarHBondContact O-N 3.23Å; M338-C341 HydrophobicContact CE-CB 4.13Å; M338-C341 VanDerWaalsContact O-CB 3.22Å; M338-C341 WeakPolarHBondContact O-CB 3.18Å; M338-C341 PolarHBondContact O-N 3.45Å; M338-C341 PolarHBondContact O-SG 2.66Å; M338-R342 WeakPolarHBondContact O-CG 3.47Å; M338-E450 WeakPolarHBondContact CB-OE2 3.37Å; M338-E450 VanDerWaalsContact CG-CD 3.46Å; M338-E450 HydrophobicContact CG-CG 4.45Å; M338-E450 WeakPolarHBondContact CG-OE1 3.08Å; M338-E450 WeakPolarHBondContact CG-OE2 3.42Å; M338-Y459 WeakPolarHBondContact CE-O 3.39Å; M338-Y459 VanDerWaalsContact SD-C 3.59Å; M338-Y459 WeakPolarHBondContact SD-CB 3.5Å
339	R	49.7	Very low	39.7	Very low	37 Å²	37	86.4 Å²	86.4	14%	0.14	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-41	-30.7	177.1	-62.5	177.7	-167.3	-110.5	-15.5	117	S337 R342 G389 D479	S337-R339 PolarHBondContact O-N 3.06Å; R339-R342 VanDerWaalsContact CG-NH1 3.35Å; R339-R342 PolarHBondContact O-N 3.4Å; R339-G389 PolarHBondContact NH1-O 2.91Å; R339-D479 IonicContact CZ-OD2 3.4Å; R339-D479 IonicContact NE-OD2 3.08Å; R339-D479 PolarHBondContact NE-OD2 2.86Å; R339-D479 IonicContact NH2-OD2 2.68Å; R339-D479 PolarHBondContact NH2-OD2 3.1Å; R339-D479 VanDerWaalsContact NH2-OD2 3.1Å
340	L	38.5	Very low	40	Very low	71 Å²	71	81 Å²	81	37%	0.372	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-76.2	-30.2	176.9	-71.5	173.4	0	0	0	113.4	R336 M338 R342 Y454	R336-L340 HydrophobicContact CG-CD1 4.2Å; M338-L340 PolarHBondContact O-N 3.23Å; L340-R342 PolarHBondContact O-N 3.46Å; L340-Y454 HydrophobicContact CB-CD2 4.42Å; L340-Y454 HydrophobicContact CB-CE2 4.14Å; L340-Y454 WeakPolarHBondContact O-CD2 3.43Å; L340-Y454 VanDerWaalsContact O-CE2 3.31Å; L340-Y454 WeakPolarHBondContact O-CE2 3.33Å
341	C	41	Very low	40.3	Very low	10 Å²	10	82.7 Å²	82.7	7%	0.068	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-62.1	-36.3	168.9	-47.7	0	0	0	0	111	M338 R343 K344 E453 Y454	M338-C341 HydrophobicContact CE-CB 4.13Å; M338-C341 VanDerWaalsContact O-CB 3.22Å; M338-C341 WeakPolarHBondContact O-CB 3.18Å; M338-C341 PolarHBondContact O-N 3.45Å; M338-C341 PolarHBondContact O-SG 2.66Å; C341-R343 PolarHBondContact O-N 3.21Å; C341-K344 PolarHBondContact O-N 2.94Å; C341-E453 WeakPolarHBondContact CA-O 3.38Å; C341-E453 WeakPolarHBondContact CB-O 3.36Å; C341-Y454 WeakPolarHBondContact SG-CB 3.37Å
342	R	52.1	Low	40.2	Very low	60 Å²	60	81.5 Å²	81.5	23%	0.226	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-69.9	-5.3	-169.9	-50.3	-178.6	-170.2	160.4	-5.1	114.6	M338 R339 L340 E450 D479 E481	M338-R342 WeakPolarHBondContact O-CG 3.47Å; R339-R342 VanDerWaalsContact CG-NH1 3.35Å; R339-R342 PolarHBondContact O-N 3.4Å; L340-R342 PolarHBondContact O-N 3.46Å; R342-E450 IonicContact CZ-OE2 2.73Å; R342-E450 IonicContact NH2-OE2 3.1Å; R342-E450 PolarHBondContact NH2-OE2 2.93Å; R342-D479 PolarHBondContact NH2-O 2.81Å; R342-E481 WeakPolarHBondContact CD-OE1 3.39Å; R342-E481 IonicContact CZ-OE1 3.14Å; R342-E481 IonicContact NE-OE1 3.65Å; R342-E481 PolarHBondContact NE-OE1 3.32Å; R342-E481 IonicContact NH1-OE1 3.73Å; R342-E481 PolarHBondContact NH1-OE1 3.18Å
343	R	40.4	Very low	40.3	Very low	196 Å²	196	83.8 Å²	83.8	74%	0.74	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-85.4	-14.5	176.1	-112.9	179.2	174.6	173.1	-1.8	114.9	C341	C341-R343 PolarHBondContact O-N 3.21Å
344	K	40.7	Very low	39.9	Very low	151 Å²	151	89.8 Å²	89.8	66%	0.657	45%	0.45	S	S	*	.	S	Bend	trans	-155.3	85.2	174.6	-69.3	-165.7	177.9	-173.4	0	112.9	T316 C341	T316-K344 PolarHBondContact O-NZ 2.9Å; C341-K344 PolarHBondContact O-N 2.94Å
345	S	35.1	Very low	39.4	Very low	54 Å²	54	90.2 Å²	90.2	38%	0.378	46%	0.459	S	S	.	.			trans	-144.8	116.5	167.7	58.8	0	0	0	0	112.4	F347	S345-F347 PolarHBondContact O-N 3.5Å
346	H	36.6	Very low	38.5	Very low	166 Å²	166	90.9 Å²	90.9	77%	0.769	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	13.2	179.8	-77.2	-86.9	0	0	0	114.3
347	F	37.5	Very low	37.5	Very low	147 Å²	147	94.7 Å²	94.7	65%	0.645	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-7	-172.5	-105.7	-87.2	0	0	0	115.3	S345 Q349 L350	S345-F347 PolarHBondContact O-N 3.5Å; F347-Q349 PolarHBondContact O-N 3.27Å; F347-Q349 VanDerWaalsContact O-N 3.08Å; F347-L350 HydrophobicContact CD1-CD1 3.82Å; F347-L350 HydrophobicContact CE1-CD1 3.7Å; F347-L350 PolarHBondContact O-N 2.86Å
348	S	40.1	Very low	36.7	Very low	95 Å²	95	97.6 Å²	97.6	66%	0.664	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-6	-174.3	41.6	0	0	0	0	115.5
349	Q	32.9	Very low	36	Very low	165 Å²	165	102 Å²	102	77%	0.771	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-17.2	175.3	-77.9	-178.3	-33.7	0	0	114.5	F347 H351	F347-Q349 PolarHBondContact O-N 3.27Å; F347-Q349 VanDerWaalsContact O-N 3.08Å; Q349-H351 VanDerWaalsContact C-N 3.33Å; Q349-H351 PolarHBondContact O-N 3.32Å
350	L	32	Very low	35.2	Very low	108 Å²	108	104 Å²	104	57%	0.565	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-80.1	-11.6	-179.4	-82.9	162.9	0	0	0	114.2	F347 A352	F347-L350 HydrophobicContact CD1-CD1 3.82Å; F347-L350 HydrophobicContact CE1-CD1 3.7Å; F347-L350 PolarHBondContact O-N 2.86Å; L350-A352 PolarHBondContact O-N 3.33Å
351	H	37.1	Very low	35.1	Very low	97 Å²	97	108 Å²	108	45%	0.449	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-71	-7.7	-178.8	-117.2	-86.5	0	0	0	114.7	Q349	Q349-H351 VanDerWaalsContact C-N 3.33Å; Q349-H351 PolarHBondContact O-N 3.32Å
352	A	32.1	Very low	34.9	Very low	92 Å²	92	111.8 Å²	111.8	76%	0.76	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-94.7	-8	-170.1	0	0	0	0	0	115.6	L350	L350-A352 PolarHBondContact O-N 3.33Å
353	S	32.9	Very low	34.5	Very low	91 Å²	91	109.9 Å²	109.9	64%	0.636	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	-8.9	-171.1	68.5	0	0	0	0	118.1
354	L	31.9	Very low	34.9	Very low	140 Å²	140	104.8 Å²	104.8	73%	0.733	60%	0.604	S	S	*	*			trans	-146.6	76.7	-172	-71.9	171	0	0	0	113
355	C	29.9	Very low	35.5	Very low	64 Å²	64	99.7 Å²	99.7	43%	0.432	59%	0.594	S	S	.	*			trans	-148.2	120.4	169	-89.5	0	0	0	0	112.9
356	C	28.5	Very low	37	Very low	80 Å²	80	98.5 Å²	98.5	54%	0.541	59%	0.587	S	S	.	*			trans	28.9	125.6	162.6	-137.2	0	0	0	0	122.8	C358	C356-C358 PolarHBondContact O-N 3.28Å
357	S	26.8	Very low	38.9	Very low	139 Å²	139	92.9 Å²	92.9	97%	0.972	57%	0.566	S	S	*	*			trans	-76.6	43.8	172.3	-51.2	0	0	0	0	114.8
358	C	28.1	Very low	41.3	Very low	76 Å²	76	88 Å²	88	51%	0.514	54%	0.544	S	S	.	.			trans	-96.5	148.2	178.2	-165.2	0	0	0	0	111.7	C356 C360	C356-C358 PolarHBondContact O-N 3.28Å; C358-C360 PolarHBondContact O-N 3.18Å
359	S	32.5	Very low	43.6	Very low	103 Å²	103	87 Å²	87	72%	0.72	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-62.2	0.4	-168.8	-164.5	0	0	0	0	116.5
360	C	32.7	Very low	46.3	Very low	80 Å²	80	86 Å²	86	54%	0.541	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-83.2	-1.7	-178.8	47.6	0	0	0	0	114.9	C358 S362	C358-C360 PolarHBondContact O-N 3.18Å; C360-S362 PolarHBondContact O-N 3.34Å
361	Y	35.4	Very low	49.2	Very low	154 Å²	154	82.9 Å²	82.9	60%	0.604	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-67.1	-17.6	179.6	-125.1	-82.5	0	0	0	114.4	A363 V364	Y361-A363 VanDerWaalsContact C-N 3.28Å; Y361-A363 PolarHBondContact O-N 2.91Å; Y361-V364 PolarHBondContact O-N 2.96Å
362	S	38	Very low	51.9	Low	89 Å²	89	80.6 Å²	80.6	62%	0.622	50%	0.502	S	S	*	.	H	α-helix	trans	-57.7	-35.3	-176.9	-55.6	0	0	0	0	113.8	C360 V364 A366	C360-S362 PolarHBondContact O-N 3.34Å; S362-V364 PolarHBondContact O-N 3.4Å; S362-A366 VanDerWaalsContact O-CB 3.26Å; S362-A366 WeakPolarHBondContact O-CB 3.39Å; S362-A366 PolarHBondContact O-N 3.36Å
363	A	42.4	Very low	54.8	Low	20 Å²	20	83.1 Å²	83.1	17%	0.165	49%	0.492	C	S	.	.	H	α-helix	trans	-73.6	-20.2	-173.4	0	0	0	0	0	115.1	Y361 E369	Y361-A363 VanDerWaalsContact C-N 3.28Å; Y361-A363 PolarHBondContact O-N 2.91Å; A363-E369 WeakPolarHBondContact CB-OE1 3.39Å
364	V	49.2	Very low	57.6	Low	89 Å²	89	80.2 Å²	80.2	54%	0.539	47%	0.467	S	S	.	.	H	α-helix	trans	-87.6	-26.6	-178	-167.1	0	0	0	0	111.9	Y361 S362 Q486	Y361-V364 PolarHBondContact O-N 2.96Å; S362-V364 PolarHBondContact O-N 3.4Å; V364-Q486 VanDerWaalsContact CG2-CD 3.47Å; V364-Q486 HydrophobicContact CG2-CG 4.09Å; V364-Q486 VanDerWaalsContact CG2-NE2 3.31Å
365	G	54.5	Low	60.5	Low	44 Å²	44	77.6 Å²	77.6	45%	0.454	45%	0.451	S	S	.	.	H	α-helix	trans	-109	-2.1	-176.4	0	0	0	0	0	115.4	K295	K295-G365 WeakPolarHBondContact CE-O 3.4Å
366	A	65.4	Low	63.5	Low	29 Å²	29	76.3 Å²	76.3	24%	0.24	44%	0.437	C	S	.	.			trans	-100.6	127.5	175.1	0	0	0	0	0	110.2	S362 Y368	S362-A366 VanDerWaalsContact O-CB 3.26Å; S362-A366 WeakPolarHBondContact O-CB 3.39Å; S362-A366 PolarHBondContact O-N 3.36Å; A366-Y368 VanDerWaalsContact C-N 3.26Å; A366-Y368 WeakPolarHBondContact CB-O 3.48Å; A366-Y368 PolarHBondContact O-N 2.91Å
367	P	77.8	Confident	66.4	Low	49 Å²	49	77.6 Å²	77.6	32%	0.318	44%	0.435	S	S	.	.	S	Bend	trans	-72.5	-18.8	177.7	29	-36	0	0	0	113.7	N291 L294	N291-P367 VanDerWaalsContact OD1-CD 3.23Å; N291-P367 WeakPolarHBondContact OD1-CD 3.2Å; N291-P367 VanDerWaalsContact OD1-CG 3.28Å; N291-P367 WeakPolarHBondContact OD1-CG 3.11Å; L294-P367 HydrophobicContact CB-CB 4.24Å; L294-P367 HydrophobicContact CB-CG 3.69Å; L294-P367 HydrophobicContact CD1-CB 3.66Å; L294-P367 HydrophobicContact CD1-CG 3.51Å; L294-P367 HydrophobicContact CG-CG 4.25Å
368	Y	87.3	Confident	69.3	Low	44 Å²	44	76.3 Å²	76.3	17%	0.173	42%	0.424	C	S	.	.	S	Bend	trans	-114.7	137.2	165.5	-51	-68.6	0	0	0	109.2	F256 L262 W273 I288 P289 N291 L294 A366	F256-Y368 HydrophobicContact CE2-CE1 4.03Å; F256-Y368 AromaticContact CZ-CE1 3.88Å; F256-Y368 HydrophobicContact CZ-CE1 3.88Å; L262-Y368 HydrophobicContact CD1-CE1 4.45Å; W273-Y368 HydrophobicContact CE3-CD2 4.44Å; W273-Y368 HydrophobicContact CE3-CE2 4.37Å; W273-Y368 HydrophobicContact CZ3-CD2 4.01Å; W273-Y368 HydrophobicContact CZ3-CE2 4.35Å; I288-Y368 HydrophobicContact CD1-CE1 4.17Å; I288-Y368 HydrophobicContact CD1-CE2 4.3Å; P289-Y368 WeakPolarHBondContact O-CE2 3.21Å; P289-Y368 PolarHBondContact O-OH 3.17Å; N291-Y368 WeakPolarHBondContact OD1-CD2 3.45Å; L294-Y368 HydrophobicContact CD1-CE2 3.78Å; A366-Y368 VanDerWaalsContact C-N 3.26Å; A366-Y368 WeakPolarHBondContact CB-O 3.48Å; A366-Y368 PolarHBondContact O-N 2.91Å
369	E	88.1	Confident	72.2	Confident	75 Å²	75	77.6 Å²	77.6	35%	0.35	44%	0.439	S	S	.	.			trans	-105.8	132.6	171.4	-174.1	173.5	-137.7	0	0	108.6	A363 R489 P581	A363-E369 WeakPolarHBondContact CB-OE1 3.39Å; E369-R489 IonicContact OE1-CZ 3.12Å; E369-R489 IonicContact OE1-NH2 2.66Å; E369-R489 PolarHBondContact OE1-NH2 2.93Å; E369-R489 IonicContact OE2-CZ 2.66Å; E369-R489 IonicContact OE2-NH2 3.76Å; E369-R489 PolarHBondContact OE2-NH2 3.38Å; E369-P581 HydrophobicContact CG-CB 4.44Å; E369-P581 HydrophobicContact CG-CG 4.49Å; E369-P581 WeakPolarHBondContact OE1-CG 3.45Å
370	E	90.6	Very high	74.9	Confident	142 Å²	142	76.1 Å²	76.1	66%	0.664	42%	0.423	S	S	*	.			trans	-79.3	130.2	178.9	-174.1	149.5	-147.8	0	0	110.3	P581 E582	E370-P581 CarbonylContact O-C 3.58Å; E370-P581 WeakPolarHBondContact O-CA 3.35Å; E370-E582 HydrophobicContact CG-CB 4.09Å; E370-E582 PolarHBondContact O-N 3.12Å
371	V	92.4	Very high	77.8	Confident	43 Å²	43	77.6 Å²	77.6	26%	0.261	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.4	-169	-66.5	0	0	0	0	112.4	I261 W579 V580	I261-V371 HydrophobicContact CD1-CG2 4.43Å; I261-V371 HydrophobicContact CG2-CG2 3.94Å; V371-W579 HydrophobicContact CB-CE3 4.21Å; V371-W579 HydrophobicContact CG2-CD2 4.47Å; V371-W579 HydrophobicContact CG2-CE3 3.82Å; V371-W579 HydrophobicContact CG2-CZ3 4.39Å; V371-V580 CarbonylContact C-O 3.54Å; V371-V580 WeakPolarHBondContact CA-O 3.49Å; V371-V580 WeakPolarHBondContact CB-O 3.5Å
372	V	93.3	Very high	80.7	Confident	49 Å²	49	72.1 Å²	72.1	30%	0.297	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.7	177.7	70.3	0	0	0	0	110	Y374 V580 E582 V585	V372-Y374 PolarHBondContact O-N 2.8Å; V372-V580 HydrophobicContact CG1-CG2 3.98Å; V372-V580 PolarHBondContact N-O 3.06Å; V372-V580 PolarHBondContact O-N 3.01Å; V372-E582 HydrophobicContact CB-CG 4.38Å; V372-V585 HydrophobicContact CG1-CB 3.99Å; V372-V585 HydrophobicContact CG1-CG2 3.69Å
373	R	92.4	Very high	83.4	Confident	146 Å²	146	68.1 Å²	68.1	55%	0.551	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.4	168.9	-72.1	-167.6	173.7	117.6	-4.4	109.7	L577 Q578 W579	R373-L577 HydrophobicContact CB-CD2 4.31Å; R373-Q578 WeakPolarHBondContact CA-O 3.3Å; R373-W579 HydrophobicContact CG-CD2 4.08Å; R373-W579 HydrophobicContact CG-CE3 3.9Å; R373-W579 HydrophobicContact CG-CH2 3.61Å; R373-W579 HydrophobicContact CG-CZ2 3.76Å; R373-W579 HydrophobicContact CG-CZ3 3.68Å
374	Y	92.4	Very high	86	Confident	29 Å²	29	67.2 Å²	67.2	11%	0.114	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.8	177.4	172.8	-98.5	0	0	0	110.3	V372 R376 R383 K494 Q578 V580 V585	V372-Y374 PolarHBondContact O-N 2.8Å; Y374-R376 HydrophobicContact CE1-CB 4.09Å; Y374-R383 HydrophobicContact CE1-CG 4.42Å; Y374-K494 HydrophobicContact CE1-CD 3.88Å; Y374-K494 HydrophobicContact CE2-CD 3.99Å; Y374-Q578 PolarHBondContact N-O 3.43Å; Y374-Q578 PolarHBondContact O-N 3.04Å; Y374-V580 HydrophobicContact CD1-CG1 4.18Å; Y374-V580 HydrophobicContact CG-CG1 4.41Å; Y374-V580 HydrophobicContact CG-CG2 4.06Å; Y374-V585 HydrophobicContact CD2-CG2 3.88Å; Y374-V585 HydrophobicContact CG-CG2 4.38Å
375	Q	93.3	Very high	88.3	Confident	86 Å²	86	63 Å²	63	40%	0.402	34%	0.338	S	S	.	.			trans	-131.2	123.6	167.9	-173.2	176.5	22.2	0	0	107.1	Q377 E575 L577	Q375-Q377 PolarHBondContact O-N 3.19Å; Q375-Q377 PolarHBondContact O-NE2 2.98Å; Q375-E575 PolarHBondContact NE2-O 3.21Å; Q375-L577 HydrophobicContact CB-CD2 3.72Å; Q375-L577 HydrophobicContact CB-CG 4.05Å; Q375-L577 HydrophobicContact CG-CG 4.49Å
376	R	91.8	Very high	90.3	Very high	37 Å²	37	60.9 Å²	60.9	14%	0.14	32%	0.317	C	S	.	.			trans	-61.9	128.9	178.3	-173.8	-162.5	69	96	-3.9	109	Y374 P378 D380 K381 Q574	Y374-R376 HydrophobicContact CE1-CB 4.09Å; R376-P378 PolarHBondContact NH1-O 3.16Å; R376-D380 HydrophobicContact CG-CB 3.86Å; R376-D380 PolarHBondContact NH1-O 3.43Å; R376-K381 WeakPolarHBondContact CD-O 3.39Å; R376-Q574 PolarHBondContact NE-O 3.06Å; R376-Q574 VanDerWaalsContact NE-O 3.16Å
377	Q	90.2	Very high	91.8	Very high	107 Å²	107	59.5 Å²	59.5	50%	0.5	31%	0.305	S	S	.	.			trans	-75.9	149.7	171.4	-58.8	-56	-53.1	0	0	109.8	Q375 A379 D380	Q375-Q377 PolarHBondContact O-N 3.19Å; Q375-Q377 PolarHBondContact O-NE2 2.98Å; Q377-A379 PolarHBondContact O-N 2.95Å; Q377-D380 VanDerWaalsContact CB-OD2 3.29Å; Q377-D380 WeakPolarHBondContact CB-OD2 3.48Å; Q377-D380 PolarHBondContact N-OD2 3.4Å; Q377-D380 WeakPolarHBondContact O-CB 3.45Å; Q377-D380 PolarHBondContact O-N 3.06Å
378	P	87.5	Confident	92.6	Very high	112 Å²	112	57.1 Å²	57.1	73%	0.727	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.3	-179.4	-28.6	36.2	0	0	0	114.6	R376	R376-P378 PolarHBondContact NH1-O 3.16Å
379	A	88.8	Confident	92.8	Very high	102 Å²	102	55.2 Å²	55.2	84%	0.843	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-16.6	176.9	0	0	0	0	0	114.5	Q377	Q377-A379 PolarHBondContact O-N 2.95Å
380	D	90.6	Very high	92.9	Very high	72 Å²	72	51.6 Å²	51.6	39%	0.385	27%	0.267	S	S	.	.	S	Bend	trans	-78.3	151.1	178.4	-58.9	-33.7	0	0	0	110.9	R376 Q377	R376-D380 HydrophobicContact CG-CB 3.86Å; R376-D380 PolarHBondContact NH1-O 3.43Å; Q377-D380 VanDerWaalsContact CB-OD2 3.29Å; Q377-D380 WeakPolarHBondContact CB-OD2 3.48Å; Q377-D380 PolarHBondContact N-OD2 3.4Å; Q377-D380 WeakPolarHBondContact O-CB 3.45Å; Q377-D380 PolarHBondContact O-N 3.06Å
381	K	92.9	Very high	92.5	Very high	112 Å²	112	48.7 Å²	48.7	49%	0.487	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-55.7	145.6	171.8	-58.8	-176.8	-169.2	-177.5	0	110.8	R376 L470 D471	R376-K381 WeakPolarHBondContact CD-O 3.39Å; K381-L470 HydrophobicContact CB-CB 4.49Å; K381-L470 HydrophobicContact CD-CB 4.45Å; K381-D471 WeakPolarHBondContact CD-OD1 3.19Å; K381-D471 WeakPolarHBondContact CE-OD1 3.33Å; K381-D471 IonicContact NZ-OD1 2.85Å; K381-D471 PolarHBondContact NZ-OD1 3.27Å
382	H	95.6	Very high	91.9	Very high	39 Å²	39	48.1 Å²	48.1	18%	0.181	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-60.1	145.4	174.6	-69.3	109.7	0	0	0	111.4	L470 G473 I475	H382-L470 HydrophobicContact CB-CD2 4.34Å; H382-L470 WeakPolarHBondContact O-CD2 3.16Å; H382-G473 PolarHBondContact CE1-O 3.24Å; H382-G473 PolarHBondContact ND1-O 2.66Å; H382-I475 HydrophobicContact CB-CG1 3.9Å
383	R	95.9	Very high	91.6	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.019	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-66.8	143.4	170.9	-65	177.9	69	-176.6	-0.6	110.1	Y374 I385 K494 P495 A573 Q574	Y374-R383 HydrophobicContact CE1-CG 4.42Å; R383-I385 PolarHBondContact O-N 3.17Å; R383-K494 WeakPolarHBondContact CB-O 3.48Å; R383-K494 HydrophobicContact CG-CB 4.19Å; R383-K494 PolarHBondContact NE-O 2.76Å; R383-K494 PolarHBondContact NH2-O 3.23Å; R383-P495 PolarHBondContact NH2-O 3.37Å; R383-A573 WeakPolarHBondContact CD-O 3.19Å; R383-A573 PolarHBondContact NH1-O 2.63Å; R383-Q574 PolarHBondContact O-NE2 3.14Å
384	L	96.6	Very high	91.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-65.4	127.8	172.3	173.7	62	0	0	0	110.6	V386 V466 C476 M478 A488 L493 P495 Y496	L384-V386 HydrophobicContact CD2-CG2 3.89Å; L384-V386 HydrophobicContact CG-CG2 3.86Å; L384-V466 HydrophobicContact CD1-CG1 3.87Å; L384-V466 HydrophobicContact CD2-CG1 4.3Å; L384-C476 HydrophobicContact CD1-CB 3.91Å; L384-M478 HydrophobicContact CD1-CB 4.11Å; L384-A488 HydrophobicContact CD2-CB 4.34Å; L384-L493 HydrophobicContact CB-CB 4.31Å; L384-L493 WeakPolarHBondContact CB-O 3.38Å; L384-L493 HydrophobicContact CD2-CB 4.28Å; L384-L493 HydrophobicContact CD2-CD1 4.18Å; L384-L493 PolarHBondContact N-O 2.77Å; L384-P495 CarbonylContact O-C 3.57Å; L384-P495 VanDerWaalsContact O-CA 3.32Å; L384-P495 WeakPolarHBondContact O-CA 3.37Å; L384-Y496 PolarHBondContact O-N 3.01Å
385	I	97.8	Very high	91.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.4	171.3	-56.7	-58.9	0	0	0	109.1	R383 L387 I475 C476 I477 M478 I498 I570 A573	R383-I385 PolarHBondContact O-N 3.17Å; I385-L387 HydrophobicContact CG2-CD2 3.94Å; I385-I475 HydrophobicContact CG1-CG2 3.59Å; I385-C476 PolarHBondContact N-O 2.97Å; I385-I477 HydrophobicContact CB-CG1 4.34Å; I385-I477 HydrophobicContact CG2-CG2 4.3Å; I385-I477 WeakPolarHBondContact O-CA 3.33Å; I385-M478 PolarHBondContact O-N 3.16Å; I385-I498 HydrophobicContact CG2-CD1 4.08Å; I385-I570 HydrophobicContact CD1-CB 4.42Å; I385-I570 HydrophobicContact CD1-CG1 4.02Å; I385-I570 HydrophobicContact CD1-CG2 4.13Å; I385-I570 HydrophobicContact CG1-CD1 4.43Å; I385-I570 HydrophobicContact CG1-CG1 3.99Å; I385-I570 HydrophobicContact CG1-CG2 4.07Å; I385-I570 HydrophobicContact CG2-CD1 4.04Å; I385-I570 HydrophobicContact CG2-CG1 3.92Å; I385-A573 HydrophobicContact CD1-CB 4Å
