A0A3Q0KFR7_SCHMA Loading...

Thioredoxin_16 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KFR7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 391 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	28.9	Very low	35.5	Very low	215 Å²	215	117.8 Å²	117.8	100%	1.059	58%	0.584	S	S	*	*				0	78.6	0	-77.8	176.1	77.3	0	0	109	K3	M1-K3 HydrophobicContact CE-CG 4.47Å; M1-K3 PolarHBondContact O-N 3Å
2	Y	29.7	Very low	35.6	Very low	168 Å²	168	118.8 Å²	118.8	66%	0.659	59%	0.59	S	S	*	*			trans	-72.1	107.1	152.8	-92	-95.6	0	0	0	104.4	S319	Y2-S319 WeakPolarHBondContact OH-CA 3.06Å; Y2-S319 PolarHBondContact OH-OG 3.02Å
3	K	35.5	Very low	35.5	Very low	131 Å²	131	115.7 Å²	115.7	57%	0.57	58%	0.577	S	S	*	*			trans	-73.9	133.9	-179.3	-80	-174.1	172.2	-174.6	0	108.9	M1 D5	M1-K3 HydrophobicContact CE-CG 4.47Å; M1-K3 PolarHBondContact O-N 3Å; K3-D5 HydrophobicContact CB-CB 4.1Å; K3-D5 WeakPolarHBondContact CD-OD2 3.42Å; K3-D5 IonicContact NZ-OD2 2.78Å; K3-D5 PolarHBondContact O-N 3.1Å
4	L	38.4	Very low	35.3	Very low	58 Å²	58	122.1 Å²	122.1	30%	0.304	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-47.6	-9.7	166.1	-99.5	92.3	0	0	0	114.7	R6 L7 L61	L4-R6 PolarHBondContact O-N 3.21Å; L4-L7 PolarHBondContact O-N 2.91Å; L4-L61 HydrophobicContact CD2-CD2 4.11Å
5	D	40	Very low	35.3	Very low	114 Å²	114	117.6 Å²	117.6	61%	0.61	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-52.6	-13.4	177.6	-61.9	-0.1	0	0	0	114.9	K3	K3-D5 HydrophobicContact CB-CB 4.1Å; K3-D5 WeakPolarHBondContact CD-OD2 3.42Å; K3-D5 IonicContact NZ-OD2 2.78Å; K3-D5 PolarHBondContact O-N 3.1Å
6	R	40.8	Very low	35.1	Very low	221 Å²	221	119.7 Å²	119.7	83%	0.834	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-90.8	-18.9	173.2	-84.4	-172.1	167.7	-164.4	-7	115.2	L4	L4-R6 PolarHBondContact O-N 3.21Å
7	L	36	Very low	35.3	Very low	96 Å²	96	119.2 Å²	119.2	50%	0.503	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.8	-17.6	-179.6	-77	165	0	0	0	112.9	L4 I68	L4-L7 PolarHBondContact O-N 2.91Å; L7-I68 HydrophobicContact CD1-CD1 4.12Å
8	I	34.9	Very low	35.3	Very low	71 Å²	71	120.3 Å²	120.3	36%	0.364	61%	0.61	S	S	.	*	S	Bend	trans	-129	103.8	177.8	-53.4	175.6	0	0	0	107.3	S10	I8-S10 PolarHBondContact O-N 3.48Å
9	P	38.5	Very low	35.2	Very low	70 Å²	70	116.9 Å²	116.9	46%	0.455	60%	0.596	S	S	.	*			trans	-58.4	139.1	170.9	-16.2	28.2	0	0	0	109.1	S11	P9-S11 PolarHBondContact O-N 3.31Å
10	S	33.1	Very low	35.1	Very low	93 Å²	93	114.4 Å²	114.4	65%	0.65	58%	0.582	S	S	*	*			trans	-59.4	109.5	159.6	49.9	0	0	0	0	107.2	I8 I12	I8-S10 PolarHBondContact O-N 3.48Å; S10-I12 PolarHBondContact O-N 2.97Å
11	S	35	Very low	34.9	Very low	59 Å²	59	117.6 Å²	117.6	41%	0.413	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	37.9	-171.1	55	0	0	0	0	113.8	P9 N128	P9-S11 PolarHBondContact O-N 3.31Å; S11-N128 WeakPolarHBondContact CB-ND2 3.31Å; S11-N128 PolarHBondContact OG-ND2 3.11Å
12	I	36.1	Very low	35.4	Very low	130 Å²	130	113.4 Å²	113.4	67%	0.667	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-4.3	-173.3	-59	175.4	0	0	0	112	S10	S10-I12 PolarHBondContact O-N 2.97Å
13	N	34.4	Very low	35.8	Very low	78 Å²	78	109.7 Å²	109.7	42%	0.417	56%	0.556	S	S	.	*			trans	-125.2	42	-173.5	-71	-41.9	0	0	0	115.5	A15 S262	N13-A15 PolarHBondContact O-N 2.99Å; N13-S262 WeakPolarHBondContact ND2-CB 3.35Å; N13-S262 PolarHBondContact ND2-OG 3.05Å
14	F	32.8	Very low	35.8	Very low	206 Å²	206	109 Å²	109	90%	0.904	55%	0.554	S	S	*	*			trans	-80.4	96.6	158.1	-100.1	-86.8	0	0	0	108.7
15	A	35.9	Very low	35.3	Very low	54 Å²	54	113.4 Å²	113.4	45%	0.446	58%	0.578	S	S	.	*			trans	-85.6	122.6	172.9	0	0	0	0	0	110.5	N13 H215	N13-A15 PolarHBondContact O-N 2.99Å; A15-H215 WeakPolarHBondContact CB-NE2 3.42Å
16	H	31.6	Very low	34.9	Very low	151 Å²	151	116.4 Å²	116.4	70%	0.699	59%	0.586	S	S	*	*			trans	-57.5	147	164.7	-92.9	-97.1	0	0	0	110.3	D18 T19	H16-D18 PolarHBondContact O-N 3.29Å; H16-T19 PolarHBondContact O-N 3.21Å; H16-T19 PolarHBondContact O-OG1 3.38Å
17	T	39.3	Very low	34.3	Very low	112 Å²	112	115.1 Å²	115.1	69%	0.687	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-57.5	-7.3	-179.3	44.5	0	0	0	0	115.4	T19	T17-T19 VanDerWaalsContact C-N 3.26Å; T17-T19 PolarHBondContact O-N 3.29Å
18	D	35	Very low	34	Very low	139 Å²	139	118.4 Å²	118.4	74%	0.743	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-78	-7	-175.6	-58.6	-23.5	0	0	0	113.5	H16	H16-D18 PolarHBondContact O-N 3.29Å
19	T	32.8	Very low	33.7	Very low	56 Å²	56	123.1 Å²	123.1	34%	0.344	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-109.5	18.5	-178.5	60.9	0	0	0	0	114.7	H16 T17	H16-T19 PolarHBondContact O-N 3.21Å; H16-T19 PolarHBondContact O-OG1 3.38Å; T17-T19 VanDerWaalsContact C-N 3.26Å; T17-T19 PolarHBondContact O-N 3.29Å
20	M	33.3	Very low	33.2	Very low	65 Å²	65	126.8 Å²	126.8	32%	0.32	64%	0.636	S	S	.	*			trans	-104.3	122	-177.6	-53.8	-163.6	80.3	0	0	111.7	F213 I258	M20-F213 HydrophobicContact CE-CB 4.04Å; M20-I258 HydrophobicContact CE-CB 4.1Å; M20-I258 HydrophobicContact CE-CD1 3.63Å; M20-I258 HydrophobicContact CE-CG1 3.63Å; M20-I258 HydrophobicContact CE-CG2 3.37Å; M20-I258 HydrophobicContact SD-CD1 4.47Å
21	Y	31.7	Very low	33.2	Very low	182 Å²	182	131 Å²	131	71%	0.714	64%	0.643	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.5	135.6	171.6	-56.9	-83.6	0	0	0	110.1
22	K	37.7	Very low	33.1	Very low	128 Å²	128	135.8 Å²	135.8	56%	0.557	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.8	136.5	170.4	-169.6	179.3	-180	-173	0	108.5	E24 F213	K22-E24 VanDerWaalsContact C-N 3.31Å; K22-E24 HydrophobicContact CD-CG 4.49Å; K22-E24 PolarHBondContact O-N 2.83Å; K22-F213 HydrophobicContact CB-CD1 4.37Å; K22-F213 HydrophobicContact CB-CE1 4.11Å; K22-F213 HydrophobicContact CG-CE1 4.09Å
23	L	38.2	Very low	33	Very low	90 Å²	90	137 Å²	137	47%	0.471	67%	0.666	S	S	.	*			trans	-65.6	94.8	167.4	-107.4	131.5	0	0	0	108.3	V214 L221	L23-V214 HydrophobicContact CD1-CG2 3.6Å; L23-L221 HydrophobicContact CD1-CD1 4.14Å
24	E	35.8	Very low	32.8	Very low	116 Å²	116	140.3 Å²	140.3	54%	0.542	68%	0.684	S	S	.	*			trans	-97.3	140.7	163.4	-71.2	-175.4	171.5	0	0	108.5	K22 F26	K22-E24 VanDerWaalsContact C-N 3.31Å; K22-E24 HydrophobicContact CD-CG 4.49Å; K22-E24 PolarHBondContact O-N 2.83Å; E24-F26 VanDerWaalsContact C-N 3.33Å; E24-F26 HydrophobicContact CB-CD2 3.9Å; E24-F26 HydrophobicContact CB-CE2 3.74Å; E24-F26 PolarHBondContact O-N 2.87Å
25	N	28.8	Very low	32.9	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	68%	0.681	S	S	*	*			trans	-58	87.7	179.2	-74.7	-26.5	0	0	0	111.2
26	F	31.6	Very low	32.6	Very low	176 Å²	176	139.6 Å²	139.6	77%	0.772	70%	0.701	S	S	*	*			trans	-106.8	88.1	172.9	-81.8	-79.4	0	0	0	110.5	E24	E24-F26 VanDerWaalsContact C-N 3.33Å; E24-F26 HydrophobicContact CB-CD2 3.9Å; E24-F26 HydrophobicContact CB-CE2 3.74Å; E24-F26 PolarHBondContact O-N 2.87Å
27	Y	28.9	Very low	32.6	Very low	194 Å²	194	138.4 Å²	138.4	76%	0.761	71%	0.71	S	S	*	*			trans	-58.4	141.8	148	-84.8	-95.8	0	0	0	110
28	H	27.9	Very low	32	Very low	166 Å²	166	138 Å²	138	77%	0.769	71%	0.711	S	S	*	*			trans	56.8	107.5	160.8	-65.3	-66.2	0	0	0	118
29	L	29.8	Very low	31.8	Very low	169 Å²	169	139.3 Å²	139.3	89%	0.885	72%	0.717	S	S	*	*				-176.7	129.2	106.5	-130.2	70.7	0	0	0	111.6
30	D	28	Very low	31.7	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	74%	0.74	S	S	*	*			trans	-57.5	140.4	161.3	-61.1	-62.7	0	0	0	111.8
31	K	32.5	Very low	31.7	Very low	182 Å²	182	149.5 Å²	149.5	79%	0.791	76%	0.763	S	S	*	*				159.8	121.6	120.2	-89.1	178.5	176.4	-175.4	0	113.4
32	E	32.9	Very low	31.7	Very low	158 Å²	158	146.1 Å²	146.1	74%	0.738	77%	0.766	S	S	*	*			trans	36.9	119.3	132.4	-64.2	175.5	156	0	0	119.3
33	N	33.5	Very low	31.3	Very low	155 Å²	155	146.9 Å²	146.9	83%	0.829	78%	0.781	S	S	*	*				-175.8	141.9	98	-93	-41.1	0	0	0	113.8
34	D	31.6	Very low	31	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	80%	0.801	S	S	*	*			trans	-58.5	151.6	179.1	-66.8	-51.5	0	0	0	114.9
35	S	34.7	Very low	30.6	Very low	121 Å²	121	149.9 Å²	149.9	85%	0.846	81%	0.814	S	S	*	*				169.2	114.1	105.9	43.1	0	0	0	0	112.2
36	S	29.1	Very low	30.8	Very low	124 Å²	124	148.6 Å²	148.6	87%	0.867	81%	0.811	S	S	*	*			trans	-85.2	138.7	164.3	62.7	0	0	0	0	110.5
37	S	31.4	Very low	31	Very low	125 Å²	125	145.6 Å²	145.6	87%	0.874	81%	0.813	S	S	*	*			trans	-131.1	141.9	156.1	74.1	0	0	0	0	111.2
38	C	27.3	Very low	31.4	Very low	104 Å²	104	143.5 Å²	143.5	70%	0.703	81%	0.814	S	S	*	*			trans	-86.6	144.1	-166.8	178.6	0	0	0	0	111.6
39	L	30.8	Very low	32	Very low	166 Å²	166	144.3 Å²	144.3	87%	0.869	82%	0.819	S	S	*	*			trans	-139.1	102.9	155.6	-91.7	164.2	0	0	0	109.2
40	Q	29.6	Very low	32.8	Very low	178 Å²	178	140.6 Å²	140.6	83%	0.832	80%	0.799	S	S	*	*			trans	-76.2	131.7	160.4	-78.6	179.1	-41.6	0	0	108.8
41	I	34.3	Very low	34.7	Very low	158 Å²	158	137.1 Å²	137.1	81%	0.81	78%	0.783	S	S	*	*			trans	-120.3	132.4	163.1	-63.2	177.9	0	0	0	108
42	S	31.7	Very low	36.4	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	78%	0.777	S	S	*	*			trans	-68	140.7	-165	-29.5	0	0	0	0	114.2
43	T	28.4	Very low	37.7	Very low	143 Å²	143	132.6 Å²	132.6	88%	0.877	76%	0.76	S	S	*	*			trans	-84.1	112.1	163.6	33	0	0	0	0	110.7
44	E	32	Very low	39	Very low	191 Å²	191	128.1 Å²	128.1	89%	0.893	74%	0.737	S	S	*	*			trans	-141.9	119.7	161.9	-93.6	-177.9	174.3	0	0	110.9
45	G	27.5	Very low	40.6	Very low	79 Å²	79	125.9 Å²	125.9	81%	0.814	72%	0.72	S	S	*	*			trans	72.8	83.8	140.3	0	0	0	0	0	119.8
46	V	33.1	Very low	42.3	Very low	123 Å²	123	123 Å²	123	75%	0.745	70%	0.7	S	S	*	*			trans	-139.7	112.5	145.2	-172.6	0	0	0	0	108.8	N48	V46-N48 PolarHBondContact O-N 3.41Å; V46-N48 VanDerWaalsContact O-N 3.16Å
47	S	36.5	Very low	44	Very low	114 Å²	114	118.4 Å²	118.4	80%	0.797	67%	0.665	S	S	*	*			trans	-63	107.2	167.8	46.9	0	0	0	0	109.2	E49	S47-E49 VanDerWaalsContact C-N 3.32Å; S47-E49 PolarHBondContact O-N 3.21Å
48	N	38	Very low	45.6	Very low	149 Å²	149	117 Å²	117	80%	0.797	65%	0.647	S	S	*	*			trans	-75	71.4	-176.6	-75.6	-20.4	0	0	0	112.7	V46 L50	V46-N48 PolarHBondContact O-N 3.41Å; V46-N48 VanDerWaalsContact O-N 3.16Å; N48-L50 PolarHBondContact O-N 2.92Å
49	E	39.6	Very low	47.8	Very low	184 Å²	184	118.3 Å²	118.3	86%	0.86	64%	0.641	S	S	*	*			trans	-80.2	107.5	152.9	-78.8	-169.4	162.7	0	0	108.1	S47 T51	S47-E49 VanDerWaalsContact C-N 3.32Å; S47-E49 PolarHBondContact O-N 3.21Å; E49-T51 PolarHBondContact O-N 3.47Å
50	L	46.2	Very low	49.6	Very low	91 Å²	91	112.2 Å²	112.2	48%	0.476	61%	0.608	S	S	.	*			trans	-53.8	126.9	171.7	-78.7	159.4	0	0	0	108.9	N48 D54 K55 L58	N48-L50 PolarHBondContact O-N 2.92Å; L50-D54 HydrophobicContact CB-CB 4.21Å; L50-D54 HydrophobicContact CD2-CB 3.51Å; L50-D54 HydrophobicContact CG-CB 4.48Å; L50-K55 HydrophobicContact CB-CG 4.09Å; L50-K55 WeakPolarHBondContact O-CE 3.33Å; L50-L58 HydrophobicContact CD1-CD1 3.77Å; L50-L58 HydrophobicContact CD2-CD1 4.06Å
51	T	67.9	Low	51.3	Low	74 Å²	74	106.2 Å²	106.2	45%	0.454	58%	0.581	S	S	.	*			trans	-61.6	153.1	175.5	66.5	0	0	0	0	109.4	E49 R53 D54 K55	E49-T51 PolarHBondContact O-N 3.47Å; T51-R53 PolarHBondContact O-N 3.41Å; T51-D54 WeakPolarHBondContact CB-OD2 3.35Å; T51-D54 PolarHBondContact N-OD2 2.9Å; T51-D54 PolarHBondContact O-N 3.37Å; T51-D54 PolarHBondContact OG1-N 3.42Å; T51-D54 VanDerWaalsContact OG1-N 3.16Å; T51-D54 PolarHBondContact OG1-OD2 2.86Å; T51-K55 PolarHBondContact O-N 2.74Å
52	E	67.9	Low	52.9	Low	141 Å²	141	100.3 Å²	100.3	66%	0.659	56%	0.56	S	S	*	*	H	α-helix	trans	-52.8	-28.9	173.6	-77.3	-60.6	125.5	0	0	112	K55 S56	E52-K55 IonicContact OE1-NZ 2.76Å; E52-K55 PolarHBondContact OE1-NZ 2.92Å; E52-S56 WeakPolarHBondContact O-CB 3.49Å; E52-S56 PolarHBondContact O-N 3.2Å
53	R	60.8	Low	54.7	Low	104 Å²	104	98 Å²	98	39%	0.392	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-47.2	172.9	-172.1	170.7	-174.9	149.2	-1.5	112.5	T51 K55 S56 L57 H115 N119	T51-R53 PolarHBondContact O-N 3.41Å; R53-K55 VanDerWaalsContact C-N 3.32Å; R53-K55 PolarHBondContact O-N 3.26Å; R53-S56 WeakPolarHBondContact O-CB 3.45Å; R53-S56 PolarHBondContact O-N 2.88Å; R53-L57 PolarHBondContact O-N 3.45Å; R53-H115 WeakPolarHBondContact CG-NE2 3.42Å; R53-H115 PolarHBondContact NE-CE1 3.42Å; R53-H115 VanDerWaalsContact NE-CE1 3.29Å; R53-H115 PolarHBondContact NE-NE2 3.01Å; R53-H115 PolarHBondContact NH2-O 2.91Å; R53-H115 VanDerWaalsContact NH2-O 3.11Å; R53-N119 PolarHBondContact NH1-OD1 3.46Å; R53-N119 PolarHBondContact NH2-OD1 2.92Å; R53-N119 VanDerWaalsContact NH2-OD1 3.08Å
54	D	59.8	Low	56.7	Low	62 Å²	62	91.7 Å²	91.7	33%	0.332	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-37.3	176.1	-56.1	-43.4	0	0	0	111.8	L50 T51 S56 L57 L58	L50-D54 HydrophobicContact CB-CB 4.21Å; L50-D54 HydrophobicContact CD2-CB 3.51Å; L50-D54 HydrophobicContact CG-CB 4.48Å; T51-D54 WeakPolarHBondContact CB-OD2 3.35Å; T51-D54 PolarHBondContact N-OD2 2.9Å; T51-D54 PolarHBondContact O-N 3.37Å; T51-D54 PolarHBondContact OG1-N 3.42Å; T51-D54 VanDerWaalsContact OG1-N 3.16Å; T51-D54 PolarHBondContact OG1-OD2 2.86Å; D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 PolarHBondContact O-N 3.21Å; D54-L57 PolarHBondContact O-N 3.2Å; D54-L58 WeakPolarHBondContact O-CB 3.32Å; D54-L58 WeakPolarHBondContact O-CG 3.41Å; D54-L58 PolarHBondContact O-N 3.48Å
55	K	65.9	Low	58.2	Low	102 Å²	102	85.7 Å²	85.7	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-41.2	173.1	-65.1	-179.6	-166.9	166.4	0	111.6	L50 T51 E52 R53 K59	L50-K55 HydrophobicContact CB-CG 4.09Å; L50-K55 WeakPolarHBondContact O-CE 3.33Å; T51-K55 PolarHBondContact O-N 2.74Å; E52-K55 IonicContact OE1-NZ 2.76Å; E52-K55 PolarHBondContact OE1-NZ 2.92Å; R53-K55 VanDerWaalsContact C-N 3.32Å; R53-K55 PolarHBondContact O-N 3.26Å; K55-K59 WeakPolarHBondContact O-CB 3.38Å; K55-K59 PolarHBondContact O-N 3.29Å
56	S	70.2	Confident	60.2	Low	61 Å²	61	87 Å²	87	43%	0.427	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-43.8	174.9	-167.9	0	0	0	0	111.7	E52 R53 D54 K59 E60	E52-S56 WeakPolarHBondContact O-CB 3.49Å; E52-S56 PolarHBondContact O-N 3.2Å; R53-S56 WeakPolarHBondContact O-CB 3.45Å; R53-S56 PolarHBondContact O-N 2.88Å; D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 PolarHBondContact O-N 3.21Å; S56-K59 WeakPolarHBondContact O-CB 3.3Å; S56-K59 PolarHBondContact O-N 3.23Å; S56-E60 WeakPolarHBondContact O-CG 3.36Å; S56-E60 PolarHBondContact O-N 3Å
57	L	65.9	Low	61.9	Low	26 Å²	26	82 Å²	82	14%	0.136	43%	0.429	C	S	.	.	H	α-helix	trans	-63.5	-45	177.3	-173.7	75.2	0	0	0	111.7	R53 D54 K59 E60 L61 I112 H115 Y116	R53-L57 PolarHBondContact O-N 3.45Å; D54-L57 PolarHBondContact O-N 3.2Å; L57-K59 VanDerWaalsContact C-N 3.27Å; L57-K59 PolarHBondContact O-N 3.36Å; L57-E60 PolarHBondContact O-N 3.02Å; L57-L61 HydrophobicContact CG-CD1 4.29Å; L57-L61 WeakPolarHBondContact O-CG 3.35Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-I112 HydrophobicContact CD1-CG2 4.27Å; L57-H115 HydrophobicContact CD1-CB 4.47Å; L57-Y116 HydrophobicContact CD1-CE2 4.4Å
58	L	63.9	Low	63.4	Low	95 Å²	95	78.7 Å²	78.7	50%	0.497	40%	0.402	S	S	.	.	H	α-helix	trans	-61.7	-36.2	176.4	-76.9	167.9	0	0	0	112.1	L50 D54 G62	L50-L58 HydrophobicContact CD1-CD1 3.77Å; L50-L58 HydrophobicContact CD2-CD1 4.06Å; D54-L58 WeakPolarHBondContact O-CB 3.32Å; D54-L58 WeakPolarHBondContact O-CG 3.41Å; D54-L58 PolarHBondContact O-N 3.48Å; L58-G62 PolarHBondContact O-N 3.34Å
59	K	73.3	Confident	65	Low	133 Å²	133	74 Å²	74	58%	0.578	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-46	174.7	-174.3	-175.6	176.8	-170.9	0	111.7	K55 S56 L57 G62 Q63	K55-K59 WeakPolarHBondContact O-CB 3.38Å; K55-K59 PolarHBondContact O-N 3.29Å; S56-K59 WeakPolarHBondContact O-CB 3.3Å; S56-K59 PolarHBondContact O-N 3.23Å; L57-K59 VanDerWaalsContact C-N 3.27Å; L57-K59 PolarHBondContact O-N 3.36Å; K59-G62 PolarHBondContact O-N 3.02Å; K59-Q63 WeakPolarHBondContact O-CG 3.41Å; K59-Q63 PolarHBondContact O-N 2.76Å
60	E	69.9	Low	66.4	Low	37 Å²	37	67 Å²	67	17%	0.173	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-40.2	176.3	-68.6	-69.9	150.2	0	0	111.6	S56 L57 G62 Q63 L64 H108 I112	S56-E60 WeakPolarHBondContact O-CG 3.36Å; S56-E60 PolarHBondContact O-N 3Å; L57-E60 PolarHBondContact O-N 3.02Å; E60-G62 PolarHBondContact O-N 3.28Å; E60-Q63 PolarHBondContact O-N 2.98Å; E60-L64 WeakPolarHBondContact O-CB 3.3Å; E60-L64 PolarHBondContact O-N 3.39Å; E60-H108 IonicContact OE2-CE1 3.65Å; E60-H108 IonicContact OE2-CG 3.81Å; E60-H108 IonicContact OE2-ND1 2.77Å; E60-H108 PolarHBondContact OE2-ND1 2.73Å; E60-I112 HydrophobicContact CB-CG1 4.18Å
61	L	65.3	Low	67.6	Low	52 Å²	52	64 Å²	64	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-38.5	174.5	-75	171.4	0	0	0	112.5	L4 L57 L64 D65 I112	L4-L61 HydrophobicContact CD2-CD2 4.11Å; L57-L61 HydrophobicContact CG-CD1 4.29Å; L57-L61 WeakPolarHBondContact O-CG 3.35Å; L57-L61 PolarHBondContact O-N 3.23Å; L61-L64 WeakPolarHBondContact O-CB 3.3Å; L61-L64 PolarHBondContact O-N 3.49Å; L61-D65 PolarHBondContact O-N 3.48Å; L61-D65 VanDerWaalsContact O-N 3.11Å; L61-I112 HydrophobicContact CD2-CD1 4.05Å
62	G	66.3	Low	67.6	Low	34 Å²	34	65 Å²	65	35%	0.351	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-44.2	173.6	0	0	0	0	0	112	L58 K59 E60 L64 D65 D66	L58-G62 PolarHBondContact O-N 3.34Å; K59-G62 PolarHBondContact O-N 3.02Å; E60-G62 PolarHBondContact O-N 3.28Å; G62-L64 VanDerWaalsContact C-N 3.31Å; G62-L64 PolarHBondContact O-N 3.3Å; G62-D65 PolarHBondContact O-N 2.97Å; G62-D66 PolarHBondContact O-N 2.92Å
63	Q	70.3	Confident	67.8	Low	62 Å²	62	63 Å²	63	29%	0.29	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-35.4	175.7	-71.3	171.2	-15.6	0	0	112.3	K59 E60 D66 N67 H108	K59-Q63 WeakPolarHBondContact O-CG 3.41Å; K59-Q63 PolarHBondContact O-N 2.76Å; E60-Q63 PolarHBondContact O-N 2.98Å; Q63-D66 PolarHBondContact O-N 3.27Å; Q63-N67 WeakPolarHBondContact O-CB 3.49Å; Q63-N67 PolarHBondContact O-N 2.7Å; Q63-N67 PolarHBondContact O-ND2 3.01Å; Q63-N67 PolarHBondContact O-OD1 3.33Å; Q63-H108 PolarHBondContact OE1-CE1 3.03Å; Q63-H108 VanDerWaalsContact OE1-CE1 3.23Å
64	L	69.5	Low	68.3	Low	11 Å²	11	59.8 Å²	59.8	6%	0.058	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-46.3	173.6	-169.8	77.2	0	0	0	111.5	E60 L61 G62 N67 I68 L105 H108 I109 I112	E60-L64 WeakPolarHBondContact O-CB 3.3Å; E60-L64 PolarHBondContact O-N 3.39Å; L61-L64 WeakPolarHBondContact O-CB 3.3Å; L61-L64 PolarHBondContact O-N 3.49Å; G62-L64 VanDerWaalsContact C-N 3.31Å; G62-L64 PolarHBondContact O-N 3.3Å; L64-N67 PolarHBondContact O-N 3.41Å; L64-I68 HydrophobicContact CG-CD1 4.09Å; L64-I68 VanDerWaalsContact O-CG1 3.29Å; L64-I68 WeakPolarHBondContact O-CG1 3.48Å; L64-I68 PolarHBondContact O-N 2.85Å; L64-L105 HydrophobicContact CD1-CD1 3.46Å; L64-L105 VanDerWaalsContact CD1-CD1 3.46Å; L64-L105 HydrophobicContact CG-CD1 4.27Å; L64-H108 HydrophobicContact CD1-CB 3.95Å; L64-I109 HydrophobicContact CD1-CD1 4.16Å; L64-I109 HydrophobicContact CD1-CG1 3.68Å; L64-I112 HydrophobicContact CD2-CD1 4.08Å
65	D	65	Low	68.6	Low	65 Å²	65	63 Å²	63	35%	0.348	33%	0.333	S	S	.	.	H	α-helix	trans	-63.6	-41	178.2	-166.7	42.1	0	0	0	111.8	L61 G62 S69	L61-D65 PolarHBondContact O-N 3.48Å; L61-D65 VanDerWaalsContact O-N 3.11Å; G62-D65 PolarHBondContact O-N 2.97Å; D65-S69 VanDerWaalsContact O-CB 3.27Å; D65-S69 WeakPolarHBondContact O-CB 3.49Å; D65-S69 PolarHBondContact O-N 3.23Å; D65-S69 PolarHBondContact O-OG 2.9Å
66	D	69.3	Low	68.6	Low	107 Å²	107	65 Å²	65	57%	0.572	34%	0.342	S	S	*	.	H	α-helix	trans	-62.3	-43.8	174.8	-72.8	-25.7	0	0	0	111.5	G62 Q63 S69 S70	G62-D66 PolarHBondContact O-N 2.92Å; Q63-D66 PolarHBondContact O-N 3.27Å; D66-S69 WeakPolarHBondContact O-CB 3.49Å; D66-S69 PolarHBondContact O-N 3.15Å; D66-S70 WeakPolarHBondContact O-CB 3.38Å; D66-S70 PolarHBondContact O-N 3.06Å
67	N	69.1	Low	68.5	Low	18 Å²	18	65.4 Å²	65.4	10%	0.096	35%	0.345	C	S	.	.	H	α-helix	trans	-69.3	-42	179.3	-71.4	-10.2	0	0	0	112.4	Q63 L64 S69 S70 L71 L105 H108	Q63-N67 WeakPolarHBondContact O-CB 3.49Å; Q63-N67 PolarHBondContact O-N 2.7Å; Q63-N67 PolarHBondContact O-ND2 3.01Å; Q63-N67 PolarHBondContact O-OD1 3.33Å; L64-N67 PolarHBondContact O-N 3.41Å; N67-S69 VanDerWaalsContact C-N 3.28Å; N67-S69 PolarHBondContact O-N 2.92Å; N67-S70 WeakPolarHBondContact O-CB 3.16Å; N67-S70 PolarHBondContact O-N 2.73Å; N67-L71 WeakPolarHBondContact O-CB 3.5Å; N67-L71 PolarHBondContact O-N 3.12Å; N67-L105 HydrophobicContact CB-CD1 4.29Å; N67-H108 PolarHBondContact ND2-CD2 3.45Å; N67-H108 PolarHBondContact ND2-NE2 3.48Å; N67-H108 VanDerWaalsContact ND2-NE2 3.19Å
68	I	67.3	Low	68.3	Low	44 Å²	44	68.4 Å²	68.4	23%	0.226	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-43.9	173.4	-69.5	169.9	0	0	0	109.6	L7 L64 L71 L72 L105	L7-I68 HydrophobicContact CD1-CD1 4.12Å; L64-I68 HydrophobicContact CG-CD1 4.09Å; L64-I68 VanDerWaalsContact O-CG1 3.29Å; L64-I68 WeakPolarHBondContact O-CG1 3.48Å; L64-I68 PolarHBondContact O-N 2.85Å; I68-L71 PolarHBondContact O-N 2.71Å; I68-L72 HydrophobicContact CG2-CD1 3.92Å; I68-L72 HydrophobicContact CG2-CG 4.38Å; I68-L72 WeakPolarHBondContact O-CB 3.41Å; I68-L72 VanDerWaalsContact O-CG 3.26Å; I68-L72 WeakPolarHBondContact O-CG 3.32Å; I68-L72 PolarHBondContact O-N 2.91Å; I68-L105 HydrophobicContact CD1-CD1 4.35Å; I68-L105 HydrophobicContact CG1-CD1 3.63Å
69	S	70.8	Confident	68	Low	50 Å²	50	69.8 Å²	69.8	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-43.3	177.3	-65.3	0	0	0	0	112.2	D65 D66 N67 N73	D65-S69 VanDerWaalsContact O-CB 3.27Å; D65-S69 WeakPolarHBondContact O-CB 3.49Å; D65-S69 PolarHBondContact O-N 3.23Å; D65-S69 PolarHBondContact O-OG 2.9Å; D66-S69 WeakPolarHBondContact O-CB 3.49Å; D66-S69 PolarHBondContact O-N 3.15Å; N67-S69 VanDerWaalsContact C-N 3.28Å; N67-S69 PolarHBondContact O-N 2.92Å; S69-N73 WeakPolarHBondContact O-CB 3.39Å; S69-N73 VanDerWaalsContact O-CG 3.23Å; S69-N73 PolarHBondContact O-N 3.37Å; S69-N73 PolarHBondContact O-ND2 2.98Å
70	S	70.9	Confident	67	Low	39 Å²	39	67.9 Å²	67.9	27%	0.273	36%	0.364	S	S	.	.	H	α-helix	trans	-59.1	-48.8	173.6	179.6	0	0	0	0	111.2	D66 N67 L72 N73 M74 E101	D66-S70 WeakPolarHBondContact O-CB 3.38Å; D66-S70 PolarHBondContact O-N 3.06Å; N67-S70 WeakPolarHBondContact O-CB 3.16Å; N67-S70 PolarHBondContact O-N 2.73Å; S70-L72 PolarHBondContact O-N 3.16Å; S70-N73 WeakPolarHBondContact O-CB 3.21Å; S70-N73 PolarHBondContact O-N 2.92Å; S70-N73 VanDerWaalsContact O-N 3.14Å; S70-M74 PolarHBondContact O-N 3.47Å; S70-E101 WeakPolarHBondContact CB-OE2 3.26Å; S70-E101 PolarHBondContact OG-OE2 3.22Å
71	L	69.8	Low	66	Low	28 Å²	28	74.5 Å²	74.5	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-61.7	-44.9	-179.8	-153.5	101.3	0	0	0	112.1	N67 I68 N73 M74 F75 F98 E101 L102	N67-L71 WeakPolarHBondContact O-CB 3.5Å; N67-L71 PolarHBondContact O-N 3.12Å; I68-L71 PolarHBondContact O-N 2.71Å; L71-N73 VanDerWaalsContact C-N 3.31Å; L71-N73 PolarHBondContact O-N 2.88Å; L71-M74 HydrophobicContact CD1-CE 4.12Å; L71-M74 HydrophobicContact CG-CE 4.46Å; L71-M74 PolarHBondContact O-N 3.25Å; L71-F75 WeakPolarHBondContact O-CB 3.31Å; L71-F75 PolarHBondContact O-N 2.97Å; L71-F98 HydrophobicContact CD1-CD2 4.3Å; L71-F98 HydrophobicContact CD1-CE2 4.02Å; L71-F98 HydrophobicContact CD1-CZ 4.43Å; L71-F98 HydrophobicContact CD2-CE2 3.97Å; L71-F98 HydrophobicContact CD2-CZ 4.06Å; L71-F98 HydrophobicContact CG-CD2 4.29Å; L71-F98 HydrophobicContact CG-CE2 3.66Å; L71-F98 HydrophobicContact CG-CZ 4.2Å; L71-E101 HydrophobicContact CD1-CB 3.91Å; L71-L102 HydrophobicContact CD1-CB 4.47Å; L71-L102 HydrophobicContact CD1-CD2 3.71Å; L71-L102 HydrophobicContact CD1-CG 3.8Å; L71-L102 HydrophobicContact CD2-CD2 3.76Å; L71-L102 HydrophobicContact CG-CD2 4.36Å
72	L	68.2	Low	65	Low	94 Å²	94	79 Å²	79	49%	0.492	42%	0.417	S	S	.	.	H	α-helix	trans	-61.9	-39.6	175.3	-73.8	172	0	0	0	111.6	I68 S70 K76	I68-L72 HydrophobicContact CG2-CD1 3.92Å; I68-L72 HydrophobicContact CG2-CG 4.38Å; I68-L72 WeakPolarHBondContact O-CB 3.41Å; I68-L72 VanDerWaalsContact O-CG 3.26Å; I68-L72 WeakPolarHBondContact O-CG 3.32Å; I68-L72 PolarHBondContact O-N 2.91Å; S70-L72 PolarHBondContact O-N 3.16Å; L72-K76 WeakPolarHBondContact O-CB 3.43Å; L72-K76 WeakPolarHBondContact O-CG 3.16Å; L72-K76 PolarHBondContact O-N 2.94Å
73	N	72.3	Confident	63.8	Low	98 Å²	98	84 Å²	84	52%	0.524	44%	0.436	S	S	.	.	H	α-helix	trans	-68.5	-41.4	176.7	-74.1	-24.9	0	0	0	112.1	S69 S70 L71 K76 S77	S69-N73 WeakPolarHBondContact O-CB 3.39Å; S69-N73 VanDerWaalsContact O-CG 3.23Å; S69-N73 PolarHBondContact O-N 3.37Å; S69-N73 PolarHBondContact O-ND2 2.98Å; S70-N73 WeakPolarHBondContact O-CB 3.21Å; S70-N73 PolarHBondContact O-N 2.92Å; S70-N73 VanDerWaalsContact O-N 3.14Å; L71-N73 VanDerWaalsContact C-N 3.31Å; L71-N73 PolarHBondContact O-N 2.88Å; N73-K76 PolarHBondContact O-N 3.41Å; N73-S77 WeakPolarHBondContact O-CB 3.37Å; N73-S77 PolarHBondContact O-N 3.14Å
74	M	70.9	Confident	62.6	Low	38 Å²	38	85.9 Å²	85.9	19%	0.187	46%	0.455	C	S	.	.	H	α-helix	trans	-62.7	-45.2	173.9	-75.9	-166.5	-62.5	0	0	111.6	S70 L71 K76 S77 Y78 N97 F98 E101	S70-M74 PolarHBondContact O-N 3.47Å; L71-M74 HydrophobicContact CD1-CE 4.12Å; L71-M74 HydrophobicContact CG-CE 4.46Å; L71-M74 PolarHBondContact O-N 3.25Å; M74-K76 VanDerWaalsContact C-N 3.31Å; M74-K76 PolarHBondContact O-N 2.8Å; M74-S77 WeakPolarHBondContact CA-OG 3.39Å; M74-S77 CarbonylContact O-C 3.53Å; M74-S77 WeakPolarHBondContact O-CA 3.44Å; M74-S77 PolarHBondContact O-N 3.38Å; M74-S77 PolarHBondContact O-OG 3.41Å; M74-Y78 PolarHBondContact O-N 2.87Å; M74-N97 HydrophobicContact SD-CB 4.3Å; M74-F98 HydrophobicContact CB-CD2 4.33Å; M74-F98 HydrophobicContact CE-CB 4.49Å; M74-F98 HydrophobicContact CE-CD2 3.95Å; M74-E101 HydrophobicContact CE-CB 3.44Å; M74-E101 VanDerWaalsContact CE-CB 3.44Å; M74-E101 HydrophobicContact CE-CG 3.4Å; M74-E101 HydrophobicContact SD-CG 4.09Å
75	F	66.8	Low	61.4	Low	128 Å²	128	92.6 Å²	92.6	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-60.4	-41.8	177.2	-165.4	-95.4	0	0	0	111.3	L71 S77 Y78 F98	L71-F75 WeakPolarHBondContact O-CB 3.31Å; L71-F75 PolarHBondContact O-N 2.97Å; F75-S77 VanDerWaalsContact C-N 3.28Å; F75-S77 PolarHBondContact O-N 3.45Å; F75-Y78 PolarHBondContact O-N 3.45Å; F75-F98 HydrophobicContact CD2-CE2 4.32Å; F75-F98 HydrophobicContact CD2-CZ 4.43Å
76	K	66.1	Low	60.3	Low	146 Å²	146	97.7 Å²	97.7	64%	0.635	52%	0.518	S	S	*	.	H	α-helix	trans	-61.3	-34.5	172.4	-74.6	169.6	-175.8	174.4	0	113.1	L72 N73 M74	L72-K76 WeakPolarHBondContact O-CB 3.43Å; L72-K76 WeakPolarHBondContact O-CG 3.16Å; L72-K76 PolarHBondContact O-N 2.94Å; N73-K76 PolarHBondContact O-N 3.41Å; M74-K76 VanDerWaalsContact C-N 3.31Å; M74-K76 PolarHBondContact O-N 2.8Å
77	S	68.2	Low	59.1	Low	68 Å²	68	93.8 Å²	93.8	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-81.4	-17.3	179.3	80	0	0	0	0	113.6	N73 M74 F75 N79	N73-S77 WeakPolarHBondContact O-CB 3.37Å; N73-S77 PolarHBondContact O-N 3.14Å; M74-S77 WeakPolarHBondContact CA-OG 3.39Å; M74-S77 CarbonylContact O-C 3.53Å; M74-S77 WeakPolarHBondContact O-CA 3.44Å; M74-S77 PolarHBondContact O-N 3.38Å; M74-S77 PolarHBondContact O-OG 3.41Å; F75-S77 VanDerWaalsContact C-N 3.28Å; F75-S77 PolarHBondContact O-N 3.45Å; S77-N79 PolarHBondContact O-N 3.22Å; S77-N79 VanDerWaalsContact O-N 3.15Å
78	Y	61.2	Low	58.3	Low	90 Å²	90	100 Å²	100	35%	0.353	54%	0.536	S	S	.	.			trans	-76.1	102.2	178.9	-169.9	-99.6	0	0	0	109.3	M74 F75 P80	M74-Y78 PolarHBondContact O-N 2.87Å; F75-Y78 PolarHBondContact O-N 3.45Å; Y78-P80 HydrophobicContact CD1-CG 4.31Å; Y78-P80 HydrophobicContact CE1-CB 3.9Å; Y78-P80 HydrophobicContact CE1-CG 4.02Å; Y78-P80 WeakPolarHBondContact O-CD 3.37Å
79	N	57.8	Low	57.6	Low	124 Å²	124	101.9 Å²	101.9	66%	0.663	56%	0.557	S	S	*	*			trans	-118.6	90.3	-177.4	-144.6	-9.4	0	0	0	108.6	S77 K81	S77-N79 PolarHBondContact O-N 3.22Å; S77-N79 VanDerWaalsContact O-N 3.15Å; N79-K81 PolarHBondContact O-N 3.08Å
80	P	52.2	Low	56.9	Low	92 Å²	92	105.6 Å²	105.6	60%	0.597	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	12.5	-169.4	25.8	-32.6	0	0	0	115	Y78	Y78-P80 HydrophobicContact CD1-CG 4.31Å; Y78-P80 HydrophobicContact CE1-CB 3.9Å; Y78-P80 HydrophobicContact CE1-CG 4.02Å; Y78-P80 WeakPolarHBondContact O-CD 3.37Å
81	K	49.4	Very low	56.4	Low	176 Å²	176	107.6 Å²	107.6	77%	0.765	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	20.4	-166.6	-76.8	-171	176.3	179.2	0	116.8	N79	N79-K81 PolarHBondContact O-N 3.08Å
