A0A077Z8F8_TRITR Loading...

Innexin

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A077Z8F8, Species TRITR (Trichuris trichiura, Whipworm), Gene inx, Length 537 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	30.1	Very low	31.7	Very low	244 Å²	244	153.9 Å²	153.9	100%	1.202	81%	0.813	S	S	*	*				0	69.9	0	-112.9	-168.3	-75.7	0	0	110
2	I	33.3	Very low	32.2	Very low	146 Å²	146	153 Å²	153	75%	0.749	82%	0.817	S	S	*	*			trans	-130.6	98.4	161.2	-63.8	176.5	0	0	0	103.3	I4	I2-I4 HydrophobicContact CG2-CD1 4.48Å; I2-I4 HydrophobicContact CG2-CG1 3.93Å; I2-I4 PolarHBondContact O-N 3.07Å
3	E	27.1	Very low	32.3	Very low	149 Å²	149	147.2 Å²	147.2	70%	0.696	82%	0.816	S	S	*	*			trans	-68.3	118.5	166.1	-80.9	-171.2	132.3	0	0	107.5	Y5	E3-Y5 HydrophobicContact CB-CD2 4.19Å; E3-Y5 HydrophobicContact CB-CE2 4.13Å; E3-Y5 HydrophobicContact CG-CE2 4.24Å; E3-Y5 WeakPolarHBondContact OE1-CE2 3.21Å; E3-Y5 PolarHBondContact OE1-OH 3.06Å; E3-Y5 WeakPolarHBondContact OE2-CE2 3.39Å
4	I	35	Very low	32.3	Very low	131 Å²	131	142.3 Å²	142.3	67%	0.672	82%	0.815	S	S	*	*			trans	-105.6	94.7	164.1	-57.4	-179.8	0	0	0	105.7	I2 F6	I2-I4 HydrophobicContact CG2-CD1 4.48Å; I2-I4 HydrophobicContact CG2-CG1 3.93Å; I2-I4 PolarHBondContact O-N 3.07Å; I4-F6 HydrophobicContact CG2-CD2 3.91Å; I4-F6 HydrophobicContact CG2-CE2 3.86Å; I4-F6 PolarHBondContact O-N 2.69Å
5	Y	30.4	Very low	32.4	Very low	183 Å²	183	140.3 Å²	140.3	72%	0.718	81%	0.813	S	S	*	*			trans	-72.7	112.7	165.3	-81.1	-84.4	0	0	0	108.8	E3	E3-Y5 HydrophobicContact CB-CD2 4.19Å; E3-Y5 HydrophobicContact CB-CE2 4.13Å; E3-Y5 HydrophobicContact CG-CE2 4.24Å; E3-Y5 WeakPolarHBondContact OE1-CE2 3.21Å; E3-Y5 PolarHBondContact OE1-OH 3.06Å; E3-Y5 WeakPolarHBondContact OE2-CE2 3.39Å
6	F	28.2	Very low	32.5	Very low	198 Å²	198	138.2 Å²	138.2	87%	0.868	80%	0.803	S	S	*	*			trans	-86.4	105.8	157.6	-90.3	-87.8	0	0	0	108	I4	I4-F6 HydrophobicContact CG2-CD2 3.91Å; I4-F6 HydrophobicContact CG2-CE2 3.86Å; I4-F6 PolarHBondContact O-N 2.69Å
7	A	31.7	Very low	32.4	Very low	99 Å²	99	145.2 Å²	145.2	82%	0.818	81%	0.813	S	S	*	*			trans	-106.1	111.2	164.8	0	0	0	0	0	108.6
8	A	33	Very low	32.6	Very low	109 Å²	109	144.7 Å²	144.7	90%	0.901	81%	0.808	S	S	*	*			trans	-87.1	139.6	164.1	0	0	0	0	0	108.8
9	G	33.1	Very low	33	Very low	70 Å²	70	143.2 Å²	143.2	72%	0.722	81%	0.806	S	S	*	*			trans	147.2	98.1	163.3	0	0	0	0	0	116.2
10	D	33.3	Very low	33.3	Very low	141 Å²	141	143.2 Å²	143.2	75%	0.754	81%	0.808	S	S	*	*			trans	66.6	114	141.5	-72.3	-38.6	0	0	0	123.6
11	R	33.1	Very low	33.7	Very low	223 Å²	223	142.1 Å²	142.1	84%	0.842	81%	0.805	S	S	*	*			trans	35.1	126	131.3	-53	-175.4	-159.6	-159.6	1.4	119.5
12	V	37.7	Very low	34.4	Very low	143 Å²	143	136.1 Å²	136.1	87%	0.867	78%	0.784	S	S	*	*				144.4	117.6	117.3	172.8	0	0	0	0	110
13	G	33.9	Very low	34.6	Very low	78 Å²	78	133.4 Å²	133.4	80%	0.804	78%	0.783	S	S	*	*			trans	93.2	125	141.1	0	0	0	0	0	118.2
14	G	32.6	Very low	35.1	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	79%	0.789	S	S	*	*			trans	117.6	87.7	148.5	0	0	0	0	0	116.1
15	S	33.4	Very low	35.4	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	80%	0.798	S	S	*	*			trans	-35.7	143.1	160.2	51.3	0	0	0	0	116.1
16	V	33.7	Very low	35.7	Very low	107 Å²	107	129.7 Å²	129.7	65%	0.648	80%	0.798	S	S	*	*				164.8	106.5	111.2	170	0	0	0	0	107.6
17	W	31.8	Very low	35.8	Very low	257 Å²	257	128.4 Å²	128.4	97%	0.973	80%	0.795	S	S	*	*			trans	-138.1	109.8	156.3	-77.4	97.4	0	0	0	107.8
18	N	34.6	Very low	36.2	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	80%	0.796	S	S	*	*			trans	-68	142.3	170.8	-75.9	-31.6	0	0	0	109.6	V20	N18-V20 PolarHBondContact O-N 2.63Å
19	P	40.7	Very low	36.2	Very low	117 Å²	117	135.7 Å²	135.7	76%	0.76	79%	0.793	S	S	*	*			trans	-74.2	122	171.4	17.3	-8.3	0	0	0	109.7	V21	P19-V21 PolarHBondContact O-N 3.14Å
20	V	39	Very low	36.5	Very low	142 Å²	142	137.2 Å²	137.2	86%	0.861	80%	0.798	S	S	*	*			trans	-69	112	169.3	175.4	0	0	0	0	108.4	N18	N18-V20 PolarHBondContact O-N 2.63Å
21	V	41.2	Very low	36.7	Very low	121 Å²	121	134.7 Å²	134.7	73%	0.733	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.7	132.5	169.1	178.4	0	0	0	0	108.2	P19 A23	P19-V21 PolarHBondContact O-N 3.14Å; V21-A23 PolarHBondContact O-N 3Å
22	P	46	Very low	36.9	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.4	129.7	172.2	15.5	-8.3	0	0	0	110.3
23	A	37.9	Very low	36.8	Very low	88 Å²	88	129.8 Å²	129.8	73%	0.727	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-61.1	147.5	-177.4	0	0	0	0	0	113.3	V21	V21-A23 PolarHBondContact O-N 3Å
24	P	37.1	Very low	36.8	Very low	124 Å²	124	129.5 Å²	129.5	81%	0.805	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-76.3	127.9	176.7	30.7	-31.2	0	0	0	110.6	T26	P24-T26 PolarHBondContact O-N 3.21Å
25	V	40.6	Very low	37.2	Very low	142 Å²	142	134.9 Å²	134.9	86%	0.861	80%	0.803	S	S	*	*			trans	-72.3	114	171.9	178.1	0	0	0	0	108.7	Q27	V25-Q27 PolarHBondContact O-N 2.83Å
26	T	36.5	Very low	37.5	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	80%	0.798	S	S	*	*			trans	-57	123.3	173.7	36.6	0	0	0	0	112.1	P24	P24-T26 PolarHBondContact O-N 3.21Å
27	Q	31.9	Very low	37.5	Very low	171 Å²	171	138.5 Å²	138.5	80%	0.799	81%	0.814	S	S	*	*			trans	-76	116.2	169.6	-75.2	177.7	-24.8	0	0	110.3	V25	V25-Q27 PolarHBondContact O-N 2.83Å
28	H	38.9	Very low	37.8	Very low	184 Å²	184	129.5 Å²	129.5	85%	0.852	80%	0.802	S	S	*	*			trans	-87.8	112.9	159.1	-92.9	-80.1	0	0	0	109.1
29	H	33.9	Very low	38.1	Very low	177 Å²	177	127 Å²	127	82%	0.819	81%	0.808	S	S	*	*			trans	-65.3	124.2	169.3	-77.6	-94.3	0	0	0	110.5
30	A	37.8	Very low	38.5	Very low	102 Å²	102	131 Å²	131	84%	0.843	81%	0.808	S	S	*	*			trans	-140	124.9	153.3	0	0	0	0	0	108.1
31	A	37.5	Very low	38.8	Very low	88 Å²	88	127 Å²	127	73%	0.727	80%	0.796	S	S	*	*			trans	-76.2	158.6	-167.5	0	0	0	0	0	113.9
32	L	38.5	Very low	39.1	Very low	179 Å²	179	124.8 Å²	124.8	94%	0.937	79%	0.79	S	S	*	*			trans	119.6	119.6	145.9	-65.1	156.1	0	0	0	115.5
33	G	35.1	Very low	39.5	Very low	84 Å²	84	121.4 Å²	121.4	87%	0.866	78%	0.776	S	S	*	*			trans	119.8	100.4	155.8	0	0	0	0	0	114.9
34	G	34.5	Very low	40.3	Very low	73 Å²	73	124.4 Å²	124.4	75%	0.753	77%	0.77	S	S	*	*			trans	-83.3	156.4	-175.5	0	0	0	0	0	116.1
35	H	41.7	Very low	41.3	Very low	191 Å²	191	124.7 Å²	124.7	88%	0.884	76%	0.76	S	S	*	*			trans	171.9	161	137.5	-110.1	-92.1	0	0	0	108.9
36	P	39.5	Very low	42.1	Very low	106 Å²	106	122.8 Å²	122.8	69%	0.688	75%	0.745	S	S	*	*				-104.4	157.8	-129.8	20.2	2.2	0	0	0	114.3
37	L	33.7	Very low	43.4	Very low	188 Å²	188	123.9 Å²	123.9	98%	0.984	74%	0.742	S	S	*	*			trans	-9.1	116.3	159.3	-66.7	156.9	0	0	0	116.5
38	G	38	Very low	45	Very low	69 Å²	69	119 Å²	119	71%	0.711	73%	0.726	S	S	*	*			trans	-155.4	90.1	174.9	0	0	0	0	0	114.5	R40	G38-R40 PolarHBondContact O-N 2.94Å
39	G	40.2	Very low	46.1	Very low	82 Å²	82	113.4 Å²	113.4	85%	0.845	70%	0.702	S	S	*	*			trans	64.4	1.7	132.4	0	0	0	0	0	123
40	R	48.1	Very low	47.6	Very low	202 Å²	202	111.5 Å²	111.5	76%	0.762	69%	0.691	S	S	*	*			trans	-86.3	-8.4	-171.3	-132.1	171	-177.8	166.2	-0.5	116.5	G38 Y44	G38-R40 PolarHBondContact O-N 2.94Å; R40-Y44 HydrophobicContact CG-CE2 4.42Å; R40-Y44 WeakPolarHBondContact O-CD2 3.31Å; R40-Y44 WeakPolarHBondContact O-CE2 3.45Å
41	G	46.9	Very low	49.1	Very low	59 Å²	59	109.8 Å²	109.8	61%	0.608	67%	0.673	S	S	*	*	H	α-helix	trans	-83.8	-23.8	-176.1	0	0	0	0	0	116.1
42	A	47.2	Very low	50.8	Low	73 Å²	73	111.2 Å²	111.2	60%	0.603	67%	0.666	S	S	*	*	H	α-helix	trans	-73.8	-31.9	-174.6	0	0	0	0	0	113.1	L46	A42-L46 WeakPolarHBondContact O-CB 3.46Å; A42-L46 PolarHBondContact O-N 2.88Å; A42-L46 VanDerWaalsContact O-N 3.1Å
43	G	53.9	Low	52.5	Low	48 Å²	48	108.3 Å²	108.3	50%	0.495	65%	0.648	S	S	.	*	H	α-helix	trans	-67	-43	-178.6	0	0	0	0	0	113.6	L46 Q47	G43-L46 PolarHBondContact O-N 3.42Å; G43-Q47 WeakPolarHBondContact O-CB 3.49Å; G43-Q47 PolarHBondContact O-N 2.92Å
44	Y	54.6	Low	54.4	Low	152 Å²	152	111 Å²	111	60%	0.596	64%	0.636	S	S	*	*	H	α-helix	trans	-68	-37.7	179.1	-60	-77.9	0	0	0	112.1	R40 S48	R40-Y44 HydrophobicContact CG-CE2 4.42Å; R40-Y44 WeakPolarHBondContact O-CD2 3.31Å; R40-Y44 WeakPolarHBondContact O-CE2 3.45Å; Y44-S48 WeakPolarHBondContact O-CB 3.27Å; Y44-S48 PolarHBondContact O-N 3.19Å
45	H	58.5	Low	56.2	Low	130 Å²	130	111.7 Å²	111.7	60%	0.602	62%	0.622	S	S	*	*	H	α-helix	trans	-67.9	-41.3	177.4	-160.4	-88.7	0	0	0	111.5	S48 I49	H45-S48 PolarHBondContact O-N 2.87Å; H45-I49 VanDerWaalsContact CE1-CD1 3.46Å; H45-I49 WeakPolarHBondContact CE1-CD1 3.47Å; H45-I49 WeakPolarHBondContact ND1-CD1 3.48Å; H45-I49 WeakPolarHBondContact O-CB 3.48Å; H45-I49 VanDerWaalsContact O-CG1 3.26Å; H45-I49 WeakPolarHBondContact O-CG1 3.46Å; H45-I49 PolarHBondContact O-N 3.08Å
46	L	57.1	Low	57.9	Low	102 Å²	102	106.3 Å²	106.3	53%	0.534	60%	0.602	S	S	.	*	H	α-helix	trans	-64.8	-44.8	176.4	-141.1	82.4	0	0	0	111.4	A42 G43 S48 I49 F50	A42-L46 WeakPolarHBondContact O-CB 3.46Å; A42-L46 PolarHBondContact O-N 2.88Å; A42-L46 VanDerWaalsContact O-N 3.1Å; G43-L46 PolarHBondContact O-N 3.42Å; L46-S48 VanDerWaalsContact C-N 3.34Å; L46-S48 PolarHBondContact O-N 3.25Å; L46-I49 PolarHBondContact O-N 3.47Å; L46-F50 HydrophobicContact CD2-CD2 4.35Å; L46-F50 HydrophobicContact CD2-CE2 3.68Å; L46-F50 HydrophobicContact CG-CD2 4.09Å; L46-F50 HydrophobicContact CG-CE2 3.73Å; L46-F50 WeakPolarHBondContact O-CD2 3.47Å; L46-F50 PolarHBondContact O-N 3.44Å
47	Q	64	Low	59.6	Low	142 Å²	142	104.9 Å²	104.9	66%	0.664	60%	0.595	S	S	*	*	H	α-helix	trans	-63.6	-39.5	178.7	-170.1	173.3	3.7	0	0	112.1	G43 S51	G43-Q47 WeakPolarHBondContact O-CB 3.49Å; G43-Q47 PolarHBondContact O-N 2.92Å; Q47-S51 WeakPolarHBondContact O-CB 3.47Å; Q47-S51 PolarHBondContact O-N 3.19Å
48	S	64.8	Low	61.5	Low	67 Å²	67	98.3 Å²	98.3	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-64.8	-44.2	174.3	-175.7	0	0	0	0	112	Y44 H45 L46 S51 M52	Y44-S48 WeakPolarHBondContact O-CB 3.27Å; Y44-S48 PolarHBondContact O-N 3.19Å; H45-S48 PolarHBondContact O-N 2.87Å; L46-S48 VanDerWaalsContact C-N 3.34Å; L46-S48 PolarHBondContact O-N 3.25Å; S48-S51 PolarHBondContact O-N 3.19Å; S48-M52 WeakPolarHBondContact O-CG 3.36Å; S48-M52 PolarHBondContact O-N 3.38Å
49	I	62.6	Low	63.3	Low	67 Å²	67	100.3 Å²	100.3	34%	0.344	56%	0.556	S	S	.	*	H	α-helix	trans	-60.8	-47.3	175.7	-73.3	170.3	0	0	0	111.3	H45 L46 S51 M52 H53	H45-I49 VanDerWaalsContact CE1-CD1 3.46Å; H45-I49 WeakPolarHBondContact CE1-CD1 3.47Å; H45-I49 WeakPolarHBondContact ND1-CD1 3.48Å; H45-I49 WeakPolarHBondContact O-CB 3.48Å; H45-I49 VanDerWaalsContact O-CG1 3.26Å; H45-I49 WeakPolarHBondContact O-CG1 3.46Å; H45-I49 PolarHBondContact O-N 3.08Å; L46-I49 PolarHBondContact O-N 3.47Å; I49-S51 VanDerWaalsContact C-N 3.33Å; I49-S51 PolarHBondContact O-N 2.97Å; I49-M52 PolarHBondContact O-N 3.45Å; I49-H53 VanDerWaalsContact CG2-CD2 3.46Å; I49-H53 WeakPolarHBondContact CG2-CD2 3.43Å; I49-H53 PolarHBondContact O-CD2 2.88Å; I49-H53 VanDerWaalsContact O-CD2 3.25Å; I49-H53 PolarHBondContact O-N 3.26Å
50	F	66.1	Low	65	Low	138 Å²	138	104 Å²	104	61%	0.605	55%	0.549	S	S	*	.	H	α-helix	trans	-61.7	-41.7	178.3	-84.1	-66.7	0	0	0	112	L46 H53 F54	L46-F50 HydrophobicContact CD2-CD2 4.35Å; L46-F50 HydrophobicContact CD2-CE2 3.68Å; L46-F50 HydrophobicContact CG-CD2 4.09Å; L46-F50 HydrophobicContact CG-CE2 3.73Å; L46-F50 WeakPolarHBondContact O-CD2 3.47Å; L46-F50 PolarHBondContact O-N 3.44Å; F50-H53 PolarHBondContact O-N 3.45Å; F50-F54 WeakPolarHBondContact O-CB 3.43Å; F50-F54 PolarHBondContact O-N 2.84Å
51	S	69	Low	66.4	Low	65 Å²	65	95.9 Å²	95.9	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.6	-176.1	0	0	0	0	111.7	Q47 S48 I49 F54 L55	Q47-S51 WeakPolarHBondContact O-CB 3.47Å; Q47-S51 PolarHBondContact O-N 3.19Å; S48-S51 PolarHBondContact O-N 3.19Å; I49-S51 VanDerWaalsContact C-N 3.33Å; I49-S51 PolarHBondContact O-N 2.97Å; S51-F54 PolarHBondContact O-N 3.04Å; S51-L55 WeakPolarHBondContact O-CB 3.22Å; S51-L55 VanDerWaalsContact O-CG 3.3Å; S51-L55 WeakPolarHBondContact O-CG 3.36Å; S51-L55 PolarHBondContact O-N 3.43Å
52	M	71.8	Confident	67.9	Low	118 Å²	118	93.8 Å²	93.8	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-65.9	-41.1	177.4	-72.3	-68.4	-177.9	0	0	112.6	S48 I49 F54 L55 T56	S48-M52 WeakPolarHBondContact O-CG 3.36Å; S48-M52 PolarHBondContact O-N 3.38Å; I49-M52 PolarHBondContact O-N 3.45Å; M52-F54 VanDerWaalsContact C-N 3.35Å; M52-L55 PolarHBondContact O-N 3.16Å; M52-T56 WeakPolarHBondContact O-CB 3.37Å; M52-T56 VanDerWaalsContact O-CG2 3.32Å; M52-T56 WeakPolarHBondContact O-CG2 3.37Å; M52-T56 PolarHBondContact O-N 3.45Å; M52-T56 PolarHBondContact O-OG1 2.97Å
53	H	74.6	Confident	69.7	Low	119 Å²	119	95.8 Å²	95.8	55%	0.551	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-38	174.7	-82.6	-64	0	0	0	112.6	I49 F50 T56 S57	I49-H53 VanDerWaalsContact CG2-CD2 3.46Å; I49-H53 WeakPolarHBondContact CG2-CD2 3.43Å; I49-H53 PolarHBondContact O-CD2 2.88Å; I49-H53 VanDerWaalsContact O-CD2 3.25Å; I49-H53 PolarHBondContact O-N 3.26Å; F50-H53 PolarHBondContact O-N 3.45Å; H53-T56 WeakPolarHBondContact CA-OG1 3.43Å; H53-T56 PolarHBondContact O-OG1 3.28Å; H53-S57 VanDerWaalsContact O-CB 3.25Å; H53-S57 WeakPolarHBondContact O-CB 3.48Å; H53-S57 PolarHBondContact O-N 3.4Å; H53-S57 PolarHBondContact O-OG 3.04Å
54	F	74.5	Confident	71.4	Confident	141 Å²	141	96.1 Å²	96.1	62%	0.618	49%	0.488	S	S	*	.	H	α-helix	trans	-65.1	-48.9	175.5	-179.5	-100.8	0	0	0	111	F50 S51 M52 T56 S57 V58	F50-F54 WeakPolarHBondContact O-CB 3.43Å; F50-F54 PolarHBondContact O-N 2.84Å; S51-F54 PolarHBondContact O-N 3.04Å; M52-F54 VanDerWaalsContact C-N 3.35Å; F54-T56 PolarHBondContact O-N 3.33Å; F54-S57 PolarHBondContact O-N 2.89Å; F54-V58 HydrophobicContact CD1-CG2 4.14Å; F54-V58 HydrophobicContact CD2-CG2 4.43Å; F54-V58 HydrophobicContact CE1-CG2 3.75Å; F54-V58 HydrophobicContact CE2-CG2 4.07Å; F54-V58 HydrophobicContact CG-CG2 4.47Å; F54-V58 HydrophobicContact CZ-CG2 3.71Å; F54-V58 VanDerWaalsContact O-CG2 3.32Å; F54-V58 WeakPolarHBondContact O-CG2 3.41Å; F54-V58 PolarHBondContact O-N 3.22Å
55	L	74	Confident	73	Confident	87 Å²	87	93.5 Å²	93.5	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-60.2	-47.2	178.4	-72	172.7	0	0	0	112	S51 M52 S57 V58 L59	S51-L55 WeakPolarHBondContact O-CB 3.22Å; S51-L55 VanDerWaalsContact O-CG 3.3Å; S51-L55 WeakPolarHBondContact O-CG 3.36Å; S51-L55 PolarHBondContact O-N 3.43Å; M52-L55 PolarHBondContact O-N 3.16Å; L55-S57 VanDerWaalsContact C-N 3.3Å; L55-S57 PolarHBondContact O-N 2.93Å; L55-V58 PolarHBondContact O-N 3.39Å; L55-L59 WeakPolarHBondContact O-CB 3.17Å; L55-L59 VanDerWaalsContact O-CG 3.22Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.32Å
56	T	76.5	Confident	74.4	Confident	78 Å²	78	89.2 Å²	89.2	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-62.4	-37.7	176.4	50.1	0	0	0	0	112.2	M52 H53 F54 K60	M52-T56 WeakPolarHBondContact O-CB 3.37Å; M52-T56 VanDerWaalsContact O-CG2 3.32Å; M52-T56 WeakPolarHBondContact O-CG2 3.37Å; M52-T56 PolarHBondContact O-N 3.45Å; M52-T56 PolarHBondContact O-OG1 2.97Å; H53-T56 WeakPolarHBondContact CA-OG1 3.43Å; H53-T56 PolarHBondContact O-OG1 3.28Å; F54-T56 PolarHBondContact O-N 3.33Å; T56-K60 WeakPolarHBondContact O-CB 3.31Å; T56-K60 PolarHBondContact O-N 3.45Å
57	S	74.9	Confident	75.9	Confident	75 Å²	75	84.5 Å²	84.5	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-67.1	-43	175.9	-60.7	0	0	0	0	112.3	H53 F54 L55 K60 S61	H53-S57 VanDerWaalsContact O-CB 3.25Å; H53-S57 WeakPolarHBondContact O-CB 3.48Å; H53-S57 PolarHBondContact O-N 3.4Å; H53-S57 PolarHBondContact O-OG 3.04Å; F54-S57 PolarHBondContact O-N 2.89Å; L55-S57 VanDerWaalsContact C-N 3.3Å; L55-S57 PolarHBondContact O-N 2.93Å; S57-K60 PolarHBondContact O-N 3.15Å; S57-S61 WeakPolarHBondContact O-CB 3.33Å; S57-S61 PolarHBondContact O-N 3.4Å
58	V	73.1	Confident	77.2	Confident	50 Å²	50	77.8 Å²	77.8	30%	0.303	40%	0.404	S	S	.	.	H	α-helix	trans	-63.2	-48.3	175.3	171	0	0	0	0	110.4	F54 L55 K60 S61 I62	F54-V58 HydrophobicContact CD1-CG2 4.14Å; F54-V58 HydrophobicContact CD2-CG2 4.43Å; F54-V58 HydrophobicContact CE1-CG2 3.75Å; F54-V58 HydrophobicContact CE2-CG2 4.07Å; F54-V58 HydrophobicContact CG-CG2 4.47Å; F54-V58 HydrophobicContact CZ-CG2 3.71Å; F54-V58 VanDerWaalsContact O-CG2 3.32Å; F54-V58 WeakPolarHBondContact O-CG2 3.41Å; F54-V58 PolarHBondContact O-N 3.22Å; L55-V58 PolarHBondContact O-N 3.39Å; V58-K60 VanDerWaalsContact C-N 3.35Å; V58-K60 PolarHBondContact O-N 2.97Å; V58-S61 WeakPolarHBondContact O-CB 3.43Å; V58-S61 PolarHBondContact O-N 3.11Å; V58-S61 VanDerWaalsContact O-N 3.09Å; V58-S61 PolarHBondContact O-OG 3.33Å; V58-I62 HydrophobicContact CG1-CD1 3.98Å; V58-I62 WeakPolarHBondContact O-CG1 3.43Å; V58-I62 PolarHBondContact O-N 2.91Å; V58-I62 VanDerWaalsContact O-N 3.07Å
59	L	76	Confident	78.4	Confident	112 Å²	112	75.2 Å²	75.2	59%	0.586	39%	0.385	S	S	*	.	H	α-helix	trans	-61	-43	177.5	-69.9	173.2	0	0	0	111.9	L55 S61 I62 E63	L55-L59 WeakPolarHBondContact O-CB 3.17Å; L55-L59 VanDerWaalsContact O-CG 3.22Å; L55-L59 WeakPolarHBondContact O-CG 3.41Å; L55-L59 PolarHBondContact O-N 3.32Å; L59-S61 VanDerWaalsContact C-N 3.28Å; L59-S61 PolarHBondContact O-N 3.48Å; L59-I62 PolarHBondContact O-N 3.37Å; L59-I62 VanDerWaalsContact O-N 3.1Å; L59-E63 PolarHBondContact O-N 3.05Å
60	K	77.7	Confident	79.8	Confident	158 Å²	158	78.5 Å²	78.5	69%	0.687	40%	0.397	S	S	*	.	H	α-helix	trans	-65.4	-33	175.2	-171.9	173.5	-176.2	174.7	0	112.2	T56 S57 V58 I62 E63	T56-K60 WeakPolarHBondContact O-CB 3.31Å; T56-K60 PolarHBondContact O-N 3.45Å; S57-K60 PolarHBondContact O-N 3.15Å; V58-K60 VanDerWaalsContact C-N 3.35Å; V58-K60 PolarHBondContact O-N 2.97Å; K60-I62 PolarHBondContact O-N 3.37Å; K60-E63 VanDerWaalsContact O-CB 3.23Å; K60-E63 WeakPolarHBondContact O-CB 3.3Å; K60-E63 PolarHBondContact O-N 2.73Å
61	S	75.5	Confident	81.2	Confident	33 Å²	33	73 Å²	73	23%	0.231	38%	0.375	C	S	.	.	H	α-helix	trans	-67.4	-27.4	174.1	82.9	0	0	0	0	112.4	S57 V58 L59 E63 Y164 R171	S57-S61 WeakPolarHBondContact O-CB 3.33Å; S57-S61 PolarHBondContact O-N 3.4Å; V58-S61 WeakPolarHBondContact O-CB 3.43Å; V58-S61 PolarHBondContact O-N 3.11Å; V58-S61 VanDerWaalsContact O-N 3.09Å; V58-S61 PolarHBondContact O-OG 3.33Å; L59-S61 VanDerWaalsContact C-N 3.28Å; L59-S61 PolarHBondContact O-N 3.48Å; S61-E63 PolarHBondContact O-N 3.19Å; S61-Y164 VanDerWaalsContact CB-OH 3.26Å; S61-Y164 WeakPolarHBondContact CB-OH 3.27Å; S61-Y164 PolarHBondContact O-OH 3.09Å; S61-Y164 PolarHBondContact OG-OH 3.3Å; S61-R171 PolarHBondContact O-NH1 3.35Å; S61-R171 PolarHBondContact O-NH2 3.35Å
62	I	80.3	Confident	82.4	Confident	14 Å²	14	70.1 Å²	70.1	7%	0.072	35%	0.354	C	S	.	.	H	α-helix	trans	-78.6	-11.2	178.2	-66.7	162.6	0	0	0	111	V58 L59 K60 Y76 Y77 T80 I84 Y164	V58-I62 HydrophobicContact CG1-CD1 3.98Å; V58-I62 WeakPolarHBondContact O-CG1 3.43Å; V58-I62 PolarHBondContact O-N 2.91Å; V58-I62 VanDerWaalsContact O-N 3.07Å; L59-I62 PolarHBondContact O-N 3.37Å; L59-I62 VanDerWaalsContact O-N 3.1Å; K60-I62 PolarHBondContact O-N 3.37Å; I62-Y76 WeakPolarHBondContact O-CE2 3.23Å; I62-Y77 HydrophobicContact CG2-CD2 3.58Å; I62-Y77 HydrophobicContact CG2-CE2 4.15Å; I62-Y77 WeakPolarHBondContact O-CD2 3.18Å; I62-T80 HydrophobicContact CD1-CG2 4.28Å; I62-I84 HydrophobicContact CD1-CD1 4.36Å; I62-Y164 HydrophobicContact CG1-CD2 4.06Å; I62-Y164 HydrophobicContact CG1-CE2 4.06Å
63	E	85	Confident	83.5	Confident	115 Å²	115	67.6 Å²	67.6	54%	0.537	34%	0.338	S	S	.	.	S	Bend	trans	-54.3	133.3	-178.4	-164.5	172.5	-172.4	0	0	112.5	L59 K60 S61 R65 R171	L59-E63 PolarHBondContact O-N 3.05Å; K60-E63 VanDerWaalsContact O-CB 3.23Å; K60-E63 WeakPolarHBondContact O-CB 3.3Å; K60-E63 PolarHBondContact O-N 2.73Å; S61-E63 PolarHBondContact O-N 3.19Å; E63-R65 PolarHBondContact O-N 3.44Å; E63-R171 PolarHBondContact O-NH2 3.43Å
64	P	87.6	Confident	84.5	Confident	55 Å²	55	62.7 Å²	62.7	36%	0.357	32%	0.316	S	S	.	.			trans	-65.5	134.3	-177.5	26	-34.3	0	0	0	111.2	R73 Y76	P64-R73 HydrophobicContact CB-CG 4.37Å; P64-Y76 WeakPolarHBondContact CA-OH 3.5Å
65	R	88.9	Confident	85.5	Confident	97 Å²	97	56 Å²	56	37%	0.366	29%	0.287	S	S	.	.			trans	-107.3	159.5	176	-62.3	-174.7	-179.4	-175.8	-2.6	111.6	E63 D67 D68 R73 Y76 L182	E63-R65 PolarHBondContact O-N 3.44Å; R65-D67 WeakPolarHBondContact CB-OD1 3.31Å; R65-D67 PolarHBondContact O-N 3.48Å; R65-D68 PolarHBondContact O-N 2.91Å; R65-R73 PolarHBondContact O-NE 3.37Å; R65-R73 PolarHBondContact O-NH2 3.43Å; R65-Y76 PolarHBondContact N-OH 2.86Å; R65-L182 HydrophobicContact CB-CD1 4.5Å
66	V	89.2	Confident	86.5	Confident	41 Å²	41	51.9 Å²	51.9	25%	0.248	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.5	-179.5	-61.3	0	0	0	0	113.4	D68 L182 L185 E186 H409	V66-D68 VanDerWaalsContact C-N 3.31Å; V66-L182 HydrophobicContact CG2-CD1 3.68Å; V66-L185 HydrophobicContact CG2-CB 3.98Å; V66-E186 HydrophobicContact CG2-CG 3.66Å; V66-H409 PolarHBondContact O-CD2 3.13Å; V66-H409 PolarHBondContact O-CE1 2.89Å; V66-H409 VanDerWaalsContact O-CE1 3.29Å; V66-H409 PolarHBondContact O-NE2 3.27Å
67	D	87.5	Confident	87.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.011	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	1.9	175.5	64.1	-42.4	0	0	0	114.2	R65 W170 V181 L182 L185	R65-D67 WeakPolarHBondContact CB-OD1 3.31Å; R65-D67 PolarHBondContact O-N 3.48Å; D67-W170 PolarHBondContact OD2-NE1 2.96Å; D67-V181 HydrophobicContact CB-CG1 4.47Å; D67-L182 HydrophobicContact CB-CD1 4.41Å; D67-L185 HydrophobicContact CB-CD1 3.92Å
68	D	90.6	Very high	88.2	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.011	26%	0.255	C	S	.	.	S	Bend	trans	-107.9	141	-179.2	-57.8	-46.6	0	0	0	111.7	R65 V66 D72 R73 Y76 H409	R65-D68 PolarHBondContact O-N 2.91Å; V66-D68 VanDerWaalsContact C-N 3.31Å; D68-D72 HydrophobicContact CB-CB 4.16Å; D68-R73 HydrophobicContact CB-CG 4.15Å; D68-R73 PolarHBondContact O-NH2 2.73Å; D68-R73 VanDerWaalsContact O-NH2 3.14Å; D68-Y76 HydrophobicContact CB-CE1 4.18Å; D68-Y76 WeakPolarHBondContact OD2-CE1 3.26Å; D68-Y76 VanDerWaalsContact OD2-CZ 3.31Å; D68-Y76 PolarHBondContact OD2-OH 3.27Å; D68-H409 PolarHBondContact O-NE2 3.47Å
69	D	91	Very high	89.3	Confident	12 Å²	12	51.7 Å²	51.7	6%	0.064	24%	0.24	C	C	.	.			trans	-72.4	162.8	170.4	-73.9	-28	0	0	0	111.9	V71 D72 R73 Y247 K251 W353	D69-V71 VanDerWaalsContact C-N 3.28Å; D69-V71 PolarHBondContact O-N 3.26Å; D69-D72 PolarHBondContact N-OD2 3.01Å; D69-D72 VanDerWaalsContact N-OD2 3.13Å; D69-D72 WeakPolarHBondContact O-CB 3.28Å; D69-D72 PolarHBondContact O-N 3.16Å; D69-R73 WeakPolarHBondContact O-CG 3.29Å; D69-R73 PolarHBondContact O-N 2.95Å; D69-Y247 VanDerWaalsContact CG-OH 3.24Å; D69-Y247 PolarHBondContact OD2-OH 2.92Å; D69-K251 IonicContact OD2-NZ 3.75Å; D69-K251 PolarHBondContact OD2-NZ 3.37Å; D69-W353 VanDerWaalsContact OD2-CE2 3.25Å; D69-W353 WeakPolarHBondContact OD2-CZ2 3.33Å; D69-W353 PolarHBondContact OD2-NE1 3.16Å
70	F	92.4	Very high	90.2	Very high	137 Å²	137	46.5 Å²	46.5	60%	0.601	21%	0.213	S	C	*	.	H	α-helix	trans	-52.1	-44.7	172	178.4	-101.2	0	0	0	113.2	D72 R73 L74	F70-D72 VanDerWaalsContact C-N 3.3Å; F70-D72 PolarHBondContact O-N 3.46Å; F70-R73 PolarHBondContact O-N 2.81Å; F70-L74 PolarHBondContact O-N 3.05Å
71	V	95	Very high	90.9	Very high	23 Å²	23	40.8 Å²	40.8	14%	0.139	20%	0.199	C	C	.	.	H	α-helix	trans	-68	-31.4	179.5	179.1	0	0	0	0	111.4	D69 L74 N75 T346 N349	D69-V71 VanDerWaalsContact C-N 3.28Å; D69-V71 PolarHBondContact O-N 3.26Å; V71-L74 WeakPolarHBondContact O-CB 3.48Å; V71-L74 PolarHBondContact O-N 3.02Å; V71-N75 PolarHBondContact O-N 3.14Å; V71-N75 PolarHBondContact O-ND2 3.34Å; V71-T346 HydrophobicContact CG1-CG2 3.97Å; V71-N349 HydrophobicContact CB-CB 4.05Å; V71-N349 HydrophobicContact CG1-CB 3.85Å; V71-N349 HydrophobicContact CG2-CB 4.05Å
72	D	94.8	Very high	91.8	Very high	4 Å²	4	41 Å²	41	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-46.6	175.1	-58.9	-23.8	0	0	0	109.8	D68 D69 F70 L74 N75 Y76 Y247 K251 Y254	D68-D72 HydrophobicContact CB-CB 4.16Å; D69-D72 PolarHBondContact N-OD2 3.01Å; D69-D72 VanDerWaalsContact N-OD2 3.13Å; D69-D72 WeakPolarHBondContact O-CB 3.28Å; D69-D72 PolarHBondContact O-N 3.16Å; F70-D72 VanDerWaalsContact C-N 3.3Å; F70-D72 PolarHBondContact O-N 3.46Å; D72-L74 PolarHBondContact O-N 3.29Å; D72-N75 WeakPolarHBondContact O-CA 3.37Å; D72-N75 WeakPolarHBondContact O-CB 3.28Å; D72-N75 PolarHBondContact O-N 3.29Å; D72-Y76 HydrophobicContact CB-CE1 4.44Å; D72-Y76 WeakPolarHBondContact O-CD1 3.28Å; D72-Y76 PolarHBondContact O-N 3.28Å; D72-Y247 PolarHBondContact OD2-OH 3.48Å; D72-K251 WeakPolarHBondContact OD1-CE 3.46Å; D72-K251 IonicContact OD1-NZ 3.97Å; D72-K251 PolarHBondContact OD1-NZ 3.14Å; D72-K251 IonicContact OD2-NZ 3.26Å; D72-K251 PolarHBondContact OD2-NZ 3.38Å; D72-Y254 HydrophobicContact CB-CE2 4.02Å
73	R	94.9	Very high	92.5	Very high	64 Å²	64	40.4 Å²	40.4	24%	0.242	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-36.7	174.2	-61.8	176.6	-168.1	166.4	11.6	111.5	P64 R65 D68 D69 F70 N75 Y76 Y77 Y78	P64-R73 HydrophobicContact CB-CG 4.37Å; R65-R73 PolarHBondContact O-NE 3.37Å; R65-R73 PolarHBondContact O-NH2 3.43Å; D68-R73 HydrophobicContact CB-CG 4.15Å; D68-R73 PolarHBondContact O-NH2 2.73Å; D68-R73 VanDerWaalsContact O-NH2 3.14Å; D69-R73 WeakPolarHBondContact O-CG 3.29Å; D69-R73 PolarHBondContact O-N 2.95Å; F70-R73 PolarHBondContact O-N 2.81Å; R73-N75 PolarHBondContact O-N 2.81Å; R73-Y76 HydrophobicContact CB-CE1 4.45Å; R73-Y76 HydrophobicContact CG-CE1 4.12Å; R73-Y77 WeakPolarHBondContact O-CA 3.42Å; R73-Y77 VanDerWaalsContact O-CB 3.22Å; R73-Y77 WeakPolarHBondContact O-CB 3.26Å; R73-Y77 PolarHBondContact O-N 2.96Å; R73-Y78 HydrophobicContact CB-CD2 4.5Å; R73-Y78 HydrophobicContact CB-CE2 4.34Å; R73-Y78 WeakPolarHBondContact O-CD2 3.37Å; R73-Y78 PolarHBondContact O-N 2.9Å
74	L	95.5	Very high	92.9	Very high	17 Å²	17	37.7 Å²	37.7	9%	0.089	18%	0.184	C	C	.	.	I	π-helix	trans	-57.9	-37.5	174.4	-162.8	64.6	0	0	0	112.4	F70 V71 D72 Y78 T79 W338 L342 L345	F70-L74 PolarHBondContact O-N 3.05Å; V71-L74 WeakPolarHBondContact O-CB 3.48Å; V71-L74 PolarHBondContact O-N 3.02Å; D72-L74 PolarHBondContact O-N 3.29Å; L74-Y78 HydrophobicContact CD1-CD2 4.2Å; L74-Y78 HydrophobicContact CD1-CG 4.44Å; L74-T79 WeakPolarHBondContact O-CB 3.49Å; L74-T79 PolarHBondContact O-N 2.75Å; L74-T79 PolarHBondContact O-OG1 3.04Å; L74-W338 HydrophobicContact CD1-CH2 3.71Å; L74-W338 HydrophobicContact CD1-CZ2 3.74Å; L74-W338 HydrophobicContact CG-CZ2 4.19Å; L74-L342 HydrophobicContact CB-CD1 4.13Å; L74-L342 HydrophobicContact CD2-CD1 3.6Å; L74-L342 HydrophobicContact CG-CD1 3.61Å; L74-L345 HydrophobicContact CD2-CD1 3.57Å
75	N	95.7	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-76.2	-62.9	178.3	-74.5	-90.7	0	0	0	112.5	V71 D72 R73 T79 F163 Y254 V258 T346	V71-N75 PolarHBondContact O-N 3.14Å; V71-N75 PolarHBondContact O-ND2 3.34Å; D72-N75 WeakPolarHBondContact O-CA 3.37Å; D72-N75 WeakPolarHBondContact O-CB 3.28Å; D72-N75 PolarHBondContact O-N 3.29Å; R73-N75 PolarHBondContact O-N 2.81Å; N75-T79 VanDerWaalsContact O-CB 3.25Å; N75-T79 WeakPolarHBondContact O-CB 3.43Å; N75-F163 HydrophobicContact CB-CD1 4.44Å; N75-Y254 HydrophobicContact CB-CD1 3.49Å; N75-Y254 VanDerWaalsContact CB-CD1 3.49Å; N75-Y254 HydrophobicContact CB-CE1 3.64Å; N75-Y254 HydrophobicContact CB-CG 4.38Å; N75-V258 WeakPolarHBondContact OD1-CG2 3.4Å; N75-T346 WeakPolarHBondContact ND2-CG2 3.38Å; N75-T346 WeakPolarHBondContact OD1-CG2 3.29Å
76	Y	94.2	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-86.5	-21.7	-168.3	78.8	-97.6	0	0	0	114.5	I62 P64 R65 D68 D72 R73 T80 T167 Y254	I62-Y76 WeakPolarHBondContact O-CE2 3.23Å; P64-Y76 WeakPolarHBondContact CA-OH 3.5Å; R65-Y76 PolarHBondContact N-OH 2.86Å; D68-Y76 HydrophobicContact CB-CE1 4.18Å; D68-Y76 WeakPolarHBondContact OD2-CE1 3.26Å; D68-Y76 VanDerWaalsContact OD2-CZ 3.31Å; D68-Y76 PolarHBondContact OD2-OH 3.27Å; D72-Y76 HydrophobicContact CB-CE1 4.44Å; D72-Y76 WeakPolarHBondContact O-CD1 3.28Å; D72-Y76 PolarHBondContact O-N 3.28Å; R73-Y76 HydrophobicContact CB-CE1 4.45Å; R73-Y76 HydrophobicContact CG-CE1 4.12Å; Y76-T80 WeakPolarHBondContact O-CB 3.36Å; Y76-T80 PolarHBondContact O-OG1 2.97Å; Y76-T80 VanDerWaalsContact O-OG1 3.04Å; Y76-T167 WeakPolarHBondContact CB-OG1 3.45Å; Y76-T167 HydrophobicContact CD1-CG2 3.94Å; Y76-T167 VanDerWaalsContact CD1-OG1 3.25Å; Y76-T167 WeakPolarHBondContact CD1-OG1 3.36Å; Y76-T167 HydrophobicContact CD2-CG2 4.16Å; Y76-T167 HydrophobicContact CE1-CG2 4.03Å; Y76-T167 HydrophobicContact CE2-CG2 4.28Å; Y76-T167 HydrophobicContact CG-CG2 4.01Å; Y76-Y254 WeakPolarHBondContact CD1-OH 3.32Å
77	Y	94	Very high	93.5	Very high	88 Å²	88	34.9 Å²	34.9	35%	0.345	17%	0.171	S	C	.	.	I	π-helix	trans	-99.9	-62.9	-176.5	178.6	-105.3	0	0	0	110.3	I62 R73 G81	I62-Y77 HydrophobicContact CG2-CD2 3.58Å; I62-Y77 HydrophobicContact CG2-CE2 4.15Å; I62-Y77 WeakPolarHBondContact O-CD2 3.18Å; R73-Y77 WeakPolarHBondContact O-CA 3.42Å; R73-Y77 VanDerWaalsContact O-CB 3.22Å; R73-Y77 WeakPolarHBondContact O-CB 3.26Å; R73-Y77 PolarHBondContact O-N 2.96Å; Y77-G81 PolarHBondContact O-N 3.02Å
78	Y	94.4	Very high	93.7	Very high	112 Å²	112	40.1 Å²	40.1	44%	0.439	20%	0.198	S	C	.	.	I	π-helix	trans	-70.7	-49.4	-175.3	-67.2	-73.4	0	0	0	112	R73 L74 G81 V82	R73-Y78 HydrophobicContact CB-CD2 4.5Å; R73-Y78 HydrophobicContact CB-CE2 4.34Å; R73-Y78 WeakPolarHBondContact O-CD2 3.37Å; R73-Y78 PolarHBondContact O-N 2.9Å; L74-Y78 HydrophobicContact CD1-CD2 4.2Å; L74-Y78 HydrophobicContact CD1-CG 4.44Å; Y78-G81 PolarHBondContact O-N 3.38Å; Y78-V82 WeakPolarHBondContact O-CB 3.29Å; Y78-V82 VanDerWaalsContact O-CG2 3.27Å; Y78-V82 WeakPolarHBondContact O-CG2 3.48Å; Y78-V82 PolarHBondContact O-N 3.15Å
79	T	95.8	Very high	93.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-66.3	-46.7	-179	-55.1	0	0	0	0	111.4	L74 N75 G81 V82 I83 F163 W338 F339 L342	L74-T79 WeakPolarHBondContact O-CB 3.49Å; L74-T79 PolarHBondContact O-N 2.75Å; L74-T79 PolarHBondContact O-OG1 3.04Å; N75-T79 VanDerWaalsContact O-CB 3.25Å; N75-T79 WeakPolarHBondContact O-CB 3.43Å; T79-G81 VanDerWaalsContact C-N 3.33Å; T79-G81 PolarHBondContact O-N 3.24Å; T79-V82 PolarHBondContact O-N 3.42Å; T79-I83 HydrophobicContact CG2-CD1 3.73Å; T79-I83 HydrophobicContact CG2-CG1 4.31Å; T79-I83 VanDerWaalsContact O-CG1 3.28Å; T79-I83 WeakPolarHBondContact O-CG1 3.48Å; T79-I83 PolarHBondContact O-N 2.82Å; T79-F163 HydrophobicContact CG2-CD1 4.09Å; T79-F163 HydrophobicContact CG2-CD2 3.97Å; T79-F163 HydrophobicContact CG2-CE1 3.9Å; T79-F163 HydrophobicContact CG2-CE2 3.76Å; T79-F163 HydrophobicContact CG2-CG 4.14Å; T79-F163 HydrophobicContact CG2-CZ 3.74Å; T79-W338 PolarHBondContact OG1-NE1 3.39Å; T79-F339 HydrophobicContact CG2-CE1 3.81Å; T79-L342 HydrophobicContact CG2-CD2 4.07Å; T79-L342 WeakPolarHBondContact OG1-CD2 3.42Å
80	T	94.2	Very high	93.8	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-56.8	-45.3	173.2	-62.9	0	0	0	0	111.9	I62 Y76 I83 I84 A160 F163	I62-T80 HydrophobicContact CD1-CG2 4.28Å; Y76-T80 WeakPolarHBondContact O-CB 3.36Å; Y76-T80 PolarHBondContact O-OG1 2.97Å; Y76-T80 VanDerWaalsContact O-OG1 3.04Å; T80-I83 PolarHBondContact O-N 2.8Å; T80-I84 HydrophobicContact CG2-CD1 3.69Å; T80-I84 HydrophobicContact CG2-CG1 4.37Å; T80-I84 WeakPolarHBondContact O-CB 3.47Å; T80-I84 VanDerWaalsContact O-CG1 3.23Å; T80-I84 WeakPolarHBondContact O-CG1 3.18Å; T80-I84 PolarHBondContact O-N 2.87Å; T80-A160 HydrophobicContact CG2-CB 4.23Å; T80-A160 PolarHBondContact OG1-O 3.24Å; T80-F163 VanDerWaalsContact OG1-CB 3.25Å; T80-F163 WeakPolarHBondContact OG1-CB 3.42Å