386	V	96.6	Very high	91	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.9	179.4	-179.3	0	0	0	0	109.4	L384 V388 L480 P495 Y496 V497 I498	L384-V386 HydrophobicContact CD2-CG2 3.89Å; L384-V386 HydrophobicContact CG-CG2 3.86Å; V386-V388 HydrophobicContact CG1-CG2 3.93Å; V386-L480 HydrophobicContact CG1-CB 3.91Å; V386-L480 HydrophobicContact CG1-CD1 3.77Å; V386-L480 HydrophobicContact CG1-CG 3.9Å; V386-L480 HydrophobicContact CG2-CD1 4.22Å; V386-P495 HydrophobicContact CG2-CB 3.86Å; V386-Y496 PolarHBondContact N-O 3.09Å; V386-V497 HydrophobicContact CB-CG1 4.49Å; V386-V497 HydrophobicContact CB-CG2 4.22Å; V386-V497 HydrophobicContact CG1-CG1 4.37Å; V386-V497 WeakPolarHBondContact O-CA 3.2Å; V386-I498 PolarHBondContact O-N 3.38Å
387	L	96.4	Very high	90.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.3	176.5	-52	-176.1	0	0	0	110.7	I385 V395 R399 I477 M478 D479 L480 I498 L566	I385-L387 HydrophobicContact CG2-CD2 3.94Å; L387-V395 HydrophobicContact CB-CG1 3.45Å; L387-V395 VanDerWaalsContact CB-CG1 3.45Å; L387-V395 HydrophobicContact CD1-CG1 4.01Å; L387-V395 HydrophobicContact CG-CG1 4.4Å; L387-R399 HydrophobicContact CD1-CB 4.03Å; L387-I477 HydrophobicContact CD1-CG2 3.85Å; L387-I477 HydrophobicContact CG-CG2 4.06Å; L387-M478 PolarHBondContact N-O 3.19Å; L387-D479 WeakPolarHBondContact O-CA 3.33Å; L387-L480 PolarHBondContact O-N 3.31Å; L387-I498 HydrophobicContact CD2-CB 3.99Å; L387-I498 HydrophobicContact CD2-CD1 4.32Å; L387-L566 HydrophobicContact CD1-CD2 4.38Å; L387-L566 HydrophobicContact CD2-CD1 3.77Å
388	V	94.3	Very high	90.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.9	-179.8	-174.2	0	0	0	0	108.6	V386 P482 I485 V497 I498 F499 I500 F550	V386-V388 HydrophobicContact CG1-CG2 3.93Å; V388-P482 HydrophobicContact CG1-CB 4.4Å; V388-P482 HydrophobicContact CG1-CG 3.79Å; V388-I485 HydrophobicContact CG2-CD1 3.95Å; V388-I485 HydrophobicContact CG2-CG1 4.14Å; V388-V497 HydrophobicContact CG2-CG1 3.64Å; V388-I498 PolarHBondContact N-O 2.99Å; V388-F499 HydrophobicContact CB-CD2 4.39Å; V388-F499 HydrophobicContact CG1-CD2 4.26Å; V388-F499 CarbonylContact O-C 3.59Å; V388-F499 WeakPolarHBondContact O-CA 3.31Å; V388-I500 PolarHBondContact O-N 3.46Å; V388-F550 HydrophobicContact CB-CE1 4.39Å; V388-F550 HydrophobicContact CG1-CE1 4.11Å; V388-F550 HydrophobicContact CG1-CZ 4.33Å
389	G	92.4	Very high	90.9	Very high	3 Å²	3	28 Å²	28	3%	0.031	17%	0.173	C	C	.	.			trans	159.4	155.4	176.9	0	0	0	0	0	112.5	R339 I500	R339-G389 PolarHBondContact NH1-O 2.91Å; G389-I500 WeakPolarHBondContact CA-O 3.3Å
390	P	89.2	Confident	90.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.			trans	-63.6	162.3	-170.9	24	-32.1	0	0	0	113.2	G392 V393 P502 M535 L538 A539 M542	P390-G392 PolarHBondContact O-N 3Å; P390-V393 HydrophobicContact CG-CB 4.06Å; P390-V393 HydrophobicContact CG-CG2 4.41Å; P390-V393 WeakPolarHBondContact O-CB 3.5Å; P390-V393 VanDerWaalsContact O-CG1 3.23Å; P390-V393 WeakPolarHBondContact O-CG1 3.18Å; P390-V393 PolarHBondContact O-N 3.45Å; P390-P502 HydrophobicContact CG-CG 4.37Å; P390-M535 HydrophobicContact CB-CG 4.42Å; P390-M535 HydrophobicContact CG-CG 4.09Å; P390-L538 HydrophobicContact CB-CB 3.84Å; P390-A539 HydrophobicContact CG-CB 4.07Å; P390-M542 HydrophobicContact CB-SD 4.37Å
391	S	82.8	Confident	90.9	Very high	81 Å²	81	27.5 Å²	27.5	57%	0.566	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	140.5	174.2	-172	0	0	0	0	110.6	V393	S391-V393 PolarHBondContact O-N 2.8Å
392	G	79.6	Confident	90.8	Very high	31 Å²	31	22.4 Å²	22.4	32%	0.32	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	-12.5	-178.1	0	0	0	0	0	115.9	P390 G394 R512	P390-G392 PolarHBondContact O-N 3Å; G392-G394 VanDerWaalsContact C-N 3.28Å; G392-G394 PolarHBondContact O-N 3.34Å; G392-R512 PolarHBondContact O-NH1 3.49Å
393	V	87.3	Confident	90.5	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	-65.5	-28.8	-175.1	80.7	0	0	0	0	113.8	P390 S391 V395 I500 P502 R512 M535 N556	P390-V393 HydrophobicContact CG-CB 4.06Å; P390-V393 HydrophobicContact CG-CG2 4.41Å; P390-V393 WeakPolarHBondContact O-CB 3.5Å; P390-V393 VanDerWaalsContact O-CG1 3.23Å; P390-V393 WeakPolarHBondContact O-CG1 3.18Å; P390-V393 PolarHBondContact O-N 3.45Å; S391-V393 PolarHBondContact O-N 2.8Å; V393-V395 HydrophobicContact CG1-CG2 3.72Å; V393-I500 HydrophobicContact CG1-CB 4.19Å; V393-I500 HydrophobicContact CG1-CG2 3.94Å; V393-I500 HydrophobicContact CG2-CG2 4.13Å; V393-P502 HydrophobicContact CG2-CB 4.05Å; V393-P502 HydrophobicContact CG2-CG 4.49Å; V393-R512 PolarHBondContact O-NH2 2.92Å; V393-M535 HydrophobicContact CB-SD 4.17Å; V393-M535 HydrophobicContact CG2-SD 4.49Å; V393-N556 PolarHBondContact O-ND2 2.96Å
394	G	87.9	Confident	90.2	Very high	20 Å²	20	23.1 Å²	23.1	21%	0.206	14%	0.142	C	C	.	.	S	Bend	trans	119.8	4.6	175.4	0	0	0	0	0	116.3	G392 N396 E397 L398	G392-G394 VanDerWaalsContact C-N 3.28Å; G392-G394 PolarHBondContact O-N 3.34Å; G394-N396 VanDerWaalsContact C-N 3.27Å; G394-N396 PolarHBondContact O-N 3.29Å; G394-N396 VanDerWaalsContact O-N 3.13Å; G394-E397 WeakPolarHBondContact O-CA 3.32Å; G394-E397 WeakPolarHBondContact O-CB 3.37Å; G394-E397 PolarHBondContact O-N 3.42Å; G394-L398 PolarHBondContact O-N 3.4Å
395	V	89.7	Confident	89.8	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-46.6	-46.6	-178.4	175	0	0	0	0	113.6	L387 V393 E397 L398 R399 D479 I500	L387-V395 HydrophobicContact CB-CG1 3.45Å; L387-V395 VanDerWaalsContact CB-CG1 3.45Å; L387-V395 HydrophobicContact CD1-CG1 4.01Å; L387-V395 HydrophobicContact CG-CG1 4.4Å; V393-V395 HydrophobicContact CG1-CG2 3.72Å; V395-E397 VanDerWaalsContact C-N 3.29Å; V395-E397 PolarHBondContact O-N 2.94Å; V395-L398 PolarHBondContact O-N 3.38Å; V395-R399 PolarHBondContact O-N 3.13Å; V395-D479 HydrophobicContact CG1-CB 3.79Å; V395-I500 HydrophobicContact CG2-CB 3.86Å; V395-I500 HydrophobicContact CG2-CG1 3.86Å; V395-I500 HydrophobicContact CG2-CG2 4.43Å
396	N	86.6	Confident	89.5	Confident	58 Å²	58	31.1 Å²	31.1	31%	0.31	19%	0.192	S	C	.	.	H	α-helix	trans	-64	-33.7	178.8	-77.3	-29.5	0	0	0	113.6	S337 G394 R399 R400	S337-N396 VanDerWaalsContact CB-OD1 3.3Å; S337-N396 WeakPolarHBondContact CB-OD1 3.29Å; S337-N396 PolarHBondContact OG-ND2 3.25Å; S337-N396 PolarHBondContact OG-OD1 3Å; G394-N396 VanDerWaalsContact C-N 3.27Å; G394-N396 PolarHBondContact O-N 3.29Å; G394-N396 VanDerWaalsContact O-N 3.13Å; N396-R399 PolarHBondContact OD1-NH2 3.48Å; N396-R400 WeakPolarHBondContact O-CB 2.95Å; N396-R400 PolarHBondContact O-N 2.91Å
397	E	86.8	Confident	89.2	Confident	45 Å²	45	35.1 Å²	35.1	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-72.2	-46.1	177.8	-172.5	56.7	-158.9	0	0	110.7	G394 V395 R399 R400 Q401 L559	G394-E397 WeakPolarHBondContact O-CA 3.32Å; G394-E397 WeakPolarHBondContact O-CB 3.37Å; G394-E397 PolarHBondContact O-N 3.42Å; V395-E397 VanDerWaalsContact C-N 3.29Å; V395-E397 PolarHBondContact O-N 2.94Å; E397-R399 PolarHBondContact O-N 3.47Å; E397-R400 PolarHBondContact O-N 3.48Å; E397-R400 VanDerWaalsContact O-N 3.13Å; E397-R400 IonicContact OE2-CZ 2.73Å; E397-R400 IonicContact OE2-NE 2.72Å; E397-R400 PolarHBondContact OE2-NE 3.2Å; E397-R400 VanDerWaalsContact OE2-NE 3.08Å; E397-R400 IonicContact OE2-NH2 3.33Å; E397-R400 PolarHBondContact OE2-NH2 3.24Å; E397-Q401 HydrophobicContact CG-CG 4.42Å; E397-Q401 WeakPolarHBondContact O-CG 3.24Å; E397-Q401 PolarHBondContact O-N 3.35Å; E397-Q401 WeakPolarHBondContact OE1-CG 3.45Å; E397-Q401 PolarHBondContact OE1-NE2 3.12Å; E397-L559 HydrophobicContact CB-CD2 4.13Å; E397-L559 HydrophobicContact CG-CD1 3.86Å; E397-L559 HydrophobicContact CG-CD2 3.91Å
398	L	90.6	Very high	89	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-48.7	176.2	-61.3	176.1	0	0	0	111.3	G394 V395 R400 Q401 L402 I500 L559 A562 C563 L566	G394-L398 PolarHBondContact O-N 3.4Å; V395-L398 PolarHBondContact O-N 3.38Å; L398-R400 VanDerWaalsContact C-N 3.31Å; L398-R400 PolarHBondContact O-N 3.11Å; L398-Q401 PolarHBondContact O-N 3.26Å; L398-L402 WeakPolarHBondContact O-CB 3.49Å; L398-L402 PolarHBondContact O-N 3.29Å; L398-I500 HydrophobicContact CD1-CD1 3.97Å; L398-I500 HydrophobicContact CD1-CG1 4.1Å; L398-I500 HydrophobicContact CD1-CG2 3.77Å; L398-L559 HydrophobicContact CD2-CD2 3.84Å; L398-L559 HydrophobicContact CG-CD2 4.34Å; L398-A562 HydrophobicContact CD1-CB 4.39Å; L398-A562 HydrophobicContact CD2-CB 3.81Å; L398-C563 WeakPolarHBondContact CD2-SG 3.07Å; L398-L566 HydrophobicContact CB-CD2 3.93Å
399	R	90.8	Very high	88.9	Confident	20 Å²	20	41.3 Å²	41.3	8%	0.075	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-41.2	175	-179.3	175.9	58.8	-172.2	-14.8	112.3	F334 L387 V395 N396 E397 I403 I477 D479	F334-R399 HydrophobicContact CE1-CG 4.4Å; L387-R399 HydrophobicContact CD1-CB 4.03Å; V395-R399 PolarHBondContact O-N 3.13Å; N396-R399 PolarHBondContact OD1-NH2 3.48Å; E397-R399 PolarHBondContact O-N 3.47Å; R399-I403 HydrophobicContact CG-CD1 3.79Å; R399-I403 WeakPolarHBondContact O-CG1 3.49Å; R399-I403 PolarHBondContact O-N 3.49Å; R399-I403 VanDerWaalsContact O-N 3.11Å; R399-I477 WeakPolarHBondContact CD-O 3.31Å; R399-I477 HydrophobicContact CG-CB 4.37Å; R399-I477 HydrophobicContact CG-CG2 3.91Å; R399-D479 IonicContact CZ-OD1 3.16Å; R399-D479 IonicContact NH1-OD1 3.05Å; R399-D479 PolarHBondContact NH1-OD1 3.05Å; R399-D479 IonicContact NH2-OD1 2.63Å; R399-D479 PolarHBondContact NH2-OD1 3.36Å
400	R	88.8	Confident	89	Confident	102 Å²	102	41.9 Å²	41.9	39%	0.385	26%	0.262	S	S	.	.	H	α-helix	trans	-67.4	-46.8	-179.7	174.5	165.2	59.6	171	-8.7	112.7	F334 N396 E397 L398 G404	F334-R400 HydrophobicContact CD1-CB 3.7Å; F334-R400 HydrophobicContact CD1-CG 3.95Å; F334-R400 HydrophobicContact CE1-CB 3.78Å; F334-R400 HydrophobicContact CE1-CG 4.25Å; F334-R400 HydrophobicContact CG-CG 4.37Å; N396-R400 WeakPolarHBondContact O-CB 2.95Å; N396-R400 PolarHBondContact O-N 2.91Å; E397-R400 PolarHBondContact O-N 3.48Å; E397-R400 VanDerWaalsContact O-N 3.13Å; E397-R400 IonicContact OE2-CZ 2.73Å; E397-R400 IonicContact OE2-NE 2.72Å; E397-R400 PolarHBondContact OE2-NE 3.2Å; E397-R400 VanDerWaalsContact OE2-NE 3.08Å; E397-R400 IonicContact OE2-NH2 3.33Å; E397-R400 PolarHBondContact OE2-NH2 3.24Å; L398-R400 VanDerWaalsContact C-N 3.31Å; L398-R400 PolarHBondContact O-N 3.11Å; R400-G404 PolarHBondContact O-N 3.17Å
401	Q	89.7	Confident	89.3	Confident	60 Å²	60	44.2 Å²	44.2	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-45.2	176.5	-68.9	-175.1	10.2	0	0	110.4	E397 L398 G404 C405 C563	E397-Q401 HydrophobicContact CG-CG 4.42Å; E397-Q401 WeakPolarHBondContact O-CG 3.24Å; E397-Q401 PolarHBondContact O-N 3.35Å; E397-Q401 WeakPolarHBondContact OE1-CG 3.45Å; E397-Q401 PolarHBondContact OE1-NE2 3.12Å; L398-Q401 PolarHBondContact O-N 3.26Å; Q401-G404 PolarHBondContact O-N 3.25Å; Q401-C405 WeakPolarHBondContact O-CB 3.22Å; Q401-C405 PolarHBondContact O-N 2.85Å; Q401-C405 PolarHBondContact O-SG 3.12Å; Q401-C563 PolarHBondContact OE1-SG 3.01Å; Q401-C563 VanDerWaalsContact OE1-SG 3.37Å
402	L	90.9	Very high	89.8	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-51.9	-179.4	178.3	56.4	0	0	0	113.7	L398 G404 C405 N406 F410 I477 L566 L567 I570	L398-L402 WeakPolarHBondContact O-CB 3.49Å; L398-L402 PolarHBondContact O-N 3.29Å; L402-G404 VanDerWaalsContact C-N 3.35Å; L402-C405 PolarHBondContact O-N 3.46Å; L402-N406 PolarHBondContact O-N 3.28Å; L402-F410 HydrophobicContact CD1-CD2 3.78Å; L402-F410 HydrophobicContact CD1-CE2 3.49Å; L402-F410 VanDerWaalsContact CD1-CE2 3.49Å; L402-F410 HydrophobicContact CD1-CG 4.42Å; L402-F410 HydrophobicContact CD1-CZ 3.91Å; L402-F410 HydrophobicContact CG-CD2 3.98Å; L402-F410 HydrophobicContact CG-CE2 4.18Å; L402-F410 HydrophobicContact CG-CG 4.24Å; L402-I477 HydrophobicContact CD2-CD1 3.31Å; L402-I477 HydrophobicContact CG-CD1 3.92Å; L402-L566 HydrophobicContact CD2-CD2 3.75Å; L402-L566 HydrophobicContact CD2-CG 3.99Å; L402-L567 HydrophobicContact CD1-CD2 3.34Å; L402-L567 HydrophobicContact CD1-CG 3.69Å; L402-I570 HydrophobicContact CD2-CD1 3.42Å; L402-I570 VanDerWaalsContact CD2-CD1 3.42Å
403	I	91.1	Very high	90.4	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-68.2	-35.9	176.9	-68.4	166.3	0	0	0	111.1	F334 R399 C405 N406 P407 F410 S412 I477	F334-I403 HydrophobicContact CE1-CD1 4.16Å; F334-I403 HydrophobicContact CE2-CB 4.36Å; F334-I403 HydrophobicContact CE2-CG2 3.89Å; F334-I403 HydrophobicContact CZ-CB 3.62Å; F334-I403 HydrophobicContact CZ-CD1 3.66Å; F334-I403 HydrophobicContact CZ-CG1 4.2Å; F334-I403 HydrophobicContact CZ-CG2 3.61Å; R399-I403 HydrophobicContact CG-CD1 3.79Å; R399-I403 WeakPolarHBondContact O-CG1 3.49Å; R399-I403 PolarHBondContact O-N 3.49Å; R399-I403 VanDerWaalsContact O-N 3.11Å; I403-C405 VanDerWaalsContact C-N 3.3Å; I403-C405 PolarHBondContact O-N 2.88Å; I403-N406 CarbonylContact O-C 3.58Å; I403-N406 VanDerWaalsContact O-C 3.27Å; I403-N406 PolarHBondContact O-N 2.89Å; I403-P407 WeakPolarHBondContact O-CA 3.42Å; I403-P407 WeakPolarHBondContact O-CD 3.5Å; I403-F410 HydrophobicContact CB-CB 4.39Å; I403-F410 HydrophobicContact CG1-CB 3.63Å; I403-S412 WeakPolarHBondContact CD1-OG 3.33Å; I403-I477 HydrophobicContact CG1-CD1 4.45Å
404	G	88.9	Confident	90.6	Very high	49 Å²	49	40.8 Å²	40.8	51%	0.505	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-35.3	174.3	0	0	0	0	0	113.4	R400 Q401 L402	R400-G404 PolarHBondContact O-N 3.17Å; Q401-G404 PolarHBondContact O-N 3.25Å; L402-G404 VanDerWaalsContact C-N 3.35Å
405	C	88.9	Confident	90.9	Very high	108 Å²	108	40.6 Å²	40.6	73%	0.73	24%	0.239	S	C	*	.	H	α-helix	trans	-72.4	-34.9	176.8	-72.9	0	0	0	0	113.1	Q401 L402 I403	Q401-C405 WeakPolarHBondContact O-CB 3.22Å; Q401-C405 PolarHBondContact O-N 2.85Å; Q401-C405 PolarHBondContact O-SG 3.12Å; L402-C405 PolarHBondContact O-N 3.46Å; I403-C405 VanDerWaalsContact C-N 3.3Å; I403-C405 PolarHBondContact O-N 2.88Å
406	N	89.9	Confident	91	Very high	60 Å²	60	41.6 Å²	41.6	32%	0.321	24%	0.243	S	C	.	.			trans	-145.9	81.8	175.4	-170.1	-7.6	0	0	0	112.8	L402 I403 S408 C409 F410	L402-N406 PolarHBondContact O-N 3.28Å; I403-N406 CarbonylContact O-C 3.58Å; I403-N406 VanDerWaalsContact O-C 3.27Å; I403-N406 PolarHBondContact O-N 2.89Å; N406-S408 PolarHBondContact O-N 3.48Å; N406-S408 PolarHBondContact OD1-N 3.2Å; N406-S408 PolarHBondContact OD1-OG 3.1Å; N406-C409 HydrophobicContact CB-CB 4.41Å; N406-C409 WeakPolarHBondContact ND2-CB 3.45Å; N406-C409 PolarHBondContact O-N 3.45Å; N406-C409 PolarHBondContact OD1-N 3.4Å; N406-F410 HydrophobicContact CB-CD2 3.95Å; N406-F410 HydrophobicContact CB-CE2 4Å; N406-F410 WeakPolarHBondContact O-CD2 3.33Å; N406-F410 PolarHBondContact O-N 2.88Å; N406-F410 VanDerWaalsContact O-N 3.12Å
407	P	91.2	Very high	91.4	Very high	84 Å²	84	38.8 Å²	38.8	55%	0.545	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-8.4	-179.6	30.3	-36.1	0	0	0	113.4	I403	I403-P407 WeakPolarHBondContact O-CA 3.42Å; I403-P407 WeakPolarHBondContact O-CD 3.5Å
408	S	91.6	Very high	91.8	Very high	92 Å²	92	37.8 Å²	37.8	64%	0.643	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-28.1	173.8	73.2	0	0	0	0	112.3	N406	N406-S408 PolarHBondContact O-N 3.48Å; N406-S408 PolarHBondContact OD1-N 3.2Å; N406-S408 PolarHBondContact OD1-OG 3.1Å
409	C	93.1	Very high	91.9	Very high	39 Å²	39	39.3 Å²	39.3	26%	0.264	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-34.2	-176.3	-170.7	0	0	0	0	113.3	N406 I475	N406-C409 HydrophobicContact CB-CB 4.41Å; N406-C409 WeakPolarHBondContact ND2-CB 3.45Å; N406-C409 PolarHBondContact O-N 3.45Å; N406-C409 PolarHBondContact OD1-N 3.4Å; C409-I475 PolarHBondContact O-N 3Å
410	F	94.9	Very high	91.9	Very high	14 Å²	14	46.7 Å²	46.7	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.7	-172.5	-52.6	-63.9	0	0	0	111.7	L402 I403 N406 I475 I477 L567 I570	L402-F410 HydrophobicContact CD1-CD2 3.78Å; L402-F410 HydrophobicContact CD1-CE2 3.49Å; L402-F410 VanDerWaalsContact CD1-CE2 3.49Å; L402-F410 HydrophobicContact CD1-CG 4.42Å; L402-F410 HydrophobicContact CD1-CZ 3.91Å; L402-F410 HydrophobicContact CG-CD2 3.98Å; L402-F410 HydrophobicContact CG-CE2 4.18Å; L402-F410 HydrophobicContact CG-CG 4.24Å; I403-F410 HydrophobicContact CB-CB 4.39Å; I403-F410 HydrophobicContact CG1-CB 3.63Å; N406-F410 HydrophobicContact CB-CD2 3.95Å; N406-F410 HydrophobicContact CB-CE2 4Å; N406-F410 WeakPolarHBondContact O-CD2 3.33Å; N406-F410 PolarHBondContact O-N 2.88Å; N406-F410 VanDerWaalsContact O-N 3.12Å; F410-I475 HydrophobicContact CD1-CB 3.9Å; F410-I475 HydrophobicContact CD1-CD1 4.26Å; F410-I475 HydrophobicContact CD1-CG2 4.13Å; F410-I475 HydrophobicContact CE1-CB 4.3Å; F410-I475 HydrophobicContact CE1-CD1 3.8Å; F410-I475 HydrophobicContact CE1-CG2 4.41Å; F410-I477 HydrophobicContact CB-CD1 3.93Å; F410-I477 HydrophobicContact CD1-CD1 3.75Å; F410-I477 HydrophobicContact CD1-CG1 4.47Å; F410-I477 HydrophobicContact CG-CD1 4.01Å; F410-L567 HydrophobicContact CE2-CD2 3.93Å; F410-L567 HydrophobicContact CZ-CD2 3.87Å; F410-I570 HydrophobicContact CE1-CG2 4.01Å
411	Q	94.6	Very high	92.1	Very high	49 Å²	49	45 Å²	45	23%	0.229	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	148.3	177.5	176.6	165.3	-46.4	0	0	111.1	V469 E472 K474 I475 C476 I477	Q411-V469 HydrophobicContact CB-CG1 3.72Å; Q411-V469 HydrophobicContact CG-CG1 3.98Å; Q411-V469 HydrophobicContact CG-CG2 4.06Å; Q411-E472 PolarHBondContact NE2-OE2 3.09Å; Q411-K474 HydrophobicContact CB-CD 3.97Å; Q411-K474 VanDerWaalsContact OE1-CD 3.31Å; Q411-I475 PolarHBondContact N-O 3.3Å; Q411-I475 VanDerWaalsContact N-O 3.16Å; Q411-C476 WeakPolarHBondContact O-CA 3.2Å; Q411-I477 PolarHBondContact O-N 2.89Å
412	S	92.8	Very high	92.1	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.063	27%	0.268	C	S	.	.			trans	-87.7	143	170	-60	0	0	0	0	109.9	I403	I403-S412 WeakPolarHBondContact CD1-OG 3.33Å
413	A	92.7	Very high	92	Very high	8 Å²	8	51.6 Å²	51.6	7%	0.066	31%	0.31	C	S	.	.			trans	-60.6	143.4	164.5	0	0	0	0	0	110.8	P415 T461 A465 V466 M478	A413-P415 VanDerWaalsContact O-CD 3.3Å; A413-P415 WeakPolarHBondContact O-CD 3.33Å; A413-T461 HydrophobicContact CB-CG2 3.79Å; A413-A465 HydrophobicContact CB-CB 4.23Å; A413-A465 WeakPolarHBondContact CB-O 3.43Å; A413-V466 HydrophobicContact CB-CG2 3.83Å; A413-M478 HydrophobicContact CB-CE 3.99Å
414	V	92	Very high	91.7	Very high	24 Å²	24	55.9 Å²	55.9	15%	0.145	33%	0.326	C	S	.	.			trans	-83.2	114.2	179.3	-179.2	0	0	0	0	109.9	A465	V414-A465 WeakPolarHBondContact O-CB 3.47Å
415	P	93.2	Very high	91.6	Very high	16 Å²	16	54.3 Å²	54.3	10%	0.104	31%	0.306	C	S	.	.			trans	-71.3	157.5	-179.8	28.2	-33.3	0	0	0	111.8	A413 Y431 H432 G460	A413-P415 VanDerWaalsContact O-CD 3.3Å; A413-P415 WeakPolarHBondContact O-CD 3.33Å; P415-Y431 HydrophobicContact CB-CD1 4.07Å; P415-Y431 HydrophobicContact CB-CE1 4.22Å; P415-Y431 HydrophobicContact CG-CD1 3.59Å; P415-Y431 HydrophobicContact CG-CE1 3.6Å; P415-Y431 CarbonylContact O-C 3.27Å; P415-Y431 WeakPolarHBondContact O-CA 3.44Å; P415-Y431 WeakPolarHBondContact O-CB 3.41Å; P415-H432 PolarHBondContact O-N 3.15Å; P415-G460 CarbonylContact C-O 3.59Å; P415-G460 WeakPolarHBondContact CA-O 3.46Å