82	N	44.5	Very low	55.9	Low	147 Å²	147	109.1 Å²	109.1	79%	0.786	59%	0.593	S	S	*	*	S	Bend	trans	-101.8	98.5	169.6	-85	-3	0	0	0	111.8
83	N	41.3	Very low	55.9	Low	140 Å²	140	107.2 Å²	107.2	75%	0.749	59%	0.588	S	S	*	*			trans	28.9	110.2	147	-65.6	-14.5	0	0	0	118.2
84	S	43.8	Very low	55.7	Low	100 Å²	100	106.7 Å²	106.7	70%	0.699	58%	0.581	S	S	*	*	S	Bend	trans	12.7	124.7	140.2	45.3	0	0	0	0	118.5
85	N	43.7	Very low	55.4	Low	152 Å²	152	106.1 Å²	106.1	81%	0.813	58%	0.581	S	S	*	*	S	Bend	trans	100.6	8.1	153	-57.9	-11	0	0	0	119.4
86	L	41.9	Very low	55.7	Low	173 Å²	173	103 Å²	103	91%	0.906	58%	0.575	S	S	*	*	S	Bend	trans	-157.1	70.5	171.7	-135.5	98.8	0	0	0	111.5
87	G	44.1	Very low	56.1	Low	24 Å²	24	100.1 Å²	100.1	25%	0.247	57%	0.567	C	S	.	*			trans	-164.8	-5.6	-173.1	0	0	0	0	0	120.6	A89 Q90 N91	G87-A89 PolarHBondContact O-N 3.19Å; G87-Q90 PolarHBondContact O-N 2.9Å; G87-Q90 VanDerWaalsContact O-N 3.1Å; G87-N91 PolarHBondContact O-N 3.17Å
88	D	52.7	Low	56.2	Low	150 Å²	150	97.9 Å²	97.9	80%	0.802	55%	0.548	S	S	*	.	H	α-helix	trans	-58.7	-38.7	-175.8	-67	-17.8	0	0	0	112.1	A92	D88-A92 WeakPolarHBondContact O-CB 3.38Å; D88-A92 PolarHBondContact O-N 3.36Å
89	A	52.1	Low	56.8	Low	82 Å²	82	94.6 Å²	94.6	68%	0.678	54%	0.536	S	S	*	.	H	α-helix	trans	-71.3	-36.7	177.1	0	0	0	0	0	113.8	G87 S93	G87-A89 PolarHBondContact O-N 3.19Å; A89-S93 WeakPolarHBondContact O-CB 3.47Å; A89-S93 PolarHBondContact O-N 3.43Å
90	Q	57.4	Low	57.6	Low	129 Å²	129	91 Å²	91	60%	0.603	52%	0.521	S	S	*	.	H	α-helix	trans	-77.6	-37.1	-178.9	-77	-170	-7.8	0	0	112.4	G87 S93 K94	G87-Q90 PolarHBondContact O-N 2.9Å; G87-Q90 VanDerWaalsContact O-N 3.1Å; Q90-S93 PolarHBondContact O-N 2.83Å; Q90-S93 PolarHBondContact O-OG 3.29Å; Q90-K94 WeakPolarHBondContact O-CB 3.36Å; Q90-K94 WeakPolarHBondContact O-CG 3.37Å; Q90-K94 PolarHBondContact O-N 3.23Å
91	N	59.5	Low	58.6	Low	81 Å²	81	88.4 Å²	88.4	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-72.7	-37.7	175	-71.3	-20.4	0	0	0	110.9	G87 K94 S95	G87-N91 PolarHBondContact O-N 3.17Å; N91-K94 PolarHBondContact O-N 2.77Å; N91-S95 VanDerWaalsContact O-CB 3.3Å; N91-S95 WeakPolarHBondContact O-CB 3.34Å; N91-S95 PolarHBondContact O-N 2.99Å
92	A	60.1	Low	59.7	Low	59 Å²	59	80.1 Å²	80.1	49%	0.488	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-42.6	170.8	0	0	0	0	0	111.7	D88 S95 S96	D88-A92 WeakPolarHBondContact O-CB 3.38Å; D88-A92 PolarHBondContact O-N 3.36Å; A92-S95 PolarHBondContact O-N 2.94Å; A92-S96 WeakPolarHBondContact O-CB 3.46Å; A92-S96 PolarHBondContact O-N 2.95Å; A92-S96 PolarHBondContact O-OG 2.86Å
93	S	67	Low	61.2	Low	55 Å²	55	80.6 Å²	80.6	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-68.5	-37.5	178.1	91.8	0	0	0	0	112.8	A89 Q90 S96 N97	A89-S93 WeakPolarHBondContact O-CB 3.47Å; A89-S93 PolarHBondContact O-N 3.43Å; Q90-S93 PolarHBondContact O-N 2.83Å; Q90-S93 PolarHBondContact O-OG 3.29Å; S93-S96 WeakPolarHBondContact CA-OG 3.07Å; S93-S96 PolarHBondContact O-N 2.87Å; S93-S96 PolarHBondContact O-OG 2.98Å; S93-N97 WeakPolarHBondContact O-CB 3.4Å; S93-N97 PolarHBondContact O-N 3.36Å; S93-N97 PolarHBondContact O-ND2 3.34Å; S93-N97 PolarHBondContact O-OD1 2.92Å
94	K	67.9	Low	62.9	Low	87 Å²	87	77.9 Å²	77.9	38%	0.378	44%	0.438	S	S	.	.	H	α-helix	trans	-65.9	-41.4	173.5	-75	179.3	-178.9	-177	0	111.9	Q90 N91 N97 F98	Q90-K94 WeakPolarHBondContact O-CB 3.36Å; Q90-K94 WeakPolarHBondContact O-CG 3.37Å; Q90-K94 PolarHBondContact O-N 3.23Å; N91-K94 PolarHBondContact O-N 2.77Å; K94-N97 PolarHBondContact O-N 3.23Å; K94-F98 WeakPolarHBondContact O-CB 3.39Å; K94-F98 PolarHBondContact O-N 3.44Å
95	S	66	Low	64.3	Low	26 Å²	26	73.6 Å²	73.6	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-64.9	-42.9	175.2	178.1	0	0	0	0	111.4	N91 A92 N97 F98 I99	N91-S95 VanDerWaalsContact O-CB 3.3Å; N91-S95 WeakPolarHBondContact O-CB 3.34Å; N91-S95 PolarHBondContact O-N 2.99Å; A92-S95 PolarHBondContact O-N 2.94Å; S95-N97 VanDerWaalsContact C-N 3.34Å; S95-N97 PolarHBondContact O-N 3.49Å; S95-F98 PolarHBondContact O-N 3.32Å; S95-I99 VanDerWaalsContact O-CG1 3.3Å; S95-I99 WeakPolarHBondContact O-CG1 3.47Å; S95-I99 PolarHBondContact O-N 3.03Å
96	S	72.2	Confident	65.8	Low	63 Å²	63	67.2 Å²	67.2	44%	0.441	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176	65.1	0	0	0	0	112.1	A92 S93 I99 S100	A92-S96 WeakPolarHBondContact O-CB 3.46Å; A92-S96 PolarHBondContact O-N 2.95Å; A92-S96 PolarHBondContact O-OG 2.86Å; S93-S96 WeakPolarHBondContact CA-OG 3.07Å; S93-S96 PolarHBondContact O-N 2.87Å; S93-S96 PolarHBondContact O-OG 2.98Å; S96-I99 PolarHBondContact O-N 3.45Å; S96-S100 PolarHBondContact O-N 2.91Å; S96-S100 PolarHBondContact O-OG 3.45Å
97	N	74.6	Confident	67.4	Low	85 Å²	85	65.9 Å²	65.9	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-64.7	-42.2	175.1	-69.7	-3.6	0	0	0	111.2	M74 S93 K94 S95 S100 E101	M74-N97 HydrophobicContact SD-CB 4.3Å; S93-N97 WeakPolarHBondContact O-CB 3.4Å; S93-N97 PolarHBondContact O-N 3.36Å; S93-N97 PolarHBondContact O-ND2 3.34Å; S93-N97 PolarHBondContact O-OD1 2.92Å; K94-N97 PolarHBondContact O-N 3.23Å; S95-N97 VanDerWaalsContact C-N 3.34Å; S95-N97 PolarHBondContact O-N 3.49Å; N97-S100 WeakPolarHBondContact CA-OG 3.39Å; N97-S100 PolarHBondContact O-N 2.82Å; N97-S100 PolarHBondContact O-OG 2.95Å; N97-E101 WeakPolarHBondContact O-CG 3.49Å; N97-E101 PolarHBondContact O-N 2.91Å
98	F	71.3	Confident	68.7	Low	20 Å²	20	65.5 Å²	65.5	9%	0.088	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-44.9	175.8	-173.1	-98.4	0	0	0	112	L71 M74 F75 K94 S95 S100 E101 L102 F147	L71-F98 HydrophobicContact CD1-CD2 4.3Å; L71-F98 HydrophobicContact CD1-CE2 4.02Å; L71-F98 HydrophobicContact CD1-CZ 4.43Å; L71-F98 HydrophobicContact CD2-CE2 3.97Å; L71-F98 HydrophobicContact CD2-CZ 4.06Å; L71-F98 HydrophobicContact CG-CD2 4.29Å; L71-F98 HydrophobicContact CG-CE2 3.66Å; L71-F98 HydrophobicContact CG-CZ 4.2Å; M74-F98 HydrophobicContact CB-CD2 4.33Å; M74-F98 HydrophobicContact CE-CB 4.49Å; M74-F98 HydrophobicContact CE-CD2 3.95Å; F75-F98 HydrophobicContact CD2-CE2 4.32Å; F75-F98 HydrophobicContact CD2-CZ 4.43Å; K94-F98 WeakPolarHBondContact O-CB 3.39Å; K94-F98 PolarHBondContact O-N 3.44Å; S95-F98 PolarHBondContact O-N 3.32Å; F98-S100 VanDerWaalsContact C-N 3.35Å; F98-S100 PolarHBondContact O-N 3.23Å; F98-E101 PolarHBondContact O-N 3.01Å; F98-L102 HydrophobicContact CD1-CD1 3.8Å; F98-L102 HydrophobicContact CD1-CG 4.23Å; F98-L102 HydrophobicContact CE1-CD1 3.37Å; F98-L102 HydrophobicContact CE1-CD2 4.49Å; F98-L102 HydrophobicContact CE1-CG 3.88Å; F98-L102 HydrophobicContact CZ-CD1 4.12Å; F98-L102 HydrophobicContact CZ-CD2 4.47Å; F98-L102 HydrophobicContact CZ-CG 4.24Å; F98-L102 PolarHBondContact O-N 3.43Å; F98-F147 AromaticContact CD1-CD1 3.97Å; F98-F147 HydrophobicContact CD1-CD1 3.97Å; F98-F147 HydrophobicContact CD1-CD2 4.41Å; F98-F147 AromaticContact CD1-CE1 4Å; F98-F147 HydrophobicContact CD1-CE1 4Å; F98-F147 HydrophobicContact CD1-CE2 4.45Å; F98-F147 HydrophobicContact CD1-CG 4.18Å; F98-F147 HydrophobicContact CD1-CZ 4.24Å; F98-F147 AromaticContact CE1-CD1 3.97Å; F98-F147 HydrophobicContact CE1-CD1 3.97Å; F98-F147 AromaticContact CE1-CD2 3.73Å; F98-F147 HydrophobicContact CE1-CD2 3.73Å; F98-F147 AromaticContact CE1-CE1 3.76Å; F98-F147 HydrophobicContact CE1-CE1 3.76Å; F98-F147 AromaticContact CE1-CE2 3.52Å; F98-F147 HydrophobicContact CE1-CE2 3.52Å; F98-F147 AromaticContact CE1-CG 3.95Å; F98-F147 HydrophobicContact CE1-CG 3.95Å; F98-F147 AromaticContact CE1-CZ 3.52Å; F98-F147 HydrophobicContact CE1-CZ 3.52Å; F98-F147 HydrophobicContact CZ-CE2 4.13Å; F98-F147 HydrophobicContact CZ-CZ 4.05Å
99	I	72.6	Confident	69.7	Low	21 Å²	21	58.5 Å²	58.5	11%	0.108	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-40.1	175.9	-68.1	166.9	0	0	0	111	S95 S96 E101 R103 L144 F147 T148	S95-I99 VanDerWaalsContact O-CG1 3.3Å; S95-I99 WeakPolarHBondContact O-CG1 3.47Å; S95-I99 PolarHBondContact O-N 3.03Å; S96-I99 PolarHBondContact O-N 3.45Å; I99-E101 VanDerWaalsContact C-N 3.33Å; I99-E101 PolarHBondContact O-N 3.25Å; I99-R103 WeakPolarHBondContact O-CB 3.37Å; I99-R103 VanDerWaalsContact O-CG 3.31Å; I99-R103 WeakPolarHBondContact O-CG 3.21Å; I99-R103 PolarHBondContact O-N 3.14Å; I99-L144 HydrophobicContact CG2-CD2 4.33Å; I99-F147 HydrophobicContact CG1-CB 4.43Å; I99-T148 HydrophobicContact CD1-CG2 4.36Å
100	S	75.2	Confident	70.7	Confident	48 Å²	48	56.5 Å²	56.5	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-65	-37.9	178	57.9	0	0	0	0	112.4	S96 N97 F98 R103 Q104	S96-S100 PolarHBondContact O-N 2.91Å; S96-S100 PolarHBondContact O-OG 3.45Å; N97-S100 WeakPolarHBondContact CA-OG 3.39Å; N97-S100 PolarHBondContact O-N 2.82Å; N97-S100 PolarHBondContact O-OG 2.95Å; F98-S100 VanDerWaalsContact C-N 3.35Å; F98-S100 PolarHBondContact O-N 3.23Å; S100-R103 PolarHBondContact O-N 3.01Å; S100-Q104 WeakPolarHBondContact O-CG 3.27Å; S100-Q104 PolarHBondContact O-N 3.34Å
101	E	74	Confident	71.5	Confident	38 Å²	38	52.5 Å²	52.5	18%	0.178	28%	0.276	C	S	.	.	H	α-helix	trans	-75.5	-37.3	179.6	-65.1	-87.3	140.8	0	0	111.4	S70 L71 M74 N97 F98 I99 R103 Q104 L105	S70-E101 WeakPolarHBondContact CB-OE2 3.26Å; S70-E101 PolarHBondContact OG-OE2 3.22Å; L71-E101 HydrophobicContact CD1-CB 3.91Å; M74-E101 HydrophobicContact CE-CB 3.44Å; M74-E101 VanDerWaalsContact CE-CB 3.44Å; M74-E101 HydrophobicContact CE-CG 3.4Å; M74-E101 HydrophobicContact SD-CG 4.09Å; N97-E101 WeakPolarHBondContact O-CG 3.49Å; N97-E101 PolarHBondContact O-N 2.91Å; F98-E101 PolarHBondContact O-N 3.01Å; I99-E101 VanDerWaalsContact C-N 3.33Å; I99-E101 PolarHBondContact O-N 3.25Å; E101-R103 VanDerWaalsContact C-N 3.31Å; E101-R103 PolarHBondContact O-N 3.31Å; E101-Q104 PolarHBondContact O-N 3.33Å; E101-L105 WeakPolarHBondContact O-CB 3.44Å; E101-L105 PolarHBondContact O-N 3.24Å
102	L	72.6	Confident	72.2	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-43.7	168.5	-80.8	179.3	0	0	0	111.2	L71 F98 Q104 L105 T106 L140 I143 L144 F147	L71-L102 HydrophobicContact CD1-CB 4.47Å; L71-L102 HydrophobicContact CD1-CD2 3.71Å; L71-L102 HydrophobicContact CD1-CG 3.8Å; L71-L102 HydrophobicContact CD2-CD2 3.76Å; L71-L102 HydrophobicContact CG-CD2 4.36Å; F98-L102 HydrophobicContact CD1-CD1 3.8Å; F98-L102 HydrophobicContact CD1-CG 4.23Å; F98-L102 HydrophobicContact CE1-CD1 3.37Å; F98-L102 HydrophobicContact CE1-CD2 4.49Å; F98-L102 HydrophobicContact CE1-CG 3.88Å; F98-L102 HydrophobicContact CZ-CD1 4.12Å; F98-L102 HydrophobicContact CZ-CD2 4.47Å; F98-L102 HydrophobicContact CZ-CG 4.24Å; F98-L102 PolarHBondContact O-N 3.43Å; L102-Q104 VanDerWaalsContact C-N 3.32Å; L102-Q104 PolarHBondContact O-N 3.35Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.96Å; L102-L105 VanDerWaalsContact O-N 3.17Å; L102-T106 PolarHBondContact O-N 2.85Å; L102-T106 PolarHBondContact O-OG1 3.48Å; L102-T106 VanDerWaalsContact O-OG1 3.08Å; L102-L140 HydrophobicContact CD2-CD2 4.09Å; L102-I143 HydrophobicContact CD1-CG2 3.88Å; L102-I143 HydrophobicContact CD2-CG2 4.31Å; L102-L144 HydrophobicContact CB-CD2 3.46Å; L102-L144 VanDerWaalsContact CB-CD2 3.46Å; L102-L144 HydrophobicContact CB-CG 3.94Å; L102-L144 HydrophobicContact CD1-CD2 3.86Å; L102-L144 HydrophobicContact CD1-CG 4.16Å; L102-L144 HydrophobicContact CG-CD2 4.33Å; L102-F147 HydrophobicContact CD1-CD2 4.38Å
103	R	75.8	Confident	72.8	Confident	157 Å²	157	46.5 Å²	46.5	59%	0.592	24%	0.237	S	C	*	.	H	α-helix	trans	-63.5	-37.7	176.2	-75.2	176.6	-179.6	-176	0.7	112.6	I99 S100 E101 Y107 L144	I99-R103 WeakPolarHBondContact O-CB 3.37Å; I99-R103 VanDerWaalsContact O-CG 3.31Å; I99-R103 WeakPolarHBondContact O-CG 3.21Å; I99-R103 PolarHBondContact O-N 3.14Å; S100-R103 PolarHBondContact O-N 3.01Å; E101-R103 VanDerWaalsContact C-N 3.31Å; E101-R103 PolarHBondContact O-N 3.31Å; R103-Y107 WeakPolarHBondContact O-CB 3.43Å; R103-Y107 PolarHBondContact O-N 3.29Å; R103-L144 HydrophobicContact CG-CD1 4.45Å; R103-L144 HydrophobicContact CG-CD2 4.07Å
104	Q	75.3	Confident	73.1	Confident	83 Å²	83	47.9 Å²	47.9	39%	0.388	24%	0.24	S	C	.	.	H	α-helix	trans	-63.7	-44	172.7	-73.4	179.7	21.6	0	0	110.6	S100 E101 L102 T106 Y107 H108	S100-Q104 WeakPolarHBondContact O-CG 3.27Å; S100-Q104 PolarHBondContact O-N 3.34Å; E101-Q104 PolarHBondContact O-N 3.33Å; L102-Q104 VanDerWaalsContact C-N 3.32Å; L102-Q104 PolarHBondContact O-N 3.35Å; Q104-T106 PolarHBondContact O-N 3.49Å; Q104-Y107 WeakPolarHBondContact O-CB 3.35Å; Q104-Y107 PolarHBondContact O-N 2.95Å; Q104-Y107 VanDerWaalsContact O-N 3.14Å; Q104-H108 PolarHBondContact O-CD2 2.93Å; Q104-H108 PolarHBondContact O-N 2.97Å
105	L	74.5	Confident	73.2	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.052	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-49.3	177	-174.1	67.2	0	0	0	111.8	L64 N67 I68 E101 L102 Y107 H108 I109 L140	L64-L105 HydrophobicContact CD1-CD1 3.46Å; L64-L105 VanDerWaalsContact CD1-CD1 3.46Å; L64-L105 HydrophobicContact CG-CD1 4.27Å; N67-L105 HydrophobicContact CB-CD1 4.29Å; I68-L105 HydrophobicContact CD1-CD1 4.35Å; I68-L105 HydrophobicContact CG1-CD1 3.63Å; E101-L105 WeakPolarHBondContact O-CB 3.44Å; E101-L105 PolarHBondContact O-N 3.24Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.96Å; L102-L105 VanDerWaalsContact O-N 3.17Å; L105-Y107 VanDerWaalsContact C-N 3.31Å; L105-Y107 PolarHBondContact O-N 2.79Å; L105-H108 PolarHBondContact O-N 3.27Å; L105-I109 HydrophobicContact CD1-CD1 4.34Å; L105-I109 HydrophobicContact CG-CD1 4.06Å; L105-I109 PolarHBondContact O-N 3.26Å; L105-L140 HydrophobicContact CD2-CD1 3.85Å; L105-L140 HydrophobicContact CD2-CD2 3.62Å; L105-L140 HydrophobicContact CD2-CG 4.42Å; L105-L140 HydrophobicContact CG-CD1 3.84Å; L105-L140 HydrophobicContact CG-CD2 4.46Å
106	T	74.3	Confident	73.2	Confident	19 Å²	19	46.1 Å²	46.1	12%	0.117	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-43.8	173.2	-55.8	0	0	0	0	111.2	L102 Q104 H108 I109 S110 D137 L144	L102-T106 PolarHBondContact O-N 2.85Å; L102-T106 PolarHBondContact O-OG1 3.48Å; L102-T106 VanDerWaalsContact O-OG1 3.08Å; Q104-T106 PolarHBondContact O-N 3.49Å; T106-H108 PolarHBondContact O-N 2.7Å; T106-I109 PolarHBondContact O-N 3.34Å; T106-S110 WeakPolarHBondContact O-CB 3.37Å; T106-S110 PolarHBondContact O-N 2.87Å; T106-D137 WeakPolarHBondContact CG2-OD1 3.49Å; T106-L144 WeakPolarHBondContact OG1-CD1 3.22Å
107	Y	75.4	Confident	73	Confident	144 Å²	144	50.3 Å²	50.3	57%	0.565	24%	0.239	S	C	*	.	H	α-helix	trans	-59.6	-44.8	177.3	174.7	-97.8	0	0	0	112.7	R103 Q104 L105 S110 N111	R103-Y107 WeakPolarHBondContact O-CB 3.43Å; R103-Y107 PolarHBondContact O-N 3.29Å; Q104-Y107 WeakPolarHBondContact O-CB 3.35Å; Q104-Y107 PolarHBondContact O-N 2.95Å; Q104-Y107 VanDerWaalsContact O-N 3.14Å; L105-Y107 VanDerWaalsContact C-N 3.31Å; L105-Y107 PolarHBondContact O-N 2.79Å; Y107-S110 PolarHBondContact O-N 3.48Å; Y107-N111 WeakPolarHBondContact CE1-ND2 3.45Å; Y107-N111 PolarHBondContact O-N 3.49Å; Y107-N111 PolarHBondContact OH-ND2 2.98Å
108	H	72.3	Confident	72.3	Confident	17 Å²	17	48.7 Å²	48.7	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-67.3	-41	177.9	-70.4	-67.7	0	0	0	112.2	E60 Q63 L64 N67 Q104 L105 T106 S110 N111 I112	E60-H108 IonicContact OE2-CE1 3.65Å; E60-H108 IonicContact OE2-CG 3.81Å; E60-H108 IonicContact OE2-ND1 2.77Å; E60-H108 PolarHBondContact OE2-ND1 2.73Å; Q63-H108 PolarHBondContact OE1-CE1 3.03Å; Q63-H108 VanDerWaalsContact OE1-CE1 3.23Å; L64-H108 HydrophobicContact CD1-CB 3.95Å; N67-H108 PolarHBondContact ND2-CD2 3.45Å; N67-H108 PolarHBondContact ND2-NE2 3.48Å; N67-H108 VanDerWaalsContact ND2-NE2 3.19Å; Q104-H108 PolarHBondContact O-CD2 2.93Å; Q104-H108 PolarHBondContact O-N 2.97Å; L105-H108 PolarHBondContact O-N 3.27Å; T106-H108 PolarHBondContact O-N 2.7Å; H108-S110 VanDerWaalsContact C-N 3.33Å; H108-S110 PolarHBondContact O-N 3.32Å; H108-N111 PolarHBondContact O-N 3.03Å; H108-I112 WeakPolarHBondContact O-CG1 3.5Å; H108-I112 PolarHBondContact O-N 3.01Å
109	I	73.1	Confident	71.7	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-42.4	176.3	-72.6	159.9	0	0	0	110.8	L64 L105 T106 N111 I112 S113 L133 L136 D137 L140	L64-I109 HydrophobicContact CD1-CD1 4.16Å; L64-I109 HydrophobicContact CD1-CG1 3.68Å; L105-I109 HydrophobicContact CD1-CD1 4.34Å; L105-I109 HydrophobicContact CG-CD1 4.06Å; L105-I109 PolarHBondContact O-N 3.26Å; T106-I109 PolarHBondContact O-N 3.34Å; I109-N111 PolarHBondContact O-N 3.28Å; I109-I112 PolarHBondContact O-N 2.93Å; I109-S113 VanDerWaalsContact O-CB 3.28Å; I109-S113 WeakPolarHBondContact O-CB 3.39Å; I109-S113 PolarHBondContact O-N 3.42Å; I109-L133 HydrophobicContact CG2-CD2 4.39Å; I109-L136 HydrophobicContact CD1-CD2 3.45Å; I109-L136 VanDerWaalsContact CD1-CD2 3.45Å; I109-L136 HydrophobicContact CD1-CG 3.82Å; I109-L136 HydrophobicContact CG1-CD2 4.03Å; I109-D137 HydrophobicContact CG2-CB 4.02Å; I109-L140 HydrophobicContact CD1-CD1 3.1Å
110	S	74.4	Confident	70.7	Confident	40 Å²	40	56.8 Å²	56.8	28%	0.28	29%	0.286	S	S	.	.	H	α-helix	trans	-62.4	-41.2	175.4	-163.9	0	0	0	0	111.9	T106 Y107 H108 S113 N114	T106-S110 WeakPolarHBondContact O-CB 3.37Å; T106-S110 PolarHBondContact O-N 2.87Å; Y107-S110 PolarHBondContact O-N 3.48Å; H108-S110 VanDerWaalsContact C-N 3.33Å; H108-S110 PolarHBondContact O-N 3.32Å; S110-S113 PolarHBondContact O-N 3.43Å; S110-N114 WeakPolarHBondContact O-CB 3.27Å; S110-N114 VanDerWaalsContact O-CG 3.25Å; S110-N114 PolarHBondContact O-N 3.24Å; S110-N114 PolarHBondContact O-ND2 2.71Å
111	N	74.3	Confident	69.6	Low	45 Å²	45	59 Å²	59	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-44.5	174.9	-79.4	-11.4	0	0	0	112.5	Y107 H108 I109 N114 H115	Y107-N111 WeakPolarHBondContact CE1-ND2 3.45Å; Y107-N111 PolarHBondContact O-N 3.49Å; Y107-N111 PolarHBondContact OH-ND2 2.98Å; H108-N111 PolarHBondContact O-N 3.03Å; I109-N111 PolarHBondContact O-N 3.28Å; N111-N114 PolarHBondContact O-N 3.01Å; N111-H115 WeakPolarHBondContact O-CB 3.38Å; N111-H115 PolarHBondContact O-N 2.87Å
112	I	73.8	Confident	68.6	Low	5 Å²	5	66.7 Å²	66.7	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-63	-46.8	175.6	-62.5	164.1	0	0	0	109.1	L57 E60 L61 L64 H108 I109 N114 H115 Y116 L133	L57-I112 HydrophobicContact CD1-CG2 4.27Å; E60-I112 HydrophobicContact CB-CG1 4.18Å; L61-I112 HydrophobicContact CD2-CD1 4.05Å; L64-I112 HydrophobicContact CD2-CD1 4.08Å; H108-I112 WeakPolarHBondContact O-CG1 3.5Å; H108-I112 PolarHBondContact O-N 3.01Å; I109-I112 PolarHBondContact O-N 2.93Å; I112-N114 VanDerWaalsContact C-N 3.35Å; I112-N114 PolarHBondContact O-N 2.92Å; I112-H115 WeakPolarHBondContact O-CA 3.34Å; I112-H115 VanDerWaalsContact O-CB 3.25Å; I112-H115 WeakPolarHBondContact O-CB 3.45Å; I112-H115 PolarHBondContact O-N 3.1Å; I112-Y116 HydrophobicContact CG2-CD2 3.98Å; I112-Y116 HydrophobicContact CG2-CE2 3.86Å; I112-Y116 VanDerWaalsContact O-CD2 3.28Å; I112-Y116 WeakPolarHBondContact O-CD2 3.46Å; I112-Y116 PolarHBondContact O-N 2.92Å; I112-L133 HydrophobicContact CB-CD1 4.35Å; I112-L133 HydrophobicContact CG2-CD1 3.54Å; I112-L133 HydrophobicContact CG2-CD2 4.15Å
113	S	71.9	Confident	67.8	Low	10 Å²	10	70.4 Å²	70.4	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-58	-45.2	177.8	-172.1	0	0	0	0	112	I109 S110 H115 Y116 K117	I109-S113 VanDerWaalsContact O-CB 3.28Å; I109-S113 WeakPolarHBondContact O-CB 3.39Å; I109-S113 PolarHBondContact O-N 3.42Å; S110-S113 PolarHBondContact O-N 3.43Å; S113-H115 VanDerWaalsContact C-N 3.31Å; S113-H115 PolarHBondContact O-N 3.24Å; S113-Y116 PolarHBondContact O-N 3.12Å; S113-Y116 VanDerWaalsContact O-N 3.1Å; S113-K117 PolarHBondContact O-N 3.24Å
114	N	74.5	Confident	66.8	Low	84 Å²	84	67.9 Å²	67.9	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-35	175	-74.7	-40.2	0	0	0	112.6	S110 N111 I112 Y116 K117 G118	S110-N114 WeakPolarHBondContact O-CB 3.27Å; S110-N114 VanDerWaalsContact O-CG 3.25Å; S110-N114 PolarHBondContact O-N 3.24Å; S110-N114 PolarHBondContact O-ND2 2.71Å; N111-N114 PolarHBondContact O-N 3.01Å; I112-N114 VanDerWaalsContact C-N 3.35Å; I112-N114 PolarHBondContact O-N 2.92Å; N114-Y116 VanDerWaalsContact C-N 3.28Å; N114-Y116 PolarHBondContact O-N 3.24Å; N114-K117 PolarHBondContact O-N 3.09Å; N114-G118 PolarHBondContact O-N 3.43Å
115	H	69.3	Low	65.9	Low	35 Å²	35	69.6 Å²	69.6	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-38.5	173.3	-173.7	-81.3	0	0	0	111.6	R53 L57 N111 I112 S113	R53-H115 WeakPolarHBondContact CG-NE2 3.42Å; R53-H115 PolarHBondContact NE-CE1 3.42Å; R53-H115 VanDerWaalsContact NE-CE1 3.29Å; R53-H115 PolarHBondContact NE-NE2 3.01Å; R53-H115 PolarHBondContact NH2-O 2.91Å; R53-H115 VanDerWaalsContact NH2-O 3.11Å; L57-H115 HydrophobicContact CD1-CB 4.47Å; N111-H115 WeakPolarHBondContact O-CB 3.38Å; N111-H115 PolarHBondContact O-N 2.87Å; I112-H115 WeakPolarHBondContact O-CA 3.34Å; I112-H115 VanDerWaalsContact O-CB 3.25Å; I112-H115 WeakPolarHBondContact O-CB 3.45Å; I112-H115 PolarHBondContact O-N 3.1Å; S113-H115 VanDerWaalsContact C-N 3.31Å; S113-H115 PolarHBondContact O-N 3.24Å
116	Y	66.3	Low	65.1	Low	40 Å²	40	71.8 Å²	71.8	16%	0.157	37%	0.368	C	S	.	.	H	α-helix	trans	-73	-39	174.6	-81.2	-88.7	0	0	0	112.4	L57 I112 S113 N114 G118 N119 Y126 I129 L133	L57-Y116 HydrophobicContact CD1-CE2 4.4Å; I112-Y116 HydrophobicContact CG2-CD2 3.98Å; I112-Y116 HydrophobicContact CG2-CE2 3.86Å; I112-Y116 VanDerWaalsContact O-CD2 3.28Å; I112-Y116 WeakPolarHBondContact O-CD2 3.46Å; I112-Y116 PolarHBondContact O-N 2.92Å; S113-Y116 PolarHBondContact O-N 3.12Å; S113-Y116 VanDerWaalsContact O-N 3.1Å; N114-Y116 VanDerWaalsContact C-N 3.28Å; N114-Y116 PolarHBondContact O-N 3.24Å; Y116-G118 VanDerWaalsContact C-N 3.3Å; Y116-G118 PolarHBondContact O-N 3.36Å; Y116-N119 PolarHBondContact O-N 3.4Å; Y116-Y126 AromaticContact CD1-CD1 3.38Å; Y116-Y126 HydrophobicContact CD1-CD1 3.38Å; Y116-Y126 HydrophobicContact CD1-CD2 4.43Å; Y116-Y126 AromaticContact CD1-CE1 3.19Å; Y116-Y126 HydrophobicContact CD1-CE1 3.19Å; Y116-Y126 HydrophobicContact CD1-CE2 4.31Å; Y116-Y126 AromaticContact CD1-CG 3.99Å; Y116-Y126 HydrophobicContact CD1-CG 3.99Å; Y116-Y126 AromaticContact CD1-CZ 3.69Å; Y116-Y126 HydrophobicContact CE1-CD1 4.11Å; Y116-Y126 HydrophobicContact CE1-CD2 4.41Å; Y116-Y126 AromaticContact CE1-CE1 3.74Å; Y116-Y126 HydrophobicContact CE1-CE1 3.74Å; Y116-Y126 HydrophobicContact CE1-CE2 4.08Å; Y116-Y126 HydrophobicContact CE1-CG 4.4Å; Y116-Y126 AromaticContact CE1-CZ 3.7Å; Y116-Y126 HydrophobicContact CG-CD1 4.28Å; Y116-Y126 AromaticContact CG-CE1 3.99Å; Y116-Y126 HydrophobicContact CG-CE1 3.99Å; Y116-I129 HydrophobicContact CD1-CB 4.25Å; Y116-I129 HydrophobicContact CD1-CG2 4.01Å; Y116-I129 HydrophobicContact CD2-CG2 4.08Å; Y116-I129 HydrophobicContact CE1-CB 4.09Å; Y116-I129 HydrophobicContact CE1-CD1 3.86Å; Y116-I129 HydrophobicContact CE1-CG2 3.76Å; Y116-I129 HydrophobicContact CE2-CG2 3.82Å; Y116-I129 HydrophobicContact CG-CG2 4.21Å; Y116-L133 HydrophobicContact CD2-CD1 3.85Å; Y116-L133 HydrophobicContact CE2-CD1 4.26Å
117	K	67.5	Low	64.5	Low	152 Å²	152	76.1 Å²	76.1	66%	0.661	39%	0.39	S	S	*	.	H	α-helix	trans	-63.2	-32.4	177.6	-168.7	175.4	-179.1	176.9	0	113.5	S113 N114 N119	S113-K117 PolarHBondContact O-N 3.24Å; N114-K117 PolarHBondContact O-N 3.09Å; K117-N119 VanDerWaalsContact C-N 3.34Å
118	G	61	Low	64.1	Low	50 Å²	50	72.1 Å²	72.1	52%	0.515	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-10.8	-179.6	0	0	0	0	0	115.2	N114 Y116 L120	N114-G118 PolarHBondContact O-N 3.43Å; Y116-G118 VanDerWaalsContact C-N 3.3Å; Y116-G118 PolarHBondContact O-N 3.36Å; G118-L120 PolarHBondContact O-N 3.16Å
119	N	56.8	Low	63.8	Low	45 Å²	45	73.2 Å²	73.2	24%	0.241	38%	0.384	C	S	.	.			trans	-93.2	100.1	176.8	-86	-15.3	0	0	0	109.5	R53 Y116 K117 V121 Y126	R53-N119 PolarHBondContact NH1-OD1 3.46Å; R53-N119 PolarHBondContact NH2-OD1 2.92Å; R53-N119 VanDerWaalsContact NH2-OD1 3.08Å; Y116-N119 PolarHBondContact O-N 3.4Å; K117-N119 VanDerWaalsContact C-N 3.34Å; N119-V121 PolarHBondContact O-N 2.81Å; N119-Y126 HydrophobicContact CB-CD1 4.15Å; N119-Y126 HydrophobicContact CB-CE1 3.47Å; N119-Y126 VanDerWaalsContact CB-CE1 3.47Å; N119-Y126 PolarHBondContact ND2-OH 3.39Å
120	L	51.8	Low	63.5	Low	167 Å²	167	75.8 Å²	75.8	87%	0.874	40%	0.396	S	S	*	.			trans	-62.3	11.4	174.8	-92.5	149.8	0	0	0	114.8	G118 K122	G118-L120 PolarHBondContact O-N 3.16Å; L120-K122 PolarHBondContact O-N 3.22Å
121	V	53.8	Low	63.4	Low	95 Å²	95	80.7 Å²	80.7	58%	0.576	41%	0.412	S	S	*	.			trans	-81.3	105.4	175.5	-173.4	0	0	0	0	107.4	N119 D123	N119-V121 PolarHBondContact O-N 2.81Å; V121-D123 HydrophobicContact CG1-CB 4.36Å; V121-D123 PolarHBondContact O-N 3.46Å
122	K	52.1	Low	63.1	Low	198 Å²	198	82.2 Å²	82.2	86%	0.861	42%	0.418	S	S	*	.			trans	-69.2	58.1	176.3	-64.8	-178.5	176.6	-178.3	0	111.8	L120	L120-K122 PolarHBondContact O-N 3.22Å
123	D	56	Low	63	Low	81 Å²	81	82.7 Å²	82.7	43%	0.433	42%	0.421	S	S	.	.			trans	-91.7	131.8	171.9	-152	-26	0	0	0	109.1	V121 Q125 Y126 D127	V121-D123 HydrophobicContact CG1-CB 4.36Å; V121-D123 PolarHBondContact O-N 3.46Å; D123-Q125 PolarHBondContact O-N 2.85Å; D123-Q125 VanDerWaalsContact O-N 3.08Å; D123-Y126 WeakPolarHBondContact O-CA 3.22Å; D123-Y126 VanDerWaalsContact O-CB 3.28Å; D123-Y126 WeakPolarHBondContact O-CB 3.46Å; D123-Y126 PolarHBondContact O-N 3.26Å; D123-D127 PolarHBondContact O-N 2.87Å
124	V	54.2	Low	63	Low	104 Å²	104	84 Å²	84	63%	0.63	43%	0.43	S	S	*	.	H	α-helix	trans	-57.8	-28.3	-177.6	176.4	0	0	0	0	111	N128	V124-N128 PolarHBondContact O-N 3.44Å
125	Q	56.8	Low	63	Low	118 Å²	118	84.3 Å²	84.3	55%	0.551	43%	0.427	S	S	*	.	H	α-helix	trans	-68.1	-36.2	174.5	-64.4	-172.5	-3.2	0	0	112.9	D123 N128 I129	D123-Q125 PolarHBondContact O-N 2.85Å; D123-Q125 VanDerWaalsContact O-N 3.08Å; Q125-N128 PolarHBondContact O-N 3.31Å; Q125-I129 WeakPolarHBondContact O-CG1 3.2Å; Q125-I129 PolarHBondContact O-N 3.02Å; Q125-I129 VanDerWaalsContact O-N 3.14Å
126	Y	57.7	Low	63.1	Low	57 Å²	57	85 Å²	85	22%	0.224	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-43.1	178.1	-112.2	-101.5	0	0	0	111.2	Y116 N119 D123 N128 I129 H130	Y116-Y126 AromaticContact CD1-CD1 3.38Å; Y116-Y126 HydrophobicContact CD1-CD1 3.38Å; Y116-Y126 HydrophobicContact CD1-CD2 4.43Å; Y116-Y126 AromaticContact CD1-CE1 3.19Å; Y116-Y126 HydrophobicContact CD1-CE1 3.19Å; Y116-Y126 HydrophobicContact CD1-CE2 4.31Å; Y116-Y126 AromaticContact CD1-CG 3.99Å; Y116-Y126 HydrophobicContact CD1-CG 3.99Å; Y116-Y126 AromaticContact CD1-CZ 3.69Å; Y116-Y126 HydrophobicContact CE1-CD1 4.11Å; Y116-Y126 HydrophobicContact CE1-CD2 4.41Å; Y116-Y126 AromaticContact CE1-CE1 3.74Å; Y116-Y126 HydrophobicContact CE1-CE1 3.74Å; Y116-Y126 HydrophobicContact CE1-CE2 4.08Å; Y116-Y126 HydrophobicContact CE1-CG 4.4Å; Y116-Y126 AromaticContact CE1-CZ 3.7Å; Y116-Y126 HydrophobicContact CG-CD1 4.28Å; Y116-Y126 AromaticContact CG-CE1 3.99Å; Y116-Y126 HydrophobicContact CG-CE1 3.99Å; N119-Y126 HydrophobicContact CB-CD1 4.15Å; N119-Y126 HydrophobicContact CB-CE1 3.47Å; N119-Y126 VanDerWaalsContact CB-CE1 3.47Å; N119-Y126 PolarHBondContact ND2-OH 3.39Å; D123-Y126 WeakPolarHBondContact O-CA 3.22Å; D123-Y126 VanDerWaalsContact O-CB 3.28Å; D123-Y126 WeakPolarHBondContact O-CB 3.46Å; D123-Y126 PolarHBondContact O-N 3.26Å; Y126-N128 VanDerWaalsContact C-N 3.35Å; Y126-N128 PolarHBondContact O-N 3Å; Y126-I129 PolarHBondContact O-N 3.3Å; Y126-H130 WeakPolarHBondContact O-CB 3.22Å; Y126-H130 PolarHBondContact O-N 2.89Å
127	D	62.4	Low	63.3	Low	110 Å²	110	84.7 Å²	84.7	59%	0.588	43%	0.433	S	S	*	.	H	α-helix	trans	-63.6	-39.7	177.8	-77.2	-16.9	0	0	0	111.9	D123 K131	D123-D127 PolarHBondContact O-N 2.87Å; D127-K131 VanDerWaalsContact O-CB 3.29Å; D127-K131 WeakPolarHBondContact O-CB 3.29Å; D127-K131 PolarHBondContact O-N 3.5Å
128	N	66.8	Low	63.5	Low	59 Å²	59	82.9 Å²	82.9	32%	0.316	43%	0.43	S	S	.	.	H	α-helix	trans	-65.4	-45.6	177.2	-78.3	-17.1	0	0	0	112.3	S11 V124 Q125 Y126 K131 E132	S11-N128 WeakPolarHBondContact CB-ND2 3.31Å; S11-N128 PolarHBondContact OG-ND2 3.11Å; V124-N128 PolarHBondContact O-N 3.44Å; Q125-N128 PolarHBondContact O-N 3.31Å; Y126-N128 VanDerWaalsContact C-N 3.35Å; Y126-N128 PolarHBondContact O-N 3Å; N128-K131 PolarHBondContact O-N 3.26Å; N128-E132 PolarHBondContact O-N 2.66Å