81	G	92.6	Very high	93.7	Very high	37 Å²	37	39.3 Å²	39.3	38%	0.381	20%	0.202	S	C	.	.	H	α-helix	trans	-61.6	-44.2	177.7	0	0	0	0	0	113.3	Y77 Y78 T79 I84 M85	Y77-G81 PolarHBondContact O-N 3.02Å; Y78-G81 PolarHBondContact O-N 3.38Å; T79-G81 VanDerWaalsContact C-N 3.33Å; T79-G81 PolarHBondContact O-N 3.24Å; G81-I84 PolarHBondContact O-N 3.16Å; G81-M85 WeakPolarHBondContact O-CB 3.34Å; G81-M85 PolarHBondContact O-N 3.47Å
82	V	94	Very high	93.5	Very high	39 Å²	39	40.8 Å²	40.8	24%	0.236	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-45.3	177	171.7	0	0	0	0	111.2	Y78 T79 M85 M86 F334	Y78-V82 WeakPolarHBondContact O-CB 3.29Å; Y78-V82 VanDerWaalsContact O-CG2 3.27Å; Y78-V82 WeakPolarHBondContact O-CG2 3.48Å; Y78-V82 PolarHBondContact O-N 3.15Å; T79-V82 PolarHBondContact O-N 3.42Å; V82-M85 WeakPolarHBondContact O-CB 3.35Å; V82-M85 PolarHBondContact O-N 3.23Å; V82-M86 HydrophobicContact CG1-CE 4.33Å; V82-M86 WeakPolarHBondContact O-CG 3.49Å; V82-M86 PolarHBondContact O-N 2.88Å; V82-F334 HydrophobicContact CG1-CE1 3.5Å; V82-F334 HydrophobicContact CG1-CZ 3.97Å
83	I	95	Very high	93.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-43.8	178	-65.4	170	0	0	0	111	T79 T80 M85 M86 A87 L156 E159 A160 F163 L335 F339	T79-I83 HydrophobicContact CG2-CD1 3.73Å; T79-I83 HydrophobicContact CG2-CG1 4.31Å; T79-I83 VanDerWaalsContact O-CG1 3.28Å; T79-I83 WeakPolarHBondContact O-CG1 3.48Å; T79-I83 PolarHBondContact O-N 2.82Å; T80-I83 PolarHBondContact O-N 2.8Å; I83-M85 VanDerWaalsContact C-N 3.31Å; I83-M85 PolarHBondContact O-N 2.82Å; I83-M86 PolarHBondContact O-N 2.79Å; I83-A87 WeakPolarHBondContact O-CB 3.47Å; I83-A87 PolarHBondContact O-N 3.28Å; I83-L156 HydrophobicContact CG2-CB 4.02Å; I83-L156 HydrophobicContact CG2-CD2 4.22Å; I83-L156 WeakPolarHBondContact CG2-O 3.36Å; I83-E159 HydrophobicContact CD1-CB 4.26Å; I83-E159 HydrophobicContact CG2-CB 4.35Å; I83-A160 HydrophobicContact CB-CB 4.2Å; I83-A160 HydrophobicContact CG2-CB 3.84Å; I83-F163 HydrophobicContact CD1-CD2 3.61Å; I83-F163 HydrophobicContact CD1-CE2 3.64Å; I83-L335 HydrophobicContact CG1-CD2 3.96Å; I83-F339 HydrophobicContact CD1-CE1 4.14Å; I83-F339 HydrophobicContact CD1-CZ 3.97Å
84	I	92.8	Very high	93	Very high	58 Å²	58	41.1 Å²	41.1	30%	0.297	22%	0.22	S	C	.	.	H	α-helix	trans	-58.9	-44.6	176	-72	170.1	0	0	0	110.6	I62 T80 G81 M86 A87 I88 A160	I62-I84 HydrophobicContact CD1-CD1 4.36Å; T80-I84 HydrophobicContact CG2-CD1 3.69Å; T80-I84 HydrophobicContact CG2-CG1 4.37Å; T80-I84 WeakPolarHBondContact O-CB 3.47Å; T80-I84 VanDerWaalsContact O-CG1 3.23Å; T80-I84 WeakPolarHBondContact O-CG1 3.18Å; T80-I84 PolarHBondContact O-N 2.87Å; G81-I84 PolarHBondContact O-N 3.16Å; I84-M86 PolarHBondContact O-N 3.39Å; I84-A87 PolarHBondContact O-N 2.83Å; I84-I88 HydrophobicContact CG2-CD1 3.85Å; I84-I88 HydrophobicContact CG2-CG1 4.5Å; I84-I88 VanDerWaalsContact O-CG1 3.29Å; I84-I88 WeakPolarHBondContact O-CG1 3.17Å; I84-I88 PolarHBondContact O-N 2.95Å; I84-A160 HydrophobicContact CD1-CB 4.45Å; I84-A160 HydrophobicContact CG1-CB 3.77Å
85	M	92.4	Very high	92.6	Very high	92 Å²	92	47.6 Å²	47.6	45%	0.453	24%	0.244	S	C	.	.	H	α-helix	trans	-59.9	-46.1	176.6	-175.7	-164	71.4	0	0	111.4	G81 V82 I83 A87 I88 L89	G81-M85 WeakPolarHBondContact O-CB 3.34Å; G81-M85 PolarHBondContact O-N 3.47Å; V82-M85 WeakPolarHBondContact O-CB 3.35Å; V82-M85 PolarHBondContact O-N 3.23Å; I83-M85 VanDerWaalsContact C-N 3.31Å; I83-M85 PolarHBondContact O-N 2.82Å; M85-A87 PolarHBondContact O-N 3.2Å; M85-I88 PolarHBondContact O-N 3.25Å; M85-L89 HydrophobicContact CE-CD1 4.36Å; M85-L89 HydrophobicContact CG-CD1 4.37Å; M85-L89 WeakPolarHBondContact O-CG 3.45Å; M85-L89 PolarHBondContact O-N 3.45Å
86	M	93.3	Very high	92	Very high	32 Å²	32	52.2 Å²	52.2	16%	0.158	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-40.1	177	-63	-50.8	172.8	0	0	112.1	V82 I83 I84 I88 L89 V90 L156 I331	V82-M86 HydrophobicContact CG1-CE 4.33Å; V82-M86 WeakPolarHBondContact O-CG 3.49Å; V82-M86 PolarHBondContact O-N 2.88Å; I83-M86 PolarHBondContact O-N 2.79Å; I84-M86 PolarHBondContact O-N 3.39Å; M86-I88 VanDerWaalsContact C-N 3.32Å; M86-I88 PolarHBondContact O-N 3.17Å; M86-L89 PolarHBondContact O-N 3.48Å; M86-L89 HydrophobicContact SD-CD1 4Å; M86-V90 WeakPolarHBondContact O-CG2 3.25Å; M86-V90 PolarHBondContact O-N 3.28Å; M86-L156 HydrophobicContact CB-CD1 4.43Å; M86-I331 HydrophobicContact CB-CD1 4.39Å; M86-I331 HydrophobicContact CB-CG2 4.25Å; M86-I331 HydrophobicContact CG-CG2 4.43Å; M86-I331 HydrophobicContact SD-CG1 4.26Å
87	A	93.3	Very high	91.5	Very high	11 Å²	11	53.5 Å²	53.5	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-41.1	175.7	0	0	0	0	0	111.7	I83 I84 M85 S91 L156	I83-A87 WeakPolarHBondContact O-CB 3.47Å; I83-A87 PolarHBondContact O-N 3.28Å; I84-A87 PolarHBondContact O-N 2.83Å; M85-A87 PolarHBondContact O-N 3.2Å; A87-S91 VanDerWaalsContact O-CB 3.23Å; A87-S91 WeakPolarHBondContact O-CB 3.27Å; A87-S91 PolarHBondContact O-N 2.88Å; A87-S91 PolarHBondContact O-OG 3.01Å; A87-L156 HydrophobicContact CB-CB 3.81Å; A87-L156 HydrophobicContact CB-CD1 4.37Å
88	I	91.7	Very high	91.2	Very high	112 Å²	112	54.8 Å²	54.8	57%	0.574	30%	0.304	S	S	*	.	H	α-helix	trans	-64.7	-45.2	175	-67.6	165.8	0	0	0	110.8	I84 M85 M86 S91 A92	I84-I88 HydrophobicContact CG2-CD1 3.85Å; I84-I88 HydrophobicContact CG2-CG1 4.5Å; I84-I88 VanDerWaalsContact O-CG1 3.29Å; I84-I88 WeakPolarHBondContact O-CG1 3.17Å; I84-I88 PolarHBondContact O-N 2.95Å; M85-I88 PolarHBondContact O-N 3.25Å; M86-I88 VanDerWaalsContact C-N 3.32Å; M86-I88 PolarHBondContact O-N 3.17Å; I88-S91 PolarHBondContact O-N 2.72Å; I88-A92 WeakPolarHBondContact O-CB 3.06Å; I88-A92 PolarHBondContact O-N 3.37Å
89	L	91.2	Very high	91.1	Very high	99 Å²	99	50.1 Å²	50.1	52%	0.518	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-45.9	179.5	-71.4	172.2	0	0	0	112.3	M85 M86 A92 K93	M85-L89 HydrophobicContact CE-CD1 4.36Å; M85-L89 HydrophobicContact CG-CD1 4.37Å; M85-L89 WeakPolarHBondContact O-CG 3.45Å; M85-L89 PolarHBondContact O-N 3.45Å; M86-L89 PolarHBondContact O-N 3.48Å; M86-L89 HydrophobicContact SD-CD1 4Å; L89-A92 PolarHBondContact O-N 3.17Å; L89-K93 PolarHBondContact O-N 3.39Å; L89-K93 VanDerWaalsContact O-N 3.15Å
90	V	92.2	Very high	90.9	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-44.4	176.3	175.1	0	0	0	0	110.6	M86 A92 K93 Q94 V152 P153 L156 I324 I331	M86-V90 WeakPolarHBondContact O-CG2 3.25Å; M86-V90 PolarHBondContact O-N 3.28Å; V90-A92 VanDerWaalsContact C-N 3.32Å; V90-A92 PolarHBondContact O-N 3.02Å; V90-K93 PolarHBondContact O-N 3.44Å; V90-Q94 WeakPolarHBondContact O-CB 3.33Å; V90-Q94 PolarHBondContact O-N 3.34Å; V90-V152 HydrophobicContact CG1-CB 4.47Å; V90-V152 HydrophobicContact CG1-CG1 4.1Å; V90-P153 HydrophobicContact CG1-CB 4.49Å; V90-L156 HydrophobicContact CG2-CD1 4.4Å; V90-I324 HydrophobicContact CG1-CD1 4.23Å; V90-I331 HydrophobicContact CG2-CD1 3.18Å
91	S	91.9	Very high	90.9	Very high	32 Å²	32	54 Å²	54	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-40.6	177.6	-60.2	0	0	0	0	111.8	A87 I88 K93 Q94 Y95 P153	A87-S91 VanDerWaalsContact O-CB 3.23Å; A87-S91 WeakPolarHBondContact O-CB 3.27Å; A87-S91 PolarHBondContact O-N 2.88Å; A87-S91 PolarHBondContact O-OG 3.01Å; I88-S91 PolarHBondContact O-N 2.72Å; S91-K93 VanDerWaalsContact C-N 3.32Å; S91-K93 PolarHBondContact O-N 3.08Å; S91-Q94 PolarHBondContact O-N 3.48Å; S91-Y95 WeakPolarHBondContact O-CD2 3.33Å; S91-Y95 PolarHBondContact O-N 3.3Å; S91-P153 WeakPolarHBondContact OG-CB 3.46Å
92	A	90.4	Very high	91.1	Very high	53 Å²	53	52.8 Å²	52.8	44%	0.438	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-43.5	175.9	0	0	0	0	0	111.1	I88 L89 V90 A96	I88-A92 WeakPolarHBondContact O-CB 3.06Å; I88-A92 PolarHBondContact O-N 3.37Å; L89-A92 PolarHBondContact O-N 3.17Å; V90-A92 VanDerWaalsContact C-N 3.32Å; V90-A92 PolarHBondContact O-N 3.02Å; A92-A96 WeakPolarHBondContact O-CA 3.48Å; A92-A96 VanDerWaalsContact O-CB 3.25Å; A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.42Å
93	K	89.8	Confident	91.2	Very high	56 Å²	56	61 Å²	61	24%	0.243	32%	0.318	C	S	.	.	H	α-helix	trans	-68	-35.3	176.4	-177.6	58	-175.7	163.1	0	112.7	L89 V90 S91 G97 H98 F327	L89-K93 PolarHBondContact O-N 3.39Å; L89-K93 VanDerWaalsContact O-N 3.15Å; V90-K93 PolarHBondContact O-N 3.44Å; S91-K93 VanDerWaalsContact C-N 3.32Å; S91-K93 PolarHBondContact O-N 3.08Å; K93-G97 CarbonylContact O-C 3.6Å; K93-G97 WeakPolarHBondContact O-CA 3.2Å; K93-G97 PolarHBondContact O-N 2.98Å; K93-H98 WeakPolarHBondContact CE-O 3.47Å; K93-H98 PolarHBondContact NZ-O 3.5Å; K93-F327 HydrophobicContact CD-CE2 4.41Å; K93-F327 HydrophobicContact CG-CD2 4.37Å; K93-F327 HydrophobicContact CG-CE2 4.31Å
94	Q	88.8	Confident	91.2	Very high	19 Å²	19	62.1 Å²	62.1	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-75.4	-35.9	-178.3	-176.8	167.4	-26.5	0	0	113.6	V90 S91 W121 I324	V90-Q94 WeakPolarHBondContact O-CB 3.33Å; V90-Q94 PolarHBondContact O-N 3.34Å; S91-Q94 PolarHBondContact O-N 3.48Å; Q94-W121 HydrophobicContact CG-CZ2 3.85Å; Q94-I324 HydrophobicContact CB-CD1 4.27Å
95	Y	86	Confident	91.2	Very high	154 Å²	154	61.2 Å²	61.2	60%	0.604	32%	0.323	S	S	*	.	H	α-helix	trans	-105.9	-28.7	-174.4	-64.5	-66.1	0	0	0	114.6	S91	S91-Y95 WeakPolarHBondContact O-CD2 3.33Å; S91-Y95 PolarHBondContact O-N 3.3Å
96	A	84	Confident	91.2	Very high	96 Å²	96	62 Å²	62	79%	0.793	34%	0.344	S	S	*	.	H	α-helix	trans	-103.7	-13.9	179.8	0	0	0	0	0	113.2	A92	A92-A96 WeakPolarHBondContact O-CA 3.48Å; A92-A96 VanDerWaalsContact O-CB 3.25Å; A92-A96 WeakPolarHBondContact O-CB 3.36Å; A92-A96 PolarHBondContact O-N 3.42Å
97	G	84.7	Confident	91.2	Very high	28 Å²	28	67.1 Å²	67.1	29%	0.289	37%	0.368	S	S	.	.	S	Bend	trans	-113.1	-180	176.7	0	0	0	0	0	112.6	K93 P99	K93-G97 CarbonylContact O-C 3.6Å; K93-G97 WeakPolarHBondContact O-CA 3.2Å; K93-G97 PolarHBondContact O-N 2.98Å; G97-P99 VanDerWaalsContact O-CD 3.29Å; G97-P99 WeakPolarHBondContact O-CD 3.42Å
98	H	87.7	Confident	91.2	Very high	114 Å²	114	68.2 Å²	68.2	53%	0.528	37%	0.37	S	S	.	.			trans	-87.7	109.1	167.5	-58	-82.2	0	0	0	108.7	K93 I100 E101	K93-H98 WeakPolarHBondContact CE-O 3.47Å; K93-H98 PolarHBondContact NZ-O 3.5Å; H98-I100 VanDerWaalsContact C-N 3.33Å; H98-E101 HydrophobicContact CB-CG 4.47Å; H98-E101 WeakPolarHBondContact CB-OE1 3.31Å; H98-E101 IonicContact CD2-OE1 3.2Å; H98-E101 IonicContact CG-OE1 2.96Å; H98-E101 VanDerWaalsContact CG-OE1 3.26Å; H98-E101 IonicContact ND1-OE1 3.1Å
99	P	90.7	Very high	91.3	Very high	15 Å²	15	66.4 Å²	66.4	10%	0.097	36%	0.364	C	S	.	.	S	Bend	trans	-75	-26.7	-179.4	29.5	-34.1	0	0	0	112.3	G97 W121 V323	G97-P99 VanDerWaalsContact O-CD 3.29Å; G97-P99 WeakPolarHBondContact O-CD 3.42Å; P99-W121 HydrophobicContact CB-CD2 4.32Å; P99-W121 HydrophobicContact CB-CE3 4.04Å; P99-W121 HydrophobicContact CB-CH2 4.01Å; P99-W121 HydrophobicContact CB-CZ2 4.27Å; P99-W121 HydrophobicContact CB-CZ3 3.88Å; P99-W121 HydrophobicContact CG-CD2 3.87Å; P99-W121 HydrophobicContact CG-CE3 4.02Å; P99-W121 HydrophobicContact CG-CG 4.34Å; P99-W121 HydrophobicContact CG-CZ2 4.39Å; P99-W121 HydrophobicContact CG-CZ3 4.34Å; P99-V323 PolarHBondContact O-N 2.93Å
100	I	93	Very high	91.5	Very high	5 Å²	5	69 Å²	69	3%	0.026	37%	0.371	C	S	.	.			trans	-138.9	142.6	-178.3	-166.6	169.7	0	0	0	109.1	H98 E117 C120 W121 T125 C320 V321 L322	H98-I100 VanDerWaalsContact C-N 3.33Å; I100-E117 HydrophobicContact CG2-CB 4.48Å; I100-C120 HydrophobicContact CD1-CB 4.2Å; I100-W121 HydrophobicContact CB-CE3 4.39Å; I100-W121 HydrophobicContact CG2-CB 3.93Å; I100-W121 HydrophobicContact CG2-CE3 4.37Å; I100-T125 HydrophobicContact CD1-CG2 3.97Å; I100-C320 HydrophobicContact CD1-CB 3.6Å; I100-C320 HydrophobicContact CG1-CB 3.64Å; I100-V321 WeakPolarHBondContact CA-O 3.32Å; I100-L322 HydrophobicContact CB-CD1 4.2Å; I100-L322 HydrophobicContact CD1-CD1 4.26Å; I100-L322 HydrophobicContact CG1-CD1 4.2Å
101	E	94.1	Very high	91.6	Very high	79 Å²	79	72 Å²	72	37%	0.369	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.1	176.1	-64.5	-81.3	166.1	0	0	107.2	H98 C320 V321	H98-E101 HydrophobicContact CB-CG 4.47Å; H98-E101 WeakPolarHBondContact CB-OE1 3.31Å; H98-E101 IonicContact CD2-OE1 3.2Å; H98-E101 IonicContact CG-OE1 2.96Å; H98-E101 VanDerWaalsContact CG-OE1 3.26Å; H98-E101 IonicContact ND1-OE1 3.1Å; E101-C320 CarbonylContact O-C 3.5Å; E101-C320 VanDerWaalsContact O-CA 3.28Å; E101-C320 WeakPolarHBondContact O-CA 3.39Å; E101-V321 PolarHBondContact N-O 2.83Å; E101-V321 VanDerWaalsContact N-O 3.13Å; E101-V321 PolarHBondContact O-N 3.09Å
102	C	95.9	Very high	91.7	Very high	11 Å²	11	74.9 Å²	74.9	7%	0.074	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.6	-171.2	-65.8	0	0	0	0	113	V104 E117 V318 C320	C102-V104 HydrophobicContact CB-CG1 4.32Å; C102-V104 PolarHBondContact O-N 3.21Å; C102-V104 VanDerWaalsContact O-N 3.1Å; C102-E117 HydrophobicContact CB-CG 3.99Å; C102-E117 PolarHBondContact N-OE1 3.08Å; C102-V318 HydrophobicContact CB-CG2 4.46Å; C102-C320 HydrophobicContact CB-CB 4.1Å; C102-C320 WeakPolarHBondContact CB-SG 3.32Å; C102-C320 WeakPolarHBondContact SG-CB 3.41Å; C102-C320 CovalentContact SG-SG 2.05Å; C102-C320 PolarHBondContact SG-SG 3.39Å
103	W	95.8	Very high	91.9	Very high	212 Å²	212	75.6 Å²	75.6	80%	0.803	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	95	170.1	-174.1	-91.4	0	0	0	109.9	Q319	W103-Q319 HydrophobicContact CB-CB 4.46Å; W103-Q319 WeakPolarHBondContact CB-O 3.37Å; W103-Q319 PolarHBondContact N-O 3.36Å
104	V	94.8	Very high	92.1	Very high	24 Å²	24	77.5 Å²	77.5	15%	0.145	41%	0.412	C	S	.	.			trans	-96.9	153.7	178.2	-62.3	0	0	0	0	111.9	C102 F108 E113 A116 V318	C102-V104 HydrophobicContact CB-CG1 4.32Å; C102-V104 PolarHBondContact O-N 3.21Å; C102-V104 VanDerWaalsContact O-N 3.1Å; V104-F108 HydrophobicContact CB-CB 4.37Å; V104-F108 HydrophobicContact CB-CD2 3.86Å; V104-F108 HydrophobicContact CB-CG 4.35Å; V104-F108 HydrophobicContact CG1-CD2 4.17Å; V104-F108 HydrophobicContact CG2-CB 4.14Å; V104-F108 HydrophobicContact CG2-CD2 4.41Å; V104-E113 HydrophobicContact CG2-CB 3.96Å; V104-E113 HydrophobicContact CG2-CG 3.86Å; V104-A116 HydrophobicContact CG1-CB 3.98Å; V104-V318 HydrophobicContact CG1-CG1 4.44Å
105	P	94	Very high	92.4	Very high	39 Å²	39	82.4 Å²	82.4	25%	0.253	43%	0.43	S	S	.	.			trans	-59.2	146.2	176.6	-24.2	34.8	0	0	0	113.1	Q107 F108	P105-Q107 HydrophobicContact CB-CG 4.37Å; P105-Q107 PolarHBondContact O-N 3.29Å; P105-F108 HydrophobicContact CB-CD1 4.46Å; P105-F108 HydrophobicContact CG-CE1 4.43Å; P105-F108 WeakPolarHBondContact O-CB 3.46Å; P105-F108 PolarHBondContact O-N 2.83Å
106	A	92.6	Very high	92.8	Very high	107 Å²	107	75.1 Å²	75.1	88%	0.884	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.5	-174.7	0	0	0	0	0	114.9	F108	A106-F108 VanDerWaalsContact C-N 3.28Å; A106-F108 PolarHBondContact O-N 2.92Å
107	Q	93	Very high	93.3	Very high	141 Å²	141	71.4 Å²	71.4	66%	0.659	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-12.2	174.9	65.8	-85.9	16.6	0	0	114.1	P105	P105-Q107 HydrophobicContact CB-CG 4.37Å; P105-Q107 PolarHBondContact O-N 3.29Å
108	F	92.2	Very high	93.7	Very high	34 Å²	34	74.8 Å²	74.8	15%	0.149	38%	0.379	C	S	.	.			trans	-73.6	130.9	179	-82.3	25.2	0	0	0	110.2	V104 P105 A106 M112 F305 I307	V104-F108 HydrophobicContact CB-CB 4.37Å; V104-F108 HydrophobicContact CB-CD2 3.86Å; V104-F108 HydrophobicContact CB-CG 4.35Å; V104-F108 HydrophobicContact CG1-CD2 4.17Å; V104-F108 HydrophobicContact CG2-CB 4.14Å; V104-F108 HydrophobicContact CG2-CD2 4.41Å; P105-F108 HydrophobicContact CB-CD1 4.46Å; P105-F108 HydrophobicContact CG-CE1 4.43Å; P105-F108 WeakPolarHBondContact O-CB 3.46Å; P105-F108 PolarHBondContact O-N 2.83Å; A106-F108 VanDerWaalsContact C-N 3.28Å; A106-F108 PolarHBondContact O-N 2.92Å; F108-M112 HydrophobicContact CB-CB 3.98Å; F108-M112 HydrophobicContact CD2-CB 3.86Å; F108-M112 HydrophobicContact CG-CB 3.99Å; F108-F305 HydrophobicContact CE2-CE2 4.23Å; F108-F305 AromaticContact CE2-CZ 3.81Å; F108-F305 HydrophobicContact CE2-CZ 3.81Å; F108-F305 HydrophobicContact CZ-CE2 4.37Å; F108-F305 HydrophobicContact CZ-CZ 4.15Å; F108-I307 HydrophobicContact CZ-CD1 4.11Å
109	T	95	Very high	94	Very high	73 Å²	73	72.3 Å²	72.3	45%	0.448	37%	0.366	S	S	.	.			trans	-70.8	159.2	169.5	65.7	0	0	0	0	110.1	A111 M112 E113	T109-A111 PolarHBondContact O-N 3.24Å; T109-M112 HydrophobicContact CG2-CE 4.45Å; T109-M112 HydrophobicContact CG2-SD 4.18Å; T109-M112 PolarHBondContact N-SD 3.28Å; T109-M112 WeakPolarHBondContact O-CA 3.32Å; T109-M112 WeakPolarHBondContact O-CB 3.23Å; T109-M112 PolarHBondContact O-N 3.28Å; T109-M112 WeakPolarHBondContact OG1-CG 3.32Å; T109-M112 PolarHBondContact OG1-SD 3.47Å; T109-E113 PolarHBondContact O-N 3.43Å
110	K	94.7	Very high	94.1	Very high	153 Å²	153	71.6 Å²	71.6	67%	0.665	36%	0.361	S	S	*	.	H	α-helix	trans	-52.4	-32.8	175.9	-172.2	176.3	-176.9	174.4	0	113.6	Q114	K110-Q114 WeakPolarHBondContact O-CG 3.2Å; K110-Q114 PolarHBondContact O-N 3.24Å
111	A	94.9	Very high	94.1	Very high	66 Å²	66	73.4 Å²	73.4	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-70.4	-33.7	175.9	0	0	0	0	0	112.6	T109 Y115	T109-A111 PolarHBondContact O-N 3.24Å; A111-Y115 WeakPolarHBondContact O-CB 3.15Å; A111-Y115 PolarHBondContact O-N 2.94Å
112	M	94.4	Very high	94	Very high	93 Å²	93	74.9 Å²	74.9	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-73.1	-37.6	175.6	-65.3	163.8	176.4	0	0	111.5	F108 T109 Y115 A116	F108-M112 HydrophobicContact CB-CB 3.98Å; F108-M112 HydrophobicContact CD2-CB 3.86Å; F108-M112 HydrophobicContact CG-CB 3.99Å; T109-M112 HydrophobicContact CG2-CE 4.45Å; T109-M112 HydrophobicContact CG2-SD 4.18Å; T109-M112 PolarHBondContact N-SD 3.28Å; T109-M112 WeakPolarHBondContact O-CA 3.32Å; T109-M112 WeakPolarHBondContact O-CB 3.23Å; T109-M112 PolarHBondContact O-N 3.28Å; T109-M112 WeakPolarHBondContact OG1-CG 3.32Å; T109-M112 PolarHBondContact OG1-SD 3.47Å; M112-Y115 PolarHBondContact O-N 3.37Å; M112-A116 WeakPolarHBondContact O-CB 3.37Å; M112-A116 PolarHBondContact O-N 3.02Å
113	E	94.6	Very high	93.6	Very high	68 Å²	68	79.1 Å²	79.1	32%	0.318	40%	0.396	S	S	.	.	H	α-helix	trans	-57.8	-53.5	170.8	-178.7	-178.4	-171.1	0	0	110.8	V104 T109 Y115 A116 E117	V104-E113 HydrophobicContact CG2-CB 3.96Å; V104-E113 HydrophobicContact CG2-CG 3.86Å; T109-E113 PolarHBondContact O-N 3.43Å; E113-Y115 VanDerWaalsContact C-N 3.27Å; E113-Y115 PolarHBondContact O-N 3.43Å; E113-A116 WeakPolarHBondContact O-CB 3.45Å; E113-A116 PolarHBondContact O-N 2.84Å; E113-E117 WeakPolarHBondContact O-CG 3.44Å; E113-E117 PolarHBondContact O-N 2.98Å
114	Q	94.2	Very high	93.3	Very high	97 Å²	97	71.4 Å²	71.4	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-59.3	-36.5	175.9	-73	-179.8	-21.7	0	0	112.9	K110 N118	K110-Q114 WeakPolarHBondContact O-CG 3.2Å; K110-Q114 PolarHBondContact O-N 3.24Å; Q114-N118 WeakPolarHBondContact O-CB 3.38Å; Q114-N118 VanDerWaalsContact O-CG 3.29Å; Q114-N118 PolarHBondContact O-N 3.1Å; Q114-N118 VanDerWaalsContact O-N 3.07Å; Q114-N118 PolarHBondContact O-ND2 3.32Å
115	Y	94.2	Very high	93.2	Very high	122 Å²	122	70.5 Å²	70.5	48%	0.478	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-47.9	173.4	170.9	-93.2	0	0	0	111.3	A111 M112 E113 N118 Y119	A111-Y115 WeakPolarHBondContact O-CB 3.15Å; A111-Y115 PolarHBondContact O-N 2.94Å; M112-Y115 PolarHBondContact O-N 3.37Å; E113-Y115 VanDerWaalsContact C-N 3.27Å; E113-Y115 PolarHBondContact O-N 3.43Å; Y115-N118 PolarHBondContact O-N 2.96Å; Y115-Y119 VanDerWaalsContact O-CB 3.22Å; Y115-Y119 WeakPolarHBondContact O-CB 3.44Å; Y115-Y119 PolarHBondContact O-N 2.66Å
116	A	94.4	Very high	93.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-46.4	179.7	0	0	0	0	0	111.2	V104 M112 E113 Y119 C120 F305	V104-A116 HydrophobicContact CG1-CB 3.98Å; M112-A116 WeakPolarHBondContact O-CB 3.37Å; M112-A116 PolarHBondContact O-N 3.02Å; E113-A116 WeakPolarHBondContact O-CB 3.45Å; E113-A116 PolarHBondContact O-N 2.84Å; A116-Y119 PolarHBondContact O-N 3.17Å; A116-C120 VanDerWaalsContact O-CB 3.27Å; A116-C120 WeakPolarHBondContact O-CB 3.41Å; A116-C120 PolarHBondContact O-N 3.46Å; A116-C120 PolarHBondContact O-SG 3.45Å; A116-F305 HydrophobicContact CB-CE1 4.08Å; A116-F305 HydrophobicContact CB-CZ 4.09Å
117	E	94	Very high	93.1	Very high	18 Å²	18	65.8 Å²	65.8	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-47.9	176.7	-70.1	177.7	157.3	0	0	112.5	I100 C102 E113 C120 W121	I100-E117 HydrophobicContact CG2-CB 4.48Å; C102-E117 HydrophobicContact CB-CG 3.99Å; C102-E117 PolarHBondContact N-OE1 3.08Å; E113-E117 WeakPolarHBondContact O-CG 3.44Å; E113-E117 PolarHBondContact O-N 2.98Å; E117-C120 PolarHBondContact O-N 3.41Å; E117-W121 WeakPolarHBondContact O-CB 3.19Å; E117-W121 PolarHBondContact O-N 2.84Å
118	N	92.9	Very high	93	Very high	99 Å²	99	59.7 Å²	59.7	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-38.6	178.4	-75.6	-50.6	0	0	0	112.1	Q114 Y115 W121 I122	Q114-N118 WeakPolarHBondContact O-CB 3.38Å; Q114-N118 VanDerWaalsContact O-CG 3.29Å; Q114-N118 PolarHBondContact O-N 3.1Å; Q114-N118 VanDerWaalsContact O-N 3.07Å; Q114-N118 PolarHBondContact O-ND2 3.32Å; Y115-N118 PolarHBondContact O-N 2.96Å; N118-W121 PolarHBondContact O-N 3.1Å; N118-I122 WeakPolarHBondContact O-CD1 3.41Å; N118-I122 VanDerWaalsContact O-CG1 3.27Å; N118-I122 WeakPolarHBondContact O-CG1 3.37Å; N118-I122 PolarHBondContact O-N 2.65Å
119	Y	94.2	Very high	92.9	Very high	63 Å²	63	59.5 Å²	59.5	25%	0.247	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-49.8	176.9	-174.9	-82.9	0	0	0	110.7	Y115 A116 W121 I122 Q123 F305	Y115-Y119 VanDerWaalsContact O-CB 3.22Å; Y115-Y119 WeakPolarHBondContact O-CB 3.44Å; Y115-Y119 PolarHBondContact O-N 2.66Å; A116-Y119 PolarHBondContact O-N 3.17Å; Y119-W121 VanDerWaalsContact C-N 3.29Å; Y119-W121 PolarHBondContact O-N 3.19Å; Y119-I122 PolarHBondContact O-N 2.72Å; Y119-Q123 HydrophobicContact CD1-CB 4.2Å; Y119-Q123 HydrophobicContact CD1-CG 3.96Å; Y119-Q123 HydrophobicContact CD2-CG 4.42Å; Y119-Q123 HydrophobicContact CE1-CB 3.9Å; Y119-Q123 HydrophobicContact CE1-CG 3.56Å; Y119-Q123 HydrophobicContact CE2-CG 4.06Å; Y119-Q123 HydrophobicContact CG-CG 4.38Å; Y119-Q123 WeakPolarHBondContact O-CB 3.24Å; Y119-Q123 PolarHBondContact O-N 3.27Å; Y119-F305 HydrophobicContact CD1-CB 3.38Å; Y119-F305 HydrophobicContact CD1-CG 4.35Å; Y119-F305 HydrophobicContact CE1-CB 3.22Å; Y119-F305 HydrophobicContact CG-CB 4.23Å
120	C	94	Very high	92.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-34.4	178.5	-68.8	0	0	0	0	112.7	I100 A116 E117 I122 C303	I100-C120 HydrophobicContact CD1-CB 4.2Å; A116-C120 VanDerWaalsContact O-CB 3.27Å; A116-C120 WeakPolarHBondContact O-CB 3.41Å; A116-C120 PolarHBondContact O-N 3.46Å; A116-C120 PolarHBondContact O-SG 3.45Å; E117-C120 PolarHBondContact O-N 3.41Å; C120-I122 VanDerWaalsContact C-N 3.3Å; C120-I122 PolarHBondContact O-N 3.47Å; C120-C303 WeakPolarHBondContact CA-SG 3.49Å; C120-C303 HydrophobicContact CB-CB 3.66Å; C120-C303 WeakPolarHBondContact CB-SG 3.48Å; C120-C303 WeakPolarHBondContact SG-CB 3.34Å; C120-C303 CovalentContact SG-SG 2.02Å; C120-C303 PolarHBondContact SG-SG 3.48Å
121	W	91.9	Very high	92.3	Very high	43 Å²	43	62.1 Å²	62.1	16%	0.163	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-37.1	172.2	-179.6	-115.6	0	0	0	112.2	Q94 P99 I100 E117 N118 Y119 Q150 L322 I324	Q94-W121 HydrophobicContact CG-CZ2 3.85Å; P99-W121 HydrophobicContact CB-CD2 4.32Å; P99-W121 HydrophobicContact CB-CE3 4.04Å; P99-W121 HydrophobicContact CB-CH2 4.01Å; P99-W121 HydrophobicContact CB-CZ2 4.27Å; P99-W121 HydrophobicContact CB-CZ3 3.88Å; P99-W121 HydrophobicContact CG-CD2 3.87Å; P99-W121 HydrophobicContact CG-CE3 4.02Å; P99-W121 HydrophobicContact CG-CG 4.34Å; P99-W121 HydrophobicContact CG-CZ2 4.39Å; P99-W121 HydrophobicContact CG-CZ3 4.34Å; I100-W121 HydrophobicContact CB-CE3 4.39Å; I100-W121 HydrophobicContact CG2-CB 3.93Å; I100-W121 HydrophobicContact CG2-CE3 4.37Å; E117-W121 WeakPolarHBondContact O-CB 3.19Å; E117-W121 PolarHBondContact O-N 2.84Å; N118-W121 PolarHBondContact O-N 3.1Å; Y119-W121 VanDerWaalsContact C-N 3.29Å; Y119-W121 PolarHBondContact O-N 3.19Å; W121-Q150 HydrophobicContact CZ2-CG 4.22Å; W121-Q150 PolarHBondContact O-NE2 3.49Å; W121-L322 HydrophobicContact CE3-CD1 4.48Å; W121-L322 HydrophobicContact CZ3-CD1 4.08Å; W121-I324 HydrophobicContact CH2-CD1 4.07Å; W121-I324 HydrophobicContact CH2-CG2 4.26Å; W121-I324 HydrophobicContact CZ3-CG2 4.08Å
122	I	91.9	Very high	91.9	Very high	110 Å²	110	63.3 Å²	63.3	56%	0.564	30%	0.304	S	S	*	.	H	α-helix	trans	-84.7	-40.5	-176.1	-66.1	165.7	0	0	0	112.5	N118 Y119 C120 N124 Q150	N118-I122 WeakPolarHBondContact O-CD1 3.41Å; N118-I122 VanDerWaalsContact O-CG1 3.27Å; N118-I122 WeakPolarHBondContact O-CG1 3.37Å; N118-I122 PolarHBondContact O-N 2.65Å; Y119-I122 PolarHBondContact O-N 2.72Å; C120-I122 VanDerWaalsContact C-N 3.3Å; C120-I122 PolarHBondContact O-N 3.47Å; I122-N124 VanDerWaalsContact C-N 3.29Å; I122-N124 PolarHBondContact O-N 2.87Å; I122-Q150 PolarHBondContact O-NE2 2.9Å
123	Q	88.2	Confident	91.7	Very high	99 Å²	99	66.9 Å²	66.9	46%	0.463	32%	0.317	S	S	.	.	S	Bend	trans	-87.3	9.9	-171.2	-71	-71.8	-4.4	0	0	114.7	Y119	Y119-Q123 HydrophobicContact CD1-CB 4.2Å; Y119-Q123 HydrophobicContact CD1-CG 3.96Å; Y119-Q123 HydrophobicContact CD2-CG 4.42Å; Y119-Q123 HydrophobicContact CE1-CB 3.9Å; Y119-Q123 HydrophobicContact CE1-CG 3.56Å; Y119-Q123 HydrophobicContact CE2-CG 4.06Å; Y119-Q123 HydrophobicContact CG-CG 4.38Å; Y119-Q123 WeakPolarHBondContact O-CB 3.24Å; Y119-Q123 PolarHBondContact O-N 3.27Å
124	N	89.7	Confident	91.5	Very high	50 Å²	50	67 Å²	67	27%	0.267	32%	0.319	S	S	.	.			trans	63.9	167.9	-172.8	-50.2	-46.8	0	0	0	113	I122 Q145 G147	I122-N124 VanDerWaalsContact C-N 3.29Å; I122-N124 PolarHBondContact O-N 2.87Å; N124-Q145 HydrophobicContact CB-CB 4.39Å; N124-G147 WeakPolarHBondContact OD1-CA 3.2Å
125	T	92.8	Very high	91.3	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	152.2	-178.2	59.6	0	0	0	0	109.3	I100 I146 T301 L302 C303	I100-T125 HydrophobicContact CD1-CG2 3.97Å; T125-I146 PolarHBondContact O-N 3.02Å; T125-T301 WeakPolarHBondContact CB-OG1 3.38Å; T125-T301 PolarHBondContact OG1-OG1 3.23Å; T125-L302 WeakPolarHBondContact CA-O 3.26Å; T125-L302 WeakPolarHBondContact CB-O 3.3Å; T125-C303 HydrophobicContact CG2-CB 4.28Å
126	Y	92.7	Very high	91	Very high	5 Å²	5	66 Å²	66	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	158.2	177.5	65.4	-84.7	0	0	0	111.2	V128 I134 R141 R144 T301 L302 D304	Y126-V128 HydrophobicContact CD2-CG2 3.75Å; Y126-V128 HydrophobicContact CE2-CG2 3.73Å; Y126-I134 HydrophobicContact CE2-CG2 4.27Å; Y126-R141 HydrophobicContact CD1-CB 4.43Å; Y126-R141 HydrophobicContact CD2-CB 4.48Å; Y126-R141 HydrophobicContact CE1-CB 4.36Å; Y126-R141 HydrophobicContact CE2-CB 4.4Å; Y126-R141 HydrophobicContact CE2-CG 4.21Å; Y126-R141 HydrophobicContact CG-CB 4.5Å; Y126-R141 PolarHBondContact OH-NH1 2.86Å; Y126-R144 WeakPolarHBondContact CA-O 3.34Å; Y126-R144 WeakPolarHBondContact CB-O 3.46Å; Y126-T301 CarbonylContact O-C 3.58Å; Y126-T301 WeakPolarHBondContact O-CA 3.5Å; Y126-T301 WeakPolarHBondContact O-CB 3.44Å; Y126-L302 HydrophobicContact CD1-CB 4.3Å; Y126-L302 WeakPolarHBondContact CD1-O 3.3Å; Y126-L302 HydrophobicContact CD2-CB 4.17Å; Y126-L302 HydrophobicContact CE1-CB 3.78Å; Y126-L302 HydrophobicContact CE2-CB 3.63Å; Y126-L302 HydrophobicContact CE2-CD1 3.65Å; Y126-L302 HydrophobicContact CE2-CG 4.26Å; Y126-L302 HydrophobicContact CG-CB 4.47Å; Y126-L302 VanDerWaalsContact CZ-CB 3.4Å; Y126-L302 PolarHBondContact N-O 3.34Å; Y126-L302 PolarHBondContact O-N 3.41Å; Y126-D304 WeakPolarHBondContact CE1-OD2 3.4Å; Y126-D304 PolarHBondContact OH-OD1 3.33Å; Y126-D304 PolarHBondContact OH-OD2 3.47Å
127	W	91.2	Very high	90.8	Very high	42 Å²	42	72 Å²	72	16%	0.159	35%	0.348	C	S	.	.			trans	-114.1	139.2	178.5	177	75.2	0	0	0	111.2	P129 I146 W291 Q292 P298	W127-P129 HydrophobicContact CH2-CB 4.33Å; W127-P129 HydrophobicContact CH2-CG 3.54Å; W127-P129 HydrophobicContact CZ2-CB 4.36Å; W127-P129 HydrophobicContact CZ2-CG 4Å; W127-P129 HydrophobicContact CZ3-CG 3.93Å; W127-I146 HydrophobicContact CB-CD1 3.93Å; W127-W291 AromaticContact NE1-CE3 3.93Å; W127-W291 AromaticContact NE1-CZ3 3.68Å; W127-Q292 VanDerWaalsContact CZ2-O 3.29Å; W127-Q292 WeakPolarHBondContact CZ2-O 3.24Å; W127-P298 HydrophobicContact CB-CB 4.04Å; W127-P298 HydrophobicContact CB-CG 3.86Å; W127-P298 HydrophobicContact CD2-CB 4.34Å; W127-P298 HydrophobicContact CG-CB 3.59Å; W127-P298 HydrophobicContact CG-CG 3.93Å
128	V	90.8	Very high	90.5	Very high	13 Å²	13	74.8 Å²	74.8	8%	0.079	36%	0.363	C	S	.	.			trans	-137.6	134.3	173.3	-174.2	0	0	0	0	106.9	Y126 D132 L302	Y126-V128 HydrophobicContact CD2-CG2 3.75Å; Y126-V128 HydrophobicContact CE2-CG2 3.73Å; V128-D132 HydrophobicContact CG1-CB 3.86Å; V128-L302 HydrophobicContact CB-CD1 4.33Å; V128-L302 HydrophobicContact CG2-CD1 4.15Å
129	P	90.7	Very high	90.3	Very high	31 Å²	31	75 Å²	75	20%	0.201	36%	0.364	C	S	.	.			trans	-54.3	147.4	170	-22.3	31	0	0	0	111.5	W127 D131 D132	W127-P129 HydrophobicContact CH2-CB 4.33Å; W127-P129 HydrophobicContact CH2-CG 3.54Å; W127-P129 HydrophobicContact CZ2-CB 4.36Å; W127-P129 HydrophobicContact CZ2-CG 4Å; W127-P129 HydrophobicContact CZ3-CG 3.93Å; P129-D131 PolarHBondContact O-N 2.94Å; P129-D132 HydrophobicContact CB-CB 4.29Å; P129-D132 HydrophobicContact CG-CB 4.45Å; P129-D132 WeakPolarHBondContact CG-OD2 3.48Å; P129-D132 PolarHBondContact O-N 3.26Å
130	F	87.7	Confident	90.1	Very high	129 Å²	129	74.8 Å²	74.8	57%	0.566	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.2	179	-75.7	-81	0	0	0	113.4	D132 W291 V300	F130-D132 VanDerWaalsContact C-N 3.3Å; F130-W291 HydrophobicContact CE2-CH2 4.2Å; F130-V300 HydrophobicContact CZ-CB 4.42Å; F130-V300 HydrophobicContact CZ-CG1 4.1Å
131	D	88.2	Confident	89.9	Confident	151 Å²	151	76.3 Å²	76.3	81%	0.807	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-14.7	178.3	-59.7	-44.2	0	0	0	112.9	P129	P129-D131 PolarHBondContact O-N 2.94Å
132	D	87.8	Confident	89.7	Confident	92 Å²	92	79.2 Å²	79.2	49%	0.492	39%	0.388	S	S	.	.	S	Bend	trans	-96.9	144.9	-178.9	-75.8	-14.1	0	0	0	111.4	V128 P129 F130	V128-D132 HydrophobicContact CG1-CB 3.86Å; P129-D132 HydrophobicContact CB-CB 4.29Å; P129-D132 HydrophobicContact CG-CB 4.45Å; P129-D132 WeakPolarHBondContact CG-OD2 3.48Å; P129-D132 PolarHBondContact O-N 3.26Å; F130-D132 VanDerWaalsContact C-N 3.3Å
133	F	90	Very high	89.4	Confident	168 Å²	168	81.7 Å²	81.7	74%	0.737	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-71.4	142.5	171	-64.1	-78.5	0	0	0	111	P135	F133-P135 WeakPolarHBondContact O-CD 3.32Å
134	I	90.4	Very high	89.2	Confident	70 Å²	70	82 Å²	82	36%	0.359	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-62.7	123	173.4	-52.1	174.4	0	0	0	108.2	Y126 Q136 R141 L302 T317	Y126-I134 HydrophobicContact CE2-CG2 4.27Å; I134-Q136 PolarHBondContact O-N 3.41Å; I134-R141 VanDerWaalsContact CG2-CZ 3.43Å; I134-R141 VanDerWaalsContact CG2-NH2 3.33Å; I134-L302 HydrophobicContact CD1-CD1 3.84Å; I134-L302 HydrophobicContact CG1-CD1 3.9Å; I134-L302 HydrophobicContact CG2-CD1 4.34Å; I134-T317 HydrophobicContact CD1-CG2 4.38Å
135	P	90.5	Very high	89.1	Confident	16 Å²	16	83.6 Å²	83.6	10%	0.104	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-53.2	136.6	-179.1	-27	34.2	0	0	0	111.9	F133 D140 R141	F133-P135 WeakPolarHBondContact O-CD 3.32Å; P135-D140 HydrophobicContact CB-CB 3.68Å; P135-D140 HydrophobicContact CG-CB 4.21Å; P135-R141 HydrophobicContact CB-CG 4.32Å; P135-R141 VanDerWaalsContact O-CZ 3.28Å; P135-R141 PolarHBondContact O-NE 3.48Å; P135-R141 PolarHBondContact O-NH2 3.07Å