416	H	93.2	Very high	91.6	Very high	21 Å²	21	54.6 Å²	54.6	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	150.8	175.6	-63	38.6	0	0	0	110	H432 V434 F439 Y459 G460 S462	H416-H432 CarbonylContact C-O 3.52Å; H416-H432 VanDerWaalsContact CA-O 3.3Å; H416-H432 WeakPolarHBondContact CA-O 3.03Å; H416-H432 HydrophobicContact CB-CB 4.46Å; H416-H432 AromaticContact CE1-CD2 3.55Å; H416-H432 AromaticContact ND1-CD2 3.81Å; H416-V434 HydrophobicContact CB-CG2 4.3Å; H416-F439 HydrophobicContact CB-CD2 4.15Å; H416-F439 HydrophobicContact CB-CE2 3.92Å; H416-Y459 VanDerWaalsContact O-CA 3.31Å; H416-Y459 WeakPolarHBondContact O-CA 3.43Å; H416-G460 PolarHBondContact N-O 3.21Å; H416-G460 PolarHBondContact O-N 2.86Å; H416-G460 VanDerWaalsContact O-N 3.1Å; H416-S462 PolarHBondContact CE1-OG 2.99Å; H416-S462 PolarHBondContact NE2-OG 3.38Å
417	T	94.3	Very high	91.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	152.9	172.3	-169.2	0	0	0	0	112.8	R419 Y431 H432 Y433 V434 L458 Y459	T417-R419 HydrophobicContact CG2-CB 4.28Å; T417-R419 PolarHBondContact OG1-N 3.04Å; T417-Y431 HydrophobicContact CG2-CD1 4.01Å; T417-Y431 HydrophobicContact CG2-CD2 4.29Å; T417-Y431 HydrophobicContact CG2-CG 3.7Å; T417-H432 PolarHBondContact N-O 3.36Å; T417-Y433 HydrophobicContact CG2-CD1 3.5Å; T417-Y433 HydrophobicContact CG2-CE1 3.68Å; T417-Y433 HydrophobicContact CG2-CG 4.39Å; T417-V434 PolarHBondContact O-N 2.99Å; T417-L458 WeakPolarHBondContact CA-O 3.48Å; T417-L458 PolarHBondContact OG1-O 3.26Å; T417-L458 VanDerWaalsContact OG1-O 3.09Å; T417-Y459 HydrophobicContact CG2-CE1 4.48Å; T417-Y459 WeakPolarHBondContact OG1-CD1 3.43Å; T417-Y459 WeakPolarHBondContact OG1-CE1 3.38Å
418	T	93.9	Very high	91.3	Very high	23 Å²	23	54.2 Å²	54.2	14%	0.141	30%	0.299	C	S	.	.	S	Bend	trans	-99	4.9	171.7	56.7	0	0	0	0	113.1	V434 R436 F439 H457 L458	T418-V434 WeakPolarHBondContact CA-O 3.42Å; T418-R436 HydrophobicContact CG2-CB 4.33Å; T418-F439 HydrophobicContact CG2-CB 3.57Å; T418-F439 HydrophobicContact CG2-CD2 4Å; T418-F439 HydrophobicContact CG2-CG 3.87Å; T418-H457 PolarHBondContact O-ND1 3.19Å; T418-L458 HydrophobicContact CG2-CB 4Å; T418-L458 HydrophobicContact CG2-CD1 4.45Å; T418-L458 PolarHBondContact N-O 2.98Å; T418-L458 PolarHBondContact OG1-N 3.26Å; T418-L458 PolarHBondContact OG1-O 3.12Å
419	R	93.3	Very high	90.9	Very high	33 Å²	33	54 Å²	54	13%	0.125	28%	0.284	C	S	.	.	S	Bend	trans	-74	144	168.1	-175.1	-173.6	53.9	91.7	-12.7	109	T417 E425 Y433 H457 Y459	T417-R419 HydrophobicContact CG2-CB 4.28Å; T417-R419 PolarHBondContact OG1-N 3.04Å; R419-E425 IonicContact CZ-OE1 3.18Å; R419-E425 IonicContact CZ-OE2 2.66Å; R419-E425 VanDerWaalsContact CZ-OE2 3.27Å; R419-E425 IonicContact NH1-OE1 2.86Å; R419-E425 IonicContact NH1-OE2 3.5Å; R419-E425 PolarHBondContact NH1-OE2 2.72Å; R419-E425 VanDerWaalsContact NH2-CD 3.33Å; R419-E425 IonicContact NH2-OE1 2.77Å; R419-E425 PolarHBondContact NH2-OE1 3.1Å; R419-E425 VanDerWaalsContact NH2-OE1 3.14Å; R419-E425 IonicContact NH2-OE2 2.69Å; R419-E425 PolarHBondContact NH2-OE2 3.1Å; R419-Y433 VanDerWaalsContact O-CD1 3.24Å; R419-Y433 WeakPolarHBondContact O-CD1 3.32Å; R419-H457 WeakPolarHBondContact CA-ND1 3.25Å; R419-H457 HydrophobicContact CB-CB 4Å; R419-Y459 WeakPolarHBondContact CD-OH 3.48Å; R419-Y459 PolarHBondContact NE-OH 3.5Å
420	F	92	Very high	90.5	Very high	175 Å²	175	52.5 Å²	52.5	77%	0.768	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-64.6	143.7	168.9	-68	-76.2	0	0	0	112.3
421	P	91.8	Very high	90.4	Very high	65 Å²	65	52 Å²	52	42%	0.422	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-62.5	148.5	172.5	26.9	-33.9	0	0	0	110.9	Y433	P421-Y433 VanDerWaalsContact CA-CE1 3.45Å; P421-Y433 HydrophobicContact CB-CD1 3.9Å; P421-Y433 HydrophobicContact CB-CD2 3.97Å; P421-Y433 HydrophobicContact CB-CE1 3.77Å; P421-Y433 HydrophobicContact CB-CE2 3.89Å; P421-Y433 HydrophobicContact CB-CG 3.98Å; P421-Y433 HydrophobicContact CG-CD1 4.33Å; P421-Y433 HydrophobicContact CG-CG 4.24Å
422	K	89.9	Confident	90.3	Very high	75 Å²	75	52.6 Å²	52.6	33%	0.326	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-83.3	163.5	168.2	-60.2	177.9	-159.7	125.9	0	110.3	Y424 E425	K422-Y424 HydrophobicContact CB-CD1 4.26Å; K422-Y424 HydrophobicContact CB-CE1 4.1Å; K422-Y424 HydrophobicContact CD-CE1 3.7Å; K422-Y424 HydrophobicContact CD-CE2 4.23Å; K422-Y424 VanDerWaalsContact CD-CZ 3.47Å; K422-Y424 VanDerWaalsContact CD-OH 3.24Å; K422-Y424 WeakPolarHBondContact CD-OH 3.48Å; K422-Y424 PolarHBondContact NZ-OH 2.88Å; K422-Y424 PolarHBondContact O-N 3.48Å; K422-E425 HydrophobicContact CB-CG 4.01Å; K422-E425 WeakPolarHBondContact CD-OE1 3.46Å; K422-E425 WeakPolarHBondContact CE-OE1 3.47Å; K422-E425 PolarHBondContact N-OE2 2.93Å; K422-E425 IonicContact NZ-OE1 3.44Å; K422-E425 PolarHBondContact NZ-OE1 3.37Å; K422-E425 PolarHBondContact O-N 3.42Å
423	S	88.1	Confident	90.4	Very high	131 Å²	131	54 Å²	54	92%	0.916	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-19.3	177.9	50.9	0	0	0	0	116.1
424	Y	86.1	Confident	90.6	Very high	98 Å²	98	55.2 Å²	55.2	38%	0.384	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	0.5	178.9	62.8	-104.8	0	0	0	114.2	F330 K422	F330-Y424 HydrophobicContact CE2-CD2 4.42Å; F330-Y424 HydrophobicContact CE2-CE2 4.34Å; K422-Y424 HydrophobicContact CB-CD1 4.26Å; K422-Y424 HydrophobicContact CB-CE1 4.1Å; K422-Y424 HydrophobicContact CD-CE1 3.7Å; K422-Y424 HydrophobicContact CD-CE2 4.23Å; K422-Y424 VanDerWaalsContact CD-CZ 3.47Å; K422-Y424 VanDerWaalsContact CD-OH 3.24Å; K422-Y424 WeakPolarHBondContact CD-OH 3.48Å; K422-Y424 PolarHBondContact NZ-OH 2.88Å; K422-Y424 PolarHBondContact O-N 3.48Å
425	E	87.3	Confident	90.8	Very high	16 Å²	16	56.5 Å²	56.5	8%	0.075	30%	0.295	C	S	.	.			trans	-97.3	146	179.3	-63.7	171.3	170.5	0	0	109.4	R419 K422 Y433	R419-E425 IonicContact CZ-OE1 3.18Å; R419-E425 IonicContact CZ-OE2 2.66Å; R419-E425 VanDerWaalsContact CZ-OE2 3.27Å; R419-E425 IonicContact NH1-OE1 2.86Å; R419-E425 IonicContact NH1-OE2 3.5Å; R419-E425 PolarHBondContact NH1-OE2 2.72Å; R419-E425 VanDerWaalsContact NH2-CD 3.33Å; R419-E425 IonicContact NH2-OE1 2.77Å; R419-E425 PolarHBondContact NH2-OE1 3.1Å; R419-E425 VanDerWaalsContact NH2-OE1 3.14Å; R419-E425 IonicContact NH2-OE2 2.69Å; R419-E425 PolarHBondContact NH2-OE2 3.1Å; K422-E425 HydrophobicContact CB-CG 4.01Å; K422-E425 WeakPolarHBondContact CD-OE1 3.46Å; K422-E425 WeakPolarHBondContact CE-OE1 3.47Å; K422-E425 PolarHBondContact N-OE2 2.93Å; K422-E425 IonicContact NZ-OE1 3.44Å; K422-E425 PolarHBondContact NZ-OE1 3.37Å; K422-E425 PolarHBondContact O-N 3.42Å; E425-Y433 VanDerWaalsContact CB-OH 3.24Å; E425-Y433 WeakPolarHBondContact CB-OH 3.1Å; E425-Y433 VanDerWaalsContact CD-OH 3.24Å; E425-Y433 PolarHBondContact OE2-OH 3.22Å
426	M	87.3	Confident	90.8	Very high	114 Å²	114	61.7 Å²	61.7	56%	0.562	31%	0.312	S	S	*	.			trans	-118.8	139.7	178.6	-61	-165.8	-57.4	0	0	110.9	R429 E430	M426-R429 HydrophobicContact CB-CB 4.16Å; M426-R429 VanDerWaalsContact CE-CD 3.44Å; M426-R429 WeakPolarHBondContact O-CB 3.33Å; M426-R429 PolarHBondContact O-N 3.33Å; M426-E430 PolarHBondContact N-OE2 3.08Å; M426-E430 PolarHBondContact O-N 3.43Å
427	D	89.9	Confident	91	Very high	105 Å²	105	67 Å²	67	56%	0.561	34%	0.337	S	S	*	.	B	Isolated β-bridge	trans	-63.8	141.3	176.3	-171.4	61.3	0	0	0	111.6	R429 H432 Y433	D427-R429 PolarHBondContact O-N 3.24Å; D427-H432 WeakPolarHBondContact OD1-CA 3.43Å; D427-Y433 HydrophobicContact CB-CD2 4.11Å; D427-Y433 WeakPolarHBondContact OD1-CD2 3.34Å; D427-Y433 PolarHBondContact OD1-N 3.32Å
428	G	84.7	Confident	91	Very high	32 Å²	32	70.2 Å²	70.2	33%	0.33	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	3.5	-174.4	0	0	0	0	0	115.1	Y431	G428-Y431 PolarHBondContact N-O 2.67Å
429	R	84.7	Confident	91.1	Very high	86 Å²	86	69.1 Å²	69.1	33%	0.325	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-57.8	178.9	-170.9	-177.3	-166.9	-111.3	4.9	113.1	F330 A332 G333 M426 D427	F330-R429 PolarHBondContact O-NH1 3.45Å; F330-R429 PolarHBondContact O-NH2 2.86Å; A332-R429 HydrophobicContact CB-CG 3.75Å; A332-R429 WeakPolarHBondContact CB-O 3.39Å; G333-R429 PolarHBondContact N-O 2.88Å; M426-R429 HydrophobicContact CB-CB 4.16Å; M426-R429 VanDerWaalsContact CE-CD 3.44Å; M426-R429 WeakPolarHBondContact O-CB 3.33Å; M426-R429 PolarHBondContact O-N 3.33Å; D427-R429 PolarHBondContact O-N 3.24Å
430	E	84.4	Confident	91	Very high	8 Å²	8	70 Å²	70	4%	0.037	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-45.5	174.3	-73.5	75.5	-149.1	0	0	110.9	M426	M426-E430 PolarHBondContact N-OE2 3.08Å; M426-E430 PolarHBondContact O-N 3.43Å
431	Y	91.7	Very high	91.1	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.016	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-147.5	162.9	173.1	-62.4	-89.7	0	0	0	110.1	R335 R336 P415 T417 G428 Y433 Y459	R335-Y431 PolarHBondContact O-OH 3.09Å; R336-Y431 WeakPolarHBondContact CB-OH 3.35Å; P415-Y431 HydrophobicContact CB-CD1 4.07Å; P415-Y431 HydrophobicContact CB-CE1 4.22Å; P415-Y431 HydrophobicContact CG-CD1 3.59Å; P415-Y431 HydrophobicContact CG-CE1 3.6Å; P415-Y431 CarbonylContact O-C 3.27Å; P415-Y431 WeakPolarHBondContact O-CA 3.44Å; P415-Y431 WeakPolarHBondContact O-CB 3.41Å; T417-Y431 HydrophobicContact CG2-CD1 4.01Å; T417-Y431 HydrophobicContact CG2-CD2 4.29Å; T417-Y431 HydrophobicContact CG2-CG 3.7Å; G428-Y431 PolarHBondContact N-O 2.67Å; Y431-Y433 HydrophobicContact CD2-CE1 4.25Å; Y431-Y433 AromaticContact CD2-CZ 3.96Å; Y431-Y433 WeakPolarHBondContact O-CD2 3.35Å; Y431-Y433 WeakPolarHBondContact O-CE2 3.34Å; Y431-Y459 HydrophobicContact CD1-CD1 4.25Å; Y431-Y459 AromaticContact CE1-CD1 3.75Å; Y431-Y459 HydrophobicContact CE1-CD1 3.75Å; Y431-Y459 HydrophobicContact CE1-CE1 4.08Å
432	H	93.8	Very high	91.1	Very high	61 Å²	61	64.1 Å²	64.1	28%	0.282	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	113.2	152.9	-68.6	-68.6	0	0	0	109.2	P415 H416 T417 D427 V434	P415-H432 PolarHBondContact O-N 3.15Å; H416-H432 CarbonylContact C-O 3.52Å; H416-H432 VanDerWaalsContact CA-O 3.3Å; H416-H432 WeakPolarHBondContact CA-O 3.03Å; H416-H432 HydrophobicContact CB-CB 4.46Å; H416-H432 AromaticContact CE1-CD2 3.55Å; H416-H432 AromaticContact ND1-CD2 3.81Å; T417-H432 PolarHBondContact N-O 3.36Å; D427-H432 WeakPolarHBondContact OD1-CA 3.43Å; H432-V434 HydrophobicContact CB-CG1 4.41Å; H432-V434 PolarHBondContact O-N 3.47Å
433	Y	94.6	Very high	91	Very high	39 Å²	39	62.7 Å²	62.7	15%	0.153	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	96.9	-176.6	-65.2	-81.7	0	0	0	109.7	T417 R419 P421 E425 D427 Y431	T417-Y433 HydrophobicContact CG2-CD1 3.5Å; T417-Y433 HydrophobicContact CG2-CE1 3.68Å; T417-Y433 HydrophobicContact CG2-CG 4.39Å; R419-Y433 VanDerWaalsContact O-CD1 3.24Å; R419-Y433 WeakPolarHBondContact O-CD1 3.32Å; P421-Y433 VanDerWaalsContact CA-CE1 3.45Å; P421-Y433 HydrophobicContact CB-CD1 3.9Å; P421-Y433 HydrophobicContact CB-CD2 3.97Å; P421-Y433 HydrophobicContact CB-CE1 3.77Å; P421-Y433 HydrophobicContact CB-CE2 3.89Å; P421-Y433 HydrophobicContact CB-CG 3.98Å; P421-Y433 HydrophobicContact CG-CD1 4.33Å; P421-Y433 HydrophobicContact CG-CG 4.24Å; E425-Y433 VanDerWaalsContact CB-OH 3.24Å; E425-Y433 WeakPolarHBondContact CB-OH 3.1Å; E425-Y433 VanDerWaalsContact CD-OH 3.24Å; E425-Y433 PolarHBondContact OE2-OH 3.22Å; D427-Y433 HydrophobicContact CB-CD2 4.11Å; D427-Y433 WeakPolarHBondContact OD1-CD2 3.34Å; D427-Y433 PolarHBondContact OD1-N 3.32Å; Y431-Y433 HydrophobicContact CD2-CE1 4.25Å; Y431-Y433 AromaticContact CD2-CZ 3.96Å; Y431-Y433 WeakPolarHBondContact O-CD2 3.35Å; Y431-Y433 WeakPolarHBondContact O-CE2 3.34Å
434	V	95.8	Very high	91	Very high	33 Å²	33	65 Å²	65	20%	0.2	32%	0.32	C	S	.	.			trans	-112.4	156.3	-171.3	-63.4	0	0	0	0	112	H416 T417 T418 H432 T438 F439	H416-V434 HydrophobicContact CB-CG2 4.3Å; T417-V434 PolarHBondContact O-N 2.99Å; T418-V434 WeakPolarHBondContact CA-O 3.42Å; H432-V434 HydrophobicContact CB-CG1 4.41Å; H432-V434 PolarHBondContact O-N 3.47Å; V434-T438 HydrophobicContact CB-CG2 4.09Å; V434-T438 HydrophobicContact CG1-CG2 4.31Å; V434-F439 HydrophobicContact CG2-CB 4.02Å; V434-F439 HydrophobicContact CG2-CD2 3.87Å; V434-F439 HydrophobicContact CG2-CG 4.45Å
435	S	96.4	Very high	91	Very high	52 Å²	52	62.4 Å²	62.4	36%	0.364	32%	0.322	S	S	.	.			trans	-66.5	161.3	172.5	91	0	0	0	0	111.1	E437 T438 F439	S435-E437 VanDerWaalsContact C-N 3.33Å; S435-E437 WeakPolarHBondContact CB-OE2 3.46Å; S435-E437 PolarHBondContact O-N 2.97Å; S435-E437 PolarHBondContact OG-N 3.16Å; S435-E437 PolarHBondContact OG-OE2 2.97Å; S435-T438 PolarHBondContact O-N 2.93Å; S435-T438 PolarHBondContact OG-N 2.92Å; S435-T438 VanDerWaalsContact OG-N 3.12Å; S435-T438 PolarHBondContact OG-OG1 2.75Å; S435-F439 PolarHBondContact O-N 2.95Å
436	R	94.7	Very high	90.8	Very high	124 Å²	124	66.2 Å²	66.2	47%	0.468	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-40.5	178.6	-176.6	172.8	176.1	129.7	13	111.7	T418 T438 F439 E440 L458	T418-R436 HydrophobicContact CG2-CB 4.33Å; R436-T438 VanDerWaalsContact C-N 3.32Å; R436-T438 PolarHBondContact O-N 2.84Å; R436-F439 PolarHBondContact O-N 2.86Å; R436-E440 HydrophobicContact CG-CG 4.36Å; R436-E440 IonicContact CZ-OE1 2.78Å; R436-E440 VanDerWaalsContact CZ-OE1 3.26Å; R436-E440 IonicContact NE-OE1 3.36Å; R436-E440 PolarHBondContact NE-OE1 2.88Å; R436-E440 IonicContact NH2-OE1 2.82Å; R436-E440 PolarHBondContact NH2-OE1 3.31Å; R436-E440 WeakPolarHBondContact O-CB 3.27Å; R436-E440 WeakPolarHBondContact O-CG 3.37Å; R436-E440 PolarHBondContact O-N 2.83Å; R436-L458 HydrophobicContact CG-CD1 4.47Å
437	E	96.1	Very high	90.8	Very high	134 Å²	134	65.9 Å²	65.9	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-63.2	-39.8	177.1	-48.7	74	-161.4	0	0	110.9	S435 S441	S435-E437 VanDerWaalsContact C-N 3.33Å; S435-E437 WeakPolarHBondContact CB-OE2 3.46Å; S435-E437 PolarHBondContact O-N 2.97Å; S435-E437 PolarHBondContact OG-N 3.16Å; S435-E437 PolarHBondContact OG-OE2 2.97Å; E437-S441 VanDerWaalsContact O-CB 3.29Å; E437-S441 WeakPolarHBondContact O-CB 3.5Å; E437-S441 PolarHBondContact O-N 3.44Å
438	T	94.9	Very high	90.8	Very high	67 Å²	67	61.7 Å²	61.7	41%	0.411	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-44.3	175.9	-53.3	0	0	0	0	110.9	V434 S435 R436 S441 L442	V434-T438 HydrophobicContact CB-CG2 4.09Å; V434-T438 HydrophobicContact CG1-CG2 4.31Å; S435-T438 PolarHBondContact O-N 2.93Å; S435-T438 PolarHBondContact OG-N 2.92Å; S435-T438 VanDerWaalsContact OG-N 3.12Å; S435-T438 PolarHBondContact OG-OG1 2.75Å; R436-T438 VanDerWaalsContact C-N 3.32Å; R436-T438 PolarHBondContact O-N 2.84Å; T438-S441 PolarHBondContact O-N 2.95Å; T438-L442 WeakPolarHBondContact O-CG 3.3Å; T438-L442 PolarHBondContact O-N 2.91Å; T438-L442 VanDerWaalsContact O-N 3.1Å
439	F	94.9	Very high	91	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-46.3	177.8	-163.9	-74.3	0	0	0	111.6	H416 T418 V434 S435 R436 S441 L442 M443 M448 L458 Y459	H416-F439 HydrophobicContact CB-CD2 4.15Å; H416-F439 HydrophobicContact CB-CE2 3.92Å; T418-F439 HydrophobicContact CG2-CB 3.57Å; T418-F439 HydrophobicContact CG2-CD2 4Å; T418-F439 HydrophobicContact CG2-CG 3.87Å; V434-F439 HydrophobicContact CG2-CB 4.02Å; V434-F439 HydrophobicContact CG2-CD2 3.87Å; V434-F439 HydrophobicContact CG2-CG 4.45Å; S435-F439 PolarHBondContact O-N 2.95Å; R436-F439 PolarHBondContact O-N 2.86Å; F439-S441 VanDerWaalsContact C-N 3.32Å; F439-S441 PolarHBondContact O-N 3.21Å; F439-L442 PolarHBondContact O-N 2.91Å; F439-M443 HydrophobicContact CD1-CG 4Å; F439-M443 HydrophobicContact CD1-SD 3.6Å; F439-M443 HydrophobicContact CE1-CG 3.87Å; F439-M443 HydrophobicContact CE1-SD 3.54Å; F439-M443 VanDerWaalsContact CE1-SD 3.54Å; F439-M443 WeakPolarHBondContact O-CG 3.37Å; F439-M443 PolarHBondContact O-N 2.7Å; F439-M448 HydrophobicContact CE1-CE 4.21Å; F439-M448 HydrophobicContact CE2-CE 3.96Å; F439-M448 HydrophobicContact CZ-CE 3.58Å; F439-L458 HydrophobicContact CD1-CB 3.79Å; F439-L458 HydrophobicContact CD1-CD1 3.61Å; F439-L458 HydrophobicContact CD1-CG 4.32Å; F439-L458 HydrophobicContact CD2-CB 4.34Å; F439-L458 HydrophobicContact CE1-CB 3.74Å; F439-L458 HydrophobicContact CE1-CD1 4.14Å; F439-L458 HydrophobicContact CE1-CG 4.48Å; F439-L458 HydrophobicContact CE2-CB 4.29Å; F439-L458 HydrophobicContact CG-CB 4.12Å; F439-L458 HydrophobicContact CG-CD1 4.23Å; F439-L458 HydrophobicContact CZ-CB 4.01Å; F439-Y459 WeakPolarHBondContact CZ-O 3.46Å
440	E	92.8	Very high	91.2	Very high	51 Å²	51	56.6 Å²	56.6	24%	0.238	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-36.3	177.2	-72.6	173.4	173.8	0	0	111.2	R436 L442 M443 Y444 L458	R436-E440 HydrophobicContact CG-CG 4.36Å; R436-E440 IonicContact CZ-OE1 2.78Å; R436-E440 VanDerWaalsContact CZ-OE1 3.26Å; R436-E440 IonicContact NE-OE1 3.36Å; R436-E440 PolarHBondContact NE-OE1 2.88Å; R436-E440 IonicContact NH2-OE1 2.82Å; R436-E440 PolarHBondContact NH2-OE1 3.31Å; R436-E440 WeakPolarHBondContact O-CB 3.27Å; R436-E440 WeakPolarHBondContact O-CG 3.37Å; R436-E440 PolarHBondContact O-N 2.83Å; E440-L442 PolarHBondContact O-N 3.09Å; E440-M443 WeakPolarHBondContact O-CB 3.44Å; E440-M443 PolarHBondContact O-N 2.74Å; E440-Y444 HydrophobicContact CB-CD2 4.39Å; E440-Y444 HydrophobicContact CB-CE2 4.09Å; E440-Y444 WeakPolarHBondContact O-CD2 3.4Å; E440-Y444 PolarHBondContact O-N 3.38Å; E440-L458 HydrophobicContact CG-CD1 4.22Å
441	S	94.3	Very high	91.4	Very high	80 Å²	80	60.8 Å²	60.8	56%	0.559	30%	0.3	S	S	*	.	H	α-helix	trans	-60.9	-41.7	171.6	-175.9	0	0	0	0	112.9	E437 T438 F439 M443 G445	E437-S441 VanDerWaalsContact O-CB 3.29Å; E437-S441 WeakPolarHBondContact O-CB 3.5Å; E437-S441 PolarHBondContact O-N 3.44Å; T438-S441 PolarHBondContact O-N 2.95Å; F439-S441 VanDerWaalsContact C-N 3.32Å; F439-S441 PolarHBondContact O-N 3.21Å; S441-M443 VanDerWaalsContact C-N 3.34Å; S441-G445 PolarHBondContact O-N 3.36Å
442	L	90.6	Very high	91.1	Very high	36 Å²	36	61.2 Å²	61.2	19%	0.188	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-37.3	174.2	-68.5	171.6	0	0	0	112.2	T438 F439 E440 H446 K447 M448	T438-L442 WeakPolarHBondContact O-CG 3.3Å; T438-L442 PolarHBondContact O-N 2.91Å; T438-L442 VanDerWaalsContact O-N 3.1Å; F439-L442 PolarHBondContact O-N 2.91Å; E440-L442 PolarHBondContact O-N 3.09Å; L442-H446 PolarHBondContact O-N 3.47Å; L442-K447 HydrophobicContact CD2-CB 4.27Å; L442-K447 HydrophobicContact CD2-CD 4.5Å; L442-K447 PolarHBondContact O-N 2.73Å; L442-M448 HydrophobicContact CB-CG 3.99Å; L442-M448 HydrophobicContact CB-SD 3.8Å; L442-M448 HydrophobicContact CD1-SD 4.22Å