129	I	64.5	Low	64.1	Low	40 Å²	40	84.6 Å²	84.6	21%	0.205	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-45	179	-65.7	167.1	0	0	0	110.6	Y116 Q125 Y126 K131 E132 L133	Y116-I129 HydrophobicContact CD1-CB 4.25Å; Y116-I129 HydrophobicContact CD1-CG2 4.01Å; Y116-I129 HydrophobicContact CD2-CG2 4.08Å; Y116-I129 HydrophobicContact CE1-CB 4.09Å; Y116-I129 HydrophobicContact CE1-CD1 3.86Å; Y116-I129 HydrophobicContact CE1-CG2 3.76Å; Y116-I129 HydrophobicContact CE2-CG2 3.82Å; Y116-I129 HydrophobicContact CG-CG2 4.21Å; Q125-I129 WeakPolarHBondContact O-CG1 3.2Å; Q125-I129 PolarHBondContact O-N 3.02Å; Q125-I129 VanDerWaalsContact O-N 3.14Å; Y126-I129 PolarHBondContact O-N 3.3Å; I129-K131 VanDerWaalsContact C-N 3.27Å; I129-K131 PolarHBondContact O-N 2.84Å; I129-E132 PolarHBondContact O-N 3.06Å; I129-L133 HydrophobicContact CG2-CD1 3.76Å; I129-L133 HydrophobicContact CG2-CG 4.27Å; I129-L133 WeakPolarHBondContact O-CB 2.96Å; I129-L133 WeakPolarHBondContact O-CG 3.42Å; I129-L133 PolarHBondContact O-N 3.46Å
130	H	66.7	Low	64.9	Low	57 Å²	57	83.1 Å²	83.1	26%	0.264	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-39.7	176	179.5	-78.6	0	0	0	111.6	Y126 S134	Y126-H130 WeakPolarHBondContact O-CB 3.22Å; Y126-H130 PolarHBondContact O-N 2.89Å; H130-S134 PolarHBondContact CE1-OG 3.41Å; H130-S134 PolarHBondContact ND1-OG 2.87Å; H130-S134 VanDerWaalsContact O-CB 3.32Å; H130-S134 WeakPolarHBondContact O-CB 3.23Å; H130-S134 PolarHBondContact O-N 3.42Å; H130-S134 PolarHBondContact O-OG 2.86Å
131	K	72.7	Confident	65.8	Low	142 Å²	142	78.9 Å²	78.9	62%	0.617	40%	0.395	S	S	*	.	H	α-helix	trans	-65.3	-44.5	177.6	-171.5	-180	178.5	-175	0	112.4	D127 N128 I129 S134 K135	D127-K131 VanDerWaalsContact O-CB 3.29Å; D127-K131 WeakPolarHBondContact O-CB 3.29Å; D127-K131 PolarHBondContact O-N 3.5Å; N128-K131 PolarHBondContact O-N 3.26Å; I129-K131 VanDerWaalsContact C-N 3.27Å; I129-K131 PolarHBondContact O-N 2.84Å; K131-S134 PolarHBondContact O-N 3.27Å; K131-K135 WeakPolarHBondContact O-CB 3.26Å; K131-K135 PolarHBondContact O-N 3.46Å
132	E	68.9	Low	66.7	Low	77 Å²	77	79.3 Å²	79.3	36%	0.36	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-42.2	176.4	-69.2	-56.8	137.4	0	0	111.8	N128 I129 S134 K135 L136	N128-E132 PolarHBondContact O-N 2.66Å; I129-E132 PolarHBondContact O-N 3.06Å; E132-S134 VanDerWaalsContact C-N 3.34Å; E132-S134 PolarHBondContact O-N 3.02Å; E132-K135 WeakPolarHBondContact O-CB 3.21Å; E132-K135 PolarHBondContact O-N 2.98Å; E132-L136 PolarHBondContact O-N 3.31Å
133	L	70.4	Confident	67.6	Low	16 Å²	16	72.7 Å²	72.7	8%	0.084	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-41.2	174.7	-72.4	169.3	0	0	0	111.9	I109 I112 Y116 I129 K135 L136 D137	I109-L133 HydrophobicContact CG2-CD2 4.39Å; I112-L133 HydrophobicContact CB-CD1 4.35Å; I112-L133 HydrophobicContact CG2-CD1 3.54Å; I112-L133 HydrophobicContact CG2-CD2 4.15Å; Y116-L133 HydrophobicContact CD2-CD1 3.85Å; Y116-L133 HydrophobicContact CE2-CD1 4.26Å; I129-L133 HydrophobicContact CG2-CD1 3.76Å; I129-L133 HydrophobicContact CG2-CG 4.27Å; I129-L133 WeakPolarHBondContact O-CB 2.96Å; I129-L133 WeakPolarHBondContact O-CG 3.42Å; I129-L133 PolarHBondContact O-N 3.46Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.5Å; L133-L136 PolarHBondContact O-N 3.34Å; L133-D137 WeakPolarHBondContact O-CB 3.41Å; L133-D137 PolarHBondContact O-N 2.87Å
134	S	72.7	Confident	68.3	Low	38 Å²	38	69.6 Å²	69.6	27%	0.266	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-35.8	176.5	-58.4	0	0	0	0	111.9	H130 K131 E132 L138	H130-S134 PolarHBondContact CE1-OG 3.41Å; H130-S134 PolarHBondContact ND1-OG 2.87Å; H130-S134 VanDerWaalsContact O-CB 3.32Å; H130-S134 WeakPolarHBondContact O-CB 3.23Å; H130-S134 PolarHBondContact O-N 3.42Å; H130-S134 PolarHBondContact O-OG 2.86Å; K131-S134 PolarHBondContact O-N 3.27Å; E132-S134 VanDerWaalsContact C-N 3.34Å; E132-S134 PolarHBondContact O-N 3.02Å; S134-L138 WeakPolarHBondContact O-CG 3.5Å; S134-L138 PolarHBondContact O-N 3.39Å; S134-L138 VanDerWaalsContact O-N 3.17Å
135	K	73.9	Confident	69.1	Low	90 Å²	90	66.9 Å²	66.9	39%	0.391	34%	0.336	S	S	.	.	H	α-helix	trans	-67.3	-44.6	175.2	-175.4	-176	171.6	-161	0	111.2	K131 E132 L133 D137 L138 E139	K131-K135 WeakPolarHBondContact O-CB 3.26Å; K131-K135 PolarHBondContact O-N 3.46Å; E132-K135 WeakPolarHBondContact O-CB 3.21Å; E132-K135 PolarHBondContact O-N 2.98Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.5Å; K135-D137 VanDerWaalsContact C-N 3.31Å; K135-D137 PolarHBondContact O-N 3Å; K135-L138 PolarHBondContact O-N 3.22Å; K135-E139 WeakPolarHBondContact CE-OE1 3.44Å; K135-E139 IonicContact NZ-OE1 3.31Å; K135-E139 WeakPolarHBondContact O-CG 3.45Å; K135-E139 PolarHBondContact O-N 3.2Å
136	L	71.5	Confident	69.7	Low	48 Å²	48	66.8 Å²	66.8	25%	0.251	34%	0.337	S	S	.	.	H	α-helix	trans	-62.5	-38.8	176.5	-172.9	67.5	0	0	0	111.9	I109 E132 L133 E139 L140	I109-L136 HydrophobicContact CD1-CD2 3.45Å; I109-L136 VanDerWaalsContact CD1-CD2 3.45Å; I109-L136 HydrophobicContact CD1-CG 3.82Å; I109-L136 HydrophobicContact CG1-CD2 4.03Å; E132-L136 PolarHBondContact O-N 3.31Å; L133-L136 PolarHBondContact O-N 3.34Å; L136-E139 PolarHBondContact O-N 3.38Å; L136-L140 HydrophobicContact CG-CD1 4.36Å; L136-L140 WeakPolarHBondContact O-CB 3.46Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3.48Å
137	D	72	Confident	70	Confident	35 Å²	35	66.9 Å²	66.9	19%	0.187	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-46.4	175	-156.5	37.4	0	0	0	111.1	T106 I109 L133 K135 L140 D141	T106-D137 WeakPolarHBondContact CG2-OD1 3.49Å; I109-D137 HydrophobicContact CG2-CB 4.02Å; L133-D137 WeakPolarHBondContact O-CB 3.41Å; L133-D137 PolarHBondContact O-N 2.87Å; K135-D137 VanDerWaalsContact C-N 3.31Å; K135-D137 PolarHBondContact O-N 3Å; D137-L140 PolarHBondContact O-N 2.96Å; D137-D141 PolarHBondContact O-N 2.83Å
138	L	70.9	Confident	70.2	Confident	113 Å²	113	63.6 Å²	63.6	59%	0.592	32%	0.323	S	S	*	.	H	α-helix	trans	-63.7	-44.2	175.8	-70.3	170.4	0	0	0	112.7	S134 K135 L140 D141 D142	S134-L138 WeakPolarHBondContact O-CG 3.5Å; S134-L138 PolarHBondContact O-N 3.39Å; S134-L138 VanDerWaalsContact O-N 3.17Å; K135-L138 PolarHBondContact O-N 3.22Å; L138-L140 VanDerWaalsContact C-N 3.29Å; L138-L140 PolarHBondContact O-N 3.2Å; L138-D141 PolarHBondContact O-N 2.76Å; L138-D142 PolarHBondContact O-N 2.93Å
139	E	73.6	Confident	70.1	Confident	87 Å²	87	65.4 Å²	65.4	41%	0.407	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-36	177.7	-73.1	178.5	-172.9	0	0	111.7	K135 L136 D142 I143	K135-E139 WeakPolarHBondContact CE-OE1 3.44Å; K135-E139 IonicContact NZ-OE1 3.31Å; K135-E139 WeakPolarHBondContact O-CG 3.45Å; K135-E139 PolarHBondContact O-N 3.2Å; L136-E139 PolarHBondContact O-N 3.38Å; E139-D142 PolarHBondContact O-N 2.8Å; E139-I143 VanDerWaalsContact O-CG1 3.27Å; E139-I143 WeakPolarHBondContact O-CG1 3.39Å; E139-I143 PolarHBondContact O-N 3.01Å
140	L	72.6	Confident	69.5	Low	13 Å²	13	69.8 Å²	69.8	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-71.2	-38.1	175.1	-76.9	172.6	0	0	0	113	L102 L105 I109 L136 D137 L138 D142 I143 L144	L102-L140 HydrophobicContact CD2-CD2 4.09Å; L105-L140 HydrophobicContact CD2-CD1 3.85Å; L105-L140 HydrophobicContact CD2-CD2 3.62Å; L105-L140 HydrophobicContact CD2-CG 4.42Å; L105-L140 HydrophobicContact CG-CD1 3.84Å; L105-L140 HydrophobicContact CG-CD2 4.46Å; I109-L140 HydrophobicContact CD1-CD1 3.1Å; L136-L140 HydrophobicContact CG-CD1 4.36Å; L136-L140 WeakPolarHBondContact O-CB 3.46Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3.48Å; D137-L140 PolarHBondContact O-N 2.96Å; L138-L140 VanDerWaalsContact C-N 3.29Å; L138-L140 PolarHBondContact O-N 3.2Å; L140-D142 VanDerWaalsContact C-N 3.3Å; L140-I143 HydrophobicContact CD2-CD1 4.43Å; L140-I143 PolarHBondContact O-N 3.27Å; L140-L144 WeakPolarHBondContact O-CB 3.48Å; L140-L144 WeakPolarHBondContact O-CG 3.28Å; L140-L144 PolarHBondContact O-N 2.97Å
141	D	72.1	Confident	68.6	Low	79 Å²	79	69.5 Å²	69.5	42%	0.422	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-39.5	172.1	-86	-10.2	0	0	0	111.3	D137 L138 L144 S145	D137-D141 PolarHBondContact O-N 2.83Å; L138-D141 PolarHBondContact O-N 2.76Å; D141-L144 PolarHBondContact O-N 2.9Å; D141-S145 WeakPolarHBondContact O-CB 3.2Å; D141-S145 PolarHBondContact O-N 3.41Å
142	D	71.4	Confident	67.4	Low	104 Å²	104	69.7 Å²	69.7	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-62	-44.9	173	-77.6	-17.9	0	0	0	111.1	L138 E139 L140 S145 M146	L138-D142 PolarHBondContact O-N 2.93Å; E139-D142 PolarHBondContact O-N 2.8Å; L140-D142 VanDerWaalsContact C-N 3.3Å; D142-S145 WeakPolarHBondContact O-CB 3.38Å; D142-S145 PolarHBondContact O-N 3.28Å; D142-S145 PolarHBondContact O-OG 3.46Å; D142-M146 WeakPolarHBondContact O-CG 3.45Å; D142-M146 PolarHBondContact O-N 2.95Å
143	I	71.1	Confident	66.2	Low	58 Å²	58	69.7 Å²	69.7	30%	0.297	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-45.7	175.2	-67.1	164.4	0	0	0	111.1	L102 E139 L140 S145 M146 F147	L102-I143 HydrophobicContact CD1-CG2 3.88Å; L102-I143 HydrophobicContact CD2-CG2 4.31Å; E139-I143 VanDerWaalsContact O-CG1 3.27Å; E139-I143 WeakPolarHBondContact O-CG1 3.39Å; E139-I143 PolarHBondContact O-N 3.01Å; L140-I143 HydrophobicContact CD2-CD1 4.43Å; L140-I143 PolarHBondContact O-N 3.27Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 3.17Å; I143-M146 HydrophobicContact CB-CE 4.27Å; I143-M146 HydrophobicContact CG1-CE 3.84Å; I143-M146 WeakPolarHBondContact O-CB 3.31Å; I143-M146 PolarHBondContact O-N 3.12Å; I143-M146 VanDerWaalsContact O-N 3.16Å; I143-F147 HydrophobicContact CG2-CD2 3.82Å; I143-F147 HydrophobicContact CG2-CE2 3.94Å; I143-F147 WeakPolarHBondContact O-CD2 3.32Å; I143-F147 PolarHBondContact O-N 3.49Å
144	L	70.3	Confident	64.9	Low	17 Å²	17	75 Å²	75	9%	0.089	39%	0.387	C	S	.	.	H	α-helix	trans	-58.2	-41.6	175.1	-84.6	167.7	0	0	0	111	I99 L102 R103 T106 L140 D141 F147 T148	I99-L144 HydrophobicContact CG2-CD2 4.33Å; L102-L144 HydrophobicContact CB-CD2 3.46Å; L102-L144 VanDerWaalsContact CB-CD2 3.46Å; L102-L144 HydrophobicContact CB-CG 3.94Å; L102-L144 HydrophobicContact CD1-CD2 3.86Å; L102-L144 HydrophobicContact CD1-CG 4.16Å; L102-L144 HydrophobicContact CG-CD2 4.33Å; R103-L144 HydrophobicContact CG-CD1 4.45Å; R103-L144 HydrophobicContact CG-CD2 4.07Å; T106-L144 WeakPolarHBondContact OG1-CD1 3.22Å; L140-L144 WeakPolarHBondContact O-CB 3.48Å; L140-L144 WeakPolarHBondContact O-CG 3.28Å; L140-L144 PolarHBondContact O-N 2.97Å; D141-L144 PolarHBondContact O-N 2.9Å; L144-F147 PolarHBondContact O-N 3.37Å; L144-T148 WeakPolarHBondContact O-CB 2.99Å; L144-T148 VanDerWaalsContact O-CG2 3.3Å; L144-T148 WeakPolarHBondContact O-CG2 3.32Å; L144-T148 PolarHBondContact O-N 3.36Å; L144-T148 PolarHBondContact O-OG1 3.34Å
145	S	72	Confident	63.3	Low	47 Å²	47	81.5 Å²	81.5	33%	0.329	41%	0.413	S	S	.	.	H	α-helix	trans	-63.5	-42.9	176.3	86.8	0	0	0	0	111.1	D141 D142 I143 F147 T148 N149	D141-S145 WeakPolarHBondContact O-CB 3.2Å; D141-S145 PolarHBondContact O-N 3.41Å; D142-S145 WeakPolarHBondContact O-CB 3.38Å; D142-S145 PolarHBondContact O-N 3.28Å; D142-S145 PolarHBondContact O-OG 3.46Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 3.17Å; S145-F147 PolarHBondContact O-N 3.34Å; S145-T148 WeakPolarHBondContact CA-OG1 3.3Å; S145-T148 PolarHBondContact O-OG1 3.04Å; S145-T148 VanDerWaalsContact O-OG1 3.12Å; S145-N149 WeakPolarHBondContact O-CB 3.44Å; S145-N149 PolarHBondContact O-N 3.22Å; S145-N149 PolarHBondContact O-ND2 3.41Å
146	M	69.9	Low	61.5	Low	115 Å²	115	82.9 Å²	82.9	57%	0.567	42%	0.424	S	S	*	.	H	α-helix	trans	-60.1	-48.5	176.4	-74.9	-169.8	-69.6	0	0	111	D142 I143 Y150	D142-M146 WeakPolarHBondContact O-CG 3.45Å; D142-M146 PolarHBondContact O-N 2.95Å; I143-M146 HydrophobicContact CB-CE 4.27Å; I143-M146 HydrophobicContact CG1-CE 3.84Å; I143-M146 WeakPolarHBondContact O-CB 3.31Å; I143-M146 PolarHBondContact O-N 3.12Å; I143-M146 VanDerWaalsContact O-N 3.16Å; M146-Y150 WeakPolarHBondContact O-CB 3.45Å; M146-Y150 PolarHBondContact O-N 3.04Å
147	F	63.6	Low	59.5	Low	60 Å²	60	87.4 Å²	87.4	26%	0.263	45%	0.448	S	S	.	.	H	α-helix	trans	-70.2	-40.9	-178.2	-84.8	-86	0	0	0	113	F98 I99 L102 I143 L144 S145 Y150 S151	F98-F147 AromaticContact CD1-CD1 3.97Å; F98-F147 HydrophobicContact CD1-CD1 3.97Å; F98-F147 HydrophobicContact CD1-CD2 4.41Å; F98-F147 AromaticContact CD1-CE1 4Å; F98-F147 HydrophobicContact CD1-CE1 4Å; F98-F147 HydrophobicContact CD1-CE2 4.45Å; F98-F147 HydrophobicContact CD1-CG 4.18Å; F98-F147 HydrophobicContact CD1-CZ 4.24Å; F98-F147 AromaticContact CE1-CD1 3.97Å; F98-F147 HydrophobicContact CE1-CD1 3.97Å; F98-F147 AromaticContact CE1-CD2 3.73Å; F98-F147 HydrophobicContact CE1-CD2 3.73Å; F98-F147 AromaticContact CE1-CE1 3.76Å; F98-F147 HydrophobicContact CE1-CE1 3.76Å; F98-F147 AromaticContact CE1-CE2 3.52Å; F98-F147 HydrophobicContact CE1-CE2 3.52Å; F98-F147 AromaticContact CE1-CG 3.95Å; F98-F147 HydrophobicContact CE1-CG 3.95Å; F98-F147 AromaticContact CE1-CZ 3.52Å; F98-F147 HydrophobicContact CE1-CZ 3.52Å; F98-F147 HydrophobicContact CZ-CE2 4.13Å; F98-F147 HydrophobicContact CZ-CZ 4.05Å; I99-F147 HydrophobicContact CG1-CB 4.43Å; L102-F147 HydrophobicContact CD1-CD2 4.38Å; I143-F147 HydrophobicContact CG2-CD2 3.82Å; I143-F147 HydrophobicContact CG2-CE2 3.94Å; I143-F147 WeakPolarHBondContact O-CD2 3.32Å; I143-F147 PolarHBondContact O-N 3.49Å; L144-F147 PolarHBondContact O-N 3.37Å; S145-F147 PolarHBondContact O-N 3.34Å; F147-Y150 PolarHBondContact O-N 3.45Å; F147-S151 PolarHBondContact O-N 3.31Å; F147-S151 PolarHBondContact O-OG 3.45Å
148	T	66.7	Low	57.4	Low	40 Å²	40	91.6 Å²	91.6	25%	0.245	48%	0.48	C	S	.	.	H	α-helix	trans	-65.7	-40.2	177.1	49.6	0	0	0	0	112	I99 L144 S145 S151 H152	I99-T148 HydrophobicContact CD1-CG2 4.36Å; L144-T148 WeakPolarHBondContact O-CB 2.99Å; L144-T148 VanDerWaalsContact O-CG2 3.3Å; L144-T148 WeakPolarHBondContact O-CG2 3.32Å; L144-T148 PolarHBondContact O-N 3.36Å; L144-T148 PolarHBondContact O-OG1 3.34Å; S145-T148 WeakPolarHBondContact CA-OG1 3.3Å; S145-T148 PolarHBondContact O-OG1 3.04Å; S145-T148 VanDerWaalsContact O-OG1 3.12Å; T148-S151 PolarHBondContact O-N 2.71Å; T148-H152 PolarHBondContact O-N 3.21Å; T148-H152 PolarHBondContact O-ND1 3.38Å
149	N	65	Low	55.5	Low	97 Å²	97	92.1 Å²	92.1	52%	0.519	49%	0.488	S	S	.	.	H	α-helix	trans	-69.4	-34.4	174.1	-69.2	-26.8	0	0	0	112	S145 H152 S153	S145-N149 WeakPolarHBondContact O-CB 3.44Å; S145-N149 PolarHBondContact O-N 3.22Å; S145-N149 PolarHBondContact O-ND2 3.41Å; N149-H152 PolarHBondContact O-N 3.15Å; N149-S153 WeakPolarHBondContact O-CB 3.42Å; N149-S153 PolarHBondContact O-N 3.42Å; N149-S153 PolarHBondContact O-OG 3.1Å
150	Y	52.5	Low	53.4	Low	133 Å²	133	94.5 Å²	94.5	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-41.7	175.7	-157.7	-98.6	0	0	0	111.6	M146 F147 H152 S153 Q154	M146-Y150 WeakPolarHBondContact O-CB 3.45Å; M146-Y150 PolarHBondContact O-N 3.04Å; F147-Y150 PolarHBondContact O-N 3.45Å; Y150-H152 PolarHBondContact O-N 2.83Å; Y150-S153 PolarHBondContact O-N 2.86Å; Y150-Q154 HydrophobicContact CD1-CG 4.22Å; Y150-Q154 HydrophobicContact CE1-CG 3.95Å; Y150-Q154 PolarHBondContact O-N 3.4Å; Y150-Q154 PolarHBondContact OH-NE2 3.35Å
151	S	47.4	Very low	51.3	Low	51 Å²	51	100.1 Å²	100.1	36%	0.357	54%	0.544	S	S	.	.	H	α-helix	trans	-61	-30	173.8	-50.3	0	0	0	0	112.9	F147 T148	F147-S151 PolarHBondContact O-N 3.31Å; F147-S151 PolarHBondContact O-OG 3.45Å; T148-S151 PolarHBondContact O-N 2.71Å
152	H	46	Very low	49.2	Very low	146 Å²	146	104.3 Å²	104.3	68%	0.676	57%	0.566	S	S	*	*	H	α-helix	trans	-84.4	-28	177	-74	63.8	0	0	0	112.9	T148 N149 Y150	T148-H152 PolarHBondContact O-N 3.21Å; T148-H152 PolarHBondContact O-ND1 3.38Å; N149-H152 PolarHBondContact O-N 3.15Å; Y150-H152 PolarHBondContact O-N 2.83Å
153	S	43.6	Very low	47.3	Very low	77 Å²	77	104.5 Å²	104.5	54%	0.538	58%	0.576	S	S	.	*	H	α-helix	trans	-84.2	-24.5	-174.3	-56.2	0	0	0	0	113.7	N149 Y150 H155 I156	N149-S153 WeakPolarHBondContact O-CB 3.42Å; N149-S153 PolarHBondContact O-N 3.42Å; N149-S153 PolarHBondContact O-OG 3.1Å; Y150-S153 PolarHBondContact O-N 2.86Å; S153-H155 PolarHBondContact O-N 3.35Å; S153-I156 PolarHBondContact O-N 2.93Å
154	Q	43.4	Very low	45.3	Very low	126 Å²	126	108 Å²	108	59%	0.589	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-7.7	179.7	-73.7	-154.1	-23	0	0	115	Y150	Y150-Q154 HydrophobicContact CD1-CG 4.22Å; Y150-Q154 HydrophobicContact CE1-CG 3.95Å; Y150-Q154 PolarHBondContact O-N 3.4Å; Y150-Q154 PolarHBondContact OH-NE2 3.35Å
155	H	38.8	Very low	43.6	Very low	176 Å²	176	113.1 Å²	113.1	82%	0.815	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-4.9	173.8	-97.2	-68.3	0	0	0	114.5	S153	S153-H155 PolarHBondContact O-N 3.35Å
156	I	36.6	Very low	41.5	Very low	118 Å²	118	117.2 Å²	117.2	61%	0.605	66%	0.657	S	S	*	*	S	Bend	trans	-134.3	110.2	-173.4	-51.3	177.1	0	0	0	108.5	S153	S153-I156 PolarHBondContact O-N 2.93Å
157	N	29.8	Very low	39.5	Very low	144 Å²	144	118.1 Å²	118.1	77%	0.77	67%	0.67	S	S	*	*			trans	94	74.8	169.8	-48.6	-29.8	0	0	0	117.7
158	S	28.4	Very low	38.1	Very low	122 Å²	122	118.1 Å²	118.1	85%	0.853	68%	0.677	S	S	*	*			trans	-99.8	86.7	152	-60.9	0	0	0	0	109.2
159	T	30.3	Very low	36.8	Very low	125 Å²	125	123.2 Å²	123.2	77%	0.767	70%	0.703	S	S	*	*			trans	-128.2	100.4	163.2	-23.1	0	0	0	0	108.2	T161	T159-T161 PolarHBondContact O-N 2.78Å
160	T	29.3	Very low	36	Very low	137 Å²	137	122.5 Å²	122.5	84%	0.84	70%	0.699	S	S	*	*			trans	-67.3	112.8	176.2	38	0	0	0	0	110.9
161	T	29.9	Very low	36.2	Very low	131 Å²	131	120.1 Å²	120.1	80%	0.804	70%	0.702	S	S	*	*			trans	-101.2	112.9	160	38.9	0	0	0	0	109.5	T159 S163	T159-T161 PolarHBondContact O-N 2.78Å; T161-S163 PolarHBondContact O-N 3.31Å
162	N	27.6	Very low	37.1	Very low	166 Å²	166	119.9 Å²	119.9	89%	0.888	70%	0.696	S	S	*	*			trans	-65.3	105.9	168.1	-72.4	-28.1	0	0	0	109.5
163	S	31.5	Very low	37.9	Very low	109 Å²	109	114.6 Å²	114.6	76%	0.762	67%	0.674	S	S	*	*			trans	-100.1	109.9	163.8	49.8	0	0	0	0	109.3	T161	T161-S163 PolarHBondContact O-N 3.31Å
164	T	29	Very low	38.8	Very low	130 Å²	130	114 Å²	114	80%	0.798	67%	0.667	S	S	*	*			trans	-51.8	135.4	167.5	8.4	0	0	0	0	111.2	T166	T164-T166 PolarHBondContact O-N 2.95Å
165	P	34.1	Very low	39.7	Very low	126 Å²	126	109.1 Å²	109.1	82%	0.818	65%	0.646	S	S	*	*			trans	-73.8	114	177.9	29	-31	0	0	0	109.7	T167	P165-T167 PolarHBondContact O-N 3.45Å
166	T	28.5	Very low	40.9	Very low	132 Å²	132	110.1 Å²	110.1	81%	0.81	65%	0.648	S	S	*	*			trans	-67	125.6	167.3	3.7	0	0	0	0	109.5	T164 S168	T164-T166 PolarHBondContact O-N 2.95Å; T166-S168 PolarHBondContact O-N 3.19Å
167	T	28.5	Very low	42.5	Very low	135 Å²	135	110.9 Å²	110.9	83%	0.828	65%	0.649	S	S	*	*			trans	-55.5	98.8	166.3	28.9	0	0	0	0	110.6	P165	P165-T167 PolarHBondContact O-N 3.45Å
168	S	34.1	Very low	44.9	Very low	60 Å²	60	108.2 Å²	108.2	42%	0.42	64%	0.64	S	S	.	*			trans	-96.3	125.1	163	52	0	0	0	0	108.7	T166 N170	T166-S168 PolarHBondContact O-N 3.19Å; S168-N170 PolarHBondContact O-N 3.27Å
169	N	39.3	Very low	47.6	Very low	147 Å²	147	102.9 Å²	102.9	79%	0.786	60%	0.603	S	S	*	*			trans	-63.1	131	170.5	-82.2	-17.7	0	0	0	108.3	S171	N169-S171 PolarHBondContact O-N 2.9Å
170	N	46.9	Very low	50.3	Low	82 Å²	82	98.3 Å²	98.3	44%	0.439	58%	0.575	S	S	.	*			trans	-66.9	71.6	-175.9	-66.7	-45.7	0	0	0	112.4	S168 N298 R346	S168-N170 PolarHBondContact O-N 3.27Å; N170-N298 PolarHBondContact OD1-ND2 3.21Å; N170-R346 WeakPolarHBondContact ND2-CB 3Å
171	S	58	Low	53.1	Low	82 Å²	82	91.8 Å²	91.8	57%	0.573	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-93.9	125.5	173.1	58.2	0	0	0	0	109.9	N169 T173	N169-S171 PolarHBondContact O-N 2.9Å; S171-T173 PolarHBondContact O-N 3.16Å; S171-T173 VanDerWaalsContact O-N 3.16Å
172	I	64.9	Low	55.9	Low	47 Å²	47	87.6 Å²	87.6	24%	0.241	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-51.1	122.1	164.6	-67.6	158.4	0	0	0	107.6	L201 T251 L294 L348	I172-L201 HydrophobicContact CD1-CD2 3.35Å; I172-L201 HydrophobicContact CG1-CD2 4.38Å; I172-T251 HydrophobicContact CG2-CG2 4.48Å; I172-L294 HydrophobicContact CG2-CB 4.46Å; I172-L294 HydrophobicContact CG2-CD2 4.35Å; I172-L348 HydrophobicContact CD1-CD2 3.8Å
173	T	63.3	Low	58.9	Low	34 Å²	34	79.7 Å²	79.7	21%	0.209	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-86.2	133.3	177.4	59.6	0	0	0	0	109.3	S171 P175 L294 P296	S171-T173 PolarHBondContact O-N 3.16Å; S171-T173 VanDerWaalsContact O-N 3.16Å; T173-P175 VanDerWaalsContact O-CD 3.31Å; T173-P175 WeakPolarHBondContact O-CD 3.17Å; T173-L294 PolarHBondContact N-O 3.35Å; T173-P296 HydrophobicContact CG2-CG 4.04Å; T173-P296 WeakPolarHBondContact OG1-CD 3.42Å; T173-P296 WeakPolarHBondContact OG1-CG 3.45Å
174	V	61.7	Low	61.7	Low	66 Å²	66	77.7 Å²	77.7	40%	0.4	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-78.1	117.3	173.4	175.7	0	0	0	0	108.8	D250 K252	V174-D250 WeakPolarHBondContact CG1-O 3.27Å; V174-K252 HydrophobicContact CG1-CD 4.43Å; V174-K252 HydrophobicContact CG1-CG 4.38Å
175	P	63.4	Low	64.7	Low	22 Å²	22	71.5 Å²	71.5	14%	0.143	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-60.6	148	175.2	25.3	-33.3	0	0	0	110.8	T173 E177 T251 K252 I293	T173-P175 VanDerWaalsContact O-CD 3.31Å; T173-P175 WeakPolarHBondContact O-CD 3.17Å; P175-E177 VanDerWaalsContact C-N 3.28Å; P175-E177 PolarHBondContact O-N 3.06Å; P175-T251 WeakPolarHBondContact CD-O 3.4Å; P175-T251 WeakPolarHBondContact CG-O 3.47Å; P175-K252 HydrophobicContact CG-CB 4.34Å; P175-K252 WeakPolarHBondContact O-CD 3.37Å; P175-K252 PolarHBondContact O-NZ 3.34Å; P175-I293 HydrophobicContact CG-CG2 4.19Å
176	K	63.9	Low	67.3	Low	197 Å²	197	66.6 Å²	66.6	86%	0.857	37%	0.372	S	S	*	.	S	Bend	trans	-64	-38	-180	-71.7	-177.5	-179.7	176.4	0	111.2	K252	K176-K252 PolarHBondContact O-NZ 3.28Å
177	E	70.9	Confident	70.3	Confident	135 Å²	135	61 Å²	61	63%	0.631	34%	0.338	S	S	*	.	S	Bend	trans	-119.1	151.5	-178.5	-66.9	-176.1	-179.1	0	0	111.1	P175 S179	P175-E177 VanDerWaalsContact C-N 3.28Å; P175-E177 PolarHBondContact O-N 3.06Å; E177-S179 PolarHBondContact O-N 2.91Å
178	P	79.6	Confident	73.2	Confident	88 Å²	88	61 Å²	61	57%	0.571	33%	0.333	S	S	*	.			trans	-65	126.7	176.6	27.7	-33.7	0	0	0	111.1	K252	P178-K252 CarbonylContact C-O 3.58Å; P178-K252 VanDerWaalsContact CA-O 3.24Å; P178-K252 WeakPolarHBondContact CA-O 3.33Å; P178-K252 HydrophobicContact CB-CB 4.16Å
179	S	85.1	Confident	75.7	Confident	10 Å²	10	62 Å²	62	7%	0.07	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.2	176	-61.6	0	0	0	0	109	E177 K252 C254	E177-S179 PolarHBondContact O-N 2.91Å; S179-K252 PolarHBondContact N-O 3.11Å; S179-C254 PolarHBondContact O-N 3.08Å
180	T	86.9	Confident	78.1	Confident	29 Å²	29	56.3 Å²	56.3	18%	0.178	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.1	178.2	-55.9	0	0	0	0	110.6	C254 S270 L271	T180-C254 CarbonylContact C-O 3.21Å; T180-C254 WeakPolarHBondContact CA-O 3.28Å; T180-C254 HydrophobicContact CG2-CB 4.16Å; T180-S270 PolarHBondContact O-OG 3.19Å; T180-S270 VanDerWaalsContact O-OG 3.08Å; T180-L271 HydrophobicContact CG2-CD1 3.67Å; T180-L271 PolarHBondContact O-N 3.16Å
181	L	88.2	Confident	80.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.2	177.5	-56.1	-176.2	0	0	0	109.8	I183 L253 C254 L255 H256 V268 L286 L289 I290 I293	L181-I183 HydrophobicContact CB-CD1 4.36Å; L181-I183 HydrophobicContact CB-CG1 4.33Å; L181-L253 HydrophobicContact CD1-CD1 4.3Å; L181-L253 HydrophobicContact CG-CD1 4.46Å; L181-C254 PolarHBondContact N-O 3.25Å; L181-L255 HydrophobicContact CB-CD2 3.95Å; L181-L255 HydrophobicContact CD1-CD2 3.88Å; L181-L255 HydrophobicContact CG-CD2 4.2Å; L181-H256 PolarHBondContact O-N 3.04Å; L181-V268 HydrophobicContact CB-CG1 4.49Å; L181-L286 HydrophobicContact CD1-CD1 4.27Å; L181-L289 HydrophobicContact CD1-CD2 3.94Å; L181-L289 HydrophobicContact CD1-CG 4.23Å; L181-L289 HydrophobicContact CD2-CD2 3.45Å; L181-L289 VanDerWaalsContact CD2-CD2 3.45Å; L181-L289 HydrophobicContact CD2-CG 4.17Å; L181-L289 HydrophobicContact CG-CD2 4.33Å; L181-I290 HydrophobicContact CD1-CG1 3.84Å; L181-I293 HydrophobicContact CD1-CD1 4.09Å; L181-I293 HydrophobicContact CD2-CD1 4.3Å; L181-I293 HydrophobicContact CG-CD1 4.41Å
182	I	88	Confident	81.8	Confident	42 Å²	42	50.4 Å²	50.4	22%	0.215	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.9	171.7	-60.4	170	0	0	0	107.5	H256 I258 S269 L271	I182-H256 HydrophobicContact CG1-CB 4.31Å; I182-I258 HydrophobicContact CG2-CD1 3.44Å; I182-I258 VanDerWaalsContact CG2-CD1 3.44Å; I182-I258 HydrophobicContact CG2-CG1 4.39Å; I182-S269 WeakPolarHBondContact CB-OG 3.03Å; I182-S269 PolarHBondContact N-O 3.18Å; I182-S269 PolarHBondContact O-N 3.13Å; I182-S269 PolarHBondContact O-OG 2.81Å; I182-L271 HydrophobicContact CD1-CD1 3.76Å; I182-L271 HydrophobicContact CD1-CG 4.12Å; I182-L271 HydrophobicContact CG1-CD1 4.24Å
183	I	90.9	Very high	83.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	108.5	-169.7	-60.1	156.9	0	0	0	107.8	L181 L255 H256 F257 I258 I266 T267 V268 L286	L181-I183 HydrophobicContact CB-CD1 4.36Å; L181-I183 HydrophobicContact CB-CG1 4.33Å; I183-L255 HydrophobicContact CD1-CB 4.35Å; I183-L255 HydrophobicContact CD1-CD2 4.11Å; I183-H256 PolarHBondContact N-O 3.02Å; I183-F257 HydrophobicContact CB-CD1 4.04Å; I183-F257 HydrophobicContact CB-CE1 4.2Å; I183-F257 HydrophobicContact CD1-CD1 4.2Å; I183-F257 HydrophobicContact CD1-CE1 3.62Å; I183-F257 HydrophobicContact CD1-CE2 4.44Å; I183-F257 HydrophobicContact CD1-CZ 3.75Å; I183-F257 HydrophobicContact CG2-CD1 3.9Å; I183-F257 HydrophobicContact CG2-CE1 3.95Å; I183-F257 CarbonylContact O-C 3.57Å; I183-F257 WeakPolarHBondContact O-CA 3.32Å; I183-I258 PolarHBondContact O-N 2.86Å; I183-I266 HydrophobicContact CG2-CG2 3.96Å; I183-T267 WeakPolarHBondContact CA-O 3.21Å; I183-V268 HydrophobicContact CG1-CG1 4.39Å; I183-L286 HydrophobicContact CD1-CD1 3.72Å; I183-L286 HydrophobicContact CD1-CD2 4.02Å; I183-L286 HydrophobicContact CG1-CD1 3.88Å; I183-L286 HydrophobicContact CG1-CD2 4.29Å; I183-L286 HydrophobicContact CG2-CD2 3.96Å
184	Q	90.8	Very high	84.7	Confident	67 Å²	67	46.6 Å²	46.6	31%	0.313	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	134	166.1	-42.5	-168.7	-5.4	0	0	109.2	I258 I266 T267	Q184-I258 WeakPolarHBondContact CA-O 3.41Å; Q184-I258 HydrophobicContact CB-CB 4.43Å; Q184-I258 HydrophobicContact CG-CB 4.16Å; Q184-I258 HydrophobicContact CG-CD1 4.2Å; Q184-I258 HydrophobicContact CG-CG2 4.48Å; Q184-I266 CarbonylContact O-C 3.4Å; Q184-I266 WeakPolarHBondContact O-CA 3.19Å; Q184-T267 WeakPolarHBondContact CB-OG1 3.36Å; Q184-T267 PolarHBondContact N-O 3.4Å; Q184-T267 PolarHBondContact O-N 2.97Å
185	C	91.1	Very high	86.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	154.3	-179.2	53.4	0	0	0	0	111.2	I258 W259 N260 I266	C185-I258 PolarHBondContact N-O 2.86Å; C185-W259 WeakPolarHBondContact O-CA 3.37Å; C185-W259 VanDerWaalsContact SG-CE3 3.51Å; C185-W259 WeakPolarHBondContact SG-CZ3 3.5Å; C185-N260 PolarHBondContact O-N 3.42Å; C185-I266 HydrophobicContact CB-CG1 3.82Å
186	N	90.4	Very high	87.6	Confident	23 Å²	23	42.8 Å²	42.8	12%	0.123	23%	0.227	C	C	.	.			trans	-77.1	129.1	175.4	-158.3	-56.8	0	0	0	109.4	N188 S189 S261 C263	N186-N188 PolarHBondContact O-N 3.39Å; N186-N188 VanDerWaalsContact O-N 3.1Å; N186-N188 WeakPolarHBondContact OD1-CB 3.26Å; N186-N188 PolarHBondContact OD1-N 3.21Å; N186-N188 PolarHBondContact OD1-ND2 2.89Å; N186-N188 VanDerWaalsContact OD1-ND2 3.1Å; N186-S189 CarbonylContact O-C 3.55Å; N186-S189 PolarHBondContact O-N 2.93Å; N186-S261 PolarHBondContact ND2-O 3.43Å; N186-C263 WeakPolarHBondContact CB-O 3.47Å; N186-C263 PolarHBondContact ND2-O 2.76Å
187	P	91.2	Very high	89	Confident	16 Å²	16	33.5 Å²	33.5	10%	0.104	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.9	176.1	26.5	-36.2	0	0	0	113.6	S189 V218 L221 L225 W259	P187-S189 VanDerWaalsContact C-N 3.32Å; P187-V218 HydrophobicContact CG-CG1 4.04Å; P187-V218 HydrophobicContact CG-CG2 3.84Å; P187-L221 HydrophobicContact CB-CD2 3.75Å; P187-L221 HydrophobicContact CG-CD2 4.5Å; P187-L225 HydrophobicContact CB-CD2 4.03Å; P187-W259 HydrophobicContact CB-CE3 4.04Å
188	N	87.9	Confident	90.1	Very high	133 Å²	133	27.2 Å²	27.2	71%	0.711	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.7	174.6	-58.6	-51.3	0	0	0	113.5	N186	N186-N188 PolarHBondContact O-N 3.39Å; N186-N188 VanDerWaalsContact O-N 3.1Å; N186-N188 WeakPolarHBondContact OD1-CB 3.26Å; N186-N188 PolarHBondContact OD1-N 3.21Å; N186-N188 PolarHBondContact OD1-ND2 2.89Å; N186-N188 VanDerWaalsContact OD1-ND2 3.1Å