136	Q	87.2	Confident	88.8	Confident	183 Å²	183	84.7 Å²	84.7	86%	0.855	41%	0.406	S	S	*	.	S	Bend	trans	-76.8	-32.3	177.6	-69.8	-171.1	-12.9	0	0	111.9	I134	I134-Q136 PolarHBondContact O-N 3.41Å
137	Q	89.7	Confident	88.5	Confident	124 Å²	124	85.5 Å²	85.5	58%	0.579	42%	0.415	S	S	*	.	S	Bend	trans	-73.6	133.8	176.1	-63.5	-174.5	-10.6	0	0	109.7	D139 D140	Q137-D139 VanDerWaalsContact C-N 3.34Å; Q137-D140 HydrophobicContact CB-CB 4.46Å
138	I	87.3	Confident	88.3	Confident	78 Å²	78	85.3 Å²	85.3	40%	0.4	42%	0.415	S	S	.	.	H	α-helix	trans	-69.7	-38.2	-179.6	-64.1	172.4	0	0	0	109.9	D140 R141 E142	I138-D140 VanDerWaalsContact C-N 3.32Å; I138-D140 PolarHBondContact O-N 2.89Å; I138-R141 WeakPolarHBondContact O-CA 3.31Å; I138-R141 WeakPolarHBondContact O-CB 3.29Å; I138-R141 PolarHBondContact O-N 3.4Å; I138-E142 HydrophobicContact CG2-CG 4.22Å; I138-E142 PolarHBondContact O-N 2.9Å
139	D	89.7	Confident	88.1	Confident	104 Å²	104	85 Å²	85	56%	0.556	41%	0.412	S	S	*	.	H	α-helix	trans	-56.5	-44.8	179.8	-56.2	-26.9	0	0	0	111.3	Q137 R141 E142 E143	Q137-D139 VanDerWaalsContact C-N 3.34Å; D139-R141 PolarHBondContact O-N 3.02Å; D139-E142 PolarHBondContact O-N 3.28Å; D139-E142 VanDerWaalsContact O-N 3.08Å; D139-E143 PolarHBondContact O-N 3.42Å
140	D	89.2	Confident	88	Confident	57 Å²	57	85.5 Å²	85.5	31%	0.305	41%	0.412	S	S	.	.	H	α-helix	trans	-60.3	-32.1	175.6	-66.8	-19.6	0	0	0	113.1	P135 Q137 I138 R144	P135-D140 HydrophobicContact CB-CB 3.68Å; P135-D140 HydrophobicContact CG-CB 4.21Å; Q137-D140 HydrophobicContact CB-CB 4.46Å; I138-D140 VanDerWaalsContact C-N 3.32Å; I138-D140 PolarHBondContact O-N 2.89Å; D140-R144 WeakPolarHBondContact O-CG 3.37Å
141	R	89.8	Confident	88.2	Confident	32 Å²	32	86.7 Å²	86.7	12%	0.121	41%	0.413	C	S	.	.	H	α-helix	trans	-75.7	-37.8	176.5	-59.4	-176.9	-175.1	-164.3	1.4	110.9	Y126 I134 P135 I138 D139 R144 D304 T317	Y126-R141 HydrophobicContact CD1-CB 4.43Å; Y126-R141 HydrophobicContact CD2-CB 4.48Å; Y126-R141 HydrophobicContact CE1-CB 4.36Å; Y126-R141 HydrophobicContact CE2-CB 4.4Å; Y126-R141 HydrophobicContact CE2-CG 4.21Å; Y126-R141 HydrophobicContact CG-CB 4.5Å; Y126-R141 PolarHBondContact OH-NH1 2.86Å; I134-R141 VanDerWaalsContact CG2-CZ 3.43Å; I134-R141 VanDerWaalsContact CG2-NH2 3.33Å; P135-R141 HydrophobicContact CB-CG 4.32Å; P135-R141 VanDerWaalsContact O-CZ 3.28Å; P135-R141 PolarHBondContact O-NE 3.48Å; P135-R141 PolarHBondContact O-NH2 3.07Å; I138-R141 WeakPolarHBondContact O-CA 3.31Å; I138-R141 WeakPolarHBondContact O-CB 3.29Å; I138-R141 PolarHBondContact O-N 3.4Å; D139-R141 PolarHBondContact O-N 3.02Å; R141-R144 PolarHBondContact O-N 2.97Å; R141-D304 WeakPolarHBondContact CD-OD2 3.46Å; R141-D304 IonicContact CZ-OD2 3.69Å; R141-D304 IonicContact NE-OD2 3.79Å; R141-D304 IonicContact NH1-OD1 3.21Å; R141-D304 PolarHBondContact NH1-OD1 3.02Å; R141-D304 IonicContact NH1-OD2 2.79Å; R141-D304 PolarHBondContact NH1-OD2 3.35Å; R141-T317 PolarHBondContact NH1-OG1 2.78Å
142	E	87.2	Confident	88.3	Confident	105 Å²	105	79.9 Å²	79.9	49%	0.491	38%	0.376	S	S	.	.	H	α-helix	trans	-65.3	-41.2	177.6	-69.6	-173.2	179.8	0	0	111.8	I138 D139 R144 Q145	I138-E142 HydrophobicContact CG2-CG 4.22Å; I138-E142 PolarHBondContact O-N 2.9Å; D139-E142 PolarHBondContact O-N 3.28Å; D139-E142 VanDerWaalsContact O-N 3.08Å; E142-R144 PolarHBondContact O-N 2.59Å; E142-Q145 VanDerWaalsContact O-CB 3.3Å; E142-Q145 WeakPolarHBondContact O-CB 3.21Å; E142-Q145 WeakPolarHBondContact O-CG 3.43Å; E142-Q145 PolarHBondContact O-N 3.48Å; E142-Q145 VanDerWaalsContact O-N 3.1Å
143	E	85.9	Confident	88.5	Confident	162 Å²	162	75.9 Å²	75.9	76%	0.757	36%	0.356	S	S	*	.	H	α-helix	trans	-62.4	-27.3	176.1	-71.2	-176.4	-179.8	0	0	113.3	D139	D139-E143 PolarHBondContact O-N 3.42Å
144	R	85.8	Confident	88.6	Confident	104 Å²	104	72.8 Å²	72.8	39%	0.392	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	4.7	178.5	-64.5	177.7	-170.6	-162.3	2.6	113.5	Y126 D140 R141 E142	Y126-R144 WeakPolarHBondContact CA-O 3.34Å; Y126-R144 WeakPolarHBondContact CB-O 3.46Å; D140-R144 WeakPolarHBondContact O-CG 3.37Å; R141-R144 PolarHBondContact O-N 2.97Å; E142-R144 PolarHBondContact O-N 2.59Å
145	Q	87.3	Confident	88.7	Confident	85 Å²	85	70.7 Å²	70.7	40%	0.397	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.8	-178.7	-74.1	178.7	0.9	0	0	112.4	N124 E142	N124-Q145 HydrophobicContact CB-CB 4.39Å; E142-Q145 VanDerWaalsContact O-CB 3.3Å; E142-Q145 WeakPolarHBondContact O-CB 3.21Å; E142-Q145 WeakPolarHBondContact O-CG 3.43Å; E142-Q145 PolarHBondContact O-N 3.48Å; E142-Q145 VanDerWaalsContact O-N 3.1Å
146	I	86.6	Confident	88.9	Confident	28 Å²	28	70.2 Å²	70.2	14%	0.144	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.4	-178.4	-47	177.2	0	0	0	108.1	T125 W127 Y148 Y149 P298	T125-I146 PolarHBondContact O-N 3.02Å; W127-I146 HydrophobicContact CB-CD1 3.93Å; I146-Y148 HydrophobicContact CG2-CD1 3.42Å; I146-Y148 VanDerWaalsContact CG2-CD1 3.42Å; I146-Y148 HydrophobicContact CG2-CE1 3.13Å; I146-Y148 HydrophobicContact CG2-CG 4.47Å; I146-Y149 HydrophobicContact CB-CE2 3.94Å; I146-Y149 HydrophobicContact CG2-CD2 4.24Å; I146-Y149 HydrophobicContact CG2-CE2 3.34Å; I146-P298 HydrophobicContact CD1-CG 3.52Å
147	G	85.8	Confident	89.1	Confident	21 Å²	21	64 Å²	64	22%	0.216	31%	0.309	C	S	.	.			trans	-118.5	4	-176	0	0	0	0	0	115.8	N124 Y149	N124-G147 WeakPolarHBondContact OD1-CA 3.2Å; G147-Y149 VanDerWaalsContact C-N 3.29Å; G147-Y149 PolarHBondContact O-N 2.87Å
148	Y	86.8	Confident	89.4	Confident	39 Å²	39	62.7 Å²	62.7	15%	0.153	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-70.3	-23.3	-174.1	64.5	-102.7	0	0	0	113.7	I146 Q150 W151 V152 F268 F297 T328	I146-Y148 HydrophobicContact CG2-CD1 3.42Å; I146-Y148 VanDerWaalsContact CG2-CD1 3.42Å; I146-Y148 HydrophobicContact CG2-CE1 3.13Å; I146-Y148 HydrophobicContact CG2-CG 4.47Å; Y148-Q150 VanDerWaalsContact C-N 3.3Å; Y148-Q150 PolarHBondContact O-N 2.9Å; Y148-W151 PolarHBondContact O-N 3.43Å; Y148-V152 HydrophobicContact CD2-CG2 4.31Å; Y148-V152 PolarHBondContact O-N 3.28Å; Y148-F268 WeakPolarHBondContact O-CZ 3.29Å; Y148-F297 WeakPolarHBondContact OH-CD1 3.49Å; Y148-T328 HydrophobicContact CE2-CG2 4.26Å
149	Y	87	Confident	89.7	Confident	6 Å²	6	59 Å²	59	2%	0.024	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58.4	-39.2	-174.3	-51.8	-67.1	0	0	0	113.5	I146 G147 W151 V152 L322 N325	I146-Y149 HydrophobicContact CB-CE2 3.94Å; I146-Y149 HydrophobicContact CG2-CD2 4.24Å; I146-Y149 HydrophobicContact CG2-CE2 3.34Å; G147-Y149 VanDerWaalsContact C-N 3.29Å; G147-Y149 PolarHBondContact O-N 2.87Å; Y149-W151 PolarHBondContact O-N 3.26Å; Y149-V152 PolarHBondContact O-N 3.49Å; Y149-L322 HydrophobicContact CD1-CD2 4.07Å; Y149-L322 HydrophobicContact CD2-CD2 3.56Å; Y149-L322 HydrophobicContact CE1-CD2 3.78Å; Y149-L322 HydrophobicContact CE2-CD2 3.23Å; Y149-L322 HydrophobicContact CG-CD2 3.96Å; Y149-N325 HydrophobicContact CE1-CB 4.13Å; Y149-N325 VanDerWaalsContact CE1-CG 3.47Å; Y149-N325 VanDerWaalsContact CE1-OD1 3.31Å; Y149-N325 WeakPolarHBondContact CE1-OD1 3.29Å; Y149-N325 PolarHBondContact OH-ND2 3.31Å
150	Q	88.9	Confident	89.9	Confident	42 Å²	42	54.3 Å²	54.3	20%	0.196	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-62.6	-29.2	178.4	-60.7	171.6	-12.9	0	0	112.1	W121 I122 Y148	W121-Q150 HydrophobicContact CZ2-CG 4.22Å; W121-Q150 PolarHBondContact O-NE2 3.49Å; I122-Q150 PolarHBondContact O-NE2 2.9Å; Y148-Q150 VanDerWaalsContact C-N 3.3Å; Y148-Q150 PolarHBondContact O-N 2.9Å
151	W	90.7	Very high	90.1	Very high	153 Å²	153	56.9 Å²	56.9	58%	0.58	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-17.9	-172.9	-65.9	96	0	0	0	113.9	Y148 Y149 F154 V155 F268	Y148-W151 PolarHBondContact O-N 3.43Å; Y149-W151 PolarHBondContact O-N 3.26Å; W151-F154 HydrophobicContact CE3-CD2 4.32Å; W151-F154 PolarHBondContact O-N 3.22Å; W151-V155 HydrophobicContact CB-CG2 4.44Å; W151-V155 WeakPolarHBondContact O-CG2 3.35Å; W151-V155 PolarHBondContact O-N 2.99Å; W151-F268 HydrophobicContact CB-CE2 4.09Å; W151-F268 HydrophobicContact CB-CZ 4.02Å
152	V	91.3	Very high	90.4	Very high	8 Å²	8	58.6 Å²	58.6	5%	0.048	29%	0.285	C	S	.	.	H	α-helix	trans	-46.4	-53.6	-177.8	177.9	0	0	0	0	113.5	V90 Y148 Y149 F154 V155 L156 F268 T328	V90-V152 HydrophobicContact CG1-CB 4.47Å; V90-V152 HydrophobicContact CG1-CG1 4.1Å; Y148-V152 HydrophobicContact CD2-CG2 4.31Å; Y148-V152 PolarHBondContact O-N 3.28Å; Y149-V152 PolarHBondContact O-N 3.49Å; V152-F154 VanDerWaalsContact C-N 3.3Å; V152-F154 PolarHBondContact O-N 2.92Å; V152-V155 PolarHBondContact O-N 3.32Å; V152-L156 HydrophobicContact CG1-CD1 3.95Å; V152-L156 HydrophobicContact CG1-CG 4.36Å; V152-L156 WeakPolarHBondContact O-CG 3.33Å; V152-L156 PolarHBondContact O-N 2.97Å; V152-F268 HydrophobicContact CG2-CE1 4.13Å; V152-F268 HydrophobicContact CG2-CZ 4.36Å; V152-T328 HydrophobicContact CG2-CG2 4.13Å
153	P	91.1	Very high	90.8	Very high	8 Å²	8	53.6 Å²	53.6	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-34.4	-177.6	25.6	-35.6	0	0	0	113.1	V90 S91 A157	V90-P153 HydrophobicContact CG1-CB 4.49Å; S91-P153 WeakPolarHBondContact OG-CB 3.46Å; P153-A157 WeakPolarHBondContact O-CB 3.49Å; P153-A157 PolarHBondContact O-N 3.49Å
154	F	92.3	Very high	91.1	Very high	104 Å²	104	47.7 Å²	47.7	46%	0.456	23%	0.233	S	C	.	.	H	α-helix	trans	-71.2	-41.3	177.9	-59	-66.4	0	0	0	111.6	W151 V152 A157 I158	W151-F154 HydrophobicContact CE3-CD2 4.32Å; W151-F154 PolarHBondContact O-N 3.22Å; V152-F154 VanDerWaalsContact C-N 3.3Å; V152-F154 PolarHBondContact O-N 2.92Å; F154-A157 PolarHBondContact O-N 3.28Å; F154-I158 WeakPolarHBondContact O-CG1 3.38Å; F154-I158 PolarHBondContact O-N 3.49Å
155	V	93.2	Very high	91.5	Very high	25 Å²	25	46.1 Å²	46.1	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-51.2	175.2	173.1	0	0	0	0	109.7	W151 V152 A157 I158 E159 L264 F268	W151-V155 HydrophobicContact CB-CG2 4.44Å; W151-V155 WeakPolarHBondContact O-CG2 3.35Å; W151-V155 PolarHBondContact O-N 2.99Å; V152-V155 PolarHBondContact O-N 3.32Å; V155-A157 VanDerWaalsContact C-N 3.28Å; V155-A157 PolarHBondContact O-N 2.9Å; V155-I158 WeakPolarHBondContact O-CA 3.15Å; V155-I158 WeakPolarHBondContact O-CB 3.43Å; V155-I158 PolarHBondContact O-N 3.21Å; V155-E159 HydrophobicContact CG1-CG 4.23Å; V155-E159 WeakPolarHBondContact O-CG 3.44Å; V155-E159 PolarHBondContact O-N 2.93Å; V155-L264 HydrophobicContact CG1-CD2 4.01Å; V155-F268 HydrophobicContact CB-CZ 4.44Å; V155-F268 HydrophobicContact CG1-CD1 4.44Å; V155-F268 HydrophobicContact CG2-CD2 4.14Å; V155-F268 HydrophobicContact CG2-CE1 4.33Å; V155-F268 HydrophobicContact CG2-CE2 3.7Å; V155-F268 HydrophobicContact CG2-CZ 3.81Å
156	L	94	Very high	91.9	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-56.9	-40.2	177.2	-66.9	174.2	0	0	0	112.4	I83 M86 A87 V90 V152 I158 E159 A160 I331 L335	I83-L156 HydrophobicContact CG2-CB 4.02Å; I83-L156 HydrophobicContact CG2-CD2 4.22Å; I83-L156 WeakPolarHBondContact CG2-O 3.36Å; M86-L156 HydrophobicContact CB-CD1 4.43Å; A87-L156 HydrophobicContact CB-CB 3.81Å; A87-L156 HydrophobicContact CB-CD1 4.37Å; V90-L156 HydrophobicContact CG2-CD1 4.4Å; V152-L156 HydrophobicContact CG1-CD1 3.95Å; V152-L156 HydrophobicContact CG1-CG 4.36Å; V152-L156 WeakPolarHBondContact O-CG 3.33Å; V152-L156 PolarHBondContact O-N 2.97Å; L156-I158 PolarHBondContact O-N 3.35Å; L156-E159 PolarHBondContact O-N 2.97Å; L156-A160 WeakPolarHBondContact O-CB 3.27Å; L156-A160 PolarHBondContact O-N 3.03Å; L156-I331 HydrophobicContact CD1-CG2 4.48Å; L156-L335 HydrophobicContact CD2-CD1 3.57Å
157	A	92.3	Very high	92.2	Very high	54 Å²	54	41 Å²	41	45%	0.446	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-38.9	176	0	0	0	0	0	112.7	P153 F154 V155 L161	P153-A157 WeakPolarHBondContact O-CB 3.49Å; P153-A157 PolarHBondContact O-N 3.49Å; F154-A157 PolarHBondContact O-N 3.28Å; V155-A157 VanDerWaalsContact C-N 3.28Å; V155-A157 PolarHBondContact O-N 2.9Å; A157-L161 PolarHBondContact O-N 3.41Å; A157-L161 VanDerWaalsContact O-N 3.15Å
158	I	94.2	Very high	92.4	Very high	95 Å²	95	42.1 Å²	42.1	49%	0.487	22%	0.215	S	C	.	.	H	α-helix	trans	-68.1	-43	175.2	-67.9	166	0	0	0	110.6	F154 V155 L156 A160 L161 M162	F154-I158 WeakPolarHBondContact O-CG1 3.38Å; F154-I158 PolarHBondContact O-N 3.49Å; V155-I158 WeakPolarHBondContact O-CA 3.15Å; V155-I158 WeakPolarHBondContact O-CB 3.43Å; V155-I158 PolarHBondContact O-N 3.21Å; L156-I158 PolarHBondContact O-N 3.35Å; I158-A160 VanDerWaalsContact C-N 3.34Å; I158-A160 PolarHBondContact O-N 3.41Å; I158-L161 WeakPolarHBondContact O-CB 3.46Å; I158-L161 PolarHBondContact O-N 2.86Å; I158-M162 HydrophobicContact CG2-CG 4.36Å; I158-M162 HydrophobicContact CG2-SD 4.03Å; I158-M162 WeakPolarHBondContact O-CG 3.4Å; I158-M162 PolarHBondContact O-N 3.33Å
159	E	94.8	Very high	92.7	Very high	2 Å²	2	42 Å²	42	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-47.6	175.6	-65.2	-172.3	166.4	0	0	110.9	I83 V155 L156 L161 M162 F163 L264	I83-E159 HydrophobicContact CD1-CB 4.26Å; I83-E159 HydrophobicContact CG2-CB 4.35Å; V155-E159 HydrophobicContact CG1-CG 4.23Å; V155-E159 WeakPolarHBondContact O-CG 3.44Å; V155-E159 PolarHBondContact O-N 2.93Å; L156-E159 PolarHBondContact O-N 2.97Å; E159-L161 VanDerWaalsContact C-N 3.3Å; E159-L161 PolarHBondContact O-N 3.25Å; E159-M162 PolarHBondContact O-N 3.25Å; E159-M162 VanDerWaalsContact O-N 3.16Å; E159-F163 VanDerWaalsContact O-CD2 3.29Å; E159-F163 WeakPolarHBondContact O-CD2 3.38Å; E159-F163 PolarHBondContact O-N 2.95Å; E159-L264 HydrophobicContact CG-CD2 4.44Å
160	A	94.3	Very high	93	Very high	4 Å²	4	41.9 Å²	41.9	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-42.8	176.6	0	0	0	0	0	112.5	T80 I83 I84 L156 I158 F163 Y164	T80-A160 HydrophobicContact CG2-CB 4.23Å; T80-A160 PolarHBondContact OG1-O 3.24Å; I83-A160 HydrophobicContact CB-CB 4.2Å; I83-A160 HydrophobicContact CG2-CB 3.84Å; I84-A160 HydrophobicContact CD1-CB 4.45Å; I84-A160 HydrophobicContact CG1-CB 3.77Å; L156-A160 WeakPolarHBondContact O-CB 3.27Å; L156-A160 PolarHBondContact O-N 3.03Å; I158-A160 VanDerWaalsContact C-N 3.34Å; I158-A160 PolarHBondContact O-N 3.41Å; A160-F163 PolarHBondContact O-N 3.44Å; A160-Y164 PolarHBondContact O-N 3.18Å
161	L	93.2	Very high	93.1	Very high	111 Å²	111	41.4 Å²	41.4	58%	0.581	21%	0.214	S	C	*	.	H	α-helix	trans	-64	-45	176.5	179.5	63.5	0	0	0	111.4	A157 I158 E159 F163 Y164 V165	A157-L161 PolarHBondContact O-N 3.41Å; A157-L161 VanDerWaalsContact O-N 3.15Å; I158-L161 WeakPolarHBondContact O-CB 3.46Å; I158-L161 PolarHBondContact O-N 2.86Å; E159-L161 VanDerWaalsContact C-N 3.3Å; E159-L161 PolarHBondContact O-N 3.25Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.38Å; L161-Y164 WeakPolarHBondContact O-CB 3.32Å; L161-Y164 PolarHBondContact O-N 3.44Å; L161-V165 WeakPolarHBondContact O-CG2 3.19Å; L161-V165 PolarHBondContact O-N 3.16Å
162	M	95.3	Very high	93	Very high	68 Å²	68	40.9 Å²	40.9	34%	0.335	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-36.6	179.7	-73.4	178.4	69.4	0	0	112.5	I158 E159 Y164 V165 P166 Q261	I158-M162 HydrophobicContact CG2-CG 4.36Å; I158-M162 HydrophobicContact CG2-SD 4.03Å; I158-M162 WeakPolarHBondContact O-CG 3.4Å; I158-M162 PolarHBondContact O-N 3.33Å; E159-M162 PolarHBondContact O-N 3.25Å; E159-M162 VanDerWaalsContact O-N 3.16Å; M162-Y164 PolarHBondContact O-N 3.17Å; M162-V165 PolarHBondContact O-N 3.26Å; M162-P166 WeakPolarHBondContact O-CD 3.31Å; M162-Q261 VanDerWaalsContact CE-NE2 3.29Å; M162-Q261 PolarHBondContact SD-NE2 3.3Å
163	F	95.7	Very high	92.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-25.6	172.2	-85	-75.4	0	0	0	114.1	N75 T79 T80 I83 E159 A160 L161 N257 V258 Q261 F339 L342	N75-F163 HydrophobicContact CB-CD1 4.44Å; T79-F163 HydrophobicContact CG2-CD1 4.09Å; T79-F163 HydrophobicContact CG2-CD2 3.97Å; T79-F163 HydrophobicContact CG2-CE1 3.9Å; T79-F163 HydrophobicContact CG2-CE2 3.76Å; T79-F163 HydrophobicContact CG2-CG 4.14Å; T79-F163 HydrophobicContact CG2-CZ 3.74Å; T80-F163 VanDerWaalsContact OG1-CB 3.25Å; T80-F163 WeakPolarHBondContact OG1-CB 3.42Å; I83-F163 HydrophobicContact CD1-CD2 3.61Å; I83-F163 HydrophobicContact CD1-CE2 3.64Å; E159-F163 VanDerWaalsContact O-CD2 3.29Å; E159-F163 WeakPolarHBondContact O-CD2 3.38Å; E159-F163 PolarHBondContact O-N 2.95Å; A160-F163 PolarHBondContact O-N 3.44Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.38Å; F163-N257 WeakPolarHBondContact CA-ND2 3.37Å; F163-N257 WeakPolarHBondContact CD1-ND2 3.47Å; F163-N257 WeakPolarHBondContact CE1-ND2 3.49Å; F163-N257 WeakPolarHBondContact CG-ND2 3.26Å; F163-V258 HydrophobicContact CE1-CG2 3.77Å; F163-V258 HydrophobicContact CZ-CG2 4.47Å; F163-Q261 HydrophobicContact CD2-CG 4.34Å; F163-Q261 HydrophobicContact CE2-CB 4.25Å; F163-Q261 HydrophobicContact CE2-CG 3.62Å; F163-Q261 HydrophobicContact CZ-CB 4.24Å; F163-Q261 HydrophobicContact CZ-CG 3.83Å; F163-F339 HydrophobicContact CE2-CD1 4.45Å; F163-F339 AromaticContact CE2-CE1 3.55Å; F163-F339 HydrophobicContact CE2-CE1 3.55Å; F163-F339 AromaticContact CE2-CZ 3.7Å; F163-F339 HydrophobicContact CE2-CZ 3.7Å; F163-F339 AromaticContact CZ-CD1 3.95Å; F163-F339 HydrophobicContact CZ-CD1 3.95Å; F163-F339 AromaticContact CZ-CE1 3.48Å; F163-F339 HydrophobicContact CZ-CE1 3.48Å; F163-F339 VanDerWaalsContact CZ-CE1 3.48Å; F163-F339 HydrophobicContact CZ-CZ 4.01Å; F163-L342 HydrophobicContact CE1-CD2 3.68Å; F163-L342 HydrophobicContact CZ-CD2 4.15Å
164	Y	93	Very high	92.7	Very high	39 Å²	39	42.3 Å²	42.3	15%	0.153	22%	0.222	C	C	.	.	H	α-helix	trans	-84.9	-19.8	177.6	-176.7	-107.3	0	0	0	113.8	S61 I62 A160 L161 M162 T167 S168 R171	S61-Y164 VanDerWaalsContact CB-OH 3.26Å; S61-Y164 WeakPolarHBondContact CB-OH 3.27Å; S61-Y164 PolarHBondContact O-OH 3.09Å; S61-Y164 PolarHBondContact OG-OH 3.3Å; I62-Y164 HydrophobicContact CG1-CD2 4.06Å; I62-Y164 HydrophobicContact CG1-CE2 4.06Å; A160-Y164 PolarHBondContact O-N 3.18Å; L161-Y164 WeakPolarHBondContact O-CB 3.32Å; L161-Y164 PolarHBondContact O-N 3.44Å; M162-Y164 PolarHBondContact O-N 3.17Å; Y164-T167 PolarHBondContact O-N 2.89Å; Y164-S168 WeakPolarHBondContact CD1-OG 3.37Å; Y164-S168 WeakPolarHBondContact CE1-OG 3.35Å; Y164-S168 PolarHBondContact O-N 3.36Å; Y164-S168 PolarHBondContact O-OG 2.83Å; Y164-R171 PolarHBondContact OH-NH1 3.4Å
165	V	93.6	Very high	92.3	Very high	71 Å²	71	41.4 Å²	41.4	43%	0.43	23%	0.234	S	C	.	.	H	α-helix	trans	-58.1	-48.3	-177	170.2	0	0	0	0	113.2	L161 M162 T167 S168 V169	L161-V165 WeakPolarHBondContact O-CG2 3.19Å; L161-V165 PolarHBondContact O-N 3.16Å; M162-V165 PolarHBondContact O-N 3.26Å; V165-T167 VanDerWaalsContact C-N 3.29Å; V165-T167 PolarHBondContact O-N 3.2Å; V165-S168 WeakPolarHBondContact O-CB 3.46Å; V165-S168 PolarHBondContact O-N 3.38Å; V165-S168 VanDerWaalsContact O-N 3.07Å; V165-V169 HydrophobicContact CG1-CG2 4.29Å; V165-V169 WeakPolarHBondContact O-CG2 3.32Å; V165-V169 PolarHBondContact O-N 3.09Å
166	P	94.7	Very high	91.7	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-37.5	-177	-24.9	34.6	0	0	0	113.4	M162 V169 W170 V250 L253 Y254	M162-P166 WeakPolarHBondContact O-CD 3.31Å; P166-V169 WeakPolarHBondContact O-CB 3.18Å; P166-V169 PolarHBondContact O-N 3.13Å; P166-W170 PolarHBondContact O-N 3.35Å; P166-V250 HydrophobicContact CB-CG1 4.27Å; P166-L253 HydrophobicContact CB-CB 4.03Å; P166-L253 HydrophobicContact CG-CB 4.14Å; P166-Y254 HydrophobicContact CB-CD1 3.65Å; P166-Y254 HydrophobicContact CB-CD2 4.18Å; P166-Y254 HydrophobicContact CB-CE1 3.58Å; P166-Y254 HydrophobicContact CB-CE2 4.14Å; P166-Y254 HydrophobicContact CB-CG 3.95Å; P166-Y254 HydrophobicContact CG-CD1 3.76Å; P166-Y254 HydrophobicContact CG-CE1 3.99Å; P166-Y254 HydrophobicContact CG-CG 4.29Å
167	T	92.9	Very high	90.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-38.6	176.1	-37.5	0	0	0	0	111.9	Y76 Y164 V165 V169 W170 R171 Y254	Y76-T167 WeakPolarHBondContact CB-OG1 3.45Å; Y76-T167 HydrophobicContact CD1-CG2 3.94Å; Y76-T167 VanDerWaalsContact CD1-OG1 3.25Å; Y76-T167 WeakPolarHBondContact CD1-OG1 3.36Å; Y76-T167 HydrophobicContact CD2-CG2 4.16Å; Y76-T167 HydrophobicContact CE1-CG2 4.03Å; Y76-T167 HydrophobicContact CE2-CG2 4.28Å; Y76-T167 HydrophobicContact CG-CG2 4.01Å; Y164-T167 PolarHBondContact O-N 2.89Å; V165-T167 VanDerWaalsContact C-N 3.29Å; V165-T167 PolarHBondContact O-N 3.2Å; T167-V169 VanDerWaalsContact C-N 3.3Å; T167-V169 PolarHBondContact O-N 3.02Å; T167-W170 WeakPolarHBondContact O-CB 3.35Å; T167-W170 PolarHBondContact O-N 3.37Å; T167-R171 VanDerWaalsContact O-CG 3.3Å; T167-R171 WeakPolarHBondContact O-CG 3.2Å; T167-R171 PolarHBondContact O-N 2.97Å; T167-Y254 PolarHBondContact OG1-OH 3.02Å
168	S	91.6	Very high	90.3	Very high	45 Å²	45	45.8 Å²	45.8	32%	0.315	26%	0.26	S	S	.	.	H	α-helix	trans	-61.6	-41.6	174.4	-63.7	0	0	0	0	111.2	Y164 V165 R171 F172	Y164-S168 WeakPolarHBondContact CD1-OG 3.37Å; Y164-S168 WeakPolarHBondContact CE1-OG 3.35Å; Y164-S168 PolarHBondContact O-N 3.36Å; Y164-S168 PolarHBondContact O-OG 2.83Å; V165-S168 WeakPolarHBondContact O-CB 3.46Å; V165-S168 PolarHBondContact O-N 3.38Å; V165-S168 VanDerWaalsContact O-N 3.07Å; S168-R171 PolarHBondContact O-N 3.25Å; S168-F172 WeakPolarHBondContact O-CB 3.2Å; S168-F172 PolarHBondContact O-N 2.95Å
169	V	92.7	Very high	89.8	Confident	37 Å²	37	41.7 Å²	41.7	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-46.9	174.4	175.1	0	0	0	0	110.9	V165 P166 T167 R171 F172 M173 F249 V250 L253	V165-V169 HydrophobicContact CG1-CG2 4.29Å; V165-V169 WeakPolarHBondContact O-CG2 3.32Å; V165-V169 PolarHBondContact O-N 3.09Å; P166-V169 WeakPolarHBondContact O-CB 3.18Å; P166-V169 PolarHBondContact O-N 3.13Å; T167-V169 VanDerWaalsContact C-N 3.3Å; T167-V169 PolarHBondContact O-N 3.02Å; V169-R171 PolarHBondContact O-N 3.07Å; V169-F172 PolarHBondContact O-N 3.14Å; V169-M173 HydrophobicContact CG1-CG 4.21Å; V169-M173 HydrophobicContact CG1-SD 3.53Å; V169-M173 VanDerWaalsContact CG1-SD 3.53Å; V169-M173 WeakPolarHBondContact O-CB 3.47Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.32Å; V169-M173 PolarHBondContact O-N 2.91Å; V169-F249 HydrophobicContact CG1-CE1 4.14Å; V169-V250 HydrophobicContact CG1-CG2 4.22Å; V169-L253 HydrophobicContact CB-CD1 4.26Å; V169-L253 HydrophobicContact CG1-CD1 4.02Å; V169-L253 HydrophobicContact CG2-CD1 4.24Å
170	W	92.8	Very high	89.4	Confident	3 Å²	3	46 Å²	46	1%	0.011	26%	0.262	C	S	.	.	H	α-helix	trans	-55.2	-53.8	175.7	173.6	-117.2	0	0	0	112	D67 P166 T167 F172 M173 N174 V243 I246 Y247 V250 F401	D67-W170 PolarHBondContact OD2-NE1 2.96Å; P166-W170 PolarHBondContact O-N 3.35Å; T167-W170 WeakPolarHBondContact O-CB 3.35Å; T167-W170 PolarHBondContact O-N 3.37Å; W170-F172 VanDerWaalsContact C-N 3.33Å; W170-F172 PolarHBondContact O-N 3.29Å; W170-M173 PolarHBondContact O-N 3.02Å; W170-N174 HydrophobicContact CD2-CB 4.25Å; W170-N174 HydrophobicContact CE3-CB 4.44Å; W170-N174 HydrophobicContact CH2-CB 4.45Å; W170-N174 HydrophobicContact CZ2-CB 4.27Å; W170-N174 WeakPolarHBondContact O-CB 2.97Å; W170-N174 PolarHBondContact O-N 3.37Å; W170-V243 HydrophobicContact CH2-CG1 4.08Å; W170-I246 HydrophobicContact CE3-CG2 3.84Å; W170-I246 HydrophobicContact CZ3-CB 4.46Å; W170-I246 HydrophobicContact CZ3-CG2 3.93Å; W170-Y247 HydrophobicContact CD2-CD2 4.17Å; W170-Y247 AromaticContact CE3-CD2 3.8Å; W170-Y247 HydrophobicContact CE3-CD2 3.8Å; W170-Y247 AromaticContact CH2-CD2 3.54Å; W170-Y247 HydrophobicContact CH2-CD2 3.54Å; W170-Y247 HydrophobicContact CH2-CE2 4.41Å; W170-Y247 HydrophobicContact CH2-CG 4.19Å; W170-Y247 AromaticContact CZ2-CD2 3.91Å; W170-Y247 HydrophobicContact CZ2-CD2 3.91Å; W170-Y247 HydrophobicContact CZ2-CE2 4.36Å; W170-Y247 AromaticContact CZ3-CD2 3.5Å; W170-Y247 HydrophobicContact CZ3-CD2 3.5Å; W170-Y247 HydrophobicContact CZ3-CG 4.06Å; W170-V250 HydrophobicContact CB-CG1 4.06Å; W170-V250 HydrophobicContact CB-CG2 3.88Å; W170-V250 HydrophobicContact CE3-CG2 4.28Å; W170-F401 HydrophobicContact CH2-CE1 4.38Å; W170-F401 HydrophobicContact CH2-CZ 4.42Å
171	R	90.2	Very high	89.2	Confident	33 Å²	33	45.9 Å²	45.9	13%	0.125	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-40.1	-176.4	-68.9	170.2	178.2	-179.1	-1.2	112.2	S61 E63 Y164 T167 S168 V169 A175	S61-R171 PolarHBondContact O-NH1 3.35Å; S61-R171 PolarHBondContact O-NH2 3.35Å; E63-R171 PolarHBondContact O-NH2 3.43Å; Y164-R171 PolarHBondContact OH-NH1 3.4Å; T167-R171 VanDerWaalsContact O-CG 3.3Å; T167-R171 WeakPolarHBondContact O-CG 3.2Å; T167-R171 PolarHBondContact O-N 2.97Å; S168-R171 PolarHBondContact O-N 3.25Å; V169-R171 PolarHBondContact O-N 3.07Å; R171-A175 PolarHBondContact O-N 2.88Å
172	F	89.1	Confident	89.2	Confident	142 Å²	142	42.5 Å²	42.5	62%	0.623	24%	0.243	S	C	*	.	H	α-helix	trans	-68.2	-45.8	178	179.8	-102.4	0	0	0	112.3	S168 V169 W170	S168-F172 WeakPolarHBondContact O-CB 3.2Å; S168-F172 PolarHBondContact O-N 2.95Å; V169-F172 PolarHBondContact O-N 3.14Å; W170-F172 VanDerWaalsContact C-N 3.33Å; W170-F172 PolarHBondContact O-N 3.29Å
173	M	87.9	Confident	89	Confident	32 Å²	32	40.2 Å²	40.2	16%	0.158	24%	0.237	C	C	.	.	H	α-helix	trans	-76.7	-37	-176.7	-65.1	-176.6	78.8	0	0	112.6	V169 W170 A175 Q176 I246 F249	V169-M173 HydrophobicContact CG1-CG 4.21Å; V169-M173 HydrophobicContact CG1-SD 3.53Å; V169-M173 VanDerWaalsContact CG1-SD 3.53Å; V169-M173 WeakPolarHBondContact O-CB 3.47Å; V169-M173 VanDerWaalsContact O-CG 3.29Å; V169-M173 WeakPolarHBondContact O-CG 3.32Å; V169-M173 PolarHBondContact O-N 2.91Å; W170-M173 PolarHBondContact O-N 3.02Å; M173-A175 VanDerWaalsContact C-N 3.28Å; M173-A175 PolarHBondContact O-N 3.37Å; M173-Q176 PolarHBondContact O-N 3Å; M173-Q176 VanDerWaalsContact O-N 3.07Å; M173-I246 HydrophobicContact CB-CD1 3.96Å; M173-I246 HydrophobicContact CB-CG2 3.74Å; M173-I246 HydrophobicContact CE-CD1 3.96Å; M173-I246 HydrophobicContact CE-CG1 3.77Å; M173-I246 HydrophobicContact CE-CG2 4.41Å; M173-I246 HydrophobicContact SD-CG2 4.13Å; M173-F249 HydrophobicContact SD-CD1 4.47Å
174	N	87.8	Confident	88.9	Confident	14 Å²	14	40.3 Å²	40.3	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-37.9	177.4	-174.3	27.7	0	0	0	111.4	W170 Q176 S177 V181	W170-N174 HydrophobicContact CD2-CB 4.25Å; W170-N174 HydrophobicContact CE3-CB 4.44Å; W170-N174 HydrophobicContact CH2-CB 4.45Å; W170-N174 HydrophobicContact CZ2-CB 4.27Å; W170-N174 WeakPolarHBondContact O-CB 2.97Å; W170-N174 PolarHBondContact O-N 3.37Å; N174-Q176 PolarHBondContact O-N 3.41Å; N174-Q176 VanDerWaalsContact O-N 3.13Å; N174-S177 WeakPolarHBondContact O-CB 3.34Å; N174-S177 PolarHBondContact O-N 2.97Å; N174-S177 PolarHBondContact O-OG 3.44Å; N174-V181 WeakPolarHBondContact OD1-CG2 3.28Å
175	A	84.2	Confident	88.9	Confident	85 Å²	85	38.5 Å²	38.5	70%	0.702	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23	175.6	0	0	0	0	0	113.8	R171 M173	R171-A175 PolarHBondContact O-N 2.88Å; M173-A175 VanDerWaalsContact C-N 3.28Å; M173-A175 PolarHBondContact O-N 3.37Å
176	Q	81.1	Confident	88.9	Confident	109 Å²	109	40.2 Å²	40.2	51%	0.509	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-5.3	179	-59.8	-177.2	6.1	0	0	113.7	M173 N174 G178	M173-Q176 PolarHBondContact O-N 3Å; M173-Q176 VanDerWaalsContact O-N 3.07Å; N174-Q176 PolarHBondContact O-N 3.41Å; N174-Q176 VanDerWaalsContact O-N 3.13Å; Q176-G178 VanDerWaalsContact C-N 3.3Å; Q176-G178 PolarHBondContact O-N 3.36Å
177	S	78.5	Confident	88.9	Confident	11 Å²	11	42.5 Å²	42.5	8%	0.077	25%	0.246	C	C	.	.	S	Bend	trans	-74.1	-18.9	-174	71.3	0	0	0	0	114.8	N174 I179 Q217 Y242	N174-S177 WeakPolarHBondContact O-CB 3.34Å; N174-S177 PolarHBondContact O-N 2.97Å; N174-S177 PolarHBondContact O-OG 3.44Å; S177-I179 PolarHBondContact O-N 2.95Å; S177-I179 PolarHBondContact OG-N 3.41Å; S177-I179 VanDerWaalsContact OG-N 3.15Å; S177-I179 PolarHBondContact OG-O 3.4Å; S177-Q217 PolarHBondContact O-NE2 3.12Å; S177-Y242 VanDerWaalsContact CA-CE1 3.47Å
178	G	78.8	Confident	89	Confident	57 Å²	57	42.6 Å²	42.6	59%	0.588	25%	0.247	S	C	*	.	S	Bend	trans	76.7	-7.3	-170.8	0	0	0	0	0	114.1	Q176	Q176-G178 VanDerWaalsContact C-N 3.3Å; Q176-G178 PolarHBondContact O-N 3.36Å
179	I	82.8	Confident	89	Confident	9 Å²	9	43.1 Å²	43.1	5%	0.046	25%	0.248	C	C	.	.			trans	-100.6	118.3	172.5	-55.8	-174.1	0	0	0	107.7	S177 V181 A213 Q217 V243 L402	S177-I179 PolarHBondContact O-N 2.95Å; S177-I179 PolarHBondContact OG-N 3.41Å; S177-I179 VanDerWaalsContact OG-N 3.15Å; S177-I179 PolarHBondContact OG-O 3.4Å; I179-V181 HydrophobicContact CB-CG2 4.34Å; I179-V181 HydrophobicContact CG2-CG2 3.94Å; I179-V181 PolarHBondContact O-N 3.5Å; I179-A213 HydrophobicContact CG1-CB 4.22Å; I179-Q217 VanDerWaalsContact CD1-NE2 3.28Å; I179-V243 HydrophobicContact CD1-CG2 4.22Å; I179-L402 HydrophobicContact CG2-CD2 4.3Å
180	N	87.1	Confident	89.1	Confident	92 Å²	92	42.9 Å²	42.9	49%	0.492	25%	0.245	S	C	.	.			trans	-76	75.5	171.1	-172.1	2.7	0	0	0	110.3	L182 G183 V184	N180-L182 PolarHBondContact O-N 3.05Å; N180-G183 PolarHBondContact O-N 3.02Å; N180-G183 PolarHBondContact OD1-N 3Å; N180-V184 WeakPolarHBondContact O-CG2 3.43Å; N180-V184 PolarHBondContact O-N 3.37Å
181	V	91.1	Very high	89.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-56.7	-41.6	-178.9	178.6	0	0	0	0	111.1	D67 N174 I179 V184 L185 V243 L402	D67-V181 HydrophobicContact CB-CG1 4.47Å; N174-V181 WeakPolarHBondContact OD1-CG2 3.28Å; I179-V181 HydrophobicContact CB-CG2 4.34Å; I179-V181 HydrophobicContact CG2-CG2 3.94Å; I179-V181 PolarHBondContact O-N 3.5Å; V181-V184 PolarHBondContact O-N 2.65Å; V181-L185 HydrophobicContact CG1-CD1 3.9Å; V181-L185 WeakPolarHBondContact O-CG 3.5Å; V181-L185 PolarHBondContact O-N 2.99Å; V181-V243 HydrophobicContact CG2-CG1 4.06Å; V181-L402 HydrophobicContact CB-CD1 4.38Å; V181-L402 HydrophobicContact CG1-CD1 3.9Å; V181-L402 HydrophobicContact CG2-CD1 4.26Å
182	L	91.8	Very high	89.2	Confident	39 Å²	39	53.5 Å²	53.5	20%	0.204	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-51.6	177.6	179.6	63.8	0	0	0	110.9	R65 V66 D67 N180 V184 L185 E186	R65-L182 HydrophobicContact CB-CD1 4.5Å; V66-L182 HydrophobicContact CG2-CD1 3.68Å; D67-L182 HydrophobicContact CB-CD1 4.41Å; N180-L182 PolarHBondContact O-N 3.05Å; L182-V184 VanDerWaalsContact C-N 3.31Å; L182-V184 PolarHBondContact O-N 2.75Å; L182-L185 PolarHBondContact O-N 2.85Å; L182-L185 VanDerWaalsContact O-N 3.13Å; L182-E186 HydrophobicContact CD1-CG 4.12Å; L182-E186 HydrophobicContact CG-CG 4.29Å; L182-E186 WeakPolarHBondContact O-CB 3.42Å; L182-E186 WeakPolarHBondContact O-CG 3.25Å; L182-E186 PolarHBondContact O-N 3.36Å
183	G	91.6	Very high	89.3	Confident	21 Å²	21	47.4 Å²	47.4	22%	0.216	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-35	179.6	0	0	0	0	0	113.7	N180 L187	N180-G183 PolarHBondContact O-N 3.02Å; N180-G183 PolarHBondContact OD1-N 3Å; G183-L187 WeakPolarHBondContact O-CB 3.45Å; G183-L187 PolarHBondContact O-N 3.31Å; G183-L187 VanDerWaalsContact O-N 3.09Å
184	V	92.8	Very high	89.5	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-47.2	172.9	165.9	0	0	0	0	110.3	N180 V181 L182 A188 L206 I210 L402 V406	N180-V184 WeakPolarHBondContact O-CG2 3.43Å; N180-V184 PolarHBondContact O-N 3.37Å; V181-V184 PolarHBondContact O-N 2.65Å; L182-V184 VanDerWaalsContact C-N 3.31Å; L182-V184 PolarHBondContact O-N 2.75Å; V184-A188 WeakPolarHBondContact O-CB 3.36Å; V184-A188 PolarHBondContact O-N 3.34Å; V184-L206 HydrophobicContact CB-CD1 3.94Å; V184-L206 HydrophobicContact CG1-CD1 3.45Å; V184-L206 VanDerWaalsContact CG1-CD1 3.45Å; V184-L206 HydrophobicContact CG1-CG 4.4Å; V184-L206 HydrophobicContact CG2-CD1 3.94Å; V184-I210 HydrophobicContact CG1-CD1 4.38Å; V184-L402 HydrophobicContact CB-CD1 4.4Å; V184-L402 HydrophobicContact CG1-CD1 3.87Å; V184-L402 HydrophobicContact CG1-CD2 3.94Å; V184-L402 HydrophobicContact CG1-CG 3.95Å; V184-L402 HydrophobicContact CG2-CD2 4.41Å; V184-V406 HydrophobicContact CG1-CG2 4.25Å