443	M	87.5	Confident	90.7	Very high	45 Å²	45	62 Å²	62	22%	0.222	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-54.3	174.2	-69.5	172.8	51.7	0	0	111.7	F439 E440 S441 G445 H446 M448 Y451 L458	F439-M443 HydrophobicContact CD1-CG 4Å; F439-M443 HydrophobicContact CD1-SD 3.6Å; F439-M443 HydrophobicContact CE1-CG 3.87Å; F439-M443 HydrophobicContact CE1-SD 3.54Å; F439-M443 VanDerWaalsContact CE1-SD 3.54Å; F439-M443 WeakPolarHBondContact O-CG 3.37Å; F439-M443 PolarHBondContact O-N 2.7Å; E440-M443 WeakPolarHBondContact O-CB 3.44Å; E440-M443 PolarHBondContact O-N 2.74Å; S441-M443 VanDerWaalsContact C-N 3.34Å; M443-G445 VanDerWaalsContact C-N 3.26Å; M443-G445 PolarHBondContact O-N 3.48Å; M443-H446 WeakPolarHBondContact O-CA 3.09Å; M443-H446 PolarHBondContact O-N 2.57Å; M443-M448 HydrophobicContact CG-CG 4.1Å; M443-Y451 HydrophobicContact CE-CD2 3.75Å; M443-Y451 HydrophobicContact CE-CE1 4.42Å; M443-Y451 HydrophobicContact CE-CE2 3.38Å; M443-Y451 HydrophobicContact CE-CG 4.43Å; M443-Y451 HydrophobicContact CG-CD1 4.23Å; M443-Y451 HydrophobicContact CG-CD2 4.45Å; M443-Y451 HydrophobicContact CG-CE1 4.43Å; M443-Y451 HydrophobicContact CG-CG 4.23Å; M443-Y451 HydrophobicContact SD-CD2 4.01Å; M443-Y451 HydrophobicContact SD-CE2 4.25Å; M443-Y451 HydrophobicContact SD-CG 4.32Å; M443-L458 HydrophobicContact SD-CD1 4.42Å
444	Y	88.3	Confident	90.1	Very high	181 Å²	181	62.1 Å²	62.1	71%	0.71	31%	0.31	S	S	*	.	H	α-helix	trans	-63	-32.7	179.5	-68	-57.3	0	0	0	112.6	E440 H446	E440-Y444 HydrophobicContact CB-CD2 4.39Å; E440-Y444 HydrophobicContact CB-CE2 4.09Å; E440-Y444 WeakPolarHBondContact O-CD2 3.4Å; E440-Y444 PolarHBondContact O-N 3.38Å; Y444-H446 PolarHBondContact O-N 2.9Å; Y444-H446 PolarHBondContact O-ND1 3.42Å
445	G	86.5	Confident	89.6	Confident	42 Å²	42	66.7 Å²	66.7	43%	0.433	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	0.1	171.9	0	0	0	0	0	115.1	S441 M443 K447	S441-G445 PolarHBondContact O-N 3.36Å; M443-G445 VanDerWaalsContact C-N 3.26Å; M443-G445 PolarHBondContact O-N 3.48Å; G445-K447 WeakPolarHBondContact O-CG 3.35Å; G445-K447 PolarHBondContact O-N 3.33Å
446	H	83.2	Confident	89.1	Confident	96 Å²	96	66.3 Å²	66.3	44%	0.444	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	30.4	-175.5	-59	58.4	0	0	0	113.2	L442 M443 Y444	L442-H446 PolarHBondContact O-N 3.47Å; M443-H446 WeakPolarHBondContact O-CA 3.09Å; M443-H446 PolarHBondContact O-N 2.57Å; Y444-H446 PolarHBondContact O-N 2.9Å; Y444-H446 PolarHBondContact O-ND1 3.42Å
447	K	87.8	Confident	88.9	Confident	108 Å²	108	63.3 Å²	63.3	47%	0.47	32%	0.323	S	S	.	.			trans	-96	7.2	-177.7	-60	-171.3	179.1	179.3	0	113.7	L442 G445 S462 V463	L442-K447 HydrophobicContact CD2-CB 4.27Å; L442-K447 HydrophobicContact CD2-CD 4.5Å; L442-K447 PolarHBondContact O-N 2.73Å; G445-K447 WeakPolarHBondContact O-CG 3.35Å; G445-K447 PolarHBondContact O-N 3.33Å; K447-S462 CarbonylContact O-C 3.51Å; K447-S462 VanDerWaalsContact O-CA 3.22Å; K447-S462 WeakPolarHBondContact O-CA 3.49Å; K447-S462 WeakPolarHBondContact O-CB 3.45Å; K447-V463 PolarHBondContact O-N 2.88Å
448	M	89.6	Confident	88.7	Confident	16 Å²	16	57.7 Å²	57.7	8%	0.079	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126	178.7	-61.1	-61.2	-69.9	0	0	109.7	F439 L442 M443 Y451 G460	F439-M448 HydrophobicContact CE1-CE 4.21Å; F439-M448 HydrophobicContact CE2-CE 3.96Å; F439-M448 HydrophobicContact CZ-CE 3.58Å; L442-M448 HydrophobicContact CB-CG 3.99Å; L442-M448 HydrophobicContact CB-SD 3.8Å; L442-M448 HydrophobicContact CD1-SD 4.22Å; M443-M448 HydrophobicContact CG-CG 4.1Å; M448-Y451 HydrophobicContact CB-CD1 3.89Å; M448-G460 VanDerWaalsContact CE-C 3.41Å
449	L	88.4	Confident	88.5	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-43.2	174.2	-73.3	172	0	0	0	111.2	T461 V463 V466 M478 S487 A488 L493	L449-T461 PolarHBondContact N-O 3.08Å; L449-V463 HydrophobicContact CD2-CG2 3.82Å; L449-V463 HydrophobicContact CG-CG2 3.76Å; L449-V466 HydrophobicContact CD1-CB 4.42Å; L449-V466 HydrophobicContact CD1-CG2 3.6Å; L449-M478 HydrophobicContact CD1-CE 4.27Å; L449-M478 HydrophobicContact CD1-SD 4.06Å; L449-S487 WeakPolarHBondContact CD2-O 3.46Å; L449-A488 HydrophobicContact CD2-CB 4.23Å; L449-L493 HydrophobicContact CD1-CD1 4.16Å; L449-L493 HydrophobicContact CD2-CD1 3.96Å
450	E	88.6	Confident	88.3	Confident	7 Å²	7	54.9 Å²	54.9	3%	0.033	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.8	173.4	52.8	155	-168.2	0	0	109.7	M338 R342 G460 T461 L480 D484	M338-E450 WeakPolarHBondContact CB-OE2 3.37Å; M338-E450 VanDerWaalsContact CG-CD 3.46Å; M338-E450 HydrophobicContact CG-CG 4.45Å; M338-E450 WeakPolarHBondContact CG-OE1 3.08Å; M338-E450 WeakPolarHBondContact CG-OE2 3.42Å; R342-E450 IonicContact CZ-OE2 2.73Å; R342-E450 IonicContact NH2-OE2 3.1Å; R342-E450 PolarHBondContact NH2-OE2 2.93Å; E450-G460 CarbonylContact O-C 3.51Å; E450-G460 WeakPolarHBondContact O-CA 3.48Å; E450-T461 PolarHBondContact O-N 3.32Å; E450-T461 PolarHBondContact OE1-OG1 3.32Å; E450-L480 HydrophobicContact CB-CD2 3.99Å; E450-L480 HydrophobicContact CG-CD2 3.65Å; E450-D484 HydrophobicContact CB-CB 4.34Å
451	Y	88.4	Confident	88.3	Confident	96 Å²	96	52.8 Å²	52.8	38%	0.376	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	163.6	171.5	61.9	-92.7	0	0	0	111.5	M443 M448 Y459	M443-Y451 HydrophobicContact CE-CD2 3.75Å; M443-Y451 HydrophobicContact CE-CE1 4.42Å; M443-Y451 HydrophobicContact CE-CE2 3.38Å; M443-Y451 HydrophobicContact CE-CG 4.43Å; M443-Y451 HydrophobicContact CG-CD1 4.23Å; M443-Y451 HydrophobicContact CG-CD2 4.45Å; M443-Y451 HydrophobicContact CG-CE1 4.43Å; M443-Y451 HydrophobicContact CG-CG 4.23Å; M443-Y451 HydrophobicContact SD-CD2 4.01Å; M443-Y451 HydrophobicContact SD-CE2 4.25Å; M443-Y451 HydrophobicContact SD-CG 4.32Å; M448-Y451 HydrophobicContact CB-CD1 3.89Å; Y451-Y459 CarbonylContact C-O 3.51Å; Y451-Y459 VanDerWaalsContact CA-O 3.26Å; Y451-Y459 WeakPolarHBondContact CA-O 3.47Å
452	G	86.3	Confident	88.2	Confident	13 Å²	13	49.1 Å²	49.1	13%	0.134	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	163	-179.9	0	0	0	0	0	112.8	Y459	G452-Y459 PolarHBondContact N-O 3.02Å; G452-Y459 PolarHBondContact O-N 3.19Å; G452-Y459 VanDerWaalsContact O-O 3.11Å
453	E	85.7	Confident	88.3	Confident	77 Å²	77	49.1 Å²	49.1	36%	0.36	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139	-178.2	-162.6	-168.2	136.1	0	0	111.6	C341 G456 H457 L458	C341-E453 WeakPolarHBondContact CA-O 3.38Å; C341-E453 WeakPolarHBondContact CB-O 3.36Å; E453-G456 WeakPolarHBondContact OE1-CA 3.43Å; E453-H457 CarbonylContact C-O 3.53Å; E453-H457 WeakPolarHBondContact CA-O 3.26Å; E453-L458 HydrophobicContact CB-CD2 4.15Å; E453-L458 HydrophobicContact CG-CD2 4.19Å
454	Y	81.3	Confident	88.6	Confident	43 Å²	43	51.8 Å²	51.8	17%	0.169	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	125.3	170.1	-175.7	-107.9	0	0	0	111.7	L340 C341 G456 H457	L340-Y454 HydrophobicContact CB-CD2 4.42Å; L340-Y454 HydrophobicContact CB-CE2 4.14Å; L340-Y454 WeakPolarHBondContact O-CD2 3.43Å; L340-Y454 VanDerWaalsContact O-CE2 3.31Å; L340-Y454 WeakPolarHBondContact O-CE2 3.33Å; C341-Y454 WeakPolarHBondContact SG-CB 3.37Å; Y454-G456 VanDerWaalsContact C-N 3.25Å; Y454-G456 PolarHBondContact O-N 3.39Å; Y454-H457 PolarHBondContact N-O 3.25Å; Y454-H457 PolarHBondContact O-N 2.67Å; Y454-H457 VanDerWaalsContact O-N 3.1Å
455	K	85.7	Confident	89	Confident	128 Å²	128	43.5 Å²	43.5	56%	0.557	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	42	-179.5	-64.6	-172.3	173.2	-168.8	0	112.9	H457 Y521	K455-H457 VanDerWaalsContact C-N 3.33Å; K455-H457 PolarHBondContact O-CD2 3.26Å; K455-H457 PolarHBondContact O-N 3.24Å; K455-Y521 PolarHBondContact NZ-OH 2.92Å
456	G	86.2	Confident	89.4	Confident	45 Å²	45	41.5 Å²	41.5	46%	0.464	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	0.8	178.5	0	0	0	0	0	115.6	E453 Y454	E453-G456 WeakPolarHBondContact OE1-CA 3.43Å; Y454-G456 VanDerWaalsContact C-N 3.25Å; Y454-G456 PolarHBondContact O-N 3.39Å
457	H	90.8	Very high	90	Very high	61 Å²	61	38.6 Å²	38.6	28%	0.282	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.4	177.8	-59.8	-73.6	0	0	0	111.1	T418 R419 E453 Y454 K455 Y459	T418-H457 PolarHBondContact O-ND1 3.19Å; R419-H457 WeakPolarHBondContact CA-ND1 3.25Å; R419-H457 HydrophobicContact CB-CB 4Å; E453-H457 CarbonylContact C-O 3.53Å; E453-H457 WeakPolarHBondContact CA-O 3.26Å; Y454-H457 PolarHBondContact N-O 3.25Å; Y454-H457 PolarHBondContact O-N 2.67Å; Y454-H457 VanDerWaalsContact O-N 3.1Å; K455-H457 VanDerWaalsContact C-N 3.33Å; K455-H457 PolarHBondContact O-CD2 3.26Å; K455-H457 PolarHBondContact O-N 3.24Å; H457-Y459 HydrophobicContact CB-CE2 3.8Å; H457-Y459 VanDerWaalsContact O-CD2 3.28Å; H457-Y459 WeakPolarHBondContact O-CD2 3.49Å; H457-Y459 WeakPolarHBondContact O-CE2 3.3Å
458	L	90.4	Very high	90.3	Very high	16 Å²	16	35.8 Å²	35.8	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.6	169.2	-54.7	175.6	0	0	0	110.8	T417 T418 R436 F439 E440 M443 E453	T417-L458 WeakPolarHBondContact CA-O 3.48Å; T417-L458 PolarHBondContact OG1-O 3.26Å; T417-L458 VanDerWaalsContact OG1-O 3.09Å; T418-L458 HydrophobicContact CG2-CB 4Å; T418-L458 HydrophobicContact CG2-CD1 4.45Å; T418-L458 PolarHBondContact N-O 2.98Å; T418-L458 PolarHBondContact OG1-N 3.26Å; T418-L458 PolarHBondContact OG1-O 3.12Å; R436-L458 HydrophobicContact CG-CD1 4.47Å; F439-L458 HydrophobicContact CD1-CB 3.79Å; F439-L458 HydrophobicContact CD1-CD1 3.61Å; F439-L458 HydrophobicContact CD1-CG 4.32Å; F439-L458 HydrophobicContact CD2-CB 4.34Å; F439-L458 HydrophobicContact CE1-CB 3.74Å; F439-L458 HydrophobicContact CE1-CD1 4.14Å; F439-L458 HydrophobicContact CE1-CG 4.48Å; F439-L458 HydrophobicContact CE2-CB 4.29Å; F439-L458 HydrophobicContact CG-CB 4.12Å; F439-L458 HydrophobicContact CG-CD1 4.23Å; F439-L458 HydrophobicContact CZ-CB 4.01Å; E440-L458 HydrophobicContact CG-CD1 4.22Å; M443-L458 HydrophobicContact SD-CD1 4.42Å; E453-L458 HydrophobicContact CB-CD2 4.15Å; E453-L458 HydrophobicContact CG-CD2 4.19Å
459	Y	90.8	Very high	90.6	Very high	8 Å²	8	35.2 Å²	35.2	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	155.3	171.2	-61.5	-105	0	0	0	108.4	M338 H416 T417 R419 Y431 F439 Y451 G452 H457	M338-Y459 WeakPolarHBondContact CE-O 3.39Å; M338-Y459 VanDerWaalsContact SD-C 3.59Å; M338-Y459 WeakPolarHBondContact SD-CB 3.5Å; H416-Y459 VanDerWaalsContact O-CA 3.31Å; H416-Y459 WeakPolarHBondContact O-CA 3.43Å; T417-Y459 HydrophobicContact CG2-CE1 4.48Å; T417-Y459 WeakPolarHBondContact OG1-CD1 3.43Å; T417-Y459 WeakPolarHBondContact OG1-CE1 3.38Å; R419-Y459 WeakPolarHBondContact CD-OH 3.48Å; R419-Y459 PolarHBondContact NE-OH 3.5Å; Y431-Y459 HydrophobicContact CD1-CD1 4.25Å; Y431-Y459 AromaticContact CE1-CD1 3.75Å; Y431-Y459 HydrophobicContact CE1-CD1 3.75Å; Y431-Y459 HydrophobicContact CE1-CE1 4.08Å; F439-Y459 WeakPolarHBondContact CZ-O 3.46Å; Y451-Y459 CarbonylContact C-O 3.51Å; Y451-Y459 VanDerWaalsContact CA-O 3.26Å; Y451-Y459 WeakPolarHBondContact CA-O 3.47Å; G452-Y459 PolarHBondContact N-O 3.02Å; G452-Y459 PolarHBondContact O-N 3.19Å; G452-Y459 VanDerWaalsContact O-O 3.11Å; H457-Y459 HydrophobicContact CB-CE2 3.8Å; H457-Y459 VanDerWaalsContact O-CD2 3.28Å; H457-Y459 WeakPolarHBondContact O-CD2 3.49Å; H457-Y459 WeakPolarHBondContact O-CE2 3.3Å
460	G	90.4	Very high	90.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.3	170.7	173.7	0	0	0	0	0	112.4	P415 H416 M448 E450	P415-G460 CarbonylContact C-O 3.59Å; P415-G460 WeakPolarHBondContact CA-O 3.46Å; H416-G460 PolarHBondContact N-O 3.21Å; H416-G460 PolarHBondContact O-N 2.86Å; H416-G460 VanDerWaalsContact O-N 3.1Å; M448-G460 VanDerWaalsContact CE-C 3.41Å; E450-G460 CarbonylContact O-C 3.51Å; E450-G460 WeakPolarHBondContact O-CA 3.48Å
461	T	92.9	Very high	91.2	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.043	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.3	-179.8	-42.3	0	0	0	0	110.8	A413 L449 E450 A465 M478	A413-T461 HydrophobicContact CB-CG2 3.79Å; L449-T461 PolarHBondContact N-O 3.08Å; E450-T461 PolarHBondContact O-N 3.32Å; E450-T461 PolarHBondContact OE1-OG1 3.32Å; T461-A465 HydrophobicContact CG2-CB 4.15Å; T461-M478 HydrophobicContact CG2-CE 3.32Å
462	S	93.7	Very high	91.5	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	154.2	179.9	66	0	0	0	0	112.1	H416 K447 N464 A465 V466	H416-S462 PolarHBondContact CE1-OG 2.99Å; H416-S462 PolarHBondContact NE2-OG 3.38Å; K447-S462 CarbonylContact O-C 3.51Å; K447-S462 VanDerWaalsContact O-CA 3.22Å; K447-S462 WeakPolarHBondContact O-CA 3.49Å; K447-S462 WeakPolarHBondContact O-CB 3.45Å; S462-N464 PolarHBondContact O-N 3.12Å; S462-A465 WeakPolarHBondContact O-CB 3.44Å; S462-A465 PolarHBondContact O-N 3.3Å; S462-A465 VanDerWaalsContact O-N 3.13Å; S462-A465 WeakPolarHBondContact OG-CB 3.43Å; S462-A465 PolarHBondContact OG-N 2.94Å; S462-V466 PolarHBondContact O-N 3.22Å
463	V	92.8	Very high	91.9	Very high	35 Å²	35	41.4 Å²	41.4	21%	0.212	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-40.7	173.9	-178.7	0	0	0	0	110.1	K447 L449 A465 V466 H467	K447-V463 PolarHBondContact O-N 2.88Å; L449-V463 HydrophobicContact CD2-CG2 3.82Å; L449-V463 HydrophobicContact CG-CG2 3.76Å; V463-A465 VanDerWaalsContact C-N 3.34Å; V463-A465 PolarHBondContact O-N 3.24Å; V463-V466 WeakPolarHBondContact O-CB 3.37Å; V463-V466 PolarHBondContact O-N 2.92Å; V463-V466 VanDerWaalsContact O-N 3.12Å; V463-H467 WeakPolarHBondContact CG1-NE2 3.47Å; V463-H467 PolarHBondContact O-CD2 2.81Å; V463-H467 PolarHBondContact O-N 3.43Å
464	N	94	Very high	92.4	Very high	101 Å²	101	39.9 Å²	39.9	54%	0.54	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-35.9	177	-68.7	11.1	0	0	0	113.2	S462 V466 H467 A468	S462-N464 PolarHBondContact O-N 3.12Å; N464-V466 VanDerWaalsContact C-N 3.25Å; N464-V466 PolarHBondContact O-N 3.41Å; N464-H467 PolarHBondContact O-N 2.85Å; N464-A468 PolarHBondContact O-N 2.98Å
465	A	94.7	Very high	93.1	Very high	7 Å²	7	38.3 Å²	38.3	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-67.5	-27.6	176.7	0	0	0	0	0	112.5	A413 V414 T461 S462 V463	A413-A465 HydrophobicContact CB-CB 4.23Å; A413-A465 WeakPolarHBondContact CB-O 3.43Å; V414-A465 WeakPolarHBondContact O-CB 3.47Å; T461-A465 HydrophobicContact CG2-CB 4.15Å; S462-A465 WeakPolarHBondContact O-CB 3.44Å; S462-A465 PolarHBondContact O-N 3.3Å; S462-A465 VanDerWaalsContact O-N 3.13Å; S462-A465 WeakPolarHBondContact OG-CB 3.43Å; S462-A465 PolarHBondContact OG-N 2.94Å; V463-A465 VanDerWaalsContact C-N 3.34Å; V463-A465 PolarHBondContact O-N 3.24Å
466	V	95.3	Very high	93.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-74.7	-46.8	170.3	175.5	0	0	0	0	110.6	L384 A413 L449 S462 V463 N464 A468 V469 L470 C476 M478 L493	L384-V466 HydrophobicContact CD1-CG1 3.87Å; L384-V466 HydrophobicContact CD2-CG1 4.3Å; A413-V466 HydrophobicContact CB-CG2 3.83Å; L449-V466 HydrophobicContact CD1-CB 4.42Å; L449-V466 HydrophobicContact CD1-CG2 3.6Å; S462-V466 PolarHBondContact O-N 3.22Å; V463-V466 WeakPolarHBondContact O-CB 3.37Å; V463-V466 PolarHBondContact O-N 2.92Å; V463-V466 VanDerWaalsContact O-N 3.12Å; N464-V466 VanDerWaalsContact C-N 3.25Å; N464-V466 PolarHBondContact O-N 3.41Å; V466-A468 VanDerWaalsContact C-N 3.31Å; V466-A468 PolarHBondContact O-N 2.82Å; V466-V469 PolarHBondContact O-N 2.83Å; V466-V469 VanDerWaalsContact O-N 3.09Å; V466-L470 HydrophobicContact CG1-CD1 4Å; V466-L470 HydrophobicContact CG1-CG 4.3Å; V466-L470 PolarHBondContact O-N 2.77Å; V466-C476 HydrophobicContact CG1-CB 4.31Å; V466-M478 HydrophobicContact CG2-CE 3.38Å; V466-M478 HydrophobicContact CG2-SD 4.25Å; V466-L493 HydrophobicContact CB-CD2 4.35Å; V466-L493 HydrophobicContact CG1-CD2 3.6Å
467	H	95.6	Very high	94.1	Very high	35 Å²	35	30.1 Å²	30.1	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-41.6	177.6	-73.5	-49.5	0	0	0	112.8	V463 N464 V469 L470 D471	V463-H467 WeakPolarHBondContact CG1-NE2 3.47Å; V463-H467 PolarHBondContact O-CD2 2.81Å; V463-H467 PolarHBondContact O-N 3.43Å; N464-H467 PolarHBondContact O-N 2.85Å; H467-V469 PolarHBondContact O-N 3.23Å; H467-V469 VanDerWaalsContact O-N 3.16Å; H467-L470 CarbonylContact O-C 3.46Å; H467-L470 PolarHBondContact O-N 2.84Å; H467-D471 VanDerWaalsContact O-CB 3.29Å; H467-D471 WeakPolarHBondContact O-CB 3.48Å; H467-D471 PolarHBondContact O-N 3.27Å
468	A	95.3	Very high	94.2	Very high	50 Å²	50	27.5 Å²	27.5	41%	0.413	16%	0.16	S	C	.	.	H	α-helix	trans	-51.7	-41	175.7	0	0	0	0	0	113	N464 V466 E472	N464-A468 PolarHBondContact O-N 2.98Å; V466-A468 VanDerWaalsContact C-N 3.31Å; V466-A468 PolarHBondContact O-N 2.82Å; A468-E472 WeakPolarHBondContact O-CG 3.26Å; A468-E472 PolarHBondContact O-N 3.42Å
469	V	95.6	Very high	94.2	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.024	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-38.8	177.6	-178.4	0	0	0	0	112.3	Q411 V466 H467 K474 C476	Q411-V469 HydrophobicContact CB-CG1 3.72Å; Q411-V469 HydrophobicContact CG-CG1 3.98Å; Q411-V469 HydrophobicContact CG-CG2 4.06Å; V466-V469 PolarHBondContact O-N 2.83Å; V466-V469 VanDerWaalsContact O-N 3.09Å; H467-V469 PolarHBondContact O-N 3.23Å; H467-V469 VanDerWaalsContact O-N 3.16Å; V469-K474 HydrophobicContact CG1-CB 4Å; V469-K474 PolarHBondContact O-N 2.86Å; V469-C476 HydrophobicContact CB-CB 3.99Å; V469-C476 HydrophobicContact CG1-CB 3.74Å
470	L	95.1	Very high	94.1	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-71.7	-32.6	179	-61.2	-177.7	0	0	0	112.1	K381 H382 V466 H467 G473 C476 L493	K381-L470 HydrophobicContact CB-CB 4.49Å; K381-L470 HydrophobicContact CD-CB 4.45Å; H382-L470 HydrophobicContact CB-CD2 4.34Å; H382-L470 WeakPolarHBondContact O-CD2 3.16Å; V466-L470 HydrophobicContact CG1-CD1 4Å; V466-L470 HydrophobicContact CG1-CG 4.3Å; V466-L470 PolarHBondContact O-N 2.77Å; H467-L470 CarbonylContact O-C 3.46Å; H467-L470 PolarHBondContact O-N 2.84Å; L470-G473 WeakPolarHBondContact O-CA 3.11Å; L470-G473 PolarHBondContact O-N 3.19Å; L470-C476 HydrophobicContact CD2-CB 3.63Å; L470-C476 HydrophobicContact CG-CB 4.19Å; L470-L493 HydrophobicContact CD1-CD2 4.06Å
471	D	95.4	Very high	93.7	Very high	95 Å²	95	28.1 Å²	28.1	51%	0.508	16%	0.163	S	C	.	.	H	α-helix	trans	-74.3	-28.9	177.8	-65.5	-15.4	0	0	0	111.9	K381 H467 G473	K381-D471 WeakPolarHBondContact CD-OD1 3.19Å; K381-D471 WeakPolarHBondContact CE-OD1 3.33Å; K381-D471 IonicContact NZ-OD1 2.85Å; K381-D471 PolarHBondContact NZ-OD1 3.27Å; H467-D471 VanDerWaalsContact O-CB 3.29Å; H467-D471 WeakPolarHBondContact O-CB 3.48Å; H467-D471 PolarHBondContact O-N 3.27Å; D471-G473 PolarHBondContact O-N 3.1Å
472	E	94.9	Very high	93.3	Very high	108 Å²	108	28 Å²	28	51%	0.505	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-2.1	164.6	-75.7	177.2	-148.5	0	0	113.3	Q411 A468 K474	Q411-E472 PolarHBondContact NE2-OE2 3.09Å; A468-E472 WeakPolarHBondContact O-CG 3.26Å; A468-E472 PolarHBondContact O-N 3.42Å; E472-K474 VanDerWaalsContact C-N 3.28Å; E472-K474 HydrophobicContact CB-CD 4.37Å; E472-K474 HydrophobicContact CB-CG 4.46Å; E472-K474 PolarHBondContact O-N 2.85Å; E472-K474 WeakPolarHBondContact OE2-CE 3.24Å; E472-K474 IonicContact OE2-NZ 2.64Å; E472-K474 PolarHBondContact OE2-NZ 3.08Å