189	S	86.6	Confident	90.6	Very high	81 Å²	81	24 Å²	24	57%	0.566	14%	0.135	S	C	*	.	S	Bend	trans	-142.1	64.6	178.6	-55.9	0	0	0	0	109.3	N186 P187	N186-S189 CarbonylContact O-C 3.55Å; N186-S189 PolarHBondContact O-N 2.93Å; P187-S189 VanDerWaalsContact C-N 3.32Å
190	P	90.1	Very high	90.9	Very high	28 Å²	28	23.5 Å²	23.5	18%	0.182	13%	0.132	C	C	.	.			trans	-65.4	150.6	-179	26.1	-32.6	0	0	0	111.7	L192 F195 L225 W259	P190-L192 HydrophobicContact CB-CD2 4.32Å; P190-L192 HydrophobicContact CG-CD2 3.77Å; P190-L192 HydrophobicContact CG-CG 4.11Å; P190-L192 PolarHBondContact O-N 3.47Å; P190-F195 HydrophobicContact CB-CD2 4.42Å; P190-F195 HydrophobicContact CB-CE2 3.76Å; P190-L225 HydrophobicContact CB-CD1 4.24Å; P190-W259 HydrophobicContact CB-CH2 4.11Å; P190-W259 HydrophobicContact CB-CZ3 4.12Å
191	P	92	Very high	91.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.123	C	C	.	.			trans	-74.3	75	174.8	30	-33.3	0	0	0	111.1	S193 V194 F195 F257 I266 E283 L286	P191-S193 VanDerWaalsContact C-N 3.26Å; P191-S193 PolarHBondContact O-N 3.21Å; P191-V194 HydrophobicContact CB-CB 4.24Å; P191-V194 HydrophobicContact CB-CG2 4.21Å; P191-V194 PolarHBondContact O-N 2.83Å; P191-V194 VanDerWaalsContact O-N 3.16Å; P191-F195 HydrophobicContact CG-CE1 4.32Å; P191-F195 HydrophobicContact CG-CE2 4.33Å; P191-F195 HydrophobicContact CG-CZ 4.01Å; P191-F195 PolarHBondContact O-N 3.2Å; P191-F257 HydrophobicContact CG-CD1 4.26Å; P191-F257 HydrophobicContact CG-CE1 3.67Å; P191-I266 HydrophobicContact CB-CD1 3.72Å; P191-I266 HydrophobicContact CG-CD1 4.47Å; P191-E283 VanDerWaalsContact CA-OE1 3.25Å; P191-E283 WeakPolarHBondContact CA-OE1 3.42Å; P191-E283 HydrophobicContact CB-CG 4.09Å; P191-L286 HydrophobicContact CB-CD2 4.02Å; P191-L286 HydrophobicContact CG-CD2 4.37Å
192	L	91.8	Very high	91.1	Very high	41 Å²	41	22.4 Å²	22.4	22%	0.215	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-35.4	-172.1	-69.1	178.5	0	0	0	112.9	P190 V194 F195 L196 E283 V358 L389	P190-L192 HydrophobicContact CB-CD2 4.32Å; P190-L192 HydrophobicContact CG-CD2 3.77Å; P190-L192 HydrophobicContact CG-CG 4.11Å; P190-L192 PolarHBondContact O-N 3.47Å; L192-V194 VanDerWaalsContact C-N 3.3Å; L192-V194 PolarHBondContact O-N 3.28Å; L192-F195 PolarHBondContact O-N 2.96Å; L192-L196 WeakPolarHBondContact O-CG 3.25Å; L192-L196 PolarHBondContact O-N 3.39Å; L192-E283 PolarHBondContact N-OE1 2.97Å; L192-E283 VanDerWaalsContact N-OE1 3.13Å; L192-V358 HydrophobicContact CB-CG1 4.09Å; L192-V358 HydrophobicContact CB-CG2 3.87Å; L192-L389 HydrophobicContact CB-CD2 3.96Å; L192-L389 HydrophobicContact CD1-CD2 3.99Å; L192-L389 HydrophobicContact CD2-CD2 4.14Å; L192-L389 HydrophobicContact CG-CD2 4.25Å
193	S	93.7	Very high	91	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.4	-35.8	-178.9	70.4	0	0	0	0	111.6	P191 F197 E283 V287 C354	P191-S193 VanDerWaalsContact C-N 3.26Å; P191-S193 PolarHBondContact O-N 3.21Å; S193-F197 WeakPolarHBondContact O-CB 3.44Å; S193-F197 PolarHBondContact O-N 3.31Å; S193-E283 WeakPolarHBondContact CA-OE1 3.49Å; S193-E283 WeakPolarHBondContact CB-OE1 3.43Å; S193-E283 PolarHBondContact N-OE1 3.37Å; S193-E283 PolarHBondContact OG-OE1 3.29Å; S193-V287 VanDerWaalsContact OG-CG2 3.24Å; S193-V287 WeakPolarHBondContact OG-CG2 3.5Å; S193-C354 VanDerWaalsContact O-CB 3.26Å; S193-C354 WeakPolarHBondContact O-CB 3.42Å
194	V	94	Very high	90.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69	-43	175.8	177.9	0	0	0	0	110.2	P191 L192 L196 F197 C198 L255 F257 L286 V287 I290	P191-V194 HydrophobicContact CB-CB 4.24Å; P191-V194 HydrophobicContact CB-CG2 4.21Å; P191-V194 PolarHBondContact O-N 2.83Å; P191-V194 VanDerWaalsContact O-N 3.16Å; L192-V194 VanDerWaalsContact C-N 3.3Å; L192-V194 PolarHBondContact O-N 3.28Å; V194-L196 PolarHBondContact O-N 2.91Å; V194-F197 PolarHBondContact O-N 3.29Å; V194-C198 WeakPolarHBondContact O-CB 3.44Å; V194-C198 PolarHBondContact O-N 2.86Å; V194-C198 PolarHBondContact O-SG 3.47Å; V194-L255 HydrophobicContact CG1-CD1 4.17Å; V194-F257 HydrophobicContact CG1-CZ 4.09Å; V194-L286 HydrophobicContact CG2-CD2 3.73Å; V194-L286 HydrophobicContact CG2-CG 3.86Å; V194-V287 HydrophobicContact CG2-CG2 4.25Å; V194-I290 HydrophobicContact CB-CD1 4.34Å; V194-I290 HydrophobicContact CG1-CD1 3.49Å; V194-I290 VanDerWaalsContact CG1-CD1 3.49Å; V194-I290 HydrophobicContact CG2-CD1 3.9Å
195	F	93.2	Very high	90.5	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.013	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-41	176.9	-64.5	-27.6	0	0	0	113.2	P190 P191 L192 F197 C198 H199 L225 L228 M229 L232 F257 W259	P190-F195 HydrophobicContact CB-CD2 4.42Å; P190-F195 HydrophobicContact CB-CE2 3.76Å; P191-F195 HydrophobicContact CG-CE1 4.32Å; P191-F195 HydrophobicContact CG-CE2 4.33Å; P191-F195 HydrophobicContact CG-CZ 4.01Å; P191-F195 PolarHBondContact O-N 3.2Å; L192-F195 PolarHBondContact O-N 2.96Å; F195-F197 VanDerWaalsContact C-N 3.35Å; F195-C198 PolarHBondContact O-N 2.87Å; F195-H199 PolarHBondContact O-N 3.36Å; F195-L225 HydrophobicContact CE2-CD1 3.98Å; F195-L228 HydrophobicContact CB-CD2 3.99Å; F195-L228 HydrophobicContact CD2-CD2 3.47Å; F195-L228 VanDerWaalsContact CD2-CD2 3.47Å; F195-L228 HydrophobicContact CD2-CG 4.47Å; F195-L228 HydrophobicContact CE2-CD2 4.21Å; F195-L228 HydrophobicContact CG-CD2 4.01Å; F195-M229 HydrophobicContact CE1-SD 4.02Å; F195-M229 HydrophobicContact CE2-SD 4.49Å; F195-M229 HydrophobicContact CZ-SD 3.94Å; F195-L232 HydrophobicContact CB-CD1 4.09Å; F195-L232 HydrophobicContact CD1-CD1 3.84Å; F195-L232 HydrophobicContact CG-CD1 4.13Å; F195-F257 HydrophobicContact CD1-CE1 4.49Å; F195-F257 HydrophobicContact CD1-CE2 4.41Å; F195-F257 HydrophobicContact CD1-CZ 4.08Å; F195-F257 AromaticContact CE1-CD1 3.93Å; F195-F257 HydrophobicContact CE1-CD1 3.93Å; F195-F257 HydrophobicContact CE1-CD2 4.06Å; F195-F257 AromaticContact CE1-CE1 3.54Å; F195-F257 HydrophobicContact CE1-CE1 3.54Å; F195-F257 AromaticContact CE1-CE2 3.68Å; F195-F257 HydrophobicContact CE1-CE2 3.68Å; F195-F257 HydrophobicContact CE1-CG 4.18Å; F195-F257 AromaticContact CE1-CZ 3.4Å; F195-F257 HydrophobicContact CE1-CZ 3.4Å; F195-F257 VanDerWaalsContact CE1-CZ 3.4Å; F195-F257 HydrophobicContact CZ-CD1 4.07Å; F195-F257 HydrophobicContact CZ-CE1 4Å; F195-F257 HydrophobicContact CZ-CG 4.43Å; F195-F257 HydrophobicContact CZ-CZ 4.3Å; F195-W259 AromaticContact CE2-CH2 3.74Å; F195-W259 HydrophobicContact CE2-CH2 3.74Å; F195-W259 HydrophobicContact CE2-CZ2 4.32Å; F195-W259 AromaticContact CZ-CH2 3.46Å; F195-W259 HydrophobicContact CZ-CH2 3.46Å; F195-W259 VanDerWaalsContact CZ-CH2 3.46Å; F195-W259 AromaticContact CZ-CZ2 3.79Å; F195-W259 HydrophobicContact CZ-CZ2 3.79Å
196	L	93.3	Very high	90.3	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-48.4	171.9	-73.5	173.2	0	0	0	111.5	L192 V194 C198 H199 I200 C354 F357 V358 S385 F386 L389	L192-L196 WeakPolarHBondContact O-CG 3.25Å; L192-L196 PolarHBondContact O-N 3.39Å; V194-L196 PolarHBondContact O-N 2.91Å; L196-C198 VanDerWaalsContact C-N 3.35Å; L196-C198 PolarHBondContact O-N 3.18Å; L196-H199 PolarHBondContact O-N 3.02Å; L196-I200 WeakPolarHBondContact O-CG1 3.38Å; L196-I200 PolarHBondContact O-N 2.66Å; L196-C354 HydrophobicContact CB-CB 4.05Å; L196-C354 HydrophobicContact CD1-CB 4.46Å; L196-F357 HydrophobicContact CD1-CD1 4.4Å; L196-V358 HydrophobicContact CD1-CG2 3.62Å; L196-S385 WeakPolarHBondContact CD2-O 3.49Å; L196-F386 HydrophobicContact CD1-CD1 4.49Å; L196-L389 HydrophobicContact CD1-CD1 3.38Å; L196-L389 HydrophobicContact CD1-CD2 4.2Å; L196-L389 HydrophobicContact CD1-CG 3.86Å; L196-L389 HydrophobicContact CD2-CD1 4.12Å; L196-L389 HydrophobicContact CD2-CD2 4.39Å; L196-L389 HydrophobicContact CD2-CG 3.79Å; L196-L389 HydrophobicContact CG-CD1 4.16Å; L196-L389 HydrophobicContact CG-CD2 4.31Å; L196-L389 HydrophobicContact CG-CG 4.09Å
197	F	94	Very high	90.2	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.013	16%	0.161	C	C	.	.	H	α-helix	trans	-63.2	-43.2	-179.1	-172	-122.9	0	0	0	111.5	S193 V194 F195 H199 I200 L201 I290 L294 I351 C354	S193-F197 WeakPolarHBondContact O-CB 3.44Å; S193-F197 PolarHBondContact O-N 3.31Å; V194-F197 PolarHBondContact O-N 3.29Å; F195-F197 VanDerWaalsContact C-N 3.35Å; F197-H199 VanDerWaalsContact C-N 3.34Å; F197-H199 PolarHBondContact O-N 2.9Å; F197-I200 WeakPolarHBondContact O-CB 3.46Å; F197-I200 PolarHBondContact O-N 3.37Å; F197-I200 VanDerWaalsContact O-N 3.12Å; F197-L201 HydrophobicContact CD1-CD1 4.04Å; F197-L201 HydrophobicContact CE1-CD1 3.81Å; F197-L201 HydrophobicContact CE1-CG 4.33Å; F197-L201 HydrophobicContact CE2-CD2 4.4Å; F197-L201 HydrophobicContact CE2-CG 4.5Å; F197-L201 HydrophobicContact CZ-CD1 4.22Å; F197-L201 HydrophobicContact CZ-CD2 4.12Å; F197-L201 HydrophobicContact CZ-CG 4.3Å; F197-L201 WeakPolarHBondContact O-CG 3.45Å; F197-L201 PolarHBondContact O-N 3.45Å; F197-I290 HydrophobicContact CD1-CG2 4.1Å; F197-I290 HydrophobicContact CE1-CG2 3.96Å; F197-L294 HydrophobicContact CE1-CD1 3.72Å; F197-L294 HydrophobicContact CZ-CD1 4.36Å; F197-I351 HydrophobicContact CB-CG1 4.08Å; F197-I351 HydrophobicContact CD1-CB 3.89Å; F197-I351 HydrophobicContact CD1-CD1 3.83Å; F197-I351 HydrophobicContact CD1-CG1 3.77Å; F197-I351 HydrophobicContact CD2-CB 4.08Å; F197-I351 HydrophobicContact CD2-CG1 4.43Å; F197-I351 HydrophobicContact CE1-CB 3.94Å; F197-I351 HydrophobicContact CE1-CD1 4.25Å; F197-I351 HydrophobicContact CE1-CG1 4.27Å; F197-I351 HydrophobicContact CE2-CB 4.17Å; F197-I351 HydrophobicContact CG-CB 3.95Å; F197-I351 HydrophobicContact CG-CD1 4.38Å; F197-I351 HydrophobicContact CG-CG1 3.84Å; F197-I351 HydrophobicContact CZ-CB 4.09Å; F197-C354 HydrophobicContact CB-CB 4.26Å
198	C	92.6	Very high	90	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.014	16%	0.156	C	C	.	.	H	α-helix	trans	-54.6	-48.3	172.4	-73.7	0	0	0	0	112	V194 F195 L196 I200 L201 L202 I208 I210 L232 L255	V194-C198 WeakPolarHBondContact O-CB 3.44Å; V194-C198 PolarHBondContact O-N 2.86Å; V194-C198 PolarHBondContact O-SG 3.47Å; F195-C198 PolarHBondContact O-N 2.87Å; L196-C198 VanDerWaalsContact C-N 3.35Å; L196-C198 PolarHBondContact O-N 3.18Å; C198-I200 VanDerWaalsContact C-N 3.31Å; C198-I200 PolarHBondContact O-N 2.86Å; C198-L201 PolarHBondContact O-N 3.23Å; C198-L202 VanDerWaalsContact O-CG 3.3Å; C198-L202 WeakPolarHBondContact O-CG 3.28Å; C198-L202 PolarHBondContact O-N 3.46Å; C198-I208 VanDerWaalsContact CA-CD1 3.44Å; C198-I208 HydrophobicContact CB-CD1 3.46Å; C198-I208 VanDerWaalsContact CB-CD1 3.46Å; C198-I208 WeakPolarHBondContact O-CD1 3.42Å; C198-I210 HydrophobicContact CB-CD1 3.83Å; C198-L232 HydrophobicContact CB-CD2 4Å; C198-L255 VanDerWaalsContact SG-CD1 3.54Å
199	H	91.3	Very high	90.1	Very high	20 Å²	20	24.2 Å²	24.2	9%	0.093	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-37	177.6	-172.9	-88.5	0	0	0	112.5	F195 L196 F197 S203 L232 S385 L388	F195-H199 PolarHBondContact O-N 3.36Å; L196-H199 PolarHBondContact O-N 3.02Å; F197-H199 VanDerWaalsContact C-N 3.34Å; F197-H199 PolarHBondContact O-N 2.9Å; H199-S203 PolarHBondContact CE1-OG 2.99Å; H199-S203 PolarHBondContact ND1-OG 3.33Å; H199-S203 WeakPolarHBondContact O-CB 3.48Å; H199-S203 PolarHBondContact O-N 3.33Å; H199-S203 PolarHBondContact O-OG 3.03Å; H199-L232 HydrophobicContact CB-CD2 3.85Å; H199-S385 WeakPolarHBondContact ND1-CA 3.34Å; H199-S385 VanDerWaalsContact ND1-CB 3.32Å; H199-S385 WeakPolarHBondContact ND1-CB 3.27Å; H199-S385 PolarHBondContact ND1-OG 2.82Å; H199-L388 HydrophobicContact CB-CD1 3.98Å; H199-L388 VanDerWaalsContact CD2-CD1 3.44Å; H199-L388 WeakPolarHBondContact CD2-CD1 3.24Å
200	I	91.1	Very high	90.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-47.4	173.5	-69	172.9	0	0	0	110.5	L196 F197 C198 S203 N204 L348 P349 C354 S385 F386	L196-I200 WeakPolarHBondContact O-CG1 3.38Å; L196-I200 PolarHBondContact O-N 2.66Å; F197-I200 WeakPolarHBondContact O-CB 3.46Å; F197-I200 PolarHBondContact O-N 3.37Å; F197-I200 VanDerWaalsContact O-N 3.12Å; C198-I200 VanDerWaalsContact C-N 3.31Å; C198-I200 PolarHBondContact O-N 2.86Å; I200-S203 PolarHBondContact O-N 2.95Å; I200-N204 PolarHBondContact O-N 3.16Å; I200-N204 VanDerWaalsContact O-N 3.15Å; I200-N204 PolarHBondContact O-ND2 3.06Å; I200-L348 HydrophobicContact CG2-CD1 3.42Å; I200-L348 VanDerWaalsContact CG2-CD1 3.42Å; I200-L348 HydrophobicContact CG2-CD2 3.94Å; I200-L348 HydrophobicContact CG2-CG 3.68Å; I200-P349 HydrophobicContact CD1-CB 3.96Å; I200-P349 HydrophobicContact CD1-CG 4.16Å; I200-C354 WeakPolarHBondContact CD1-SG 3.41Å; I200-S385 VanDerWaalsContact CG1-CB 3.44Å; I200-S385 VanDerWaalsContact CG1-OG 3.23Å; I200-S385 WeakPolarHBondContact CG1-OG 3.08Å; I200-F386 HydrophobicContact CD1-CD2 4.37Å; I200-F386 HydrophobicContact CD1-CE2 3.52Å; I200-F386 HydrophobicContact CD1-CZ 3.88Å
201	L	90.3	Very high	90.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.4	-50.9	177.8	-66.5	175.4	0	0	0	111.2	I172 F197 C198 S203 N204 Q205 C206 I208 L294	I172-L201 HydrophobicContact CD1-CD2 3.35Å; I172-L201 HydrophobicContact CG1-CD2 4.38Å; F197-L201 HydrophobicContact CD1-CD1 4.04Å; F197-L201 HydrophobicContact CE1-CD1 3.81Å; F197-L201 HydrophobicContact CE1-CG 4.33Å; F197-L201 HydrophobicContact CE2-CD2 4.4Å; F197-L201 HydrophobicContact CE2-CG 4.5Å; F197-L201 HydrophobicContact CZ-CD1 4.22Å; F197-L201 HydrophobicContact CZ-CD2 4.12Å; F197-L201 HydrophobicContact CZ-CG 4.3Å; F197-L201 WeakPolarHBondContact O-CG 3.45Å; F197-L201 PolarHBondContact O-N 3.45Å; C198-L201 PolarHBondContact O-N 3.23Å; L201-S203 PolarHBondContact O-N 2.97Å; L201-N204 CarbonylContact O-C 3.55Å; L201-N204 PolarHBondContact O-N 2.91Å; L201-Q205 PolarHBondContact O-N 2.89Å; L201-C206 CarbonylContact C-O 3.55Å; L201-C206 HydrophobicContact CB-CB 3.96Å; L201-C206 HydrophobicContact CD2-CB 4.2Å; L201-C206 VanDerWaalsContact O-CB 3.27Å; L201-C206 WeakPolarHBondContact O-CB 3.34Å; L201-C206 PolarHBondContact O-N 3.34Å; L201-I208 HydrophobicContact CB-CD1 4.29Å; L201-I208 HydrophobicContact CB-CG2 4.34Å; L201-I208 HydrophobicContact CD1-CD1 4.43Å; L201-I208 HydrophobicContact CD1-CG2 3.73Å; L201-L294 HydrophobicContact CD1-CD1 3.73Å
202	L	88.2	Confident	90.2	Very high	7 Å²	7	22.2 Å²	22.2	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-58.7	-46.9	179.1	-67.2	168.8	0	0	0	112	C198 N204 Q205 I208 L232 D235 M236 W247	C198-L202 VanDerWaalsContact O-CG 3.3Å; C198-L202 WeakPolarHBondContact O-CG 3.28Å; C198-L202 PolarHBondContact O-N 3.46Å; L202-N204 PolarHBondContact O-N 3.48Å; L202-N204 VanDerWaalsContact O-N 3.14Å; L202-Q205 PolarHBondContact O-N 3.21Å; L202-I208 HydrophobicContact CD1-CD1 4.16Å; L202-I208 HydrophobicContact CD1-CG1 4.37Å; L202-I208 HydrophobicContact CD2-CD1 4.17Å; L202-I208 HydrophobicContact CD2-CG1 3.56Å; L202-I208 HydrophobicContact CG-CD1 3.83Å; L202-I208 HydrophobicContact CG-CG1 3.8Å; L202-L232 HydrophobicContact CD1-CD2 3.92Å; L202-L232 WeakPolarHBondContact CD1-O 3.4Å; L202-D235 HydrophobicContact CB-CB 4.2Å; L202-D235 HydrophobicContact CD1-CB 4.17Å; L202-D235 HydrophobicContact CD2-CB 4.14Å; L202-D235 HydrophobicContact CG-CB 4.4Å; L202-M236 HydrophobicContact CD2-CE 3.36Å; L202-W247 HydrophobicContact CD2-CH2 3.91Å; L202-W247 HydrophobicContact CD2-CZ3 4.17Å
203	S	87.2	Confident	90.2	Very high	59 Å²	59	22 Å²	22	41%	0.413	12%	0.117	S	C	.	.	H	α-helix	trans	-61.3	-23.4	178	-67.5	0	0	0	0	113.3	H199 I200 L201	H199-S203 PolarHBondContact CE1-OG 2.99Å; H199-S203 PolarHBondContact ND1-OG 3.33Å; H199-S203 WeakPolarHBondContact O-CB 3.48Å; H199-S203 PolarHBondContact O-N 3.33Å; H199-S203 PolarHBondContact O-OG 3.03Å; I200-S203 PolarHBondContact O-N 2.95Å; L201-S203 PolarHBondContact O-N 2.97Å
204	N	86.2	Confident	90.1	Very high	49 Å²	49	23.8 Å²	23.8	26%	0.262	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	27.5	178.7	-70.6	-89.4	0	0	0	112.3	I200 L201 L202 C206 L348 W383	I200-N204 PolarHBondContact O-N 3.16Å; I200-N204 VanDerWaalsContact O-N 3.15Å; I200-N204 PolarHBondContact O-ND2 3.06Å; L201-N204 CarbonylContact O-C 3.55Å; L201-N204 PolarHBondContact O-N 2.91Å; L202-N204 PolarHBondContact O-N 3.48Å; L202-N204 VanDerWaalsContact O-N 3.14Å; N204-C206 PolarHBondContact O-N 3.29Å; N204-C206 VanDerWaalsContact O-N 3.12Å; N204-L348 HydrophobicContact CB-CD1 4.22Å; N204-L348 VanDerWaalsContact CG-CD1 3.42Å; N204-L348 WeakPolarHBondContact ND2-CD1 3.5Å; N204-W383 WeakPolarHBondContact ND2-CZ3 3.26Å; N204-W383 WeakPolarHBondContact OD1-CH2 3.25Å; N204-W383 WeakPolarHBondContact OD1-CZ3 3.46Å
205	Q	84.7	Confident	89.9	Confident	87 Å²	87	24.4 Å²	24.4	41%	0.407	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	27.1	174	-54.4	176.9	8.2	0	0	113.1	L201 L202 W247 Q248 F249	L201-Q205 PolarHBondContact O-N 2.89Å; L202-Q205 PolarHBondContact O-N 3.21Å; Q205-W247 CarbonylContact O-C 3.59Å; Q205-Q248 HydrophobicContact CB-CB 4.17Å; Q205-Q248 HydrophobicContact CB-CG 3.9Å; Q205-Q248 PolarHBondContact O-N 3.24Å; Q205-Q248 VanDerWaalsContact OE1-CD 3.27Å; Q205-F249 PolarHBondContact O-N 2.91Å
206	C	86.7	Confident	89.8	Confident	6 Å²	6	28.3 Å²	28.3	4%	0.041	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.4	169.9	-61.4	0	0	0	0	109.5	L201 N204 F249 T251	L201-C206 CarbonylContact C-O 3.55Å; L201-C206 HydrophobicContact CB-CB 3.96Å; L201-C206 HydrophobicContact CD2-CB 4.2Å; L201-C206 VanDerWaalsContact O-CB 3.27Å; L201-C206 WeakPolarHBondContact O-CB 3.34Å; L201-C206 PolarHBondContact O-N 3.34Å; N204-C206 PolarHBondContact O-N 3.29Å; N204-C206 VanDerWaalsContact O-N 3.12Å; C206-F249 CarbonylContact C-O 3.31Å; C206-F249 WeakPolarHBondContact CA-O 3.49Å; C206-T251 HydrophobicContact CB-CG2 3.96Å
207	K	87.2	Confident	89.6	Confident	66 Å²	66	30.2 Å²	30.2	29%	0.287	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127	179.7	-175.7	-176.7	161.7	-151.4	0	110.4	M236 W247 F249 D250 T251	K207-M236 HydrophobicContact CB-CE 4.43Å; K207-M236 HydrophobicContact CG-CE 3.82Å; K207-M236 HydrophobicContact CG-SD 4.12Å; K207-W247 HydrophobicContact CB-CB 4.06Å; K207-W247 HydrophobicContact CB-CD2 3.75Å; K207-W247 HydrophobicContact CB-CE3 4.14Å; K207-W247 HydrophobicContact CB-CG 3.7Å; K207-W247 HydrophobicContact CD-CG 4.21Å; K207-W247 HydrophobicContact CG-CD2 4.25Å; K207-W247 HydrophobicContact CG-CG 4.21Å; K207-F249 PolarHBondContact N-O 3.36Å; K207-D250 HydrophobicContact CB-CB 4.42Å; K207-D250 HydrophobicContact CD-CB 4.41Å; K207-D250 WeakPolarHBondContact CD-OD2 3.38Å; K207-D250 WeakPolarHBondContact CE-OD2 3.49Å; K207-D250 IonicContact NZ-OD2 2.69Å; K207-D250 PolarHBondContact NZ-OD2 3Å; K207-T251 WeakPolarHBondContact O-CB 3.37Å; K207-T251 WeakPolarHBondContact O-CG2 3.21Å; K207-T251 PolarHBondContact O-N 3.35Å; K207-T251 PolarHBondContact O-OG1 2.83Å
208	I	88.7	Confident	89.4	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135	172.9	51.5	174.3	0	0	0	108.9	C198 L201 L202 I210 M236 T251 L253	C198-I208 VanDerWaalsContact CA-CD1 3.44Å; C198-I208 HydrophobicContact CB-CD1 3.46Å; C198-I208 VanDerWaalsContact CB-CD1 3.46Å; C198-I208 WeakPolarHBondContact O-CD1 3.42Å; L201-I208 HydrophobicContact CB-CD1 4.29Å; L201-I208 HydrophobicContact CB-CG2 4.34Å; L201-I208 HydrophobicContact CD1-CD1 4.43Å; L201-I208 HydrophobicContact CD1-CG2 3.73Å; L202-I208 HydrophobicContact CD1-CD1 4.16Å; L202-I208 HydrophobicContact CD1-CG1 4.37Å; L202-I208 HydrophobicContact CD2-CD1 4.17Å; L202-I208 HydrophobicContact CD2-CG1 3.56Å; L202-I208 HydrophobicContact CG-CD1 3.83Å; L202-I208 HydrophobicContact CG-CG1 3.8Å; I208-I210 HydrophobicContact CD1-CD1 3.77Å; I208-I210 HydrophobicContact CD1-CG1 4.3Å; I208-I210 HydrophobicContact CG1-CD1 4.3Å; I208-I210 HydrophobicContact CG1-CG1 4.47Å; I208-M236 HydrophobicContact CG1-CE 4.49Å; I208-M236 WeakPolarHBondContact O-CE 3.44Å; I208-T251 HydrophobicContact CG2-CG2 4Å; I208-T251 WeakPolarHBondContact CG2-OG1 3.3Å; I208-L253 HydrophobicContact CG2-CB 4.38Å
209	T	88.3	Confident	89.1	Confident	50 Å²	50	41 Å²	41	31%	0.307	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.6	175.8	-60.4	0	0	0	0	110	L253 C254 L255	T209-L253 PolarHBondContact N-O 2.91Å; T209-C254 CarbonylContact O-C 3.59Å; T209-C254 WeakPolarHBondContact O-CA 3.32Å; T209-L255 PolarHBondContact O-N 3.32Å
210	I	90.4	Very high	88.9	Confident	12 Å²	12	46.4 Å²	46.4	6%	0.062	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.3	176.5	-60.9	168.2	0	0	0	108.4	C198 I208 M229 L232 L255 F257	C198-I210 HydrophobicContact CB-CD1 3.83Å; I208-I210 HydrophobicContact CD1-CD1 3.77Å; I208-I210 HydrophobicContact CD1-CG1 4.3Å; I208-I210 HydrophobicContact CG1-CD1 4.3Å; I208-I210 HydrophobicContact CG1-CG1 4.47Å; I210-M229 HydrophobicContact CG2-CE 3.65Å; I210-L232 HydrophobicContact CD1-CB 3.91Å; I210-L232 HydrophobicContact CD1-CD1 4.36Å; I210-L232 HydrophobicContact CD1-CD2 4.42Å; I210-L232 HydrophobicContact CD1-CG 4.46Å; I210-L255 CarbonylContact C-O 3.59Å; I210-L255 WeakPolarHBondContact CA-O 3.45Å; I210-F257 HydrophobicContact CG2-CD2 3.94Å; I210-F257 HydrophobicContact CG2-CE2 4Å
211	N	89.8	Confident	88.8	Confident	41 Å²	41	46.7 Å²	46.7	22%	0.219	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	140.7	173.9	-65.4	-57.6	0	0	0	109.2	F213 L255 H256 F257	N211-F213 HydrophobicContact CB-CE2 3.56Å; N211-F213 HydrophobicContact CB-CZ 3.91Å; N211-L255 PolarHBondContact N-O 3.32Å; N211-H256 PolarHBondContact ND2-CE1 3.38Å; N211-H256 PolarHBondContact ND2-NE2 3.37Å; N211-H256 CarbonylContact O-C 3.59Å; N211-H256 WeakPolarHBondContact O-CA 3.22Å; N211-F257 PolarHBondContact O-N 3.02Å
212	S	91.5	Very high	88.8	Confident	14 Å²	14	49.8 Å²	49.8	10%	0.098	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.9	-177.8	-176.7	0	0	0	0	110.6	F257 W259	S212-F257 CarbonylContact C-O 3.55Å; S212-F257 WeakPolarHBondContact CA-O 3.46Å; S212-W259 PolarHBondContact OG-NE1 3.01Å
213	F	90.8	Very high	88.8	Confident	38 Å²	38	53.7 Å²	53.7	17%	0.167	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140	-179.2	-54.2	-88.4	0	0	0	109.4	M20 K22 N211 H256 F257 I258 W259	M20-F213 HydrophobicContact CE-CB 4.04Å; K22-F213 HydrophobicContact CB-CD1 4.37Å; K22-F213 HydrophobicContact CB-CE1 4.11Å; K22-F213 HydrophobicContact CG-CE1 4.09Å; N211-F213 HydrophobicContact CB-CE2 3.56Å; N211-F213 HydrophobicContact CB-CZ 3.91Å; F213-H256 HydrophobicContact CE2-CB 4.17Å; F213-H256 AromaticContact CE2-ND1 3.43Å; F213-H256 WeakPolarHBondContact CE2-ND1 3.44Å; F213-H256 AromaticContact CZ-ND1 3.88Å; F213-F257 PolarHBondContact N-O 3.06Å; F213-I258 HydrophobicContact CB-CG1 4.49Å; F213-I258 HydrophobicContact CD2-CG1 4.49Å; F213-I258 WeakPolarHBondContact O-CA 3.28Å; F213-W259 PolarHBondContact O-N 3.4Å
214	V	92	Very high	88.9	Confident	36 Å²	36	53.3 Å²	53.3	22%	0.218	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.3	177.3	-178.9	0	0	0	0	108.5	L23 V218 L221	L23-V214 HydrophobicContact CD1-CG2 3.6Å; V214-V218 HydrophobicContact CG1-CB 3.79Å; V214-V218 HydrophobicContact CG1-CG1 3.99Å; V214-L221 HydrophobicContact CG2-CD1 3.63Å; V214-L221 HydrophobicContact CG2-CD2 4.32Å; V214-L221 HydrophobicContact CG2-CG 3.85Å
215	H	90.3	Very high	89	Confident	13 Å²	13	51.3 Å²	51.3	6%	0.06	28%	0.277	C	S	.	.			trans	-76.2	149.2	174.3	-170.2	-102.7	0	0	0	110.3	A15 T217 V218 I258 W259 N260	A15-H215 WeakPolarHBondContact CB-NE2 3.42Å; H215-T217 VanDerWaalsContact CE1-CG2 3.47Å; H215-T217 WeakPolarHBondContact CE1-CG2 3.36Å; H215-T217 WeakPolarHBondContact ND1-CG2 3.49Å; H215-T217 PolarHBondContact ND1-N 3.15Å; H215-T217 PolarHBondContact ND1-OG1 3.28Å; H215-T217 PolarHBondContact O-N 3.2Å; H215-V218 PolarHBondContact O-N 3.35Å; H215-I258 HydrophobicContact CB-CG2 4.39Å; H215-W259 WeakPolarHBondContact CB-O 3.46Å; H215-W259 PolarHBondContact N-O 3.46Å; H215-N260 HydrophobicContact CB-CB 4.07Å
216	S	90.3	Very high	89.2	Confident	86 Å²	86	50.3 Å²	50.3	60%	0.601	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.2	-177.5	57.9	0	0	0	0	114.6	V218	S216-V218 PolarHBondContact O-N 3.03Å
217	T	90.2	Very high	89.2	Confident	44 Å²	44	55.4 Å²	55.4	27%	0.27	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-17.6	175.8	60.3	0	0	0	0	113	H215 N260 S261 S262	H215-T217 VanDerWaalsContact CE1-CG2 3.47Å; H215-T217 WeakPolarHBondContact CE1-CG2 3.36Å; H215-T217 WeakPolarHBondContact ND1-CG2 3.49Å; H215-T217 PolarHBondContact ND1-N 3.15Å; H215-T217 PolarHBondContact ND1-OG1 3.28Å; H215-T217 PolarHBondContact O-N 3.2Å; T217-N260 PolarHBondContact OG1-OD1 3.49Å; T217-S261 WeakPolarHBondContact CB-OG 3.47Å; T217-S261 PolarHBondContact O-OG 3.4Å; T217-S261 PolarHBondContact OG1-N 3.13Å; T217-S261 PolarHBondContact OG1-OG 3.39Å; T217-S261 VanDerWaalsContact OG1-OG 3.06Å; T217-S262 WeakPolarHBondContact CG2-OG 3.47Å
218	V	89	Confident	89.2	Confident	14 Å²	14	53.3 Å²	53.3	9%	0.085	29%	0.285	C	S	.	.			trans	-98.8	113.1	177.7	179.4	0	0	0	0	108.4	P187 V214 H215 S216 L221 W259 S261	P187-V218 HydrophobicContact CG-CG1 4.04Å; P187-V218 HydrophobicContact CG-CG2 3.84Å; V214-V218 HydrophobicContact CG1-CB 3.79Å; V214-V218 HydrophobicContact CG1-CG1 3.99Å; H215-V218 PolarHBondContact O-N 3.35Å; S216-V218 PolarHBondContact O-N 3.03Å; V218-L221 HydrophobicContact CG1-CD2 4.01Å; V218-W259 HydrophobicContact CG2-CB 4.4Å; V218-W259 VanDerWaalsContact CG2-O 3.26Å; V218-W259 WeakPolarHBondContact CG2-O 3.45Å; V218-S261 VanDerWaalsContact CG2-N 3.31Å
219	K	87.4	Confident	89.1	Confident	217 Å²	217	53.8 Å²	53.8	94%	0.943	29%	0.287	S	S	*	.	S	Bend	trans	-64.7	-46.1	177.8	-66.8	-174.1	178.1	-175.4	0	112.1
220	E	87.3	Confident	89	Confident	134 Å²	134	56.1 Å²	56.1	63%	0.626	30%	0.295	S	S	*	.			trans	-155.6	144.4	179.7	-159.3	-174.2	169.2	0	0	110	K226	E220-K226 IonicContact OE1-NZ 3.92Å; E220-K226 PolarHBondContact OE1-NZ 2.98Å
221	L	89	Confident	88.7	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	31%	0.305	C	S	.	.			trans	-79.1	145.5	167.4	-62.6	177.6	0	0	0	110.4	L23 P187 V214 V218 L225 K226 W259	L23-L221 HydrophobicContact CD1-CD1 4.14Å; P187-L221 HydrophobicContact CB-CD2 3.75Å; P187-L221 HydrophobicContact CG-CD2 4.5Å; V214-L221 HydrophobicContact CG2-CD1 3.63Å; V214-L221 HydrophobicContact CG2-CD2 4.32Å; V214-L221 HydrophobicContact CG2-CG 3.85Å; V218-L221 HydrophobicContact CG1-CD2 4.01Å; L221-L225 HydrophobicContact CD2-CD2 3.97Å; L221-K226 HydrophobicContact CB-CD 4.45Å; L221-K226 HydrophobicContact CB-CG 3.82Å; L221-K226 VanDerWaalsContact O-CE 3.23Å; L221-K226 WeakPolarHBondContact O-CE 3.28Å; L221-W259 HydrophobicContact CD1-CG 4.26Å; L221-W259 HydrophobicContact CD2-CB 3.72Å; L221-W259 HydrophobicContact CD2-CD2 4.03Å; L221-W259 HydrophobicContact CD2-CG 3.57Å
222	S	89.9	Confident	88.5	Confident	64 Å²	64	56.2 Å²	56.2	45%	0.448	29%	0.294	S	S	.	.			trans	-59.8	147.9	173.4	68.9	0	0	0	0	111.3	S224 L225 K226	S222-S224 PolarHBondContact O-N 3.43Å; S222-L225 PolarHBondContact O-N 2.78Å; S222-L225 VanDerWaalsContact O-N 3.1Å; S222-L225 WeakPolarHBondContact OG-CB 3.47Å; S222-L225 PolarHBondContact OG-N 2.72Å; S222-K226 PolarHBondContact O-N 3.48Å
223	T	88.6	Confident	87.7	Confident	90 Å²	90	57.6 Å²	57.6	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-57.1	-37.8	179.1	-51.3	0	0	0	0	112.3	K226 K227	T223-K226 PolarHBondContact O-N 3.22Å; T223-K227 HydrophobicContact CG2-CD 4.35Å; T223-K227 WeakPolarHBondContact O-CB 2.99Å; T223-K227 WeakPolarHBondContact O-CG 3.46Å; T223-K227 PolarHBondContact O-N 3.47Å
224	S	87.6	Confident	86.3	Confident	50 Å²	50	60.1 Å²	60.1	35%	0.35	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-46	175.9	-63.2	0	0	0	0	112	S222 K227 L228 L391	S222-S224 PolarHBondContact O-N 3.43Å; S224-K227 PolarHBondContact O-N 2.87Å; S224-L228 PolarHBondContact O-N 3.4Å; S224-L391 WeakPolarHBondContact CB-OXT 3.23Å; S224-L391 PolarHBondContact OG-OXT 2.79Å