185	L	94	Very high	89.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-73.7	-36.4	-177.9	-70.1	171.6	0	0	0	112.9	V66 D67 V181 L182 A188 T189 M405 V406	V66-L185 HydrophobicContact CG2-CB 3.98Å; D67-L185 HydrophobicContact CB-CD1 3.92Å; V181-L185 HydrophobicContact CG1-CD1 3.9Å; V181-L185 WeakPolarHBondContact O-CG 3.5Å; V181-L185 PolarHBondContact O-N 2.99Å; L182-L185 PolarHBondContact O-N 2.85Å; L182-L185 VanDerWaalsContact O-N 3.13Å; L185-A188 PolarHBondContact O-N 3.4Å; L185-T189 VanDerWaalsContact O-CB 3.32Å; L185-T189 WeakPolarHBondContact O-CB 3.12Å; L185-T189 PolarHBondContact O-N 3.38Å; L185-T189 PolarHBondContact O-OG1 3Å; L185-M405 HydrophobicContact CD1-CB 4.32Å; L185-M405 HydrophobicContact CD2-CB 4.05Å; L185-V406 HydrophobicContact CD2-CB 4.43Å; L185-V406 HydrophobicContact CD2-CG2 3.79Å
186	E	94.3	Very high	90	Very high	108 Å²	108	56 Å²	56	51%	0.505	31%	0.307	S	S	.	.	H	α-helix	trans	-60.8	-45.5	173.4	-75.4	176.8	166	0	0	111.1	V66 L182 T189 D190	V66-E186 HydrophobicContact CG2-CG 3.66Å; L182-E186 HydrophobicContact CD1-CG 4.12Å; L182-E186 HydrophobicContact CG-CG 4.29Å; L182-E186 WeakPolarHBondContact O-CB 3.42Å; L182-E186 WeakPolarHBondContact O-CG 3.25Å; L182-E186 PolarHBondContact O-N 3.36Å; E186-T189 PolarHBondContact O-N 3.39Å; E186-D190 PolarHBondContact O-N 3.46Å
187	L	93.8	Very high	90.5	Very high	52 Å²	52	58.2 Å²	58.2	27%	0.272	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-38.7	177.2	-175.1	63.7	0	0	0	111.8	G183 D190 N193 T202 V205	G183-L187 WeakPolarHBondContact O-CB 3.45Å; G183-L187 PolarHBondContact O-N 3.31Å; G183-L187 VanDerWaalsContact O-N 3.09Å; L187-D190 WeakPolarHBondContact O-CB 3.35Å; L187-D190 PolarHBondContact O-N 2.94Å; L187-N193 PolarHBondContact O-ND2 2.98Å; L187-T202 HydrophobicContact CD1-CG2 4.36Å; L187-T202 HydrophobicContact CD2-CG2 4.36Å; L187-T202 HydrophobicContact CG-CG2 3.84Å; L187-V205 HydrophobicContact CD2-CB 4.36Å; L187-V205 HydrophobicContact CD2-CG1 3.83Å
188	A	94.1	Very high	91.2	Very high	2 Å²	2	61.1 Å²	61.1	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-69	-36.6	178.7	0	0	0	0	0	112.4	V184 L185 D190 N193 L206 V406 T410 L414	V184-A188 WeakPolarHBondContact O-CB 3.36Å; V184-A188 PolarHBondContact O-N 3.34Å; L185-A188 PolarHBondContact O-N 3.4Å; A188-D190 VanDerWaalsContact C-N 3.29Å; A188-D190 PolarHBondContact O-N 2.84Å; A188-N193 PolarHBondContact O-ND2 3.38Å; A188-L206 HydrophobicContact CB-CD2 4.06Å; A188-V406 HydrophobicContact CB-CG1 4.07Å; A188-V406 HydrophobicContact CB-CG2 4.3Å; A188-T410 HydrophobicContact CB-CG2 3.69Å; A188-T410 WeakPolarHBondContact O-CG2 3.5Å; A188-L414 HydrophobicContact CB-CD2 4.23Å
189	T	93.6	Very high	91.9	Very high	55 Å²	55	61 Å²	61	34%	0.337	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	5.9	-178.9	-40.8	0	0	0	0	112.6	L185 E186	L185-T189 VanDerWaalsContact O-CB 3.32Å; L185-T189 WeakPolarHBondContact O-CB 3.12Å; L185-T189 PolarHBondContact O-N 3.38Å; L185-T189 PolarHBondContact O-OG1 3Å; E186-T189 PolarHBondContact O-N 3.39Å
190	D	94	Very high	92.4	Very high	32 Å²	32	65.3 Å²	65.3	17%	0.171	34%	0.336	C	S	.	.			trans	-59.7	126	178.6	-169.6	-39.9	0	0	0	110.6	E186 L187 A188 R192 N193	E186-D190 PolarHBondContact O-N 3.46Å; L187-D190 WeakPolarHBondContact O-CB 3.35Å; L187-D190 PolarHBondContact O-N 2.94Å; A188-D190 VanDerWaalsContact C-N 3.29Å; A188-D190 PolarHBondContact O-N 2.84Å; D190-R192 PolarHBondContact O-N 3.33Å; D190-R192 VanDerWaalsContact OD1-CB 3.28Å; D190-R192 WeakPolarHBondContact OD1-CB 3.17Å; D190-R192 VanDerWaalsContact OD1-CG 3.26Å; D190-R192 WeakPolarHBondContact OD1-CG 3.22Å; D190-R192 PolarHBondContact OD1-N 3.46Å; D190-R192 IonicContact OD1-NE 2.79Å; D190-R192 PolarHBondContact OD1-NE 3.01Å; D190-R192 VanDerWaalsContact OD1-NE 3.1Å; D190-R192 IonicContact OD2-CZ 2.84Å; D190-R192 IonicContact OD2-NE 3.42Å; D190-R192 PolarHBondContact OD2-NE 2.83Å; D190-R192 IonicContact OD2-NH2 3.17Å; D190-R192 PolarHBondContact OD2-NH2 3.44Å; D190-N193 VanDerWaalsContact O-CB 3.28Å; D190-N193 WeakPolarHBondContact O-CB 3.32Å; D190-N193 PolarHBondContact O-N 3.29Å; D190-N193 PolarHBondContact O-ND2 3.37Å
191	P	92.7	Very high	92.8	Very high	101 Å²	101	68.7 Å²	68.7	66%	0.656	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-58.5	-20.5	-179.6	23.6	-35	0	0	0	113.5	N193 I194	P191-N193 PolarHBondContact O-N 3.03Å; P191-I194 WeakPolarHBondContact O-CD1 3.4Å; P191-I194 VanDerWaalsContact O-CG1 3.28Å; P191-I194 WeakPolarHBondContact O-CG1 3.47Å; P191-I194 PolarHBondContact O-N 3.41Å
192	R	92.5	Very high	93	Very high	159 Å²	159	69 Å²	69	60%	0.6	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-66.7	-18.7	175.4	-62.9	178.2	-65.8	167.7	2.3	113.3	D190 I194 E195 N198	D190-R192 PolarHBondContact O-N 3.33Å; D190-R192 VanDerWaalsContact OD1-CB 3.28Å; D190-R192 WeakPolarHBondContact OD1-CB 3.17Å; D190-R192 VanDerWaalsContact OD1-CG 3.26Å; D190-R192 WeakPolarHBondContact OD1-CG 3.22Å; D190-R192 PolarHBondContact OD1-N 3.46Å; D190-R192 IonicContact OD1-NE 2.79Å; D190-R192 PolarHBondContact OD1-NE 3.01Å; D190-R192 VanDerWaalsContact OD1-NE 3.1Å; D190-R192 IonicContact OD2-CZ 2.84Å; D190-R192 IonicContact OD2-NE 3.42Å; D190-R192 PolarHBondContact OD2-NE 2.83Å; D190-R192 IonicContact OD2-NH2 3.17Å; D190-R192 PolarHBondContact OD2-NH2 3.44Å; R192-I194 PolarHBondContact O-N 2.97Å; R192-E195 PolarHBondContact O-N 3.39Å; R192-N198 VanDerWaalsContact O-CB 3.27Å; R192-N198 WeakPolarHBondContact O-CB 3.19Å; R192-N198 PolarHBondContact O-ND2 3.44Å
193	N	91.6	Very high	93.1	Very high	13 Å²	13	67.3 Å²	67.3	7%	0.07	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-72.2	-1.4	178.4	-63.8	-27.8	0	0	0	113.7	L187 A188 D190 P191 E195 R199 T202 L414	L187-N193 PolarHBondContact O-ND2 2.98Å; A188-N193 PolarHBondContact O-ND2 3.38Å; D190-N193 VanDerWaalsContact O-CB 3.28Å; D190-N193 WeakPolarHBondContact O-CB 3.32Å; D190-N193 PolarHBondContact O-N 3.29Å; D190-N193 PolarHBondContact O-ND2 3.37Å; P191-N193 PolarHBondContact O-N 3.03Å; N193-E195 VanDerWaalsContact C-N 3.28Å; N193-R199 WeakPolarHBondContact O-CB 3.27Å; N193-T202 VanDerWaalsContact OD1-CB 3.29Å; N193-T202 WeakPolarHBondContact OD1-CB 3.23Å; N193-T202 PolarHBondContact OD1-OG1 3.39Å; N193-L414 HydrophobicContact CB-CD1 3.96Å
194	I	90.7	Very high	93.3	Very high	143 Å²	143	69.3 Å²	69.3	73%	0.733	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-64.9	-37.2	168.7	-62.9	168.4	0	0	0	110	P191 R192	P191-I194 WeakPolarHBondContact O-CD1 3.4Å; P191-I194 VanDerWaalsContact O-CG1 3.28Å; P191-I194 WeakPolarHBondContact O-CG1 3.47Å; P191-I194 PolarHBondContact O-N 3.41Å; R192-I194 PolarHBondContact O-N 2.97Å
195	E	92.6	Very high	93.4	Very high	99 Å²	99	71.7 Å²	71.7	46%	0.463	36%	0.356	S	S	.	.	S	Bend	trans	-77.1	125.5	177.7	-174.7	61.3	-141.5	0	0	110.4	R192 N193 Q197 N198 R199	R192-E195 PolarHBondContact O-N 3.39Å; N193-E195 VanDerWaalsContact C-N 3.28Å; E195-Q197 VanDerWaalsContact C-N 3.28Å; E195-Q197 PolarHBondContact O-N 3.49Å; E195-N198 HydrophobicContact CB-CB 4.38Å; E195-N198 PolarHBondContact O-N 2.87Å; E195-R199 WeakPolarHBondContact O-CB 3.34Å; E195-R199 PolarHBondContact O-N 3.13Å
196	P	90.9	Very high	93.4	Very high	71 Å²	71	71.8 Å²	71.8	46%	0.461	36%	0.357	S	S	.	.	H	α-helix	trans	-57.1	-35.8	-175.2	20.3	-34.8	0	0	0	114.2	R199 L200	P196-R199 PolarHBondContact O-N 2.99Å; P196-L200 WeakPolarHBondContact O-CB 3.3Å; P196-L200 PolarHBondContact O-N 3.34Å
197	Q	92.3	Very high	93.4	Very high	154 Å²	154	66.6 Å²	66.6	72%	0.72	33%	0.333	S	S	*	.	H	α-helix	trans	-66.2	-45.6	179.6	-61.9	-175.3	3.9	0	0	111.9	E195 L200 Y201	E195-Q197 VanDerWaalsContact C-N 3.28Å; E195-Q197 PolarHBondContact O-N 3.49Å; Q197-L200 PolarHBondContact O-N 3.38Å; Q197-Y201 PolarHBondContact O-N 2.87Å; Q197-Y201 VanDerWaalsContact O-N 3.16Å
198	N	92.8	Very high	93.4	Very high	72 Å²	72	71.1 Å²	71.1	39%	0.385	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-40.6	176.4	-70.6	-23.9	0	0	0	110.8	R192 E195 L200 Y201 T202	R192-N198 VanDerWaalsContact O-CB 3.27Å; R192-N198 WeakPolarHBondContact O-CB 3.19Å; R192-N198 PolarHBondContact O-ND2 3.44Å; E195-N198 HydrophobicContact CB-CB 4.38Å; E195-N198 PolarHBondContact O-N 2.87Å; N198-L200 PolarHBondContact O-N 2.55Å; N198-Y201 WeakPolarHBondContact O-CB 3.32Å; N198-Y201 PolarHBondContact O-N 3.45Å; N198-T202 WeakPolarHBondContact O-CB 3.18Å; N198-T202 PolarHBondContact O-N 3.18Å; N198-T202 PolarHBondContact O-OG1 2.89Å
199	R	93.9	Very high	93.3	Very high	54 Å²	54	74.8 Å²	74.8	20%	0.204	36%	0.363	C	S	.	.	H	α-helix	trans	-57.4	-47.7	176	-170.7	171.1	72.2	-145.1	4.4	111.7	N193 E195 P196 Y201 T202 V203 L414 E417	N193-R199 WeakPolarHBondContact O-CB 3.27Å; E195-R199 WeakPolarHBondContact O-CB 3.34Å; E195-R199 PolarHBondContact O-N 3.13Å; P196-R199 PolarHBondContact O-N 2.99Å; R199-Y201 VanDerWaalsContact C-N 3.34Å; R199-Y201 PolarHBondContact O-N 2.81Å; R199-T202 WeakPolarHBondContact O-CB 3.22Å; R199-T202 PolarHBondContact O-N 3.34Å; R199-V203 HydrophobicContact CG-CG2 4.39Å; R199-V203 WeakPolarHBondContact O-CB 3.26Å; R199-V203 VanDerWaalsContact O-CG2 3.29Å; R199-V203 WeakPolarHBondContact O-CG2 3.3Å; R199-V203 PolarHBondContact O-N 3.22Å; R199-L414 HydrophobicContact CG-CD1 4.13Å; R199-L414 HydrophobicContact CG-CG 4.36Å; R199-E417 WeakPolarHBondContact CD-OE2 3.47Å; R199-E417 IonicContact CZ-OE1 3.49Å; R199-E417 VanDerWaalsContact CZ-OE1 3.27Å; R199-E417 IonicContact CZ-OE2 3.14Å; R199-E417 VanDerWaalsContact NE-CD 3.33Å; R199-E417 IonicContact NE-OE1 3.66Å; R199-E417 PolarHBondContact NE-OE1 2.75Å; R199-E417 VanDerWaalsContact NE-OE1 3.14Å; R199-E417 IonicContact NE-OE2 2.9Å; R199-E417 PolarHBondContact NE-OE2 3.18Å; R199-E417 IonicContact NH2-OE1 3.26Å; R199-E417 PolarHBondContact NH2-OE1 3.1Å; R199-E417 IonicContact NH2-OE2 2.69Å
200	L	93.4	Very high	93.2	Very high	100 Å²	100	72.3 Å²	72.3	52%	0.524	35%	0.347	S	S	.	.	H	α-helix	trans	-63.7	-39.7	179.1	-173.7	65.2	0	0	0	112	P196 Q197 N198 N204	P196-L200 WeakPolarHBondContact O-CB 3.3Å; P196-L200 PolarHBondContact O-N 3.34Å; Q197-L200 PolarHBondContact O-N 3.38Å; N198-L200 PolarHBondContact O-N 2.55Å; L200-N204 PolarHBondContact O-N 3.5Å; L200-N204 PolarHBondContact O-ND2 3.42Å
201	Y	94.3	Very high	93.1	Very high	164 Å²	164	70.8 Å²	70.8	64%	0.643	34%	0.339	S	S	*	.	H	α-helix	trans	-60.4	-50.6	172.5	174.4	-96.3	0	0	0	111.3	Q197 N198 R199 V203 N204 V205	Q197-Y201 PolarHBondContact O-N 2.87Å; Q197-Y201 VanDerWaalsContact O-N 3.16Å; N198-Y201 WeakPolarHBondContact O-CB 3.32Å; N198-Y201 PolarHBondContact O-N 3.45Å; R199-Y201 VanDerWaalsContact C-N 3.34Å; R199-Y201 PolarHBondContact O-N 2.81Å; Y201-V203 PolarHBondContact O-N 2.88Å; Y201-N204 PolarHBondContact O-N 3.16Å; Y201-N204 VanDerWaalsContact O-N 3.16Å; Y201-V205 HydrophobicContact CD1-CG2 4.26Å; Y201-V205 HydrophobicContact CE1-CG2 3.8Å; Y201-V205 HydrophobicContact CE2-CG2 4.11Å; Y201-V205 WeakPolarHBondContact O-CG2 3.2Å; Y201-V205 PolarHBondContact O-N 3.3Å
202	T	94.7	Very high	93	Very high	8 Å²	8	70.5 Å²	70.5	5%	0.049	33%	0.332	C	S	.	.	H	α-helix	trans	-57	-46.7	177.1	-68	0	0	0	0	111.7	L187 N193 N198 R199 N204 V205 L206	L187-T202 HydrophobicContact CD1-CG2 4.36Å; L187-T202 HydrophobicContact CD2-CG2 4.36Å; L187-T202 HydrophobicContact CG-CG2 3.84Å; N193-T202 VanDerWaalsContact OD1-CB 3.29Å; N193-T202 WeakPolarHBondContact OD1-CB 3.23Å; N193-T202 PolarHBondContact OD1-OG1 3.39Å; N198-T202 WeakPolarHBondContact O-CB 3.18Å; N198-T202 PolarHBondContact O-N 3.18Å; N198-T202 PolarHBondContact O-OG1 2.89Å; R199-T202 WeakPolarHBondContact O-CB 3.22Å; R199-T202 PolarHBondContact O-N 3.34Å; T202-N204 VanDerWaalsContact C-N 3.31Å; T202-N204 PolarHBondContact O-N 3.3Å; T202-V205 PolarHBondContact O-N 3.04Å; T202-L206 WeakPolarHBondContact O-CB 3.43Å; T202-L206 PolarHBondContact O-N 3.15Å
203	V	94.7	Very high	92.7	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-58.5	-42.5	177.1	164.6	0	0	0	0	111.2	R199 Y201 L206 S207 L414 E417 L418	R199-V203 HydrophobicContact CG-CG2 4.39Å; R199-V203 WeakPolarHBondContact O-CB 3.26Å; R199-V203 VanDerWaalsContact O-CG2 3.29Å; R199-V203 WeakPolarHBondContact O-CG2 3.3Å; R199-V203 PolarHBondContact O-N 3.22Å; Y201-V203 PolarHBondContact O-N 2.88Å; V203-L206 PolarHBondContact O-N 3.31Å; V203-S207 VanDerWaalsContact O-CB 3.26Å; V203-S207 WeakPolarHBondContact O-CB 3.48Å; V203-S207 PolarHBondContact O-N 3.4Å; V203-S207 PolarHBondContact O-OG 2.93Å; V203-L414 HydrophobicContact CG2-CG 4.28Å; V203-E417 HydrophobicContact CG1-CB 4.39Å; V203-E417 HydrophobicContact CG2-CB 4.1Å; V203-L418 HydrophobicContact CG1-CD1 4.49Å
204	N	94.9	Very high	92.5	Very high	64 Å²	64	63.2 Å²	63.2	34%	0.342	31%	0.307	S	S	.	.	H	α-helix	trans	-67.9	-38.8	177.5	-78.2	-52	0	0	0	113.3	L200 Y201 T202 S207 R208	L200-N204 PolarHBondContact O-N 3.5Å; L200-N204 PolarHBondContact O-ND2 3.42Å; Y201-N204 PolarHBondContact O-N 3.16Å; Y201-N204 VanDerWaalsContact O-N 3.16Å; T202-N204 VanDerWaalsContact C-N 3.31Å; T202-N204 PolarHBondContact O-N 3.3Å; N204-S207 PolarHBondContact O-OG 2.97Å; N204-R208 VanDerWaalsContact O-CG 3.29Å; N204-R208 WeakPolarHBondContact O-CG 3.25Å; N204-R208 PolarHBondContact O-N 3.29Å
205	V	94.7	Very high	92.3	Very high	51 Å²	51	61.1 Å²	61.1	31%	0.309	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-45.9	175	172.6	0	0	0	0	110.1	L187 Y201 T202 R208 H209	L187-V205 HydrophobicContact CD2-CB 4.36Å; L187-V205 HydrophobicContact CD2-CG1 3.83Å; Y201-V205 HydrophobicContact CD1-CG2 4.26Å; Y201-V205 HydrophobicContact CE1-CG2 3.8Å; Y201-V205 HydrophobicContact CE2-CG2 4.11Å; Y201-V205 WeakPolarHBondContact O-CG2 3.2Å; Y201-V205 PolarHBondContact O-N 3.3Å; T202-V205 PolarHBondContact O-N 3.04Å; V205-R208 PolarHBondContact O-N 3.02Å; V205-H209 WeakPolarHBondContact O-CB 3.06Å; V205-H209 PolarHBondContact O-N 3.46Å
206	L	95.1	Very high	91.8	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-41.6	-178.2	-167.4	57.2	0	0	0	111.9	V184 A188 T202 V203 R208 H209 I210 L418	V184-L206 HydrophobicContact CB-CD1 3.94Å; V184-L206 HydrophobicContact CG1-CD1 3.45Å; V184-L206 VanDerWaalsContact CG1-CD1 3.45Å; V184-L206 HydrophobicContact CG1-CG 4.4Å; V184-L206 HydrophobicContact CG2-CD1 3.94Å; A188-L206 HydrophobicContact CB-CD2 4.06Å; T202-L206 WeakPolarHBondContact O-CB 3.43Å; T202-L206 PolarHBondContact O-N 3.15Å; V203-L206 PolarHBondContact O-N 3.31Å; L206-R208 VanDerWaalsContact C-N 3.34Å; L206-R208 PolarHBondContact O-N 3.43Å; L206-H209 PolarHBondContact O-N 3.13Å; L206-I210 HydrophobicContact CD1-CD1 4.12Å; L206-I210 HydrophobicContact CD1-CG1 4.3Å; L206-I210 HydrophobicContact CG-CD1 3.86Å; L206-I210 HydrophobicContact CG-CG1 4.42Å; L206-I210 WeakPolarHBondContact O-CB 3.33Å; L206-I210 VanDerWaalsContact O-CG1 3.23Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 2.69Å; L206-L418 HydrophobicContact CB-CD1 3.91Å; L206-L418 HydrophobicContact CD2-CD1 4.08Å; L206-L418 HydrophobicContact CD2-CD2 3.5Å; L206-L418 HydrophobicContact CD2-CG 4.41Å; L206-L418 HydrophobicContact CG-CD1 3.9Å; L206-L418 HydrophobicContact CG-CD2 3.99Å
207	S	94.2	Very high	91.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-38.9	177.3	72.1	0	0	0	0	111.9	V203 N204 D211 S421 L422	V203-S207 VanDerWaalsContact O-CB 3.26Å; V203-S207 WeakPolarHBondContact O-CB 3.48Å; V203-S207 PolarHBondContact O-N 3.4Å; V203-S207 PolarHBondContact O-OG 2.93Å; N204-S207 PolarHBondContact O-OG 2.97Å; S207-D211 WeakPolarHBondContact O-CB 3.27Å; S207-D211 PolarHBondContact O-N 3.28Å; S207-S421 WeakPolarHBondContact CB-OG 3.37Å; S207-S421 PolarHBondContact OG-OG 3.33Å; S207-S421 VanDerWaalsContact OG-OG 3.04Å; S207-L422 WeakPolarHBondContact O-CD2 3.39Å
208	R	93.1	Very high	90.5	Very high	146 Å²	146	57.1 Å²	57.1	55%	0.551	26%	0.256	S	S	*	.	H	α-helix	trans	-63.5	-51.2	172	-73.6	172.9	-172.9	179.8	2.1	111.6	N204 V205 L206 I210 D211 D212	N204-R208 VanDerWaalsContact O-CG 3.29Å; N204-R208 WeakPolarHBondContact O-CG 3.25Å; N204-R208 PolarHBondContact O-N 3.29Å; V205-R208 PolarHBondContact O-N 3.02Å; L206-R208 VanDerWaalsContact C-N 3.34Å; L206-R208 PolarHBondContact O-N 3.43Å; R208-I210 PolarHBondContact O-N 3.27Å; R208-D211 PolarHBondContact O-N 2.99Å; R208-D212 WeakPolarHBondContact O-CB 3.48Å; R208-D212 VanDerWaalsContact O-CG 3.26Å; R208-D212 PolarHBondContact O-N 3.46Å
209	H	92.4	Very high	89.8	Confident	80 Å²	80	59.9 Å²	59.9	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-42.7	-179	-176	-84.4	0	0	0	112.3	V205 L206 A213	V205-H209 WeakPolarHBondContact O-CB 3.06Å; V205-H209 PolarHBondContact O-N 3.46Å; L206-H209 PolarHBondContact O-N 3.13Å; H209-A213 WeakPolarHBondContact O-CB 3.44Å; H209-A213 PolarHBondContact O-N 3.1Å
210	I	92.3	Very high	88.6	Confident	2 Å²	2	61 Å²	61	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-45.4	176.4	-67.1	174.9	0	0	0	110.8	V184 L206 R208 D212 A213 L214 L402 L418 L422	V184-I210 HydrophobicContact CG1-CD1 4.38Å; L206-I210 HydrophobicContact CD1-CD1 4.12Å; L206-I210 HydrophobicContact CD1-CG1 4.3Å; L206-I210 HydrophobicContact CG-CD1 3.86Å; L206-I210 HydrophobicContact CG-CG1 4.42Å; L206-I210 WeakPolarHBondContact O-CB 3.33Å; L206-I210 VanDerWaalsContact O-CG1 3.23Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 2.69Å; R208-I210 PolarHBondContact O-N 3.27Å; I210-D212 PolarHBondContact O-N 3.46Å; I210-A213 PolarHBondContact O-N 2.77Å; I210-L214 HydrophobicContact CG2-CD1 3.68Å; I210-L214 HydrophobicContact CG2-CG 4.15Å; I210-L214 WeakPolarHBondContact O-CB 3.43Å; I210-L214 WeakPolarHBondContact O-CG 3.5Å; I210-L214 PolarHBondContact O-N 2.87Å; I210-L402 HydrophobicContact CD1-CD2 3.82Å; I210-L402 HydrophobicContact CG1-CD2 3.71Å; I210-L402 HydrophobicContact CG2-CD2 4.47Å; I210-L418 HydrophobicContact CD1-CD1 4.48Å; I210-L418 HydrophobicContact CD1-CD2 4.06Å; I210-L422 HydrophobicContact CB-CD2 4.5Å; I210-L422 HydrophobicContact CG2-CD1 4.24Å; I210-L422 HydrophobicContact CG2-CD2 4.34Å
211	D	91.5	Very high	87.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-47.5	177.1	-176.2	34.3	0	0	0	111.3	S207 R208 L214 R215 Y394 L422 R425	S207-D211 WeakPolarHBondContact O-CB 3.27Å; S207-D211 PolarHBondContact O-N 3.28Å; R208-D211 PolarHBondContact O-N 2.99Å; D211-L214 PolarHBondContact O-N 2.98Å; D211-R215 VanDerWaalsContact CG-NE 3.3Å; D211-R215 WeakPolarHBondContact O-CB 3.04Å; D211-R215 WeakPolarHBondContact O-CG 3.37Å; D211-R215 PolarHBondContact O-N 2.62Å; D211-R215 IonicContact OD1-CZ 2.69Å; D211-R215 IonicContact OD1-NE 3.9Å; D211-R215 PolarHBondContact OD1-NE 2.75Å; D211-R215 IonicContact OD1-NH2 2.62Å; D211-R215 PolarHBondContact OD1-NH2 3.01Å; D211-R215 IonicContact OD2-CZ 3.83Å; D211-R215 IonicContact OD2-NE 2.75Å; D211-R215 PolarHBondContact OD2-NE 3.36Å; D211-R215 IonicContact OD2-NH2 2.89Å; D211-R215 PolarHBondContact OD2-NH2 3.28Å; D211-Y394 WeakPolarHBondContact OD1-CE2 3.25Å; D211-Y394 PolarHBondContact OD1-OH 3.37Å; D211-L422 HydrophobicContact CB-CD2 4.47Å; D211-R425 IonicContact OD2-CZ 3.27Å; D211-R425 IonicContact OD2-NE 3.77Å; D211-R425 PolarHBondContact OD2-NE 2.87Å; D211-R425 IonicContact OD2-NH2 3.88Å; D211-R425 PolarHBondContact OD2-NH2 3.37Å
212	D	89.4	Confident	86	Confident	95 Å²	95	61 Å²	61	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-43.4	178.9	-67.7	-21	0	0	0	111.7	R208 I210 R215 Y216	R208-D212 WeakPolarHBondContact O-CB 3.48Å; R208-D212 VanDerWaalsContact O-CG 3.26Å; R208-D212 PolarHBondContact O-N 3.46Å; I210-D212 PolarHBondContact O-N 3.46Å; D212-R215 PolarHBondContact O-N 3.26Å; D212-Y216 WeakPolarHBondContact O-CB 2.97Å; D212-Y216 PolarHBondContact O-N 3.47Å
213	A	87.6	Confident	84.5	Confident	13 Å²	13	70.7 Å²	70.7	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-42.7	177.9	0	0	0	0	0	112.3	I179 H209 I210 Y216 Q217	I179-A213 HydrophobicContact CG1-CB 4.22Å; H209-A213 WeakPolarHBondContact O-CB 3.44Å; H209-A213 PolarHBondContact O-N 3.1Å; I210-A213 PolarHBondContact O-N 2.77Å; A213-Y216 PolarHBondContact O-N 3.35Å; A213-Q217 WeakPolarHBondContact O-CG 3.49Å; A213-Q217 PolarHBondContact O-N 2.63Å
214	L	87.1	Confident	82.7	Confident	6 Å²	6	75 Å²	75	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-68.1	-37.2	176.8	-69.3	175.7	0	0	0	112	I210 D211 R218 L395	I210-L214 HydrophobicContact CG2-CD1 3.68Å; I210-L214 HydrophobicContact CG2-CG 4.15Å; I210-L214 WeakPolarHBondContact O-CB 3.43Å; I210-L214 WeakPolarHBondContact O-CG 3.5Å; I210-L214 PolarHBondContact O-N 2.87Å; D211-L214 PolarHBondContact O-N 2.98Å; L214-R218 WeakPolarHBondContact O-CB 3.36Å; L214-R218 PolarHBondContact O-N 3.19Å; L214-L395 HydrophobicContact CD1-CD2 4.2Å
215	R	85.7	Confident	80.7	Confident	99 Å²	99	84.2 Å²	84.2	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-63.2	-47	172.5	-75.7	172.1	-170.8	-132.6	19	111.4	D211 D212 Q217 R218 E219 M429	D211-R215 VanDerWaalsContact CG-NE 3.3Å; D211-R215 WeakPolarHBondContact O-CB 3.04Å; D211-R215 WeakPolarHBondContact O-CG 3.37Å; D211-R215 PolarHBondContact O-N 2.62Å; D211-R215 IonicContact OD1-CZ 2.69Å; D211-R215 IonicContact OD1-NE 3.9Å; D211-R215 PolarHBondContact OD1-NE 2.75Å; D211-R215 IonicContact OD1-NH2 2.62Å; D211-R215 PolarHBondContact OD1-NH2 3.01Å; D211-R215 IonicContact OD2-CZ 3.83Å; D211-R215 IonicContact OD2-NE 2.75Å; D211-R215 PolarHBondContact OD2-NE 3.36Å; D211-R215 IonicContact OD2-NH2 2.89Å; D211-R215 PolarHBondContact OD2-NH2 3.28Å; D212-R215 PolarHBondContact O-N 3.26Å; R215-Q217 VanDerWaalsContact C-N 3.35Å; R215-Q217 PolarHBondContact O-N 3.48Å; R215-R218 WeakPolarHBondContact O-CB 3.24Å; R215-R218 PolarHBondContact O-N 2.9Å; R215-R218 VanDerWaalsContact O-N 3.12Å; R215-E219 PolarHBondContact O-N 3.41Å; R215-M429 VanDerWaalsContact CZ-SD 3.59Å; R215-M429 PolarHBondContact NH2-SD 2.97Å
216	Y	82.2	Confident	78.7	Confident	134 Å²	134	85.1 Å²	85.1	53%	0.525	36%	0.362	S	S	.	.	H	α-helix	trans	-57.1	-47.9	177.1	179.3	-97.9	0	0	0	111.3	D212 A213 R218 E219 Y220	D212-Y216 WeakPolarHBondContact O-CB 2.97Å; D212-Y216 PolarHBondContact O-N 3.47Å; A213-Y216 PolarHBondContact O-N 3.35Å; Y216-R218 VanDerWaalsContact C-N 3.32Å; Y216-R218 PolarHBondContact O-N 2.97Å; Y216-E219 PolarHBondContact O-N 3.2Å; Y216-Y220 VanDerWaalsContact O-CB 3.28Å; Y216-Y220 WeakPolarHBondContact O-CB 3.36Å; Y216-Y220 PolarHBondContact O-N 2.87Å
217	Q	78.4	Confident	76.5	Confident	21 Å²	21	90.5 Å²	90.5	10%	0.098	40%	0.395	C	S	.	.	H	α-helix	trans	-60.9	-39.6	175.9	-76.3	-169.2	-22.5	0	0	112.9	S177 I179 A213 R215 S221	S177-Q217 PolarHBondContact O-NE2 3.12Å; I179-Q217 VanDerWaalsContact CD1-NE2 3.28Å; A213-Q217 WeakPolarHBondContact O-CG 3.49Å; A213-Q217 PolarHBondContact O-N 2.63Å; R215-Q217 VanDerWaalsContact C-N 3.35Å; R215-Q217 PolarHBondContact O-N 3.48Å; Q217-S221 VanDerWaalsContact O-CB 3.25Å; Q217-S221 WeakPolarHBondContact O-CB 3.4Å; Q217-S221 PolarHBondContact O-N 3.16Å
218	R	78.4	Confident	74.6	Confident	86 Å²	86	95.8 Å²	95.8	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-64.1	-41.3	178.3	-174.9	179	-53.4	152.2	13.2	112.1	L214 R215 Y216 H393 Y394	L214-R218 WeakPolarHBondContact O-CB 3.36Å; L214-R218 PolarHBondContact O-N 3.19Å; R215-R218 WeakPolarHBondContact O-CB 3.24Å; R215-R218 PolarHBondContact O-N 2.9Å; R215-R218 VanDerWaalsContact O-N 3.12Å; Y216-R218 VanDerWaalsContact C-N 3.32Å; Y216-R218 PolarHBondContact O-N 2.97Å; R218-H393 PolarHBondContact NH2-O 2.85Å; R218-Y394 PolarHBondContact NH2-O 3.34Å
219	E	77.3	Confident	72.7	Confident	130 Å²	130	96.9 Å²	96.9	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-74.6	-42.6	179.8	-167.4	168.8	-170.9	0	0	111.7	R215 Y216 S221 R222 R223	R215-E219 PolarHBondContact O-N 3.41Å; Y216-E219 PolarHBondContact O-N 3.2Å; E219-S221 PolarHBondContact O-N 3.44Å; E219-R222 WeakPolarHBondContact O-CB 3.1Å; E219-R222 PolarHBondContact O-N 3.25Å; E219-R222 VanDerWaalsContact O-N 3.1Å; E219-R223 PolarHBondContact O-N 3.36Å
220	Y	70.2	Confident	71	Confident	78 Å²	78	102.4 Å²	102.4	31%	0.306	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-44.3	177.2	-170.6	-101	0	0	0	112	Y216 R222 R223 E224	Y216-Y220 VanDerWaalsContact O-CB 3.28Å; Y216-Y220 WeakPolarHBondContact O-CB 3.36Å; Y216-Y220 PolarHBondContact O-N 2.87Å; Y220-R222 PolarHBondContact O-N 3.07Å; Y220-R223 PolarHBondContact O-N 2.99Å; Y220-R223 VanDerWaalsContact O-N 3.08Å; Y220-E224 HydrophobicContact CE2-CG 4.47Å; Y220-E224 WeakPolarHBondContact CE2-OE1 3Å; Y220-E224 VanDerWaalsContact CZ-CD 3.45Å; Y220-E224 PolarHBondContact OH-OE1 3.4Å; Y220-E224 PolarHBondContact OH-OE2 3.41Å
221	S	66	Low	69.4	Low	31 Å²	31	105.6 Å²	105.6	22%	0.217	48%	0.476	C	S	.	.	H	α-helix	trans	-60.6	-19.5	176.9	-175.8	0	0	0	0	113.7	Q217 E219 K237 L238	Q217-S221 VanDerWaalsContact O-CB 3.25Å; Q217-S221 WeakPolarHBondContact O-CB 3.4Å; Q217-S221 PolarHBondContact O-N 3.16Å; E219-S221 PolarHBondContact O-N 3.44Å; S221-K237 PolarHBondContact OG-O 3.47Å; S221-K237 VanDerWaalsContact OG-O 3.07Å; S221-L238 PolarHBondContact OG-O 3.25Å
222	R	66.3	Low	67.7	Low	233 Å²	233	109.5 Å²	109.5	88%	0.879	49%	0.493	S	S	*	.	H	α-helix	trans	-87.8	-23.9	178.7	-166.9	176.8	178.8	-180	-0.7	112.8	E219 Y220	E219-R222 WeakPolarHBondContact O-CB 3.1Å; E219-R222 PolarHBondContact O-N 3.25Å; E219-R222 VanDerWaalsContact O-N 3.1Å; Y220-R222 PolarHBondContact O-N 3.07Å
223	R	62.4	Low	66.3	Low	210 Å²	210	106.4 Å²	106.4	79%	0.792	48%	0.478	S	S	*	.	H	α-helix	trans	-100	-27.1	-165.4	-155.3	167.7	-175.1	157.9	-1.4	114.4	E219 Y220	E219-R223 PolarHBondContact O-N 3.36Å; Y220-R223 PolarHBondContact O-N 2.99Å; Y220-R223 VanDerWaalsContact O-N 3.08Å
224	E	57.6	Low	64.7	Low	93 Å²	93	111.4 Å²	111.4	44%	0.435	49%	0.494	S	S	.	.			trans	-105.1	114.9	-178.9	-82	-173.8	-165.4	0	0	113.9	Y220	Y220-E224 HydrophobicContact CE2-CG 4.47Å; Y220-E224 WeakPolarHBondContact CE2-OE1 3Å; Y220-E224 VanDerWaalsContact CZ-CD 3.45Å; Y220-E224 PolarHBondContact OH-OE1 3.4Å; Y220-E224 PolarHBondContact OH-OE2 3.41Å
225	R	52.4	Low	63.3	Low	258 Å²	258	115.4 Å²	115.4	97%	0.974	52%	0.515	S	S	*	.			trans	-100.2	35.5	169.4	-161.6	-178.3	-97.4	172.4	-7.6	110.9
226	S	52.6	Low	62.1	Low	70 Å²	70	110.7 Å²	110.7	49%	0.49	50%	0.497	S	S	.	.			trans	-94.3	149.4	-169.5	-168.2	0	0	0	0	114.4	Y228	S226-Y228 PolarHBondContact O-N 2.85Å
227	V	49.8	Very low	61	Low	115 Å²	115	107.5 Å²	107.5	70%	0.697	49%	0.485	S	S	*	.			trans	-85.7	92.7	-163	-176	0	0	0	0	111.3
228	Y	53.3	Low	60	Low	112 Å²	112	112 Å²	112	44%	0.439	51%	0.51	S	S	.	.			trans	-99	134.4	164.5	-61.1	-74.4	0	0	0	110.3	S226 W230 R234	S226-Y228 PolarHBondContact O-N 2.85Å; Y228-W230 PolarHBondContact O-N 3.48Å; Y228-R234 VanDerWaalsContact O-CZ 3.27Å; Y228-R234 PolarHBondContact O-NE 2.95Å; Y228-R234 PolarHBondContact O-NH2 3.36Å
229	L	54.3	Low	59.1	Low	169 Å²	169	115.3 Å²	115.3	89%	0.885	52%	0.523	S	S	*	.	S	Bend	trans	-66.5	-12.6	-171.8	-94.5	153.6	0	0	0	115.2
230	W	57	Low	58.9	Low	195 Å²	195	109.3 Å²	109.3	74%	0.739	50%	0.496	S	S	*	.			trans	-104.7	109.6	-176.7	-75.1	78.4	0	0	0	112	Y228 F232 V233 R234	Y228-W230 PolarHBondContact O-N 3.48Å; W230-F232 VanDerWaalsContact C-N 3.28Å; W230-F232 PolarHBondContact O-N 3.4Å; W230-V233 HydrophobicContact CB-CB 4.4Å; W230-V233 HydrophobicContact CB-CG2 4.23Å; W230-V233 PolarHBondContact O-N 2.83Å; W230-R234 PolarHBondContact O-N 3.48Å
231	A	57.3	Low	59.5	Low	69 Å²	69	106.1 Å²	106.1	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-57.7	-37.2	-178.9	0	0	0	0	0	113.2	V233 R234 I235	A231-V233 VanDerWaalsContact C-N 3.35Å; A231-V233 PolarHBondContact O-N 3.32Å; A231-R234 WeakPolarHBondContact O-CB 3.38Å; A231-R234 PolarHBondContact O-N 3.22Å; A231-R234 VanDerWaalsContact O-N 3.16Å; A231-I235 VanDerWaalsContact O-CG1 3.32Å; A231-I235 WeakPolarHBondContact O-CG1 3.39Å; A231-I235 PolarHBondContact O-N 3.2Å
232	F	56.5	Low	60.4	Low	82 Å²	82	105.1 Å²	105.1	36%	0.36	48%	0.477	S	S	.	.	H	α-helix	trans	-60.8	-42.4	179.2	-173.4	-103.7	0	0	0	112.7	W230 R234 I235 G236 L245 F249	W230-F232 VanDerWaalsContact C-N 3.28Å; W230-F232 PolarHBondContact O-N 3.4Å; F232-R234 VanDerWaalsContact C-N 3.34Å; F232-I235 PolarHBondContact O-N 2.94Å; F232-G236 PolarHBondContact O-N 2.87Å; F232-G236 VanDerWaalsContact O-N 3.12Å; F232-L245 HydrophobicContact CE1-CB 3.94Å; F232-L245 HydrophobicContact CE2-CB 4.33Å; F232-L245 HydrophobicContact CE2-CD1 4.36Å; F232-L245 HydrophobicContact CE2-CD2 4.28Å; F232-L245 HydrophobicContact CZ-CB 3.63Å; F232-L245 HydrophobicContact CZ-CD1 4.43Å; F232-L245 HydrophobicContact CZ-CD2 4.28Å; F232-L245 HydrophobicContact CZ-CG 4.33Å; F232-L245 VanDerWaalsContact CZ-O 3.29Å; F232-L245 WeakPolarHBondContact CZ-O 3.44Å; F232-F249 HydrophobicContact CE1-CB 3.87Å; F232-F249 HydrophobicContact CE1-CG 4.39Å; F232-F249 HydrophobicContact CZ-CB 3.99Å
233	V	59.1	Low	61.5	Low	31 Å²	31	94.2 Å²	94.2	19%	0.188	44%	0.437	C	S	.	.	H	α-helix	trans	-67.7	-36.4	176.9	171.7	0	0	0	0	111.1	W230 A231 K237 Y242	W230-V233 HydrophobicContact CB-CB 4.4Å; W230-V233 HydrophobicContact CB-CG2 4.23Å; W230-V233 PolarHBondContact O-N 2.83Å; A231-V233 VanDerWaalsContact C-N 3.35Å; A231-V233 PolarHBondContact O-N 3.32Å; V233-K237 HydrophobicContact CG1-CD 4.44Å; V233-K237 WeakPolarHBondContact O-CG 3.38Å; V233-K237 PolarHBondContact O-N 3.43Å; V233-Y242 HydrophobicContact CG1-CD2 4.5Å; V233-Y242 HydrophobicContact CG1-CE2 3.92Å
234	R	55.5	Low	62.8	Low	118 Å²	118	84.2 Å²	84.2	45%	0.445	40%	0.399	S	S	.	.	H	α-helix	trans	-63.9	-45.9	174.9	-66.7	-161.9	-166.6	-175	6.3	112	Y228 W230 A231 F232 K237 L238	Y228-R234 VanDerWaalsContact O-CZ 3.27Å; Y228-R234 PolarHBondContact O-NE 2.95Å; Y228-R234 PolarHBondContact O-NH2 3.36Å; W230-R234 PolarHBondContact O-N 3.48Å; A231-R234 WeakPolarHBondContact O-CB 3.38Å; A231-R234 PolarHBondContact O-N 3.22Å; A231-R234 VanDerWaalsContact O-N 3.16Å; F232-R234 VanDerWaalsContact C-N 3.34Å; R234-K237 PolarHBondContact O-N 3.24Å; R234-L238 WeakPolarHBondContact O-CB 3.48Å; R234-L238 PolarHBondContact O-N 2.79Å
235	I	58	Low	64.2	Low	90 Å²	90	81.6 Å²	81.6	46%	0.462	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-47.8	-178.4	-65.4	162.3	0	0	0	109.7	A231 F232 K237 L238 Y239 L245	A231-I235 VanDerWaalsContact O-CG1 3.32Å; A231-I235 WeakPolarHBondContact O-CG1 3.39Å; A231-I235 PolarHBondContact O-N 3.2Å; F232-I235 PolarHBondContact O-N 2.94Å; I235-K237 PolarHBondContact O-N 3.3Å; I235-L238 PolarHBondContact O-N 3.07Å; I235-Y239 HydrophobicContact CG2-CD2 3.87Å; I235-Y239 HydrophobicContact CG2-CE2 4.06Å; I235-Y239 VanDerWaalsContact O-CD2 3.26Å; I235-Y239 WeakPolarHBondContact O-CD2 3.4Å; I235-Y239 PolarHBondContact O-N 3.38Å; I235-L245 HydrophobicContact CG2-CD1 4.36Å
236	G	59.6	Low	66	Low	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-57.7	-46.4	178.6	0	0	0	0	0	113.6	F232 G240 A241 Y242	F232-G236 PolarHBondContact O-N 2.87Å; F232-G236 VanDerWaalsContact O-N 3.12Å; G236-G240 PolarHBondContact O-N 3.46Å; G236-A241 CarbonylContact O-C 3.56Å; G236-A241 PolarHBondContact O-N 3.13Å; G236-Y242 PolarHBondContact O-N 3.41Å; G236-Y242 VanDerWaalsContact O-N 3.16Å