473	G	94.1	Very high	92.7	Very high	45 Å²	45	33.3 Å²	33.3	46%	0.464	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	11.9	-178.4	0	0	0	0	0	114.3	H382 L470 D471	H382-G473 PolarHBondContact CE1-O 3.24Å; H382-G473 PolarHBondContact ND1-O 2.66Å; L470-G473 WeakPolarHBondContact O-CA 3.11Å; L470-G473 PolarHBondContact O-N 3.19Å; D471-G473 PolarHBondContact O-N 3.1Å
474	K	95.5	Very high	92.4	Very high	44 Å²	44	32.4 Å²	32.4	19%	0.191	18%	0.181	C	C	.	.			trans	-92.9	160.6	179.8	-66.3	171.4	-176.1	158.3	0	111.8	Q411 V469 E472 C476	Q411-K474 HydrophobicContact CB-CD 3.97Å; Q411-K474 VanDerWaalsContact OE1-CD 3.31Å; V469-K474 HydrophobicContact CG1-CB 4Å; V469-K474 PolarHBondContact O-N 2.86Å; E472-K474 VanDerWaalsContact C-N 3.28Å; E472-K474 HydrophobicContact CB-CD 4.37Å; E472-K474 HydrophobicContact CB-CG 4.46Å; E472-K474 PolarHBondContact O-N 2.85Å; E472-K474 WeakPolarHBondContact OE2-CE 3.24Å; E472-K474 IonicContact OE2-NZ 2.64Å; E472-K474 PolarHBondContact OE2-NZ 3.08Å; K474-C476 PolarHBondContact O-N 3Å
475	I	96.5	Very high	92.2	Very high	11 Å²	11	27.6 Å²	27.6	6%	0.056	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.3	170.7	-62.5	169.3	0	0	0	108	H382 I385 C409 F410 Q411 I477 I570 Q574	H382-I475 HydrophobicContact CB-CG1 3.9Å; I385-I475 HydrophobicContact CG1-CG2 3.59Å; C409-I475 PolarHBondContact O-N 3Å; F410-I475 HydrophobicContact CD1-CB 3.9Å; F410-I475 HydrophobicContact CD1-CD1 4.26Å; F410-I475 HydrophobicContact CD1-CG2 4.13Å; F410-I475 HydrophobicContact CE1-CB 4.3Å; F410-I475 HydrophobicContact CE1-CD1 3.8Å; F410-I475 HydrophobicContact CE1-CG2 4.41Å; Q411-I475 PolarHBondContact N-O 3.3Å; Q411-I475 VanDerWaalsContact N-O 3.16Å; I475-I477 HydrophobicContact CG2-CG1 4.36Å; I475-I570 HydrophobicContact CD1-CG2 4.05Å; I475-I570 HydrophobicContact CG2-CG2 4.16Å; I475-Q574 HydrophobicContact CD1-CG 3.97Å; I475-Q574 HydrophobicContact CG1-CG 4.42Å
476	C	96.8	Very high	91.7	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	128.7	175.1	-175.5	0	0	0	0	110.8	L384 I385 Q411 V466 V469 L470 K474	L384-C476 HydrophobicContact CD1-CB 3.91Å; I385-C476 PolarHBondContact N-O 2.97Å; Q411-C476 WeakPolarHBondContact O-CA 3.2Å; V466-C476 HydrophobicContact CG1-CB 4.31Å; V469-C476 HydrophobicContact CB-CB 3.99Å; V469-C476 HydrophobicContact CG1-CB 3.74Å; L470-C476 HydrophobicContact CD2-CB 3.63Å; L470-C476 HydrophobicContact CG-CB 4.19Å; K474-C476 PolarHBondContact O-N 3Å
477	I	95.8	Very high	91.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.4	177.3	-47.5	-171	0	0	0	110.5	I385 L387 R399 L402 I403 F410 Q411 I475 I570	I385-I477 HydrophobicContact CB-CG1 4.34Å; I385-I477 HydrophobicContact CG2-CG2 4.3Å; I385-I477 WeakPolarHBondContact O-CA 3.33Å; L387-I477 HydrophobicContact CD1-CG2 3.85Å; L387-I477 HydrophobicContact CG-CG2 4.06Å; R399-I477 WeakPolarHBondContact CD-O 3.31Å; R399-I477 HydrophobicContact CG-CB 4.37Å; R399-I477 HydrophobicContact CG-CG2 3.91Å; L402-I477 HydrophobicContact CD2-CD1 3.31Å; L402-I477 HydrophobicContact CG-CD1 3.92Å; I403-I477 HydrophobicContact CG1-CD1 4.45Å; F410-I477 HydrophobicContact CB-CD1 3.93Å; F410-I477 HydrophobicContact CD1-CD1 3.75Å; F410-I477 HydrophobicContact CD1-CG1 4.47Å; F410-I477 HydrophobicContact CG-CD1 4.01Å; Q411-I477 PolarHBondContact O-N 2.89Å; I475-I477 HydrophobicContact CG2-CG1 4.36Å; I477-I570 HydrophobicContact CD1-CD1 4.12Å
478	M	92.7	Very high	91	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.03	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	155.5	-175	178.7	169.8	-85	0	0	111.2	L384 I385 L387 A413 L449 T461 V466 L480	L384-M478 HydrophobicContact CD1-CB 4.11Å; I385-M478 PolarHBondContact O-N 3.16Å; L387-M478 PolarHBondContact N-O 3.19Å; A413-M478 HydrophobicContact CB-CE 3.99Å; L449-M478 HydrophobicContact CD1-CE 4.27Å; L449-M478 HydrophobicContact CD1-SD 4.06Å; T461-M478 HydrophobicContact CG2-CE 3.32Å; V466-M478 HydrophobicContact CG2-CE 3.38Å; V466-M478 HydrophobicContact CG2-SD 4.25Å; M478-L480 HydrophobicContact CG-CD2 3.95Å; M478-L480 HydrophobicContact CG-CG 4.02Å; M478-L480 HydrophobicContact SD-CD1 4.37Å; M478-L480 HydrophobicContact SD-CD2 3.6Å; M478-L480 VanDerWaalsContact SD-CD2 3.6Å; M478-L480 HydrophobicContact SD-CG 4.01Å
479	D	90.3	Very high	90.8	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.7	172.3	83.8	-74.7	0	0	0	111.5	S337 R339 R342 L387 V395 R399	S337-D479 VanDerWaalsContact CB-OD1 3.27Å; S337-D479 WeakPolarHBondContact CB-OD1 3.12Å; S337-D479 VanDerWaalsContact CB-OD2 3.31Å; S337-D479 WeakPolarHBondContact CB-OD2 3.43Å; R339-D479 IonicContact CZ-OD2 3.4Å; R339-D479 IonicContact NE-OD2 3.08Å; R339-D479 PolarHBondContact NE-OD2 2.86Å; R339-D479 IonicContact NH2-OD2 2.68Å; R339-D479 PolarHBondContact NH2-OD2 3.1Å; R339-D479 VanDerWaalsContact NH2-OD2 3.1Å; R342-D479 PolarHBondContact NH2-O 2.81Å; L387-D479 WeakPolarHBondContact O-CA 3.33Å; V395-D479 HydrophobicContact CG1-CB 3.79Å; R399-D479 IonicContact CZ-OD1 3.16Å; R399-D479 IonicContact NH1-OD1 3.05Å; R399-D479 PolarHBondContact NH1-OD1 3.05Å; R399-D479 IonicContact NH2-OD1 2.63Å; R399-D479 PolarHBondContact NH2-OD1 3.36Å
480	L	88.1	Confident	90.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.171	C	C	.	.			trans	-104.2	161.8	-176.7	-66.9	-179.6	0	0	0	111.4	V386 L387 E450 M478 D484 A488	V386-L480 HydrophobicContact CG1-CB 3.91Å; V386-L480 HydrophobicContact CG1-CD1 3.77Å; V386-L480 HydrophobicContact CG1-CG 3.9Å; V386-L480 HydrophobicContact CG2-CD1 4.22Å; L387-L480 PolarHBondContact O-N 3.31Å; E450-L480 HydrophobicContact CB-CD2 3.99Å; E450-L480 HydrophobicContact CG-CD2 3.65Å; M478-L480 HydrophobicContact CG-CD2 3.95Å; M478-L480 HydrophobicContact CG-CG 4.02Å; M478-L480 HydrophobicContact SD-CD1 4.37Å; M478-L480 HydrophobicContact SD-CD2 3.6Å; M478-L480 VanDerWaalsContact SD-CD2 3.6Å; M478-L480 HydrophobicContact SD-CG 4.01Å; L480-D484 HydrophobicContact CD2-CB 4.44Å; L480-A488 HydrophobicContact CD1-CB 3.83Å
481	E	82.4	Confident	90.3	Very high	33 Å²	33	35 Å²	35	15%	0.154	18%	0.184	C	C	.	.			trans	-76.6	158.5	156.4	-78.5	-56.8	137.4	0	0	110.7	R342 Q483 D484	R342-E481 WeakPolarHBondContact CD-OE1 3.39Å; R342-E481 IonicContact CZ-OE1 3.14Å; R342-E481 IonicContact NE-OE1 3.65Å; R342-E481 PolarHBondContact NE-OE1 3.32Å; R342-E481 IonicContact NH1-OE1 3.73Å; R342-E481 PolarHBondContact NH1-OE1 3.18Å; E481-Q483 HydrophobicContact CB-CG 4.45Å; E481-Q483 PolarHBondContact O-N 3.36Å; E481-D484 PolarHBondContact O-N 3.22Å; E481-D484 VanDerWaalsContact O-N 3.09Å
482	P	84	Confident	90	Very high	6 Å²	6	36 Å²	36	4%	0.039	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-56.7	-34	175.8	-21	30.6	0	0	0	114.5	V388 D484 I485 M542 F546	V388-P482 HydrophobicContact CG1-CB 4.4Å; V388-P482 HydrophobicContact CG1-CG 3.79Å; P482-D484 VanDerWaalsContact C-N 3.3Å; P482-D484 PolarHBondContact O-N 3.37Å; P482-I485 HydrophobicContact CB-CD1 4.39Å; P482-I485 WeakPolarHBondContact O-CD1 3.44Å; P482-I485 WeakPolarHBondContact O-CG1 3.4Å; P482-M542 HydrophobicContact CG-CE 3.95Å; P482-M542 HydrophobicContact CG-CG 3.84Å; P482-M542 HydrophobicContact CG-SD 3.98Å; P482-F546 HydrophobicContact CB-CB 3.9Å; P482-F546 HydrophobicContact CB-CD1 3.61Å; P482-F546 HydrophobicContact CB-CD2 3.29Å; P482-F546 HydrophobicContact CB-CE1 3.89Å; P482-F546 HydrophobicContact CB-CE2 3.6Å; P482-F546 HydrophobicContact CB-CG 3.3Å; P482-F546 HydrophobicContact CB-CZ 3.89Å; P482-F546 HydrophobicContact CG-CD2 4.13Å; P482-F546 HydrophobicContact CG-CE2 4.39Å; P482-F546 HydrophobicContact CG-CG 4.49Å; P482-F546 WeakPolarHBondContact O-CD1 3.43Å
483	Q	83.1	Confident	89.9	Confident	114 Å²	114	30.9 Å²	30.9	53%	0.533	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-69.3	-26	178.4	73.5	-93.8	-14.7	0	0	113.8	E481	E481-Q483 HydrophobicContact CB-CG 4.45Å; E481-Q483 PolarHBondContact O-N 3.36Å
484	D	85.8	Confident	89.9	Confident	16 Å²	16	30.6 Å²	30.6	9%	0.086	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-89.7	-8.2	-174.5	-55.2	-43.3	0	0	0	112.1	E450 L480 E481 P482 Q486 S487	E450-D484 HydrophobicContact CB-CB 4.34Å; L480-D484 HydrophobicContact CD2-CB 4.44Å; E481-D484 PolarHBondContact O-N 3.22Å; E481-D484 VanDerWaalsContact O-N 3.09Å; P482-D484 VanDerWaalsContact C-N 3.3Å; P482-D484 PolarHBondContact O-N 3.37Å; D484-Q486 PolarHBondContact O-N 3.33Å; D484-S487 WeakPolarHBondContact O-CB 3.3Å; D484-S487 PolarHBondContact O-N 2.84Å
485	I	88.5	Confident	89.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.6	-40.4	177	-58.6	167.8	0	0	0	110.7	V388 P482 S487 A488 R489 V497 F549 F550	V388-I485 HydrophobicContact CG2-CD1 3.95Å; V388-I485 HydrophobicContact CG2-CG1 4.14Å; P482-I485 HydrophobicContact CB-CD1 4.39Å; P482-I485 WeakPolarHBondContact O-CD1 3.44Å; P482-I485 WeakPolarHBondContact O-CG1 3.4Å; I485-S487 VanDerWaalsContact C-N 3.27Å; I485-S487 PolarHBondContact O-N 3.43Å; I485-A488 WeakPolarHBondContact O-CB 3.31Å; I485-A488 PolarHBondContact O-N 3.23Å; I485-R489 HydrophobicContact CG2-CG 4.25Å; I485-R489 WeakPolarHBondContact O-CG 3.34Å; I485-R489 PolarHBondContact O-N 3.11Å; I485-V497 HydrophobicContact CD1-CG1 4.17Å; I485-V497 HydrophobicContact CG2-CG2 3.93Å; I485-F549 HydrophobicContact CD1-CB 4.12Å; I485-F549 HydrophobicContact CG2-CB 3.95Å; I485-F549 HydrophobicContact CG2-CG 4.35Å; I485-F550 HydrophobicContact CD1-CD1 4.46Å; I485-F550 HydrophobicContact CD1-CE1 3.95Å
486	Q	85.8	Confident	90	Very high	57 Å²	57	28.4 Å²	28.4	27%	0.266	14%	0.141	S	C	.	.	H	α-helix	trans	-57.2	-40.6	-178.5	-165.4	71.1	31.5	0	0	111.9	V364 D484 A488 R489 F549	V364-Q486 VanDerWaalsContact CG2-CD 3.47Å; V364-Q486 HydrophobicContact CG2-CG 4.09Å; V364-Q486 VanDerWaalsContact CG2-NE2 3.31Å; D484-Q486 PolarHBondContact O-N 3.33Å; Q486-A488 PolarHBondContact O-N 2.96Å; Q486-R489 PolarHBondContact O-N 2.96Å; Q486-F549 VanDerWaalsContact OE1-CZ 3.23Å
487	S	86	Confident	89.9	Confident	50 Å²	50	28.4 Å²	28.4	35%	0.35	14%	0.141	S	C	.	.	H	α-helix	trans	-65.5	-27.2	178.1	-52.6	0	0	0	0	112.8	L449 D484 I485	L449-S487 WeakPolarHBondContact CD2-O 3.46Å; D484-S487 WeakPolarHBondContact O-CB 3.3Å; D484-S487 PolarHBondContact O-N 2.84Å; I485-S487 VanDerWaalsContact C-N 3.27Å; I485-S487 PolarHBondContact O-N 3.43Å
488	A	90.4	Very high	90	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-85	-15.1	176.8	0	0	0	0	0	113.6	L384 L449 L480 I485 Q486 T490 P495	L384-A488 HydrophobicContact CD2-CB 4.34Å; L449-A488 HydrophobicContact CD2-CB 4.23Å; L480-A488 HydrophobicContact CD1-CB 3.83Å; I485-A488 WeakPolarHBondContact O-CB 3.31Å; I485-A488 PolarHBondContact O-N 3.23Å; Q486-A488 PolarHBondContact O-N 2.96Å; A488-T490 PolarHBondContact O-N 3.4Å; A488-P495 HydrophobicContact CB-CG 4.48Å; A488-P495 WeakPolarHBondContact O-CD 3.49Å; A488-P495 VanDerWaalsContact O-CG 3.29Å; A488-P495 WeakPolarHBondContact O-CG 3.39Å
489	R	90.8	Very high	90.3	Very high	22 Å²	22	28.1 Å²	28.1	8%	0.083	14%	0.14	C	C	.	.			trans	-76.6	55.9	-176.7	-73.5	-179.7	66	97	-9.9	113	E369 I485 Q486 P495 P581 W584	E369-R489 IonicContact OE1-CZ 3.12Å; E369-R489 IonicContact OE1-NH2 2.66Å; E369-R489 PolarHBondContact OE1-NH2 2.93Å; E369-R489 IonicContact OE2-CZ 2.66Å; E369-R489 IonicContact OE2-NH2 3.76Å; E369-R489 PolarHBondContact OE2-NH2 3.38Å; I485-R489 HydrophobicContact CG2-CG 4.25Å; I485-R489 WeakPolarHBondContact O-CG 3.34Å; I485-R489 PolarHBondContact O-N 3.11Å; Q486-R489 PolarHBondContact O-N 2.96Å; R489-P495 HydrophobicContact CG-CG 4.05Å; R489-P581 VanDerWaalsContact NH2-CG 3.25Å; R489-W584 HydrophobicContact CB-CZ2 3.7Å; R489-W584 HydrophobicContact CG-CH2 4.45Å; R489-W584 HydrophobicContact CG-CZ2 3.78Å; R489-W584 PolarHBondContact O-NE1 3.45Å
490	T	89.9	Confident	90.6	Very high	49 Å²	49	28 Å²	28	30%	0.301	14%	0.139	S	C	.	.	S	Bend	trans	-103.7	161.6	-179.7	71.5	0	0	0	0	112.8	A488 D492 L493 K494	A488-T490 PolarHBondContact O-N 3.4Å; T490-D492 PolarHBondContact O-N 3.49Å; T490-L493 PolarHBondContact O-N 3.37Å; T490-L493 WeakPolarHBondContact OG1-CB 3.16Å; T490-L493 WeakPolarHBondContact OG1-CG 3.41Å; T490-L493 PolarHBondContact OG1-N 2.87Å; T490-K494 PolarHBondContact O-N 2.93Å
491	R	89.3	Confident	90.9	Very high	76 Å²	76	30.5 Å²	30.5	29%	0.287	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.5	172	-80.3	-178.4	177.2	159.8	4.9	113.6	K494 A583 S586 D588	R491-K494 WeakPolarHBondContact O-CG 3.47Å; R491-K494 PolarHBondContact O-NZ 3.35Å; R491-A583 WeakPolarHBondContact CG-O 3.42Å; R491-A583 PolarHBondContact NE-O 2.84Å; R491-S586 PolarHBondContact NE-O 2.67Å; R491-S586 PolarHBondContact NH2-O 2.94Å; R491-S586 VanDerWaalsContact NH2-O 3.1Å; R491-D588 IonicContact CZ-OD1 3.05Å; R491-D588 VanDerWaalsContact CZ-OD1 3.22Å; R491-D588 IonicContact CZ-OD2 2.77Å; R491-D588 IonicContact NH1-OD1 3.31Å; R491-D588 PolarHBondContact NH1-OD1 2.94Å; R491-D588 IonicContact NH1-OD2 2.7Å; R491-D588 PolarHBondContact NH1-OD2 3.34Å; R491-D588 IonicContact NH2-OD1 3.83Å; R491-D588 PolarHBondContact NH2-OD1 2.79Å
492	D	89.8	Confident	91.4	Very high	115 Å²	115	29.3 Å²	29.3	62%	0.615	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-31	-172.6	-50.9	-56.5	0	0	0	112.6	T490	T490-D492 PolarHBondContact O-N 3.49Å
493	L	93.2	Very high	91.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-30.5	-177.3	-61.5	179.8	0	0	0	112.9	L384 L449 V466 L470 T490 P495	L384-L493 HydrophobicContact CB-CB 4.31Å; L384-L493 WeakPolarHBondContact CB-O 3.38Å; L384-L493 HydrophobicContact CD2-CB 4.28Å; L384-L493 HydrophobicContact CD2-CD1 4.18Å; L384-L493 PolarHBondContact N-O 2.77Å; L449-L493 HydrophobicContact CD1-CD1 4.16Å; L449-L493 HydrophobicContact CD2-CD1 3.96Å; V466-L493 HydrophobicContact CB-CD2 4.35Å; V466-L493 HydrophobicContact CG1-CD2 3.6Å; L470-L493 HydrophobicContact CD1-CD2 4.06Å; T490-L493 PolarHBondContact O-N 3.37Å; T490-L493 WeakPolarHBondContact OG1-CB 3.16Å; T490-L493 WeakPolarHBondContact OG1-CG 3.41Å; T490-L493 PolarHBondContact OG1-N 2.87Å; L493-P495 VanDerWaalsContact C-N 3.3Å; L493-P495 VanDerWaalsContact O-N 3.17Å
494	K	94.1	Very high	91.9	Very high	39 Å²	39	27.9 Å²	27.9	17%	0.17	14%	0.142	C	C	.	.			trans	36.7	55.5	-177.7	-60.8	-172.1	168	68.3	0	112.6	Y374 R383 T490 R491 W584	Y374-K494 HydrophobicContact CE1-CD 3.88Å; Y374-K494 HydrophobicContact CE2-CD 3.99Å; R383-K494 WeakPolarHBondContact CB-O 3.48Å; R383-K494 HydrophobicContact CG-CB 4.19Å; R383-K494 PolarHBondContact NE-O 2.76Å; R383-K494 PolarHBondContact NH2-O 3.23Å; T490-K494 PolarHBondContact O-N 2.93Å; R491-K494 WeakPolarHBondContact O-CG 3.47Å; R491-K494 PolarHBondContact O-NZ 3.35Å; K494-W584 HydrophobicContact CB-CE3 3.86Å; K494-W584 HydrophobicContact CB-CZ3 4.24Å; K494-W584 WeakPolarHBondContact CE-O 3.33Å; K494-W584 HydrophobicContact CG-CB 4.4Å; K494-W584 HydrophobicContact CG-CE3 4.09Å; K494-W584 PolarHBondContact NZ-O 3.13Å
495	P	95.8	Very high	91.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.145	C	C	.	.			trans	-57.9	151.9	-165.7	26.1	-37	0	0	0	112	R383 L384 V386 A488 R489 L493 V497 W584	R383-P495 PolarHBondContact NH2-O 3.37Å; L384-P495 CarbonylContact O-C 3.57Å; L384-P495 VanDerWaalsContact O-CA 3.32Å; L384-P495 WeakPolarHBondContact O-CA 3.37Å; V386-P495 HydrophobicContact CG2-CB 3.86Å; A488-P495 HydrophobicContact CB-CG 4.48Å; A488-P495 WeakPolarHBondContact O-CD 3.49Å; A488-P495 VanDerWaalsContact O-CG 3.29Å; A488-P495 WeakPolarHBondContact O-CG 3.39Å; R489-P495 HydrophobicContact CG-CG 4.05Å; L493-P495 VanDerWaalsContact C-N 3.3Å; L493-P495 VanDerWaalsContact O-N 3.17Å; P495-V497 HydrophobicContact CB-CG2 4.41Å; P495-W584 HydrophobicContact CG-CH2 3.8Å; P495-W584 HydrophobicContact CG-CZ2 4.16Å
496	Y	96.8	Very high	91.6	Very high	8 Å²	8	31.4 Å²	31.4	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.7	166.4	-169.5	-93.6	0	0	0	107.6	L384 V386 I498 D551 H552 A573 Q578	L384-Y496 PolarHBondContact O-N 3.01Å; V386-Y496 PolarHBondContact N-O 3.09Å; Y496-I498 HydrophobicContact CD1-CD1 4.03Å; Y496-I498 HydrophobicContact CD1-CG1 3.73Å; Y496-I498 HydrophobicContact CE1-CD1 4.12Å; Y496-I498 HydrophobicContact CE1-CG1 3.85Å; Y496-D551 HydrophobicContact CD1-CB 4.29Å; Y496-D551 HydrophobicContact CD2-CB 3.59Å; Y496-D551 HydrophobicContact CE1-CB 4.11Å; Y496-D551 HydrophobicContact CE2-CB 3.4Å; Y496-D551 HydrophobicContact CG-CB 4.06Å; Y496-H552 HydrophobicContact CE1-CB 4.06Å; Y496-A573 HydrophobicContact CD1-CB 3.5Å; Y496-A573 VanDerWaalsContact CD1-CB 3.5Å; Y496-A573 HydrophobicContact CD2-CB 3.65Å; Y496-A573 HydrophobicContact CE1-CB 3.85Å; Y496-A573 HydrophobicContact CE2-CB 3.99Å; Y496-A573 HydrophobicContact CG-CB 3.37Å; Y496-Q578 HydrophobicContact CE2-CG 4.47Å
497	V	96.4	Very high	91.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114.7	-166	-173.3	0	0	0	0	109.6	V386 V388 I485 P495 F549 F550 D551 H552	V386-V497 HydrophobicContact CB-CG1 4.49Å; V386-V497 HydrophobicContact CB-CG2 4.22Å; V386-V497 HydrophobicContact CG1-CG1 4.37Å; V386-V497 WeakPolarHBondContact O-CA 3.2Å; V388-V497 HydrophobicContact CG2-CG1 3.64Å; I485-V497 HydrophobicContact CD1-CG1 4.17Å; I485-V497 HydrophobicContact CG2-CG2 3.93Å; P495-V497 HydrophobicContact CB-CG2 4.41Å; V497-F549 WeakPolarHBondContact CB-O 3.46Å; V497-F549 WeakPolarHBondContact CG1-O 3.36Å; V497-F549 WeakPolarHBondContact CG2-O 3.24Å; V497-F550 HydrophobicContact CG1-CD1 3.94Å; V497-D551 PolarHBondContact N-OD2 3.06Å; V497-D551 PolarHBondContact O-N 3.21Å; V497-H552 PolarHBondContact O-N 3.26Å
498	I	97.7	Very high	91.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	113.1	-178	-52.2	178.3	0	0	0	108.3	I385 V386 L387 V388 Y496 I500 H552 I554 L566 A569 I570	I385-I498 HydrophobicContact CG2-CD1 4.08Å; V386-I498 PolarHBondContact O-N 3.38Å; L387-I498 HydrophobicContact CD2-CB 3.99Å; L387-I498 HydrophobicContact CD2-CD1 4.32Å; V388-I498 PolarHBondContact N-O 2.99Å; Y496-I498 HydrophobicContact CD1-CD1 4.03Å; Y496-I498 HydrophobicContact CD1-CG1 3.73Å; Y496-I498 HydrophobicContact CE1-CD1 4.12Å; Y496-I498 HydrophobicContact CE1-CG1 3.85Å; I498-I500 HydrophobicContact CG2-CD1 3.86Å; I498-H552 WeakPolarHBondContact CA-O 3.39Å; I498-H552 HydrophobicContact CG1-CB 4.45Å; I498-H552 HydrophobicContact CG2-CB 4.48Å; I498-I554 HydrophobicContact CG2-CD1 3.64Å; I498-I554 HydrophobicContact CG2-CG1 3.94Å; I498-L566 HydrophobicContact CD1-CD1 3.54Å; I498-L566 HydrophobicContact CG2-CD1 4.3Å; I498-A569 HydrophobicContact CD1-CB 3.89Å; I498-I570 HydrophobicContact CD1-CG1 4.16Å