225	L	89	Confident	84.7	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-68.8	-39.8	179.9	-176.5	59.3	0	0	0	111.8	P187 P190 F195 L221 S222 L228 M229 W259	P187-L225 HydrophobicContact CB-CD2 4.03Å; P190-L225 HydrophobicContact CB-CD1 4.24Å; F195-L225 HydrophobicContact CE2-CD1 3.98Å; L221-L225 HydrophobicContact CD2-CD2 3.97Å; S222-L225 PolarHBondContact O-N 2.78Å; S222-L225 VanDerWaalsContact O-N 3.1Å; S222-L225 WeakPolarHBondContact OG-CB 3.47Å; S222-L225 PolarHBondContact OG-N 2.72Å; L225-L228 PolarHBondContact O-N 3.37Å; L225-M229 HydrophobicContact CD1-CG 4.48Å; L225-M229 WeakPolarHBondContact O-CG 3.32Å; L225-M229 PolarHBondContact O-N 2.9Å; L225-W259 HydrophobicContact CD1-CH2 3.59Å; L225-W259 HydrophobicContact CD1-CZ2 3.8Å; L225-W259 HydrophobicContact CD1-CZ3 4.39Å; L225-W259 HydrophobicContact CD2-CD2 4.13Å; L225-W259 HydrophobicContact CD2-CE3 3.97Å; L225-W259 HydrophobicContact CD2-CH2 3.67Å; L225-W259 HydrophobicContact CD2-CZ2 3.88Å; L225-W259 HydrophobicContact CD2-CZ3 3.73Å; L225-W259 HydrophobicContact CG-CH2 4.1Å; L225-W259 HydrophobicContact CG-CZ2 4.07Å
226	K	88.5	Confident	82.8	Confident	66 Å²	66	62.3 Å²	62.3	29%	0.287	33%	0.329	S	S	.	.	H	α-helix	trans	-56.9	-50.6	173.2	-71.2	177.2	176.5	176.3	0	111.2	E220 L221 S222 T223 L228 M229 E230	E220-K226 IonicContact OE1-NZ 3.92Å; E220-K226 PolarHBondContact OE1-NZ 2.98Å; L221-K226 HydrophobicContact CB-CD 4.45Å; L221-K226 HydrophobicContact CB-CG 3.82Å; L221-K226 VanDerWaalsContact O-CE 3.23Å; L221-K226 WeakPolarHBondContact O-CE 3.28Å; S222-K226 PolarHBondContact O-N 3.48Å; T223-K226 PolarHBondContact O-N 3.22Å; K226-L228 VanDerWaalsContact C-N 3.32Å; K226-L228 PolarHBondContact O-N 3.35Å; K226-M229 PolarHBondContact O-N 3.45Å; K226-E230 WeakPolarHBondContact O-CG 3.44Å; K226-E230 PolarHBondContact O-N 3.24Å
227	K	86.7	Confident	80.7	Confident	114 Å²	114	65.9 Å²	65.9	50%	0.496	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-41.3	177	-75	175.8	177.7	179.4	0	112.5	T223 S224 E230 I231	T223-K227 HydrophobicContact CG2-CD 4.35Å; T223-K227 WeakPolarHBondContact O-CB 2.99Å; T223-K227 WeakPolarHBondContact O-CG 3.46Å; T223-K227 PolarHBondContact O-N 3.47Å; S224-K227 PolarHBondContact O-N 2.87Å; K227-E230 PolarHBondContact O-N 3.27Å; K227-I231 VanDerWaalsContact O-CG1 3.27Å; K227-I231 WeakPolarHBondContact O-CG1 3.48Å; K227-I231 PolarHBondContact O-N 3.43Å
228	L	87.3	Confident	78.3	Confident	22 Å²	22	65.1 Å²	65.1	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-62.6	-45.5	176.6	-177.4	62.9	0	0	0	111.3	F195 S224 L225 K226 E230 I231 L232	F195-L228 HydrophobicContact CB-CD2 3.99Å; F195-L228 HydrophobicContact CD2-CD2 3.47Å; F195-L228 VanDerWaalsContact CD2-CD2 3.47Å; F195-L228 HydrophobicContact CD2-CG 4.47Å; F195-L228 HydrophobicContact CE2-CD2 4.21Å; F195-L228 HydrophobicContact CG-CD2 4.01Å; S224-L228 PolarHBondContact O-N 3.4Å; L225-L228 PolarHBondContact O-N 3.37Å; K226-L228 VanDerWaalsContact C-N 3.32Å; K226-L228 PolarHBondContact O-N 3.35Å; L228-E230 VanDerWaalsContact C-N 3.33Å; L228-E230 PolarHBondContact O-N 3.41Å; L228-I231 PolarHBondContact O-N 2.96Å; L228-L232 HydrophobicContact CG-CD1 4.34Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 3.34Å; L228-L232 VanDerWaalsContact O-N 3.08Å
229	M	88	Confident	75.9	Confident	11 Å²	11	68.4 Å²	68.4	5%	0.054	36%	0.36	C	S	.	.	H	α-helix	trans	-65.3	-36.2	176.9	-66.5	-46.5	-67.2	0	0	112.4	F195 I210 L225 K226 L232 S233 F257 W259	F195-M229 HydrophobicContact CE1-SD 4.02Å; F195-M229 HydrophobicContact CE2-SD 4.49Å; F195-M229 HydrophobicContact CZ-SD 3.94Å; I210-M229 HydrophobicContact CG2-CE 3.65Å; L225-M229 HydrophobicContact CD1-CG 4.48Å; L225-M229 WeakPolarHBondContact O-CG 3.32Å; L225-M229 PolarHBondContact O-N 2.9Å; K226-M229 PolarHBondContact O-N 3.45Å; M229-L232 PolarHBondContact O-N 2.91Å; M229-L232 HydrophobicContact SD-CD1 4.34Å; M229-S233 VanDerWaalsContact O-CB 3.28Å; M229-S233 WeakPolarHBondContact O-CB 3.39Å; M229-S233 PolarHBondContact O-N 3.01Å; M229-S233 PolarHBondContact O-OG 2.93Å; M229-F257 HydrophobicContact CE-CD2 4.19Å; M229-W259 HydrophobicContact CG-CZ2 4.26Å; M229-W259 HydrophobicContact SD-CZ2 4Å
230	E	84.9	Confident	73.4	Confident	99 Å²	99	61.6 Å²	61.6	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-48.9	172.9	-75.4	167.8	-166.3	0	0	111.3	K226 K227 L228 L232 S233 I234	K226-E230 WeakPolarHBondContact O-CG 3.44Å; K226-E230 PolarHBondContact O-N 3.24Å; K227-E230 PolarHBondContact O-N 3.27Å; L228-E230 VanDerWaalsContact C-N 3.33Å; L228-E230 PolarHBondContact O-N 3.41Å; E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 3.33Å; E230-S233 PolarHBondContact O-N 3.26Å; E230-I234 HydrophobicContact CB-CD1 4.25Å; E230-I234 WeakPolarHBondContact O-CB 3.32Å; E230-I234 WeakPolarHBondContact O-CD1 3.35Å; E230-I234 WeakPolarHBondContact O-CG1 3.17Å; E230-I234 PolarHBondContact O-N 2.77Å
231	I	84.2	Confident	71.2	Confident	53 Å²	53	63 Å²	63	27%	0.272	35%	0.35	S	S	.	.	H	α-helix	trans	-55.3	-47.6	176.6	-68.3	163.7	0	0	0	110.4	K227 L228 S233 L388	K227-I231 VanDerWaalsContact O-CG1 3.27Å; K227-I231 WeakPolarHBondContact O-CG1 3.48Å; K227-I231 PolarHBondContact O-N 3.43Å; L228-I231 PolarHBondContact O-N 2.96Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 2.74Å; I231-L388 HydrophobicContact CD1-CD2 4.45Å
232	L	85.6	Confident	68.6	Low	1 Å²	1	69.3 Å²	69.3	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-68.5	-24	-179.7	-66.7	176.2	0	0	0	113.6	F195 C198 H199 L202 I210 L228 M229 E230	F195-L232 HydrophobicContact CB-CD1 4.09Å; F195-L232 HydrophobicContact CD1-CD1 3.84Å; F195-L232 HydrophobicContact CG-CD1 4.13Å; C198-L232 HydrophobicContact CB-CD2 4Å; H199-L232 HydrophobicContact CB-CD2 3.85Å; L202-L232 HydrophobicContact CD1-CD2 3.92Å; L202-L232 WeakPolarHBondContact CD1-O 3.4Å; I210-L232 HydrophobicContact CD1-CB 3.91Å; I210-L232 HydrophobicContact CD1-CD1 4.36Å; I210-L232 HydrophobicContact CD1-CD2 4.42Å; I210-L232 HydrophobicContact CD1-CG 4.46Å; L228-L232 HydrophobicContact CG-CD1 4.34Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 3.34Å; L228-L232 VanDerWaalsContact O-N 3.08Å; M229-L232 PolarHBondContact O-N 2.91Å; M229-L232 HydrophobicContact SD-CD1 4.34Å; E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 3.33Å
233	S	76.4	Confident	66.2	Low	43 Å²	43	72.1 Å²	72.1	30%	0.301	39%	0.394	S	S	.	.	H	α-helix	trans	-91.9	-34.1	-178.9	-55.9	0	0	0	0	113.1	M229 E230 I231 D235 M236	M229-S233 VanDerWaalsContact O-CB 3.28Å; M229-S233 WeakPolarHBondContact O-CB 3.39Å; M229-S233 PolarHBondContact O-N 3.01Å; M229-S233 PolarHBondContact O-OG 2.93Å; E230-S233 PolarHBondContact O-N 3.26Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 2.74Å; S233-D235 VanDerWaalsContact C-N 3.29Å; S233-D235 PolarHBondContact O-N 3.35Å; S233-M236 WeakPolarHBondContact O-CB 3.02Å; S233-M236 PolarHBondContact O-N 3.29Å
234	I	61.3	Low	64.1	Low	91 Å²	91	72.9 Å²	72.9	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-64.8	-35.9	-177.2	-72.2	162.6	0	0	0	110.9	E230 M236 H237	E230-I234 HydrophobicContact CB-CD1 4.25Å; E230-I234 WeakPolarHBondContact O-CB 3.32Å; E230-I234 WeakPolarHBondContact O-CD1 3.35Å; E230-I234 WeakPolarHBondContact O-CG1 3.17Å; E230-I234 PolarHBondContact O-N 2.77Å; I234-M236 PolarHBondContact O-N 2.81Å; I234-H237 PolarHBondContact O-N 2.71Å
235	D	56.6	Low	62.5	Low	59 Å²	59	73.4 Å²	73.4	32%	0.316	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-61.9	-29.5	179.4	-78	-16.8	0	0	0	112.1	L202 S233 H237 W247	L202-D235 HydrophobicContact CB-CB 4.2Å; L202-D235 HydrophobicContact CD1-CB 4.17Å; L202-D235 HydrophobicContact CD2-CB 4.14Å; L202-D235 HydrophobicContact CG-CB 4.4Å; S233-D235 VanDerWaalsContact C-N 3.29Å; S233-D235 PolarHBondContact O-N 3.35Å; D235-H237 VanDerWaalsContact C-N 3.34Å; D235-H237 PolarHBondContact O-N 2.61Å; D235-W247 HydrophobicContact CB-CH2 4.3Å; D235-W247 WeakPolarHBondContact O-CH2 3.43Å; D235-W247 WeakPolarHBondContact O-CZ2 3.49Å
236	M	50.8	Low	61	Low	36 Å²	36	79.6 Å²	79.6	18%	0.177	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-66.7	-28.7	177.5	-80.5	-70.1	112.5	0	0	114.7	L202 K207 I208 S233 I234 W247	L202-M236 HydrophobicContact CD2-CE 3.36Å; K207-M236 HydrophobicContact CB-CE 4.43Å; K207-M236 HydrophobicContact CG-CE 3.82Å; K207-M236 HydrophobicContact CG-SD 4.12Å; I208-M236 HydrophobicContact CG1-CE 4.49Å; I208-M236 WeakPolarHBondContact O-CE 3.44Å; S233-M236 WeakPolarHBondContact O-CB 3.02Å; S233-M236 PolarHBondContact O-N 3.29Å; I234-M236 PolarHBondContact O-N 2.81Å; M236-W247 HydrophobicContact CE-CH2 3.86Å; M236-W247 HydrophobicContact CE-CZ2 3.71Å
237	H	46	Very low	60.4	Low	162 Å²	162	79.5 Å²	79.5	75%	0.75	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-102.6	3.5	-169.4	-72.8	-60.3	0	0	0	114.3	I234 D235 S239	I234-H237 PolarHBondContact O-N 2.71Å; D235-H237 VanDerWaalsContact C-N 3.34Å; D235-H237 PolarHBondContact O-N 2.61Å; H237-S239 PolarHBondContact O-N 3.1Å
238	G	41.4	Very low	59.7	Low	27 Å²	27	79.9 Å²	79.9	28%	0.278	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	32.9	173.4	0	0	0	0	0	113	S240	G238-S240 PolarHBondContact O-N 3.15Å
239	S	37.5	Very low	59.3	Low	84 Å²	84	84.1 Å²	84.1	59%	0.587	45%	0.449	S	S	*	.			trans	-75.1	27	-171	79	0	0	0	0	113.8	H237 I241	H237-S239 PolarHBondContact O-N 3.1Å; S239-I241 PolarHBondContact O-N 3.41Å
240	S	35.3	Very low	59.1	Low	74 Å²	74	86.5 Å²	86.5	52%	0.517	46%	0.462	S	S	.	.			trans	-76.3	109	150.8	172.5	0	0	0	0	106.1	G238 N242 N243	G238-S240 PolarHBondContact O-N 3.15Å; S240-N242 PolarHBondContact O-N 2.63Å; S240-N243 PolarHBondContact O-N 3.21Å
241	I	41	Very low	59	Low	164 Å²	164	81.9 Å²	81.9	84%	0.841	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-1.1	177.7	-74.8	162.8	0	0	0	113.7	S239	S239-I241 PolarHBondContact O-N 3.41Å
242	N	34.8	Very low	59	Low	138 Å²	138	82.8 Å²	82.8	74%	0.738	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	10.6	-177.6	-78	-25.3	0	0	0	117.6	S240	S240-N242 PolarHBondContact O-N 2.63Å
243	N	39.9	Very low	59.2	Low	124 Å²	124	82.9 Å²	82.9	66%	0.663	44%	0.442	S	S	*	.			trans	-149.6	124.2	175.4	-86	-33.9	0	0	0	112.7	S240 C245	S240-N243 PolarHBondContact O-N 3.21Å; N243-C245 PolarHBondContact O-N 3.37Å
244	T	44	Very low	59.9	Low	105 Å²	105	81.8 Å²	81.8	64%	0.644	44%	0.435	S	S	*	.			trans	-50.4	112.2	162.8	37.1	0	0	0	0	109.1	H246	T244-H246 VanDerWaalsContact C-N 3.34Å; T244-H246 WeakPolarHBondContact CB-NE2 3.45Å; T244-H246 PolarHBondContact O-CD2 3.31Å; T244-H246 VanDerWaalsContact O-CD2 3.22Å; T244-H246 PolarHBondContact O-N 3.47Å; T244-H246 PolarHBondContact OG1-CD2 3.22Å; T244-H246 PolarHBondContact OG1-NE2 3.33Å
245	C	53.1	Low	61.3	Low	61 Å²	61	77.4 Å²	77.4	41%	0.412	41%	0.412	S	S	.	.			trans	-66.6	97.9	171.5	-171.2	0	0	0	0	108	N243 W247	N243-C245 PolarHBondContact O-N 3.37Å; C245-W247 PolarHBondContact O-N 2.96Å
246	H	59	Low	63	Low	138 Å²	138	76.7 Å²	76.7	64%	0.639	41%	0.407	S	S	*	.			trans	-83.6	92.7	175.2	-71.9	-72.5	0	0	0	108.4	T244 Q248	T244-H246 VanDerWaalsContact C-N 3.34Å; T244-H246 WeakPolarHBondContact CB-NE2 3.45Å; T244-H246 PolarHBondContact O-CD2 3.31Å; T244-H246 VanDerWaalsContact O-CD2 3.22Å; T244-H246 PolarHBondContact O-N 3.47Å; T244-H246 PolarHBondContact OG1-CD2 3.22Å; T244-H246 PolarHBondContact OG1-NE2 3.33Å; H246-Q248 PolarHBondContact O-N 3.45Å
247	W	74.1	Confident	65	Low	63 Å²	63	75 Å²	75	24%	0.239	40%	0.398	C	S	.	.			trans	-60.4	129	166.3	-56.2	108.3	0	0	0	109.3	L202 Q205 K207 D235 M236 C245	L202-W247 HydrophobicContact CD2-CH2 3.91Å; L202-W247 HydrophobicContact CD2-CZ3 4.17Å; Q205-W247 CarbonylContact O-C 3.59Å; K207-W247 HydrophobicContact CB-CB 4.06Å; K207-W247 HydrophobicContact CB-CD2 3.75Å; K207-W247 HydrophobicContact CB-CE3 4.14Å; K207-W247 HydrophobicContact CB-CG 3.7Å; K207-W247 HydrophobicContact CD-CG 4.21Å; K207-W247 HydrophobicContact CG-CD2 4.25Å; K207-W247 HydrophobicContact CG-CG 4.21Å; D235-W247 HydrophobicContact CB-CH2 4.3Å; D235-W247 WeakPolarHBondContact O-CH2 3.43Å; D235-W247 WeakPolarHBondContact O-CZ2 3.49Å; M236-W247 HydrophobicContact CE-CH2 3.86Å; M236-W247 HydrophobicContact CE-CZ2 3.71Å; C245-W247 PolarHBondContact O-N 2.96Å
248	Q	73.8	Confident	67.2	Low	122 Å²	122	67.9 Å²	67.9	57%	0.57	37%	0.366	S	S	*	.	S	Bend	trans	-73.3	-37	174.3	-70.6	179.6	8.7	0	0	110.8	Q205 H246	Q205-Q248 HydrophobicContact CB-CB 4.17Å; Q205-Q248 HydrophobicContact CB-CG 3.9Å; Q205-Q248 PolarHBondContact O-N 3.24Å; Q205-Q248 VanDerWaalsContact OE1-CD 3.27Å; H246-Q248 PolarHBondContact O-N 3.45Å
249	F	78.7	Confident	69.6	Low	111 Å²	111	66.6 Å²	66.6	49%	0.487	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.4	-174.4	-57.7	-76.9	0	0	0	110.4	Q205 C206 K207	Q205-F249 PolarHBondContact O-N 2.91Å; C206-F249 CarbonylContact C-O 3.31Å; C206-F249 WeakPolarHBondContact CA-O 3.49Å; K207-F249 PolarHBondContact N-O 3.36Å
250	D	82.9	Confident	72.2	Confident	62 Å²	62	63 Å²	63	33%	0.332	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	111.9	167.5	-166.8	-20.7	0	0	0	109.1	V174 K207 K252	V174-D250 WeakPolarHBondContact CG1-O 3.27Å; K207-D250 HydrophobicContact CB-CB 4.42Å; K207-D250 HydrophobicContact CD-CB 4.41Å; K207-D250 WeakPolarHBondContact CD-OD2 3.38Å; K207-D250 WeakPolarHBondContact CE-OD2 3.49Å; K207-D250 IonicContact NZ-OD2 2.69Å; K207-D250 PolarHBondContact NZ-OD2 3Å; D250-K252 PolarHBondContact O-N 3.02Å; D250-K252 WeakPolarHBondContact OD1-CA 3.5Å; D250-K252 PolarHBondContact OD1-N 2.91Å
251	T	82.9	Confident	74.8	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-14	179.8	67.4	0	0	0	0	112.4	I172 P175 C206 K207 I208 L253 L294	I172-T251 HydrophobicContact CG2-CG2 4.48Å; P175-T251 WeakPolarHBondContact CD-O 3.4Å; P175-T251 WeakPolarHBondContact CG-O 3.47Å; C206-T251 HydrophobicContact CB-CG2 3.96Å; K207-T251 WeakPolarHBondContact O-CB 3.37Å; K207-T251 WeakPolarHBondContact O-CG2 3.21Å; K207-T251 PolarHBondContact O-N 3.35Å; K207-T251 PolarHBondContact O-OG1 2.83Å; I208-T251 HydrophobicContact CG2-CG2 4Å; I208-T251 WeakPolarHBondContact CG2-OG1 3.3Å; T251-L253 PolarHBondContact O-N 2.9Å; T251-L253 PolarHBondContact OG1-N 3.15Å; T251-L294 HydrophobicContact CG2-CD2 4.24Å
252	K	84.8	Confident	76.9	Confident	73 Å²	73	56 Å²	56	32%	0.317	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.7	20.7	-171.3	-45.7	-178.4	-174.4	154.3	0	114.2	V174 P175 K176 P178 S179 D250	V174-K252 HydrophobicContact CG1-CD 4.43Å; V174-K252 HydrophobicContact CG1-CG 4.38Å; P175-K252 HydrophobicContact CG-CB 4.34Å; P175-K252 WeakPolarHBondContact O-CD 3.37Å; P175-K252 PolarHBondContact O-NZ 3.34Å; K176-K252 PolarHBondContact O-NZ 3.28Å; P178-K252 CarbonylContact C-O 3.58Å; P178-K252 VanDerWaalsContact CA-O 3.24Å; P178-K252 WeakPolarHBondContact CA-O 3.33Å; P178-K252 HydrophobicContact CB-CB 4.16Å; S179-K252 PolarHBondContact N-O 3.11Å; D250-K252 PolarHBondContact O-N 3.02Å; D250-K252 WeakPolarHBondContact OD1-CA 3.5Å; D250-K252 PolarHBondContact OD1-N 2.91Å
253	L	89.4	Confident	79.1	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.9	173.4	179.9	64.2	0	0	0	109	L181 I208 T209 T251 L255 I290 I293 L294	L181-L253 HydrophobicContact CD1-CD1 4.3Å; L181-L253 HydrophobicContact CG-CD1 4.46Å; I208-L253 HydrophobicContact CG2-CB 4.38Å; T209-L253 PolarHBondContact N-O 2.91Å; T251-L253 PolarHBondContact O-N 2.9Å; T251-L253 PolarHBondContact OG1-N 3.15Å; L253-L255 HydrophobicContact CD1-CD2 3.78Å; L253-L255 HydrophobicContact CD2-CD1 4.35Å; L253-L255 HydrophobicContact CD2-CD2 4.07Å; L253-L255 HydrophobicContact CD2-CG 4.28Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.09Å; L253-I290 HydrophobicContact CD2-CG2 4.05Å; L253-I293 HydrophobicContact CD1-CD1 4.2Å; L253-I293 HydrophobicContact CD1-CG2 4.38Å; L253-L294 HydrophobicContact CB-CD2 4.47Å; L253-L294 HydrophobicContact CD2-CD1 3.67Å; L253-L294 HydrophobicContact CD2-CG 4.3Å
254	C	90	Very high	80.6	Confident	20 Å²	20	49.4 Å²	49.4	14%	0.135	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.1	174.9	-168	0	0	0	0	110.1	S179 T180 L181 T209 H256	S179-C254 PolarHBondContact O-N 3.08Å; T180-C254 CarbonylContact C-O 3.21Å; T180-C254 WeakPolarHBondContact CA-O 3.28Å; T180-C254 HydrophobicContact CG2-CB 4.16Å; L181-C254 PolarHBondContact N-O 3.25Å; T209-C254 CarbonylContact O-C 3.59Å; T209-C254 WeakPolarHBondContact O-CA 3.32Å; C254-H256 PolarHBondContact SG-NE2 3.29Å
255	L	92.3	Very high	82.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121	-178.3	-55.8	-178.5	0	0	0	109.7	L181 I183 V194 C198 T209 I210 N211 L253 F257 I290	L181-L255 HydrophobicContact CB-CD2 3.95Å; L181-L255 HydrophobicContact CD1-CD2 3.88Å; L181-L255 HydrophobicContact CG-CD2 4.2Å; I183-L255 HydrophobicContact CD1-CB 4.35Å; I183-L255 HydrophobicContact CD1-CD2 4.11Å; V194-L255 HydrophobicContact CG1-CD1 4.17Å; C198-L255 VanDerWaalsContact SG-CD1 3.54Å; T209-L255 PolarHBondContact O-N 3.32Å; I210-L255 CarbonylContact C-O 3.59Å; I210-L255 WeakPolarHBondContact CA-O 3.45Å; N211-L255 PolarHBondContact N-O 3.32Å; L253-L255 HydrophobicContact CD1-CD2 3.78Å; L253-L255 HydrophobicContact CD2-CD1 4.35Å; L253-L255 HydrophobicContact CD2-CD2 4.07Å; L253-L255 HydrophobicContact CD2-CG 4.28Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.09Å; L255-F257 HydrophobicContact CB-CD2 4.36Å; L255-F257 HydrophobicContact CB-CE2 3.69Å; L255-F257 HydrophobicContact CB-CZ 4.25Å; L255-F257 HydrophobicContact CD1-CE2 4.1Å; L255-F257 HydrophobicContact CD1-CZ 4.14Å; L255-I290 HydrophobicContact CD1-CD1 4.49Å; L255-I290 HydrophobicContact CD2-CD1 4.37Å
256	H	91.2	Very high	83.6	Confident	43 Å²	43	44.5 Å²	44.5	20%	0.199	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	104	174.5	-68.3	-108.6	0	0	0	109.2	L181 I182 I183 N211 F213 C254	L181-H256 PolarHBondContact O-N 3.04Å; I182-H256 HydrophobicContact CG1-CB 4.31Å; I183-H256 PolarHBondContact N-O 3.02Å; N211-H256 PolarHBondContact ND2-CE1 3.38Å; N211-H256 PolarHBondContact ND2-NE2 3.37Å; N211-H256 CarbonylContact O-C 3.59Å; N211-H256 WeakPolarHBondContact O-CA 3.22Å; F213-H256 HydrophobicContact CE2-CB 4.17Å; F213-H256 AromaticContact CE2-ND1 3.43Å; F213-H256 WeakPolarHBondContact CE2-ND1 3.44Å; F213-H256 AromaticContact CZ-ND1 3.88Å; C254-H256 PolarHBondContact SG-NE2 3.29Å
257	F	92.4	Very high	84.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	126.5	174.9	-66.8	-83.1	0	0	0	110.4	I183 P191 V194 F195 I210 N211 S212 F213 M229 L255 W259	I183-F257 HydrophobicContact CB-CD1 4.04Å; I183-F257 HydrophobicContact CB-CE1 4.2Å; I183-F257 HydrophobicContact CD1-CD1 4.2Å; I183-F257 HydrophobicContact CD1-CE1 3.62Å; I183-F257 HydrophobicContact CD1-CE2 4.44Å; I183-F257 HydrophobicContact CD1-CZ 3.75Å; I183-F257 HydrophobicContact CG2-CD1 3.9Å; I183-F257 HydrophobicContact CG2-CE1 3.95Å; I183-F257 CarbonylContact O-C 3.57Å; I183-F257 WeakPolarHBondContact O-CA 3.32Å; P191-F257 HydrophobicContact CG-CD1 4.26Å; P191-F257 HydrophobicContact CG-CE1 3.67Å; V194-F257 HydrophobicContact CG1-CZ 4.09Å; F195-F257 HydrophobicContact CD1-CE1 4.49Å; F195-F257 HydrophobicContact CD1-CE2 4.41Å; F195-F257 HydrophobicContact CD1-CZ 4.08Å; F195-F257 AromaticContact CE1-CD1 3.93Å; F195-F257 HydrophobicContact CE1-CD1 3.93Å; F195-F257 HydrophobicContact CE1-CD2 4.06Å; F195-F257 AromaticContact CE1-CE1 3.54Å; F195-F257 HydrophobicContact CE1-CE1 3.54Å; F195-F257 AromaticContact CE1-CE2 3.68Å; F195-F257 HydrophobicContact CE1-CE2 3.68Å; F195-F257 HydrophobicContact CE1-CG 4.18Å; F195-F257 AromaticContact CE1-CZ 3.4Å; F195-F257 HydrophobicContact CE1-CZ 3.4Å; F195-F257 VanDerWaalsContact CE1-CZ 3.4Å; F195-F257 HydrophobicContact CZ-CD1 4.07Å; F195-F257 HydrophobicContact CZ-CE1 4Å; F195-F257 HydrophobicContact CZ-CG 4.43Å; F195-F257 HydrophobicContact CZ-CZ 4.3Å; I210-F257 HydrophobicContact CG2-CD2 3.94Å; I210-F257 HydrophobicContact CG2-CE2 4Å; N211-F257 PolarHBondContact O-N 3.02Å; S212-F257 CarbonylContact C-O 3.55Å; S212-F257 WeakPolarHBondContact CA-O 3.46Å; F213-F257 PolarHBondContact N-O 3.06Å; M229-F257 HydrophobicContact CE-CD2 4.19Å; L255-F257 HydrophobicContact CB-CD2 4.36Å; L255-F257 HydrophobicContact CB-CE2 3.69Å; L255-F257 HydrophobicContact CB-CZ 4.25Å; L255-F257 HydrophobicContact CD1-CE2 4.1Å; L255-F257 HydrophobicContact CD1-CZ 4.14Å; F257-W259 HydrophobicContact CB-CZ2 4.32Å
258	I	92	Very high	85.1	Confident	13 Å²	13	36.4 Å²	36.4	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	108.1	175.7	-56.8	170.9	0	0	0	107.4	M20 I182 I183 Q184 C185 F213 H215 N260	M20-I258 HydrophobicContact CE-CB 4.1Å; M20-I258 HydrophobicContact CE-CD1 3.63Å; M20-I258 HydrophobicContact CE-CG1 3.63Å; M20-I258 HydrophobicContact CE-CG2 3.37Å; M20-I258 HydrophobicContact SD-CD1 4.47Å; I182-I258 HydrophobicContact CG2-CD1 3.44Å; I182-I258 VanDerWaalsContact CG2-CD1 3.44Å; I182-I258 HydrophobicContact CG2-CG1 4.39Å; I183-I258 PolarHBondContact O-N 2.86Å; Q184-I258 WeakPolarHBondContact CA-O 3.41Å; Q184-I258 HydrophobicContact CB-CB 4.43Å; Q184-I258 HydrophobicContact CG-CB 4.16Å; Q184-I258 HydrophobicContact CG-CD1 4.2Å; Q184-I258 HydrophobicContact CG-CG2 4.48Å; C185-I258 PolarHBondContact N-O 2.86Å; F213-I258 HydrophobicContact CB-CG1 4.49Å; F213-I258 HydrophobicContact CD2-CG1 4.49Å; F213-I258 WeakPolarHBondContact O-CA 3.28Å; H215-I258 HydrophobicContact CB-CG2 4.39Å; I258-N260 PolarHBondContact O-N 2.88Å
259	W	93.3	Very high	85.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	107.5	179.8	-57.9	109.2	0	0	0	110	C185 P187 P190 F195 S212 F213 H215 V218 L221 L225 M229 F257	C185-W259 WeakPolarHBondContact O-CA 3.37Å; C185-W259 VanDerWaalsContact SG-CE3 3.51Å; C185-W259 WeakPolarHBondContact SG-CZ3 3.5Å; P187-W259 HydrophobicContact CB-CE3 4.04Å; P190-W259 HydrophobicContact CB-CH2 4.11Å; P190-W259 HydrophobicContact CB-CZ3 4.12Å; F195-W259 AromaticContact CE2-CH2 3.74Å; F195-W259 HydrophobicContact CE2-CH2 3.74Å; F195-W259 HydrophobicContact CE2-CZ2 4.32Å; F195-W259 AromaticContact CZ-CH2 3.46Å; F195-W259 HydrophobicContact CZ-CH2 3.46Å; F195-W259 VanDerWaalsContact CZ-CH2 3.46Å; F195-W259 AromaticContact CZ-CZ2 3.79Å; F195-W259 HydrophobicContact CZ-CZ2 3.79Å; S212-W259 PolarHBondContact OG-NE1 3.01Å; F213-W259 PolarHBondContact O-N 3.4Å; H215-W259 WeakPolarHBondContact CB-O 3.46Å; H215-W259 PolarHBondContact N-O 3.46Å; V218-W259 HydrophobicContact CG2-CB 4.4Å; V218-W259 VanDerWaalsContact CG2-O 3.26Å; V218-W259 WeakPolarHBondContact CG2-O 3.45Å; L221-W259 HydrophobicContact CD1-CG 4.26Å; L221-W259 HydrophobicContact CD2-CB 3.72Å; L221-W259 HydrophobicContact CD2-CD2 4.03Å; L221-W259 HydrophobicContact CD2-CG 3.57Å; L225-W259 HydrophobicContact CD1-CH2 3.59Å; L225-W259 HydrophobicContact CD1-CZ2 3.8Å; L225-W259 HydrophobicContact CD1-CZ3 4.39Å; L225-W259 HydrophobicContact CD2-CD2 4.13Å; L225-W259 HydrophobicContact CD2-CE3 3.97Å; L225-W259 HydrophobicContact CD2-CH2 3.67Å; L225-W259 HydrophobicContact CD2-CZ2 3.88Å; L225-W259 HydrophobicContact CD2-CZ3 3.73Å; L225-W259 HydrophobicContact CG-CH2 4.1Å; L225-W259 HydrophobicContact CG-CZ2 4.07Å; M229-W259 HydrophobicContact CG-CZ2 4.26Å; M229-W259 HydrophobicContact SD-CZ2 4Å; F257-W259 HydrophobicContact CB-CZ2 4.32Å
260	N	91.4	Very high	84.9	Confident	8 Å²	8	28.5 Å²	28.5	4%	0.043	17%	0.169	C	C	.	.			trans	-130.4	105.7	-177.1	-178.4	-1.8	0	0	0	109.8	C185 H215 T217 I258 S262 C263	C185-N260 PolarHBondContact O-N 3.42Å; H215-N260 HydrophobicContact CB-CB 4.07Å; T217-N260 PolarHBondContact OG1-OD1 3.49Å; I258-N260 PolarHBondContact O-N 2.88Å; N260-S262 PolarHBondContact O-N 2.96Å; N260-S262 VanDerWaalsContact OD1-CB 3.3Å; N260-S262 WeakPolarHBondContact OD1-CB 3.49Å; N260-S262 PolarHBondContact OD1-N 3.16Å; N260-C263 HydrophobicContact CB-CB 4.07Å; N260-C263 WeakPolarHBondContact O-CB 3.43Å; N260-C263 PolarHBondContact O-N 2.82Å
261	S	89.3	Confident	84	Confident	43 Å²	43	31.2 Å²	31.2	30%	0.301	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.2	176.1	50.4	0	0	0	0	114.4	N186 T217 V218 C263	N186-S261 PolarHBondContact ND2-O 3.43Å; T217-S261 WeakPolarHBondContact CB-OG 3.47Å; T217-S261 PolarHBondContact O-OG 3.4Å; T217-S261 PolarHBondContact OG1-N 3.13Å; T217-S261 PolarHBondContact OG1-OG 3.39Å; T217-S261 VanDerWaalsContact OG1-OG 3.06Å; V218-S261 VanDerWaalsContact CG2-N 3.31Å; S261-C263 VanDerWaalsContact C-N 3.34Å
262	S	85.1	Confident	82.9	Confident	50 Å²	50	33 Å²	33	35%	0.35	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-10.1	174.9	-55.4	0	0	0	0	112.9	N13 T217 N260 P264	N13-S262 WeakPolarHBondContact ND2-CB 3.35Å; N13-S262 PolarHBondContact ND2-OG 3.05Å; T217-S262 WeakPolarHBondContact CG2-OG 3.47Å; N260-S262 PolarHBondContact O-N 2.96Å; N260-S262 VanDerWaalsContact OD1-CB 3.3Å; N260-S262 WeakPolarHBondContact OD1-CB 3.49Å; N260-S262 PolarHBondContact OD1-N 3.16Å; S262-P264 VanDerWaalsContact O-CD 3.32Å; S262-P264 WeakPolarHBondContact O-CD 3.12Å
263	C	82	Confident	81.3	Confident	8 Å²	8	39.4 Å²	39.4	5%	0.054	22%	0.22	C	C	.	.			trans	-75.5	115.2	174.5	-149	0	0	0	0	107.8	N186 N260 S261 D265	N186-C263 WeakPolarHBondContact CB-O 3.47Å; N186-C263 PolarHBondContact ND2-O 2.76Å; N260-C263 HydrophobicContact CB-CB 4.07Å; N260-C263 WeakPolarHBondContact O-CB 3.43Å; N260-C263 PolarHBondContact O-N 2.82Å; S261-C263 VanDerWaalsContact C-N 3.34Å; C263-D265 PolarHBondContact O-N 3.01Å; C263-D265 PolarHBondContact SG-O 3.47Å
264	P	70.7	Confident	79.3	Confident	115 Å²	115	43.6 Å²	43.6	75%	0.747	25%	0.25	S	C	*	.	S	Bend	trans	-72.5	-19.3	-176.7	29.4	-35	0	0	0	112.5	S262	S262-P264 VanDerWaalsContact O-CD 3.32Å; S262-P264 WeakPolarHBondContact O-CD 3.12Å
265	D	75.2	Confident	77.6	Confident	57 Å²	57	44.4 Å²	44.4	31%	0.305	25%	0.253	S	S	.	.	S	Bend	trans	-151.5	-171.6	-179.5	-155.4	-15.2	0	0	0	109.6	C263 G282	C263-D265 PolarHBondContact O-N 3.01Å; C263-D265 PolarHBondContact SG-O 3.47Å; D265-G282 WeakPolarHBondContact OD1-CA 3.18Å; D265-G282 WeakPolarHBondContact OD2-CA 3.29Å; D265-G282 PolarHBondContact OD2-N 3.32Å
266	I	84.9	Confident	75.5	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.026	28%	0.283	C	S	.	.			trans	-78.4	126.9	170.7	-67.7	151.3	0	0	0	109.1	I183 Q184 C185 P191 V268 Y281 G282 E283 L286	I183-I266 HydrophobicContact CG2-CG2 3.96Å; Q184-I266 CarbonylContact O-C 3.4Å; Q184-I266 WeakPolarHBondContact O-CA 3.19Å; C185-I266 HydrophobicContact CB-CG1 3.82Å; P191-I266 HydrophobicContact CB-CD1 3.72Å; P191-I266 HydrophobicContact CG-CD1 4.47Å; I266-V268 HydrophobicContact CG2-CG2 3.99Å; I266-Y281 WeakPolarHBondContact O-CA 3.44Å; I266-G282 PolarHBondContact O-N 3.25Å; I266-G282 VanDerWaalsContact O-N 3.09Å; I266-E283 HydrophobicContact CD1-CB 3.53Å; I266-E283 HydrophobicContact CD1-CG 4.07Å; I266-L286 HydrophobicContact CG2-CB 4.33Å; I266-L286 HydrophobicContact CG2-CD2 4.05Å
267	T	83.6	Confident	73.5	Confident	24 Å²	24	52.5 Å²	52.5	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.6	168.9	63	0	0	0	0	110	I183 Q184 T279 L280 Y281	I183-T267 WeakPolarHBondContact CA-O 3.21Å; Q184-T267 WeakPolarHBondContact CB-OG1 3.36Å; Q184-T267 PolarHBondContact N-O 3.4Å; Q184-T267 PolarHBondContact O-N 2.97Å; T267-T279 HydrophobicContact CG2-CG2 3.8Å; T267-L280 WeakPolarHBondContact CA-O 3.43Å; T267-Y281 HydrophobicContact CG2-CD1 4.2Å; T267-Y281 HydrophobicContact CG2-CE1 4.01Å
268	V	82.5	Confident	71.5	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.042	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.6	179.9	-168.1	0	0	0	0	110	L181 I183 I266 L280 L286 L289	L181-V268 HydrophobicContact CB-CG1 4.49Å; I183-V268 HydrophobicContact CG1-CG1 4.39Å; I266-V268 HydrophobicContact CG2-CG2 3.99Å; V268-L280 PolarHBondContact N-O 2.97Å; V268-L286 HydrophobicContact CG1-CD1 4.27Å; V268-L286 HydrophobicContact CG2-CB 3.91Å; V268-L286 HydrophobicContact CG2-CD1 3.8Å; V268-L286 HydrophobicContact CG2-CG 4.32Å; V268-L289 HydrophobicContact CG1-CD2 3.76Å
269	S	76.2	Confident	69.7	Low	48 Å²	48	58.6 Å²	58.6	34%	0.336	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148	166.4	52.6	0	0	0	0	108.8	I182	I182-S269 WeakPolarHBondContact CB-OG 3.03Å; I182-S269 PolarHBondContact N-O 3.18Å; I182-S269 PolarHBondContact O-N 3.13Å; I182-S269 PolarHBondContact O-OG 2.81Å
270	S	72	Confident	68.2	Low	20 Å²	20	60.8 Å²	60.8	14%	0.14	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.7	174.5	-171.1	0	0	0	0	110	T180 D272	T180-S270 PolarHBondContact O-OG 3.19Å; T180-S270 VanDerWaalsContact O-OG 3.08Å; S270-D272 VanDerWaalsContact C-N 3.25Å; S270-D272 WeakPolarHBondContact OG-CB 2.92Å; S270-D272 PolarHBondContact OG-N 3.46Å
271	L	62.1	Low	67	Low	118 Å²	118	66.5 Å²	66.5	62%	0.618	38%	0.378	S	S	*	.	S	Bend	trans	-79.3	-14.6	167.4	-85.1	147.5	0	0	0	111.8	T180 I182 K273	T180-L271 HydrophobicContact CG2-CD1 3.67Å; T180-L271 PolarHBondContact O-N 3.16Å; I182-L271 HydrophobicContact CD1-CD1 3.76Å; I182-L271 HydrophobicContact CD1-CG 4.12Å; I182-L271 HydrophobicContact CG1-CD1 4.24Å; L271-K273 PolarHBondContact O-N 2.87Å