237	K	59.3	Low	67.9	Low	66 Å²	66	66.1 Å²	66.1	29%	0.287	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-40.5	179.4	-71.7	-171.9	177.6	-173.7	0	112.3	S221 V233 R234 I235 Y239 G240 Y242	S221-K237 PolarHBondContact OG-O 3.47Å; S221-K237 VanDerWaalsContact OG-O 3.07Å; V233-K237 HydrophobicContact CG1-CD 4.44Å; V233-K237 WeakPolarHBondContact O-CG 3.38Å; V233-K237 PolarHBondContact O-N 3.43Å; R234-K237 PolarHBondContact O-N 3.24Å; I235-K237 PolarHBondContact O-N 3.3Å; K237-Y239 VanDerWaalsContact C-N 3.33Å; K237-Y239 PolarHBondContact O-N 2.92Å; K237-G240 PolarHBondContact O-N 3.42Å; K237-Y242 HydrophobicContact CG-CD2 3.71Å; K237-Y242 HydrophobicContact CG-CE2 4.35Å; K237-Y242 HydrophobicContact CG-CG 4.08Å
238	L	56.6	Low	69.9	Low	117 Å²	117	61.1 Å²	61.1	61%	0.613	29%	0.289	S	S	*	.	H	α-helix	trans	-65.1	-35.6	-177	-150.1	90.9	0	0	0	112.9	S221 R234 I235	S221-L238 PolarHBondContact OG-O 3.25Å; R234-L238 WeakPolarHBondContact O-CB 3.48Å; R234-L238 PolarHBondContact O-N 2.79Å; I235-L238 PolarHBondContact O-N 3.07Å
239	Y	61	Low	71.8	Confident	155 Å²	155	59.5 Å²	59.5	61%	0.608	28%	0.284	S	S	*	.	H	α-helix	trans	-94.2	-0.8	-178	-70.2	-77.3	0	0	0	113.9	I235 K237 A241	I235-Y239 HydrophobicContact CG2-CD2 3.87Å; I235-Y239 HydrophobicContact CG2-CE2 4.06Å; I235-Y239 VanDerWaalsContact O-CD2 3.26Å; I235-Y239 WeakPolarHBondContact O-CD2 3.4Å; I235-Y239 PolarHBondContact O-N 3.38Å; K237-Y239 VanDerWaalsContact C-N 3.33Å; K237-Y239 PolarHBondContact O-N 2.92Å; Y239-A241 VanDerWaalsContact C-N 3.27Å
240	G	72.4	Confident	73.7	Confident	4 Å²	4	51.5 Å²	51.5	4%	0.041	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	41.3	-170.1	0	0	0	0	0	112.2	G236 K237 D398	G236-G240 PolarHBondContact O-N 3.46Å; K237-G240 PolarHBondContact O-N 3.42Å; G240-D398 WeakPolarHBondContact O-CB 3.38Å; G240-D398 VanDerWaalsContact O-CG 3.25Å; G240-D398 PolarHBondContact O-N 3.11Å
241	A	82.3	Confident	75.5	Confident	10 Å²	10	42.5 Å²	42.5	8%	0.083	21%	0.208	C	C	.	.			trans	-124.6	19.1	-177.5	0	0	0	0	0	111.1	G236 Y239 L245 P397 D398	G236-A241 CarbonylContact O-C 3.56Å; G236-A241 PolarHBondContact O-N 3.13Å; Y239-A241 VanDerWaalsContact C-N 3.27Å; A241-L245 HydrophobicContact CB-CG 4.33Å; A241-L245 VanDerWaalsContact O-CB 3.27Å; A241-L245 WeakPolarHBondContact O-CB 3.36Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.07Å; A241-P397 HydrophobicContact CB-CB 3.92Å; A241-P397 HydrophobicContact CB-CG 3.77Å; A241-D398 WeakPolarHBondContact CA-OD1 3.43Å
242	Y	84.9	Confident	77.3	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.039	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-50.3	-168.9	173.5	-102.3	0	0	0	111.5	S177 V233 G236 K237 T244 L245 I246 D398	S177-Y242 VanDerWaalsContact CA-CE1 3.47Å; V233-Y242 HydrophobicContact CG1-CD2 4.5Å; V233-Y242 HydrophobicContact CG1-CE2 3.92Å; G236-Y242 PolarHBondContact O-N 3.41Å; G236-Y242 VanDerWaalsContact O-N 3.16Å; K237-Y242 HydrophobicContact CG-CD2 3.71Å; K237-Y242 HydrophobicContact CG-CE2 4.35Å; K237-Y242 HydrophobicContact CG-CG 4.08Å; Y242-T244 VanDerWaalsContact C-N 3.31Å; Y242-T244 PolarHBondContact O-N 3.33Å; Y242-L245 PolarHBondContact O-N 2.68Å; Y242-I246 HydrophobicContact CD1-CD1 3.79Å; Y242-I246 HydrophobicContact CD2-CD1 3.9Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE2-CD1 3.38Å; Y242-I246 HydrophobicContact CE2-CG1 4.27Å; Y242-I246 HydrophobicContact CG-CD1 4.1Å; Y242-I246 WeakPolarHBondContact O-CG1 3.17Å; Y242-I246 PolarHBondContact O-N 2.97Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.34Å; Y242-D398 PolarHBondContact N-OD1 2.85Å; Y242-D398 PolarHBondContact N-OD2 2.74Å
243	V	88.6	Confident	79.2	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-44.9	-179.8	179.8	0	0	0	0	109.7	W170 I179 V181 L245 I246 Y247 D398 F401	W170-V243 HydrophobicContact CH2-CG1 4.08Å; I179-V243 HydrophobicContact CD1-CG2 4.22Å; V181-V243 HydrophobicContact CG2-CG1 4.06Å; V243-L245 PolarHBondContact O-N 3.31Å; V243-I246 PolarHBondContact O-N 3.05Å; V243-Y247 PolarHBondContact O-N 2.91Å; V243-D398 PolarHBondContact N-OD1 2.93Å; V243-D398 PolarHBondContact N-OD2 3.43Å; V243-F401 HydrophobicContact CG1-CD1 3.91Å; V243-F401 HydrophobicContact CG1-CE1 3.71Å
244	T	89.7	Confident	81	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-47.1	179.9	-50.2	0	0	0	0	111.8	Y242 Y247 C248 V357 P397 D398 F401	Y242-T244 VanDerWaalsContact C-N 3.31Å; Y242-T244 PolarHBondContact O-N 3.33Å; T244-Y247 PolarHBondContact O-N 3.05Å; T244-C248 PolarHBondContact O-N 3.08Å; T244-C248 PolarHBondContact O-SG 3Å; T244-V357 HydrophobicContact CG2-CB 3.96Å; T244-V357 HydrophobicContact CG2-CG1 3.41Å; T244-V357 VanDerWaalsContact CG2-CG1 3.41Å; T244-V357 HydrophobicContact CG2-CG2 3.26Å; T244-P397 PolarHBondContact OG1-O 3.21Å; T244-D398 VanDerWaalsContact CB-OD1 3.32Å; T244-D398 WeakPolarHBondContact CB-OD1 3.47Å; T244-D398 PolarHBondContact N-OD1 3.42Å; T244-D398 WeakPolarHBondContact OG1-CA 3.12Å; T244-D398 PolarHBondContact OG1-N 3.19Å; T244-D398 PolarHBondContact OG1-OD1 3Å; T244-F401 HydrophobicContact CG2-CB 4.18Å; T244-F401 HydrophobicContact CG2-CD2 4.33Å; T244-F401 HydrophobicContact CG2-CG 4.36Å; T244-F401 WeakPolarHBondContact OG1-CB 3.46Å
245	L	88.4	Confident	83	Confident	37 Å²	37	35.3 Å²	35.3	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-40.4	179.5	-76.9	-173.5	0	0	0	112.2	F232 I235 A241 Y242 V243 Y247 C248 F249	F232-L245 HydrophobicContact CE1-CB 3.94Å; F232-L245 HydrophobicContact CE2-CB 4.33Å; F232-L245 HydrophobicContact CE2-CD1 4.36Å; F232-L245 HydrophobicContact CE2-CD2 4.28Å; F232-L245 HydrophobicContact CZ-CB 3.63Å; F232-L245 HydrophobicContact CZ-CD1 4.43Å; F232-L245 HydrophobicContact CZ-CD2 4.28Å; F232-L245 HydrophobicContact CZ-CG 4.33Å; F232-L245 VanDerWaalsContact CZ-O 3.29Å; F232-L245 WeakPolarHBondContact CZ-O 3.44Å; I235-L245 HydrophobicContact CG2-CD1 4.36Å; A241-L245 HydrophobicContact CB-CG 4.33Å; A241-L245 VanDerWaalsContact O-CB 3.27Å; A241-L245 WeakPolarHBondContact O-CB 3.36Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.07Å; Y242-L245 PolarHBondContact O-N 2.68Å; V243-L245 PolarHBondContact O-N 3.31Å; L245-Y247 VanDerWaalsContact C-N 3.28Å; L245-Y247 PolarHBondContact O-N 2.8Å; L245-C248 PolarHBondContact O-N 3.07Å; L245-F249 WeakPolarHBondContact O-CB 3.22Å; L245-F249 PolarHBondContact O-N 2.89Å
246	I	89.6	Confident	84.8	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-61.4	-42.4	174.8	-72.1	167.4	0	0	0	110.7	W170 M173 Y242 V243 F249 V250	W170-I246 HydrophobicContact CE3-CG2 3.84Å; W170-I246 HydrophobicContact CZ3-CB 4.46Å; W170-I246 HydrophobicContact CZ3-CG2 3.93Å; M173-I246 HydrophobicContact CB-CD1 3.96Å; M173-I246 HydrophobicContact CB-CG2 3.74Å; M173-I246 HydrophobicContact CE-CD1 3.96Å; M173-I246 HydrophobicContact CE-CG1 3.77Å; M173-I246 HydrophobicContact CE-CG2 4.41Å; M173-I246 HydrophobicContact SD-CG2 4.13Å; Y242-I246 HydrophobicContact CD1-CD1 3.79Å; Y242-I246 HydrophobicContact CD2-CD1 3.9Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE2-CD1 3.38Å; Y242-I246 HydrophobicContact CE2-CG1 4.27Å; Y242-I246 HydrophobicContact CG-CD1 4.1Å; Y242-I246 WeakPolarHBondContact O-CG1 3.17Å; Y242-I246 PolarHBondContact O-N 2.97Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.34Å; V243-I246 PolarHBondContact O-N 3.05Å; I246-F249 WeakPolarHBondContact O-CB 3.26Å; I246-F249 PolarHBondContact O-N 2.71Å; I246-V250 HydrophobicContact CG2-CG2 4.39Å; I246-V250 WeakPolarHBondContact O-CG2 3.49Å; I246-V250 PolarHBondContact O-N 3.46Å
247	Y	92.3	Very high	86.6	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-62.3	-46.8	178.6	-166.2	-110.2	0	0	0	111.4	D69 D72 W170 V243 T244 L245 F249 V250 K251 W353 F401 M405	D69-Y247 VanDerWaalsContact CG-OH 3.24Å; D69-Y247 PolarHBondContact OD2-OH 2.92Å; D72-Y247 PolarHBondContact OD2-OH 3.48Å; W170-Y247 HydrophobicContact CD2-CD2 4.17Å; W170-Y247 AromaticContact CE3-CD2 3.8Å; W170-Y247 HydrophobicContact CE3-CD2 3.8Å; W170-Y247 AromaticContact CH2-CD2 3.54Å; W170-Y247 HydrophobicContact CH2-CD2 3.54Å; W170-Y247 HydrophobicContact CH2-CE2 4.41Å; W170-Y247 HydrophobicContact CH2-CG 4.19Å; W170-Y247 AromaticContact CZ2-CD2 3.91Å; W170-Y247 HydrophobicContact CZ2-CD2 3.91Å; W170-Y247 HydrophobicContact CZ2-CE2 4.36Å; W170-Y247 AromaticContact CZ3-CD2 3.5Å; W170-Y247 HydrophobicContact CZ3-CD2 3.5Å; W170-Y247 HydrophobicContact CZ3-CG 4.06Å; V243-Y247 PolarHBondContact O-N 2.91Å; T244-Y247 PolarHBondContact O-N 3.05Å; L245-Y247 VanDerWaalsContact C-N 3.28Å; L245-Y247 PolarHBondContact O-N 2.8Å; Y247-F249 VanDerWaalsContact C-N 3.28Å; Y247-F249 PolarHBondContact O-N 3.33Å; Y247-V250 PolarHBondContact O-N 2.88Å; Y247-V250 VanDerWaalsContact O-N 3.16Å; Y247-K251 HydrophobicContact CD1-CG 4.26Å; Y247-K251 HydrophobicContact CE1-CD 4.3Å; Y247-K251 HydrophobicContact CE1-CG 4.2Å; Y247-K251 WeakPolarHBondContact O-CG 3.46Å; Y247-K251 PolarHBondContact O-N 3.16Å; Y247-K251 WeakPolarHBondContact OH-CE 3.4Å; Y247-K251 PolarHBondContact OH-NZ 3.19Å; Y247-W353 HydrophobicContact CD1-CD2 4.23Å; Y247-W353 HydrophobicContact CD1-CE3 4.31Å; Y247-W353 AromaticContact CE1-CD2 3.69Å; Y247-W353 HydrophobicContact CE1-CD2 3.69Å; Y247-W353 AromaticContact CE1-CE2 3.63Å; Y247-W353 HydrophobicContact CE1-CE3 4.08Å; Y247-W353 HydrophobicContact CE1-CG 4.06Å; Y247-W353 HydrophobicContact CE1-CH2 4.27Å; Y247-W353 AromaticContact CE1-CZ2 3.92Å; Y247-W353 HydrophobicContact CE1-CZ2 3.92Å; Y247-W353 HydrophobicContact CE1-CZ3 4.36Å; Y247-W353 AromaticContact CE1-NE1 3.96Å; Y247-F401 HydrophobicContact CD1-CD2 4.44Å; Y247-F401 AromaticContact CD1-CE2 3.27Å; Y247-F401 HydrophobicContact CD1-CE2 3.27Å; Y247-F401 AromaticContact CD1-CZ 3.55Å; Y247-F401 HydrophobicContact CD1-CZ 3.55Å; Y247-F401 HydrophobicContact CD2-CE2 4.47Å; Y247-F401 AromaticContact CD2-CZ 3.89Å; Y247-F401 HydrophobicContact CD2-CZ 3.89Å; Y247-F401 AromaticContact CE1-CE2 3.75Å; Y247-F401 HydrophobicContact CE1-CE2 3.75Å; Y247-F401 HydrophobicContact CE1-CZ 4.03Å; Y247-F401 HydrophobicContact CE2-CZ 4.37Å; Y247-F401 AromaticContact CG-CE2 3.66Å; Y247-F401 HydrophobicContact CG-CE2 3.66Å; Y247-F401 AromaticContact CG-CZ 3.43Å; Y247-F401 HydrophobicContact CG-CZ 3.43Å; Y247-F401 VanDerWaalsContact CG-CZ 3.43Å; Y247-M405 HydrophobicContact CD1-CE 4.44Å; Y247-M405 HydrophobicContact CD2-CE 4.15Å; Y247-M405 HydrophobicContact CE1-CE 3.72Å; Y247-M405 HydrophobicContact CE2-CE 3.42Å; Y247-M405 VanDerWaalsContact CE2-CE 3.42Å; Y247-M405 WeakPolarHBondContact OH-CE 3.48Å
248	C	92.5	Very high	88.4	Confident	9 Å²	9	33.2 Å²	33.2	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-37.8	173.4	-69.8	0	0	0	0	112.9	T244 L245 K251 S252 M354	T244-C248 PolarHBondContact O-N 3.08Å; T244-C248 PolarHBondContact O-SG 3Å; L245-C248 PolarHBondContact O-N 3.07Å; C248-K251 PolarHBondContact O-N 2.86Å; C248-S252 PolarHBondContact O-N 3.04Å; C248-S252 PolarHBondContact O-OG 3.37Å; C248-M354 HydrophobicContact CB-SD 3.72Å
249	F	92.8	Very high	90.1	Very high	78 Å²	78	33.9 Å²	33.9	34%	0.342	17%	0.166	S	C	.	.	H	α-helix	trans	-63.6	-45.9	174.9	174.3	-109.3	0	0	0	111.3	V169 M173 F232 L245 I246 Y247 K251 S252 L253	V169-F249 HydrophobicContact CG1-CE1 4.14Å; M173-F249 HydrophobicContact SD-CD1 4.47Å; F232-F249 HydrophobicContact CE1-CB 3.87Å; F232-F249 HydrophobicContact CE1-CG 4.39Å; F232-F249 HydrophobicContact CZ-CB 3.99Å; L245-F249 WeakPolarHBondContact O-CB 3.22Å; L245-F249 PolarHBondContact O-N 2.89Å; I246-F249 WeakPolarHBondContact O-CB 3.26Å; I246-F249 PolarHBondContact O-N 2.71Å; Y247-F249 VanDerWaalsContact C-N 3.28Å; Y247-F249 PolarHBondContact O-N 3.33Å; F249-K251 PolarHBondContact O-N 3.34Å; F249-S252 CarbonylContact O-C 3.54Å; F249-S252 WeakPolarHBondContact O-CA 3.29Å; F249-S252 WeakPolarHBondContact O-CB 3.41Å; F249-S252 PolarHBondContact O-N 3.19Å; F249-S252 VanDerWaalsContact O-N 3.14Å; F249-L253 HydrophobicContact CD1-CD1 4.1Å; F249-L253 HydrophobicContact CD1-CG 4.47Å; F249-L253 HydrophobicContact CE1-CD1 3.57Å; F249-L253 HydrophobicContact CE1-CG 4.11Å; F249-L253 HydrophobicContact CE2-CD2 4.29Å; F249-L253 HydrophobicContact CE2-CG 4.37Å; F249-L253 HydrophobicContact CZ-CD1 3.89Å; F249-L253 HydrophobicContact CZ-CD2 4.02Å; F249-L253 HydrophobicContact CZ-CG 4.05Å; F249-L253 WeakPolarHBondContact O-CG 3.31Å; F249-L253 PolarHBondContact O-N 3.5Å
250	V	94.2	Very high	91.6	Very high	2 Å²	2	28 Å²	28	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176.1	169.6	0	0	0	0	111.6	P166 V169 W170 I246 Y247 S252 L253 Y254	P166-V250 HydrophobicContact CB-CG1 4.27Å; V169-V250 HydrophobicContact CG1-CG2 4.22Å; W170-V250 HydrophobicContact CB-CG1 4.06Å; W170-V250 HydrophobicContact CB-CG2 3.88Å; W170-V250 HydrophobicContact CE3-CG2 4.28Å; I246-V250 HydrophobicContact CG2-CG2 4.39Å; I246-V250 WeakPolarHBondContact O-CG2 3.49Å; I246-V250 PolarHBondContact O-N 3.46Å; Y247-V250 PolarHBondContact O-N 2.88Å; Y247-V250 VanDerWaalsContact O-N 3.16Å; V250-S252 PolarHBondContact O-N 3.07Å; V250-L253 WeakPolarHBondContact O-CA 3.18Å; V250-L253 WeakPolarHBondContact O-CB 3.34Å; V250-L253 PolarHBondContact O-N 3.35Å; V250-Y254 HydrophobicContact CG1-CD2 3.95Å; V250-Y254 HydrophobicContact CG1-CE2 3.6Å; V250-Y254 WeakPolarHBondContact O-CD2 3.49Å; V250-Y254 PolarHBondContact O-N 2.91Å
251	K	95.3	Very high	92.6	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.022	15%	0.151	C	C	.	.	H	α-helix	trans	-57.7	-40.6	173	-67	-68.7	-174.7	-174.4	0	111.7	D69 D72 Y247 C248 F249 Y254 F255 N349 L350	D69-K251 IonicContact OD2-NZ 3.75Å; D69-K251 PolarHBondContact OD2-NZ 3.37Å; D72-K251 WeakPolarHBondContact OD1-CE 3.46Å; D72-K251 IonicContact OD1-NZ 3.97Å; D72-K251 PolarHBondContact OD1-NZ 3.14Å; D72-K251 IonicContact OD2-NZ 3.26Å; D72-K251 PolarHBondContact OD2-NZ 3.38Å; Y247-K251 HydrophobicContact CD1-CG 4.26Å; Y247-K251 HydrophobicContact CE1-CD 4.3Å; Y247-K251 HydrophobicContact CE1-CG 4.2Å; Y247-K251 WeakPolarHBondContact O-CG 3.46Å; Y247-K251 PolarHBondContact O-N 3.16Å; Y247-K251 WeakPolarHBondContact OH-CE 3.4Å; Y247-K251 PolarHBondContact OH-NZ 3.19Å; C248-K251 PolarHBondContact O-N 2.86Å; F249-K251 PolarHBondContact O-N 3.34Å; K251-Y254 PolarHBondContact O-N 3.45Å; K251-F255 PolarHBondContact O-N 3.27Å; K251-F255 VanDerWaalsContact O-N 3.13Å; K251-N349 PolarHBondContact NZ-ND2 3.45Å; K251-L350 HydrophobicContact CB-CD1 3.59Å
252	S	95.1	Very high	93	Very high	41 Å²	41	29 Å²	29	29%	0.287	15%	0.154	S	C	.	.	H	α-helix	trans	-65.5	-39.9	175.1	-54.3	0	0	0	0	111.2	C248 F249 V250 Y254 F255 V256	C248-S252 PolarHBondContact O-N 3.04Å; C248-S252 PolarHBondContact O-OG 3.37Å; F249-S252 CarbonylContact O-C 3.54Å; F249-S252 WeakPolarHBondContact O-CA 3.29Å; F249-S252 WeakPolarHBondContact O-CB 3.41Å; F249-S252 PolarHBondContact O-N 3.19Å; F249-S252 VanDerWaalsContact O-N 3.14Å; V250-S252 PolarHBondContact O-N 3.07Å; S252-Y254 PolarHBondContact O-N 3.43Å; S252-F255 PolarHBondContact O-N 2.88Å; S252-V256 WeakPolarHBondContact O-CB 3.21Å; S252-V256 VanDerWaalsContact O-CG2 3.3Å; S252-V256 WeakPolarHBondContact O-CG2 3.42Å; S252-V256 PolarHBondContact O-N 3.13Å
253	L	96.6	Very high	93.1	Very high	49 Å²	49	35.1 Å²	35.1	26%	0.257	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-40.2	174.2	-69.2	-179.9	0	0	0	112.4	P166 V169 F249 V250 N257	P166-L253 HydrophobicContact CB-CB 4.03Å; P166-L253 HydrophobicContact CG-CB 4.14Å; V169-L253 HydrophobicContact CB-CD1 4.26Å; V169-L253 HydrophobicContact CG1-CD1 4.02Å; V169-L253 HydrophobicContact CG2-CD1 4.24Å; F249-L253 HydrophobicContact CD1-CD1 4.1Å; F249-L253 HydrophobicContact CD1-CG 4.47Å; F249-L253 HydrophobicContact CE1-CD1 3.57Å; F249-L253 HydrophobicContact CE1-CG 4.11Å; F249-L253 HydrophobicContact CE2-CD2 4.29Å; F249-L253 HydrophobicContact CE2-CG 4.37Å; F249-L253 HydrophobicContact CZ-CD1 3.89Å; F249-L253 HydrophobicContact CZ-CD2 4.02Å; F249-L253 HydrophobicContact CZ-CG 4.05Å; F249-L253 WeakPolarHBondContact O-CG 3.31Å; F249-L253 PolarHBondContact O-N 3.5Å; V250-L253 WeakPolarHBondContact O-CA 3.18Å; V250-L253 WeakPolarHBondContact O-CB 3.34Å; V250-L253 PolarHBondContact O-N 3.35Å; L253-N257 WeakPolarHBondContact O-CB 3.38Å; L253-N257 PolarHBondContact O-N 3.4Å
254	Y	96.9	Very high	93.1	Very high	5 Å²	5	38 Å²	38	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-48	173.5	-77.6	-61.5	0	0	0	111.6	D72 N75 Y76 P166 T167 V250 K251 S252 N257 V258	D72-Y254 HydrophobicContact CB-CE2 4.02Å; N75-Y254 HydrophobicContact CB-CD1 3.49Å; N75-Y254 VanDerWaalsContact CB-CD1 3.49Å; N75-Y254 HydrophobicContact CB-CE1 3.64Å; N75-Y254 HydrophobicContact CB-CG 4.38Å; Y76-Y254 WeakPolarHBondContact CD1-OH 3.32Å; P166-Y254 HydrophobicContact CB-CD1 3.65Å; P166-Y254 HydrophobicContact CB-CD2 4.18Å; P166-Y254 HydrophobicContact CB-CE1 3.58Å; P166-Y254 HydrophobicContact CB-CE2 4.14Å; P166-Y254 HydrophobicContact CB-CG 3.95Å; P166-Y254 HydrophobicContact CG-CD1 3.76Å; P166-Y254 HydrophobicContact CG-CE1 3.99Å; P166-Y254 HydrophobicContact CG-CG 4.29Å; T167-Y254 PolarHBondContact OG1-OH 3.02Å; V250-Y254 HydrophobicContact CG1-CD2 3.95Å; V250-Y254 HydrophobicContact CG1-CE2 3.6Å; V250-Y254 WeakPolarHBondContact O-CD2 3.49Å; V250-Y254 PolarHBondContact O-N 2.91Å; K251-Y254 PolarHBondContact O-N 3.45Å; S252-Y254 PolarHBondContact O-N 3.43Å; Y254-N257 PolarHBondContact O-N 3.2Å; Y254-V258 WeakPolarHBondContact O-CG2 3.36Å; Y254-V258 PolarHBondContact O-N 3.42Å
255	F	96.6	Very high	93.1	Very high	55 Å²	55	38.3 Å²	38.3	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-47.2	179.6	178.6	-110.6	0	0	0	112.4	K251 S252 N257 V258 F259 F347 L350	K251-F255 PolarHBondContact O-N 3.27Å; K251-F255 VanDerWaalsContact O-N 3.13Å; S252-F255 PolarHBondContact O-N 2.88Å; F255-N257 VanDerWaalsContact C-N 3.28Å; F255-N257 PolarHBondContact O-N 3.46Å; F255-V258 PolarHBondContact O-N 3.1Å; F255-F259 WeakPolarHBondContact O-CB 3.49Å; F255-F259 PolarHBondContact O-N 3.35Å; F255-F347 HydrophobicContact CD2-CB 4.02Å; F255-F347 HydrophobicContact CD2-CD2 4.33Å; F255-F347 HydrophobicContact CE1-CD2 4.39Å; F255-F347 HydrophobicContact CE2-CB 3.72Å; F255-F347 AromaticContact CE2-CD2 3.78Å; F255-F347 HydrophobicContact CE2-CD2 3.78Å; F255-F347 HydrophobicContact CE2-CG 4.16Å; F255-F347 AromaticContact CZ-CD2 3.8Å; F255-F347 HydrophobicContact CZ-CD2 3.8Å; F255-L350 HydrophobicContact CB-CD2 3.9Å; F255-L350 HydrophobicContact CD1-CD2 4.14Å; F255-L350 HydrophobicContact CG-CD2 4.08Å
256	V	96.8	Very high	92.9	Very high	94 Å²	94	37 Å²	37	57%	0.57	19%	0.191	S	C	*	.	H	α-helix	trans	-61.7	-38.7	175.9	171.5	0	0	0	0	110.9	S252 G260	S252-V256 WeakPolarHBondContact O-CB 3.21Å; S252-V256 VanDerWaalsContact O-CG2 3.3Å; S252-V256 WeakPolarHBondContact O-CG2 3.42Å; S252-V256 PolarHBondContact O-N 3.13Å; V256-G260 WeakPolarHBondContact O-CA 3.22Å; V256-G260 PolarHBondContact O-N 3.35Å
257	N	97.4	Very high	92.7	Very high	17 Å²	17	44.4 Å²	44.4	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-54.6	175.1	-179.4	60.5	0	0	0	110.5	F163 L253 Y254 F255 F259 G260 Q261	F163-N257 WeakPolarHBondContact CA-ND2 3.37Å; F163-N257 WeakPolarHBondContact CD1-ND2 3.47Å; F163-N257 WeakPolarHBondContact CE1-ND2 3.49Å; F163-N257 WeakPolarHBondContact CG-ND2 3.26Å; L253-N257 WeakPolarHBondContact O-CB 3.38Å; L253-N257 PolarHBondContact O-N 3.4Å; Y254-N257 PolarHBondContact O-N 3.2Å; F255-N257 VanDerWaalsContact C-N 3.28Å; F255-N257 PolarHBondContact O-N 3.46Å; N257-F259 VanDerWaalsContact C-N 3.31Å; N257-F259 PolarHBondContact O-N 3.46Å; N257-G260 CarbonylContact O-C 3.6Å; N257-G260 WeakPolarHBondContact O-CA 3.37Å; N257-G260 PolarHBondContact O-N 2.82Å; N257-G260 VanDerWaalsContact O-N 3.09Å; N257-Q261 VanDerWaalsContact O-CG 3.24Å; N257-Q261 WeakPolarHBondContact O-CG 3.41Å; N257-Q261 PolarHBondContact O-N 3.27Å; N257-Q261 PolarHBondContact OD1-NE2 3.13Å
258	V	96	Very high	92.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.4	-43.1	-178.1	-177.1	0	0	0	0	111.6	N75 F163 Y254 F255 Q261 F262 L342 A343 T346	N75-V258 WeakPolarHBondContact OD1-CG2 3.4Å; F163-V258 HydrophobicContact CE1-CG2 3.77Å; F163-V258 HydrophobicContact CZ-CG2 4.47Å; Y254-V258 WeakPolarHBondContact O-CG2 3.36Å; Y254-V258 PolarHBondContact O-N 3.42Å; F255-V258 PolarHBondContact O-N 3.1Å; V258-Q261 PolarHBondContact O-N 2.8Å; V258-F262 PolarHBondContact O-N 2.8Å; V258-L342 HydrophobicContact CG1-CB 4.25Å; V258-L342 HydrophobicContact CG1-CD2 4.27Å; V258-L342 HydrophobicContact CG1-CG 4.22Å; V258-L342 HydrophobicContact CG2-CD2 3.96Å; V258-L342 HydrophobicContact CG2-CG 4.07Å; V258-A343 HydrophobicContact CG1-CB 3.86Å; V258-T346 HydrophobicContact CG2-CG2 4.18Å
259	F	92.6	Very high	91.6	Very high	132 Å²	132	47.8 Å²	47.8	58%	0.579	23%	0.233	S	C	*	.	H	α-helix	trans	-64.7	-41.8	176.4	-172.3	-96.9	0	0	0	112.1	F255 N257 F262 F263	F255-F259 WeakPolarHBondContact O-CB 3.49Å; F255-F259 PolarHBondContact O-N 3.35Å; N257-F259 VanDerWaalsContact C-N 3.31Å; N257-F259 PolarHBondContact O-N 3.46Å; F259-F262 WeakPolarHBondContact O-CB 3.35Å; F259-F262 PolarHBondContact O-N 2.82Å; F259-F263 PolarHBondContact O-N 2.72Å
260	G	93.1	Very high	90.4	Very high	31 Å²	31	44.9 Å²	44.9	32%	0.32	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-40.9	174.5	0	0	0	0	0	112.7	V256 N257 F263 L264	V256-G260 WeakPolarHBondContact O-CA 3.22Å; V256-G260 PolarHBondContact O-N 3.35Å; N257-G260 CarbonylContact O-C 3.6Å; N257-G260 WeakPolarHBondContact O-CA 3.37Å; N257-G260 PolarHBondContact O-N 2.82Å; N257-G260 VanDerWaalsContact O-N 3.09Å; G260-F263 PolarHBondContact O-N 3.14Å; G260-L264 VanDerWaalsContact O-CB 3.32Å; G260-L264 WeakPolarHBondContact O-CB 3.11Å; G260-L264 PolarHBondContact O-N 3.36Å
261	Q	93.8	Very high	88.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-41.7	174.9	-65.2	-58.8	-9.9	0	0	111.5	M162 F163 N257 V258 F263 L264 L265 F339	M162-Q261 VanDerWaalsContact CE-NE2 3.29Å; M162-Q261 PolarHBondContact SD-NE2 3.3Å; F163-Q261 HydrophobicContact CD2-CG 4.34Å; F163-Q261 HydrophobicContact CE2-CB 4.25Å; F163-Q261 HydrophobicContact CE2-CG 3.62Å; F163-Q261 HydrophobicContact CZ-CB 4.24Å; F163-Q261 HydrophobicContact CZ-CG 3.83Å; N257-Q261 VanDerWaalsContact O-CG 3.24Å; N257-Q261 WeakPolarHBondContact O-CG 3.41Å; N257-Q261 PolarHBondContact O-N 3.27Å; N257-Q261 PolarHBondContact OD1-NE2 3.13Å; V258-Q261 PolarHBondContact O-N 2.8Å; Q261-F263 VanDerWaalsContact C-N 3.3Å; Q261-F263 PolarHBondContact O-N 2.98Å; Q261-L264 PolarHBondContact O-N 3.46Å; Q261-L265 VanDerWaalsContact O-CB 3.25Å; Q261-L265 WeakPolarHBondContact O-CB 3.44Å; Q261-L265 PolarHBondContact O-N 3.5Å; Q261-F339 HydrophobicContact CB-CD2 4.35Å; Q261-F339 HydrophobicContact CB-CE2 4.07Å; Q261-F339 HydrophobicContact CB-CZ 4.45Å
262	F	89.5	Confident	86.9	Confident	34 Å²	34	57.6 Å²	57.6	15%	0.149	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-44.5	174.2	-170.6	-95.3	0	0	0	111.1	V258 F259 N266 W336 F339	V258-F262 PolarHBondContact O-N 2.8Å; F259-F262 WeakPolarHBondContact O-CB 3.35Å; F259-F262 PolarHBondContact O-N 2.82Å; F262-N266 WeakPolarHBondContact CD1-ND2 3.28Å; F262-N266 VanDerWaalsContact CE1-ND2 3.3Å; F262-N266 WeakPolarHBondContact CE1-ND2 3.45Å; F262-N266 PolarHBondContact O-N 3.12Å; F262-N266 VanDerWaalsContact O-N 3.14Å; F262-N266 PolarHBondContact O-ND2 2.98Å; F262-W336 AromaticContact CE2-CD1 3.76Å; F262-W336 HydrophobicContact CE2-CD2 4.22Å; F262-W336 AromaticContact CE2-CE2 3.76Å; F262-W336 HydrophobicContact CE2-CG 4.23Å; F262-W336 HydrophobicContact CE2-CZ2 4.31Å; F262-W336 AromaticContact CE2-NE1 3.45Å; F262-W336 AromaticContact CZ-CE2 3.72Å; F262-W336 AromaticContact CZ-CZ2 3.97Å; F262-W336 HydrophobicContact CZ-CZ2 3.97Å; F262-W336 AromaticContact CZ-NE1 3.38Å; F262-F339 HydrophobicContact CD2-CB 4.19Å
263	F	87.4	Confident	84.9	Confident	140 Å²	140	60.8 Å²	60.8	61%	0.614	32%	0.316	S	S	*	.	H	α-helix	trans	-66.9	-43.1	176	-174.3	-96.4	0	0	0	112.6	F259 G260 Q261 N266 R267	F259-F263 PolarHBondContact O-N 2.72Å; G260-F263 PolarHBondContact O-N 3.14Å; Q261-F263 VanDerWaalsContact C-N 3.3Å; Q261-F263 PolarHBondContact O-N 2.98Å; F263-N266 PolarHBondContact O-N 3.4Å; F263-R267 HydrophobicContact CE1-CB 4.46Å; F263-R267 VanDerWaalsContact O-CB 3.31Å; F263-R267 WeakPolarHBondContact O-CB 3.25Å; F263-R267 PolarHBondContact O-N 2.98Å
264	L	89.7	Confident	83.2	Confident	63 Å²	63	61.1 Å²	61.1	33%	0.33	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-45.7	178.4	-174.8	147.7	0	0	0	111.1	V155 E159 G260 Q261 R267 F268	V155-L264 HydrophobicContact CG1-CD2 4.01Å; E159-L264 HydrophobicContact CG-CD2 4.44Å; G260-L264 VanDerWaalsContact O-CB 3.32Å; G260-L264 WeakPolarHBondContact O-CB 3.11Å; G260-L264 PolarHBondContact O-N 3.36Å; Q261-L264 PolarHBondContact O-N 3.46Å; L264-R267 PolarHBondContact O-N 3.24Å; L264-F268 VanDerWaalsContact O-CB 3.25Å; L264-F268 WeakPolarHBondContact O-CB 3.37Å; L264-F268 PolarHBondContact O-N 2.93Å
265	L	88.3	Confident	81.3	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-61.9	-46.1	177.9	-169.3	74.7	0	0	0	111.1	Q261 F268 L269 F332 L335 W336 F339	Q261-L265 VanDerWaalsContact O-CB 3.25Å; Q261-L265 WeakPolarHBondContact O-CB 3.44Å; Q261-L265 PolarHBondContact O-N 3.5Å; L265-F268 PolarHBondContact O-N 2.88Å; L265-L269 HydrophobicContact CD1-CD1 4.27Å; L265-L269 HydrophobicContact CG-CD1 4.48Å; L265-L269 WeakPolarHBondContact O-CD1 3.37Å; L265-L269 PolarHBondContact O-N 2.88Å; L265-F332 HydrophobicContact CD1-CD2 3.92Å; L265-F332 HydrophobicContact CD1-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CD2 3.8Å; L265-F332 HydrophobicContact CD2-CE2 3.82Å; L265-F332 HydrophobicContact CG-CD2 3.68Å; L265-F332 HydrophobicContact CG-CE2 3.64Å; L265-L335 HydrophobicContact CD2-CB 4.09Å; L265-W336 HydrophobicContact CD2-CB 4.28Å; L265-F339 HydrophobicContact CD2-CD2 4.13Å; L265-F339 HydrophobicContact CD2-CE2 4.21Å
266	N	85.4	Confident	80.1	Confident	9 Å²	9	68.6 Å²	68.6	5%	0.048	37%	0.367	C	S	.	.	H	α-helix	trans	-64.5	-40.8	176	-74.5	-73.1	0	0	0	111.5	F262 F263 A270	F262-N266 WeakPolarHBondContact CD1-ND2 3.28Å; F262-N266 VanDerWaalsContact CE1-ND2 3.3Å; F262-N266 WeakPolarHBondContact CE1-ND2 3.45Å; F262-N266 PolarHBondContact O-N 3.12Å; F262-N266 VanDerWaalsContact O-N 3.14Å; F262-N266 PolarHBondContact O-ND2 2.98Å; F263-N266 PolarHBondContact O-N 3.4Å; N266-A270 WeakPolarHBondContact O-CB 3.47Å; N266-A270 PolarHBondContact O-N 2.92Å
267	R	84.4	Confident	79.1	Confident	159 Å²	159	64.5 Å²	64.5	60%	0.6	34%	0.342	S	S	*	.	H	α-helix	trans	-69.6	-33.9	179.6	-177	60	177.6	126.6	-6.3	113.1	F263 L264 L269	F263-R267 HydrophobicContact CE1-CB 4.46Å; F263-R267 VanDerWaalsContact O-CB 3.31Å; F263-R267 WeakPolarHBondContact O-CB 3.25Å; F263-R267 PolarHBondContact O-N 2.98Å; L264-R267 PolarHBondContact O-N 3.24Å; R267-L269 VanDerWaalsContact C-N 3.31Å
268	F	84.9	Confident	78.3	Confident	60 Å²	60	63.7 Å²	63.7	26%	0.263	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-33.1	-179.8	179.2	-115.8	0	0	0	112.1	Y148 W151 V152 V155 L264 L265	Y148-F268 WeakPolarHBondContact O-CZ 3.29Å; W151-F268 HydrophobicContact CB-CE2 4.09Å; W151-F268 HydrophobicContact CB-CZ 4.02Å; V152-F268 HydrophobicContact CG2-CE1 4.13Å; V152-F268 HydrophobicContact CG2-CZ 4.36Å; V155-F268 HydrophobicContact CB-CZ 4.44Å; V155-F268 HydrophobicContact CG1-CD1 4.44Å; V155-F268 HydrophobicContact CG2-CD2 4.14Å; V155-F268 HydrophobicContact CG2-CE1 4.33Å; V155-F268 HydrophobicContact CG2-CE2 3.7Å; V155-F268 HydrophobicContact CG2-CZ 3.81Å; L264-F268 VanDerWaalsContact O-CB 3.25Å; L264-F268 WeakPolarHBondContact O-CB 3.37Å; L264-F268 PolarHBondContact O-N 2.93Å; L265-F268 PolarHBondContact O-N 2.88Å
269	L	77.9	Confident	77.6	Confident	22 Å²	22	65.6 Å²	65.6	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-99	-25.6	-179.9	-74.4	89.3	0	0	0	114.2	L265 R267 S271 L277 F297 F332	L265-L269 HydrophobicContact CD1-CD1 4.27Å; L265-L269 HydrophobicContact CG-CD1 4.48Å; L265-L269 WeakPolarHBondContact O-CD1 3.37Å; L265-L269 PolarHBondContact O-N 2.88Å; R267-L269 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.2Å; L269-L277 HydrophobicContact CB-CD2 3.45Å; L269-L277 VanDerWaalsContact CB-CD2 3.45Å; L269-L277 HydrophobicContact CD2-CD2 4.43Å; L269-F297 HydrophobicContact CD2-CE1 3.32Å; L269-F297 HydrophobicContact CD2-CE2 4.3Å; L269-F297 HydrophobicContact CD2-CZ 3.13Å; L269-F332 HydrophobicContact CB-CE2 4.33Å; L269-F332 HydrophobicContact CD1-CD2 3.49Å; L269-F332 VanDerWaalsContact CD1-CD2 3.49Å; L269-F332 HydrophobicContact CD1-CE2 3.64Å; L269-F332 HydrophobicContact CD1-CG 4.44Å; L269-F332 HydrophobicContact CD2-CB 4.07Å; L269-F332 HydrophobicContact CD2-CD1 4.02Å; L269-F332 HydrophobicContact CD2-CD2 3.36Å; L269-F332 HydrophobicContact CD2-CE1 4.29Å; L269-F332 HydrophobicContact CD2-CE2 3.66Å; L269-F332 HydrophobicContact CD2-CG 3.54Å; L269-F332 HydrophobicContact CD2-CZ 4.13Å; L269-F332 HydrophobicContact CG-CD2 4.03Å; L269-F332 HydrophobicContact CG-CE2 4.1Å
270	A	66.3	Low	77.1	Confident	16 Å²	16	61 Å²	61	13%	0.132	34%	0.338	C	S	.	.			trans	-75.8	110.1	-178.3	0	0	0	0	0	111.5	N266	N266-A270 WeakPolarHBondContact O-CB 3.47Å; N266-A270 PolarHBondContact O-N 2.92Å
271	S	61.4	Low	76.6	Confident	99 Å²	99	60.1 Å²	60.1	69%	0.692	33%	0.327	S	S	*	.			trans	-80.3	116.7	155.7	-168.4	0	0	0	0	109.2	L269 S273	L269-S271 PolarHBondContact O-N 3.2Å; S271-S273 PolarHBondContact O-N 3.28Å
272	E	54.7	Low	76.2	Confident	176 Å²	176	62.2 Å²	62.2	82%	0.822	34%	0.337	S	S	*	.	S	Bend	trans	53.3	-9.8	161.3	-67	-83.6	127.1	0	0	123.1
273	S	53.5	Low	76	Confident	108 Å²	108	65.4 Å²	65.4	76%	0.755	35%	0.354	S	S	*	.	S	Bend	trans	-155.3	-1.4	-179.2	63.9	0	0	0	0	121.5	S271	S271-S273 PolarHBondContact O-N 3.28Å
274	T	60.5	Low	75.9	Confident	56 Å²	56	60.6 Å²	60.6	34%	0.344	34%	0.335	S	S	.	.			trans	-125.9	92.7	-177.9	45.4	0	0	0	0	112.7	F276 L277	T274-F276 PolarHBondContact O-N 3.32Å; T274-L277 PolarHBondContact O-N 3.26Å; T274-L277 WeakPolarHBondContact OG1-CD1 3.44Å
275	A	57.6	Low	75.6	Confident	77 Å²	77	62.2 Å²	62.2	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.2	176	0	0	0	0	0	113.8
276	F	71.3	Confident	75.6	Confident	139 Å²	139	68.4 Å²	68.4	61%	0.61	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	44.6	178.4	-66.4	-80.3	0	0	0	111.9	T274 G278 A279 S280	T274-F276 PolarHBondContact O-N 3.32Å; F276-G278 PolarHBondContact O-N 3.4Å; F276-G278 VanDerWaalsContact O-N 3.16Å; F276-A279 HydrophobicContact CB-CB 4.27Å; F276-A279 PolarHBondContact O-N 2.88Å; F276-S280 PolarHBondContact O-N 3.46Å; F276-S280 VanDerWaalsContact O-N 3.1Å
277	L	75.8	Confident	75.8	Confident	8 Å²	8	73.7 Å²	73.7	4%	0.042	40%	0.4	C	S	.	.	H	α-helix	trans	-49.6	-41.4	179.7	-173	75.9	0	0	0	112.3	L269 T274 A279 S280 V281 V296 F332	L269-L277 HydrophobicContact CB-CD2 3.45Å; L269-L277 VanDerWaalsContact CB-CD2 3.45Å; L269-L277 HydrophobicContact CD2-CD2 4.43Å; T274-L277 PolarHBondContact O-N 3.26Å; T274-L277 WeakPolarHBondContact OG1-CD1 3.44Å; L277-A279 VanDerWaalsContact C-N 3.35Å; L277-A279 PolarHBondContact O-N 3.42Å; L277-S280 WeakPolarHBondContact CA-OG 3.47Å; L277-S280 PolarHBondContact O-N 3.1Å; L277-S280 PolarHBondContact O-OG 3.07Å; L277-V281 HydrophobicContact CD1-CG2 4.35Å; L277-V281 HydrophobicContact CG-CG2 4.1Å; L277-V281 WeakPolarHBondContact O-CB 3.35Å; L277-V281 WeakPolarHBondContact O-CG2 3.47Å; L277-V281 PolarHBondContact O-N 2.63Å; L277-V296 HydrophobicContact CD1-CG1 4.12Å; L277-V296 HydrophobicContact CD1-CG2 4.19Å; L277-F332 HydrophobicContact CD2-CZ 4.23Å