499	F	97.4	Very high	91.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.6	175.8	-179.8	-122.4	0	0	0	110.6	V388 K501 A539 M542 E543 F550 H552 V553 I554	V388-F499 HydrophobicContact CB-CD2 4.39Å; V388-F499 HydrophobicContact CG1-CD2 4.26Å; V388-F499 CarbonylContact O-C 3.59Å; V388-F499 WeakPolarHBondContact O-CA 3.31Å; F499-K501 HydrophobicContact CD1-CB 4.18Å; F499-K501 HydrophobicContact CE1-CB 3.91Å; F499-K501 HydrophobicContact CE1-CD 4.21Å; F499-K501 HydrophobicContact CE1-CG 3.89Å; F499-K501 PolarHBondContact O-N 3.46Å; F499-A539 HydrophobicContact CZ-CB 4.33Å; F499-M542 HydrophobicContact CE2-CB 3.8Å; F499-M542 HydrophobicContact CE2-SD 4.09Å; F499-M542 HydrophobicContact CZ-CB 4Å; F499-E543 HydrophobicContact CE1-CB 4.2Å; F499-F550 HydrophobicContact CB-CB 4.18Å; F499-F550 HydrophobicContact CB-CD1 4.15Å; F499-F550 HydrophobicContact CB-CD2 3.43Å; F499-F550 VanDerWaalsContact CB-CD2 3.43Å; F499-F550 HydrophobicContact CB-CE1 4.42Å; F499-F550 HydrophobicContact CB-CE2 3.75Å; F499-F550 HydrophobicContact CB-CG 3.67Å; F499-F550 HydrophobicContact CB-CZ 4.24Å; F499-F550 AromaticContact CD1-CD2 3.8Å; F499-F550 HydrophobicContact CD1-CD2 3.8Å; F499-F550 AromaticContact CD1-CE2 3.66Å; F499-F550 HydrophobicContact CD1-CE2 3.66Å; F499-F550 HydrophobicContact CD2-CD2 4.17Å; F499-F550 HydrophobicContact CD2-CE1 4.39Å; F499-F550 AromaticContact CD2-CE2 3.54Å; F499-F550 HydrophobicContact CD2-CE2 3.54Å; F499-F550 AromaticContact CD2-CZ 3.68Å; F499-F550 HydrophobicContact CD2-CZ 3.68Å; F499-F550 HydrophobicContact CE1-CE2 4.09Å; F499-F550 AromaticContact CE2-CE2 3.98Å; F499-F550 HydrophobicContact CE2-CE2 3.98Å; F499-F550 HydrophobicContact CE2-CZ 4.14Å; F499-F550 AromaticContact CG-CD2 3.56Å; F499-F550 HydrophobicContact CG-CD2 3.56Å; F499-F550 AromaticContact CG-CE2 3.37Å; F499-F550 HydrophobicContact CG-CE2 3.37Å; F499-F550 HydrophobicContact CG-CG 4.26Å; F499-F550 AromaticContact CG-CZ 3.95Å; F499-F550 HydrophobicContact CG-CZ 3.95Å; F499-F550 HydrophobicContact CZ-CE2 4.24Å; F499-H552 PolarHBondContact N-O 3.4Å; F499-V553 HydrophobicContact CB-CG2 4.36Å; F499-V553 HydrophobicContact CD1-CG1 4.01Å; F499-V553 HydrophobicContact CD1-CG2 4.3Å; F499-V553 WeakPolarHBondContact O-CA 3.38Å; F499-I554 PolarHBondContact O-N 3.09Å
500	I	96.5	Very high	90.6	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	103.6	175.3	-50.5	-54.7	0	0	0	108.1	V388 G389 V393 V395 L398 I498 I554 N556	V388-I500 PolarHBondContact O-N 3.46Å; G389-I500 WeakPolarHBondContact CA-O 3.3Å; V393-I500 HydrophobicContact CG1-CB 4.19Å; V393-I500 HydrophobicContact CG1-CG2 3.94Å; V393-I500 HydrophobicContact CG2-CG2 4.13Å; V395-I500 HydrophobicContact CG2-CB 3.86Å; V395-I500 HydrophobicContact CG2-CG1 3.86Å; V395-I500 HydrophobicContact CG2-CG2 4.43Å; L398-I500 HydrophobicContact CD1-CD1 3.97Å; L398-I500 HydrophobicContact CD1-CG1 4.1Å; L398-I500 HydrophobicContact CD1-CG2 3.77Å; I498-I500 HydrophobicContact CG2-CD1 3.86Å; I500-I554 CarbonylContact C-O 3.58Å; I500-I554 WeakPolarHBondContact CA-O 3.27Å; I500-I554 HydrophobicContact CD1-CB 3.98Å; I500-I554 HydrophobicContact CD1-CD1 4.29Å; I500-N556 HydrophobicContact CG2-CB 3.71Å
501	K	94.7	Very high	90.1	Very high	54 Å²	54	40.2 Å²	40.2	24%	0.235	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	139.8	-177.8	-163.1	177.2	-175.4	165.3	0	110.3	F499 A539 E543 V553 I554 V555 N556	F499-K501 HydrophobicContact CD1-CB 4.18Å; F499-K501 HydrophobicContact CE1-CB 3.91Å; F499-K501 HydrophobicContact CE1-CD 4.21Å; F499-K501 HydrophobicContact CE1-CG 3.89Å; F499-K501 PolarHBondContact O-N 3.46Å; K501-A539 HydrophobicContact CG-CB 4.43Å; K501-E543 WeakPolarHBondContact CE-OE1 3.46Å; K501-E543 IonicContact NZ-OE1 3.88Å; K501-E543 PolarHBondContact NZ-OE1 2.86Å; K501-E543 IonicContact NZ-OE2 2.77Å; K501-E543 PolarHBondContact NZ-OE2 2.88Å; K501-V553 HydrophobicContact CB-CG1 4.09Å; K501-V553 HydrophobicContact CD-CG1 4.24Å; K501-I554 PolarHBondContact N-O 3.45Å; K501-V555 CarbonylContact O-C 3.59Å; K501-V555 WeakPolarHBondContact O-CA 3.45Å; K501-N556 PolarHBondContact O-N 2.9Å
502	P	92.5	Very high	89.4	Confident	8 Å²	8	37.7 Å²	37.7	5%	0.052	20%	0.196	C	C	.	.			trans	-66.8	152.4	165.5	29.7	-34.3	0	0	0	110.5	P390 V393 M508 M535 A539	P390-P502 HydrophobicContact CG-CG 4.37Å; V393-P502 HydrophobicContact CG2-CB 4.05Å; V393-P502 HydrophobicContact CG2-CG 4.49Å; P502-M508 HydrophobicContact CB-CE 4.07Å; P502-M508 HydrophobicContact CB-SD 3.59Å; P502-M508 VanDerWaalsContact CB-SD 3.59Å; P502-M535 HydrophobicContact CB-CG 3.96Å; P502-M535 HydrophobicContact CB-SD 4.26Å; P502-M535 HydrophobicContact CG-CG 4.01Å; P502-A539 VanDerWaalsContact CD-CB 3.44Å; P502-A539 HydrophobicContact CG-CB 3.61Å
503	P	91.3	Very high	88.4	Confident	13 Å²	13	39.4 Å²	39.4	8%	0.084	20%	0.198	C	C	.	.			trans	-70.2	174	161.6	33.4	-32.9	0	0	0	109.3	M508 V555 N556 D557	P503-M508 HydrophobicContact CG-CG 3.59Å; P503-M508 WeakPolarHBondContact O-CE 3.22Å; P503-V555 HydrophobicContact CB-CG1 3.81Å; P503-N556 WeakPolarHBondContact CD-O 3.39Å; P503-D557 HydrophobicContact CB-CB 4.11Å; P503-D557 HydrophobicContact CG-CB 3.82Å; P503-D557 WeakPolarHBondContact CG-OD1 3.12Å
504	N	88.3	Confident	87.1	Confident	78 Å²	78	45.7 Å²	45.7	42%	0.417	23%	0.231	S	C	.	.			trans	-59.7	153.5	178.6	59.4	34.2	0	0	0	112.5	S506 S507 M508	N504-S506 PolarHBondContact O-N 2.81Å; N504-S506 VanDerWaalsContact O-N 3.11Å; N504-S506 PolarHBondContact OD1-OG 2.84Å; N504-S507 PolarHBondContact O-N 2.82Å; N504-S507 WeakPolarHBondContact OD1-CB 3.49Å; N504-S507 PolarHBondContact OD1-N 2.91Å; N504-S507 PolarHBondContact OD1-OG 2.96Å; N504-M508 PolarHBondContact O-N 2.66Å
505	T	83.7	Confident	85.8	Confident	23 Å²	23	45.5 Å²	45.5	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-53.7	-30.1	-179.8	32.7	0	0	0	0	114.7	M508 R509 L532 E536	T505-M508 HydrophobicContact CG2-CE 3.94Å; T505-R509 WeakPolarHBondContact O-CG 3.49Å; T505-R509 PolarHBondContact O-N 3.02Å; T505-R509 VanDerWaalsContact O-N 3.15Å; T505-R509 PolarHBondContact O-NE 2.77Å; T505-L532 HydrophobicContact CG2-CB 4.3Å; T505-E536 WeakPolarHBondContact CB-OE2 3.18Å; T505-E536 HydrophobicContact CG2-CB 4.13Å; T505-E536 WeakPolarHBondContact CG2-OE2 3.48Å; T505-E536 PolarHBondContact N-OE2 3.39Å; T505-E536 PolarHBondContact OG1-OE2 3.01Å
506	S	83.9	Confident	84.3	Confident	66 Å²	66	50.9 Å²	50.9	46%	0.462	26%	0.261	S	S	.	.	H	α-helix	trans	-70.8	-41.7	175.4	50.5	0	0	0	0	112.4	N504 H510	N504-S506 PolarHBondContact O-N 2.81Å; N504-S506 VanDerWaalsContact O-N 3.11Å; N504-S506 PolarHBondContact OD1-OG 2.84Å; S506-H510 PolarHBondContact O-ND1 2.78Å
507	S	83.7	Confident	82.7	Confident	44 Å²	44	52.6 Å²	52.6	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-68.4	-44.5	174.6	-54.6	0	0	0	0	110.9	N504 R509 H510 S511	N504-S507 PolarHBondContact O-N 2.82Å; N504-S507 WeakPolarHBondContact OD1-CB 3.49Å; N504-S507 PolarHBondContact OD1-N 2.91Å; N504-S507 PolarHBondContact OD1-OG 2.96Å; S507-R509 VanDerWaalsContact C-N 3.28Å; S507-R509 PolarHBondContact O-N 3.44Å; S507-H510 WeakPolarHBondContact O-CA 3.39Å; S507-H510 WeakPolarHBondContact O-CB 3.44Å; S507-H510 PolarHBondContact O-N 2.98Å; S507-S511 PolarHBondContact O-N 2.82Å; S507-S511 PolarHBondContact O-OG 2.88Å
508	M	84.8	Confident	80.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-56.3	-39.6	177	-70.9	-162.2	-74.4	0	0	113	P502 P503 N504 T505 H510 R512 L532 M535 E536	P502-M508 HydrophobicContact CB-CE 4.07Å; P502-M508 HydrophobicContact CB-SD 3.59Å; P502-M508 VanDerWaalsContact CB-SD 3.59Å; P503-M508 HydrophobicContact CG-CG 3.59Å; P503-M508 WeakPolarHBondContact O-CE 3.22Å; N504-M508 PolarHBondContact O-N 2.66Å; T505-M508 HydrophobicContact CG2-CE 3.94Å; M508-H510 PolarHBondContact O-N 2.7Å; M508-R512 WeakPolarHBondContact O-CA 3.43Å; M508-R512 VanDerWaalsContact O-CB 3.22Å; M508-R512 WeakPolarHBondContact O-CB 3.38Å; M508-R512 PolarHBondContact O-N 3.1Å; M508-L532 HydrophobicContact CB-CD1 4.08Å; M508-L532 HydrophobicContact CB-CD2 4.01Å; M508-L532 HydrophobicContact CE-CB 4.24Å; M508-L532 VanDerWaalsContact CE-O 3.3Å; M508-L532 WeakPolarHBondContact CE-O 2.92Å; M508-L532 HydrophobicContact SD-CD2 4.14Å; M508-M535 HydrophobicContact CE-CE 4.28Å; M508-M535 HydrophobicContact SD-CE 3.5Å; M508-M535 VanDerWaalsContact SD-CE 3.5Å; M508-M535 HydrophobicContact SD-SD 4.19Å; M508-E536 HydrophobicContact CE-CB 4.22Å
509	R	83.9	Confident	78.3	Confident	115 Å²	115	60.4 Å²	60.4	43%	0.434	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-23.3	175.6	-85.4	-174.1	-96.7	-149.7	1	113.8	T505 S507 D529 L532	T505-R509 WeakPolarHBondContact O-CG 3.49Å; T505-R509 PolarHBondContact O-N 3.02Å; T505-R509 VanDerWaalsContact O-N 3.15Å; T505-R509 PolarHBondContact O-NE 2.77Å; S507-R509 VanDerWaalsContact C-N 3.28Å; S507-R509 PolarHBondContact O-N 3.44Å; R509-D529 WeakPolarHBondContact CD-OD2 3.22Å; R509-D529 IonicContact CZ-OD2 2.72Å; R509-D529 IonicContact NE-OD2 3.54Å; R509-D529 IonicContact NH1-OD2 3.92Å; R509-D529 PolarHBondContact NH1-OD2 3.38Å; R509-L532 HydrophobicContact CB-CD1 4.48Å; R509-L532 HydrophobicContact CG-CD1 3.65Å
510	H	79.8	Confident	75.5	Confident	151 Å²	151	63.4 Å²	63.4	70%	0.699	33%	0.334	S	S	*	.	H	α-helix	trans	-92	-56.3	175.1	-64.2	86.4	0	0	0	111.5	S506 S507 M508 R512 K513	S506-H510 PolarHBondContact O-ND1 2.78Å; S507-H510 WeakPolarHBondContact O-CA 3.39Å; S507-H510 WeakPolarHBondContact O-CB 3.44Å; S507-H510 PolarHBondContact O-N 2.98Å; M508-H510 PolarHBondContact O-N 2.7Å; H510-R512 PolarHBondContact O-N 2.73Å; H510-K513 WeakPolarHBondContact O-CB 3.41Å
511	S	78.1	Confident	72.8	Confident	53 Å²	53	69 Å²	69	37%	0.371	36%	0.356	S	S	.	.	H	α-helix	trans	-67.5	-33	-175.5	57.2	0	0	0	0	113.3	S507 D557	S507-S511 PolarHBondContact O-N 2.82Å; S507-S511 PolarHBondContact O-OG 2.88Å; S511-D557 WeakPolarHBondContact CB-OD1 3.48Å; S511-D557 PolarHBondContact OG-OD1 3.42Å
512	R	75.7	Confident	70.2	Confident	24 Å²	24	76 Å²	76	9%	0.091	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	4.2	-176.5	-54	-178.8	172.7	-130.4	-5.6	114.4	G392 V393 M508 H510 N514 A515 F527 N556	G392-R512 PolarHBondContact O-NH1 3.49Å; V393-R512 PolarHBondContact O-NH2 2.92Å; M508-R512 WeakPolarHBondContact O-CA 3.43Å; M508-R512 VanDerWaalsContact O-CB 3.22Å; M508-R512 WeakPolarHBondContact O-CB 3.38Å; M508-R512 PolarHBondContact O-N 3.1Å; H510-R512 PolarHBondContact O-N 2.73Å; R512-N514 PolarHBondContact O-N 2.81Å; R512-N514 VanDerWaalsContact O-N 3.1Å; R512-A515 HydrophobicContact CB-CB 3.98Å; R512-A515 HydrophobicContact CG-CB 4.47Å; R512-A515 WeakPolarHBondContact O-CB 3.43Å; R512-A515 PolarHBondContact O-N 2.66Å; R512-F527 HydrophobicContact CB-CD2 4.22Å; R512-N556 PolarHBondContact NH2-O 2.83Å
513	K	68.3	Low	67.9	Low	150 Å²	150	79.8 Å²	79.8	65%	0.652	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.2	-179.7	-169.6	172	-177.4	174	0	114.5	H510	H510-K513 WeakPolarHBondContact O-CB 3.41Å
514	N	65.8	Low	66.1	Low	133 Å²	133	83.8 Å²	83.8	71%	0.711	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-0.1	177.3	-65.4	-32.6	0	0	0	112.9	R512	R512-N514 PolarHBondContact O-N 2.81Å; R512-N514 VanDerWaalsContact O-N 3.1Å
515	A	66.3	Low	64.9	Low	36 Å²	36	84.7 Å²	84.7	30%	0.298	43%	0.429	S	S	.	.			trans	-72.5	139.8	178	0	0	0	0	0	110	R512 F527	R512-A515 HydrophobicContact CB-CB 3.98Å; R512-A515 HydrophobicContact CG-CB 4.47Å; R512-A515 WeakPolarHBondContact O-CB 3.43Å; R512-A515 PolarHBondContact O-N 2.66Å; A515-F527 HydrophobicContact CB-CD2 4.26Å; A515-F527 HydrophobicContact CB-CE2 4.03Å
516	K	65.3	Low	64.4	Low	113 Å²	113	90.1 Å²	90.1	49%	0.491	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.7	-176.4	-67.4	162.6	155.7	-161.8	0	108.8	T518 D524	K516-T518 PolarHBondContact O-N 2.69Å; K516-D524 HydrophobicContact CB-CB 4.23Å; K516-D524 HydrophobicContact CD-CB 3.81Å; K516-D524 VanDerWaalsContact CD-CG 3.43Å; K516-D524 WeakPolarHBondContact CD-OD1 3.28Å; K516-D524 VanDerWaalsContact CE-OD2 3.3Å; K516-D524 WeakPolarHBondContact CE-OD2 3.5Å; K516-D524 HydrophobicContact CG-CB 3.91Å; K516-D524 IonicContact NZ-OD2 3.64Å; K516-D524 PolarHBondContact NZ-OD2 3.43Å
517	I	62.7	Low	63.9	Low	43 Å²	43	88.8 Å²	88.8	22%	0.221	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	104.6	171.8	-57.9	172.3	0	0	0	106.7	T519 M525 F527	I517-T519 HydrophobicContact CG2-CG2 3.88Å; I517-T519 PolarHBondContact O-N 3.43Å; I517-M525 HydrophobicContact CB-CB 4.44Å; I517-M525 HydrophobicContact CD1-CB 4.35Å; I517-M525 WeakPolarHBondContact CG1-O 3.37Å; I517-M525 PolarHBondContact N-O 3.44Å; I517-F527 HydrophobicContact CD1-CD1 3.98Å; I517-F527 HydrophobicContact CD1-CE1 4.13Å; I517-F527 HydrophobicContact CD1-CG 4.31Å; I517-F527 HydrophobicContact CG1-CD1 3.96Å; I517-F527 HydrophobicContact CG1-CD2 4.1Å; I517-F527 HydrophobicContact CG1-CE1 3.78Å; I517-F527 HydrophobicContact CG1-CE2 3.9Å; I517-F527 HydrophobicContact CG1-CG 4.13Å; I517-F527 HydrophobicContact CG1-CZ 3.74Å
518	T	54.3	Low	63.9	Low	105 Å²	105	92.1 Å²	92.1	64%	0.644	45%	0.445	S	S	*	.			trans	-68.7	105.8	176.8	-59.5	0	0	0	0	108.8	K516	K516-T518 PolarHBondContact O-N 2.69Å
519	T	47.9	Very low	63.8	Low	60 Å²	60	96.2 Å²	96.2	37%	0.368	47%	0.467	S	S	.	.			trans	-111	160	169.5	76.5	0	0	0	0	110.3	I517 Y521	I517-T519 HydrophobicContact CG2-CG2 3.88Å; I517-T519 PolarHBondContact O-N 3.43Å; T519-Y521 PolarHBondContact O-N 3.5Å; T519-Y521 VanDerWaalsContact O-N 3.13Å; T519-Y521 PolarHBondContact OG1-N 2.85Å; T519-Y521 PolarHBondContact OG1-O 3.46Å
520	D	38.8	Very low	63.8	Low	63 Å²	63	96.3 Å²	96.3	34%	0.337	47%	0.472	S	S	.	.	S	Bend	trans	-64.5	-9.5	175.2	-108.4	-8.2	0	0	0	113.2	R335 R336	R335-D520 IonicContact NH1-OD1 3.96Å; R335-D520 PolarHBondContact NH1-OD1 3.42Å; R336-D520 IonicContact CZ-OD2 3.21Å; R336-D520 IonicContact NE-OD2 2.67Å; R336-D520 PolarHBondContact NE-OD2 2.86Å; R336-D520 IonicContact NH2-OD2 2.62Å; R336-D520 PolarHBondContact NH2-OD2 2.92Å
521	Y	38.4	Very low	63.9	Low	118 Å²	118	91.2 Å²	91.2	46%	0.463	45%	0.45	S	S	.	.	S	Bend	trans	-104	148.1	179.4	-67.8	-86.3	0	0	0	109.6	K455 T519 V523	K455-Y521 PolarHBondContact NZ-OH 2.92Å; T519-Y521 PolarHBondContact O-N 3.5Å; T519-Y521 VanDerWaalsContact O-N 3.13Å; T519-Y521 PolarHBondContact OG1-N 2.85Å; T519-Y521 PolarHBondContact OG1-O 3.46Å; Y521-V523 PolarHBondContact O-N 2.68Å
522	Y	40	Very low	64.3	Low	201 Å²	201	89 Å²	89	79%	0.788	43%	0.434	S	S	*	.	S	Bend	trans	-70.8	47.9	-176.4	-69.9	-91.1	0	0	0	114
523	V	45.3	Very low	64.7	Low	86 Å²	86	91.8 Å²	91.8	52%	0.521	45%	0.448	S	S	.	.			trans	-128.2	100.3	175.2	-166.1	0	0	0	0	108.3	Y521 M525	Y521-V523 PolarHBondContact O-N 2.68Å; V523-M525 HydrophobicContact CB-CG 4.24Å; V523-M525 HydrophobicContact CG1-CG 3.57Å; V523-M525 PolarHBondContact O-N 3.23Å
524	D	54	Low	65.6	Low	97 Å²	97	89.5 Å²	89.5	52%	0.519	44%	0.44	S	S	.	.			trans	-68	75.4	166.3	-81	-37.1	0	0	0	109.5	K516 K526	K516-D524 HydrophobicContact CB-CB 4.23Å; K516-D524 HydrophobicContact CD-CB 3.81Å; K516-D524 VanDerWaalsContact CD-CG 3.43Å; K516-D524 WeakPolarHBondContact CD-OD1 3.28Å; K516-D524 VanDerWaalsContact CE-OD2 3.3Å; K516-D524 WeakPolarHBondContact CE-OD2 3.5Å; K516-D524 HydrophobicContact CG-CB 3.91Å; K516-D524 IonicContact NZ-OD2 3.64Å; K516-D524 PolarHBondContact NZ-OD2 3.43Å; D524-K526 PolarHBondContact O-N 2.89Å
525	M	62.7	Low	66.6	Low	98 Å²	98	83.4 Å²	83.4	48%	0.483	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	123.7	174.6	-66	-169.2	72.8	0	0	109	I517 V523	I517-M525 HydrophobicContact CB-CB 4.44Å; I517-M525 HydrophobicContact CD1-CB 4.35Å; I517-M525 WeakPolarHBondContact CG1-O 3.37Å; I517-M525 PolarHBondContact N-O 3.44Å; V523-M525 HydrophobicContact CB-CG 4.24Å; V523-M525 HydrophobicContact CG1-CG 3.57Å; V523-M525 PolarHBondContact O-N 3.23Å
526	K	71.8	Confident	67.7	Low	137 Å²	137	83.5 Å²	83.5	60%	0.596	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.7	165.4	-62.4	-174.1	179.8	-172.6	0	108.6	D524 K528	D524-K526 PolarHBondContact O-N 2.89Å; K526-K528 PolarHBondContact O-N 2.96Å
527	F	75.2	Confident	68.8	Low	38 Å²	38	83.1 Å²	83.1	17%	0.167	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-59	133.4	167.8	-67.8	-88.3	0	0	0	109.9	R512 A515 I517 D531 L532 M535	R512-F527 HydrophobicContact CB-CD2 4.22Å; A515-F527 HydrophobicContact CB-CD2 4.26Å; A515-F527 HydrophobicContact CB-CE2 4.03Å; I517-F527 HydrophobicContact CD1-CD1 3.98Å; I517-F527 HydrophobicContact CD1-CE1 4.13Å; I517-F527 HydrophobicContact CD1-CG 4.31Å; I517-F527 HydrophobicContact CG1-CD1 3.96Å; I517-F527 HydrophobicContact CG1-CD2 4.1Å; I517-F527 HydrophobicContact CG1-CE1 3.78Å; I517-F527 HydrophobicContact CG1-CE2 3.9Å; I517-F527 HydrophobicContact CG1-CG 4.13Å; I517-F527 HydrophobicContact CG1-CZ 3.74Å; F527-D531 HydrophobicContact CD1-CB 4.21Å; F527-L532 HydrophobicContact CB-CD2 3.85Å; F527-L532 HydrophobicContact CB-CG 4.24Å; F527-L532 HydrophobicContact CD1-CD2 3.98Å; F527-L532 HydrophobicContact CG-CD2 4.03Å; F527-M535 HydrophobicContact CD1-CE 4.24Å; F527-M535 HydrophobicContact CE1-CE 4.05Å
528	K	82.2	Confident	70	Confident	114 Å²	114	84.4 Å²	84.4	50%	0.496	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-87.3	162.5	164.4	-56.1	-176	-176.1	179.5	0	110.2	K526 E530 D531 L532	K526-K528 PolarHBondContact O-N 2.96Å; K528-E530 WeakPolarHBondContact CD-OE2 3.49Å; K528-E530 IonicContact NZ-OE2 3.05Å; K528-E530 PolarHBondContact O-N 2.77Å; K528-D531 WeakPolarHBondContact CB-OD2 3.34Å; K528-D531 PolarHBondContact N-OD2 2.82Å; K528-D531 PolarHBondContact O-N 3.04Å; K528-L532 WeakPolarHBondContact O-CG 3.47Å; K528-L532 PolarHBondContact O-N 3.1Å; K528-L532 VanDerWaalsContact O-N 3.12Å
529	D	82.9	Confident	71.8	Confident	85 Å²	85	79.5 Å²	79.5	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-59	-33.1	172.4	-84.5	21.7	0	0	0	111.8	R509 L532 Q533	R509-D529 WeakPolarHBondContact CD-OD2 3.22Å; R509-D529 IonicContact CZ-OD2 2.72Å; R509-D529 IonicContact NE-OD2 3.54Å; R509-D529 IonicContact NH1-OD2 3.92Å; R509-D529 PolarHBondContact NH1-OD2 3.38Å; D529-L532 PolarHBondContact O-N 3.27Å; D529-Q533 WeakPolarHBondContact O-CB 3.42Å; D529-Q533 PolarHBondContact O-N 3.05Å
530	E	84.1	Confident	73.9	Confident	118 Å²	118	81.8 Å²	81.8	55%	0.551	39%	0.385	S	S	*	.	H	α-helix	trans	-59.1	-48.6	170.6	-61.1	113.9	-142.2	0	0	112.3	K528 L532 Q533 E534	K528-E530 WeakPolarHBondContact CD-OE2 3.49Å; K528-E530 IonicContact NZ-OE2 3.05Å; K528-E530 PolarHBondContact O-N 2.77Å; E530-L532 VanDerWaalsContact C-N 3.25Å; E530-L532 PolarHBondContact O-N 3.47Å; E530-Q533 PolarHBondContact O-N 3.33Å; E530-E534 WeakPolarHBondContact O-CG 3.42Å; E530-E534 PolarHBondContact O-N 3.49Å
531	D	82.4	Confident	76.3	Confident	43 Å²	43	84.2 Å²	84.2	23%	0.23	39%	0.392	C	S	.	.	H	α-helix	trans	-63.7	-32.5	-179.8	-58.4	-62.2	0	0	0	111.8	F527 K528 M535	F527-D531 HydrophobicContact CD1-CB 4.21Å; K528-D531 WeakPolarHBondContact CB-OD2 3.34Å; K528-D531 PolarHBondContact N-OD2 2.82Å; K528-D531 PolarHBondContact O-N 3.04Å; D531-M535 VanDerWaalsContact O-CB 3.23Å; D531-M535 WeakPolarHBondContact O-CB 3.49Å; D531-M535 PolarHBondContact O-N 3.49Å; D531-M535 VanDerWaalsContact O-N 3.15Å