272	D	60.1	Low	66.4	Low	38 Å²	38	65 Å²	65	20%	0.203	37%	0.37	C	S	.	.			trans	-75.4	118.9	177.2	-170	-11.5	0	0	0	109.5	S270 S274 I275	S270-D272 VanDerWaalsContact C-N 3.25Å; S270-D272 WeakPolarHBondContact OG-CB 2.92Å; S270-D272 PolarHBondContact OG-N 3.46Å; D272-S274 PolarHBondContact O-N 3.23Å; D272-S274 VanDerWaalsContact O-N 3.09Å; D272-S274 WeakPolarHBondContact OD1-CB 3.3Å; D272-S274 PolarHBondContact OD1-N 2.91Å; D272-S274 PolarHBondContact OD1-OG 3.45Å; D272-S274 VanDerWaalsContact OD1-OG 3.05Å; D272-S274 PolarHBondContact OD2-OG 3.41Å; D272-I275 HydrophobicContact CB-CD1 4.29Å; D272-I275 HydrophobicContact CB-CG1 4.38Å; D272-I275 PolarHBondContact O-N 3.34Å
273	K	50.8	Low	66.6	Low	208 Å²	208	63.9 Å²	63.9	90%	0.904	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.3	177.1	-65.1	-179.1	-179.7	178.4	0	112.4	L271 I275	L271-K273 PolarHBondContact O-N 2.87Å; K273-I275 VanDerWaalsContact C-N 3.27Å
274	S	49.2	Very low	66.9	Low	90 Å²	90	63.8 Å²	63.8	63%	0.629	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.3	177.2	79.2	0	0	0	0	113.3	D272	D272-S274 PolarHBondContact O-N 3.23Å; D272-S274 VanDerWaalsContact O-N 3.09Å; D272-S274 WeakPolarHBondContact OD1-CB 3.3Å; D272-S274 PolarHBondContact OD1-N 2.91Å; D272-S274 PolarHBondContact OD1-OG 3.45Å; D272-S274 VanDerWaalsContact OD1-OG 3.05Å; D272-S274 PolarHBondContact OD2-OG 3.41Å
275	I	54.3	Low	67.6	Low	38 Å²	38	61 Å²	61	20%	0.195	34%	0.336	C	S	.	.	S	Bend	trans	-106.3	98.3	179.2	-55.4	174.2	0	0	0	106.3	D272 K273 L289	D272-I275 HydrophobicContact CB-CD1 4.29Å; D272-I275 HydrophobicContact CB-CG1 4.38Å; D272-I275 PolarHBondContact O-N 3.34Å; K273-I275 VanDerWaalsContact C-N 3.27Å; I275-L289 HydrophobicContact CD1-CD1 4.19Å; I275-L289 HydrophobicContact CG2-CD1 4.13Å
276	T	47.6	Very low	68.3	Low	105 Å²	105	58.3 Å²	58.3	64%	0.644	32%	0.322	S	S	*	.			trans	-48.8	129.4	174.7	32	0	0	0	0	109.5	T278	T276-T278 PolarHBondContact O-N 2.86Å; T276-T278 PolarHBondContact O-OG1 3.48Å
277	P	48.2	Very low	68.7	Low	107 Å²	107	58.1 Å²	58.1	70%	0.695	32%	0.32	S	S	*	.			trans	-77.8	64.2	-176.8	33.6	-34.5	0	0	0	109.2	T279	P277-T279 PolarHBondContact O-N 3.13Å
278	T	50.5	Low	69	Low	78 Å²	78	58.3 Å²	58.3	48%	0.479	32%	0.32	S	S	.	.			trans	-73	119.1	157.4	41.1	0	0	0	0	106.1	T276 L280	T276-T278 PolarHBondContact O-N 2.86Å; T276-T278 PolarHBondContact O-OG1 3.48Å; T278-L280 VanDerWaalsContact C-N 3.33Å; T278-L280 WeakPolarHBondContact O-CG 3.28Å; T278-L280 PolarHBondContact O-N 2.97Å
279	T	55	Low	69.2	Low	63 Å²	63	59 Å²	59	39%	0.387	32%	0.323	S	S	.	.			trans	-59	102	168.6	-51.8	0	0	0	0	107.4	T267 P277 Y281	T267-T279 HydrophobicContact CG2-CG2 3.8Å; P277-T279 PolarHBondContact O-N 3.13Å; T279-Y281 HydrophobicContact CG2-CE1 4.21Å; T279-Y281 HydrophobicContact CG2-CE2 4.18Å; T279-Y281 WeakPolarHBondContact O-CD2 3.45Å; T279-Y281 WeakPolarHBondContact O-CE2 3.49Å
280	L	61.4	Low	69.9	Low	47 Å²	47	56.8 Å²	56.8	25%	0.246	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.3	177.5	-62	177.2	0	0	0	108.5	T267 V268 T278 M285	T267-L280 WeakPolarHBondContact CA-O 3.43Å; V268-L280 PolarHBondContact N-O 2.97Å; T278-L280 VanDerWaalsContact C-N 3.33Å; T278-L280 WeakPolarHBondContact O-CG 3.28Å; T278-L280 PolarHBondContact O-N 2.97Å; L280-M285 HydrophobicContact CB-CB 3.67Å; L280-M285 HydrophobicContact CB-CG 4.05Å; L280-M285 HydrophobicContact CD1-CB 4.15Å; L280-M285 HydrophobicContact CG-CB 4.38Å
281	Y	66.1	Low	70.8	Confident	128 Å²	128	55.9 Å²	55.9	50%	0.502	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.5	-179.3	-63.6	-85.5	0	0	0	111.2	I266 T267 T279 M285	I266-Y281 WeakPolarHBondContact O-CA 3.44Å; T267-Y281 HydrophobicContact CG2-CD1 4.2Å; T267-Y281 HydrophobicContact CG2-CE1 4.01Å; T279-Y281 HydrophobicContact CG2-CE1 4.21Å; T279-Y281 HydrophobicContact CG2-CE2 4.18Å; T279-Y281 WeakPolarHBondContact O-CD2 3.45Å; T279-Y281 WeakPolarHBondContact O-CE2 3.49Å; Y281-M285 VanDerWaalsContact O-CG 3.27Å; Y281-M285 WeakPolarHBondContact O-CG 3.24Å
282	G	78.2	Confident	72	Confident	11 Å²	11	56.4 Å²	56.4	11%	0.113	30%	0.298	C	S	.	.	S	Bend	trans	89.7	155.1	172	0	0	0	0	0	114.4	D265 I266 C284 M285	D265-G282 WeakPolarHBondContact OD1-CA 3.18Å; D265-G282 WeakPolarHBondContact OD2-CA 3.29Å; D265-G282 PolarHBondContact OD2-N 3.32Å; I266-G282 PolarHBondContact O-N 3.25Å; I266-G282 VanDerWaalsContact O-N 3.09Å; G282-C284 VanDerWaalsContact C-N 3.25Å; G282-C284 PolarHBondContact O-N 3.48Å; G282-M285 PolarHBondContact O-N 2.85Å
283	E	88.1	Confident	73.3	Confident	27 Å²	27	55.4 Å²	55.4	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-35.3	179.3	-168.7	173.5	-169.2	0	0	112.3	P191 L192 S193 I266 M285 L286 V287 Y355	P191-E283 VanDerWaalsContact CA-OE1 3.25Å; P191-E283 WeakPolarHBondContact CA-OE1 3.42Å; P191-E283 HydrophobicContact CB-CG 4.09Å; L192-E283 PolarHBondContact N-OE1 2.97Å; L192-E283 VanDerWaalsContact N-OE1 3.13Å; S193-E283 WeakPolarHBondContact CA-OE1 3.49Å; S193-E283 WeakPolarHBondContact CB-OE1 3.43Å; S193-E283 PolarHBondContact N-OE1 3.37Å; S193-E283 PolarHBondContact OG-OE1 3.29Å; I266-E283 HydrophobicContact CD1-CB 3.53Å; I266-E283 HydrophobicContact CD1-CG 4.07Å; E283-M285 VanDerWaalsContact C-N 3.26Å; E283-M285 PolarHBondContact O-N 3.08Å; E283-L286 WeakPolarHBondContact O-CB 3.3Å; E283-L286 PolarHBondContact O-N 2.93Å; E283-L286 VanDerWaalsContact O-N 3.08Å; E283-V287 HydrophobicContact CG-CG2 4.1Å; E283-V287 VanDerWaalsContact O-CG2 3.3Å; E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 3.26Å; E283-Y355 HydrophobicContact CB-CE2 4.47Å; E283-Y355 HydrophobicContact CG-CE2 4.37Å
284	C	88.5	Confident	75.1	Confident	6 Å²	6	45.5 Å²	45.5	4%	0.041	25%	0.25	C	S	.	.	H	α-helix	trans	-50.5	-45.6	176.8	177.5	0	0	0	0	112.1	G282 V287 Q288 I306 D310 Y355	G282-C284 VanDerWaalsContact C-N 3.25Å; G282-C284 PolarHBondContact O-N 3.48Å; C284-V287 PolarHBondContact O-N 3.42Å; C284-Q288 WeakPolarHBondContact O-CG 3.38Å; C284-Q288 PolarHBondContact O-N 3.41Å; C284-I306 WeakPolarHBondContact SG-CG2 3.07Å; C284-D310 HydrophobicContact CB-CB 4.22Å; C284-Y355 WeakPolarHBondContact CB-OH 3.47Å
285	M	85.3	Confident	76.9	Confident	57 Å²	57	42.9 Å²	42.9	28%	0.281	23%	0.228	S	C	.	.	H	α-helix	trans	-71.1	-38.1	-179.3	-66.6	-61.5	114.2	0	0	112.3	L280 Y281 G282 E283 V287 Q288 L289	L280-M285 HydrophobicContact CB-CB 3.67Å; L280-M285 HydrophobicContact CB-CG 4.05Å; L280-M285 HydrophobicContact CD1-CB 4.15Å; L280-M285 HydrophobicContact CG-CB 4.38Å; Y281-M285 VanDerWaalsContact O-CG 3.27Å; Y281-M285 WeakPolarHBondContact O-CG 3.24Å; G282-M285 PolarHBondContact O-N 2.85Å; E283-M285 VanDerWaalsContact C-N 3.26Å; E283-M285 PolarHBondContact O-N 3.08Å; M285-V287 VanDerWaalsContact C-N 3.34Å; M285-Q288 VanDerWaalsContact CE-NE2 3.32Å; M285-Q288 PolarHBondContact O-N 3.34Å; M285-L289 WeakPolarHBondContact O-CB 3.15Å; M285-L289 PolarHBondContact O-N 2.8Å
286	L	90.2	Very high	78.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-43.2	174.3	177.2	58.6	0	0	0	111.2	L181 I183 P191 V194 I266 V268 E283 L289 I290	L181-L286 HydrophobicContact CD1-CD1 4.27Å; I183-L286 HydrophobicContact CD1-CD1 3.72Å; I183-L286 HydrophobicContact CD1-CD2 4.02Å; I183-L286 HydrophobicContact CG1-CD1 3.88Å; I183-L286 HydrophobicContact CG1-CD2 4.29Å; I183-L286 HydrophobicContact CG2-CD2 3.96Å; P191-L286 HydrophobicContact CB-CD2 4.02Å; P191-L286 HydrophobicContact CG-CD2 4.37Å; V194-L286 HydrophobicContact CG2-CD2 3.73Å; V194-L286 HydrophobicContact CG2-CG 3.86Å; I266-L286 HydrophobicContact CG2-CB 4.33Å; I266-L286 HydrophobicContact CG2-CD2 4.05Å; V268-L286 HydrophobicContact CG1-CD1 4.27Å; V268-L286 HydrophobicContact CG2-CB 3.91Å; V268-L286 HydrophobicContact CG2-CD1 3.8Å; V268-L286 HydrophobicContact CG2-CG 4.32Å; E283-L286 WeakPolarHBondContact O-CB 3.3Å; E283-L286 PolarHBondContact O-N 2.93Å; E283-L286 VanDerWaalsContact O-N 3.08Å; L286-L289 PolarHBondContact O-N 3.36Å; L286-I290 HydrophobicContact CD1-CD1 3.86Å; L286-I290 HydrophobicContact CD1-CG1 4.16Å; L286-I290 HydrophobicContact CG-CD1 4.05Å; L286-I290 WeakPolarHBondContact O-CG1 3.28Å; L286-I290 PolarHBondContact O-N 2.86Å
287	V	92.2	Very high	80	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-45.9	174.9	168.6	0	0	0	0	110.5	S193 V194 E283 C284 M285 L289 I290 G291 I306 I351 Y355	S193-V287 VanDerWaalsContact OG-CG2 3.24Å; S193-V287 WeakPolarHBondContact OG-CG2 3.5Å; V194-V287 HydrophobicContact CG2-CG2 4.25Å; E283-V287 HydrophobicContact CG-CG2 4.1Å; E283-V287 VanDerWaalsContact O-CG2 3.3Å; E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 3.26Å; C284-V287 PolarHBondContact O-N 3.42Å; M285-V287 VanDerWaalsContact C-N 3.34Å; V287-L289 VanDerWaalsContact C-N 3.33Å; V287-L289 PolarHBondContact O-N 3.42Å; V287-I290 PolarHBondContact O-N 3.14Å; V287-G291 PolarHBondContact O-N 3.09Å; V287-I306 HydrophobicContact CG1-CD1 3.62Å; V287-I306 HydrophobicContact CG1-CG1 3.95Å; V287-I306 HydrophobicContact CG1-CG2 4.3Å; V287-I351 HydrophobicContact CB-CD1 4.26Å; V287-I351 HydrophobicContact CG1-CD1 4.09Å; V287-I351 HydrophobicContact CG1-CG1 3.97Å; V287-I351 HydrophobicContact CG1-CG2 4.07Å; V287-I351 HydrophobicContact CG2-CD1 4.35Å; V287-I351 HydrophobicContact CG2-CG1 4.5Å; V287-Y355 HydrophobicContact CG1-CG 4.18Å; V287-Y355 HydrophobicContact CG2-CD2 3.85Å; V287-Y355 HydrophobicContact CG2-CE2 4.45Å; V287-Y355 HydrophobicContact CG2-CG 4.21Å
288	Q	89.8	Confident	81.6	Confident	29 Å²	29	41.1 Å²	41.1	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-42.6	175.3	-73.9	-172.4	49.7	0	0	111.9	C284 M285 G291 K292 F299 S303 I306	C284-Q288 WeakPolarHBondContact O-CG 3.38Å; C284-Q288 PolarHBondContact O-N 3.41Å; M285-Q288 VanDerWaalsContact CE-NE2 3.32Å; M285-Q288 PolarHBondContact O-N 3.34Å; Q288-G291 PolarHBondContact O-N 2.87Å; Q288-K292 WeakPolarHBondContact O-CB 3.42Å; Q288-K292 PolarHBondContact O-N 3.25Å; Q288-F299 HydrophobicContact CB-CE2 4.42Å; Q288-F299 HydrophobicContact CB-CZ 4.18Å; Q288-F299 WeakPolarHBondContact O-CE2 3.23Å; Q288-F299 WeakPolarHBondContact O-CZ 3.49Å; Q288-S303 PolarHBondContact OE1-OG 2.92Å; Q288-I306 HydrophobicContact CG-CB 4.24Å; Q288-I306 HydrophobicContact CG-CD1 3.92Å; Q288-I306 HydrophobicContact CG-CG2 3.8Å
289	L	88	Confident	83.3	Confident	22 Å²	22	38.8 Å²	38.8	12%	0.115	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-45.9	-179.2	-167.7	62.1	0	0	0	112	L181 V268 I275 M285 L286 V287 K292 I293	L181-L289 HydrophobicContact CD1-CD2 3.94Å; L181-L289 HydrophobicContact CD1-CG 4.23Å; L181-L289 HydrophobicContact CD2-CD2 3.45Å; L181-L289 VanDerWaalsContact CD2-CD2 3.45Å; L181-L289 HydrophobicContact CD2-CG 4.17Å; L181-L289 HydrophobicContact CG-CD2 4.33Å; V268-L289 HydrophobicContact CG1-CD2 3.76Å; I275-L289 HydrophobicContact CD1-CD1 4.19Å; I275-L289 HydrophobicContact CG2-CD1 4.13Å; M285-L289 WeakPolarHBondContact O-CB 3.15Å; M285-L289 PolarHBondContact O-N 2.8Å; L286-L289 PolarHBondContact O-N 3.36Å; V287-L289 VanDerWaalsContact C-N 3.33Å; V287-L289 PolarHBondContact O-N 3.42Å; L289-K292 PolarHBondContact O-N 3.42Å; L289-I293 HydrophobicContact CG-CD1 4.34Å; L289-I293 WeakPolarHBondContact O-CD1 3.39Å; L289-I293 VanDerWaalsContact O-CG1 3.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.42Å; L289-I293 PolarHBondContact O-N 2.77Å
290	I	90.8	Very high	84.7	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-42.2	177.3	-64.9	171.7	0	0	0	110.6	L181 V194 F197 L253 L255 L286 V287 K292 I293 L294 I351	L181-I290 HydrophobicContact CD1-CG1 3.84Å; V194-I290 HydrophobicContact CB-CD1 4.34Å; V194-I290 HydrophobicContact CG1-CD1 3.49Å; V194-I290 VanDerWaalsContact CG1-CD1 3.49Å; V194-I290 HydrophobicContact CG2-CD1 3.9Å; F197-I290 HydrophobicContact CD1-CG2 4.1Å; F197-I290 HydrophobicContact CE1-CG2 3.96Å; L253-I290 HydrophobicContact CD2-CG2 4.05Å; L255-I290 HydrophobicContact CD1-CD1 4.49Å; L255-I290 HydrophobicContact CD2-CD1 4.37Å; L286-I290 HydrophobicContact CD1-CD1 3.86Å; L286-I290 HydrophobicContact CD1-CG1 4.16Å; L286-I290 HydrophobicContact CG-CD1 4.05Å; L286-I290 WeakPolarHBondContact O-CG1 3.28Å; L286-I290 PolarHBondContact O-N 2.86Å; V287-I290 PolarHBondContact O-N 3.14Å; I290-K292 VanDerWaalsContact C-N 3.3Å; I290-K292 PolarHBondContact O-N 2.52Å; I290-I293 PolarHBondContact O-N 3.13Å; I290-I293 VanDerWaalsContact O-N 3.13Å; I290-L294 HydrophobicContact CG2-CD1 3.93Å; I290-L294 HydrophobicContact CG2-CG 4.48Å; I290-L294 PolarHBondContact O-N 3.05Å; I290-I351 HydrophobicContact CB-CD1 3.59Å; I290-I351 HydrophobicContact CD1-CD1 4.37Å; I290-I351 HydrophobicContact CG2-CD1 3.56Å
291	G	90.1	Very high	85.9	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-40.1	175.1	0	0	0	0	0	112.4	V287 Q288 I293 E295	V287-G291 PolarHBondContact O-N 3.09Å; Q288-G291 PolarHBondContact O-N 2.87Å; G291-I293 VanDerWaalsContact C-N 3.29Å; G291-I293 PolarHBondContact O-N 3.48Å; G291-E295 CarbonylContact O-C 3.53Å; G291-E295 VanDerWaalsContact O-C 3.31Å; G291-E295 VanDerWaalsContact O-CA 3.28Å; G291-E295 WeakPolarHBondContact O-CA 3.37Å; G291-E295 WeakPolarHBondContact O-CB 3.48Å; G291-E295 PolarHBondContact O-N 2.96Å
292	K	88.1	Confident	87	Confident	128 Å²	128	38.4 Å²	38.4	56%	0.557	20%	0.197	S	C	*	.	H	α-helix	trans	-64.3	-34.7	175.8	-171.1	177.3	178.3	-178.4	0	112.6	Q288 L289 I290 F299	Q288-K292 WeakPolarHBondContact O-CB 3.42Å; Q288-K292 PolarHBondContact O-N 3.25Å; L289-K292 PolarHBondContact O-N 3.42Å; I290-K292 VanDerWaalsContact C-N 3.3Å; I290-K292 PolarHBondContact O-N 2.52Å; K292-F299 VanDerWaalsContact CA-CD2 3.46Å; K292-F299 HydrophobicContact CB-CD1 4.13Å; K292-F299 HydrophobicContact CB-CD2 3.91Å; K292-F299 HydrophobicContact CB-CE1 3.93Å; K292-F299 HydrophobicContact CB-CE2 3.72Å; K292-F299 HydrophobicContact CB-CG 4.11Å; K292-F299 HydrophobicContact CB-CZ 3.72Å; K292-F299 HydrophobicContact CD-CE1 4.14Å; K292-F299 HydrophobicContact CG-CD1 4.04Å; K292-F299 HydrophobicContact CG-CE1 4.02Å; K292-F299 HydrophobicContact CG-CG 4.34Å; K292-F299 HydrophobicContact CG-CZ 4.32Å; K292-F299 VanDerWaalsContact N-CD2 3.3Å; K292-F299 VanDerWaalsContact N-CE2 3.33Å
293	I	87.1	Confident	87.5	Confident	18 Å²	18	38.8 Å²	38.8	9%	0.092	20%	0.198	C	C	.	.	H	α-helix	trans	-75.7	-43.9	-179.3	-67.2	161.5	0	0	0	111.2	P175 L181 L253 L289 I290 G291	P175-I293 HydrophobicContact CG-CG2 4.19Å; L181-I293 HydrophobicContact CD1-CD1 4.09Å; L181-I293 HydrophobicContact CD2-CD1 4.3Å; L181-I293 HydrophobicContact CG-CD1 4.41Å; L253-I293 HydrophobicContact CD1-CD1 4.2Å; L253-I293 HydrophobicContact CD1-CG2 4.38Å; L289-I293 HydrophobicContact CG-CD1 4.34Å; L289-I293 WeakPolarHBondContact O-CD1 3.39Å; L289-I293 VanDerWaalsContact O-CG1 3.3Å; L289-I293 WeakPolarHBondContact O-CG1 3.42Å; L289-I293 PolarHBondContact O-N 2.77Å; I290-I293 PolarHBondContact O-N 3.13Å; I290-I293 VanDerWaalsContact O-N 3.13Å; G291-I293 VanDerWaalsContact C-N 3.29Å; G291-I293 PolarHBondContact O-N 3.48Å
294	L	88.7	Confident	87.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-101.5	-23.9	-169.4	-64.3	-178.5	0	0	0	114.6	I172 T173 F197 L201 T251 L253 I290	I172-L294 HydrophobicContact CG2-CB 4.46Å; I172-L294 HydrophobicContact CG2-CD2 4.35Å; T173-L294 PolarHBondContact N-O 3.35Å; F197-L294 HydrophobicContact CE1-CD1 3.72Å; F197-L294 HydrophobicContact CZ-CD1 4.36Å; L201-L294 HydrophobicContact CD1-CD1 3.73Å; T251-L294 HydrophobicContact CG2-CD2 4.24Å; L253-L294 HydrophobicContact CB-CD2 4.47Å; L253-L294 HydrophobicContact CD2-CD1 3.67Å; L253-L294 HydrophobicContact CD2-CG 4.3Å; I290-L294 HydrophobicContact CG2-CD1 3.93Å; I290-L294 HydrophobicContact CG2-CG 4.48Å; I290-L294 PolarHBondContact O-N 3.05Å
295	E	86.9	Confident	87.5	Confident	34 Å²	34	39.5 Å²	39.5	16%	0.159	21%	0.206	C	C	.	.			trans	-127.1	48.2	-177.8	-55.6	-177.5	86.4	0	0	112	G291 D297 N298 F299 L302 S350 I351	G291-E295 CarbonylContact O-C 3.53Å; G291-E295 VanDerWaalsContact O-C 3.31Å; G291-E295 VanDerWaalsContact O-CA 3.28Å; G291-E295 WeakPolarHBondContact O-CA 3.37Å; G291-E295 WeakPolarHBondContact O-CB 3.48Å; G291-E295 PolarHBondContact O-N 2.96Å; E295-D297 PolarHBondContact O-N 3.08Å; E295-N298 PolarHBondContact O-N 3.31Å; E295-F299 WeakPolarHBondContact O-CB 3.26Å; E295-F299 PolarHBondContact O-N 3.46Å; E295-F299 VanDerWaalsContact O-N 3.15Å; E295-L302 HydrophobicContact CB-CD1 3.76Å; E295-L302 HydrophobicContact CG-CD1 4.35Å; E295-S350 WeakPolarHBondContact OE1-CB 3.2Å; E295-I351 WeakPolarHBondContact OE2-CG2 3.25Å; E295-I351 PolarHBondContact OE2-N 3.06Å; E295-I351 VanDerWaalsContact OE2-N 3.13Å
296	P	84.3	Confident	87.8	Confident	56 Å²	56	36.8 Å²	36.8	36%	0.364	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-63	-36.7	-171.7	27.4	-35.4	0	0	0	113.4	T173 N298 F299	T173-P296 HydrophobicContact CG2-CG 4.04Å; T173-P296 WeakPolarHBondContact OG1-CD 3.42Å; T173-P296 WeakPolarHBondContact OG1-CG 3.45Å; P296-N298 PolarHBondContact O-N 3.36Å; P296-F299 WeakPolarHBondContact O-CB 3.24Å; P296-F299 PolarHBondContact O-N 2.94Å
297	D	83.5	Confident	87.6	Confident	115 Å²	115	40.8 Å²	40.8	62%	0.615	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-65.8	-28.7	-175	-65.8	-24.7	0	0	0	112.8	E295	E295-D297 PolarHBondContact O-N 3.08Å
298	N	81.3	Confident	87.3	Confident	42 Å²	42	43 Å²	43	23%	0.225	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-109.6	7.1	179.2	-67.5	-36.3	0	0	0	112.4	N170 E295 P296 D300 Q301 L302	N170-N298 PolarHBondContact OD1-ND2 3.21Å; E295-N298 PolarHBondContact O-N 3.31Å; P296-N298 PolarHBondContact O-N 3.36Å; N298-D300 VanDerWaalsContact C-N 3.35Å; N298-D300 PolarHBondContact O-N 3.04Å; N298-Q301 PolarHBondContact O-N 3Å; N298-Q301 VanDerWaalsContact O-N 3.15Å; N298-L302 HydrophobicContact CB-CD1 4.25Å; N298-L302 HydrophobicContact CB-CG 4.3Å; N298-L302 WeakPolarHBondContact O-CG 3.4Å; N298-L302 PolarHBondContact O-N 3.37Å
299	F	86.3	Confident	87.1	Confident	30 Å²	30	41.6 Å²	41.6	13%	0.132	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-38.9	-165.3	-178.8	-111	0	0	0	113	Q288 K292 E295 P296 Q301 L302 S303	Q288-F299 HydrophobicContact CB-CE2 4.42Å; Q288-F299 HydrophobicContact CB-CZ 4.18Å; Q288-F299 WeakPolarHBondContact O-CE2 3.23Å; Q288-F299 WeakPolarHBondContact O-CZ 3.49Å; K292-F299 VanDerWaalsContact CA-CD2 3.46Å; K292-F299 HydrophobicContact CB-CD1 4.13Å; K292-F299 HydrophobicContact CB-CD2 3.91Å; K292-F299 HydrophobicContact CB-CE1 3.93Å; K292-F299 HydrophobicContact CB-CE2 3.72Å; K292-F299 HydrophobicContact CB-CG 4.11Å; K292-F299 HydrophobicContact CB-CZ 3.72Å; K292-F299 HydrophobicContact CD-CE1 4.14Å; K292-F299 HydrophobicContact CG-CD1 4.04Å; K292-F299 HydrophobicContact CG-CE1 4.02Å; K292-F299 HydrophobicContact CG-CG 4.34Å; K292-F299 HydrophobicContact CG-CZ 4.32Å; K292-F299 VanDerWaalsContact N-CD2 3.3Å; K292-F299 VanDerWaalsContact N-CE2 3.33Å; E295-F299 WeakPolarHBondContact O-CB 3.26Å; E295-F299 PolarHBondContact O-N 3.46Å; E295-F299 VanDerWaalsContact O-N 3.15Å; P296-F299 WeakPolarHBondContact O-CB 3.24Å; P296-F299 PolarHBondContact O-N 2.94Å; F299-Q301 VanDerWaalsContact C-N 3.3Å; F299-Q301 PolarHBondContact O-N 3.38Å; F299-L302 PolarHBondContact O-N 2.86Å; F299-S303 WeakPolarHBondContact O-CB 3.38Å; F299-S303 PolarHBondContact O-N 2.68Å
300	D	84.3	Confident	86.9	Confident	141 Å²	141	43.2 Å²	43.2	75%	0.754	23%	0.227	S	C	*	.	H	α-helix	trans	-60.6	-41.3	179.6	-69.3	-18.8	0	0	0	111.9	N298 S304	N298-D300 VanDerWaalsContact C-N 3.35Å; N298-D300 PolarHBondContact O-N 3.04Å; D300-S304 PolarHBondContact O-N 3.09Å; D300-S304 VanDerWaalsContact O-N 3.12Å
301	Q	85.6	Confident	86.4	Confident	84 Å²	84	45.7 Å²	45.7	39%	0.393	24%	0.244	S	C	.	.	H	α-helix	trans	-67.9	-45.3	176.4	-172.1	179.4	17.4	0	0	111	N298 F299 S304 L305	N298-Q301 PolarHBondContact O-N 3Å; N298-Q301 VanDerWaalsContact O-N 3.15Å; F299-Q301 VanDerWaalsContact C-N 3.3Å; F299-Q301 PolarHBondContact O-N 3.38Å; Q301-S304 PolarHBondContact O-N 3.36Å; Q301-S304 PolarHBondContact O-OG 3.06Å; Q301-L305 PolarHBondContact O-N 2.96Å
302	L	88.8	Confident	85.8	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-41.8	179.7	-64.7	-179	0	0	0	112.1	E295 N298 F299 S304 L305 I306 Y340 V352	E295-L302 HydrophobicContact CB-CD1 3.76Å; E295-L302 HydrophobicContact CG-CD1 4.35Å; N298-L302 HydrophobicContact CB-CD1 4.25Å; N298-L302 HydrophobicContact CB-CG 4.3Å; N298-L302 WeakPolarHBondContact O-CG 3.4Å; N298-L302 PolarHBondContact O-N 3.37Å; F299-L302 PolarHBondContact O-N 2.86Å; L302-S304 PolarHBondContact O-N 3.43Å; L302-L305 WeakPolarHBondContact O-CB 3.08Å; L302-L305 PolarHBondContact O-N 3.08Å; L302-L305 VanDerWaalsContact O-N 3.16Å; L302-I306 WeakPolarHBondContact O-CD1 3.43Å; L302-I306 VanDerWaalsContact O-CG1 3.26Å; L302-I306 WeakPolarHBondContact O-CG1 3.36Å; L302-I306 PolarHBondContact O-N 3.34Å; L302-Y340 HydrophobicContact CD2-CD2 4.18Å; L302-Y340 HydrophobicContact CD2-CE2 3.49Å; L302-Y340 VanDerWaalsContact CD2-CE2 3.49Å; L302-V352 HydrophobicContact CB-CG2 3.67Å; L302-V352 HydrophobicContact CD1-CG2 4.43Å; L302-V352 HydrophobicContact CD2-CB 4.22Å; L302-V352 HydrophobicContact CD2-CG2 3.64Å; L302-V352 HydrophobicContact CG-CG2 4.08Å
303	S	89.5	Confident	85.2	Confident	19 Å²	19	40.6 Å²	40.6	13%	0.133	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-46.5	176	176.7	0	0	0	0	110.8	Q288 F299 L305 I306 I307	Q288-S303 PolarHBondContact OE1-OG 2.92Å; F299-S303 WeakPolarHBondContact O-CB 3.38Å; F299-S303 PolarHBondContact O-N 2.68Å; S303-L305 PolarHBondContact O-N 3.08Å; S303-I306 PolarHBondContact O-N 2.8Å; S303-I307 WeakPolarHBondContact O-CG1 3.31Å; S303-I307 PolarHBondContact O-N 2.85Å
304	S	87.2	Confident	84.5	Confident	48 Å²	48	41 Å²	41	34%	0.336	23%	0.227	S	C	.	.	H	α-helix	trans	-58.7	-38.1	176.2	78	0	0	0	0	112.6	D300 Q301 L302 I308	D300-S304 PolarHBondContact O-N 3.09Å; D300-S304 VanDerWaalsContact O-N 3.12Å; Q301-S304 PolarHBondContact O-N 3.36Å; Q301-S304 PolarHBondContact O-OG 3.06Å; L302-S304 PolarHBondContact O-N 3.43Å; S304-I308 WeakPolarHBondContact O-CD1 3.41Å; S304-I308 WeakPolarHBondContact O-CG1 3.41Å; S304-I308 PolarHBondContact O-N 2.94Å
305	L	90.4	Very high	83.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-44.8	176.3	-82.3	173.2	0	0	0	112.5	Q301 L302 S303 I307 I308 M309 L335 H338 Y340 F341 V352	Q301-L305 PolarHBondContact O-N 2.96Å; L302-L305 WeakPolarHBondContact O-CB 3.08Å; L302-L305 PolarHBondContact O-N 3.08Å; L302-L305 VanDerWaalsContact O-N 3.16Å; S303-L305 PolarHBondContact O-N 3.08Å; L305-I307 VanDerWaalsContact C-N 3.3Å; L305-I307 PolarHBondContact O-N 2.88Å; L305-I308 PolarHBondContact O-N 2.81Å; L305-M309 HydrophobicContact CB-CE 4.29Å; L305-M309 VanDerWaalsContact O-CG 3.24Å; L305-M309 WeakPolarHBondContact O-CG 3.42Å; L305-M309 PolarHBondContact O-N 3.39Å; L305-L335 HydrophobicContact CD2-CD2 4.22Å; L305-H338 HydrophobicContact CD2-CB 4.27Å; L305-Y340 HydrophobicContact CD1-CD1 3.7Å; L305-Y340 HydrophobicContact CD1-CD2 3.99Å; L305-Y340 HydrophobicContact CD1-CE1 4.39Å; L305-Y340 HydrophobicContact CD1-CG 3.47Å; L305-Y340 VanDerWaalsContact CD1-CG 3.47Å; L305-F341 HydrophobicContact CD2-CE2 4.17Å; L305-V352 HydrophobicContact CB-CG1 4.1Å; L305-V352 HydrophobicContact CD1-CG1 4.33Å
306	I	90.3	Very high	82.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-46.2	177.3	-67.2	159.6	0	0	0	109.9	C284 V287 Q288 L302 S303 I308 M309 D310 V352 Y355	C284-I306 WeakPolarHBondContact SG-CG2 3.07Å; V287-I306 HydrophobicContact CG1-CD1 3.62Å; V287-I306 HydrophobicContact CG1-CG1 3.95Å; V287-I306 HydrophobicContact CG1-CG2 4.3Å; Q288-I306 HydrophobicContact CG-CB 4.24Å; Q288-I306 HydrophobicContact CG-CD1 3.92Å; Q288-I306 HydrophobicContact CG-CG2 3.8Å; L302-I306 WeakPolarHBondContact O-CD1 3.43Å; L302-I306 VanDerWaalsContact O-CG1 3.26Å; L302-I306 WeakPolarHBondContact O-CG1 3.36Å; L302-I306 PolarHBondContact O-N 3.34Å; S303-I306 PolarHBondContact O-N 2.8Å; I306-I308 PolarHBondContact O-N 3.44Å; I306-M309 PolarHBondContact O-N 2.93Å; I306-D310 WeakPolarHBondContact O-CB 3.39Å; I306-D310 PolarHBondContact O-N 3.2Å; I306-V352 HydrophobicContact CD1-CG2 3.85Å; I306-V352 HydrophobicContact CG1-CG2 3.71Å; I306-Y355 HydrophobicContact CG2-CD1 4.15Å; I306-Y355 HydrophobicContact CG2-CE1 3.98Å
307	I	86.6	Confident	80.6	Confident	84 Å²	84	44 Å²	44	43%	0.431	25%	0.248	S	C	.	.	H	α-helix	trans	-61.5	-44.6	177.2	-66.3	166.7	0	0	0	110.7	S303 L305 M309 D310 S311	S303-I307 WeakPolarHBondContact O-CG1 3.31Å; S303-I307 PolarHBondContact O-N 2.85Å; L305-I307 VanDerWaalsContact C-N 3.3Å; L305-I307 PolarHBondContact O-N 2.88Å; I307-M309 VanDerWaalsContact C-N 3.32Å; I307-M309 PolarHBondContact O-N 3.12Å; I307-D310 PolarHBondContact O-N 3.2Å; I307-S311 VanDerWaalsContact O-CB 3.26Å; I307-S311 WeakPolarHBondContact O-CB 3.21Å; I307-S311 PolarHBondContact O-N 3.08Å; I307-S311 PolarHBondContact O-OG 3.43Å; I307-S311 VanDerWaalsContact O-OG 3.09Å
308	I	84.9	Confident	79.1	Confident	46 Å²	46	45 Å²	45	24%	0.236	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-42.8	176.5	-71.3	164	0	0	0	110.8	S304 L305 I306 S311 S312 I334 L335	S304-I308 WeakPolarHBondContact O-CD1 3.41Å; S304-I308 WeakPolarHBondContact O-CG1 3.41Å; S304-I308 PolarHBondContact O-N 2.94Å; L305-I308 PolarHBondContact O-N 2.81Å; I306-I308 PolarHBondContact O-N 3.44Å; I308-S311 PolarHBondContact O-OG 3.02Å; I308-S312 WeakPolarHBondContact O-CA 3.45Å; I308-S312 WeakPolarHBondContact O-CB 3.42Å; I308-S312 PolarHBondContact O-N 3.49Å; I308-S312 PolarHBondContact O-OG 3.17Å; I308-I334 HydrophobicContact CG2-CG2 4.24Å; I308-L335 HydrophobicContact CG2-CD2 3.89Å
309	M	87.5	Confident	77.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-49.2	178.9	-68.6	169.3	-169.4	0	0	111.2	L305 I306 I307 L313 L314 L335 F341 V352 Y355 L356	L305-M309 HydrophobicContact CB-CE 4.29Å; L305-M309 VanDerWaalsContact O-CG 3.24Å; L305-M309 WeakPolarHBondContact O-CG 3.42Å; L305-M309 PolarHBondContact O-N 3.39Å; I306-M309 PolarHBondContact O-N 2.93Å; I307-M309 VanDerWaalsContact C-N 3.32Å; I307-M309 PolarHBondContact O-N 3.12Å; M309-L313 WeakPolarHBondContact O-CA 3.4Å; M309-L313 VanDerWaalsContact O-CB 3.25Å; M309-L313 WeakPolarHBondContact O-CB 3.42Å; M309-L313 PolarHBondContact O-N 3.3Å; M309-L314 PolarHBondContact O-N 3.16Å; M309-L335 HydrophobicContact CE-CD2 4.12Å; M309-L335 HydrophobicContact CG-CD1 4.18Å; M309-L335 HydrophobicContact CG-CD2 4.01Å; M309-F341 HydrophobicContact CE-CE2 4.01Å; M309-F341 HydrophobicContact CE-CZ 3.66Å; M309-V352 HydrophobicContact CE-CG1 3.45Å; M309-V352 VanDerWaalsContact CE-CG1 3.45Å; M309-V352 HydrophobicContact SD-CG1 4.11Å; M309-Y355 HydrophobicContact CB-CD1 4.28Å; M309-Y355 HydrophobicContact CB-CE1 4.06Å; M309-Y355 HydrophobicContact SD-CD1 4.03Å; M309-L356 HydrophobicContact CE-CB 3.78Å; M309-L356 HydrophobicContact CE-CD1 4.24Å; M309-L356 HydrophobicContact CE-CD2 3.95Å; M309-L356 HydrophobicContact CE-CG 4.19Å; M309-L356 HydrophobicContact CG-CD1 4.16Å; M309-L356 HydrophobicContact SD-CB 3.7Å; M309-L356 HydrophobicContact SD-CD1 4.12Å; M309-L356 HydrophobicContact SD-CG 4.37Å
310	D	83.8	Confident	75.5	Confident	55 Å²	55	48.6 Å²	48.6	29%	0.294	28%	0.276	S	S	.	.	I	π-helix	trans	-62	-49.2	179.7	-171.2	62.3	0	0	0	111.2	C284 I306 I307 S312 L314 L315 Y355	C284-D310 HydrophobicContact CB-CB 4.22Å; I306-D310 WeakPolarHBondContact O-CB 3.39Å; I306-D310 PolarHBondContact O-N 3.2Å; I307-D310 PolarHBondContact O-N 3.2Å; D310-S312 PolarHBondContact O-N 2.87Å; D310-L314 PolarHBondContact O-N 3.46Å; D310-L315 WeakPolarHBondContact O-CB 3.47Å; D310-L315 PolarHBondContact O-N 3.45Å; D310-Y355 PolarHBondContact OD1-OH 2.76Å
311	S	79	Confident	73.7	Confident	54 Å²	54	54.2 Å²	54.2	38%	0.378	29%	0.286	S	S	.	.	I	π-helix	trans	-72.3	-29.2	-177.7	78	0	0	0	0	114	I307 I308 P316	I307-S311 VanDerWaalsContact O-CB 3.26Å; I307-S311 WeakPolarHBondContact O-CB 3.21Å; I307-S311 PolarHBondContact O-N 3.08Å; I307-S311 PolarHBondContact O-OG 3.43Å; I307-S311 VanDerWaalsContact O-OG 3.09Å; I308-S311 PolarHBondContact O-OG 3.02Å; S311-P316 VanDerWaalsContact O-CD 3.32Å; S311-P316 WeakPolarHBondContact O-CD 3.32Å