278	G	79.5	Confident	75.9	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-62.5	-39.5	178.9	0	0	0	0	0	113.8	F276 I282	F276-G278 PolarHBondContact O-N 3.4Å; F276-G278 VanDerWaalsContact O-N 3.16Å; G278-I282 WeakPolarHBondContact O-CB 3.19Å; G278-I282 WeakPolarHBondContact O-CD1 3.47Å; G278-I282 VanDerWaalsContact O-CG1 3.22Å; G278-I282 WeakPolarHBondContact O-CG1 3.47Å; G278-I282 PolarHBondContact O-N 3.09Å
279	A	81.2	Confident	75.9	Confident	41 Å²	41	68.9 Å²	68.9	34%	0.339	40%	0.402	S	S	.	.	H	α-helix	trans	-70	-38.8	177.6	0	0	0	0	0	111.8	F276 L277 I282 M283 W336	F276-A279 HydrophobicContact CB-CB 4.27Å; F276-A279 PolarHBondContact O-N 2.88Å; L277-A279 VanDerWaalsContact C-N 3.35Å; L277-A279 PolarHBondContact O-N 3.42Å; A279-I282 PolarHBondContact O-N 3.42Å; A279-M283 WeakPolarHBondContact O-CB 3.39Å; A279-M283 PolarHBondContact O-N 3.43Å; A279-W336 HydrophobicContact CB-CH2 4.12Å; A279-W336 HydrophobicContact CB-CZ2 4.01Å
280	S	82.7	Confident	76.3	Confident	36 Å²	36	73.3 Å²	73.3	25%	0.252	42%	0.422	S	S	.	.	H	α-helix	trans	-67.8	-40.8	175.9	62.7	0	0	0	0	111.7	F276 L277 I282 M283 N284	F276-S280 PolarHBondContact O-N 3.46Å; F276-S280 VanDerWaalsContact O-N 3.1Å; L277-S280 WeakPolarHBondContact CA-OG 3.47Å; L277-S280 PolarHBondContact O-N 3.1Å; L277-S280 PolarHBondContact O-OG 3.07Å; S280-I282 PolarHBondContact O-N 3.14Å; S280-M283 PolarHBondContact O-N 3.24Å; S280-N284 VanDerWaalsContact O-CB 3.3Å; S280-N284 WeakPolarHBondContact O-CB 3.3Å; S280-N284 PolarHBondContact O-N 2.87Å; S280-N284 PolarHBondContact O-ND2 3.41Å; S280-N284 PolarHBondContact O-OD1 2.84Å
281	V	82.6	Confident	77.2	Confident	12 Å²	12	73.9 Å²	73.9	7%	0.073	42%	0.42	C	S	.	.	H	α-helix	trans	-62.6	-42.9	175.2	176.8	0	0	0	0	110.9	L277 N284 L285 V296 F297 L333	L277-V281 HydrophobicContact CD1-CG2 4.35Å; L277-V281 HydrophobicContact CG-CG2 4.1Å; L277-V281 WeakPolarHBondContact O-CB 3.35Å; L277-V281 WeakPolarHBondContact O-CG2 3.47Å; L277-V281 PolarHBondContact O-N 2.63Å; V281-N284 PolarHBondContact O-N 2.99Å; V281-L285 VanDerWaalsContact O-CB 3.3Å; V281-L285 WeakPolarHBondContact O-CB 3.45Å; V281-L285 PolarHBondContact O-N 3.42Å; V281-V296 HydrophobicContact CG2-CG1 3.82Å; V281-F297 HydrophobicContact CG1-CE2 4.44Å; V281-F297 HydrophobicContact CG2-CE2 4.35Å; V281-L333 HydrophobicContact CB-CD2 4.37Å; V281-L333 HydrophobicContact CG1-CD1 4.48Å; V281-L333 HydrophobicContact CG1-CD2 3.78Å; V281-L333 HydrophobicContact CG1-CG 4.35Å
282	I	85	Confident	78.4	Confident	43 Å²	43	73.4 Å²	73.4	22%	0.221	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-45.2	175.8	-70.1	164.4	0	0	0	110.8	G278 A279 S280 L285 L286 L333 W336 L337	G278-I282 WeakPolarHBondContact O-CB 3.19Å; G278-I282 WeakPolarHBondContact O-CD1 3.47Å; G278-I282 VanDerWaalsContact O-CG1 3.22Å; G278-I282 WeakPolarHBondContact O-CG1 3.47Å; G278-I282 PolarHBondContact O-N 3.09Å; A279-I282 PolarHBondContact O-N 3.42Å; S280-I282 PolarHBondContact O-N 3.14Å; I282-L285 PolarHBondContact O-N 2.68Å; I282-L286 HydrophobicContact CG2-CD1 4.02Å; I282-L286 HydrophobicContact CG2-CG 4.45Å; I282-L286 VanDerWaalsContact O-CG 3.32Å; I282-L286 WeakPolarHBondContact O-CG 3.28Å; I282-L286 PolarHBondContact O-N 3.23Å; I282-L333 HydrophobicContact CG1-CD2 3.74Å; I282-W336 HydrophobicContact CD1-CD2 4.4Å; I282-W336 HydrophobicContact CD1-CE3 3.46Å; I282-W336 VanDerWaalsContact CD1-CE3 3.46Å; I282-W336 HydrophobicContact CD1-CH2 4.17Å; I282-W336 HydrophobicContact CD1-CZ3 3.33Å; I282-L337 HydrophobicContact CD1-CD2 3.87Å; I282-L337 HydrophobicContact CD1-CG 4.22Å
283	M	85.5	Confident	79.7	Confident	102 Å²	102	71 Å²	71	50%	0.502	40%	0.4	S	S	.	.	H	α-helix	trans	-62.9	-45.5	178.2	-174.2	63.4	75.2	0	0	111.6	A279 S280 L285 L286 Q287	A279-M283 WeakPolarHBondContact O-CB 3.39Å; A279-M283 PolarHBondContact O-N 3.43Å; S280-M283 PolarHBondContact O-N 3.24Å; M283-L285 VanDerWaalsContact C-N 3.29Å; M283-L285 PolarHBondContact O-N 3.29Å; M283-L286 PolarHBondContact O-N 3.42Å; M283-Q287 WeakPolarHBondContact O-CB 3.29Å; M283-Q287 WeakPolarHBondContact O-CG 3.35Å; M283-Q287 PolarHBondContact O-N 3.36Å
284	N	84.8	Confident	81.1	Confident	39 Å²	39	67.9 Å²	67.9	21%	0.209	38%	0.378	C	S	.	.	H	α-helix	trans	-59.4	-42.6	176.6	-70.8	-9.4	0	0	0	110.8	S280 V281 Q287 G288 I289	S280-N284 VanDerWaalsContact O-CB 3.3Å; S280-N284 WeakPolarHBondContact O-CB 3.3Å; S280-N284 PolarHBondContact O-N 2.87Å; S280-N284 PolarHBondContact O-ND2 3.41Å; S280-N284 PolarHBondContact O-OD1 2.84Å; V281-N284 PolarHBondContact O-N 2.99Å; N284-Q287 CarbonylContact O-C 3.59Å; N284-Q287 PolarHBondContact O-N 3.03Å; N284-G288 PolarHBondContact O-N 3.49Å; N284-I289 HydrophobicContact CB-CB 4.13Å; N284-I289 PolarHBondContact O-N 2.96Å
285	L	83.8	Confident	82.1	Confident	96 Å²	96	66.2 Å²	66.2	50%	0.503	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-37.5	177.7	-171.8	64.9	0	0	0	112.5	V281 I282 M283 Q287 G288 L333	V281-L285 VanDerWaalsContact O-CB 3.3Å; V281-L285 WeakPolarHBondContact O-CB 3.45Å; V281-L285 PolarHBondContact O-N 3.42Å; I282-L285 PolarHBondContact O-N 2.68Å; M283-L285 VanDerWaalsContact C-N 3.29Å; M283-L285 PolarHBondContact O-N 3.29Å; L285-Q287 VanDerWaalsContact C-N 3.3Å; L285-G288 PolarHBondContact O-N 3.47Å; L285-L333 HydrophobicContact CD2-CD1 4.11Å
286	L	88.1	Confident	83.2	Confident	138 Å²	138	64.3 Å²	64.3	72%	0.723	35%	0.353	S	S	*	.	H	α-helix	trans	-67.7	-31.6	174.3	-73.2	171.7	0	0	0	112.4	I282 M283 G288	I282-L286 HydrophobicContact CG2-CD1 4.02Å; I282-L286 HydrophobicContact CG2-CG 4.45Å; I282-L286 VanDerWaalsContact O-CG 3.32Å; I282-L286 WeakPolarHBondContact O-CG 3.28Å; I282-L286 PolarHBondContact O-N 3.23Å; M283-L286 PolarHBondContact O-N 3.42Å; L286-G288 VanDerWaalsContact C-N 3.31Å
287	Q	90	Very high	83.9	Confident	121 Å²	121	58 Å²	58	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.3	175.8	-69.6	176.7	-13.2	0	0	113.3	M283 N284 L285 I289	M283-Q287 WeakPolarHBondContact O-CB 3.29Å; M283-Q287 WeakPolarHBondContact O-CG 3.35Å; M283-Q287 PolarHBondContact O-N 3.36Å; N284-Q287 CarbonylContact O-C 3.59Å; N284-Q287 PolarHBondContact O-N 3.03Å; L285-Q287 VanDerWaalsContact C-N 3.3Å; Q287-I289 VanDerWaalsContact C-N 3.32Å; Q287-I289 HydrophobicContact CB-CD1 4.15Å; Q287-I289 HydrophobicContact CB-CG1 4.06Å
288	G	86.9	Confident	84.6	Confident	57 Å²	57	57.7 Å²	57.7	59%	0.588	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	20.3	-177	0	0	0	0	0	114.1	N284 L285 L286 E290	N284-G288 PolarHBondContact O-N 3.49Å; L285-G288 PolarHBondContact O-N 3.47Å; L286-G288 VanDerWaalsContact C-N 3.31Å; G288-E290 PolarHBondContact O-N 3.48Å
289	I	85.6	Confident	85.2	Confident	61 Å²	61	61.8 Å²	61.8	31%	0.313	34%	0.339	S	S	.	.			trans	-79.4	117.1	175.8	-58.2	173.5	0	0	0	108.6	N284 Q287 N293	N284-I289 HydrophobicContact CB-CB 4.13Å; N284-I289 PolarHBondContact O-N 2.96Å; Q287-I289 VanDerWaalsContact C-N 3.32Å; Q287-I289 HydrophobicContact CB-CD1 4.15Å; Q287-I289 HydrophobicContact CB-CG1 4.06Å; I289-N293 HydrophobicContact CG2-CB 3.98Å
290	E	86.1	Confident	85.8	Confident	114 Å²	114	61.1 Å²	61.1	53%	0.533	33%	0.33	S	S	.	.			trans	-81.7	169.9	179.1	-60.4	-166.3	172.1	0	0	113.2	G288 Q292 N293 S294	G288-E290 PolarHBondContact O-N 3.48Å; E290-Q292 PolarHBondContact O-N 3.07Å; E290-N293 PolarHBondContact O-N 3.41Å; E290-S294 PolarHBondContact O-N 2.91Å; E290-S294 PolarHBondContact O-OG 3.4Å; E290-S294 VanDerWaalsContact O-OG 3.13Å
291	W	84.9	Confident	86.4	Confident	29 Å²	29	59.4 Å²	59.4	11%	0.11	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-26.1	177.8	61.6	-88.3	0	0	0	113.1	W127 F130 N293 S294 G295 V296 P298 R299 V300	W127-W291 AromaticContact NE1-CE3 3.93Å; W127-W291 AromaticContact NE1-CZ3 3.68Å; F130-W291 HydrophobicContact CE2-CH2 4.2Å; W291-N293 PolarHBondContact O-N 2.98Å; W291-S294 WeakPolarHBondContact CA-OG 3.49Å; W291-S294 PolarHBondContact O-N 3.3Å; W291-G295 WeakPolarHBondContact O-CA 3.31Å; W291-G295 PolarHBondContact O-N 2.91Å; W291-V296 WeakPolarHBondContact CB-O 3.19Å; W291-P298 HydrophobicContact CE3-CB 3.93Å; W291-P298 HydrophobicContact CZ3-CB 4.3Å; W291-R299 HydrophobicContact CD2-CB 4.46Å; W291-R299 HydrophobicContact CG-CG 4.49Å; W291-R299 HydrophobicContact CZ2-CB 4.04Å; W291-V300 HydrophobicContact CH2-CB 3.77Å; W291-V300 HydrophobicContact CH2-CG2 3.75Å; W291-V300 HydrophobicContact CZ2-CG2 4.21Å; W291-V300 HydrophobicContact CZ3-CB 4.3Å
292	Q	85.3	Confident	86.9	Confident	89 Å²	89	60.1 Å²	60.1	42%	0.416	32%	0.322	S	S	.	.	H	α-helix	trans	-59.9	-33.9	178.6	-63.4	173.9	-1.8	0	0	112.5	W127 E290	W127-Q292 VanDerWaalsContact CZ2-O 3.29Å; W127-Q292 WeakPolarHBondContact CZ2-O 3.24Å; E290-Q292 PolarHBondContact O-N 3.07Å
293	N	82.5	Confident	87.4	Confident	125 Å²	125	58.1 Å²	58.1	67%	0.668	31%	0.311	S	S	*	.	H	α-helix	trans	-98.9	-30.2	-178.4	-66	-25.8	0	0	0	112.2	I289 E290 W291	I289-N293 HydrophobicContact CG2-CB 3.98Å; E290-N293 PolarHBondContact O-N 3.41Å; W291-N293 PolarHBondContact O-N 2.98Å
294	S	82.4	Confident	87.8	Confident	42 Å²	42	54.3 Å²	54.3	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-87.8	-23.2	-176.9	57.9	0	0	0	0	113.7	E290 W291 V296	E290-S294 PolarHBondContact O-N 2.91Å; E290-S294 PolarHBondContact O-OG 3.4Å; E290-S294 VanDerWaalsContact O-OG 3.13Å; W291-S294 WeakPolarHBondContact CA-OG 3.49Å; W291-S294 PolarHBondContact O-N 3.3Å; S294-V296 PolarHBondContact O-N 3.04Å; S294-V296 VanDerWaalsContact O-N 3.11Å
295	G	81.4	Confident	88.2	Confident	21 Å²	21	52.6 Å²	52.6	22%	0.216	28%	0.284	C	S	.	.			trans	67.4	0.6	-172.1	0	0	0	0	0	114.3	W291	W291-G295 WeakPolarHBondContact O-CA 3.31Å; W291-G295 PolarHBondContact O-N 2.91Å
296	V	81.4	Confident	88.5	Confident	38 Å²	38	50.6 Å²	50.6	23%	0.23	27%	0.274	C	S	.	.	S	Bend	trans	-89.9	128.4	179.8	-168.4	0	0	0	0	108.9	L277 V281 W291 S294	L277-V296 HydrophobicContact CD1-CG1 4.12Å; L277-V296 HydrophobicContact CD1-CG2 4.19Å; V281-V296 HydrophobicContact CG2-CG1 3.82Å; W291-V296 WeakPolarHBondContact CB-O 3.19Å; S294-V296 PolarHBondContact O-N 3.04Å; S294-V296 VanDerWaalsContact O-N 3.11Å
297	F	86.9	Confident	88.7	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.026	25%	0.253	C	S	.	.	S	Bend	trans	52.2	61.2	-174.6	-54.8	-70.3	0	0	0	114.4	Y148 L269 V281 R299 N325 T328 E329 F332	Y148-F297 WeakPolarHBondContact OH-CD1 3.49Å; L269-F297 HydrophobicContact CD2-CE1 3.32Å; L269-F297 HydrophobicContact CD2-CE2 4.3Å; L269-F297 HydrophobicContact CD2-CZ 3.13Å; V281-F297 HydrophobicContact CG1-CE2 4.44Å; V281-F297 HydrophobicContact CG2-CE2 4.35Å; F297-R299 PolarHBondContact O-N 3.31Å; F297-N325 WeakPolarHBondContact CA-ND2 3.36Å; F297-N325 VanDerWaalsContact CD1-OD1 3.24Å; F297-N325 WeakPolarHBondContact CD1-OD1 3.23Å; F297-N325 PolarHBondContact O-ND2 3.41Å; F297-T328 HydrophobicContact CE1-CG2 4.12Å; F297-E329 HydrophobicContact CB-CB 4.32Å; F297-E329 HydrophobicContact CB-CG 4.38Å; F297-E329 HydrophobicContact CD1-CB 4.46Å; F297-E329 HydrophobicContact CD2-CB 4.16Å; F297-E329 HydrophobicContact CD2-CG 3.84Å; F297-E329 HydrophobicContact CE2-CG 4.31Å; F297-E329 HydrophobicContact CG-CB 4.09Å; F297-E329 HydrophobicContact CG-CG 4.2Å; F297-F332 AromaticContact CE2-CD1 4Å; F297-F332 HydrophobicContact CE2-CD1 4Å; F297-F332 HydrophobicContact CE2-CE1 4.48Å; F297-F332 HydrophobicContact CZ-CB 3.99Å; F297-F332 AromaticContact CZ-CD1 3.67Å; F297-F332 HydrophobicContact CZ-CD1 3.67Å; F297-F332 HydrophobicContact CZ-CE1 4.33Å; F297-F332 AromaticContact CZ-CG 3.92Å; F297-F332 HydrophobicContact CZ-CG 3.92Å
298	P	90.5	Very high	88.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.267	C	S	.	.			trans	-67	130.3	179.2	28.8	-34.5	0	0	0	112.3	W127 I146 W291 T301 N325	W127-P298 HydrophobicContact CB-CB 4.04Å; W127-P298 HydrophobicContact CB-CG 3.86Å; W127-P298 HydrophobicContact CD2-CB 4.34Å; W127-P298 HydrophobicContact CG-CB 3.59Å; W127-P298 HydrophobicContact CG-CG 3.93Å; I146-P298 HydrophobicContact CD1-CG 3.52Å; W291-P298 HydrophobicContact CE3-CB 3.93Å; W291-P298 HydrophobicContact CZ3-CB 4.3Å; P298-T301 HydrophobicContact CB-CG2 4.32Å; P298-T301 HydrophobicContact CG-CG2 4.06Å; P298-N325 VanDerWaalsContact N-ND2 3.17Å; P298-N325 PolarHBondContact O-ND2 3.3Å
299	R	91.7	Very high	88.8	Confident	86 Å²	86	53.1 Å²	53.1	33%	0.325	26%	0.264	S	S	.	.	S	Bend	trans	-87.3	-15.4	179	-61.4	-178.3	-174.9	164.8	5.1	113	W291 F297 V321 L322 E329	W291-R299 HydrophobicContact CD2-CB 4.46Å; W291-R299 HydrophobicContact CG-CG 4.49Å; W291-R299 HydrophobicContact CZ2-CB 4.04Å; F297-R299 PolarHBondContact O-N 3.31Å; R299-V321 CarbonylContact O-C 3.49Å; R299-V321 WeakPolarHBondContact O-CA 3.45Å; R299-L322 PolarHBondContact O-N 3.28Å; R299-E329 IonicContact CZ-OE2 3.33Å; R299-E329 IonicContact NE-OE2 3.45Å; R299-E329 IonicContact NH2-OE2 2.63Å; R299-E329 PolarHBondContact NH2-OE2 3.34Å
300	V	93.8	Very high	88.8	Confident	27 Å²	27	58.9 Å²	58.9	16%	0.164	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.3	175.5	-177.2	0	0	0	0	107.7	F130 W291 Q319 C320	F130-V300 HydrophobicContact CZ-CB 4.42Å; F130-V300 HydrophobicContact CZ-CG1 4.1Å; W291-V300 HydrophobicContact CH2-CB 3.77Å; W291-V300 HydrophobicContact CH2-CG2 3.75Å; W291-V300 HydrophobicContact CZ2-CG2 4.21Å; W291-V300 HydrophobicContact CZ3-CB 4.3Å; V300-Q319 HydrophobicContact CG1-CG 3.38Å; V300-C320 WeakPolarHBondContact CA-O 3.17Å
301	T	94.1	Very high	88.6	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.7	-178.2	53.9	0	0	0	0	110	T125 Y126 P298 C320	T125-T301 WeakPolarHBondContact CB-OG1 3.38Å; T125-T301 PolarHBondContact OG1-OG1 3.23Å; Y126-T301 CarbonylContact O-C 3.58Å; Y126-T301 WeakPolarHBondContact O-CA 3.5Å; Y126-T301 WeakPolarHBondContact O-CB 3.44Å; P298-T301 HydrophobicContact CB-CG2 4.32Å; P298-T301 HydrophobicContact CG-CG2 4.06Å; T301-C320 PolarHBondContact N-O 3.03Å; T301-C320 PolarHBondContact O-N 2.87Å
302	L	94.9	Very high	88.9	Confident	26 Å²	26	60.8 Å²	60.8	14%	0.136	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	146	174.1	-62.7	171.4	0	0	0	109.8	T125 Y126 V128 I134 T317 V318 Q319	T125-L302 WeakPolarHBondContact CA-O 3.26Å; T125-L302 WeakPolarHBondContact CB-O 3.3Å; Y126-L302 HydrophobicContact CD1-CB 4.3Å; Y126-L302 WeakPolarHBondContact CD1-O 3.3Å; Y126-L302 HydrophobicContact CD2-CB 4.17Å; Y126-L302 HydrophobicContact CE1-CB 3.78Å; Y126-L302 HydrophobicContact CE2-CB 3.63Å; Y126-L302 HydrophobicContact CE2-CD1 3.65Å; Y126-L302 HydrophobicContact CE2-CG 4.26Å; Y126-L302 HydrophobicContact CG-CB 4.47Å; Y126-L302 VanDerWaalsContact CZ-CB 3.4Å; Y126-L302 PolarHBondContact N-O 3.34Å; Y126-L302 PolarHBondContact O-N 3.41Å; V128-L302 HydrophobicContact CB-CD1 4.33Å; V128-L302 HydrophobicContact CG2-CD1 4.15Å; I134-L302 HydrophobicContact CD1-CD1 3.84Å; I134-L302 HydrophobicContact CG1-CD1 3.9Å; I134-L302 HydrophobicContact CG2-CD1 4.34Å; L302-T317 HydrophobicContact CB-CG2 4.37Å; L302-T317 HydrophobicContact CD2-CG2 4.26Å; L302-V318 WeakPolarHBondContact CA-O 3.48Å; L302-Q319 HydrophobicContact CD2-CB 4.24Å
303	C	95.1	Very high	89.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.1	175.3	171.5	0	0	0	0	109.4	C120 T125 T317 V318	C120-C303 WeakPolarHBondContact CA-SG 3.49Å; C120-C303 HydrophobicContact CB-CB 3.66Å; C120-C303 WeakPolarHBondContact CB-SG 3.48Å; C120-C303 WeakPolarHBondContact SG-CB 3.34Å; C120-C303 CovalentContact SG-SG 2.02Å; C120-C303 PolarHBondContact SG-SG 3.48Å; T125-C303 HydrophobicContact CG2-CB 4.28Å; C303-T317 WeakPolarHBondContact O-CA 3.32Å; C303-V318 HydrophobicContact CB-CG2 4.02Å; C303-V318 PolarHBondContact N-O 3.5Å; C303-V318 PolarHBondContact O-N 3.3Å
304	D	93.8	Very high	89.4	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.123	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.6	174.7	-71.3	-30.5	0	0	0	109.7	Y126 R141 R315 H316 T317	Y126-D304 WeakPolarHBondContact CE1-OD2 3.4Å; Y126-D304 PolarHBondContact OH-OD1 3.33Å; Y126-D304 PolarHBondContact OH-OD2 3.47Å; R141-D304 WeakPolarHBondContact CD-OD2 3.46Å; R141-D304 IonicContact CZ-OD2 3.69Å; R141-D304 IonicContact NE-OD2 3.79Å; R141-D304 IonicContact NH1-OD1 3.21Å; R141-D304 PolarHBondContact NH1-OD1 3.02Å; R141-D304 IonicContact NH1-OD2 2.79Å; R141-D304 PolarHBondContact NH1-OD2 3.35Å; D304-R315 VanDerWaalsContact CB-CZ 3.47Å; D304-R315 VanDerWaalsContact CG-NH2 3.32Å; D304-R315 IonicContact OD2-CZ 2.65Å; D304-R315 IonicContact OD2-NE 2.87Å; D304-R315 PolarHBondContact OD2-NE 2.99Å; D304-R315 IonicContact OD2-NH2 3.48Å; D304-R315 PolarHBondContact OD2-NH2 3.07Å; D304-H316 WeakPolarHBondContact CA-O 3.3Å; D304-T317 WeakPolarHBondContact OD1-CA 3.48Å; D304-T317 WeakPolarHBondContact OD1-CB 3.34Å; D304-T317 VanDerWaalsContact OD1-CG2 3.26Å; D304-T317 WeakPolarHBondContact OD1-CG2 3.4Å; D304-T317 PolarHBondContact OD1-OG1 2.92Å
305	F	92.2	Very high	89.7	Confident	2 Å²	2	62 Å²	62	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.6	173.2	65.6	-89.5	0	0	0	111.4	F108 A116 Y119 I307 H316 V318	F108-F305 HydrophobicContact CE2-CE2 4.23Å; F108-F305 AromaticContact CE2-CZ 3.81Å; F108-F305 HydrophobicContact CE2-CZ 3.81Å; F108-F305 HydrophobicContact CZ-CE2 4.37Å; F108-F305 HydrophobicContact CZ-CZ 4.15Å; A116-F305 HydrophobicContact CB-CE1 4.08Å; A116-F305 HydrophobicContact CB-CZ 4.09Å; Y119-F305 HydrophobicContact CD1-CB 3.38Å; Y119-F305 HydrophobicContact CD1-CG 4.35Å; Y119-F305 HydrophobicContact CE1-CB 3.22Å; Y119-F305 HydrophobicContact CG-CB 4.23Å; F305-I307 HydrophobicContact CD2-CG1 4.08Å; F305-I307 HydrophobicContact CE2-CD1 3.96Å; F305-I307 HydrophobicContact CE2-CG1 3.92Å; F305-H316 HydrophobicContact CD1-CB 4.42Å; F305-H316 HydrophobicContact CD2-CB 4.39Å; F305-H316 HydrophobicContact CE1-CB 3.91Å; F305-H316 HydrophobicContact CE2-CB 3.87Å; F305-H316 HydrophobicContact CZ-CB 3.58Å; F305-H316 PolarHBondContact N-O 2.95Å; F305-H316 PolarHBondContact O-N 3.27Å; F305-V318 HydrophobicContact CD1-CG2 4.2Å; F305-V318 HydrophobicContact CE1-CB 4.35Å; F305-V318 HydrophobicContact CE1-CG1 3.69Å; F305-V318 HydrophobicContact CE1-CG2 3.73Å; F305-V318 HydrophobicContact CZ-CG1 4.25Å
306	D	91.4	Very high	90.2	Very high	55 Å²	55	63.5 Å²	63.5	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.7	-176.3	-59.3	-33.4	0	0	0	111.3	L313 H314 R315	D306-L313 HydrophobicContact CB-CD1 3.66Å; D306-L313 HydrophobicContact CB-CD2 4.13Å; D306-L313 HydrophobicContact CB-CG 3.87Å; D306-H314 WeakPolarHBondContact CA-O 3.45Å; D306-R315 WeakPolarHBondContact OD1-CA 3.49Å; D306-R315 WeakPolarHBondContact OD1-CB 3.3Å; D306-R315 VanDerWaalsContact OD1-CG 3.25Å; D306-R315 WeakPolarHBondContact OD1-CG 3.22Å
307	I	90.8	Very high	90.8	Very high	57 Å²	57	64.4 Å²	64.4	29%	0.292	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.2	172.1	-56.5	179.1	0	0	0	108.9	F108 F305 V309 H314	F108-I307 HydrophobicContact CZ-CD1 4.11Å; F305-I307 HydrophobicContact CD2-CG1 4.08Å; F305-I307 HydrophobicContact CE2-CD1 3.96Å; F305-I307 HydrophobicContact CE2-CG1 3.92Å; I307-V309 HydrophobicContact CG2-CG2 4.31Å; I307-H314 PolarHBondContact N-O 3.31Å; I307-H314 PolarHBondContact O-N 3.47Å
308	R	90.9	Very high	91.2	Very high	226 Å²	226	64.4 Å²	64.4	85%	0.853	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	116.9	173.8	-67.1	-177.8	179.6	-148.1	-0.7	110.2	L313	R308-L313 HydrophobicContact CG-CD1 3.68Å
309	V	88.4	Confident	91.4	Very high	85 Å²	85	68.2 Å²	68.2	52%	0.515	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	153.5	166.7	-175.6	0	0	0	0	107.5	I307 G311 N312	I307-V309 HydrophobicContact CG2-CG2 4.31Å; V309-G311 PolarHBondContact O-N 3.3Å; V309-N312 PolarHBondContact N-O 3.43Å; V309-N312 PolarHBondContact O-N 2.95Å
310	L	85.5	Confident	91.6	Very high	182 Å²	182	64.1 Å²	64.1	95%	0.953	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	108.4	-179.3	-81.6	152	0	0	0	111
311	G	83.6	Confident	91.6	Very high	79 Å²	79	66.1 Å²	66.1	81%	0.814	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	-19.1	177.6	0	0	0	0	0	116.3	V309	V309-G311 PolarHBondContact O-N 3.3Å
312	N	89.5	Confident	91.5	Very high	104 Å²	104	66.2 Å²	66.2	56%	0.556	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	143	-174.3	-70.2	-19.6	0	0	0	112.4	V309	V309-N312 PolarHBondContact N-O 3.43Å; V309-N312 PolarHBondContact O-N 2.95Å
313	L	89.3	Confident	91.3	Very high	103 Å²	103	67.3 Å²	67.3	54%	0.539	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	116.5	169.7	-170.4	73.7	0	0	0	107.9	D306 R308	D306-L313 HydrophobicContact CB-CD1 3.66Å; D306-L313 HydrophobicContact CB-CD2 4.13Å; D306-L313 HydrophobicContact CB-CG 3.87Å; R308-L313 HydrophobicContact CG-CD1 3.68Å
314	H	89.3	Confident	91	Very high	88 Å²	88	67.3 Å²	67.3	41%	0.407	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.9	177.2	-68.6	-74.8	0	0	0	109.5	D306 I307	D306-H314 WeakPolarHBondContact CA-O 3.45Å; I307-H314 PolarHBondContact N-O 3.31Å; I307-H314 PolarHBondContact O-N 3.47Å
315	R	89.6	Confident	90.8	Very high	91 Å²	91	66.2 Å²	66.2	34%	0.343	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.3	174.5	-176.4	163.7	172.5	127.8	-16.3	109.9	D304 D306	D304-R315 VanDerWaalsContact CB-CZ 3.47Å; D304-R315 VanDerWaalsContact CG-NH2 3.32Å; D304-R315 IonicContact OD2-CZ 2.65Å; D304-R315 IonicContact OD2-NE 2.87Å; D304-R315 PolarHBondContact OD2-NE 2.99Å; D304-R315 IonicContact OD2-NH2 3.48Å; D304-R315 PolarHBondContact OD2-NH2 3.07Å; D306-R315 WeakPolarHBondContact OD1-CA 3.49Å; D306-R315 WeakPolarHBondContact OD1-CB 3.3Å; D306-R315 VanDerWaalsContact OD1-CG 3.25Å; D306-R315 WeakPolarHBondContact OD1-CG 3.22Å
316	H	91.8	Very high	90.6	Very high	53 Å²	53	70.9 Å²	70.9	25%	0.245	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.9	173.4	-70	-78	0	0	0	109.5	D304 F305	D304-H316 WeakPolarHBondContact CA-O 3.3Å; F305-H316 HydrophobicContact CD1-CB 4.42Å; F305-H316 HydrophobicContact CD2-CB 4.39Å; F305-H316 HydrophobicContact CE1-CB 3.91Å; F305-H316 HydrophobicContact CE2-CB 3.87Å; F305-H316 HydrophobicContact CZ-CB 3.58Å; F305-H316 PolarHBondContact N-O 2.95Å; F305-H316 PolarHBondContact O-N 3.27Å
317	T	93.6	Very high	90.5	Very high	57 Å²	57	73.3 Å²	73.3	35%	0.35	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.3	167.8	-56.6	0	0	0	0	108.2	I134 R141 L302 C303 D304	I134-T317 HydrophobicContact CD1-CG2 4.38Å; R141-T317 PolarHBondContact NH1-OG1 2.78Å; L302-T317 HydrophobicContact CB-CG2 4.37Å; L302-T317 HydrophobicContact CD2-CG2 4.26Å; C303-T317 WeakPolarHBondContact O-CA 3.32Å; D304-T317 WeakPolarHBondContact OD1-CA 3.48Å; D304-T317 WeakPolarHBondContact OD1-CB 3.34Å; D304-T317 VanDerWaalsContact OD1-CG2 3.26Å; D304-T317 WeakPolarHBondContact OD1-CG2 3.4Å; D304-T317 PolarHBondContact OD1-OG1 2.92Å
318	V	94.5	Very high	90.4	Very high	6 Å²	6	70.9 Å²	70.9	4%	0.036	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.3	177.3	-65.4	0	0	0	0	110.8	C102 V104 L302 C303 F305	C102-V318 HydrophobicContact CB-CG2 4.46Å; V104-V318 HydrophobicContact CG1-CG1 4.44Å; L302-V318 WeakPolarHBondContact CA-O 3.48Å; C303-V318 HydrophobicContact CB-CG2 4.02Å; C303-V318 PolarHBondContact N-O 3.5Å; C303-V318 PolarHBondContact O-N 3.3Å; F305-V318 HydrophobicContact CD1-CG2 4.2Å; F305-V318 HydrophobicContact CE1-CB 4.35Å; F305-V318 HydrophobicContact CE1-CG1 3.69Å; F305-V318 HydrophobicContact CE1-CG2 3.73Å; F305-V318 HydrophobicContact CZ-CG1 4.25Å
319	Q	95.4	Very high	90.3	Very high	81 Å²	81	61 Å²	61	38%	0.379	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.5	174.7	-178.2	177.6	-58.4	0	0	109.4	W103 V300 L302	W103-Q319 HydrophobicContact CB-CB 4.46Å; W103-Q319 WeakPolarHBondContact CB-O 3.37Å; W103-Q319 PolarHBondContact N-O 3.36Å; V300-Q319 HydrophobicContact CG1-CG 3.38Å; L302-Q319 HydrophobicContact CD2-CB 4.24Å
320	C	95.7	Very high	90.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.3	-179.4	-55.5	0	0	0	0	111.7	I100 E101 C102 V300 T301	I100-C320 HydrophobicContact CD1-CB 3.6Å; I100-C320 HydrophobicContact CG1-CB 3.64Å; E101-C320 CarbonylContact O-C 3.5Å; E101-C320 VanDerWaalsContact O-CA 3.28Å; E101-C320 WeakPolarHBondContact O-CA 3.39Å; C102-C320 HydrophobicContact CB-CB 4.1Å; C102-C320 WeakPolarHBondContact CB-SG 3.32Å; C102-C320 WeakPolarHBondContact SG-CB 3.41Å; C102-C320 CovalentContact SG-SG 2.05Å; C102-C320 PolarHBondContact SG-SG 3.39Å; V300-C320 WeakPolarHBondContact CA-O 3.17Å; T301-C320 PolarHBondContact N-O 3.03Å; T301-C320 PolarHBondContact O-N 2.87Å
321	V	94.3	Very high	90.7	Very high	69 Å²	69	53.8 Å²	53.8	42%	0.418	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.8	173.9	-179.4	0	0	0	0	108.8	I100 E101 R299 V323	I100-V321 WeakPolarHBondContact CA-O 3.32Å; E101-V321 PolarHBondContact N-O 2.83Å; E101-V321 VanDerWaalsContact N-O 3.13Å; E101-V321 PolarHBondContact O-N 3.09Å; R299-V321 CarbonylContact O-C 3.49Å; R299-V321 WeakPolarHBondContact O-CA 3.45Å; V321-V323 HydrophobicContact CG1-CG2 4.43Å; V321-V323 PolarHBondContact O-N 3.32Å
322	L	91.7	Very high	91	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	25%	0.248	C	C	.	.			trans	-101.2	82.8	-174.3	-164	66.8	0	0	0	110.9	I100 W121 Y149 R299 I324 N325	I100-L322 HydrophobicContact CB-CD1 4.2Å; I100-L322 HydrophobicContact CD1-CD1 4.26Å; I100-L322 HydrophobicContact CG1-CD1 4.2Å; W121-L322 HydrophobicContact CE3-CD1 4.48Å; W121-L322 HydrophobicContact CZ3-CD1 4.08Å; Y149-L322 HydrophobicContact CD1-CD2 4.07Å; Y149-L322 HydrophobicContact CD2-CD2 3.56Å; Y149-L322 HydrophobicContact CE1-CD2 3.78Å; Y149-L322 HydrophobicContact CE2-CD2 3.23Å; Y149-L322 HydrophobicContact CG-CD2 3.96Å; R299-L322 PolarHBondContact O-N 3.28Å; L322-I324 HydrophobicContact CD1-CG2 3.79Å; L322-I324 HydrophobicContact CD2-CG2 4.4Å; L322-I324 HydrophobicContact CG-CG2 3.76Å; L322-I324 PolarHBondContact O-N 2.78Å; L322-N325 HydrophobicContact CB-CB 4.45Å; L322-N325 HydrophobicContact CD2-CB 4.08Å; L322-N325 HydrophobicContact CG-CB 4.22Å; L322-N325 WeakPolarHBondContact O-CB 3.25Å; L322-N325 PolarHBondContact O-N 3.37Å; L322-N325 VanDerWaalsContact O-N 3.11Å
323	V	90.4	Very high	91	Very high	49 Å²	49	46.1 Å²	46.1	30%	0.297	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-33.7	-175.4	-174.9	0	0	0	0	111.8	P99 V321 N325 M326 F327	P99-V323 PolarHBondContact O-N 2.93Å; V321-V323 HydrophobicContact CG1-CG2 4.43Å; V321-V323 PolarHBondContact O-N 3.32Å; V323-N325 PolarHBondContact O-N 2.93Å; V323-M326 PolarHBondContact O-N 2.84Å; V323-F327 HydrophobicContact CG1-CE2 4.45Å
324	I	90.1	Very high	91.2	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-28	179.1	-168.3	163.5	0	0	0	112.5	V90 Q94 W121 L322 M326 F327 T328	V90-I324 HydrophobicContact CG1-CD1 4.23Å; Q94-I324 HydrophobicContact CB-CD1 4.27Å; W121-I324 HydrophobicContact CH2-CD1 4.07Å; W121-I324 HydrophobicContact CH2-CG2 4.26Å; W121-I324 HydrophobicContact CZ3-CG2 4.08Å; L322-I324 HydrophobicContact CD1-CG2 3.79Å; L322-I324 HydrophobicContact CD2-CG2 4.4Å; L322-I324 HydrophobicContact CG-CG2 3.76Å; L322-I324 PolarHBondContact O-N 2.78Å; I324-M326 VanDerWaalsContact C-N 3.31Å; I324-M326 PolarHBondContact O-N 2.82Å; I324-F327 PolarHBondContact O-N 2.87Å; I324-F327 VanDerWaalsContact O-N 3.1Å; I324-T328 PolarHBondContact O-N 3.42Å; I324-T328 VanDerWaalsContact O-N 3.08Å; I324-T328 PolarHBondContact O-OG1 3.09Å
325	N	89.2	Confident	91.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-32	-175.9	-153.2	5	0	0	0	113.1	Y149 F297 P298 L322 V323 F327 T328 E329	Y149-N325 HydrophobicContact CE1-CB 4.13Å; Y149-N325 VanDerWaalsContact CE1-CG 3.47Å; Y149-N325 VanDerWaalsContact CE1-OD1 3.31Å; Y149-N325 WeakPolarHBondContact CE1-OD1 3.29Å; Y149-N325 PolarHBondContact OH-ND2 3.31Å; F297-N325 WeakPolarHBondContact CA-ND2 3.36Å; F297-N325 VanDerWaalsContact CD1-OD1 3.24Å; F297-N325 WeakPolarHBondContact CD1-OD1 3.23Å; F297-N325 PolarHBondContact O-ND2 3.41Å; P298-N325 VanDerWaalsContact N-ND2 3.17Å; P298-N325 PolarHBondContact O-ND2 3.3Å; L322-N325 HydrophobicContact CB-CB 4.45Å; L322-N325 HydrophobicContact CD2-CB 4.08Å; L322-N325 HydrophobicContact CG-CB 4.22Å; L322-N325 WeakPolarHBondContact O-CB 3.25Å; L322-N325 PolarHBondContact O-N 3.37Å; L322-N325 VanDerWaalsContact O-N 3.11Å; V323-N325 PolarHBondContact O-N 2.93Å; N325-F327 PolarHBondContact O-N 2.96Å; N325-T328 PolarHBondContact O-N 3.24Å; N325-E329 WeakPolarHBondContact O-CB 3Å; N325-E329 PolarHBondContact O-N 3.3Å
326	M	88	Confident	91.5	Very high	100 Å²	100	37.8 Å²	37.8	49%	0.493	19%	0.186	S	C	.	.	H	α-helix	trans	-59.5	-36.3	173.5	-177.2	178.9	172	0	0	111.5	V323 I324 K330	V323-M326 PolarHBondContact O-N 2.84Å; I324-M326 VanDerWaalsContact C-N 3.31Å; I324-M326 PolarHBondContact O-N 2.82Å; M326-K330 WeakPolarHBondContact O-CG 3.39Å
327	F	89.1	Confident	91.6	Very high	105 Å²	105	39.2 Å²	39.2	46%	0.461	20%	0.195	S	C	.	.	H	α-helix	trans	-75.1	-44.9	176.2	-68.3	-84.9	0	0	0	111.5	K93 V323 I324 N325 E329 K330 I331	K93-F327 HydrophobicContact CD-CE2 4.41Å; K93-F327 HydrophobicContact CG-CD2 4.37Å; K93-F327 HydrophobicContact CG-CE2 4.31Å; V323-F327 HydrophobicContact CG1-CE2 4.45Å; I324-F327 PolarHBondContact O-N 2.87Å; I324-F327 VanDerWaalsContact O-N 3.1Å; N325-F327 PolarHBondContact O-N 2.96Å; F327-E329 VanDerWaalsContact C-N 3.33Å; F327-E329 PolarHBondContact O-N 3.5Å; F327-K330 PolarHBondContact O-N 3.16Å; F327-K330 VanDerWaalsContact O-N 3.16Å; F327-I331 WeakPolarHBondContact O-CG1 3.42Å; F327-I331 PolarHBondContact O-N 3.28Å
328	T	89.1	Confident	91.6	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.043	19%	0.19	C	C	.	.	H	α-helix	trans	-59.3	-42.8	179.6	-53.8	0	0	0	0	112	Y148 V152 F297 I324 N325 K330 I331 F332	Y148-T328 HydrophobicContact CE2-CG2 4.26Å; V152-T328 HydrophobicContact CG2-CG2 4.13Å; F297-T328 HydrophobicContact CE1-CG2 4.12Å; I324-T328 PolarHBondContact O-N 3.42Å; I324-T328 VanDerWaalsContact O-N 3.08Å; I324-T328 PolarHBondContact O-OG1 3.09Å; N325-T328 PolarHBondContact O-N 3.24Å; T328-K330 VanDerWaalsContact C-N 3.32Å; T328-K330 PolarHBondContact O-N 3.03Å; T328-I331 PolarHBondContact O-N 2.85Å; T328-F332 VanDerWaalsContact O-CB 3.3Å; T328-F332 WeakPolarHBondContact O-CB 3.46Å; T328-F332 PolarHBondContact O-N 3.44Å
329	E	88.6	Confident	91.6	Very high	18 Å²	18	39.2 Å²	39.2	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-53.1	-48.5	174.6	-171.9	-154.9	131.6	0	0	111.1	F297 R299 N325 F327 L333	F297-E329 HydrophobicContact CB-CB 4.32Å; F297-E329 HydrophobicContact CB-CG 4.38Å; F297-E329 HydrophobicContact CD1-CB 4.46Å; F297-E329 HydrophobicContact CD2-CB 4.16Å; F297-E329 HydrophobicContact CD2-CG 3.84Å; F297-E329 HydrophobicContact CE2-CG 4.31Å; F297-E329 HydrophobicContact CG-CB 4.09Å; F297-E329 HydrophobicContact CG-CG 4.2Å; R299-E329 IonicContact CZ-OE2 3.33Å; R299-E329 IonicContact NE-OE2 3.45Å; R299-E329 IonicContact NH2-OE2 2.63Å; R299-E329 PolarHBondContact NH2-OE2 3.34Å; N325-E329 WeakPolarHBondContact O-CB 3Å; N325-E329 PolarHBondContact O-N 3.3Å; F327-E329 VanDerWaalsContact C-N 3.33Å; F327-E329 PolarHBondContact O-N 3.5Å; E329-L333 HydrophobicContact CG-CD1 4.47Å; E329-L333 WeakPolarHBondContact O-CB 3.49Å; E329-L333 VanDerWaalsContact O-CG 3.3Å; E329-L333 WeakPolarHBondContact O-CG 3.36Å; E329-L333 PolarHBondContact O-N 2.93Å; E329-L333 VanDerWaalsContact O-N 3.09Å
330	K	90.2	Very high	91.5	Very high	95 Å²	95	39.5 Å²	39.5	41%	0.413	19%	0.192	S	C	.	.	H	α-helix	trans	-72.2	-40.1	-178.1	-58.5	-47.8	177.4	-161.1	0	112.8	M326 F327 T328 F334	M326-K330 WeakPolarHBondContact O-CG 3.39Å; F327-K330 PolarHBondContact O-N 3.16Å; F327-K330 VanDerWaalsContact O-N 3.16Å; T328-K330 VanDerWaalsContact C-N 3.32Å; T328-K330 PolarHBondContact O-N 3.03Å; K330-F334 WeakPolarHBondContact O-CB 3.34Å; K330-F334 PolarHBondContact O-N 3.46Å