532	L	85.5	Confident	78.7	Confident	6 Å²	6	79.5 Å²	79.5	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-72.2	-39.9	176.8	-62.9	-175.6	0	0	0	111.8	T505 M508 R509 F527 K528 D529 E530 M535 E536	T505-L532 HydrophobicContact CG2-CB 4.3Å; M508-L532 HydrophobicContact CB-CD1 4.08Å; M508-L532 HydrophobicContact CB-CD2 4.01Å; M508-L532 HydrophobicContact CE-CB 4.24Å; M508-L532 VanDerWaalsContact CE-O 3.3Å; M508-L532 WeakPolarHBondContact CE-O 2.92Å; M508-L532 HydrophobicContact SD-CD2 4.14Å; R509-L532 HydrophobicContact CB-CD1 4.48Å; R509-L532 HydrophobicContact CG-CD1 3.65Å; F527-L532 HydrophobicContact CB-CD2 3.85Å; F527-L532 HydrophobicContact CB-CG 4.24Å; F527-L532 HydrophobicContact CD1-CD2 3.98Å; F527-L532 HydrophobicContact CG-CD2 4.03Å; K528-L532 WeakPolarHBondContact O-CG 3.47Å; K528-L532 PolarHBondContact O-N 3.1Å; K528-L532 VanDerWaalsContact O-N 3.12Å; D529-L532 PolarHBondContact O-N 3.27Å; E530-L532 VanDerWaalsContact C-N 3.25Å; E530-L532 PolarHBondContact O-N 3.47Å; L532-M535 HydrophobicContact CD2-CE 3.53Å; L532-M535 PolarHBondContact O-N 3.5Å; L532-E536 PolarHBondContact O-N 3.2Å; L532-E536 VanDerWaalsContact O-N 3.13Å
533	Q	85.8	Confident	81.1	Confident	83 Å²	83	73.2 Å²	73.2	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-66.8	-49.2	175.9	-175.7	65.7	29.2	0	0	111.1	D529 E530 M535 E536 E537	D529-Q533 WeakPolarHBondContact O-CB 3.42Å; D529-Q533 PolarHBondContact O-N 3.05Å; E530-Q533 PolarHBondContact O-N 3.33Å; Q533-M535 PolarHBondContact O-N 3.11Å; Q533-E536 PolarHBondContact O-N 3.37Å; Q533-E536 VanDerWaalsContact O-N 3.15Å; Q533-E537 WeakPolarHBondContact CG-OE1 3.24Å; Q533-E537 PolarHBondContact NE2-OE1 3.23Å; Q533-E537 WeakPolarHBondContact O-CG 3.35Å; Q533-E537 PolarHBondContact O-N 3.31Å
534	E	86.1	Confident	83.1	Confident	103 Å²	103	73 Å²	73	48%	0.481	36%	0.355	S	S	.	.	H	α-helix	trans	-55.4	-40	175	-75.4	-174.5	-170.3	0	0	111.7	E530 L538	E530-E534 WeakPolarHBondContact O-CG 3.42Å; E530-E534 PolarHBondContact O-N 3.49Å; E534-L538 VanDerWaalsContact O-CB 3.27Å; E534-L538 WeakPolarHBondContact O-CB 3.27Å; E534-L538 WeakPolarHBondContact O-CG 3.37Å; E534-L538 PolarHBondContact O-N 2.92Å
535	M	86.2	Confident	84.6	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.02	35%	0.354	C	S	.	.	H	α-helix	trans	-68.1	-38.2	178.9	174.3	169	36.7	0	0	113	P390 V393 P502 M508 F527 D531 L532 Q533 A539	P390-M535 HydrophobicContact CB-CG 4.42Å; P390-M535 HydrophobicContact CG-CG 4.09Å; V393-M535 HydrophobicContact CB-SD 4.17Å; V393-M535 HydrophobicContact CG2-SD 4.49Å; P502-M535 HydrophobicContact CB-CG 3.96Å; P502-M535 HydrophobicContact CB-SD 4.26Å; P502-M535 HydrophobicContact CG-CG 4.01Å; M508-M535 HydrophobicContact CE-CE 4.28Å; M508-M535 HydrophobicContact SD-CE 3.5Å; M508-M535 VanDerWaalsContact SD-CE 3.5Å; M508-M535 HydrophobicContact SD-SD 4.19Å; F527-M535 HydrophobicContact CD1-CE 4.24Å; F527-M535 HydrophobicContact CE1-CE 4.05Å; D531-M535 VanDerWaalsContact O-CB 3.23Å; D531-M535 WeakPolarHBondContact O-CB 3.49Å; D531-M535 PolarHBondContact O-N 3.49Å; D531-M535 VanDerWaalsContact O-N 3.15Å; L532-M535 HydrophobicContact CD2-CE 3.53Å; L532-M535 PolarHBondContact O-N 3.5Å; Q533-M535 PolarHBondContact O-N 3.11Å; M535-A539 WeakPolarHBondContact O-CB 3.44Å; M535-A539 PolarHBondContact O-N 3.44Å; M535-A539 VanDerWaalsContact O-N 3.09Å
536	E	89.4	Confident	85.7	Confident	39 Å²	39	70.9 Å²	70.9	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-69.3	-44.3	174.4	179.2	158.4	-150.6	0	0	111.4	T505 M508 L532 Q533 A539 Q540	T505-E536 WeakPolarHBondContact CB-OE2 3.18Å; T505-E536 HydrophobicContact CG2-CB 4.13Å; T505-E536 WeakPolarHBondContact CG2-OE2 3.48Å; T505-E536 PolarHBondContact N-OE2 3.39Å; T505-E536 PolarHBondContact OG1-OE2 3.01Å; M508-E536 HydrophobicContact CE-CB 4.22Å; L532-E536 PolarHBondContact O-N 3.2Å; L532-E536 VanDerWaalsContact O-N 3.13Å; Q533-E536 PolarHBondContact O-N 3.37Å; Q533-E536 VanDerWaalsContact O-N 3.15Å; E536-A539 WeakPolarHBondContact O-CB 3.4Å; E536-A539 PolarHBondContact O-N 3.45Å; E536-A539 VanDerWaalsContact O-N 3.17Å; E536-Q540 WeakPolarHBondContact O-CG 3.46Å; E536-Q540 PolarHBondContact O-N 3.03Å
537	E	89	Confident	86.4	Confident	105 Å²	105	65.5 Å²	65.5	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176.9	-71.3	176.2	-166.5	0	0	112.4	Q533 A539 Q540 K541	Q533-E537 WeakPolarHBondContact CG-OE1 3.24Å; Q533-E537 PolarHBondContact NE2-OE1 3.23Å; Q533-E537 WeakPolarHBondContact O-CG 3.35Å; Q533-E537 PolarHBondContact O-N 3.31Å; E537-A539 VanDerWaalsContact C-N 3.31Å; E537-A539 PolarHBondContact O-N 2.84Å; E537-Q540 PolarHBondContact O-N 3.39Å; E537-K541 WeakPolarHBondContact O-CB 3.24Å; E537-K541 PolarHBondContact O-N 3.25Å
538	L	88.6	Confident	86.9	Confident	70 Å²	70	68.1 Å²	68.1	37%	0.366	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-36.8	173.7	-73.6	172.7	0	0	0	111.7	P390 E534 K541 M542	P390-L538 HydrophobicContact CB-CB 3.84Å; E534-L538 VanDerWaalsContact O-CB 3.27Å; E534-L538 WeakPolarHBondContact O-CB 3.27Å; E534-L538 WeakPolarHBondContact O-CG 3.37Å; E534-L538 PolarHBondContact O-N 2.92Å; L538-K541 PolarHBondContact O-N 3.49Å; L538-M542 WeakPolarHBondContact O-CB 3.23Å; L538-M542 VanDerWaalsContact O-CG 3.22Å; L538-M542 WeakPolarHBondContact O-CG 3.43Å; L538-M542 PolarHBondContact O-N 2.86Å
539	A	91.9	Very high	87.2	Confident	2 Å²	2	63.6 Å²	63.6	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-48.3	175.5	0	0	0	0	0	112	P390 F499 K501 P502 M535 E536 E537 K541 M542 E543	P390-A539 HydrophobicContact CG-CB 4.07Å; F499-A539 HydrophobicContact CZ-CB 4.33Å; K501-A539 HydrophobicContact CG-CB 4.43Å; P502-A539 VanDerWaalsContact CD-CB 3.44Å; P502-A539 HydrophobicContact CG-CB 3.61Å; M535-A539 WeakPolarHBondContact O-CB 3.44Å; M535-A539 PolarHBondContact O-N 3.44Å; M535-A539 VanDerWaalsContact O-N 3.09Å; E536-A539 WeakPolarHBondContact O-CB 3.4Å; E536-A539 PolarHBondContact O-N 3.45Å; E536-A539 VanDerWaalsContact O-N 3.17Å; E537-A539 VanDerWaalsContact C-N 3.31Å; E537-A539 PolarHBondContact O-N 2.84Å; A539-K541 VanDerWaalsContact C-N 3.3Å; A539-K541 PolarHBondContact O-N 3.18Å; A539-M542 PolarHBondContact O-N 3.13Å; A539-E543 WeakPolarHBondContact O-CB 3.42Å; A539-E543 PolarHBondContact O-N 2.78Å
540	Q	92.2	Very high	87.7	Confident	107 Å²	107	60.8 Å²	60.8	50%	0.5	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-38.8	178.3	-66.8	175.2	11.2	0	0	111.6	E536 E537 S544	E536-Q540 WeakPolarHBondContact O-CG 3.46Å; E536-Q540 PolarHBondContact O-N 3.03Å; E537-Q540 PolarHBondContact O-N 3.39Å; Q540-S544 WeakPolarHBondContact O-CB 3.38Å; Q540-S544 PolarHBondContact O-N 2.77Å; Q540-S544 PolarHBondContact O-OG 2.95Å
541	K	88.8	Confident	88.1	Confident	114 Å²	114	57.8 Å²	57.8	50%	0.496	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-43	174	-172.8	178.6	178.3	-177.2	0	112.3	E537 L538 A539 S544 Q545	E537-K541 WeakPolarHBondContact O-CB 3.24Å; E537-K541 PolarHBondContact O-N 3.25Å; L538-K541 PolarHBondContact O-N 3.49Å; A539-K541 VanDerWaalsContact C-N 3.3Å; A539-K541 PolarHBondContact O-N 3.18Å; K541-S544 WeakPolarHBondContact CA-OG 3.27Å; K541-S544 PolarHBondContact O-OG 3.08Å; K541-S544 VanDerWaalsContact O-OG 3.1Å; K541-Q545 HydrophobicContact CG-CG 4.44Å; K541-Q545 VanDerWaalsContact O-CB 3.31Å; K541-Q545 WeakPolarHBondContact O-CB 3.43Å; K541-Q545 VanDerWaalsContact O-CG 3.3Å; K541-Q545 WeakPolarHBondContact O-CG 3.31Å; K541-Q545 PolarHBondContact O-N 3.14Å; K541-Q545 VanDerWaalsContact O-N 3.08Å
542	M	89.3	Confident	88.7	Confident	19 Å²	19	59 Å²	59	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-44.4	176.8	-73.7	-179.3	175.6	0	0	111.8	P390 P482 F499 L538 A539 F546	P390-M542 HydrophobicContact CB-SD 4.37Å; P482-M542 HydrophobicContact CG-CE 3.95Å; P482-M542 HydrophobicContact CG-CG 3.84Å; P482-M542 HydrophobicContact CG-SD 3.98Å; F499-M542 HydrophobicContact CE2-CB 3.8Å; F499-M542 HydrophobicContact CE2-SD 4.09Å; F499-M542 HydrophobicContact CZ-CB 4Å; L538-M542 WeakPolarHBondContact O-CB 3.23Å; L538-M542 VanDerWaalsContact O-CG 3.22Å; L538-M542 WeakPolarHBondContact O-CG 3.43Å; L538-M542 PolarHBondContact O-N 2.86Å; A539-M542 PolarHBondContact O-N 3.13Å; M542-F546 WeakPolarHBondContact O-CA 3.16Å; M542-F546 WeakPolarHBondContact O-CB 3.18Å; M542-F546 PolarHBondContact O-N 3.02Å
543	E	90.3	Very high	89.2	Confident	69 Å²	69	61.6 Å²	61.6	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-45.6	-179.8	-170.3	169.5	-115.6	0	0	112.2	F499 K501 A539 G547	F499-E543 HydrophobicContact CE1-CB 4.2Å; K501-E543 WeakPolarHBondContact CE-OE1 3.46Å; K501-E543 IonicContact NZ-OE1 3.88Å; K501-E543 PolarHBondContact NZ-OE1 2.86Å; K501-E543 IonicContact NZ-OE2 2.77Å; K501-E543 PolarHBondContact NZ-OE2 2.88Å; A539-E543 WeakPolarHBondContact O-CB 3.42Å; A539-E543 PolarHBondContact O-N 2.78Å; E543-G547 VanDerWaalsContact O-CA 3.26Å; E543-G547 WeakPolarHBondContact O-CA 3.3Å; E543-G547 PolarHBondContact O-N 3.18Å
544	S	86.3	Confident	89.8	Confident	82 Å²	82	57.7 Å²	57.7	57%	0.573	29%	0.29	S	S	*	.	H	α-helix	trans	-65.4	-42.8	177.1	52.2	0	0	0	0	113.3	Q540 K541	Q540-S544 WeakPolarHBondContact O-CB 3.38Å; Q540-S544 PolarHBondContact O-N 2.77Å; Q540-S544 PolarHBondContact O-OG 2.95Å; K541-S544 WeakPolarHBondContact CA-OG 3.27Å; K541-S544 PolarHBondContact O-OG 3.08Å; K541-S544 VanDerWaalsContact O-OG 3.1Å
545	Q	85.3	Confident	90.2	Very high	104 Å²	104	56.2 Å²	56.2	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-78.8	-45.1	-177.1	-66.6	-175.2	-24	0	0	112.7	K541	K541-Q545 HydrophobicContact CG-CG 4.44Å; K541-Q545 VanDerWaalsContact O-CB 3.31Å; K541-Q545 WeakPolarHBondContact O-CB 3.43Å; K541-Q545 VanDerWaalsContact O-CG 3.3Å; K541-Q545 WeakPolarHBondContact O-CG 3.31Å; K541-Q545 PolarHBondContact O-N 3.14Å; K541-Q545 VanDerWaalsContact O-N 3.08Å
546	F	86.6	Confident	90.6	Very high	46 Å²	46	56.1 Å²	56.1	20%	0.202	29%	0.288	C	S	.	.	H	α-helix	trans	-114.9	0.3	-167.2	-58.1	-87.9	0	0	0	114.6	P482 M542 Q548 F549 F550	P482-F546 HydrophobicContact CB-CB 3.9Å; P482-F546 HydrophobicContact CB-CD1 3.61Å; P482-F546 HydrophobicContact CB-CD2 3.29Å; P482-F546 HydrophobicContact CB-CE1 3.89Å; P482-F546 HydrophobicContact CB-CE2 3.6Å; P482-F546 HydrophobicContact CB-CG 3.3Å; P482-F546 HydrophobicContact CB-CZ 3.89Å; P482-F546 HydrophobicContact CG-CD2 4.13Å; P482-F546 HydrophobicContact CG-CE2 4.39Å; P482-F546 HydrophobicContact CG-CG 4.49Å; P482-F546 WeakPolarHBondContact O-CD1 3.43Å; M542-F546 WeakPolarHBondContact O-CA 3.16Å; M542-F546 WeakPolarHBondContact O-CB 3.18Å; M542-F546 PolarHBondContact O-N 3.02Å; F546-Q548 PolarHBondContact O-N 2.77Å; F546-F549 HydrophobicContact CB-CD2 4.26Å; F546-F549 HydrophobicContact CD1-CD2 4.28Å; F546-F549 HydrophobicContact CD1-CE2 4.31Å; F546-F549 WeakPolarHBondContact O-CB 3.18Å; F546-F549 WeakPolarHBondContact O-CD2 3.16Å; F546-F549 PolarHBondContact O-N 2.86Å; F546-F550 HydrophobicContact CB-CE1 4.05Å; F546-F550 HydrophobicContact CB-CZ 3.93Å
547	G	86.9	Confident	90.5	Very high	24 Å²	24	57.8 Å²	57.8	25%	0.247	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-56.7	-18.7	-173.9	0	0	0	0	0	117	E543 F549 F550	E543-G547 VanDerWaalsContact O-CA 3.26Å; E543-G547 WeakPolarHBondContact O-CA 3.3Å; E543-G547 PolarHBondContact O-N 3.18Å; G547-F549 PolarHBondContact O-N 3.48Å; G547-F550 PolarHBondContact O-N 3.24Å
548	Q	85.1	Confident	90.5	Very high	94 Å²	94	56 Å²	56	44%	0.439	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-62.4	-25.3	170.1	54.1	-157.8	62.4	0	0	113.7	K258 F546	K258-Q548 VanDerWaalsContact CE-CB 3.4Å; F546-Q548 PolarHBondContact O-N 2.77Å
549	F	88.7	Confident	90.4	Very high	19 Å²	19	55.5 Å²	55.5	8%	0.083	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-94.9	2.1	-175.8	-55	-59	0	0	0	112.8	I485 Q486 V497 F546 G547	I485-F549 HydrophobicContact CD1-CB 4.12Å; I485-F549 HydrophobicContact CG2-CB 3.95Å; I485-F549 HydrophobicContact CG2-CG 4.35Å; Q486-F549 VanDerWaalsContact OE1-CZ 3.23Å; V497-F549 WeakPolarHBondContact CB-O 3.46Å; V497-F549 WeakPolarHBondContact CG1-O 3.36Å; V497-F549 WeakPolarHBondContact CG2-O 3.24Å; F546-F549 HydrophobicContact CB-CD2 4.26Å; F546-F549 HydrophobicContact CD1-CD2 4.28Å; F546-F549 HydrophobicContact CD1-CE2 4.31Å; F546-F549 WeakPolarHBondContact O-CB 3.18Å; F546-F549 WeakPolarHBondContact O-CD2 3.16Å; F546-F549 PolarHBondContact O-N 2.86Å; G547-F549 PolarHBondContact O-N 3.48Å
550	F	92.8	Very high	90.3	Very high	25 Å²	25	62.5 Å²	62.5	11%	0.11	32%	0.321	C	S	.	.			trans	-98	107.3	-176.4	-57.4	-17	0	0	0	110	V388 I485 V497 F499 F546 G547 H552	V388-F550 HydrophobicContact CB-CE1 4.39Å; V388-F550 HydrophobicContact CG1-CE1 4.11Å; V388-F550 HydrophobicContact CG1-CZ 4.33Å; I485-F550 HydrophobicContact CD1-CD1 4.46Å; I485-F550 HydrophobicContact CD1-CE1 3.95Å; V497-F550 HydrophobicContact CG1-CD1 3.94Å; F499-F550 HydrophobicContact CB-CB 4.18Å; F499-F550 HydrophobicContact CB-CD1 4.15Å; F499-F550 HydrophobicContact CB-CD2 3.43Å; F499-F550 VanDerWaalsContact CB-CD2 3.43Å; F499-F550 HydrophobicContact CB-CE1 4.42Å; F499-F550 HydrophobicContact CB-CE2 3.75Å; F499-F550 HydrophobicContact CB-CG 3.67Å; F499-F550 HydrophobicContact CB-CZ 4.24Å; F499-F550 AromaticContact CD1-CD2 3.8Å; F499-F550 HydrophobicContact CD1-CD2 3.8Å; F499-F550 AromaticContact CD1-CE2 3.66Å; F499-F550 HydrophobicContact CD1-CE2 3.66Å; F499-F550 HydrophobicContact CD2-CD2 4.17Å; F499-F550 HydrophobicContact CD2-CE1 4.39Å; F499-F550 AromaticContact CD2-CE2 3.54Å; F499-F550 HydrophobicContact CD2-CE2 3.54Å; F499-F550 AromaticContact CD2-CZ 3.68Å; F499-F550 HydrophobicContact CD2-CZ 3.68Å; F499-F550 HydrophobicContact CE1-CE2 4.09Å; F499-F550 AromaticContact CE2-CE2 3.98Å; F499-F550 HydrophobicContact CE2-CE2 3.98Å; F499-F550 HydrophobicContact CE2-CZ 4.14Å; F499-F550 AromaticContact CG-CD2 3.56Å; F499-F550 HydrophobicContact CG-CD2 3.56Å; F499-F550 AromaticContact CG-CE2 3.37Å; F499-F550 HydrophobicContact CG-CE2 3.37Å; F499-F550 HydrophobicContact CG-CG 4.26Å; F499-F550 AromaticContact CG-CZ 3.95Å; F499-F550 HydrophobicContact CG-CZ 3.95Å; F499-F550 HydrophobicContact CZ-CE2 4.24Å; F546-F550 HydrophobicContact CB-CE1 4.05Å; F546-F550 HydrophobicContact CB-CZ 3.93Å; G547-F550 PolarHBondContact O-N 3.24Å; F550-H552 VanDerWaalsContact C-N 3.3Å
551	D	93.6	Very high	90.3	Very high	55 Å²	55	61.9 Å²	61.9	29%	0.294	32%	0.322	S	S	.	.	S	Bend	trans	-69.2	-29.8	174.4	-56.1	-100	0	0	0	112	Y496 V497	Y496-D551 HydrophobicContact CD1-CB 4.29Å; Y496-D551 HydrophobicContact CD2-CB 3.59Å; Y496-D551 HydrophobicContact CE1-CB 4.11Å; Y496-D551 HydrophobicContact CE2-CB 3.4Å; Y496-D551 HydrophobicContact CG-CB 4.06Å; V497-D551 PolarHBondContact N-OD2 3.06Å; V497-D551 PolarHBondContact O-N 3.21Å
552	H	95.3	Very high	90.5	Very high	69 Å²	69	56.5 Å²	56.5	32%	0.319	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151.9	179.8	-157.4	51.1	0	0	0	113.1	Y496 V497 I498 F499 F550	Y496-H552 HydrophobicContact CE1-CB 4.06Å; V497-H552 PolarHBondContact O-N 3.26Å; I498-H552 WeakPolarHBondContact CA-O 3.39Å; I498-H552 HydrophobicContact CG1-CB 4.45Å; I498-H552 HydrophobicContact CG2-CB 4.48Å; F499-H552 PolarHBondContact N-O 3.4Å; F550-H552 VanDerWaalsContact C-N 3.3Å
553	V	96	Very high	90.7	Very high	61 Å²	61	56.4 Å²	56.4	37%	0.37	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.8	178.6	-177.7	0	0	0	0	109.7	F499 K501	F499-V553 HydrophobicContact CB-CG2 4.36Å; F499-V553 HydrophobicContact CD1-CG1 4.01Å; F499-V553 HydrophobicContact CD1-CG2 4.3Å; F499-V553 WeakPolarHBondContact O-CA 3.38Å; K501-V553 HydrophobicContact CB-CG1 4.09Å; K501-V553 HydrophobicContact CD-CG1 4.24Å
554	I	97.1	Very high	90.9	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.8	178.1	-61.3	178.3	0	0	0	108.9	I498 F499 I500 K501 A562 Q565 L566 A569	I498-I554 HydrophobicContact CG2-CD1 3.64Å; I498-I554 HydrophobicContact CG2-CG1 3.94Å; F499-I554 PolarHBondContact O-N 3.09Å; I500-I554 CarbonylContact C-O 3.58Å; I500-I554 WeakPolarHBondContact CA-O 3.27Å; I500-I554 HydrophobicContact CD1-CB 3.98Å; I500-I554 HydrophobicContact CD1-CD1 4.29Å; K501-I554 PolarHBondContact N-O 3.45Å; I554-A562 HydrophobicContact CG2-CB 4.13Å; I554-Q565 HydrophobicContact CD1-CB 4.11Å; I554-Q565 HydrophobicContact CG1-CB 4.42Å; I554-Q565 HydrophobicContact CG2-CB 4.16Å; I554-L566 HydrophobicContact CD1-CB 4.03Å; I554-L566 HydrophobicContact CD1-CD1 4.28Å; I554-A569 HydrophobicContact CD1-CB 4.42Å
555	V	96.1	Very high	91.4	Very high	72 Å²	72	55.3 Å²	55.3	44%	0.436	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	112	175.6	-178.3	0	0	0	0	109.7	K501 P503 D557	K501-V555 CarbonylContact O-C 3.59Å; K501-V555 WeakPolarHBondContact O-CA 3.45Å; P503-V555 HydrophobicContact CB-CG1 3.81Å; V555-D557 PolarHBondContact O-N 3.17Å
556	N	93.2	Very high	91.9	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.011	27%	0.273	C	S	.	.			trans	-92.7	77.7	-176.1	-172.3	27.2	0	0	0	112.9	V393 I500 K501 P503 R512 A562	V393-N556 PolarHBondContact O-ND2 2.96Å; I500-N556 HydrophobicContact CG2-CB 3.71Å; K501-N556 PolarHBondContact O-N 2.9Å; P503-N556 WeakPolarHBondContact CD-O 3.39Å; R512-N556 PolarHBondContact NH2-O 2.83Å; N556-A562 HydrophobicContact CB-CB 4.22Å; N556-A562 VanDerWaalsContact OD1-CB 3.24Å; N556-A562 WeakPolarHBondContact OD1-CB 3.39Å
557	D	88.6	Confident	92.4	Very high	74 Å²	74	51.4 Å²	51.4	40%	0.396	28%	0.28	S	S	.	.	S	Bend	trans	-87.2	-47.3	168.4	-165.5	38.3	0	0	0	112	P503 S511 V555	P503-D557 HydrophobicContact CB-CB 4.11Å; P503-D557 HydrophobicContact CG-CB 3.82Å; P503-D557 WeakPolarHBondContact CG-OD1 3.12Å; S511-D557 WeakPolarHBondContact CB-OD1 3.48Å; S511-D557 PolarHBondContact OG-OD1 3.42Å; V555-D557 PolarHBondContact O-N 3.17Å
558	N	87.8	Confident	92.8	Very high	67 Å²	67	52.5 Å²	52.5	36%	0.358	28%	0.284	S	S	.	.	S	Bend	trans	-115	127	171.9	-179.5	2.3	0	0	0	110.7	Q560 D561 A562	N558-Q560 VanDerWaalsContact C-N 3.32Å; N558-Q560 PolarHBondContact O-N 3.36Å; N558-Q560 PolarHBondContact OD1-N 2.75Å; N558-Q560 VanDerWaalsContact OD1-N 3.1Å; N558-D561 HydrophobicContact CB-CB 4.29Å; N558-D561 VanDerWaalsContact CB-OD2 3.3Å; N558-D561 WeakPolarHBondContact CB-OD2 3.3Å; N558-D561 PolarHBondContact ND2-OD2 3.1Å; N558-D561 PolarHBondContact O-N 3.45Å; N558-A562 VanDerWaalsContact O-CB 3.27Å; N558-A562 WeakPolarHBondContact O-CB 3.23Å; N558-A562 PolarHBondContact O-N 2.62Å
559	L	86.7	Confident	93.3	Very high	61 Å²	61	48.1 Å²	48.1	32%	0.319	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-35.5	-179.8	-73.3	168.1	0	0	0	113.5	E397 L398 C563	E397-L559 HydrophobicContact CB-CD2 4.13Å; E397-L559 HydrophobicContact CG-CD1 3.86Å; E397-L559 HydrophobicContact CG-CD2 3.91Å; L398-L559 HydrophobicContact CD2-CD2 3.84Å; L398-L559 HydrophobicContact CG-CD2 4.34Å; L559-C563 WeakPolarHBondContact O-CB 3.47Å; L559-C563 PolarHBondContact O-N 2.89Å; L559-C563 PolarHBondContact O-SG 3.13Å