312	S	76.8	Confident	71.8	Confident	21 Å²	21	56.8 Å²	56.8	15%	0.147	30%	0.303	C	S	.	.	I	π-helix	trans	-106.6	-27.3	-169.6	-43.5	0	0	0	0	113.4	I308 D310 P316 S331	I308-S312 WeakPolarHBondContact O-CA 3.45Å; I308-S312 WeakPolarHBondContact O-CB 3.42Å; I308-S312 PolarHBondContact O-N 3.49Å; I308-S312 PolarHBondContact O-OG 3.17Å; D310-S312 PolarHBondContact O-N 2.87Å; S312-P316 WeakPolarHBondContact O-CG 3.46Å; S312-S331 WeakPolarHBondContact CB-OG 3.32Å; S312-S331 VanDerWaalsContact O-CB 3.28Å; S312-S331 WeakPolarHBondContact O-CB 3.5Å; S312-S331 PolarHBondContact O-OG 2.88Å
313	L	75.5	Confident	70.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.309	C	S	.	.	I	π-helix	trans	-102.5	-53.2	178.3	-63.1	174.4	0	0	0	111.6	M309 L332 L335 L356 C359 L363 L365	M309-L313 WeakPolarHBondContact O-CA 3.4Å; M309-L313 VanDerWaalsContact O-CB 3.25Å; M309-L313 WeakPolarHBondContact O-CB 3.42Å; M309-L313 PolarHBondContact O-N 3.3Å; L313-L332 HydrophobicContact CD2-CD2 4.15Å; L313-L332 HydrophobicContact CD2-CG 4.36Å; L313-L335 HydrophobicContact CD1-CD1 3.64Å; L313-L335 HydrophobicContact CG-CD1 4.23Å; L313-L356 HydrophobicContact CD1-CD1 3.64Å; L313-C359 HydrophobicContact CD1-CB 4.4Å; L313-L363 HydrophobicContact CB-CD1 3.91Å; L313-L365 HydrophobicContact CD2-CD1 4.32Å
314	L	74.3	Confident	68.8	Low	28 Å²	28	60.7 Å²	60.7	15%	0.147	33%	0.326	C	S	.	.	I	π-helix	trans	-81.5	-50.9	-171.6	-64.5	178.5	0	0	0	112.2	M309 D310 G317 L318 Y355 C359 L363	M309-L314 PolarHBondContact O-N 3.16Å; D310-L314 PolarHBondContact O-N 3.46Å; L314-G317 WeakPolarHBondContact O-CA 3.17Å; L314-G317 PolarHBondContact O-N 2.82Å; L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 3.18Å; L314-Y355 HydrophobicContact CD1-CE2 4.5Å; L314-Y355 WeakPolarHBondContact CD1-OH 3.3Å; L314-C359 HydrophobicContact CD2-CB 4.34Å; L314-L363 HydrophobicContact CD2-CD1 4.23Å; L314-L363 HydrophobicContact CD2-CG 4.43Å
315	L	67.8	Low	67.9	Low	101 Å²	101	63.9 Å²	63.9	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-59.3	-43.8	-175.4	-170.9	68.1	0	0	0	113.1	D310 G317 L318 S319	D310-L315 WeakPolarHBondContact O-CB 3.47Å; D310-L315 PolarHBondContact O-N 3.45Å; L315-G317 VanDerWaalsContact C-N 3.34Å; L315-G317 PolarHBondContact O-N 3.09Å; L315-L318 PolarHBondContact O-N 3.34Å; L315-S319 VanDerWaalsContact O-CB 3.31Å; L315-S319 WeakPolarHBondContact O-CB 3.19Å; L315-S319 PolarHBondContact O-N 2.76Å
316	P	57.1	Low	67	Low	26 Å²	26	69.6 Å²	69.6	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-42.7	175.2	-22.9	37.5	0	0	0	110.9	S311 S312 L318 S319 I320 T323 V327	S311-P316 VanDerWaalsContact O-CD 3.32Å; S311-P316 WeakPolarHBondContact O-CD 3.32Å; S312-P316 WeakPolarHBondContact O-CG 3.46Å; P316-L318 PolarHBondContact O-N 3.26Å; P316-S319 PolarHBondContact O-N 3.02Å; P316-I320 PolarHBondContact O-N 2.97Å; P316-T323 HydrophobicContact CB-CG2 3.58Å; P316-T323 WeakPolarHBondContact O-CG2 3.23Å; P316-V327 HydrophobicContact CB-CG1 4.04Å; P316-V327 HydrophobicContact CG-CG1 4.38Å
317	G	52	Low	66.2	Low	25 Å²	25	72.2 Å²	72.2	26%	0.258	39%	0.385	S	S	.	.	H	α-helix	trans	-60.2	-29.1	179.5	0	0	0	0	0	113.8	L314 L315	L314-G317 WeakPolarHBondContact O-CA 3.17Å; L314-G317 PolarHBondContact O-N 2.82Å; L315-G317 VanDerWaalsContact C-N 3.34Å; L315-G317 PolarHBondContact O-N 3.09Å
318	L	53	Low	65.7	Low	136 Å²	136	70 Å²	70	71%	0.712	37%	0.373	S	S	*	.	H	α-helix	trans	-88	-32.9	176.4	-67.7	169.9	0	0	0	113.1	L314 L315 P316	L314-L318 WeakPolarHBondContact O-CG 3.37Å; L314-L318 PolarHBondContact O-N 3.18Å; L315-L318 PolarHBondContact O-N 3.34Å; P316-L318 PolarHBondContact O-N 3.26Å
319	S	50	Low	65.6	Low	51 Å²	51	70.5 Å²	70.5	36%	0.357	37%	0.374	S	S	.	.	H	α-helix	trans	-86	-18.4	-171.8	-167.5	0	0	0	0	114.4	Y2 L315 P316	Y2-S319 WeakPolarHBondContact OH-CA 3.06Å; Y2-S319 PolarHBondContact OH-OG 3.02Å; L315-S319 VanDerWaalsContact O-CB 3.31Å; L315-S319 WeakPolarHBondContact O-CB 3.19Å; L315-S319 PolarHBondContact O-N 2.76Å; P316-S319 PolarHBondContact O-N 3.02Å
320	I	42	Very low	65.4	Low	97 Å²	97	77.3 Å²	77.3	50%	0.497	40%	0.404	S	S	.	.			trans	-140.6	108.2	-179.4	-45.3	176.2	0	0	0	107.3	P316 N322 T323	P316-I320 PolarHBondContact O-N 2.97Å; I320-N322 HydrophobicContact CG2-CB 4.2Å; I320-N322 PolarHBondContact O-N 2.99Å; I320-T323 HydrophobicContact CB-CG2 4.15Å; I320-T323 PolarHBondContact O-N 3.2Å
321	R	46.5	Very low	65.4	Low	258 Å²	258	75 Å²	75	97%	0.974	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-9.8	170.7	-87	-174.7	173.2	-167.8	-1.7	113.7
322	N	45.2	Very low	65.9	Low	138 Å²	138	72.5 Å²	72.5	74%	0.738	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	41.9	174.1	-65.8	-16.3	0	0	0	112.7	I320 T324	I320-N322 HydrophobicContact CG2-CB 4.2Å; I320-N322 PolarHBondContact O-N 2.99Å; N322-T324 PolarHBondContact O-N 2.84Å
323	T	54.6	Low	66.5	Low	24 Å²	24	74.8 Å²	74.8	15%	0.147	39%	0.385	C	S	.	.			trans	-57.6	113.3	161.4	41.3	0	0	0	0	108.1	P316 I320 K328	P316-T323 HydrophobicContact CB-CG2 3.58Å; P316-T323 WeakPolarHBondContact O-CG2 3.23Å; I320-T323 HydrophobicContact CB-CG2 4.15Å; I320-T323 PolarHBondContact O-N 3.2Å; T323-K328 WeakPolarHBondContact OG1-CE 3.46Å
324	T	60.6	Low	67.1	Low	81 Å²	81	78.8 Å²	78.8	50%	0.497	41%	0.406	S	S	.	.			trans	-58.8	145.6	174.8	53.7	0	0	0	0	108.2	N322 D326 V327	N322-T324 PolarHBondContact O-N 2.84Å; T324-D326 PolarHBondContact O-N 3.03Å; T324-V327 PolarHBondContact O-N 3.03Å
325	L	67.3	Low	67.9	Low	115 Å²	115	77.5 Å²	77.5	60%	0.602	40%	0.399	S	S	*	.	H	α-helix	trans	-47	-30.9	172.4	-174.5	67	0	0	0	111.4	K328 Q329	L325-K328 PolarHBondContact O-N 3.34Å; L325-Q329 VanDerWaalsContact O-CB 3.3Å; L325-Q329 WeakPolarHBondContact O-CB 3.34Å; L325-Q329 PolarHBondContact O-N 2.79Å
326	D	72.4	Confident	69	Low	120 Å²	120	73.5 Å²	73.5	64%	0.642	38%	0.378	S	S	*	.	H	α-helix	trans	-58.8	-43.6	175.9	-169.1	42.4	0	0	0	114.4	T324 Q329 K330	T324-D326 PolarHBondContact O-N 3.03Å; D326-Q329 PolarHBondContact O-N 3.29Å; D326-K330 WeakPolarHBondContact O-CB 3.36Å; D326-K330 PolarHBondContact O-N 3.35Å
327	V	73.8	Confident	70.6	Confident	56 Å²	56	77.6 Å²	77.6	34%	0.339	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-46	178	177.1	0	0	0	0	110.2	P316 T324 Q329 K330 S331	P316-V327 HydrophobicContact CB-CG1 4.04Å; P316-V327 HydrophobicContact CG-CG1 4.38Å; T324-V327 PolarHBondContact O-N 3.03Å; V327-Q329 VanDerWaalsContact C-N 3.34Å; V327-Q329 PolarHBondContact O-N 3.03Å; V327-K330 PolarHBondContact O-N 3.32Å; V327-S331 PolarHBondContact O-N 2.98Å; V327-S331 PolarHBondContact O-OG 2.63Å; V327-S331 VanDerWaalsContact O-OG 3.06Å
328	K	76.7	Confident	72.5	Confident	39 Å²	39	78.2 Å²	78.2	17%	0.17	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-40.9	177.8	-62.8	-172	-177.6	179.5	0	111	T323 L325 K330 S331 L332 L365	T323-K328 WeakPolarHBondContact OG1-CE 3.46Å; L325-K328 PolarHBondContact O-N 3.34Å; K328-K330 VanDerWaalsContact C-N 3.35Å; K328-K330 PolarHBondContact O-N 3.33Å; K328-S331 PolarHBondContact O-N 3.23Å; K328-L332 VanDerWaalsContact O-CG 3.32Å; K328-L332 WeakPolarHBondContact O-CG 3.44Å; K328-L332 PolarHBondContact O-N 3.02Å; K328-L365 HydrophobicContact CB-CD2 4.42Å; K328-L365 HydrophobicContact CD-CD1 4.42Å; K328-L365 HydrophobicContact CD-CD2 3.92Å
329	Q	81.2	Confident	74.2	Confident	55 Å²	55	75.8 Å²	75.8	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-41.1	177.1	-164.7	65.4	25.2	0	0	111.7	L325 D326 V327 L332 N333	L325-Q329 VanDerWaalsContact O-CB 3.3Å; L325-Q329 WeakPolarHBondContact O-CB 3.34Å; L325-Q329 PolarHBondContact O-N 2.79Å; D326-Q329 PolarHBondContact O-N 3.29Å; V327-Q329 VanDerWaalsContact C-N 3.34Å; V327-Q329 PolarHBondContact O-N 3.03Å; Q329-L332 PolarHBondContact O-N 2.8Å; Q329-N333 WeakPolarHBondContact O-CB 3.32Å; Q329-N333 PolarHBondContact O-N 3.33Å; Q329-N333 PolarHBondContact O-ND2 2.87Å
330	K	83.2	Confident	76.2	Confident	143 Å²	143	74.6 Å²	74.6	62%	0.622	38%	0.375	S	S	*	.	H	α-helix	trans	-61.3	-44.9	174.7	-172.3	177.2	-179.4	179.5	0	111.3	D326 V327 K328 N333 I334	D326-K330 WeakPolarHBondContact O-CB 3.36Å; D326-K330 PolarHBondContact O-N 3.35Å; V327-K330 PolarHBondContact O-N 3.32Å; K328-K330 VanDerWaalsContact C-N 3.35Å; K328-K330 PolarHBondContact O-N 3.33Å; K330-N333 WeakPolarHBondContact O-CB 3.35Å; K330-N333 PolarHBondContact O-N 2.87Å; K330-I334 WeakPolarHBondContact O-CG1 3.17Å; K330-I334 PolarHBondContact O-N 2.79Å
331	S	84.9	Confident	78.6	Confident	8 Å²	8	70 Å²	70	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-43.6	175.4	-57.4	0	0	0	0	112.3	S312 V327 K328 N333 I334 L335	S312-S331 WeakPolarHBondContact CB-OG 3.32Å; S312-S331 VanDerWaalsContact O-CB 3.28Å; S312-S331 WeakPolarHBondContact O-CB 3.5Å; S312-S331 PolarHBondContact O-OG 2.88Å; V327-S331 PolarHBondContact O-N 2.98Å; V327-S331 PolarHBondContact O-OG 2.63Å; V327-S331 VanDerWaalsContact O-OG 3.06Å; K328-S331 PolarHBondContact O-N 3.23Å; S331-N333 VanDerWaalsContact C-N 3.3Å; S331-N333 PolarHBondContact O-N 2.97Å; S331-I334 WeakPolarHBondContact O-CB 3.44Å; S331-I334 PolarHBondContact O-N 2.85Å; S331-L335 PolarHBondContact O-N 2.83Å; S331-L335 VanDerWaalsContact O-N 3.1Å
332	L	89.4	Confident	80.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.6	-36.5	174.4	-70.8	174.7	0	0	0	112.1	L313 K328 Q329 L335 N336 L365 V368 L369 P370 L373	L313-L332 HydrophobicContact CD2-CD2 4.15Å; L313-L332 HydrophobicContact CD2-CG 4.36Å; K328-L332 VanDerWaalsContact O-CG 3.32Å; K328-L332 WeakPolarHBondContact O-CG 3.44Å; K328-L332 PolarHBondContact O-N 3.02Å; Q329-L332 PolarHBondContact O-N 2.8Å; L332-L335 PolarHBondContact O-N 2.87Å; L332-N336 VanDerWaalsContact O-CB 3.22Å; L332-N336 WeakPolarHBondContact O-CB 3.36Å; L332-N336 PolarHBondContact O-N 2.94Å; L332-L365 HydrophobicContact CD1-CB 4.48Å; L332-L365 HydrophobicContact CD1-CD1 4.35Å; L332-L365 HydrophobicContact CD2-CD1 4.46Å; L332-V368 HydrophobicContact CD1-CG2 4.03Å; L332-L369 HydrophobicContact CD1-CD2 4.34Å; L332-L369 HydrophobicContact CD2-CD2 3.93Å; L332-P370 HydrophobicContact CB-CG 4.14Å; L332-L373 HydrophobicContact CB-CD1 4.43Å; L332-L373 HydrophobicContact CD2-CD1 3.9Å
333	N	88.6	Confident	82.3	Confident	69 Å²	69	62.4 Å²	62.4	37%	0.369	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-37.4	176	-72.6	-20.9	0	0	0	112.2	Q329 K330 S331 N336 N337	Q329-N333 WeakPolarHBondContact O-CB 3.32Å; Q329-N333 PolarHBondContact O-N 3.33Å; Q329-N333 PolarHBondContact O-ND2 2.87Å; K330-N333 WeakPolarHBondContact O-CB 3.35Å; K330-N333 PolarHBondContact O-N 2.87Å; S331-N333 VanDerWaalsContact C-N 3.3Å; S331-N333 PolarHBondContact O-N 2.97Å; N333-N336 PolarHBondContact O-N 3.12Å; N333-N337 PolarHBondContact O-N 3.07Å; N333-N337 PolarHBondContact O-ND2 2.79Å
334	I	88.1	Confident	83.4	Confident	85 Å²	85	64.1 Å²	64.1	44%	0.436	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-49.6	173.1	-67.8	166.2	0	0	0	109.7	I308 K330 S331 N337 H338	I308-I334 HydrophobicContact CG2-CG2 4.24Å; K330-I334 WeakPolarHBondContact O-CG1 3.17Å; K330-I334 PolarHBondContact O-N 2.79Å; S331-I334 WeakPolarHBondContact O-CB 3.44Å; S331-I334 PolarHBondContact O-N 2.85Å; I334-N337 PolarHBondContact O-N 3.38Å; I334-H338 PolarHBondContact O-N 2.77Å
335	L	90.8	Very high	84.1	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-64.2	-43.7	178.4	-67.7	172.9	0	0	0	111.9	L305 I308 M309 L313 S331 L332 N337 H338 F341 L356 L373	L305-L335 HydrophobicContact CD2-CD2 4.22Å; I308-L335 HydrophobicContact CG2-CD2 3.89Å; M309-L335 HydrophobicContact CE-CD2 4.12Å; M309-L335 HydrophobicContact CG-CD1 4.18Å; M309-L335 HydrophobicContact CG-CD2 4.01Å; L313-L335 HydrophobicContact CD1-CD1 3.64Å; L313-L335 HydrophobicContact CG-CD1 4.23Å; S331-L335 PolarHBondContact O-N 2.83Å; S331-L335 VanDerWaalsContact O-N 3.1Å; L332-L335 PolarHBondContact O-N 2.87Å; L335-N337 PolarHBondContact O-N 3.06Å; L335-N337 VanDerWaalsContact O-N 3.16Å; L335-H338 VanDerWaalsContact O-CB 3.31Å; L335-H338 WeakPolarHBondContact O-CB 3.26Å; L335-H338 PolarHBondContact O-N 2.81Å; L335-F341 HydrophobicContact CB-CE2 4.47Å; L335-F341 HydrophobicContact CD2-CE2 4.26Å; L335-F341 VanDerWaalsContact O-CD2 3.23Å; L335-F341 WeakPolarHBondContact O-CD2 3.12Å; L335-L356 HydrophobicContact CD1-CD1 3.82Å; L335-L373 HydrophobicContact CB-CD1 4.2Å
336	N	92.1	Very high	84.9	Confident	16 Å²	16	62.1 Å²	62.1	9%	0.086	32%	0.315	C	S	.	.	H	α-helix	trans	-56.8	-33.7	179.7	179.3	80.7	0	0	0	113.3	L332 N333 P370 N372 L373	L332-N336 VanDerWaalsContact O-CB 3.22Å; L332-N336 WeakPolarHBondContact O-CB 3.36Å; L332-N336 PolarHBondContact O-N 2.94Å; N333-N336 PolarHBondContact O-N 3.12Å; N336-P370 HydrophobicContact CB-CB 3.69Å; N336-P370 HydrophobicContact CB-CG 4.09Å; N336-P370 WeakPolarHBondContact OD1-CB 3.49Å; N336-N372 PolarHBondContact O-ND2 3.39Å; N336-N372 WeakPolarHBondContact OD1-CA 3.43Å; N336-N372 WeakPolarHBondContact OD1-CB 2.82Å; N336-N372 PolarHBondContact OD1-N 3.41Å; N336-L373 HydrophobicContact CB-CD1 4.43Å; N336-L373 HydrophobicContact CB-CG 4.18Å; N336-L373 PolarHBondContact OD1-N 3.43Å
337	N	90.8	Very high	85.4	Confident	112 Å²	112	65 Å²	65	60%	0.599	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-4	-178.3	-63.7	-21.4	0	0	0	112.8	N333 I334 L335	N333-N337 PolarHBondContact O-N 3.07Å; N333-N337 PolarHBondContact O-ND2 2.79Å; I334-N337 PolarHBondContact O-N 3.38Å; L335-N337 PolarHBondContact O-N 3.06Å; L335-N337 VanDerWaalsContact O-N 3.16Å
338	H	91.1	Very high	86.1	Confident	38 Å²	38	64.1 Å²	64.1	18%	0.176	32%	0.318	C	S	.	.	S	Bend	trans	-71.5	134.7	-180	-168.4	-87	0	0	0	110.7	L305 I334 L335 Y340 F341 V342	L305-H338 HydrophobicContact CD2-CB 4.27Å; I334-H338 PolarHBondContact O-N 2.77Å; L335-H338 VanDerWaalsContact O-CB 3.31Å; L335-H338 WeakPolarHBondContact O-CB 3.26Å; L335-H338 PolarHBondContact O-N 2.81Å; H338-Y340 WeakPolarHBondContact ND1-CB 3.37Å; H338-Y340 PolarHBondContact ND1-N 3.41Å; H338-Y340 PolarHBondContact O-N 3.22Å; H338-F341 HydrophobicContact CB-CD2 4.24Å; H338-F341 PolarHBondContact O-N 2.98Å; H338-V342 WeakPolarHBondContact O-CG2 3.42Å; H338-V342 PolarHBondContact O-N 3.23Å
339	P	89.4	Confident	86.9	Confident	86 Å²	86	62.3 Å²	62.3	56%	0.558	31%	0.31	S	S	*	.	H	α-helix	trans	-50.2	-35.1	-176.1	-30.4	35.5	0	0	0	114.7	F341 V342 K343	P339-F341 PolarHBondContact O-N 2.97Å; P339-V342 PolarHBondContact O-N 2.94Å; P339-K343 PolarHBondContact O-N 2.87Å; P339-K343 VanDerWaalsContact O-N 3.12Å
340	Y	90.5	Very high	87.5	Confident	25 Å²	25	59.9 Å²	59.9	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-55.6	-32.1	177	-169.2	-101.4	0	0	0	115	L302 L305 H338 R346 S350 V352 D353	L302-Y340 HydrophobicContact CD2-CD2 4.18Å; L302-Y340 HydrophobicContact CD2-CE2 3.49Å; L302-Y340 VanDerWaalsContact CD2-CE2 3.49Å; L305-Y340 HydrophobicContact CD1-CD1 3.7Å; L305-Y340 HydrophobicContact CD1-CD2 3.99Å; L305-Y340 HydrophobicContact CD1-CE1 4.39Å; L305-Y340 HydrophobicContact CD1-CG 3.47Å; L305-Y340 VanDerWaalsContact CD1-CG 3.47Å; H338-Y340 WeakPolarHBondContact ND1-CB 3.37Å; H338-Y340 PolarHBondContact ND1-N 3.41Å; H338-Y340 PolarHBondContact O-N 3.22Å; Y340-R346 VanDerWaalsContact CE1-CZ 3.42Å; Y340-R346 VanDerWaalsContact CE2-NH1 3.3Å; Y340-R346 PolarHBondContact O-NH1 3.44Å; Y340-R346 PolarHBondContact OH-NE 2.91Å; Y340-R346 PolarHBondContact OH-NH1 3.15Å; Y340-S350 WeakPolarHBondContact OH-CB 3.19Å; Y340-S350 PolarHBondContact OH-OG 3.38Å; Y340-V352 HydrophobicContact CE1-CG1 4.21Å; Y340-D353 PolarHBondContact OH-OD2 2.69Å
341	F	92.4	Very high	88	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-103.3	-16.9	180	-62.1	-69.2	0	0	0	113	L305 M309 L335 H338 P339 F344 L356 L373 W376	L305-F341 HydrophobicContact CD2-CE2 4.17Å; M309-F341 HydrophobicContact CE-CE2 4.01Å; M309-F341 HydrophobicContact CE-CZ 3.66Å; L335-F341 HydrophobicContact CB-CE2 4.47Å; L335-F341 HydrophobicContact CD2-CE2 4.26Å; L335-F341 VanDerWaalsContact O-CD2 3.23Å; L335-F341 WeakPolarHBondContact O-CD2 3.12Å; H338-F341 HydrophobicContact CB-CD2 4.24Å; H338-F341 PolarHBondContact O-N 2.98Å; P339-F341 PolarHBondContact O-N 2.97Å; F341-F344 WeakPolarHBondContact O-CD1 3.49Å; F341-L356 HydrophobicContact CE1-CD2 3.64Å; F341-L356 HydrophobicContact CE2-CD2 4.16Å; F341-L356 HydrophobicContact CZ-CD2 3.38Å; F341-L373 HydrophobicContact CB-CD2 4.11Å; F341-L373 HydrophobicContact CD1-CD2 3.92Å; F341-L373 HydrophobicContact CD2-CD2 4.17Å; F341-L373 HydrophobicContact CE1-CD2 4.41Å; F341-L373 HydrophobicContact CG-CD2 3.79Å; F341-W376 HydrophobicContact CD1-CB 4.21Å; F341-W376 AromaticContact CD1-CD1 3.71Å; F341-W376 HydrophobicContact CD1-CD2 4.33Å; F341-W376 AromaticContact CD1-CG 3.8Å; F341-W376 HydrophobicContact CD1-CG 3.8Å; F341-W376 AromaticContact CE1-CD1 3.77Å; F341-W376 HydrophobicContact CE1-CD2 4.2Å; F341-W376 HydrophobicContact CE1-CG 4.06Å; F341-W376 AromaticContact CE1-NE1 3.69Å
342	V	88.1	Confident	88.4	Confident	66 Å²	66	52.7 Å²	52.7	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-77.6	-40.7	176.7	-179.9	0	0	0	0	111.1	H338 P339	H338-V342 WeakPolarHBondContact O-CG2 3.42Å; H338-V342 PolarHBondContact O-N 3.23Å; P339-V342 PolarHBondContact O-N 2.94Å
343	K	81.7	Confident	88.6	Confident	172 Å²	172	52.7 Å²	52.7	75%	0.748	27%	0.267	S	S	*	.	S	Bend	trans	-129.6	79.9	-179.1	-64.5	-176.3	-178.3	179.5	0	109.6	P339 N345	P339-K343 PolarHBondContact O-N 2.87Å; P339-K343 VanDerWaalsContact O-N 3.12Å; K343-N345 PolarHBondContact O-N 3.14Å
344	F	77.3	Confident	88.9	Confident	60 Å²	60	49.4 Å²	49.4	26%	0.263	25%	0.249	S	C	.	.			trans	-89.9	97.2	173.1	54.7	-88.3	0	0	0	109.7	F341 F379	F341-F344 WeakPolarHBondContact O-CD1 3.49Å; F344-F379 HydrophobicContact CD2-CB 4.15Å; F344-F379 HydrophobicContact CD2-CD2 4.19Å; F344-F379 HydrophobicContact CD2-CG 4.06Å; F344-F379 HydrophobicContact CE2-CB 3.66Å; F344-F379 HydrophobicContact CE2-CD2 4.29Å; F344-F379 HydrophobicContact CE2-CG 4.07Å; F344-F379 HydrophobicContact CZ-CB 4.31Å
345	N	76.1	Confident	89.2	Confident	134 Å²	134	45.5 Å²	45.5	72%	0.717	23%	0.229	S	C	*	.			trans	-99.3	22.5	172.6	65.8	-19.8	0	0	0	112.1	K343	K343-N345 PolarHBondContact O-N 3.14Å
346	R	84	Confident	89.4	Confident	20 Å²	20	45.4 Å²	45.4	8%	0.075	23%	0.229	C	C	.	.			trans	-85.4	141	-178.6	61	-177.9	169.8	-90.4	-5.1	111.5	N170 Y340 L348 D353 F379	N170-R346 WeakPolarHBondContact ND2-CB 3Å; Y340-R346 VanDerWaalsContact CE1-CZ 3.42Å; Y340-R346 VanDerWaalsContact CE2-NH1 3.3Å; Y340-R346 PolarHBondContact O-NH1 3.44Å; Y340-R346 PolarHBondContact OH-NE 2.91Å; Y340-R346 PolarHBondContact OH-NH1 3.15Å; R346-L348 VanDerWaalsContact CD-O 3.3Å; R346-L348 WeakPolarHBondContact CD-O 3.17Å; R346-L348 WeakPolarHBondContact CG-O 3.24Å; R346-D353 IonicContact CZ-OD1 2.61Å; R346-D353 IonicContact CZ-OD2 3.29Å; R346-D353 VanDerWaalsContact CZ-OD2 3.31Å; R346-D353 IonicContact NE-OD1 3.91Å; R346-D353 IonicContact NE-OD2 3.44Å; R346-D353 PolarHBondContact NE-OD2 3.1Å; R346-D353 VanDerWaalsContact NH2-CG 3.33Å; R346-D353 IonicContact NH2-OD1 3.71Å; R346-D353 PolarHBondContact NH2-OD1 3.1Å; R346-D353 IonicContact NH2-OD2 2.81Å; R346-D353 PolarHBondContact NH2-OD2 3.05Å; R346-F379 HydrophobicContact CG-CE1 4.36Å; R346-F379 HydrophobicContact CG-CZ 3.94Å
347	E	83.6	Confident	89.5	Confident	180 Å²	180	45.2 Å²	45.2	84%	0.841	23%	0.227	S	C	*	.	S	Bend	trans	-74.3	-45.1	174.9	-65.6	-175.6	172.9	0	0	110.4	W383	E347-W383 WeakPolarHBondContact O-CZ2 3.36Å
348	L	88.4	Confident	89.5	Confident	38 Å²	38	40 Å²	40	20%	0.199	20%	0.199	C	C	.	.	S	Bend	trans	-111.2	145.7	-177	-166.1	71.1	0	0	0	112	I172 I200 N204 R346 W383	I172-L348 HydrophobicContact CD1-CD2 3.8Å; I200-L348 HydrophobicContact CG2-CD1 3.42Å; I200-L348 VanDerWaalsContact CG2-CD1 3.42Å; I200-L348 HydrophobicContact CG2-CD2 3.94Å; I200-L348 HydrophobicContact CG2-CG 3.68Å; N204-L348 HydrophobicContact CB-CD1 4.22Å; N204-L348 VanDerWaalsContact CG-CD1 3.42Å; N204-L348 WeakPolarHBondContact ND2-CD1 3.5Å; R346-L348 VanDerWaalsContact CD-O 3.3Å; R346-L348 WeakPolarHBondContact CD-O 3.17Å; R346-L348 WeakPolarHBondContact CG-O 3.24Å; L348-W383 HydrophobicContact CD1-CE3 4.29Å; L348-W383 HydrophobicContact CD1-CH2 3.53Å; L348-W383 HydrophobicContact CD1-CZ2 4.01Å; L348-W383 HydrophobicContact CD1-CZ3 3.72Å
349	P	92.8	Very high	89.4	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	19%	0.191	C	C	.	.			trans	-66.3	133.2	166.7	-15.8	30.1	0	0	0	111.3	I200 D353 F379 W383 F386	I200-P349 HydrophobicContact CD1-CB 3.96Å; I200-P349 HydrophobicContact CD1-CG 4.16Å; P349-D353 WeakPolarHBondContact CA-OD2 3.27Å; P349-D353 HydrophobicContact CB-CB 3.87Å; P349-F379 HydrophobicContact CB-CE1 4.09Å; P349-F379 HydrophobicContact CG-CE1 3.8Å; P349-F379 HydrophobicContact CG-CZ 4Å; P349-W383 VanDerWaalsContact CD-CE2 3.42Å; P349-W383 HydrophobicContact CG-CD2 4.1Å; P349-W383 HydrophobicContact CG-CG 3.85Å; P349-F386 HydrophobicContact CB-CE2 3.95Å; P349-F386 HydrophobicContact CB-CZ 4.02Å; P349-F386 HydrophobicContact CG-CE2 3.84Å; P349-F386 HydrophobicContact CG-CZ 4.41Å
350	S	93.3	Very high	89.5	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.021	16%	0.164	C	C	.	.			trans	-75.3	173.8	173.8	64.6	0	0	0	0	112.6	E295 Y340 V352 D353 C354	E295-S350 WeakPolarHBondContact OE1-CB 3.2Å; Y340-S350 WeakPolarHBondContact OH-CB 3.19Å; Y340-S350 PolarHBondContact OH-OG 3.38Å; S350-V352 PolarHBondContact O-N 3.25Å; S350-V352 PolarHBondContact OG-N 3.28Å; S350-D353 PolarHBondContact N-OD2 2.61Å; S350-D353 WeakPolarHBondContact O-CB 3.45Å; S350-D353 PolarHBondContact O-N 3.18Å; S350-D353 VanDerWaalsContact O-N 3.15Å; S350-D353 VanDerWaalsContact OG-CG 3.28Å; S350-D353 PolarHBondContact OG-N 3.45Å; S350-D353 VanDerWaalsContact OG-N 3.1Å; S350-D353 PolarHBondContact OG-OD2 3.08Å; S350-C354 PolarHBondContact O-N 3.19Å
351	I	93.8	Very high	89.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-30.2	170.6	-158.6	171.8	0	0	0	112.6	F197 V287 I290 E295 D353 C354 Y355	F197-I351 HydrophobicContact CB-CG1 4.08Å; F197-I351 HydrophobicContact CD1-CB 3.89Å; F197-I351 HydrophobicContact CD1-CD1 3.83Å; F197-I351 HydrophobicContact CD1-CG1 3.77Å; F197-I351 HydrophobicContact CD2-CB 4.08Å; F197-I351 HydrophobicContact CD2-CG1 4.43Å; F197-I351 HydrophobicContact CE1-CB 3.94Å; F197-I351 HydrophobicContact CE1-CD1 4.25Å; F197-I351 HydrophobicContact CE1-CG1 4.27Å; F197-I351 HydrophobicContact CE2-CB 4.17Å; F197-I351 HydrophobicContact CG-CB 3.95Å; F197-I351 HydrophobicContact CG-CD1 4.38Å; F197-I351 HydrophobicContact CG-CG1 3.84Å; F197-I351 HydrophobicContact CZ-CB 4.09Å; V287-I351 HydrophobicContact CB-CD1 4.26Å; V287-I351 HydrophobicContact CG1-CD1 4.09Å; V287-I351 HydrophobicContact CG1-CG1 3.97Å; V287-I351 HydrophobicContact CG1-CG2 4.07Å; V287-I351 HydrophobicContact CG2-CD1 4.35Å; V287-I351 HydrophobicContact CG2-CG1 4.5Å; I290-I351 HydrophobicContact CB-CD1 3.59Å; I290-I351 HydrophobicContact CD1-CD1 4.37Å; I290-I351 HydrophobicContact CG2-CD1 3.56Å; E295-I351 WeakPolarHBondContact OE2-CG2 3.25Å; E295-I351 PolarHBondContact OE2-N 3.06Å; E295-I351 VanDerWaalsContact OE2-N 3.13Å; I351-D353 VanDerWaalsContact C-N 3.28Å; I351-D353 PolarHBondContact O-N 2.97Å; I351-C354 WeakPolarHBondContact O-CB 3.38Å; I351-C354 PolarHBondContact O-N 3.3Å; I351-Y355 WeakPolarHBondContact O-CB 3.37Å; I351-Y355 PolarHBondContact O-N 3Å
352	V	93.6	Very high	89	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-35.4	175.7	177.5	0	0	0	0	111.4	L302 L305 I306 M309 Y340 S350 Y355 L356	L302-V352 HydrophobicContact CB-CG2 3.67Å; L302-V352 HydrophobicContact CD1-CG2 4.43Å; L302-V352 HydrophobicContact CD2-CB 4.22Å; L302-V352 HydrophobicContact CD2-CG2 3.64Å; L302-V352 HydrophobicContact CG-CG2 4.08Å; L305-V352 HydrophobicContact CB-CG1 4.1Å; L305-V352 HydrophobicContact CD1-CG1 4.33Å; I306-V352 HydrophobicContact CD1-CG2 3.85Å; I306-V352 HydrophobicContact CG1-CG2 3.71Å; M309-V352 HydrophobicContact CE-CG1 3.45Å; M309-V352 VanDerWaalsContact CE-CG1 3.45Å; M309-V352 HydrophobicContact SD-CG1 4.11Å; Y340-V352 HydrophobicContact CE1-CG1 4.21Å; S350-V352 PolarHBondContact O-N 3.25Å; S350-V352 PolarHBondContact OG-N 3.28Å; V352-Y355 PolarHBondContact O-N 2.93Å; V352-L356 WeakPolarHBondContact O-CB 3.22Å; V352-L356 PolarHBondContact O-N 3.48Å
353	D	94.7	Very high	88.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.8	-45	175.3	-64.5	-56.2	0	0	0	111.4	Y340 R346 P349 S350 I351 Y355 F357 W376 F386	Y340-D353 PolarHBondContact OH-OD2 2.69Å; R346-D353 IonicContact CZ-OD1 2.61Å; R346-D353 IonicContact CZ-OD2 3.29Å; R346-D353 VanDerWaalsContact CZ-OD2 3.31Å; R346-D353 IonicContact NE-OD1 3.91Å; R346-D353 IonicContact NE-OD2 3.44Å; R346-D353 PolarHBondContact NE-OD2 3.1Å; R346-D353 VanDerWaalsContact NH2-CG 3.33Å; R346-D353 IonicContact NH2-OD1 3.71Å; R346-D353 PolarHBondContact NH2-OD1 3.1Å; R346-D353 IonicContact NH2-OD2 2.81Å; R346-D353 PolarHBondContact NH2-OD2 3.05Å; P349-D353 WeakPolarHBondContact CA-OD2 3.27Å; P349-D353 HydrophobicContact CB-CB 3.87Å; S350-D353 PolarHBondContact N-OD2 2.61Å; S350-D353 WeakPolarHBondContact O-CB 3.45Å; S350-D353 PolarHBondContact O-N 3.18Å; S350-D353 VanDerWaalsContact O-N 3.15Å; S350-D353 VanDerWaalsContact OG-CG 3.28Å; S350-D353 PolarHBondContact OG-N 3.45Å; S350-D353 VanDerWaalsContact OG-N 3.1Å; S350-D353 PolarHBondContact OG-OD2 3.08Å; I351-D353 VanDerWaalsContact C-N 3.28Å; I351-D353 PolarHBondContact O-N 2.97Å; D353-Y355 VanDerWaalsContact C-N 3.33Å; D353-Y355 PolarHBondContact O-N 3.25Å; D353-F357 VanDerWaalsContact O-CB 3.24Å; D353-F357 WeakPolarHBondContact O-CB 3.39Å; D353-F357 PolarHBondContact O-N 2.89Å; D353-W376 WeakPolarHBondContact O-CZ2 3.46Å; D353-W376 PolarHBondContact OD1-NE1 2.94Å; D353-F386 HydrophobicContact CB-CZ 4.42Å
354	C	94.8	Very high	89	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-44.4	176	-63.2	0	0	0	0	111.3	S193 L196 F197 I200 S350 I351 F357 V358	S193-C354 VanDerWaalsContact O-CB 3.26Å; S193-C354 WeakPolarHBondContact O-CB 3.42Å; L196-C354 HydrophobicContact CB-CB 4.05Å; L196-C354 HydrophobicContact CD1-CB 4.46Å; F197-C354 HydrophobicContact CB-CB 4.26Å; I200-C354 WeakPolarHBondContact CD1-SG 3.41Å; S350-C354 PolarHBondContact O-N 3.19Å; I351-C354 WeakPolarHBondContact O-CB 3.38Å; I351-C354 PolarHBondContact O-N 3.3Å; C354-F357 PolarHBondContact O-N 2.78Å; C354-V358 WeakPolarHBondContact O-CG2 3.39Å; C354-V358 PolarHBondContact O-N 3.42Å
355	Y	94.5	Very high	89.4	Confident	3 Å²	3	39.4 Å²	39.4	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-48.6	-179.3	-172	-121.1	0	0	0	112.3	E283 C284 V287 I306 M309 D310 L314 I351 V352 D353 F357 V358 C359	E283-Y355 HydrophobicContact CB-CE2 4.47Å; E283-Y355 HydrophobicContact CG-CE2 4.37Å; C284-Y355 WeakPolarHBondContact CB-OH 3.47Å; V287-Y355 HydrophobicContact CG1-CG 4.18Å; V287-Y355 HydrophobicContact CG2-CD2 3.85Å; V287-Y355 HydrophobicContact CG2-CE2 4.45Å; V287-Y355 HydrophobicContact CG2-CG 4.21Å; I306-Y355 HydrophobicContact CG2-CD1 4.15Å; I306-Y355 HydrophobicContact CG2-CE1 3.98Å; M309-Y355 HydrophobicContact CB-CD1 4.28Å; M309-Y355 HydrophobicContact CB-CE1 4.06Å; M309-Y355 HydrophobicContact SD-CD1 4.03Å; D310-Y355 PolarHBondContact OD1-OH 2.76Å; L314-Y355 HydrophobicContact CD1-CE2 4.5Å; L314-Y355 WeakPolarHBondContact CD1-OH 3.3Å; I351-Y355 WeakPolarHBondContact O-CB 3.37Å; I351-Y355 PolarHBondContact O-N 3Å; V352-Y355 PolarHBondContact O-N 2.93Å; D353-Y355 VanDerWaalsContact C-N 3.33Å; D353-Y355 PolarHBondContact O-N 3.25Å; Y355-F357 VanDerWaalsContact C-N 3.3Å; Y355-F357 PolarHBondContact O-N 3.18Å; Y355-V358 PolarHBondContact O-N 3.18Å; Y355-C359 PolarHBondContact O-N 2.82Å; Y355-C359 PolarHBondContact O-SG 2.85Å