331	I	92.1	Very high	91.5	Very high	20 Å²	20	44 Å²	44	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-63.8	-47.2	177.3	-68.8	168.1	0	0	0	110.1	M86 V90 L156 F327 T328 L333 F334 L335	M86-I331 HydrophobicContact CB-CD1 4.39Å; M86-I331 HydrophobicContact CB-CG2 4.25Å; M86-I331 HydrophobicContact CG-CG2 4.43Å; M86-I331 HydrophobicContact SD-CG1 4.26Å; V90-I331 HydrophobicContact CG2-CD1 3.18Å; L156-I331 HydrophobicContact CD1-CG2 4.48Å; F327-I331 WeakPolarHBondContact O-CG1 3.42Å; F327-I331 PolarHBondContact O-N 3.28Å; T328-I331 PolarHBondContact O-N 2.85Å; I331-L333 PolarHBondContact O-N 3.04Å; I331-F334 PolarHBondContact O-N 3.4Å; I331-L335 HydrophobicContact CG2-CD1 3.8Å; I331-L335 HydrophobicContact CG2-CG 4.25Å; I331-L335 WeakPolarHBondContact O-CB 3.37Å; I331-L335 WeakPolarHBondContact O-CG 3.42Å; I331-L335 PolarHBondContact O-N 2.9Å
332	F	89.8	Confident	91.6	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-47.4	178.4	171.1	-99.9	0	0	0	111.8	L265 L269 L277 F297 T328 F334 L335 W336	L265-F332 HydrophobicContact CD1-CD2 3.92Å; L265-F332 HydrophobicContact CD1-CE2 4.35Å; L265-F332 HydrophobicContact CD2-CD2 3.8Å; L265-F332 HydrophobicContact CD2-CE2 3.82Å; L265-F332 HydrophobicContact CG-CD2 3.68Å; L265-F332 HydrophobicContact CG-CE2 3.64Å; L269-F332 HydrophobicContact CB-CE2 4.33Å; L269-F332 HydrophobicContact CD1-CD2 3.49Å; L269-F332 VanDerWaalsContact CD1-CD2 3.49Å; L269-F332 HydrophobicContact CD1-CE2 3.64Å; L269-F332 HydrophobicContact CD1-CG 4.44Å; L269-F332 HydrophobicContact CD2-CB 4.07Å; L269-F332 HydrophobicContact CD2-CD1 4.02Å; L269-F332 HydrophobicContact CD2-CD2 3.36Å; L269-F332 HydrophobicContact CD2-CE1 4.29Å; L269-F332 HydrophobicContact CD2-CE2 3.66Å; L269-F332 HydrophobicContact CD2-CG 3.54Å; L269-F332 HydrophobicContact CD2-CZ 4.13Å; L269-F332 HydrophobicContact CG-CD2 4.03Å; L269-F332 HydrophobicContact CG-CE2 4.1Å; L277-F332 HydrophobicContact CD2-CZ 4.23Å; F297-F332 AromaticContact CE2-CD1 4Å; F297-F332 HydrophobicContact CE2-CD1 4Å; F297-F332 HydrophobicContact CE2-CE1 4.48Å; F297-F332 HydrophobicContact CZ-CB 3.99Å; F297-F332 AromaticContact CZ-CD1 3.67Å; F297-F332 HydrophobicContact CZ-CD1 3.67Å; F297-F332 HydrophobicContact CZ-CE1 4.33Å; F297-F332 AromaticContact CZ-CG 3.92Å; F297-F332 HydrophobicContact CZ-CG 3.92Å; T328-F332 VanDerWaalsContact O-CB 3.3Å; T328-F332 WeakPolarHBondContact O-CB 3.46Å; T328-F332 PolarHBondContact O-N 3.44Å; F332-F334 VanDerWaalsContact C-N 3.31Å; F332-F334 PolarHBondContact O-N 3.48Å; F332-L335 PolarHBondContact O-N 2.81Å; F332-W336 VanDerWaalsContact O-CB 3.28Å; F332-W336 WeakPolarHBondContact O-CB 3.02Å; F332-W336 PolarHBondContact O-N 3.28Å
333	L	89.6	Confident	91.8	Very high	17 Å²	17	41.8 Å²	41.8	9%	0.089	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-43	177.5	-77.8	174.7	0	0	0	112.3	V281 I282 L285 E329 I331 L337	V281-L333 HydrophobicContact CB-CD2 4.37Å; V281-L333 HydrophobicContact CG1-CD1 4.48Å; V281-L333 HydrophobicContact CG1-CD2 3.78Å; V281-L333 HydrophobicContact CG1-CG 4.35Å; I282-L333 HydrophobicContact CG1-CD2 3.74Å; L285-L333 HydrophobicContact CD2-CD1 4.11Å; E329-L333 HydrophobicContact CG-CD1 4.47Å; E329-L333 WeakPolarHBondContact O-CB 3.49Å; E329-L333 VanDerWaalsContact O-CG 3.3Å; E329-L333 WeakPolarHBondContact O-CG 3.36Å; E329-L333 PolarHBondContact O-N 2.93Å; E329-L333 VanDerWaalsContact O-N 3.09Å; I331-L333 PolarHBondContact O-N 3.04Å; L333-L337 WeakPolarHBondContact O-CG 3.3Å; L333-L337 PolarHBondContact O-N 3Å
334	F	93.4	Very high	92.1	Very high	82 Å²	82	46.4 Å²	46.4	36%	0.36	22%	0.22	S	C	.	.	H	α-helix	trans	-62.7	-50.5	175.9	172.9	-90.3	0	0	0	111.6	V82 K330 I331 F332 W336 L337 W338	V82-F334 HydrophobicContact CG1-CE1 3.5Å; V82-F334 HydrophobicContact CG1-CZ 3.97Å; K330-F334 WeakPolarHBondContact O-CB 3.34Å; K330-F334 PolarHBondContact O-N 3.46Å; I331-F334 PolarHBondContact O-N 3.4Å; F332-F334 VanDerWaalsContact C-N 3.31Å; F332-F334 PolarHBondContact O-N 3.48Å; F334-W336 PolarHBondContact O-N 3.46Å; F334-L337 PolarHBondContact O-N 3.42Å; F334-W338 HydrophobicContact CE1-CB 4.3Å; F334-W338 HydrophobicContact CZ-CB 4.49Å; F334-W338 VanDerWaalsContact O-CB 3.24Å; F334-W338 WeakPolarHBondContact O-CB 3.25Å; F334-W338 PolarHBondContact O-N 3.32Å
335	L	93.6	Very high	92.4	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-39.6	-179.1	-70.7	177.8	0	0	0	112.1	I83 L156 L265 I331 F332 W338 F339	I83-L335 HydrophobicContact CG1-CD2 3.96Å; L156-L335 HydrophobicContact CD2-CD1 3.57Å; L265-L335 HydrophobicContact CD2-CB 4.09Å; I331-L335 HydrophobicContact CG2-CD1 3.8Å; I331-L335 HydrophobicContact CG2-CG 4.25Å; I331-L335 WeakPolarHBondContact O-CB 3.37Å; I331-L335 WeakPolarHBondContact O-CG 3.42Å; I331-L335 PolarHBondContact O-N 2.9Å; F332-L335 PolarHBondContact O-N 2.81Å; L335-W338 PolarHBondContact O-N 3.1Å; L335-F339 HydrophobicContact CB-CE2 4.29Å; L335-F339 HydrophobicContact CB-CZ 4.45Å; L335-F339 HydrophobicContact CD2-CE1 4.37Å; L335-F339 HydrophobicContact CD2-CZ 4.17Å; L335-F339 VanDerWaalsContact O-CB 3.31Å; L335-F339 WeakPolarHBondContact O-CB 3.36Å; L335-F339 WeakPolarHBondContact O-CD2 3.41Å; L335-F339 WeakPolarHBondContact O-CG 3.35Å; L335-F339 PolarHBondContact O-N 3Å
336	W	91.8	Very high	92.8	Very high	22 Å²	22	49.6 Å²	49.6	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-47.4	178.2	-172.1	94.3	0	0	0	111.7	F262 L265 A279 I282 F332 F334 L340	F262-W336 AromaticContact CE2-CD1 3.76Å; F262-W336 HydrophobicContact CE2-CD2 4.22Å; F262-W336 AromaticContact CE2-CE2 3.76Å; F262-W336 HydrophobicContact CE2-CG 4.23Å; F262-W336 HydrophobicContact CE2-CZ2 4.31Å; F262-W336 AromaticContact CE2-NE1 3.45Å; F262-W336 AromaticContact CZ-CE2 3.72Å; F262-W336 AromaticContact CZ-CZ2 3.97Å; F262-W336 HydrophobicContact CZ-CZ2 3.97Å; F262-W336 AromaticContact CZ-NE1 3.38Å; L265-W336 HydrophobicContact CD2-CB 4.28Å; A279-W336 HydrophobicContact CB-CH2 4.12Å; A279-W336 HydrophobicContact CB-CZ2 4.01Å; I282-W336 HydrophobicContact CD1-CD2 4.4Å; I282-W336 HydrophobicContact CD1-CE3 3.46Å; I282-W336 VanDerWaalsContact CD1-CE3 3.46Å; I282-W336 HydrophobicContact CD1-CH2 4.17Å; I282-W336 HydrophobicContact CD1-CZ3 3.33Å; F332-W336 VanDerWaalsContact O-CB 3.28Å; F332-W336 WeakPolarHBondContact O-CB 3.02Å; F332-W336 PolarHBondContact O-N 3.28Å; F334-W336 PolarHBondContact O-N 3.46Å; W336-L340 HydrophobicContact CH2-CD2 4.24Å; W336-L340 HydrophobicContact CZ3-CD2 4.08Å; W336-L340 WeakPolarHBondContact O-CB 3.16Å; W336-L340 PolarHBondContact O-N 3.47Å; W336-L340 VanDerWaalsContact O-N 3.1Å
337	L	92.6	Very high	93.2	Very high	83 Å²	83	49.6 Å²	49.6	44%	0.435	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-42.5	176	-72.6	171.5	0	0	0	111.8	I282 L333 F334 L340 I341	I282-L337 HydrophobicContact CD1-CD2 3.87Å; I282-L337 HydrophobicContact CD1-CG 4.22Å; L333-L337 WeakPolarHBondContact O-CG 3.3Å; L333-L337 PolarHBondContact O-N 3Å; F334-L337 PolarHBondContact O-N 3.42Å; L337-L340 PolarHBondContact O-N 3.37Å; L337-I341 WeakPolarHBondContact O-CG1 3.3Å; L337-I341 PolarHBondContact O-N 2.86Å; L337-I341 VanDerWaalsContact O-N 3.13Å
338	W	95.2	Very high	93.6	Very high	63 Å²	63	46.8 Å²	46.8	24%	0.239	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-47.3	178.6	179.9	-102.8	0	0	0	111.9	L74 T79 F334 L335 L340 I341 L342	L74-W338 HydrophobicContact CD1-CH2 3.71Å; L74-W338 HydrophobicContact CD1-CZ2 3.74Å; L74-W338 HydrophobicContact CG-CZ2 4.19Å; T79-W338 PolarHBondContact OG1-NE1 3.39Å; F334-W338 HydrophobicContact CE1-CB 4.3Å; F334-W338 HydrophobicContact CZ-CB 4.49Å; F334-W338 VanDerWaalsContact O-CB 3.24Å; F334-W338 WeakPolarHBondContact O-CB 3.25Å; F334-W338 PolarHBondContact O-N 3.32Å; L335-W338 PolarHBondContact O-N 3.1Å; W338-L340 VanDerWaalsContact C-N 3.31Å; W338-L340 PolarHBondContact O-N 3.45Å; W338-I341 PolarHBondContact O-N 3.5Å; W338-L342 VanDerWaalsContact O-CB 3.26Å; W338-L342 WeakPolarHBondContact O-CB 3.31Å; W338-L342 PolarHBondContact O-N 3Å
339	F	94.2	Very high	93.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-33.3	177.7	-67.8	-16.3	0	0	0	112.3	T79 I83 F163 Q261 F262 L265 L335 L342 A343	T79-F339 HydrophobicContact CG2-CE1 3.81Å; I83-F339 HydrophobicContact CD1-CE1 4.14Å; I83-F339 HydrophobicContact CD1-CZ 3.97Å; F163-F339 HydrophobicContact CE2-CD1 4.45Å; F163-F339 AromaticContact CE2-CE1 3.55Å; F163-F339 HydrophobicContact CE2-CE1 3.55Å; F163-F339 AromaticContact CE2-CZ 3.7Å; F163-F339 HydrophobicContact CE2-CZ 3.7Å; F163-F339 AromaticContact CZ-CD1 3.95Å; F163-F339 HydrophobicContact CZ-CD1 3.95Å; F163-F339 AromaticContact CZ-CE1 3.48Å; F163-F339 HydrophobicContact CZ-CE1 3.48Å; F163-F339 VanDerWaalsContact CZ-CE1 3.48Å; F163-F339 HydrophobicContact CZ-CZ 4.01Å; Q261-F339 HydrophobicContact CB-CD2 4.35Å; Q261-F339 HydrophobicContact CB-CE2 4.07Å; Q261-F339 HydrophobicContact CB-CZ 4.45Å; F262-F339 HydrophobicContact CD2-CB 4.19Å; L265-F339 HydrophobicContact CD2-CD2 4.13Å; L265-F339 HydrophobicContact CD2-CE2 4.21Å; L335-F339 HydrophobicContact CB-CE2 4.29Å; L335-F339 HydrophobicContact CB-CZ 4.45Å; L335-F339 HydrophobicContact CD2-CE1 4.37Å; L335-F339 HydrophobicContact CD2-CZ 4.17Å; L335-F339 VanDerWaalsContact O-CB 3.31Å; L335-F339 WeakPolarHBondContact O-CB 3.36Å; L335-F339 WeakPolarHBondContact O-CD2 3.41Å; L335-F339 WeakPolarHBondContact O-CG 3.35Å; L335-F339 PolarHBondContact O-N 3Å; F339-L342 PolarHBondContact O-N 2.83Å; F339-A343 WeakPolarHBondContact O-CB 3.44Å; F339-A343 PolarHBondContact O-N 3.16Å
340	L	92.9	Very high	94.2	Very high	87 Å²	87	47.6 Å²	47.6	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-47.8	173.4	-175	66.7	0	0	0	111.6	W336 L337 W338 A343 F344	W336-L340 HydrophobicContact CH2-CD2 4.24Å; W336-L340 HydrophobicContact CZ3-CD2 4.08Å; W336-L340 WeakPolarHBondContact O-CB 3.16Å; W336-L340 PolarHBondContact O-N 3.47Å; W336-L340 VanDerWaalsContact O-N 3.1Å; L337-L340 PolarHBondContact O-N 3.37Å; W338-L340 VanDerWaalsContact C-N 3.31Å; W338-L340 PolarHBondContact O-N 3.45Å; L340-A343 PolarHBondContact O-N 2.92Å; L340-F344 PolarHBondContact O-N 2.7Å
341	I	95.3	Very high	94.5	Very high	96 Å²	96	46.9 Å²	46.9	49%	0.492	24%	0.236	S	C	.	.	H	α-helix	trans	-64.2	-45.4	176.6	-66	165.1	0	0	0	110.4	L337 W338 A343 F344 L345	L337-I341 WeakPolarHBondContact O-CG1 3.3Å; L337-I341 PolarHBondContact O-N 2.86Å; L337-I341 VanDerWaalsContact O-N 3.13Å; W338-I341 PolarHBondContact O-N 3.5Å; I341-A343 VanDerWaalsContact C-N 3.33Å; I341-A343 PolarHBondContact O-N 3.19Å; I341-F344 PolarHBondContact O-N 2.97Å; I341-L345 HydrophobicContact CG2-CD1 3.9Å; I341-L345 HydrophobicContact CG2-CG 4.36Å; I341-L345 WeakPolarHBondContact O-CG 3.39Å; I341-L345 PolarHBondContact O-N 3.4Å
342	L	96.9	Very high	94.6	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-39.6	179.8	-170.9	63.9	0	0	0	111.7	L74 T79 F163 V258 W338 F339 F344 L345 T346	L74-L342 HydrophobicContact CB-CD1 4.13Å; L74-L342 HydrophobicContact CD2-CD1 3.6Å; L74-L342 HydrophobicContact CG-CD1 3.61Å; T79-L342 HydrophobicContact CG2-CD2 4.07Å; T79-L342 WeakPolarHBondContact OG1-CD2 3.42Å; F163-L342 HydrophobicContact CE1-CD2 3.68Å; F163-L342 HydrophobicContact CZ-CD2 4.15Å; V258-L342 HydrophobicContact CG1-CB 4.25Å; V258-L342 HydrophobicContact CG1-CD2 4.27Å; V258-L342 HydrophobicContact CG1-CG 4.22Å; V258-L342 HydrophobicContact CG2-CD2 3.96Å; V258-L342 HydrophobicContact CG2-CG 4.07Å; W338-L342 VanDerWaalsContact O-CB 3.26Å; W338-L342 WeakPolarHBondContact O-CB 3.31Å; W338-L342 PolarHBondContact O-N 3Å; F339-L342 PolarHBondContact O-N 2.83Å; L342-F344 PolarHBondContact O-N 3.47Å; L342-L345 PolarHBondContact O-N 2.98Å; L342-T346 HydrophobicContact CD1-CG2 4.31Å; L342-T346 HydrophobicContact CG-CG2 4.32Å; L342-T346 VanDerWaalsContact O-CB 3.31Å; L342-T346 WeakPolarHBondContact O-CB 3.46Å; L342-T346 WeakPolarHBondContact O-CG2 3.33Å; L342-T346 PolarHBondContact O-N 3.23Å; L342-T346 PolarHBondContact O-OG1 3.29Å
343	A	95.8	Very high	94.8	Very high	22 Å²	22	50.4 Å²	50.4	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-43.1	176.1	0	0	0	0	0	111.2	V258 F339 L340 I341 T346 F347	V258-A343 HydrophobicContact CG1-CB 3.86Å; F339-A343 WeakPolarHBondContact O-CB 3.44Å; F339-A343 PolarHBondContact O-N 3.16Å; L340-A343 PolarHBondContact O-N 2.92Å; I341-A343 VanDerWaalsContact C-N 3.33Å; I341-A343 PolarHBondContact O-N 3.19Å; A343-T346 WeakPolarHBondContact CA-OG1 3.33Å; A343-T346 PolarHBondContact O-OG1 2.96Å; A343-F347 WeakPolarHBondContact O-CB 3.48Å; A343-F347 PolarHBondContact O-N 2.86Å
344	F	96.3	Very high	94.8	Very high	146 Å²	146	52.4 Å²	52.4	64%	0.64	26%	0.258	S	S	*	.	H	α-helix	trans	-63.6	-49.1	175.8	177.2	-98.9	0	0	0	112.1	L340 I341 L342 T346 F347 A348	L340-F344 PolarHBondContact O-N 2.7Å; I341-F344 PolarHBondContact O-N 2.97Å; L342-F344 PolarHBondContact O-N 3.47Å; F344-T346 PolarHBondContact O-N 3.49Å; F344-F347 PolarHBondContact O-N 3.45Å; F344-A348 WeakPolarHBondContact O-CB 3.3Å; F344-A348 PolarHBondContact O-N 3.3Å
345	L	97.3	Very high	94.8	Very high	62 Å²	62	52.2 Å²	52.2	33%	0.325	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-41.3	-179.6	-67.9	175.2	0	0	0	112.1	L74 I341 L342 N349	L74-L345 HydrophobicContact CD2-CD1 3.57Å; I341-L345 HydrophobicContact CG2-CD1 3.9Å; I341-L345 HydrophobicContact CG2-CG 4.36Å; I341-L345 WeakPolarHBondContact O-CG 3.39Å; I341-L345 PolarHBondContact O-N 3.4Å; L342-L345 PolarHBondContact O-N 2.98Å; L345-N349 WeakPolarHBondContact O-CB 3.26Å; L345-N349 PolarHBondContact O-N 3.29Å
346	T	97.2	Very high	94.6	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.043	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-40.9	176.4	49.6	0	0	0	0	112.4	V71 N75 V258 L342 A343 F344 N349 L350	V71-T346 HydrophobicContact CG1-CG2 3.97Å; N75-T346 WeakPolarHBondContact ND2-CG2 3.38Å; N75-T346 WeakPolarHBondContact OD1-CG2 3.29Å; V258-T346 HydrophobicContact CG2-CG2 4.18Å; L342-T346 HydrophobicContact CD1-CG2 4.31Å; L342-T346 HydrophobicContact CG-CG2 4.32Å; L342-T346 VanDerWaalsContact O-CB 3.31Å; L342-T346 WeakPolarHBondContact O-CB 3.46Å; L342-T346 WeakPolarHBondContact O-CG2 3.33Å; L342-T346 PolarHBondContact O-N 3.23Å; L342-T346 PolarHBondContact O-OG1 3.29Å; A343-T346 WeakPolarHBondContact CA-OG1 3.33Å; A343-T346 PolarHBondContact O-OG1 2.96Å; F344-T346 PolarHBondContact O-N 3.49Å; T346-N349 PolarHBondContact O-N 2.94Å; T346-L350 VanDerWaalsContact O-CB 3.3Å; T346-L350 WeakPolarHBondContact O-CB 3.23Å; T346-L350 PolarHBondContact O-N 3.36Å
347	F	96.8	Very high	94.3	Very high	100 Å²	100	52.5 Å²	52.5	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-47.4	175.3	-179.3	-106.2	0	0	0	111.9	F255 A343 F344 N349 L350 L351	F255-F347 HydrophobicContact CD2-CB 4.02Å; F255-F347 HydrophobicContact CD2-CD2 4.33Å; F255-F347 HydrophobicContact CE1-CD2 4.39Å; F255-F347 HydrophobicContact CE2-CB 3.72Å; F255-F347 AromaticContact CE2-CD2 3.78Å; F255-F347 HydrophobicContact CE2-CD2 3.78Å; F255-F347 HydrophobicContact CE2-CG 4.16Å; F255-F347 AromaticContact CZ-CD2 3.8Å; F255-F347 HydrophobicContact CZ-CD2 3.8Å; A343-F347 WeakPolarHBondContact O-CB 3.48Å; A343-F347 PolarHBondContact O-N 2.86Å; F344-F347 PolarHBondContact O-N 3.45Å; F347-N349 VanDerWaalsContact C-N 3.29Å; F347-N349 PolarHBondContact O-N 2.83Å; F347-L350 PolarHBondContact O-N 2.93Å; F347-L351 WeakPolarHBondContact O-CB 3.4Å; F347-L351 PolarHBondContact O-N 3.43Å
348	A	96.8	Very high	93.9	Very high	46 Å²	46	54.3 Å²	54.3	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-41.6	176.9	0	0	0	0	0	111.6	F344 L351 Y352	F344-A348 WeakPolarHBondContact O-CB 3.3Å; F344-A348 PolarHBondContact O-N 3.3Å; A348-L351 PolarHBondContact O-N 3.29Å; A348-Y352 WeakPolarHBondContact O-CB 3.4Å; A348-Y352 PolarHBondContact O-N 3.48Å
349	N	95.6	Very high	93.7	Very high	21 Å²	21	54.3 Å²	54.3	11%	0.112	28%	0.278	C	S	.	.	H	α-helix	trans	-67.9	-44.6	177.3	-166.8	40.9	0	0	0	112.5	V71 K251 L345 T346 F347 L351 Y352 W353	V71-N349 HydrophobicContact CB-CB 4.05Å; V71-N349 HydrophobicContact CG1-CB 3.85Å; V71-N349 HydrophobicContact CG2-CB 4.05Å; K251-N349 PolarHBondContact NZ-ND2 3.45Å; L345-N349 WeakPolarHBondContact O-CB 3.26Å; L345-N349 PolarHBondContact O-N 3.29Å; T346-N349 PolarHBondContact O-N 2.94Å; F347-N349 VanDerWaalsContact C-N 3.29Å; F347-N349 PolarHBondContact O-N 2.83Å; N349-L351 VanDerWaalsContact C-N 3.31Å; N349-L351 PolarHBondContact O-N 3.21Å; N349-Y352 PolarHBondContact O-N 2.95Å; N349-W353 VanDerWaalsContact O-CD1 3.22Å; N349-W353 PolarHBondContact O-N 3.23Å; N349-W353 PolarHBondContact OD1-NE1 3.48Å
350	L	95.8	Very high	93.4	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.11	30%	0.298	C	S	.	.	H	α-helix	trans	-57.2	-47.3	174.1	172	62.9	0	0	0	110.4	K251 F255 T346 F347 Y352 W353 M354	K251-L350 HydrophobicContact CB-CD1 3.59Å; F255-L350 HydrophobicContact CB-CD2 3.9Å; F255-L350 HydrophobicContact CD1-CD2 4.14Å; F255-L350 HydrophobicContact CG-CD2 4.08Å; T346-L350 VanDerWaalsContact O-CB 3.3Å; T346-L350 WeakPolarHBondContact O-CB 3.23Å; T346-L350 PolarHBondContact O-N 3.36Å; F347-L350 PolarHBondContact O-N 2.93Å; L350-Y352 PolarHBondContact O-N 3.16Å; L350-W353 PolarHBondContact O-N 3.31Å; L350-M354 HydrophobicContact CD1-CG 3.72Å; L350-M354 HydrophobicContact CD1-SD 4.47Å; L350-M354 HydrophobicContact CG-CG 4.22Å; L350-M354 VanDerWaalsContact O-CB 3.32Å; L350-M354 WeakPolarHBondContact O-CB 3.43Å; L350-M354 WeakPolarHBondContact O-CG 3.49Å; L350-M354 PolarHBondContact O-N 3.41Å
351	L	95.5	Very high	93.4	Very high	80 Å²	80	56.4 Å²	56.4	42%	0.419	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-44.6	178.6	-176.6	62.3	0	0	0	111.4	F347 A348 N349 W353 M354 L355	F347-L351 WeakPolarHBondContact O-CB 3.4Å; F347-L351 PolarHBondContact O-N 3.43Å; A348-L351 PolarHBondContact O-N 3.29Å; N349-L351 VanDerWaalsContact C-N 3.31Å; N349-L351 PolarHBondContact O-N 3.21Å; L351-W353 PolarHBondContact O-N 3.4Å; L351-M354 PolarHBondContact O-N 2.94Å; L351-L355 HydrophobicContact CD1-CD1 3.95Å; L351-L355 HydrophobicContact CD1-CD2 4.37Å; L351-L355 HydrophobicContact CD1-CG 3.93Å; L351-L355 HydrophobicContact CG-CD1 3.81Å; L351-L355 HydrophobicContact CG-CG 4.22Å; L351-L355 WeakPolarHBondContact O-CB 3.39Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.19Å
352	Y	94.4	Very high	93.2	Very high	97 Å²	97	55.2 Å²	55.2	38%	0.38	30%	0.296	S	S	.	.	H	α-helix	trans	-55.6	-50.5	175.4	171.8	-94.4	0	0	0	112.1	A348 N349 L350 T356 R404	A348-Y352 WeakPolarHBondContact O-CB 3.4Å; A348-Y352 PolarHBondContact O-N 3.48Å; N349-Y352 PolarHBondContact O-N 2.95Å; L350-Y352 PolarHBondContact O-N 3.16Å; Y352-T356 HydrophobicContact CD2-CG2 4.39Å; Y352-T356 HydrophobicContact CE1-CG2 4.31Å; Y352-T356 HydrophobicContact CE2-CG2 4.06Å; Y352-T356 WeakPolarHBondContact O-CB 3.24Å; Y352-T356 VanDerWaalsContact O-CG2 3.26Å; Y352-T356 WeakPolarHBondContact O-CG2 3.2Å; Y352-T356 PolarHBondContact O-N 3.35Å; Y352-T356 PolarHBondContact O-OG1 3.15Å; Y352-R404 PolarHBondContact OH-NE 3.49Å
353	W	93.4	Very high	93.1	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-67.3	-41.4	179.3	-77	106	0	0	0	112.5	D69 Y247 N349 L350 L351 L355 T356 V357 F401 R404 M405	D69-W353 VanDerWaalsContact OD2-CE2 3.25Å; D69-W353 WeakPolarHBondContact OD2-CZ2 3.33Å; D69-W353 PolarHBondContact OD2-NE1 3.16Å; Y247-W353 HydrophobicContact CD1-CD2 4.23Å; Y247-W353 HydrophobicContact CD1-CE3 4.31Å; Y247-W353 AromaticContact CE1-CD2 3.69Å; Y247-W353 HydrophobicContact CE1-CD2 3.69Å; Y247-W353 AromaticContact CE1-CE2 3.63Å; Y247-W353 HydrophobicContact CE1-CE3 4.08Å; Y247-W353 HydrophobicContact CE1-CG 4.06Å; Y247-W353 HydrophobicContact CE1-CH2 4.27Å; Y247-W353 AromaticContact CE1-CZ2 3.92Å; Y247-W353 HydrophobicContact CE1-CZ2 3.92Å; Y247-W353 HydrophobicContact CE1-CZ3 4.36Å; Y247-W353 AromaticContact CE1-NE1 3.96Å; N349-W353 VanDerWaalsContact O-CD1 3.22Å; N349-W353 PolarHBondContact O-N 3.23Å; N349-W353 PolarHBondContact OD1-NE1 3.48Å; L350-W353 PolarHBondContact O-N 3.31Å; L351-W353 PolarHBondContact O-N 3.4Å; W353-L355 PolarHBondContact O-N 3.08Å; W353-T356 WeakPolarHBondContact CA-OG1 3.46Å; W353-T356 PolarHBondContact O-N 3.27Å; W353-T356 PolarHBondContact O-OG1 3.35Å; W353-V357 VanDerWaalsContact O-CB 3.31Å; W353-V357 WeakPolarHBondContact O-CB 3.34Å; W353-V357 WeakPolarHBondContact O-CG2 3.12Å; W353-V357 PolarHBondContact O-N 3.27Å; W353-F401 HydrophobicContact CE3-CD2 4.09Å; W353-F401 AromaticContact CE3-CE2 3.92Å; W353-F401 HydrophobicContact CE3-CE2 3.92Å; W353-F401 HydrophobicContact CH2-CD2 4.36Å; W353-F401 AromaticContact CH2-CE2 3.95Å; W353-F401 HydrophobicContact CH2-CE2 3.95Å; W353-F401 AromaticContact CZ3-CD2 3.55Å; W353-F401 HydrophobicContact CZ3-CD2 3.55Å; W353-F401 AromaticContact CZ3-CE2 3.44Å; W353-F401 HydrophobicContact CZ3-CE2 3.44Å; W353-F401 VanDerWaalsContact CZ3-CE2 3.44Å; W353-R404 HydrophobicContact CH2-CG 4.16Å; W353-R404 HydrophobicContact CZ3-CG 4.17Å; W353-M405 HydrophobicContact CH2-CE 4.24Å; W353-M405 HydrophobicContact CH2-CG 4.11Å; W353-M405 HydrophobicContact CH2-SD 3.94Å; W353-M405 HydrophobicContact CZ2-CE 4.34Å; W353-M405 HydrophobicContact CZ2-SD 4.2Å
354	M	91	Very high	92.9	Very high	60 Å²	60	57.3 Å²	57.3	30%	0.296	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-45.6	177	-72.4	-62.6	-75.8	0	0	111.8	C248 L350 L351 V357 L358	C248-M354 HydrophobicContact CB-SD 3.72Å; L350-M354 HydrophobicContact CD1-CG 3.72Å; L350-M354 HydrophobicContact CD1-SD 4.47Å; L350-M354 HydrophobicContact CG-CG 4.22Å; L350-M354 VanDerWaalsContact O-CB 3.32Å; L350-M354 WeakPolarHBondContact O-CB 3.43Å; L350-M354 WeakPolarHBondContact O-CG 3.49Å; L350-M354 PolarHBondContact O-N 3.41Å; L351-M354 PolarHBondContact O-N 2.94Å; M354-V357 PolarHBondContact O-N 3.21Å; M354-L358 HydrophobicContact CB-CD1 4.47Å; M354-L358 HydrophobicContact CE-CD1 3.81Å; M354-L358 HydrophobicContact CE-CG 4.48Å; M354-L358 WeakPolarHBondContact O-CB 3.47Å; M354-L358 WeakPolarHBondContact O-CG 3.49Å; M354-L358 PolarHBondContact O-N 3.1Å
355	L	92.7	Very high	92.7	Very high	77 Å²	77	52.9 Å²	52.9	40%	0.403	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-44.9	177.7	-69	173.5	0	0	0	111.5	L351 W353 V357 I359 L362	L351-L355 HydrophobicContact CD1-CD1 3.95Å; L351-L355 HydrophobicContact CD1-CD2 4.37Å; L351-L355 HydrophobicContact CD1-CG 3.93Å; L351-L355 HydrophobicContact CG-CD1 3.81Å; L351-L355 HydrophobicContact CG-CG 4.22Å; L351-L355 WeakPolarHBondContact O-CB 3.39Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.19Å; W353-L355 PolarHBondContact O-N 3.08Å; L355-V357 VanDerWaalsContact C-N 3.29Å; L355-V357 PolarHBondContact O-N 3.03Å; L355-I359 HydrophobicContact CB-CD1 4.27Å; L355-I359 HydrophobicContact CD2-CD1 3.86Å; L355-I359 VanDerWaalsContact O-CB 3.31Å; L355-I359 WeakPolarHBondContact O-CB 3.25Å; L355-I359 VanDerWaalsContact O-CG1 3.32Å; L355-I359 WeakPolarHBondContact O-CG1 3.32Å; L355-I359 PolarHBondContact O-N 3.31Å; L355-I359 VanDerWaalsContact O-N 3.13Å; L355-L362 HydrophobicContact CB-CD1 4.39Å
356	T	89.3	Confident	92.6	Very high	9 Å²	9	51.7 Å²	51.7	6%	0.055	29%	0.285	C	S	.	.	H	α-helix	trans	-67.8	-27.5	-178.9	51.5	0	0	0	0	113.8	Y352 W353 R363 R404	Y352-T356 HydrophobicContact CD2-CG2 4.39Å; Y352-T356 HydrophobicContact CE1-CG2 4.31Å; Y352-T356 HydrophobicContact CE2-CG2 4.06Å; Y352-T356 WeakPolarHBondContact O-CB 3.24Å; Y352-T356 VanDerWaalsContact O-CG2 3.26Å; Y352-T356 WeakPolarHBondContact O-CG2 3.2Å; Y352-T356 PolarHBondContact O-N 3.35Å; Y352-T356 PolarHBondContact O-OG1 3.15Å; W353-T356 WeakPolarHBondContact CA-OG1 3.46Å; W353-T356 PolarHBondContact O-N 3.27Å; W353-T356 PolarHBondContact O-OG1 3.35Å; T356-R363 VanDerWaalsContact O-CG 3.3Å; T356-R363 WeakPolarHBondContact O-CG 3.31Å; T356-R404 VanDerWaalsContact CB-NH1 3.29Å; T356-R404 VanDerWaalsContact CG2-CZ 3.46Å
357	V	84.8	Confident	92.4	Very high	22 Å²	22	51.3 Å²	51.3	13%	0.133	28%	0.283	C	S	.	.	H	α-helix	trans	-84.5	-47.3	176.8	167.6	0	0	0	0	111.9	T244 W353 M354 L355	T244-V357 HydrophobicContact CG2-CB 3.96Å; T244-V357 HydrophobicContact CG2-CG1 3.41Å; T244-V357 VanDerWaalsContact CG2-CG1 3.41Å; T244-V357 HydrophobicContact CG2-CG2 3.26Å; W353-V357 VanDerWaalsContact O-CB 3.31Å; W353-V357 WeakPolarHBondContact O-CB 3.34Å; W353-V357 WeakPolarHBondContact O-CG2 3.12Å; W353-V357 PolarHBondContact O-N 3.27Å; M354-V357 PolarHBondContact O-N 3.21Å; L355-V357 VanDerWaalsContact C-N 3.29Å; L355-V357 PolarHBondContact O-N 3.03Å
358	L	85	Confident	92.2	Very high	120 Å²	120	50.2 Å²	50.2	63%	0.628	28%	0.278	S	S	*	.	H	α-helix	trans	-75.5	-26.8	-172.6	-68.8	174.7	0	0	0	113.3	M354 P360	M354-L358 HydrophobicContact CB-CD1 4.47Å; M354-L358 HydrophobicContact CE-CD1 3.81Å; M354-L358 HydrophobicContact CE-CG 4.48Å; M354-L358 WeakPolarHBondContact O-CB 3.47Å; M354-L358 WeakPolarHBondContact O-CG 3.49Å; M354-L358 PolarHBondContact O-N 3.1Å; L358-P360 VanDerWaalsContact O-CD 3.29Å; L358-P360 WeakPolarHBondContact O-CD 3.33Å
359	I	90.9	Very high	91.9	Very high	64 Å²	64	56.4 Å²	56.4	33%	0.328	29%	0.292	S	S	.	.			trans	-97.4	109.2	-174.1	-57.2	173.3	0	0	0	110.2	L355 A361 L362 R363	L355-I359 HydrophobicContact CB-CD1 4.27Å; L355-I359 HydrophobicContact CD2-CD1 3.86Å; L355-I359 VanDerWaalsContact O-CB 3.31Å; L355-I359 WeakPolarHBondContact O-CB 3.25Å; L355-I359 VanDerWaalsContact O-CG1 3.32Å; L355-I359 WeakPolarHBondContact O-CG1 3.32Å; L355-I359 PolarHBondContact O-N 3.31Å; L355-I359 VanDerWaalsContact O-N 3.13Å; I359-A361 VanDerWaalsContact C-N 3.26Å; I359-A361 HydrophobicContact CG2-CB 4.01Å; I359-A361 PolarHBondContact O-N 3.31Å; I359-L362 HydrophobicContact CB-CB 4.32Å; I359-L362 HydrophobicContact CB-CD1 4.01Å; I359-L362 HydrophobicContact CB-CG 4.01Å; I359-L362 HydrophobicContact CD1-CD1 3.86Å; I359-L362 HydrophobicContact CD1-CG 4.49Å; I359-L362 HydrophobicContact CG1-CD1 4.45Å; I359-L362 HydrophobicContact CG2-CB 4.37Å; I359-L362 HydrophobicContact CG2-CD1 4.34Å; I359-L362 HydrophobicContact CG2-CG 3.88Å; I359-L362 PolarHBondContact O-N 2.94Å; I359-L362 VanDerWaalsContact O-N 3.16Å; I359-R363 PolarHBondContact O-N 2.92Å
360	P	88.7	Confident	91.8	Very high	65 Å²	65	55.6 Å²	55.6	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-59.1	-36.2	178.5	-25.5	37.2	0	0	0	113.5	L358 L362 R363 I364	L358-P360 VanDerWaalsContact O-CD 3.29Å; L358-P360 WeakPolarHBondContact O-CD 3.33Å; P360-L362 VanDerWaalsContact C-N 3.3Å; P360-L362 PolarHBondContact O-N 3.37Å; P360-R363 WeakPolarHBondContact O-CB 3.41Å; P360-R363 PolarHBondContact O-N 2.87Å; P360-I364 WeakPolarHBondContact O-CG1 3.06Å; P360-I364 PolarHBondContact O-N 2.83Å
361	A	91.2	Very high	91.5	Very high	66 Å²	66	54.6 Å²	54.6	55%	0.545	28%	0.282	S	S	.	.	H	α-helix	trans	-60.2	-38.3	178.6	0	0	0	0	0	112.5	I359 I364 A365	I359-A361 VanDerWaalsContact C-N 3.26Å; I359-A361 HydrophobicContact CG2-CB 4.01Å; I359-A361 PolarHBondContact O-N 3.31Å; A361-I364 PolarHBondContact O-N 3.28Å; A361-A365 WeakPolarHBondContact O-CB 3.29Å; A361-A365 PolarHBondContact O-N 3.4Å
362	L	92.8	Very high	91.2	Very high	70 Å²	70	54.6 Å²	54.6	37%	0.366	28%	0.283	S	S	.	.	H	α-helix	trans	-70.8	-33.8	178.2	-67.5	-178.1	0	0	0	112.1	L355 I359 P360 F366	L355-L362 HydrophobicContact CB-CD1 4.39Å; I359-L362 HydrophobicContact CB-CB 4.32Å; I359-L362 HydrophobicContact CB-CD1 4.01Å; I359-L362 HydrophobicContact CB-CG 4.01Å; I359-L362 HydrophobicContact CD1-CD1 3.86Å; I359-L362 HydrophobicContact CD1-CG 4.49Å; I359-L362 HydrophobicContact CG1-CD1 4.45Å; I359-L362 HydrophobicContact CG2-CB 4.37Å; I359-L362 HydrophobicContact CG2-CD1 4.34Å; I359-L362 HydrophobicContact CG2-CG 3.88Å; I359-L362 PolarHBondContact O-N 2.94Å; I359-L362 VanDerWaalsContact O-N 3.16Å; P360-L362 VanDerWaalsContact C-N 3.3Å; P360-L362 PolarHBondContact O-N 3.37Å; L362-F366 WeakPolarHBondContact O-CB 3.45Å; L362-F366 PolarHBondContact O-N 3.18Å
363	R	93.2	Very high	90.8	Very high	24 Å²	24	55.2 Å²	55.2	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-47.4	174	-62.9	-176.9	-59.5	152.9	13.5	110.8	T356 I359 P360 F366 I367 V391 D392 P397 V400	T356-R363 VanDerWaalsContact O-CG 3.3Å; T356-R363 WeakPolarHBondContact O-CG 3.31Å; I359-R363 PolarHBondContact O-N 2.92Å; P360-R363 WeakPolarHBondContact O-CB 3.41Å; P360-R363 PolarHBondContact O-N 2.87Å; R363-F366 PolarHBondContact O-N 2.87Å; R363-I367 WeakPolarHBondContact O-CG1 3.46Å; R363-I367 PolarHBondContact O-N 3.42Å; R363-V391 HydrophobicContact CB-CG1 4.15Å; R363-D392 IonicContact CZ-OD1 2.94Å; R363-D392 IonicContact NH2-OD1 3.97Å; R363-D392 PolarHBondContact NH2-OD1 3.31Å; R363-P397 VanDerWaalsContact NH1-CG 3.29Å; R363-V400 HydrophobicContact CB-CG1 4.01Å; R363-V400 HydrophobicContact CG-CG1 4.07Å
364	I	92.5	Very high	90.2	Very high	45 Å²	45	56 Å²	56	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-44	177.5	-63.5	168.7	0	0	0	110.7	P360 A361 F366 I367 K368 L387 V391	P360-I364 WeakPolarHBondContact O-CG1 3.06Å; P360-I364 PolarHBondContact O-N 2.83Å; A361-I364 PolarHBondContact O-N 3.28Å; I364-F366 VanDerWaalsContact C-N 3.34Å; I364-F366 PolarHBondContact O-N 2.79Å; I364-I367 PolarHBondContact O-N 3.47Å; I364-K368 VanDerWaalsContact O-CB 3.23Å; I364-K368 WeakPolarHBondContact O-CB 3.22Å; I364-K368 PolarHBondContact O-N 2.74Å; I364-L387 HydrophobicContact CG2-CD2 4.36Å; I364-V391 HydrophobicContact CG1-CB 4.13Å; I364-V391 HydrophobicContact CG1-CG1 3.91Å; I364-V391 HydrophobicContact CG1-CG2 4.33Å
365	A	92.4	Very high	89.4	Confident	53 Å²	53	61 Å²	61	44%	0.438	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-39.4	179.1	0	0	0	0	0	112.6	A361 R369	A361-A365 WeakPolarHBondContact O-CB 3.29Å; A361-A365 PolarHBondContact O-N 3.4Å; A365-R369 VanDerWaalsContact O-CB 3.27Å; A365-R369 WeakPolarHBondContact O-CB 3.46Å; A365-R369 PolarHBondContact O-N 3.37Å
366	F	93.7	Very high	88.6	Confident	36 Å²	36	59.3 Å²	59.3	16%	0.158	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-51.8	175.1	171.5	-109.5	0	0	0	111.6	L362 R363 I364 R369 A370 V400 L403 R404 I419	L362-F366 WeakPolarHBondContact O-CB 3.45Å; L362-F366 PolarHBondContact O-N 3.18Å; R363-F366 PolarHBondContact O-N 2.87Å; I364-F366 VanDerWaalsContact C-N 3.34Å; I364-F366 PolarHBondContact O-N 2.79Å; F366-R369 PolarHBondContact O-N 3.14Å; F366-A370 PolarHBondContact O-N 2.86Å; F366-A370 VanDerWaalsContact O-N 3.14Å; F366-V400 HydrophobicContact CD1-CG1 4.24Å; F366-L403 HydrophobicContact CE1-CB 4.2Å; F366-R404 HydrophobicContact CE1-CB 4.25Å; F366-R404 HydrophobicContact CZ-CB 4.28Å; F366-I419 HydrophobicContact CE1-CD1 4.21Å; F366-I419 HydrophobicContact CZ-CD1 4.38Å
367	I	93.6	Very high	88	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.4	-41.1	179.9	-61.1	-60.2	0	0	0	111.5	R363 I364 R369 A370 L371 L387 F390 V391 L395 V400 L403 I419	R363-I367 WeakPolarHBondContact O-CG1 3.46Å; R363-I367 PolarHBondContact O-N 3.42Å; I364-I367 PolarHBondContact O-N 3.47Å; I367-R369 PolarHBondContact O-N 2.82Å; I367-A370 PolarHBondContact O-N 3.3Å; I367-L371 HydrophobicContact CG2-CD1 3.98Å; I367-L371 HydrophobicContact CG2-CG 4.45Å; I367-L371 WeakPolarHBondContact O-CG 3.33Å; I367-L371 PolarHBondContact O-N 3.21Å; I367-L387 HydrophobicContact CG2-CD1 4.11Å; I367-F390 HydrophobicContact CG2-CD1 4.1Å; I367-F390 HydrophobicContact CG2-CE1 3.81Å; I367-V391 HydrophobicContact CB-CG2 3.93Å; I367-V391 HydrophobicContact CG1-CG2 4.01Å; I367-V391 HydrophobicContact CG2-CG2 3.97Å; I367-L395 HydrophobicContact CD1-CD1 3.99Å; I367-L395 HydrophobicContact CG1-CD1 4.21Å; I367-V400 HydrophobicContact CG1-CG2 4.37Å; I367-L403 HydrophobicContact CD1-CD1 3.87Å; I367-I419 HydrophobicContact CD1-CD1 3.91Å; I367-I419 HydrophobicContact CD1-CG1 4.31Å; I367-I419 HydrophobicContact CD1-CG2 4.46Å; I367-I419 HydrophobicContact CG2-CG2 4.04Å