560	Q	88.9	Confident	93.7	Very high	148 Å²	148	47.3 Å²	47.3	69%	0.692	26%	0.261	S	S	*	.	H	α-helix	trans	-69.4	-48	-179.6	-70.6	-176	-29.7	0	0	111.1	N558 A562 C563 G564	N558-Q560 VanDerWaalsContact C-N 3.32Å; N558-Q560 PolarHBondContact O-N 3.36Å; N558-Q560 PolarHBondContact OD1-N 2.75Å; N558-Q560 VanDerWaalsContact OD1-N 3.1Å; Q560-A562 VanDerWaalsContact C-N 3.34Å; Q560-A562 PolarHBondContact O-N 2.76Å; Q560-C563 PolarHBondContact O-N 2.58Å; Q560-G564 PolarHBondContact O-N 3.04Å
561	D	92.4	Very high	93.8	Very high	95 Å²	95	51.3 Å²	51.3	51%	0.508	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-39	179	-56.2	-36.3	0	0	0	111.2	N558 G564 Q565	N558-D561 HydrophobicContact CB-CB 4.29Å; N558-D561 VanDerWaalsContact CB-OD2 3.3Å; N558-D561 WeakPolarHBondContact CB-OD2 3.3Å; N558-D561 PolarHBondContact ND2-OD2 3.1Å; N558-D561 PolarHBondContact O-N 3.45Å; D561-G564 PolarHBondContact O-N 3.02Å; D561-Q565 WeakPolarHBondContact O-CG 3.5Å; D561-Q565 PolarHBondContact O-N 2.85Å; D561-Q565 PolarHBondContact O-NE2 2.92Å
562	A	94.2	Very high	93.8	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-35.1	174.3	0	0	0	0	0	112.6	L398 I554 N556 N558 Q560 L566	L398-A562 HydrophobicContact CD1-CB 4.39Å; L398-A562 HydrophobicContact CD2-CB 3.81Å; I554-A562 HydrophobicContact CG2-CB 4.13Å; N556-A562 HydrophobicContact CB-CB 4.22Å; N556-A562 VanDerWaalsContact OD1-CB 3.24Å; N556-A562 WeakPolarHBondContact OD1-CB 3.39Å; N558-A562 VanDerWaalsContact O-CB 3.27Å; N558-A562 WeakPolarHBondContact O-CB 3.23Å; N558-A562 PolarHBondContact O-N 2.62Å; Q560-A562 VanDerWaalsContact C-N 3.34Å; Q560-A562 PolarHBondContact O-N 2.76Å; A562-L566 WeakPolarHBondContact O-CB 3.39Å; A562-L566 PolarHBondContact O-N 3.11Å
563	C	93.8	Very high	93.8	Very high	16 Å²	16	49.5 Å²	49.5	11%	0.108	27%	0.269	C	S	.	.	H	α-helix	trans	-66	-39.4	171.3	-76.7	0	0	0	0	112.2	L398 Q401 L559 Q560 L566 L567	L398-C563 WeakPolarHBondContact CD2-SG 3.07Å; Q401-C563 PolarHBondContact OE1-SG 3.01Å; Q401-C563 VanDerWaalsContact OE1-SG 3.37Å; L559-C563 WeakPolarHBondContact O-CB 3.47Å; L559-C563 PolarHBondContact O-N 2.89Å; L559-C563 PolarHBondContact O-SG 3.13Å; Q560-C563 PolarHBondContact O-N 2.58Å; C563-L566 PolarHBondContact O-N 2.97Å; C563-L567 PolarHBondContact O-N 3.15Å
564	G	94.4	Very high	93.7	Very high	41 Å²	41	47 Å²	47	42%	0.423	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-45.4	174.2	0	0	0	0	0	112.6	Q560 D561 L566 L567 S568	Q560-G564 PolarHBondContact O-N 3.04Å; D561-G564 PolarHBondContact O-N 3.02Å; G564-L566 VanDerWaalsContact C-N 3.34Å; G564-L566 PolarHBondContact O-N 3.45Å; G564-L567 PolarHBondContact O-N 3.15Å; G564-S568 PolarHBondContact O-N 3.13Å; G564-S568 VanDerWaalsContact O-N 3.12Å
565	Q	96.4	Very high	93.5	Very high	87 Å²	87	52.9 Å²	52.9	41%	0.407	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-41.6	173.2	-72.9	172.1	60.2	0	0	111.8	I554 D561 S568 A569	I554-Q565 HydrophobicContact CD1-CB 4.11Å; I554-Q565 HydrophobicContact CG1-CB 4.42Å; I554-Q565 HydrophobicContact CG2-CB 4.16Å; D561-Q565 WeakPolarHBondContact O-CG 3.5Å; D561-Q565 PolarHBondContact O-N 2.85Å; D561-Q565 PolarHBondContact O-NE2 2.92Å; Q565-S568 PolarHBondContact O-N 3.26Å; Q565-A569 WeakPolarHBondContact O-CB 3.21Å; Q565-A569 PolarHBondContact O-N 3.49Å
566	L	96	Very high	93.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-42.4	178.3	179.2	60	0	0	0	112	L387 L398 L402 I498 I554 A562 C563 G564 A569 I570	L387-L566 HydrophobicContact CD1-CD2 4.38Å; L387-L566 HydrophobicContact CD2-CD1 3.77Å; L398-L566 HydrophobicContact CB-CD2 3.93Å; L402-L566 HydrophobicContact CD2-CD2 3.75Å; L402-L566 HydrophobicContact CD2-CG 3.99Å; I498-L566 HydrophobicContact CD1-CD1 3.54Å; I498-L566 HydrophobicContact CG2-CD1 4.3Å; I554-L566 HydrophobicContact CD1-CB 4.03Å; I554-L566 HydrophobicContact CD1-CD1 4.28Å; A562-L566 WeakPolarHBondContact O-CB 3.39Å; A562-L566 PolarHBondContact O-N 3.11Å; C563-L566 PolarHBondContact O-N 2.97Å; G564-L566 VanDerWaalsContact C-N 3.34Å; G564-L566 PolarHBondContact O-N 3.45Å; L566-A569 PolarHBondContact O-N 2.7Å; L566-I570 HydrophobicContact CD1-CD1 3.91Å; L566-I570 HydrophobicContact CD1-CG1 4.22Å; L566-I570 HydrophobicContact CG-CD1 3.95Å; L566-I570 VanDerWaalsContact O-CG1 3.25Å; L566-I570 WeakPolarHBondContact O-CG1 3.43Å; L566-I570 PolarHBondContact O-N 2.94Å
567	L	95.6	Very high	93.4	Very high	68 Å²	68	58.8 Å²	58.8	36%	0.356	31%	0.306	S	S	.	.	H	α-helix	trans	-57.1	-48.3	172.5	-84.8	164.4	0	0	0	111.7	L402 F410 C563 G564 I570 Q571	L402-L567 HydrophobicContact CD1-CD2 3.34Å; L402-L567 HydrophobicContact CD1-CG 3.69Å; F410-L567 HydrophobicContact CE2-CD2 3.93Å; F410-L567 HydrophobicContact CZ-CD2 3.87Å; C563-L567 PolarHBondContact O-N 3.15Å; G564-L567 PolarHBondContact O-N 3.15Å; L567-I570 PolarHBondContact O-N 2.9Å; L567-Q571 WeakPolarHBondContact O-CG 3.48Å; L567-Q571 PolarHBondContact O-N 3.27Å
568	S	96.1	Very high	93.6	Very high	48 Å²	48	57.1 Å²	57.1	34%	0.336	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-45.8	178.1	-174.3	0	0	0	0	111.6	G564 Q565 I570 Q571 K572	G564-S568 PolarHBondContact O-N 3.13Å; G564-S568 VanDerWaalsContact O-N 3.12Å; Q565-S568 PolarHBondContact O-N 3.26Å; S568-I570 VanDerWaalsContact C-N 3.28Å; S568-I570 PolarHBondContact O-N 2.79Å; S568-Q571 PolarHBondContact O-N 3.42Å; S568-K572 VanDerWaalsContact O-CG 3.32Å; S568-K572 WeakPolarHBondContact O-CG 3.45Å; S568-K572 PolarHBondContact O-N 2.86Å
569	A	96.5	Very high	93.8	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-38.5	177.9	0	0	0	0	0	112.6	I498 I554 Q565 L566 A573	I498-A569 HydrophobicContact CD1-CB 3.89Å; I554-A569 HydrophobicContact CD1-CB 4.42Å; Q565-A569 WeakPolarHBondContact O-CB 3.21Å; Q565-A569 PolarHBondContact O-N 3.49Å; L566-A569 PolarHBondContact O-N 2.7Å; A569-A573 WeakPolarHBondContact O-CB 3.22Å; A569-A573 PolarHBondContact O-N 2.93Å
570	I	95.9	Very high	94	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-69.4	-42.4	176.3	-67.4	167.7	0	0	0	111.4	I385 L402 F410 I475 I477 I498 L566 L567 S568 K572 A573 Q574	I385-I570 HydrophobicContact CD1-CB 4.42Å; I385-I570 HydrophobicContact CD1-CG1 4.02Å; I385-I570 HydrophobicContact CD1-CG2 4.13Å; I385-I570 HydrophobicContact CG1-CD1 4.43Å; I385-I570 HydrophobicContact CG1-CG1 3.99Å; I385-I570 HydrophobicContact CG1-CG2 4.07Å; I385-I570 HydrophobicContact CG2-CD1 4.04Å; I385-I570 HydrophobicContact CG2-CG1 3.92Å; L402-I570 HydrophobicContact CD2-CD1 3.42Å; L402-I570 VanDerWaalsContact CD2-CD1 3.42Å; F410-I570 HydrophobicContact CE1-CG2 4.01Å; I475-I570 HydrophobicContact CD1-CG2 4.05Å; I475-I570 HydrophobicContact CG2-CG2 4.16Å; I477-I570 HydrophobicContact CD1-CD1 4.12Å; I498-I570 HydrophobicContact CD1-CG1 4.16Å; L566-I570 HydrophobicContact CD1-CD1 3.91Å; L566-I570 HydrophobicContact CD1-CG1 4.22Å; L566-I570 HydrophobicContact CG-CD1 3.95Å; L566-I570 VanDerWaalsContact O-CG1 3.25Å; L566-I570 WeakPolarHBondContact O-CG1 3.43Å; L566-I570 PolarHBondContact O-N 2.94Å; L567-I570 PolarHBondContact O-N 2.9Å; S568-I570 VanDerWaalsContact C-N 3.28Å; S568-I570 PolarHBondContact O-N 2.79Å; I570-K572 PolarHBondContact O-N 3.21Å; I570-A573 WeakPolarHBondContact O-CB 3.41Å; I570-A573 PolarHBondContact O-N 2.9Å; I570-Q574 HydrophobicContact CG2-CG 4.45Å; I570-Q574 WeakPolarHBondContact O-CG 3.48Å; I570-Q574 PolarHBondContact O-N 2.91Å; I570-Q574 VanDerWaalsContact O-N 3.15Å
571	Q	94.5	Very high	94.2	Very high	109 Å²	109	48.1 Å²	48.1	51%	0.509	25%	0.247	S	C	.	.	H	α-helix	trans	-57.5	-49.3	174.5	-72.2	171.9	-38.7	0	0	110.9	L567 S568 A573 Q574 E575	L567-Q571 WeakPolarHBondContact O-CG 3.48Å; L567-Q571 PolarHBondContact O-N 3.27Å; S568-Q571 PolarHBondContact O-N 3.42Å; Q571-A573 VanDerWaalsContact C-N 3.3Å; Q571-A573 PolarHBondContact O-N 3.25Å; Q571-Q574 PolarHBondContact O-N 3.04Å; Q571-Q574 VanDerWaalsContact O-N 3.09Å; Q571-E575 WeakPolarHBondContact O-CB 3.43Å; Q571-E575 PolarHBondContact O-N 2.83Å
572	K	94.3	Very high	94.1	Very high	83 Å²	83	47.3 Å²	47.3	36%	0.361	24%	0.241	S	C	.	.	H	α-helix	trans	-57.2	-41.7	175.8	-65.1	-172	173.8	-173.2	0	113	S568 I570 Q574 E576	S568-K572 VanDerWaalsContact O-CG 3.32Å; S568-K572 WeakPolarHBondContact O-CG 3.45Å; S568-K572 PolarHBondContact O-N 2.86Å; I570-K572 PolarHBondContact O-N 3.21Å; K572-Q574 VanDerWaalsContact C-N 3.28Å; K572-Q574 PolarHBondContact O-N 2.74Å; K572-E576 HydrophobicContact CB-CG 4.34Å; K572-E576 WeakPolarHBondContact CD-OE2 3.5Å; K572-E576 VanDerWaalsContact CG-CD 3.48Å; K572-E576 HydrophobicContact CG-CG 4.33Å; K572-E576 WeakPolarHBondContact CG-OE2 3.47Å; K572-E576 WeakPolarHBondContact O-CB 3.35Å; K572-E576 PolarHBondContact O-N 2.85Å
573	A	94.4	Very high	93.8	Very high	3 Å²	3	50.2 Å²	50.2	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-34.4	177.8	0	0	0	0	0	113.4	R383 I385 Y496 A569 I570 Q571	R383-A573 WeakPolarHBondContact CD-O 3.19Å; R383-A573 PolarHBondContact NH1-O 2.63Å; I385-A573 HydrophobicContact CD1-CB 4Å; Y496-A573 HydrophobicContact CD1-CB 3.5Å; Y496-A573 VanDerWaalsContact CD1-CB 3.5Å; Y496-A573 HydrophobicContact CD2-CB 3.65Å; Y496-A573 HydrophobicContact CE1-CB 3.85Å; Y496-A573 HydrophobicContact CE2-CB 3.99Å; Y496-A573 HydrophobicContact CG-CB 3.37Å; A569-A573 WeakPolarHBondContact O-CB 3.22Å; A569-A573 PolarHBondContact O-N 2.93Å; I570-A573 WeakPolarHBondContact O-CB 3.41Å; I570-A573 PolarHBondContact O-N 2.9Å; Q571-A573 VanDerWaalsContact C-N 3.3Å; Q571-A573 PolarHBondContact O-N 3.25Å
574	Q	94.3	Very high	93.6	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-94.7	-19.9	-175.3	-57.3	-61.4	-19.7	0	0	114.5	R376 R383 I475 I570 Q571 K572	R376-Q574 PolarHBondContact NE-O 3.06Å; R376-Q574 VanDerWaalsContact NE-O 3.16Å; R383-Q574 PolarHBondContact O-NE2 3.14Å; I475-Q574 HydrophobicContact CD1-CG 3.97Å; I475-Q574 HydrophobicContact CG1-CG 4.42Å; I570-Q574 HydrophobicContact CG2-CG 4.45Å; I570-Q574 WeakPolarHBondContact O-CG 3.48Å; I570-Q574 PolarHBondContact O-N 2.91Å; I570-Q574 VanDerWaalsContact O-N 3.15Å; Q571-Q574 PolarHBondContact O-N 3.04Å; Q571-Q574 VanDerWaalsContact O-N 3.09Å; K572-Q574 VanDerWaalsContact C-N 3.28Å; K572-Q574 PolarHBondContact O-N 2.74Å
575	E	93.2	Very high	93.2	Very high	125 Å²	125	51.3 Å²	51.3	58%	0.584	26%	0.261	S	S	*	.	H	α-helix	trans	-122.9	-33.4	-169.8	-62.9	176.8	-166.7	0	0	114.4	Q375 Q571	Q375-E575 PolarHBondContact NE2-O 3.21Å; Q571-E575 WeakPolarHBondContact O-CB 3.43Å; Q571-E575 PolarHBondContact O-N 2.83Å
576	E	94.1	Very high	92.1	Very high	93 Å²	93	49.1 Å²	49.1	44%	0.435	26%	0.255	S	S	.	.	S	Bend	trans	-87	160	-177.3	-66.6	-178.5	173.5	0	0	112.6	K572 Q578	K572-E576 HydrophobicContact CB-CG 4.34Å; K572-E576 WeakPolarHBondContact CD-OE2 3.5Å; K572-E576 VanDerWaalsContact CG-CD 3.48Å; K572-E576 HydrophobicContact CG-CG 4.33Å; K572-E576 WeakPolarHBondContact CG-OE2 3.47Å; K572-E576 WeakPolarHBondContact O-CB 3.35Å; K572-E576 PolarHBondContact O-N 2.85Å; E576-Q578 PolarHBondContact O-N 3.15Å
577	L	93.1	Very high	90.4	Very high	104 Å²	104	54.6 Å²	54.6	55%	0.545	29%	0.291	S	S	.	.			trans	-69.1	118.4	170.5	-81.4	156	0	0	0	110.3	R373 Q375	R373-L577 HydrophobicContact CB-CD2 4.31Å; Q375-L577 HydrophobicContact CB-CD2 3.72Å; Q375-L577 HydrophobicContact CB-CG 4.05Å; Q375-L577 HydrophobicContact CG-CG 4.49Å
578	Q	92.7	Very high	88.2	Confident	40 Å²	40	56 Å²	56	19%	0.187	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156.4	179.4	-60.8	-58.9	-35.1	0	0	111.1	R373 Y374 Y496 E576	R373-Q578 WeakPolarHBondContact CA-O 3.3Å; Y374-Q578 PolarHBondContact N-O 3.43Å; Y374-Q578 PolarHBondContact O-N 3.04Å; Y496-Q578 HydrophobicContact CE2-CG 4.47Å; E576-Q578 PolarHBondContact O-N 3.15Å
579	W	91.9	Very high	85.5	Confident	77 Å²	77	60.5 Å²	60.5	29%	0.292	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.5	166.9	-66.4	102.1	0	0	0	109.2	I261 I278 V371 R373	I261-W579 HydrophobicContact CD1-CB 4.34Å; I261-W579 HydrophobicContact CD1-CG 4.21Å; I261-W579 HydrophobicContact CG1-CD2 4.37Å; I261-W579 HydrophobicContact CG1-CG 4.06Å; I261-W579 HydrophobicContact CG2-CD2 4.05Å; I261-W579 HydrophobicContact CG2-CE3 4.26Å; I261-W579 HydrophobicContact CG2-CH2 4.37Å; I261-W579 HydrophobicContact CG2-CZ2 4.17Å; I261-W579 HydrophobicContact CG2-CZ3 4.41Å; I278-W579 HydrophobicContact CD1-CH2 3.4Å; I278-W579 VanDerWaalsContact CD1-CH2 3.4Å; I278-W579 HydrophobicContact CD1-CZ2 3.34Å; I278-W579 HydrophobicContact CD1-CZ3 4.39Å; I278-W579 HydrophobicContact CG2-CZ2 4.39Å; V371-W579 HydrophobicContact CB-CE3 4.21Å; V371-W579 HydrophobicContact CG2-CD2 4.47Å; V371-W579 HydrophobicContact CG2-CE3 3.82Å; V371-W579 HydrophobicContact CG2-CZ3 4.39Å; R373-W579 HydrophobicContact CG-CD2 4.08Å; R373-W579 HydrophobicContact CG-CE3 3.9Å; R373-W579 HydrophobicContact CG-CH2 3.61Å; R373-W579 HydrophobicContact CG-CZ2 3.76Å; R373-W579 HydrophobicContact CG-CZ3 3.68Å
580	V	92.3	Very high	82.6	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.2	173.8	-58.8	0	0	0	0	109.2	V371 V372 Y374 E582 W584 V585	V371-V580 CarbonylContact C-O 3.54Å; V371-V580 WeakPolarHBondContact CA-O 3.49Å; V371-V580 WeakPolarHBondContact CB-O 3.5Å; V372-V580 HydrophobicContact CG1-CG2 3.98Å; V372-V580 PolarHBondContact N-O 3.06Å; V372-V580 PolarHBondContact O-N 3.01Å; Y374-V580 HydrophobicContact CD1-CG1 4.18Å; Y374-V580 HydrophobicContact CG-CG1 4.41Å; Y374-V580 HydrophobicContact CG-CG2 4.06Å; V580-E582 PolarHBondContact O-N 3.32Å; V580-W584 HydrophobicContact CB-CE3 3.75Å; V580-W584 HydrophobicContact CB-CZ3 4.14Å; V580-W584 HydrophobicContact CG1-CE3 4.08Å; V580-W584 HydrophobicContact CG1-CZ3 4.16Å; V580-V585 HydrophobicContact CG2-CG2 3.68Å
581	P	91.5	Very high	79.5	Confident	8 Å²	8	78.3 Å²	78.3	5%	0.052	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	133.4	171.2	-27.8	36.1	0	0	0	111.3	E369 E370 R489 A583 W584	E369-P581 HydrophobicContact CG-CB 4.44Å; E369-P581 HydrophobicContact CG-CG 4.49Å; E369-P581 WeakPolarHBondContact OE1-CG 3.45Å; E370-P581 CarbonylContact O-C 3.58Å; E370-P581 WeakPolarHBondContact O-CA 3.35Å; R489-P581 VanDerWaalsContact NH2-CG 3.25Å; P581-A583 PolarHBondContact O-N 3.37Å; P581-W584 HydrophobicContact CB-CD2 4.29Å; P581-W584 HydrophobicContact CB-CG 4.16Å; P581-W584 HydrophobicContact CG-CD2 4.04Å; P581-W584 HydrophobicContact CG-CG 4.43Å; P581-W584 HydrophobicContact CG-CH2 4.31Å; P581-W584 HydrophobicContact CG-CZ2 3.8Å; P581-W584 VanDerWaalsContact O-CB 3.31Å; P581-W584 WeakPolarHBondContact O-CB 3.04Å; P581-W584 PolarHBondContact O-N 3.05Å
582	E	90.1	Very high	78.8	Confident	79 Å²	79	76.8 Å²	76.8	37%	0.369	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-58.4	-37.5	-179.6	-167.4	-156.5	-156.1	0	0	111.1	E370 V372 V580 W584 V585 S586	E370-E582 HydrophobicContact CG-CB 4.09Å; E370-E582 PolarHBondContact O-N 3.12Å; V372-E582 HydrophobicContact CB-CG 4.38Å; V580-E582 PolarHBondContact O-N 3.32Å; E582-W584 PolarHBondContact O-N 3.28Å; E582-V585 PolarHBondContact O-N 3.03Å; E582-S586 PolarHBondContact O-N 3.22Å; E582-S586 PolarHBondContact O-OG 3.1Å
583	A	88.3	Confident	77.9	Confident	62 Å²	62	76.4 Å²	76.4	51%	0.512	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-56.7	-9.7	172.3	0	0	0	0	0	114.8	R491 P581	R491-A583 WeakPolarHBondContact CG-O 3.42Å; R491-A583 PolarHBondContact NE-O 2.84Å; P581-A583 PolarHBondContact O-N 3.37Å
584	W	89.9	Confident	77	Confident	14 Å²	14	80.5 Å²	80.5	5%	0.053	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-88.7	-15.2	172.2	-67.7	3.2	0	0	0	114.4	R489 K494 P495 V580 P581 E582	R489-W584 HydrophobicContact CB-CZ2 3.7Å; R489-W584 HydrophobicContact CG-CH2 4.45Å; R489-W584 HydrophobicContact CG-CZ2 3.78Å; R489-W584 PolarHBondContact O-NE1 3.45Å; K494-W584 HydrophobicContact CB-CE3 3.86Å; K494-W584 HydrophobicContact CB-CZ3 4.24Å; K494-W584 WeakPolarHBondContact CE-O 3.33Å; K494-W584 HydrophobicContact CG-CB 4.4Å; K494-W584 HydrophobicContact CG-CE3 4.09Å; K494-W584 PolarHBondContact NZ-O 3.13Å; P495-W584 HydrophobicContact CG-CH2 3.8Å; P495-W584 HydrophobicContact CG-CZ2 4.16Å; V580-W584 HydrophobicContact CB-CE3 3.75Å; V580-W584 HydrophobicContact CB-CZ3 4.14Å; V580-W584 HydrophobicContact CG1-CE3 4.08Å; V580-W584 HydrophobicContact CG1-CZ3 4.16Å; P581-W584 HydrophobicContact CB-CD2 4.29Å; P581-W584 HydrophobicContact CB-CG 4.16Å; P581-W584 HydrophobicContact CG-CD2 4.04Å; P581-W584 HydrophobicContact CG-CG 4.43Å; P581-W584 HydrophobicContact CG-CH2 4.31Å; P581-W584 HydrophobicContact CG-CZ2 3.8Å; P581-W584 VanDerWaalsContact O-CB 3.31Å; P581-W584 WeakPolarHBondContact O-CB 3.04Å; P581-W584 PolarHBondContact O-N 3.05Å; E582-W584 PolarHBondContact O-N 3.28Å
585	V	86.4	Confident	76	Confident	65 Å²	65	84.8 Å²	84.8	39%	0.394	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-37.9	-170.1	-175.1	0	0	0	0	111.8	V372 Y374 V580 E582	V372-V585 HydrophobicContact CG1-CB 3.99Å; V372-V585 HydrophobicContact CG1-CG2 3.69Å; Y374-V585 HydrophobicContact CD2-CG2 3.88Å; Y374-V585 HydrophobicContact CG-CG2 4.38Å; V580-V585 HydrophobicContact CG2-CG2 3.68Å; E582-V585 PolarHBondContact O-N 3.03Å
586	S	73.6	Confident	74.9	Confident	42 Å²	42	82.3 Å²	82.3	29%	0.294	47%	0.469	S	S	.	.	S	Bend	trans	-62.5	128.3	176.6	-60.3	0	0	0	0	110.4	R491 E582	R491-S586 PolarHBondContact NE-O 2.67Å; R491-S586 PolarHBondContact NH2-O 2.94Å; R491-S586 VanDerWaalsContact NH2-O 3.1Å; E582-S586 PolarHBondContact O-N 3.22Å; E582-S586 PolarHBondContact O-OG 3.1Å
587	P	59.4	Low	73.7	Confident	115 Å²	115	81.6 Å²	81.6	75%	0.747	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-61.1	151	168.1	29	-34.1	0	0	0	108.7	T589	P587-T589 PolarHBondContact O-N 2.72Å
588	D	50.8	Low	72.3	Confident	96 Å²	96	80 Å²	80	51%	0.513	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-62.7	125.4	163.9	-72.1	-35.2	0	0	0	108	R491 E590	R491-D588 IonicContact CZ-OD1 3.05Å; R491-D588 VanDerWaalsContact CZ-OD1 3.22Å; R491-D588 IonicContact CZ-OD2 2.77Å; R491-D588 IonicContact NH1-OD1 3.31Å; R491-D588 PolarHBondContact NH1-OD1 2.94Å; R491-D588 IonicContact NH1-OD2 2.7Å; R491-D588 PolarHBondContact NH1-OD2 3.34Å; R491-D588 IonicContact NH2-OD1 3.83Å; R491-D588 PolarHBondContact NH2-OD1 2.79Å; D588-E590 HydrophobicContact CB-CG 4.3Å; D588-E590 PolarHBondContact O-N 3.18Å
589	T	38	Very low	70.7	Confident	144 Å²	144	83.1 Å²	83.1	88%	0.883	49%	0.487	S	S	*	.			trans	-60.1	90.8	147.8	17.2	0	0	0	0	106.4	P587	P587-T589 PolarHBondContact O-N 2.72Å
590	E	35.9	Very low	68.9	Low	181 Å²	181	83.6 Å²	83.6	85%	0.846	50%	0.503	S	S	*	.			trans	-58.6	151.3	179.7	-72.9	-171.3	142	0	0	111.1	D588	D588-E590 HydrophobicContact CB-CG 4.3Å; D588-E590 PolarHBondContact O-N 3.18Å
591	S	31.1	Very low	66.8	Low	196 Å²	196	91.1 Å²	91.1	100%	1.371	55%	0.549	S	S	*	.			trans	-73.6	0	-164.2	-51.2	0	0	0	0	115.4

Retrieved 591 of 591 residues in 270.5 ms (Link to these results)

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