356	L	94.1	Very high	89.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-40.1	175.7	-177.9	57.1	0	0	0	112	M309 L313 L335 F341 V352 C359 I360 L373 W376	M309-L356 HydrophobicContact CE-CB 3.78Å; M309-L356 HydrophobicContact CE-CD1 4.24Å; M309-L356 HydrophobicContact CE-CD2 3.95Å; M309-L356 HydrophobicContact CE-CG 4.19Å; M309-L356 HydrophobicContact CG-CD1 4.16Å; M309-L356 HydrophobicContact SD-CB 3.7Å; M309-L356 HydrophobicContact SD-CD1 4.12Å; M309-L356 HydrophobicContact SD-CG 4.37Å; L313-L356 HydrophobicContact CD1-CD1 3.64Å; L335-L356 HydrophobicContact CD1-CD1 3.82Å; F341-L356 HydrophobicContact CE1-CD2 3.64Å; F341-L356 HydrophobicContact CE2-CD2 4.16Å; F341-L356 HydrophobicContact CZ-CD2 3.38Å; V352-L356 WeakPolarHBondContact O-CB 3.22Å; V352-L356 PolarHBondContact O-N 3.48Å; L356-C359 WeakPolarHBondContact O-CB 3.44Å; L356-C359 PolarHBondContact O-N 2.9Å; L356-I360 HydrophobicContact CD1-CD1 3.87Å; L356-I360 HydrophobicContact CD1-CG1 4.1Å; L356-I360 HydrophobicContact CD2-CD1 4.29Å; L356-I360 HydrophobicContact CG-CD1 3.72Å; L356-I360 HydrophobicContact CG-CG1 4.37Å; L356-I360 WeakPolarHBondContact O-CB 3.47Å; L356-I360 WeakPolarHBondContact O-CG1 3.23Å; L356-I360 PolarHBondContact O-N 2.8Å; L356-L373 HydrophobicContact CD2-CD2 4.3Å; L356-W376 HydrophobicContact CB-CH2 3.96Å; L356-W376 HydrophobicContact CB-CZ2 3.93Å; L356-W376 HydrophobicContact CD2-CD2 4.47Å; L356-W376 HydrophobicContact CD2-CE3 4.37Å; L356-W376 HydrophobicContact CD2-CH2 3.77Å; L356-W376 HydrophobicContact CD2-CZ2 3.85Å; L356-W376 HydrophobicContact CD2-CZ3 4.06Å; L356-W376 HydrophobicContact CG-CH2 3.63Å; L356-W376 HydrophobicContact CG-CZ2 3.97Å; L356-W376 HydrophobicContact CG-CZ3 4.2Å
357	F	94	Very high	90	Very high	12 Å²	12	40.6 Å²	40.6	5%	0.053	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-45.4	-179.5	-173.1	-83.5	0	0	0	111.8	L196 D353 C354 Y355 I360 K361 W376 L377 C380 F386 L389	L196-F357 HydrophobicContact CD1-CD1 4.4Å; D353-F357 VanDerWaalsContact O-CB 3.24Å; D353-F357 WeakPolarHBondContact O-CB 3.39Å; D353-F357 PolarHBondContact O-N 2.89Å; C354-F357 PolarHBondContact O-N 2.78Å; Y355-F357 VanDerWaalsContact C-N 3.3Å; Y355-F357 PolarHBondContact O-N 3.18Å; F357-I360 PolarHBondContact O-N 2.87Å; F357-K361 HydrophobicContact CD1-CG 3.92Å; F357-K361 HydrophobicContact CE1-CD 4.34Å; F357-K361 HydrophobicContact CE1-CG 3.67Å; F357-K361 HydrophobicContact CZ-CG 4.31Å; F357-K361 WeakPolarHBondContact O-CG 3.34Å; F357-K361 PolarHBondContact O-N 2.89Å; F357-W376 HydrophobicContact CB-CH2 3.99Å; F357-W376 HydrophobicContact CB-CZ2 4.32Å; F357-W376 HydrophobicContact CD2-CH2 4.36Å; F357-L377 HydrophobicContact CD2-CD1 3.76Å; F357-L377 HydrophobicContact CE2-CD1 3.5Å; F357-L377 VanDerWaalsContact CE2-CD1 3.5Å; F357-C380 HydrophobicContact CD2-CB 4.19Å; F357-C380 HydrophobicContact CE2-CB 4.36Å; F357-F386 HydrophobicContact CB-CD1 3.88Å; F357-F386 HydrophobicContact CB-CE1 3.58Å; F357-F386 AromaticContact CD1-CD1 3.6Å; F357-F386 HydrophobicContact CD1-CD1 3.6Å; F357-F386 HydrophobicContact CD1-CE1 4.18Å; F357-F386 AromaticContact CD2-CD1 3.37Å; F357-F386 HydrophobicContact CD2-CD1 3.37Å; F357-F386 AromaticContact CD2-CE1 3.8Å; F357-F386 HydrophobicContact CD2-CE1 3.8Å; F357-F386 HydrophobicContact CD2-CG 4.3Å; F357-F386 HydrophobicContact CE1-CB 4.31Å; F357-F386 AromaticContact CE1-CD1 3.85Å; F357-F386 HydrophobicContact CE1-CD1 3.85Å; F357-F386 HydrophobicContact CE2-CB 4.07Å; F357-F386 AromaticContact CE2-CD1 3.63Å; F357-F386 HydrophobicContact CE2-CD1 3.63Å; F357-F386 HydrophobicContact CE2-CE1 4.48Å; F357-F386 HydrophobicContact CE2-CG 4.17Å; F357-F386 AromaticContact CG-CD1 3.34Å; F357-F386 HydrophobicContact CG-CD1 3.34Å; F357-F386 AromaticContact CG-CE1 3.61Å; F357-F386 HydrophobicContact CG-CE1 3.61Å; F357-F386 HydrophobicContact CZ-CB 3.87Å; F357-F386 AromaticContact CZ-CD1 3.85Å; F357-F386 HydrophobicContact CZ-CD1 3.85Å; F357-F386 HydrophobicContact CZ-CG 4.31Å; F357-L389 HydrophobicContact CD1-CD1 3.36Å; F357-L389 HydrophobicContact CE1-CD1 3.32Å
358	V	91.8	Very high	90.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-49.5	174.3	171.6	0	0	0	0	110.2	L192 L196 C354 Y355 I360 K361 E362 L389	L192-V358 HydrophobicContact CB-CG1 4.09Å; L192-V358 HydrophobicContact CB-CG2 3.87Å; L196-V358 HydrophobicContact CD1-CG2 3.62Å; C354-V358 WeakPolarHBondContact O-CG2 3.39Å; C354-V358 PolarHBondContact O-N 3.42Å; Y355-V358 PolarHBondContact O-N 3.18Å; V358-I360 VanDerWaalsContact C-N 3.3Å; V358-I360 PolarHBondContact O-N 2.68Å; V358-K361 PolarHBondContact O-N 3.44Å; V358-E362 HydrophobicContact CG1-CG 4.05Å; V358-E362 WeakPolarHBondContact O-CG 3.31Å; V358-E362 PolarHBondContact O-N 3.48Å; V358-L389 HydrophobicContact CG2-CD1 4.06Å; V358-L389 HydrophobicContact CG2-CD2 4.44Å
359	C	89.5	Confident	90.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-54.1	-45.6	177.3	-66.4	0	0	0	0	112.1	L313 L314 Y355 L356 K361 L363	L313-C359 HydrophobicContact CD1-CB 4.4Å; L314-C359 HydrophobicContact CD2-CB 4.34Å; Y355-C359 PolarHBondContact O-N 2.82Å; Y355-C359 PolarHBondContact O-SG 2.85Å; L356-C359 WeakPolarHBondContact O-CB 3.44Å; L356-C359 PolarHBondContact O-N 2.9Å; C359-K361 PolarHBondContact O-N 3.41Å; C359-L363 WeakPolarHBondContact O-CB 3.3Å; C359-L363 WeakPolarHBondContact O-CG 3.49Å; C359-L363 PolarHBondContact O-N 3.08Å
360	I	89.6	Confident	90.4	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.5	-38.3	179.5	-74.2	167.3	0	0	0	111.6	L356 F357 V358 K364 L365 L369 W376	L356-I360 HydrophobicContact CD1-CD1 3.87Å; L356-I360 HydrophobicContact CD1-CG1 4.1Å; L356-I360 HydrophobicContact CD2-CD1 4.29Å; L356-I360 HydrophobicContact CG-CD1 3.72Å; L356-I360 HydrophobicContact CG-CG1 4.37Å; L356-I360 WeakPolarHBondContact O-CB 3.47Å; L356-I360 WeakPolarHBondContact O-CG1 3.23Å; L356-I360 PolarHBondContact O-N 2.8Å; F357-I360 PolarHBondContact O-N 2.87Å; V358-I360 VanDerWaalsContact C-N 3.3Å; V358-I360 PolarHBondContact O-N 2.68Å; I360-K364 PolarHBondContact O-N 2.95Å; I360-K364 VanDerWaalsContact O-N 3.13Å; I360-L365 HydrophobicContact CG2-CB 4.26Å; I360-L365 PolarHBondContact O-N 3.33Å; I360-L369 HydrophobicContact CD1-CD1 4.4Å; I360-L369 HydrophobicContact CD1-CD2 3.85Å; I360-L369 HydrophobicContact CG1-CD2 4.24Å; I360-L369 HydrophobicContact CG2-CD1 4.37Å; I360-L369 HydrophobicContact CG2-CD2 4.26Å; I360-W376 HydrophobicContact CD1-CE3 4.45Å; I360-W376 HydrophobicContact CD1-CH2 3.8Å; I360-W376 HydrophobicContact CD1-CZ3 3.39Å
361	K	88.5	Confident	90.4	Very high	100 Å²	100	36.6 Å²	36.6	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-70.6	-49.2	178.7	-73.4	-64.3	-174.8	-173	0	111.8	F357 V358 C359 L363 K364	F357-K361 HydrophobicContact CD1-CG 3.92Å; F357-K361 HydrophobicContact CE1-CD 4.34Å; F357-K361 HydrophobicContact CE1-CG 3.67Å; F357-K361 HydrophobicContact CZ-CG 4.31Å; F357-K361 WeakPolarHBondContact O-CG 3.34Å; F357-K361 PolarHBondContact O-N 2.89Å; V358-K361 PolarHBondContact O-N 3.44Å; C359-K361 PolarHBondContact O-N 3.41Å; K361-L363 VanDerWaalsContact C-N 3.32Å; K361-L363 PolarHBondContact O-N 3.34Å; K361-K364 PolarHBondContact O-N 3.36Å; K361-K364 VanDerWaalsContact O-N 3.08Å
362	E	84.8	Confident	90.4	Very high	107 Å²	107	38.9 Å²	38.9	50%	0.5	20%	0.204	S	C	.	.	H	α-helix	trans	-60.8	-41.6	178.7	-70.2	-174.6	159.6	0	0	111.9	V358 K364	V358-E362 HydrophobicContact CG1-CG 4.05Å; V358-E362 WeakPolarHBondContact O-CG 3.31Å; V358-E362 PolarHBondContact O-N 3.48Å; E362-K364 VanDerWaalsContact C-N 3.27Å; E362-K364 PolarHBondContact O-N 3.07Å
363	L	84.2	Confident	90.4	Very high	35 Å²	35	38.9 Å²	38.9	18%	0.183	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.1	178.2	-61.5	175.2	0	0	0	113.9	L313 L314 C359 K361 L365	L313-L363 HydrophobicContact CB-CD1 3.91Å; L314-L363 HydrophobicContact CD2-CD1 4.23Å; L314-L363 HydrophobicContact CD2-CG 4.43Å; C359-L363 WeakPolarHBondContact O-CB 3.3Å; C359-L363 WeakPolarHBondContact O-CG 3.49Å; C359-L363 PolarHBondContact O-N 3.08Å; K361-L363 VanDerWaalsContact C-N 3.32Å; K361-L363 PolarHBondContact O-N 3.34Å; L363-L365 VanDerWaalsContact C-N 3.33Å; L363-L365 HydrophobicContact CB-CD1 3.75Å; L363-L365 HydrophobicContact CB-CG 3.72Å; L363-L365 HydrophobicContact CD1-CD1 3.95Å; L363-L365 PolarHBondContact O-N 2.99Å
364	K	85.6	Confident	90.4	Very high	184 Å²	184	43.9 Å²	43.9	80%	0.8	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	43.8	-177.8	-58.1	-179.2	179.9	179.5	0	113.5	I360 K361 E362	I360-K364 PolarHBondContact O-N 2.95Å; I360-K364 VanDerWaalsContact O-N 3.13Å; K361-K364 PolarHBondContact O-N 3.36Å; K361-K364 VanDerWaalsContact O-N 3.08Å; E362-K364 VanDerWaalsContact C-N 3.27Å; E362-K364 PolarHBondContact O-N 3.07Å
365	L	87	Confident	90.3	Very high	7 Å²	7	46.3 Å²	46.3	4%	0.037	24%	0.243	C	C	.	.			trans	-95.5	5.8	-175.5	-62.7	176.9	0	0	0	114.4	L313 K328 L332 I360 L363 D367 V368 L369	L313-L365 HydrophobicContact CD2-CD1 4.32Å; K328-L365 HydrophobicContact CB-CD2 4.42Å; K328-L365 HydrophobicContact CD-CD1 4.42Å; K328-L365 HydrophobicContact CD-CD2 3.92Å; L332-L365 HydrophobicContact CD1-CB 4.48Å; L332-L365 HydrophobicContact CD1-CD1 4.35Å; L332-L365 HydrophobicContact CD2-CD1 4.46Å; I360-L365 HydrophobicContact CG2-CB 4.26Å; I360-L365 PolarHBondContact O-N 3.33Å; L363-L365 VanDerWaalsContact C-N 3.33Å; L363-L365 HydrophobicContact CB-CD1 3.75Å; L363-L365 HydrophobicContact CB-CG 3.72Å; L363-L365 HydrophobicContact CD1-CD1 3.95Å; L363-L365 PolarHBondContact O-N 2.99Å; L365-D367 VanDerWaalsContact C-N 3.26Å; L365-D367 PolarHBondContact O-N 3.48Å; L365-V368 HydrophobicContact CB-CG2 4.11Å; L365-V368 HydrophobicContact CD2-CG2 3.92Å; L365-V368 VanDerWaalsContact O-CG2 3.28Å; L365-V368 WeakPolarHBondContact O-CG2 3.08Å; L365-V368 PolarHBondContact O-N 2.91Å; L365-L369 WeakPolarHBondContact O-CD2 3.27Å; L365-L369 WeakPolarHBondContact O-CG 3.46Å
366	S	86.5	Confident	90.3	Very high	30 Å²	30	46.2 Å²	46.2	21%	0.21	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-57.9	-35.3	-173.4	-62.9	0	0	0	0	113.6
367	D	85.8	Confident	90.2	Very high	149 Å²	149	48.1 Å²	48.1	80%	0.797	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-81.6	-17.9	-174.6	-58.4	-37.7	0	0	0	113.7	L365	L365-D367 VanDerWaalsContact C-N 3.26Å; L365-D367 PolarHBondContact O-N 3.48Å
368	V	88	Confident	90.1	Very high	51 Å²	51	53.8 Å²	53.8	31%	0.309	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-104.6	9.5	-174.3	-63.2	0	0	0	0	113.4	L332 L365 P370	L332-V368 HydrophobicContact CD1-CG2 4.03Å; L365-V368 HydrophobicContact CB-CG2 4.11Å; L365-V368 HydrophobicContact CD2-CG2 3.92Å; L365-V368 VanDerWaalsContact O-CG2 3.28Å; L365-V368 WeakPolarHBondContact O-CG2 3.08Å; L365-V368 PolarHBondContact O-N 2.91Å; V368-P370 WeakPolarHBondContact O-CD 3.43Å
369	L	91.1	Very high	90.1	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	28%	0.282	C	S	.	.			trans	-65	132.1	-176.3	-64.3	-177.6	0	0	0	112.2	L332 I360 L365 L373 K374 L377	L332-L369 HydrophobicContact CD1-CD2 4.34Å; L332-L369 HydrophobicContact CD2-CD2 3.93Å; I360-L369 HydrophobicContact CD1-CD1 4.4Å; I360-L369 HydrophobicContact CD1-CD2 3.85Å; I360-L369 HydrophobicContact CG1-CD2 4.24Å; I360-L369 HydrophobicContact CG2-CD1 4.37Å; I360-L369 HydrophobicContact CG2-CD2 4.26Å; L365-L369 WeakPolarHBondContact O-CD2 3.27Å; L365-L369 WeakPolarHBondContact O-CG 3.46Å; L369-L373 HydrophobicContact CB-CB 4.21Å; L369-L373 HydrophobicContact CD2-CB 4.38Å; L369-L373 HydrophobicContact CD2-CD1 4.43Å; L369-K374 HydrophobicContact CB-CG 3.84Å; L369-K374 WeakPolarHBondContact O-CD 3.17Å; L369-K374 WeakPolarHBondContact O-CE 3.43Å; L369-K374 WeakPolarHBondContact O-CG 3.46Å; L369-K374 PolarHBondContact O-NZ 3.49Å; L369-L377 HydrophobicContact CD1-CB 4.28Å; L369-L377 HydrophobicContact CD1-CD2 3.81Å
370	P	92.9	Very high	90.2	Very high	16 Å²	16	54.4 Å²	54.4	10%	0.104	28%	0.282	C	S	.	.			trans	-60.4	167.9	166.4	-27.8	37.9	0	0	0	113.7	L332 N336 V368 N372 L373 K374	L332-P370 HydrophobicContact CB-CG 4.14Å; N336-P370 HydrophobicContact CB-CB 3.69Å; N336-P370 HydrophobicContact CB-CG 4.09Å; N336-P370 WeakPolarHBondContact OD1-CB 3.49Å; V368-P370 WeakPolarHBondContact O-CD 3.43Å; P370-N372 PolarHBondContact O-N 2.99Å; P370-L373 PolarHBondContact O-N 2.99Å; P370-K374 PolarHBondContact O-N 3.41Å
371	A	93.2	Very high	90.2	Very high	68 Å²	68	57.7 Å²	57.7	56%	0.562	31%	0.305	S	S	*	.	H	α-helix	trans	-56.8	-49.6	-169.3	0	0	0	0	0	114.8	L373 K374 S375	A371-L373 VanDerWaalsContact C-N 3.33Å; A371-L373 PolarHBondContact O-N 2.95Å; A371-K374 WeakPolarHBondContact O-CB 3.22Å; A371-K374 PolarHBondContact O-N 3.02Å; A371-S375 PolarHBondContact O-N 2.97Å; A371-S375 PolarHBondContact O-OG 3.39Å
372	N	94.1	Very high	90.3	Very high	47 Å²	47	60.6 Å²	60.6	25%	0.251	32%	0.318	S	S	.	.	H	α-helix	trans	-69	-35.7	-178.4	-59	-32.5	0	0	0	111	N336 P370 K374 S375 W376	N336-N372 PolarHBondContact O-ND2 3.39Å; N336-N372 WeakPolarHBondContact OD1-CA 3.43Å; N336-N372 WeakPolarHBondContact OD1-CB 2.82Å; N336-N372 PolarHBondContact OD1-N 3.41Å; P370-N372 PolarHBondContact O-N 2.99Å; N372-K374 VanDerWaalsContact C-N 3.33Å; N372-S375 PolarHBondContact O-N 3.06Å; N372-W376 WeakPolarHBondContact O-CB 3.03Å; N372-W376 PolarHBondContact O-N 2.97Å
373	L	94.2	Very high	90.5	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-69	-30.6	174.1	-64	-173.5	0	0	0	112.2	L332 L335 N336 F341 L356 L369 P370 A371 W376 L377	L332-L373 HydrophobicContact CB-CD1 4.43Å; L332-L373 HydrophobicContact CD2-CD1 3.9Å; L335-L373 HydrophobicContact CB-CD1 4.2Å; N336-L373 HydrophobicContact CB-CD1 4.43Å; N336-L373 HydrophobicContact CB-CG 4.18Å; N336-L373 PolarHBondContact OD1-N 3.43Å; F341-L373 HydrophobicContact CB-CD2 4.11Å; F341-L373 HydrophobicContact CD1-CD2 3.92Å; F341-L373 HydrophobicContact CD2-CD2 4.17Å; F341-L373 HydrophobicContact CE1-CD2 4.41Å; F341-L373 HydrophobicContact CG-CD2 3.79Å; L356-L373 HydrophobicContact CD2-CD2 4.3Å; L369-L373 HydrophobicContact CB-CB 4.21Å; L369-L373 HydrophobicContact CD2-CB 4.38Å; L369-L373 HydrophobicContact CD2-CD1 4.43Å; P370-L373 PolarHBondContact O-N 2.99Å; A371-L373 VanDerWaalsContact C-N 3.33Å; A371-L373 PolarHBondContact O-N 2.95Å; L373-W376 HydrophobicContact CD2-CE3 4.49Å; L373-L377 WeakPolarHBondContact O-CB 3.02Å; L373-L377 PolarHBondContact O-N 3.19Å
374	K	93.5	Very high	90.6	Very high	105 Å²	105	64.8 Å²	64.8	46%	0.457	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-44.3	169.2	-77.2	175.3	168.2	162	0	111.7	L369 P370 A371 N372 L377 Q378	L369-K374 HydrophobicContact CB-CG 3.84Å; L369-K374 WeakPolarHBondContact O-CD 3.17Å; L369-K374 WeakPolarHBondContact O-CE 3.43Å; L369-K374 WeakPolarHBondContact O-CG 3.46Å; L369-K374 PolarHBondContact O-NZ 3.49Å; P370-K374 PolarHBondContact O-N 3.41Å; A371-K374 WeakPolarHBondContact O-CB 3.22Å; A371-K374 PolarHBondContact O-N 3.02Å; N372-K374 VanDerWaalsContact C-N 3.33Å; K374-L377 PolarHBondContact O-N 2.81Å; K374-Q378 WeakPolarHBondContact O-CG 3.37Å; K374-Q378 PolarHBondContact O-N 3.22Å
375	S	93	Very high	90.7	Very high	52 Å²	52	56 Å²	56	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-40.4	175	-61.2	0	0	0	0	112.2	A371 N372 Q378 F379	A371-S375 PolarHBondContact O-N 2.97Å; A371-S375 PolarHBondContact O-OG 3.39Å; N372-S375 PolarHBondContact O-N 3.06Å; S375-Q378 WeakPolarHBondContact O-CB 3.48Å; S375-Q378 PolarHBondContact O-N 3.28Å; S375-F379 PolarHBondContact O-N 3.33Å
376	W	94.8	Very high	90.8	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-43	172.6	163.7	79.6	0	0	0	112.1	F341 D353 L356 F357 I360 N372 L373 Q378 F379 C380	F341-W376 HydrophobicContact CD1-CB 4.21Å; F341-W376 AromaticContact CD1-CD1 3.71Å; F341-W376 HydrophobicContact CD1-CD2 4.33Å; F341-W376 AromaticContact CD1-CG 3.8Å; F341-W376 HydrophobicContact CD1-CG 3.8Å; F341-W376 AromaticContact CE1-CD1 3.77Å; F341-W376 HydrophobicContact CE1-CD2 4.2Å; F341-W376 HydrophobicContact CE1-CG 4.06Å; F341-W376 AromaticContact CE1-NE1 3.69Å; D353-W376 WeakPolarHBondContact O-CZ2 3.46Å; D353-W376 PolarHBondContact OD1-NE1 2.94Å; L356-W376 HydrophobicContact CB-CH2 3.96Å; L356-W376 HydrophobicContact CB-CZ2 3.93Å; L356-W376 HydrophobicContact CD2-CD2 4.47Å; L356-W376 HydrophobicContact CD2-CE3 4.37Å; L356-W376 HydrophobicContact CD2-CH2 3.77Å; L356-W376 HydrophobicContact CD2-CZ2 3.85Å; L356-W376 HydrophobicContact CD2-CZ3 4.06Å; L356-W376 HydrophobicContact CG-CH2 3.63Å; L356-W376 HydrophobicContact CG-CZ2 3.97Å; L356-W376 HydrophobicContact CG-CZ3 4.2Å; F357-W376 HydrophobicContact CB-CH2 3.99Å; F357-W376 HydrophobicContact CB-CZ2 4.32Å; F357-W376 HydrophobicContact CD2-CH2 4.36Å; I360-W376 HydrophobicContact CD1-CE3 4.45Å; I360-W376 HydrophobicContact CD1-CH2 3.8Å; I360-W376 HydrophobicContact CD1-CZ3 3.39Å; N372-W376 WeakPolarHBondContact O-CB 3.03Å; N372-W376 PolarHBondContact O-N 2.97Å; L373-W376 HydrophobicContact CD2-CE3 4.49Å; W376-Q378 VanDerWaalsContact C-N 3.28Å; W376-Q378 PolarHBondContact O-N 3.34Å; W376-F379 WeakPolarHBondContact O-CA 3.47Å; W376-F379 VanDerWaalsContact O-CB 3.28Å; W376-F379 WeakPolarHBondContact O-CB 3.06Å; W376-F379 PolarHBondContact O-N 3.1Å; W376-C380 VanDerWaalsContact CE2-SG 3.56Å; W376-C380 PolarHBondContact O-N 3.26Å
377	L	92.8	Very high	90.7	Very high	41 Å²	41	59.6 Å²	59.6	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-38.6	176.9	-174.5	66.7	0	0	0	111.5	F357 L369 L373 K374 F379 C380 S381	F357-L377 HydrophobicContact CD2-CD1 3.76Å; F357-L377 HydrophobicContact CE2-CD1 3.5Å; F357-L377 VanDerWaalsContact CE2-CD1 3.5Å; L369-L377 HydrophobicContact CD1-CB 4.28Å; L369-L377 HydrophobicContact CD1-CD2 3.81Å; L373-L377 WeakPolarHBondContact O-CB 3.02Å; L373-L377 PolarHBondContact O-N 3.19Å; K374-L377 PolarHBondContact O-N 2.81Å; L377-F379 VanDerWaalsContact C-N 3.33Å; L377-C380 PolarHBondContact O-N 3.39Å; L377-S381 PolarHBondContact O-N 3.24Å
378	Q	91.4	Very high	90.3	Very high	131 Å²	131	53.9 Å²	53.9	61%	0.612	28%	0.279	S	S	*	.	H	α-helix	trans	-63.1	-38.9	172	-71.3	175.9	-8.1	0	0	111.8	K374 S375 W376 S381	K374-Q378 WeakPolarHBondContact O-CG 3.37Å; K374-Q378 PolarHBondContact O-N 3.22Å; S375-Q378 WeakPolarHBondContact O-CB 3.48Å; S375-Q378 PolarHBondContact O-N 3.28Å; W376-Q378 VanDerWaalsContact C-N 3.28Å; W376-Q378 PolarHBondContact O-N 3.34Å; Q378-S381 WeakPolarHBondContact CA-OG 3.5Å; Q378-S381 PolarHBondContact O-N 3.22Å; Q378-S381 PolarHBondContact O-OG 2.84Å
379	F	92.2	Very high	89.3	Confident	14 Å²	14	53.7 Å²	53.7	6%	0.061	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-48	172	164.3	-97	0	0	0	111.9	F344 R346 P349 S375 W376 L377 S381 K382	F344-F379 HydrophobicContact CD2-CB 4.15Å; F344-F379 HydrophobicContact CD2-CD2 4.19Å; F344-F379 HydrophobicContact CD2-CG 4.06Å; F344-F379 HydrophobicContact CE2-CB 3.66Å; F344-F379 HydrophobicContact CE2-CD2 4.29Å; F344-F379 HydrophobicContact CE2-CG 4.07Å; F344-F379 HydrophobicContact CZ-CB 4.31Å; R346-F379 HydrophobicContact CG-CE1 4.36Å; R346-F379 HydrophobicContact CG-CZ 3.94Å; P349-F379 HydrophobicContact CB-CE1 4.09Å; P349-F379 HydrophobicContact CG-CE1 3.8Å; P349-F379 HydrophobicContact CG-CZ 4Å; S375-F379 PolarHBondContact O-N 3.33Å; W376-F379 WeakPolarHBondContact O-CA 3.47Å; W376-F379 VanDerWaalsContact O-CB 3.28Å; W376-F379 WeakPolarHBondContact O-CB 3.06Å; W376-F379 PolarHBondContact O-N 3.1Å; L377-F379 VanDerWaalsContact C-N 3.33Å; F379-S381 VanDerWaalsContact C-N 3.3Å; F379-S381 PolarHBondContact O-N 2.88Å; F379-K382 WeakPolarHBondContact O-CB 3.33Å; F379-K382 WeakPolarHBondContact O-CG 3.24Å; F379-K382 PolarHBondContact O-N 3.17Å
380	C	92.2	Very high	87.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-40.1	176	-68.9	0	0	0	0	112.3	F357 W376 L377 K382 W383 F386	F357-C380 HydrophobicContact CD2-CB 4.19Å; F357-C380 HydrophobicContact CE2-CB 4.36Å; W376-C380 VanDerWaalsContact CE2-SG 3.56Å; W376-C380 PolarHBondContact O-N 3.26Å; L377-C380 PolarHBondContact O-N 3.39Å; C380-K382 PolarHBondContact O-N 3.06Å; C380-K382 VanDerWaalsContact O-N 3.08Å; C380-W383 PolarHBondContact O-N 3.36Å; C380-F386 HydrophobicContact CB-CD1 4.1Å; C380-F386 HydrophobicContact CB-CD2 4.02Å; C380-F386 HydrophobicContact CB-CE1 4.11Å; C380-F386 HydrophobicContact CB-CE2 4.04Å; C380-F386 HydrophobicContact CB-CG 4.03Å; C380-F386 HydrophobicContact CB-CZ 4.08Å; C380-F386 VanDerWaalsContact O-CD2 3.23Å; C380-F386 WeakPolarHBondContact O-CD2 3.17Å
381	S	88.8	Confident	85.1	Confident	70 Å²	70	63.7 Å²	63.7	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-14.4	-179.5	70.9	0	0	0	0	115.3	L377 Q378 F379 W383	L377-S381 PolarHBondContact O-N 3.24Å; Q378-S381 WeakPolarHBondContact CA-OG 3.5Å; Q378-S381 PolarHBondContact O-N 3.22Å; Q378-S381 PolarHBondContact O-OG 2.84Å; F379-S381 VanDerWaalsContact C-N 3.3Å; F379-S381 PolarHBondContact O-N 2.88Å; S381-W383 PolarHBondContact O-N 3.41Å
382	K	89.6	Confident	84.7	Confident	162 Å²	162	63.5 Å²	63.5	70%	0.704	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.7	173.9	-62.3	177.9	-177.4	179.9	0	112.4	F379 C380	F379-K382 WeakPolarHBondContact O-CB 3.33Å; F379-K382 WeakPolarHBondContact O-CG 3.24Å; F379-K382 PolarHBondContact O-N 3.17Å; C380-K382 PolarHBondContact O-N 3.06Å; C380-K382 VanDerWaalsContact O-N 3.08Å
383	W	89.7	Confident	84.2	Confident	52 Å²	52	64.3 Å²	64.3	20%	0.197	33%	0.327	C	S	.	.	S	Bend	trans	-101.5	125.3	-174	-61.3	90.2	0	0	0	110.5	N204 E347 L348 P349 C380 S381 S385 F386	N204-W383 WeakPolarHBondContact ND2-CZ3 3.26Å; N204-W383 WeakPolarHBondContact OD1-CH2 3.25Å; N204-W383 WeakPolarHBondContact OD1-CZ3 3.46Å; E347-W383 WeakPolarHBondContact O-CZ2 3.36Å; L348-W383 HydrophobicContact CD1-CE3 4.29Å; L348-W383 HydrophobicContact CD1-CH2 3.53Å; L348-W383 HydrophobicContact CD1-CZ2 4.01Å; L348-W383 HydrophobicContact CD1-CZ3 3.72Å; P349-W383 VanDerWaalsContact CD-CE2 3.42Å; P349-W383 HydrophobicContact CG-CD2 4.1Å; P349-W383 HydrophobicContact CG-CG 3.85Å; C380-W383 PolarHBondContact O-N 3.36Å; S381-W383 PolarHBondContact O-N 3.41Å; W383-S385 PolarHBondContact O-N 3.37Å; W383-S385 VanDerWaalsContact O-N 3.09Å; W383-F386 HydrophobicContact CB-CD2 3.88Å; W383-F386 HydrophobicContact CB-CE2 4.29Å; W383-F386 PolarHBondContact O-N 2.88Å
384	K	86.9	Confident	83.7	Confident	177 Å²	177	67.9 Å²	67.9	77%	0.77	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-54.4	-31.8	178.6	-67.3	-177.4	-178.7	177.7	0	112.5	F386 N387	K384-F386 VanDerWaalsContact C-N 3.31Å; K384-F386 PolarHBondContact O-N 3.01Å; K384-N387 WeakPolarHBondContact O-CB 3.44Å; K384-N387 PolarHBondContact O-N 3.24Å
385	S	87.4	Confident	83.1	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-53.6	-42.1	179.2	-42.9	0	0	0	0	113.4	L196 H199 I200 W383 N387 L388	L196-S385 WeakPolarHBondContact CD2-O 3.49Å; H199-S385 WeakPolarHBondContact ND1-CA 3.34Å; H199-S385 VanDerWaalsContact ND1-CB 3.32Å; H199-S385 WeakPolarHBondContact ND1-CB 3.27Å; H199-S385 PolarHBondContact ND1-OG 2.82Å; I200-S385 VanDerWaalsContact CG1-CB 3.44Å; I200-S385 VanDerWaalsContact CG1-OG 3.23Å; I200-S385 WeakPolarHBondContact CG1-OG 3.08Å; W383-S385 PolarHBondContact O-N 3.37Å; W383-S385 VanDerWaalsContact O-N 3.09Å; S385-N387 PolarHBondContact O-N 3.4Å; S385-L388 VanDerWaalsContact O-CB 3.26Å; S385-L388 WeakPolarHBondContact O-CB 3.33Å; S385-L388 WeakPolarHBondContact O-CG 3.43Å; S385-L388 PolarHBondContact O-N 2.69Å
386	F	88.6	Confident	82.5	Confident	5 Å²	5	66.6 Å²	66.6	2%	0.022	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-71.7	-13.3	-178.1	-72.3	-86.7	0	0	0	113.3	L196 I200 P349 D353 F357 C380 W383 K384 L388	L196-F386 HydrophobicContact CD1-CD1 4.49Å; I200-F386 HydrophobicContact CD1-CD2 4.37Å; I200-F386 HydrophobicContact CD1-CE2 3.52Å; I200-F386 HydrophobicContact CD1-CZ 3.88Å; P349-F386 HydrophobicContact CB-CE2 3.95Å; P349-F386 HydrophobicContact CB-CZ 4.02Å; P349-F386 HydrophobicContact CG-CE2 3.84Å; P349-F386 HydrophobicContact CG-CZ 4.41Å; D353-F386 HydrophobicContact CB-CZ 4.42Å; F357-F386 HydrophobicContact CB-CD1 3.88Å; F357-F386 HydrophobicContact CB-CE1 3.58Å; F357-F386 AromaticContact CD1-CD1 3.6Å; F357-F386 HydrophobicContact CD1-CD1 3.6Å; F357-F386 HydrophobicContact CD1-CE1 4.18Å; F357-F386 AromaticContact CD2-CD1 3.37Å; F357-F386 HydrophobicContact CD2-CD1 3.37Å; F357-F386 AromaticContact CD2-CE1 3.8Å; F357-F386 HydrophobicContact CD2-CE1 3.8Å; F357-F386 HydrophobicContact CD2-CG 4.3Å; F357-F386 HydrophobicContact CE1-CB 4.31Å; F357-F386 AromaticContact CE1-CD1 3.85Å; F357-F386 HydrophobicContact CE1-CD1 3.85Å; F357-F386 HydrophobicContact CE2-CB 4.07Å; F357-F386 AromaticContact CE2-CD1 3.63Å; F357-F386 HydrophobicContact CE2-CD1 3.63Å; F357-F386 HydrophobicContact CE2-CE1 4.48Å; F357-F386 HydrophobicContact CE2-CG 4.17Å; F357-F386 AromaticContact CG-CD1 3.34Å; F357-F386 HydrophobicContact CG-CD1 3.34Å; F357-F386 AromaticContact CG-CE1 3.61Å; F357-F386 HydrophobicContact CG-CE1 3.61Å; F357-F386 HydrophobicContact CZ-CB 3.87Å; F357-F386 AromaticContact CZ-CD1 3.85Å; F357-F386 HydrophobicContact CZ-CD1 3.85Å; F357-F386 HydrophobicContact CZ-CG 4.31Å; C380-F386 HydrophobicContact CB-CD1 4.1Å; C380-F386 HydrophobicContact CB-CD2 4.02Å; C380-F386 HydrophobicContact CB-CE1 4.11Å; C380-F386 HydrophobicContact CB-CE2 4.04Å; C380-F386 HydrophobicContact CB-CG 4.03Å; C380-F386 HydrophobicContact CB-CZ 4.08Å; C380-F386 VanDerWaalsContact O-CD2 3.23Å; C380-F386 WeakPolarHBondContact O-CD2 3.17Å; W383-F386 HydrophobicContact CB-CD2 3.88Å; W383-F386 HydrophobicContact CB-CE2 4.29Å; W383-F386 PolarHBondContact O-N 2.88Å; K384-F386 VanDerWaalsContact C-N 3.31Å; K384-F386 PolarHBondContact O-N 3.01Å; F386-L388 VanDerWaalsContact C-N 3.31Å
387	N	83.8	Confident	81.6	Confident	106 Å²	106	71 Å²	71	57%	0.567	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-88.7	4.8	172.7	-61	-33	0	0	0	112.8	K384 S385 P390	K384-N387 WeakPolarHBondContact O-CB 3.44Å; K384-N387 PolarHBondContact O-N 3.24Å; S385-N387 PolarHBondContact O-N 3.4Å; N387-P390 WeakPolarHBondContact O-CD 3.28Å
388	L	77.8	Confident	80.8	Confident	30 Å²	30	73.1 Å²	73.1	16%	0.157	37%	0.369	C	S	.	.	S	Bend	trans	-84	-23.9	174.7	-63.7	175.3	0	0	0	113.2	H199 I231 S385 F386 P390 L391	H199-L388 HydrophobicContact CB-CD1 3.98Å; H199-L388 VanDerWaalsContact CD2-CD1 3.44Å; H199-L388 WeakPolarHBondContact CD2-CD1 3.24Å; I231-L388 HydrophobicContact CD1-CD2 4.45Å; S385-L388 VanDerWaalsContact O-CB 3.26Å; S385-L388 WeakPolarHBondContact O-CB 3.33Å; S385-L388 WeakPolarHBondContact O-CG 3.43Å; S385-L388 PolarHBondContact O-N 2.69Å; F386-L388 VanDerWaalsContact C-N 3.31Å; L388-P390 VanDerWaalsContact C-N 3.33Å; L388-P390 WeakPolarHBondContact O-CD 3.4Å; L388-L391 HydrophobicContact CB-CD1 4.41Å; L388-L391 HydrophobicContact CD2-CD1 4.01Å; L388-L391 WeakPolarHBondContact O-CB 3.16Å; L388-L391 WeakPolarHBondContact O-CD1 3.38Å; L388-L391 VanDerWaalsContact O-CG 3.27Å; L388-L391 WeakPolarHBondContact O-CG 3.42Å; L388-L391 PolarHBondContact O-N 2.89Å; L388-L391 VanDerWaalsContact O-N 3.08Å
389	L	66.4	Low	80	Confident	47 Å²	47	68.7 Å²	68.7	25%	0.246	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.5	178.6	-76.1	172.7	0	0	0	117.7	L192 L196 F357 V358 L391	L192-L389 HydrophobicContact CB-CD2 3.96Å; L192-L389 HydrophobicContact CD1-CD2 3.99Å; L192-L389 HydrophobicContact CD2-CD2 4.14Å; L192-L389 HydrophobicContact CG-CD2 4.25Å; L196-L389 HydrophobicContact CD1-CD1 3.38Å; L196-L389 HydrophobicContact CD1-CD2 4.2Å; L196-L389 HydrophobicContact CD1-CG 3.86Å; L196-L389 HydrophobicContact CD2-CD1 4.12Å; L196-L389 HydrophobicContact CD2-CD2 4.39Å; L196-L389 HydrophobicContact CD2-CG 3.79Å; L196-L389 HydrophobicContact CG-CD1 4.16Å; L196-L389 HydrophobicContact CG-CD2 4.31Å; L196-L389 HydrophobicContact CG-CG 4.09Å; F357-L389 HydrophobicContact CD1-CD1 3.36Å; F357-L389 HydrophobicContact CE1-CD1 3.32Å; V358-L389 HydrophobicContact CG2-CD1 4.06Å; V358-L389 HydrophobicContact CG2-CD2 4.44Å; L389-L391 PolarHBondContact O-N 2.7Å
390	P	53.6	Low	79	Confident	110 Å²	110	73.3 Å²	73.3	71%	0.714	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.5	165.7	-14.4	29.7	0	0	0	114.2	N387 L388	N387-P390 WeakPolarHBondContact O-CD 3.28Å; L388-P390 VanDerWaalsContact C-N 3.33Å; L388-P390 WeakPolarHBondContact O-CD 3.4Å
391	L	43.3	Very low	77.8	Confident	119 Å²	119	79.9 Å²	79.9	62%	0.623	41%	0.409	S	S	*	.			trans	-87.1	0	-175.7	-65.3	169.5	0	0	0	113.8	S224 L388 L389	S224-L391 WeakPolarHBondContact CB-OXT 3.23Å; S224-L391 PolarHBondContact OG-OXT 2.79Å; L388-L391 HydrophobicContact CB-CD1 4.41Å; L388-L391 HydrophobicContact CD2-CD1 4.01Å; L388-L391 WeakPolarHBondContact O-CB 3.16Å; L388-L391 WeakPolarHBondContact O-CD1 3.38Å; L388-L391 VanDerWaalsContact O-CG 3.27Å; L388-L391 WeakPolarHBondContact O-CG 3.42Å; L388-L391 PolarHBondContact O-N 2.89Å; L388-L391 VanDerWaalsContact O-N 3.08Å; L389-L391 PolarHBondContact O-N 2.7Å

Retrieved 391 of 391 residues in 464.7 ms (Link to these results)

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