368	K	92.3	Very high	87.4	Confident	76 Å²	76	62.2 Å²	62.2	33%	0.33	34%	0.341	S	S	.	.	H	α-helix	trans	-57.7	-49.5	175.8	-172.2	-178.7	173.5	-178.5	0	111	I364 A370 L371 D372 L387	I364-K368 VanDerWaalsContact O-CB 3.23Å; I364-K368 WeakPolarHBondContact O-CB 3.22Å; I364-K368 PolarHBondContact O-N 2.74Å; K368-A370 VanDerWaalsContact C-N 3.28Å; K368-A370 PolarHBondContact O-N 3.13Å; K368-L371 PolarHBondContact O-N 3.18Å; K368-L371 VanDerWaalsContact O-N 3.14Å; K368-D372 WeakPolarHBondContact O-CB 3.13Å; K368-D372 PolarHBondContact O-N 2.9Å; K368-L387 HydrophobicContact CB-CD2 3.96Å; K368-L387 HydrophobicContact CD-CD2 4.41Å; K368-L387 HydrophobicContact CG-CD2 4.01Å
369	R	91.9	Very high	86.9	Confident	177 Å²	177	61 Å²	61	67%	0.668	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-37.3	-179.8	-177.2	174.3	-175	176	1.8	112.4	A365 F366 I367 M373	A365-R369 VanDerWaalsContact O-CB 3.27Å; A365-R369 WeakPolarHBondContact O-CB 3.46Å; A365-R369 PolarHBondContact O-N 3.37Å; F366-R369 PolarHBondContact O-N 3.14Å; I367-R369 PolarHBondContact O-N 2.82Å; R369-M373 HydrophobicContact CG-CE 3.68Å; R369-M373 WeakPolarHBondContact O-CG 3.39Å
370	A	91.9	Very high	85.9	Confident	3 Å²	3	62 Å²	62	3%	0.025	35%	0.348	C	S	.	.	H	α-helix	trans	-67.5	-40.8	175.5	0	0	0	0	0	112.3	F366 I367 K368 M373 N416 I419	F366-A370 PolarHBondContact O-N 2.86Å; F366-A370 VanDerWaalsContact O-N 3.14Å; I367-A370 PolarHBondContact O-N 3.3Å; K368-A370 VanDerWaalsContact C-N 3.28Å; K368-A370 PolarHBondContact O-N 3.13Å; A370-M373 PolarHBondContact O-N 3.27Å; A370-N416 WeakPolarHBondContact CA-OD1 3.11Å; A370-N416 VanDerWaalsContact CB-OD1 3.22Å; A370-N416 WeakPolarHBondContact CB-OD1 3.37Å; A370-I419 HydrophobicContact CB-CB 4.32Å; A370-I419 HydrophobicContact CB-CD1 3.4Å; A370-I419 VanDerWaalsContact CB-CD1 3.4Å; A370-I419 HydrophobicContact CB-CG1 4.43Å; A370-I419 HydrophobicContact CB-CG2 4.18Å
371	L	91	Very high	85	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-73.1	-34.1	178	-70.4	173.7	0	0	0	113.2	I367 K368 M373 S374 P378 L387 I419 F420 W423	I367-L371 HydrophobicContact CG2-CD1 3.98Å; I367-L371 HydrophobicContact CG2-CG 4.45Å; I367-L371 WeakPolarHBondContact O-CG 3.33Å; I367-L371 PolarHBondContact O-N 3.21Å; K368-L371 PolarHBondContact O-N 3.18Å; K368-L371 VanDerWaalsContact O-N 3.14Å; L371-M373 PolarHBondContact O-N 3.19Å; L371-S374 WeakPolarHBondContact O-CB 3.25Å; L371-S374 PolarHBondContact O-N 3.05Å; L371-S374 PolarHBondContact O-OG 2.96Å; L371-P378 HydrophobicContact CB-CG 4.2Å; L371-P378 HydrophobicContact CD1-CG 4.46Å; L371-L387 HydrophobicContact CD1-CD1 3.73Å; L371-I419 HydrophobicContact CD2-CG2 3.78Å; L371-I419 HydrophobicContact CG-CG2 3.83Å; L371-F420 HydrophobicContact CD2-CB 4.5Å; L371-F420 HydrophobicContact CD2-CD2 4.38Å; L371-W423 HydrophobicContact CD1-CB 4.48Å; L371-W423 HydrophobicContact CD1-CD2 4.15Å; L371-W423 HydrophobicContact CD1-CE3 4.41Å; L371-W423 HydrophobicContact CD1-CG 4.18Å; L371-W423 HydrophobicContact CD2-CB 3.77Å; L371-W423 HydrophobicContact CD2-CG 3.91Å
372	D	88.2	Confident	84.1	Confident	80 Å²	80	73 Å²	73	43%	0.428	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-22.1	176.7	-70.7	-17	0	0	0	111.9	K368	K368-D372 WeakPolarHBondContact O-CB 3.13Å; K368-D372 PolarHBondContact O-N 2.9Å
373	M	86.2	Confident	83.5	Confident	111 Å²	111	71 Å²	71	55%	0.547	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-0.7	174.7	-62.9	178.7	-161.9	0	0	113.8	R369 A370 L371 N416	R369-M373 HydrophobicContact CG-CE 3.68Å; R369-M373 WeakPolarHBondContact O-CG 3.39Å; A370-M373 PolarHBondContact O-N 3.27Å; L371-M373 PolarHBondContact O-N 3.19Å; M373-N416 PolarHBondContact SD-ND2 2.69Å; M373-N416 VanDerWaalsContact SD-ND2 3.43Å
374	S	81.3	Confident	83	Confident	19 Å²	19	73.7 Å²	73.7	13%	0.133	39%	0.388	C	S	.	.	S	Bend	trans	-90.8	163.2	-179.8	72.5	0	0	0	0	112	L371 A376 F420	L371-S374 WeakPolarHBondContact O-CB 3.25Å; L371-S374 PolarHBondContact O-N 3.05Å; L371-S374 PolarHBondContact O-OG 2.96Å; S374-A376 PolarHBondContact O-N 3.34Å; S374-A376 VanDerWaalsContact O-N 3.07Å; S374-F420 WeakPolarHBondContact OG-CD2 3.46Å
375	D	72.8	Confident	82.6	Confident	164 Å²	164	80.2 Å²	80.2	88%	0.877	42%	0.415	S	S	*	.	S	Bend	trans	-61.9	-18.7	-175.7	-61.7	-41.1	0	0	0	114.3
376	A	76.4	Confident	82.3	Confident	42 Å²	42	82 Å²	82	35%	0.347	41%	0.414	S	S	.	.	S	Bend	trans	-134.7	80.6	177.8	0	0	0	0	0	111.1	S374 F420	S374-A376 PolarHBondContact O-N 3.34Å; S374-A376 VanDerWaalsContact O-N 3.07Å; A376-F420 HydrophobicContact CB-CE2 3.93Å; A376-F420 HydrophobicContact CB-CZ 4.09Å
377	P	76.8	Confident	82.2	Confident	76 Å²	76	80.8 Å²	80.8	49%	0.494	41%	0.409	S	S	.	.			trans	-64.7	145.6	-178.2	27.4	-34.7	0	0	0	111.1
378	P	73	Confident	82	Confident	15 Å²	15	83 Å²	83	10%	0.097	42%	0.424	C	S	.	.			trans	-66.2	137.6	177.2	26.3	-32.5	0	0	0	111.1	L371 S380 D383 W423	L371-P378 HydrophobicContact CB-CG 4.2Å; L371-P378 HydrophobicContact CD1-CG 4.46Å; P378-S380 PolarHBondContact O-N 3.46Å; P378-D383 WeakPolarHBondContact CA-OD2 3.48Å; P378-D383 HydrophobicContact CB-CB 3.82Å; P378-W423 HydrophobicContact CB-CZ2 4.23Å
379	D	73.3	Confident	81.9	Confident	96 Å²	96	82 Å²	82	51%	0.513	42%	0.423	S	S	.	.			trans	-65.3	111.2	177.2	-96.2	-20.4	0	0	0	109.3	K381 K382 D383	D379-K381 PolarHBondContact O-N 2.91Å; D379-K382 HydrophobicContact CB-CB 4.11Å; D379-K382 PolarHBondContact O-N 3.45Å; D379-K382 VanDerWaalsContact O-N 3.08Å; D379-D383 PolarHBondContact N-OD2 3.25Å; D379-D383 WeakPolarHBondContact O-CB 3.29Å; D379-D383 PolarHBondContact O-N 3.31Å
380	S	70.4	Confident	81.9	Confident	85 Å²	85	73.6 Å²	73.6	59%	0.594	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.3	-170.4	-173.5	0	0	0	0	115	P378	P378-S380 PolarHBondContact O-N 3.46Å
381	K	69.8	Low	81.9	Confident	205 Å²	205	73.5 Å²	73.5	89%	0.891	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-37.3	178.8	-68.7	-175.3	179.4	179.4	0	113.6	D379	D379-K381 PolarHBondContact O-N 2.91Å
382	K	73.4	Confident	81.7	Confident	157 Å²	157	75.9 Å²	75.9	68%	0.683	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-38	-174.8	-68.3	178.4	-178.6	169.5	0	111.9	D379	D379-K382 HydrophobicContact CB-CB 4.11Å; D379-K382 PolarHBondContact O-N 3.45Å; D379-K382 VanDerWaalsContact O-N 3.08Å
383	D	79.3	Confident	81.6	Confident	26 Å²	26	77.9 Å²	77.9	14%	0.139	41%	0.409	C	S	.	.	S	Bend	trans	-94.6	-2.2	-170.5	-66.8	-25.8	0	0	0	113.2	P378 D379 K385 H386 L387	P378-D383 WeakPolarHBondContact CA-OD2 3.48Å; P378-D383 HydrophobicContact CB-CB 3.82Å; D379-D383 PolarHBondContact N-OD2 3.25Å; D379-D383 WeakPolarHBondContact O-CB 3.29Å; D379-D383 PolarHBondContact O-N 3.31Å; D383-K385 VanDerWaalsContact C-N 3.33Å; D383-K385 PolarHBondContact O-N 3.33Å; D383-H386 CarbonylContact O-C 3.59Å; D383-H386 WeakPolarHBondContact O-CA 2.94Å; D383-H386 PolarHBondContact O-N 3.4Å; D383-L387 VanDerWaalsContact O-CB 3.3Å; D383-L387 WeakPolarHBondContact O-CB 3.5Å; D383-L387 PolarHBondContact O-N 3.15Å
384	C	82.3	Confident	81.8	Confident	82 Å²	82	72.9 Å²	72.9	55%	0.554	38%	0.384	S	S	*	.	H	α-helix	trans	-56.5	-44.6	-178.2	-174.3	0	0	0	0	112.6	L387 S388	C384-L387 PolarHBondContact O-N 2.95Å; C384-S388 PolarHBondContact O-N 2.92Å
385	K	84.7	Confident	82.3	Confident	182 Å²	182	72 Å²	72	79%	0.791	38%	0.378	S	S	*	.	H	α-helix	trans	-68.7	-37.5	176.3	-167.7	176.8	-175.1	177.7	0	112	D383 N389	D383-K385 VanDerWaalsContact C-N 3.33Å; D383-K385 PolarHBondContact O-N 3.33Å; K385-N389 VanDerWaalsContact O-CB 3.31Å; K385-N389 WeakPolarHBondContact O-CB 3.2Å; K385-N389 PolarHBondContact O-N 2.93Å
386	H	86.9	Confident	83	Confident	91 Å²	91	66.4 Å²	66.4	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-67.6	-37.7	176.2	-74.3	-74.6	0	0	0	112	D383 N389 F390 W423	D383-H386 CarbonylContact O-C 3.59Å; D383-H386 WeakPolarHBondContact O-CA 2.94Å; D383-H386 PolarHBondContact O-N 3.4Å; H386-N389 PolarHBondContact O-N 3.44Å; H386-F390 WeakPolarHBondContact O-CB 3.44Å; H386-F390 PolarHBondContact O-N 3.17Å; H386-W423 HydrophobicContact CB-CH2 4.01Å
387	L	90.3	Very high	83.6	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-66.8	-48	177.3	180	62.7	0	0	0	111.2	I364 I367 K368 L371 D383 C384 N389 F390 V391 W423	I364-L387 HydrophobicContact CG2-CD2 4.36Å; I367-L387 HydrophobicContact CG2-CD1 4.11Å; K368-L387 HydrophobicContact CB-CD2 3.96Å; K368-L387 HydrophobicContact CD-CD2 4.41Å; K368-L387 HydrophobicContact CG-CD2 4.01Å; L371-L387 HydrophobicContact CD1-CD1 3.73Å; D383-L387 VanDerWaalsContact O-CB 3.3Å; D383-L387 WeakPolarHBondContact O-CB 3.5Å; D383-L387 PolarHBondContact O-N 3.15Å; C384-L387 PolarHBondContact O-N 2.95Å; L387-N389 VanDerWaalsContact C-N 3.29Å; L387-N389 PolarHBondContact O-N 3.37Å; L387-F390 HydrophobicContact CD1-CD1 4.46Å; L387-F390 WeakPolarHBondContact O-CB 3.44Å; L387-F390 PolarHBondContact O-N 3.01Å; L387-V391 HydrophobicContact CD1-CG2 4.41Å; L387-V391 WeakPolarHBondContact O-CG2 3.4Å; L387-V391 PolarHBondContact O-N 3.01Å; L387-W423 HydrophobicContact CD1-CZ3 4.46Å
388	S	89.8	Confident	84.2	Confident	46 Å²	46	61.9 Å²	61.9	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-60.8	-40.5	173.5	166.8	0	0	0	0	111.3	C384 F390 V391 D392	C384-S388 PolarHBondContact O-N 2.92Å; S388-F390 PolarHBondContact O-N 2.96Å; S388-V391 PolarHBondContact O-N 3.01Å; S388-D392 WeakPolarHBondContact O-CB 3.45Å; S388-D392 PolarHBondContact O-N 2.83Å; S388-D392 PolarHBondContact OG-OD2 3.26Å
389	N	89.7	Confident	85.1	Confident	56 Å²	56	61.2 Å²	61.2	30%	0.299	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-39.2	176.7	-162	9.2	0	0	0	112.4	K385 H386 L387 H393 Y394 Y426	K385-N389 VanDerWaalsContact O-CB 3.31Å; K385-N389 WeakPolarHBondContact O-CB 3.2Å; K385-N389 PolarHBondContact O-N 2.93Å; H386-N389 PolarHBondContact O-N 3.44Å; L387-N389 VanDerWaalsContact C-N 3.29Å; L387-N389 PolarHBondContact O-N 3.37Å; N389-H393 WeakPolarHBondContact O-CA 3.4Å; N389-H393 WeakPolarHBondContact O-CB 3.5Å; N389-H393 PolarHBondContact O-N 3.41Å; N389-H393 WeakPolarHBondContact OD1-CB 3.28Å; N389-H393 VanDerWaalsContact OD1-CG 3.24Å; N389-H393 PolarHBondContact OD1-ND1 2.68Å; N389-H393 VanDerWaalsContact OD1-ND1 3.08Å; N389-Y394 PolarHBondContact O-N 3.33Å; N389-Y426 PolarHBondContact ND2-OH 2.89Å
390	F	91.6	Very high	86.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-61.6	-44.9	173.1	172.4	-109.9	0	0	0	112.1	I367 H386 L387 S388 Y394 L395 L422 W423 Y426	I367-F390 HydrophobicContact CG2-CD1 4.1Å; I367-F390 HydrophobicContact CG2-CE1 3.81Å; H386-F390 WeakPolarHBondContact O-CB 3.44Å; H386-F390 PolarHBondContact O-N 3.17Å; L387-F390 HydrophobicContact CD1-CD1 4.46Å; L387-F390 WeakPolarHBondContact O-CB 3.44Å; L387-F390 PolarHBondContact O-N 3.01Å; S388-F390 PolarHBondContact O-N 2.96Å; F390-Y394 AromaticContact CD2-CD1 3.36Å; F390-Y394 HydrophobicContact CD2-CD1 3.36Å; F390-Y394 HydrophobicContact CD2-CE1 4.09Å; F390-Y394 HydrophobicContact CD2-CG 4Å; F390-Y394 AromaticContact CE2-CD1 3.26Å; F390-Y394 HydrophobicContact CE2-CD1 3.26Å; F390-Y394 AromaticContact CE2-CE1 3.55Å; F390-Y394 HydrophobicContact CE2-CE1 3.55Å; F390-Y394 HydrophobicContact CE2-CG 4.3Å; F390-Y394 HydrophobicContact CG-CD1 4.48Å; F390-Y394 HydrophobicContact CZ-CD1 4.31Å; F390-Y394 CarbonylContact O-C 3.53Å; F390-Y394 WeakPolarHBondContact O-CA 3.5Å; F390-Y394 VanDerWaalsContact O-CB 3.27Å; F390-Y394 WeakPolarHBondContact O-CB 3.4Å; F390-Y394 PolarHBondContact O-N 2.91Å; F390-L395 HydrophobicContact CD1-CD1 3.93Å; F390-L395 HydrophobicContact CD1-CG 4.46Å; F390-L395 HydrophobicContact CE1-CD1 3.41Å; F390-L395 VanDerWaalsContact CE1-CD1 3.41Å; F390-L395 HydrophobicContact CE1-CG 4.06Å; F390-L395 HydrophobicContact CE2-CD1 4.44Å; F390-L395 HydrophobicContact CE2-CG 4.22Å; F390-L395 HydrophobicContact CZ-CD1 3.71Å; F390-L395 HydrophobicContact CZ-CD2 4.25Å; F390-L395 HydrophobicContact CZ-CG 3.93Å; F390-L395 PolarHBondContact O-N 3.06Å; F390-L422 HydrophobicContact CE2-CB 4.4Å; F390-L422 HydrophobicContact CZ-CB 4.09Å; F390-W423 HydrophobicContact CB-CE3 3.88Å; F390-W423 HydrophobicContact CB-CZ3 3.53Å; F390-W423 AromaticContact CD1-CE3 3.66Å; F390-W423 HydrophobicContact CD1-CE3 3.66Å; F390-W423 HydrophobicContact CD1-CZ3 4.06Å; F390-W423 AromaticContact CD2-CE3 3.86Å; F390-W423 HydrophobicContact CD2-CE3 3.86Å; F390-W423 HydrophobicContact CD2-CZ3 4.36Å; F390-W423 HydrophobicContact CE1-CB 4.44Å; F390-W423 HydrophobicContact CE1-CE3 4.06Å; F390-W423 HydrophobicContact CE2-CB 4.46Å; F390-W423 HydrophobicContact CE2-CE3 4.23Å; F390-W423 AromaticContact CG-CE3 3.53Å; F390-W423 HydrophobicContact CG-CE3 3.53Å; F390-W423 AromaticContact CG-CZ3 3.76Å; F390-W423 HydrophobicContact CG-CZ3 3.76Å; F390-W423 HydrophobicContact CZ-CB 4.08Å; F390-W423 HydrophobicContact CZ-CE3 4.34Å; F390-Y426 HydrophobicContact CB-CD1 4Å; F390-Y426 HydrophobicContact CB-CE1 3.86Å; F390-Y426 HydrophobicContact CB-CE2 4.43Å; F390-Y426 HydrophobicContact CB-CG 4.37Å; F390-Y426 AromaticContact CD2-CD1 3.78Å; F390-Y426 HydrophobicContact CD2-CD1 3.78Å; F390-Y426 AromaticContact CD2-CD2 3.86Å; F390-Y426 HydrophobicContact CD2-CD2 3.86Å; F390-Y426 HydrophobicContact CD2-CE1 4.45Å; F390-Y426 HydrophobicContact CD2-CE2 4.49Å; F390-Y426 AromaticContact CD2-CG 3.46Å; F390-Y426 HydrophobicContact CD2-CG 3.46Å; F390-Y426 VanDerWaalsContact CD2-CG 3.46Å; F390-Y426 HydrophobicContact CE2-CG 4.17Å; F390-Y426 HydrophobicContact CG-CD1 4.27Å; F390-Y426 HydrophobicContact CG-CG 4.35Å
391	V	92.1	Very high	87.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.257	C	S	.	.	I	π-helix	trans	-70.2	-50.5	-179.9	176.5	0	0	0	0	111.4	R363 I364 I367 L387 S388 R396 V400	R363-V391 HydrophobicContact CB-CG1 4.15Å; I364-V391 HydrophobicContact CG1-CB 4.13Å; I364-V391 HydrophobicContact CG1-CG1 3.91Å; I364-V391 HydrophobicContact CG1-CG2 4.33Å; I367-V391 HydrophobicContact CB-CG2 3.93Å; I367-V391 HydrophobicContact CG1-CG2 4.01Å; I367-V391 HydrophobicContact CG2-CG2 3.97Å; L387-V391 HydrophobicContact CD1-CG2 4.41Å; L387-V391 WeakPolarHBondContact O-CG2 3.4Å; L387-V391 PolarHBondContact O-N 3.01Å; S388-V391 PolarHBondContact O-N 3.01Å; V391-R396 PolarHBondContact O-N 3.27Å; V391-V400 HydrophobicContact CG1-CG2 4.01Å
392	D	87.9	Confident	88.2	Confident	51 Å²	51	43.6 Å²	43.6	27%	0.273	22%	0.216	S	C	.	.	I	π-helix	trans	-81.9	-35.1	-170.4	-68	-47.7	0	0	0	113.5	R363 S388	R363-D392 IonicContact CZ-OD1 2.94Å; R363-D392 IonicContact NH2-OD1 3.97Å; R363-D392 PolarHBondContact NH2-OD1 3.31Å; S388-D392 WeakPolarHBondContact O-CB 3.45Å; S388-D392 PolarHBondContact O-N 2.83Å; S388-D392 PolarHBondContact OG-OD2 3.26Å
393	H	86	Confident	89.2	Confident	122 Å²	122	36.1 Å²	36.1	57%	0.565	18%	0.183	S	C	*	.	I	π-helix	trans	-105.8	-38.7	-175.6	-63.4	76.6	0	0	0	113.4	R218 N389	R218-H393 PolarHBondContact NH2-O 2.85Å; N389-H393 WeakPolarHBondContact O-CA 3.4Å; N389-H393 WeakPolarHBondContact O-CB 3.5Å; N389-H393 PolarHBondContact O-N 3.41Å; N389-H393 WeakPolarHBondContact OD1-CB 3.28Å; N389-H393 VanDerWaalsContact OD1-CG 3.24Å; N389-H393 PolarHBondContact OD1-ND1 2.68Å; N389-H393 VanDerWaalsContact OD1-ND1 3.08Å
394	Y	90.2	Very high	89.9	Confident	5 Å²	5	36.2 Å²	36.2	2%	0.02	18%	0.182	C	C	.	.	I	π-helix	trans	-80.8	-62.4	-178.4	179.8	-100.4	0	0	0	111.9	D211 R218 N389 F390 Y426 M429	D211-Y394 WeakPolarHBondContact OD1-CE2 3.25Å; D211-Y394 PolarHBondContact OD1-OH 3.37Å; R218-Y394 PolarHBondContact NH2-O 3.34Å; N389-Y394 PolarHBondContact O-N 3.33Å; F390-Y394 AromaticContact CD2-CD1 3.36Å; F390-Y394 HydrophobicContact CD2-CD1 3.36Å; F390-Y394 HydrophobicContact CD2-CE1 4.09Å; F390-Y394 HydrophobicContact CD2-CG 4Å; F390-Y394 AromaticContact CE2-CD1 3.26Å; F390-Y394 HydrophobicContact CE2-CD1 3.26Å; F390-Y394 AromaticContact CE2-CE1 3.55Å; F390-Y394 HydrophobicContact CE2-CE1 3.55Å; F390-Y394 HydrophobicContact CE2-CG 4.3Å; F390-Y394 HydrophobicContact CG-CD1 4.48Å; F390-Y394 HydrophobicContact CZ-CD1 4.31Å; F390-Y394 CarbonylContact O-C 3.53Å; F390-Y394 WeakPolarHBondContact O-CA 3.5Å; F390-Y394 VanDerWaalsContact O-CB 3.27Å; F390-Y394 WeakPolarHBondContact O-CB 3.4Å; F390-Y394 PolarHBondContact O-N 2.91Å; Y394-Y426 HydrophobicContact CD1-CD2 4.15Å; Y394-Y426 AromaticContact CD2-CD2 3.79Å; Y394-Y426 HydrophobicContact CD2-CD2 3.79Å; Y394-Y426 HydrophobicContact CD2-CE2 4.49Å; Y394-Y426 AromaticContact CG-CD2 3.58Å; Y394-Y426 HydrophobicContact CG-CD2 3.58Å; Y394-Y426 HydrophobicContact CG-CE2 4.21Å; Y394-Y426 HydrophobicContact CG-CG 4.41Å; Y394-M429 HydrophobicContact CD2-CE 4.05Å; Y394-M429 HydrophobicContact CE2-CE 3.3Å
395	L	91.1	Very high	90.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-72.1	-41.4	178.9	-71.4	174.4	0	0	0	112.5	L214 I367 F390 G399 V400 L403 L422	L214-L395 HydrophobicContact CD1-CD2 4.2Å; I367-L395 HydrophobicContact CD1-CD1 3.99Å; I367-L395 HydrophobicContact CG1-CD1 4.21Å; F390-L395 HydrophobicContact CD1-CD1 3.93Å; F390-L395 HydrophobicContact CD1-CG 4.46Å; F390-L395 HydrophobicContact CE1-CD1 3.41Å; F390-L395 VanDerWaalsContact CE1-CD1 3.41Å; F390-L395 HydrophobicContact CE1-CG 4.06Å; F390-L395 HydrophobicContact CE2-CD1 4.44Å; F390-L395 HydrophobicContact CE2-CG 4.22Å; F390-L395 HydrophobicContact CZ-CD1 3.71Å; F390-L395 HydrophobicContact CZ-CD2 4.25Å; F390-L395 HydrophobicContact CZ-CG 3.93Å; F390-L395 PolarHBondContact O-N 3.06Å; L395-G399 VanDerWaalsContact O-CA 3.27Å; L395-G399 WeakPolarHBondContact O-CA 3.42Å; L395-G399 PolarHBondContact O-N 3.33Å; L395-V400 HydrophobicContact CB-CG2 4.12Å; L395-V400 HydrophobicContact CD1-CG2 4.26Å; L395-L403 HydrophobicContact CD1-CD1 3.95Å; L395-L403 HydrophobicContact CD2-CD1 3.88Å; L395-L422 HydrophobicContact CD2-CD1 4.14Å
396	R	88.5	Confident	90.9	Very high	47 Å²	47	23.7 Å²	23.7	18%	0.177	12%	0.118	C	C	.	.	H	α-helix	trans	59.9	174.5	-172.2	-58.8	-175.2	170	-159.9	-12.5	111.7	V391 D398 G399 V400	V391-R396 PolarHBondContact O-N 3.27Å; R396-D398 VanDerWaalsContact C-N 3.27Å; R396-D398 PolarHBondContact O-N 2.97Å; R396-G399 PolarHBondContact O-N 3.21Å; R396-V400 WeakPolarHBondContact O-CG2 3.11Å; R396-V400 PolarHBondContact O-N 3.26Å
397	P	88.9	Confident	91.2	Very high	22 Å²	22	19.9 Å²	19.9	14%	0.143	10%	0.101	C	C	.	.	H	α-helix	trans	-54.1	-41.7	177.2	-21.2	27.7	0	0	0	113.4	A241 T244 R363 G399 V400 F401	A241-P397 HydrophobicContact CB-CB 3.92Å; A241-P397 HydrophobicContact CB-CG 3.77Å; T244-P397 PolarHBondContact OG1-O 3.21Å; R363-P397 VanDerWaalsContact NH1-CG 3.29Å; P397-G399 PolarHBondContact O-N 2.92Å; P397-V400 PolarHBondContact O-N 2.89Å; P397-F401 VanDerWaalsContact O-CB 3.32Å; P397-F401 WeakPolarHBondContact O-CB 3.38Å; P397-F401 PolarHBondContact O-N 3.49Å
398	D	89.5	Confident	91.3	Very high	2 Å²	2	23 Å²	23	1%	0.011	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-40.3	-177.3	-74.6	-10.7	0	0	0	113.2	G240 A241 Y242 V243 T244 R396 F401 L402	G240-D398 WeakPolarHBondContact O-CB 3.38Å; G240-D398 VanDerWaalsContact O-CG 3.25Å; G240-D398 PolarHBondContact O-N 3.11Å; A241-D398 WeakPolarHBondContact CA-OD1 3.43Å; Y242-D398 PolarHBondContact N-OD1 2.85Å; Y242-D398 PolarHBondContact N-OD2 2.74Å; V243-D398 PolarHBondContact N-OD1 2.93Å; V243-D398 PolarHBondContact N-OD2 3.43Å; T244-D398 VanDerWaalsContact CB-OD1 3.32Å; T244-D398 WeakPolarHBondContact CB-OD1 3.47Å; T244-D398 PolarHBondContact N-OD1 3.42Å; T244-D398 WeakPolarHBondContact OG1-CA 3.12Å; T244-D398 PolarHBondContact OG1-N 3.19Å; T244-D398 PolarHBondContact OG1-OD1 3Å; R396-D398 VanDerWaalsContact C-N 3.27Å; R396-D398 PolarHBondContact O-N 2.97Å; D398-F401 PolarHBondContact O-N 3.29Å; D398-L402 WeakPolarHBondContact O-CB 3.42Å; D398-L402 PolarHBondContact O-N 3.31Å
399	G	91.6	Very high	91.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.5	-42.1	175.8	0	0	0	0	0	112.2	L395 R396 P397 F401 L402 L403	L395-G399 VanDerWaalsContact O-CA 3.27Å; L395-G399 WeakPolarHBondContact O-CA 3.42Å; L395-G399 PolarHBondContact O-N 3.33Å; R396-G399 PolarHBondContact O-N 3.21Å; P397-G399 PolarHBondContact O-N 2.92Å; G399-F401 VanDerWaalsContact C-N 3.35Å; G399-L402 PolarHBondContact O-N 2.81Å; G399-L403 WeakPolarHBondContact O-CB 3.2Å; G399-L403 VanDerWaalsContact O-CG 3.24Å; G399-L403 WeakPolarHBondContact O-CG 3.13Å; G399-L403 PolarHBondContact O-N 3.11Å
400	V	93.3	Very high	91.4	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.018	11%	0.111	C	C	.	.	H	α-helix	trans	-65.3	-40.4	175.8	179.3	0	0	0	0	111.2	R363 F366 I367 V391 L395 R396 P397 L403 R404	R363-V400 HydrophobicContact CB-CG1 4.01Å; R363-V400 HydrophobicContact CG-CG1 4.07Å; F366-V400 HydrophobicContact CD1-CG1 4.24Å; I367-V400 HydrophobicContact CG1-CG2 4.37Å; V391-V400 HydrophobicContact CG1-CG2 4.01Å; L395-V400 HydrophobicContact CB-CG2 4.12Å; L395-V400 HydrophobicContact CD1-CG2 4.26Å; R396-V400 WeakPolarHBondContact O-CG2 3.11Å; R396-V400 PolarHBondContact O-N 3.26Å; P397-V400 PolarHBondContact O-N 2.89Å; V400-L403 PolarHBondContact O-N 3.27Å; V400-R404 WeakPolarHBondContact O-CB 3.34Å; V400-R404 PolarHBondContact O-N 3.44Å
401	F	92.8	Very high	91.3	Very high	8 Å²	8	23.8 Å²	23.8	4%	0.035	13%	0.126	C	C	.	.	H	α-helix	trans	-59.3	-48.6	175.3	170.5	-100.2	0	0	0	111.5	W170 V243 T244 Y247 W353 P397 D398 G399 L403 R404 M405	W170-F401 HydrophobicContact CH2-CE1 4.38Å; W170-F401 HydrophobicContact CH2-CZ 4.42Å; V243-F401 HydrophobicContact CG1-CD1 3.91Å; V243-F401 HydrophobicContact CG1-CE1 3.71Å; T244-F401 HydrophobicContact CG2-CB 4.18Å; T244-F401 HydrophobicContact CG2-CD2 4.33Å; T244-F401 HydrophobicContact CG2-CG 4.36Å; T244-F401 WeakPolarHBondContact OG1-CB 3.46Å; Y247-F401 HydrophobicContact CD1-CD2 4.44Å; Y247-F401 AromaticContact CD1-CE2 3.27Å; Y247-F401 HydrophobicContact CD1-CE2 3.27Å; Y247-F401 AromaticContact CD1-CZ 3.55Å; Y247-F401 HydrophobicContact CD1-CZ 3.55Å; Y247-F401 HydrophobicContact CD2-CE2 4.47Å; Y247-F401 AromaticContact CD2-CZ 3.89Å; Y247-F401 HydrophobicContact CD2-CZ 3.89Å; Y247-F401 AromaticContact CE1-CE2 3.75Å; Y247-F401 HydrophobicContact CE1-CE2 3.75Å; Y247-F401 HydrophobicContact CE1-CZ 4.03Å; Y247-F401 HydrophobicContact CE2-CZ 4.37Å; Y247-F401 AromaticContact CG-CE2 3.66Å; Y247-F401 HydrophobicContact CG-CE2 3.66Å; Y247-F401 AromaticContact CG-CZ 3.43Å; Y247-F401 HydrophobicContact CG-CZ 3.43Å; Y247-F401 VanDerWaalsContact CG-CZ 3.43Å; W353-F401 HydrophobicContact CE3-CD2 4.09Å; W353-F401 AromaticContact CE3-CE2 3.92Å; W353-F401 HydrophobicContact CE3-CE2 3.92Å; W353-F401 HydrophobicContact CH2-CD2 4.36Å; W353-F401 AromaticContact CH2-CE2 3.95Å; W353-F401 HydrophobicContact CH2-CE2 3.95Å; W353-F401 AromaticContact CZ3-CD2 3.55Å; W353-F401 HydrophobicContact CZ3-CD2 3.55Å; W353-F401 AromaticContact CZ3-CE2 3.44Å; W353-F401 HydrophobicContact CZ3-CE2 3.44Å; W353-F401 VanDerWaalsContact CZ3-CE2 3.44Å; P397-F401 VanDerWaalsContact O-CB 3.32Å; P397-F401 WeakPolarHBondContact O-CB 3.38Å; P397-F401 PolarHBondContact O-N 3.49Å; D398-F401 PolarHBondContact O-N 3.29Å; G399-F401 VanDerWaalsContact C-N 3.35Å; F401-L403 PolarHBondContact O-N 3.1Å; F401-R404 PolarHBondContact O-N 2.98Å; F401-M405 HydrophobicContact CE1-CE 4.42Å; F401-M405 HydrophobicContact CE1-CG 4.07Å; F401-M405 HydrophobicContact CE2-CE 4.04Å; F401-M405 HydrophobicContact CE2-CG 4.11Å; F401-M405 HydrophobicContact CZ-CE 3.53Å; F401-M405 HydrophobicContact CZ-CG 3.8Å; F401-M405 PolarHBondContact O-N 3.29Å
402	L	92.8	Very high	91.2	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.031	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-42.9	178.6	-169.5	65	0	0	0	112	I179 V181 V184 I210 D398 G399 R404 M405 V406	I179-L402 HydrophobicContact CG2-CD2 4.3Å; V181-L402 HydrophobicContact CB-CD1 4.38Å; V181-L402 HydrophobicContact CG1-CD1 3.9Å; V181-L402 HydrophobicContact CG2-CD1 4.26Å; V184-L402 HydrophobicContact CB-CD1 4.4Å; V184-L402 HydrophobicContact CG1-CD1 3.87Å; V184-L402 HydrophobicContact CG1-CD2 3.94Å; V184-L402 HydrophobicContact CG1-CG 3.95Å; V184-L402 HydrophobicContact CG2-CD2 4.41Å; I210-L402 HydrophobicContact CD1-CD2 3.82Å; I210-L402 HydrophobicContact CG1-CD2 3.71Å; I210-L402 HydrophobicContact CG2-CD2 4.47Å; D398-L402 WeakPolarHBondContact O-CB 3.42Å; D398-L402 PolarHBondContact O-N 3.31Å; G399-L402 PolarHBondContact O-N 2.81Å; L402-R404 VanDerWaalsContact C-N 3.35Å; L402-R404 PolarHBondContact O-N 3.46Å; L402-M405 WeakPolarHBondContact O-CB 3.36Å; L402-M405 PolarHBondContact O-N 2.98Å; L402-V406 WeakPolarHBondContact O-CG2 3.4Å; L402-V406 PolarHBondContact O-N 2.91Å
403	L	94.5	Very high	91.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-39.3	176.3	-70.9	168.4	0	0	0	112.2	F366 I367 L395 G399 V400 F401 V406 S407 C415 L418 I419 L422	F366-L403 HydrophobicContact CE1-CB 4.2Å; I367-L403 HydrophobicContact CD1-CD1 3.87Å; L395-L403 HydrophobicContact CD1-CD1 3.95Å; L395-L403 HydrophobicContact CD2-CD1 3.88Å; G399-L403 WeakPolarHBondContact O-CB 3.2Å; G399-L403 VanDerWaalsContact O-CG 3.24Å; G399-L403 WeakPolarHBondContact O-CG 3.13Å; G399-L403 PolarHBondContact O-N 3.11Å; V400-L403 PolarHBondContact O-N 3.27Å; F401-L403 PolarHBondContact O-N 3.1Å; L403-V406 PolarHBondContact O-N 3Å; L403-S407 PolarHBondContact O-N 2.9Å; L403-C415 PolarHBondContact O-SG 2.75Å; L403-L418 HydrophobicContact CD2-CD2 3.59Å; L403-L418 HydrophobicContact CD2-CG 3.88Å; L403-I419 HydrophobicContact CD1-CD1 4.49Å; L403-I419 HydrophobicContact CD1-CG1 3.89Å; L403-I419 HydrophobicContact CD2-CG1 3.87Å; L403-I419 HydrophobicContact CG-CG1 4.32Å; L403-L422 HydrophobicContact CD1-CD1 4.25Å; L403-L422 HydrophobicContact CD2-CD1 3.98Å
404	R	94	Very high	91.7	Very high	28 Å²	28	24.9 Å²	24.9	11%	0.106	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-39.2	174.9	-177.8	167.3	-110	135.7	-1	111.7	Y352 W353 T356 F366 V400 F401 L402 S407 N408	Y352-R404 PolarHBondContact OH-NE 3.49Å; W353-R404 HydrophobicContact CH2-CG 4.16Å; W353-R404 HydrophobicContact CZ3-CG 4.17Å; T356-R404 VanDerWaalsContact CB-NH1 3.29Å; T356-R404 VanDerWaalsContact CG2-CZ 3.46Å; F366-R404 HydrophobicContact CE1-CB 4.25Å; F366-R404 HydrophobicContact CZ-CB 4.28Å; V400-R404 WeakPolarHBondContact O-CB 3.34Å; V400-R404 PolarHBondContact O-N 3.44Å; F401-R404 PolarHBondContact O-N 2.98Å; L402-R404 VanDerWaalsContact C-N 3.35Å; L402-R404 PolarHBondContact O-N 3.46Å; R404-S407 WeakPolarHBondContact O-CB 3.35Å; R404-S407 PolarHBondContact O-N 3.22Å; R404-N408 PolarHBondContact O-N 3.46Å
405	M	92.8	Very high	91.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.3	-44.2	172.4	-83.7	-67.9	-155.8	0	0	112.5	L185 Y247 W353 F401 L402 S407 N408 H409	L185-M405 HydrophobicContact CD1-CB 4.32Å; L185-M405 HydrophobicContact CD2-CB 4.05Å; Y247-M405 HydrophobicContact CD1-CE 4.44Å; Y247-M405 HydrophobicContact CD2-CE 4.15Å; Y247-M405 HydrophobicContact CE1-CE 3.72Å; Y247-M405 HydrophobicContact CE2-CE 3.42Å; Y247-M405 VanDerWaalsContact CE2-CE 3.42Å; Y247-M405 WeakPolarHBondContact OH-CE 3.48Å; W353-M405 HydrophobicContact CH2-CE 4.24Å; W353-M405 HydrophobicContact CH2-CG 4.11Å; W353-M405 HydrophobicContact CH2-SD 3.94Å; W353-M405 HydrophobicContact CZ2-CE 4.34Å; W353-M405 HydrophobicContact CZ2-SD 4.2Å; F401-M405 HydrophobicContact CE1-CE 4.42Å; F401-M405 HydrophobicContact CE1-CG 4.07Å; F401-M405 HydrophobicContact CE2-CE 4.04Å; F401-M405 HydrophobicContact CE2-CG 4.11Å; F401-M405 HydrophobicContact CZ-CE 3.53Å; F401-M405 HydrophobicContact CZ-CG 3.8Å; F401-M405 PolarHBondContact O-N 3.29Å; L402-M405 WeakPolarHBondContact O-CB 3.36Å; L402-M405 PolarHBondContact O-N 2.98Å; M405-S407 VanDerWaalsContact C-N 3.33Å; M405-S407 PolarHBondContact O-N 3.06Å; M405-N408 PolarHBondContact O-N 3.33Å; M405-H409 PolarHBondContact O-N 2.82Å; M405-H409 PolarHBondContact O-ND1 3.46Å
406	V	94.1	Very high	92	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61	-43.4	174	171.3	0	0	0	0	110.8	V184 L185 A188 L402 L403 N408 H409 T410 L414 C415 L418	V184-V406 HydrophobicContact CG1-CG2 4.25Å; L185-V406 HydrophobicContact CD2-CB 4.43Å; L185-V406 HydrophobicContact CD2-CG2 3.79Å; A188-V406 HydrophobicContact CB-CG1 4.07Å; A188-V406 HydrophobicContact CB-CG2 4.3Å; L402-V406 WeakPolarHBondContact O-CG2 3.4Å; L402-V406 PolarHBondContact O-N 2.91Å; L403-V406 PolarHBondContact O-N 3Å; V406-N408 VanDerWaalsContact C-N 3.33Å; V406-N408 PolarHBondContact O-N 3.01Å; V406-H409 PolarHBondContact O-N 3.4Å; V406-T410 HydrophobicContact CG1-CG2 4.27Å; V406-T410 WeakPolarHBondContact O-CB 3.34Å; V406-T410 PolarHBondContact O-N 3.27Å; V406-T410 PolarHBondContact O-OG1 3.27Å; V406-L414 HydrophobicContact CG1-CD2 3.74Å; V406-C415 HydrophobicContact CG1-CB 4.43Å; V406-L418 HydrophobicContact CG1-CD2 4.35Å
407	S	93.9	Very high	92.3	Very high	11 Å²	11	26.4 Å²	26.4	8%	0.077	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-40.6	177.5	-166.3	0	0	0	0	112.7	L403 R404 M405 H409 G411 N412	L403-S407 PolarHBondContact O-N 2.9Å; R404-S407 WeakPolarHBondContact O-CB 3.35Å; R404-S407 PolarHBondContact O-N 3.22Å; M405-S407 VanDerWaalsContact C-N 3.33Å; M405-S407 PolarHBondContact O-N 3.06Å; S407-H409 VanDerWaalsContact C-N 3.33Å; S407-H409 PolarHBondContact O-N 3.33Å; S407-G411 WeakPolarHBondContact O-CA 3.42Å; S407-G411 PolarHBondContact O-N 2.98Å; S407-N412 PolarHBondContact OG-OD1 3.33Å; S407-N412 VanDerWaalsContact OG-OD1 3.08Å
408	N	91.4	Very high	92.5	Very high	75 Å²	75	25.3 Å²	25.3	40%	0.401	14%	0.142	S	C	.	.	H	α-helix	trans	-69	-29.8	-179.8	-75.7	-5.5	0	0	0	112.9	R404 M405 V406	R404-N408 PolarHBondContact O-N 3.46Å; M405-N408 PolarHBondContact O-N 3.33Å; V406-N408 VanDerWaalsContact C-N 3.33Å; V406-N408 PolarHBondContact O-N 3.01Å
409	H	91.3	Very high	92.8	Very high	48 Å²	48	25.2 Å²	25.2	22%	0.222	14%	0.142	C	C	.	.	H	α-helix	trans	-97.4	-37.5	-175.5	-73.6	87.7	0	0	0	114.3	V66 D68 M405 V406 S407	V66-H409 PolarHBondContact O-CD2 3.13Å; V66-H409 PolarHBondContact O-CE1 2.89Å; V66-H409 VanDerWaalsContact O-CE1 3.29Å; V66-H409 PolarHBondContact O-NE2 3.27Å; D68-H409 PolarHBondContact O-NE2 3.47Å; M405-H409 PolarHBondContact O-N 2.82Å; M405-H409 PolarHBondContact O-ND1 3.46Å; V406-H409 PolarHBondContact O-N 3.4Å; S407-H409 VanDerWaalsContact C-N 3.33Å; S407-H409 PolarHBondContact O-N 3.33Å
410	T	91	Very high	92.9	Very high	40 Å²	40	27.8 Å²	27.8	25%	0.245	15%	0.153	C	C	.	.	H	α-helix	trans	-102.1	-12.8	-174.4	66.4	0	0	0	0	113.4	A188 V406	A188-T410 HydrophobicContact CB-CG2 3.69Å; A188-T410 WeakPolarHBondContact O-CG2 3.5Å; V406-T410 HydrophobicContact CG1-CG2 4.27Å; V406-T410 WeakPolarHBondContact O-CB 3.34Å; V406-T410 PolarHBondContact O-N 3.27Å; V406-T410 PolarHBondContact O-OG1 3.27Å
411	G	89.3	Confident	92.8	Very high	31 Å²	31	28.5 Å²	28.5	32%	0.32	16%	0.158	S	C	.	.			trans	83.7	-178.5	-168.8	0	0	0	0	0	113	S407	S407-G411 WeakPolarHBondContact O-CA 3.42Å; S407-G411 PolarHBondContact O-N 2.98Å
412	N	90.3	Very high	92.9	Very high	97 Å²	97	28.1 Å²	28.1	52%	0.519	16%	0.157	S	C	.	.	H	α-helix	trans	-79	-25.8	-169	-61.6	-30	0	0	0	113.8	S407 C415 N416	S407-N412 PolarHBondContact OG-OD1 3.33Å; S407-N412 VanDerWaalsContact OG-OD1 3.08Å; N412-C415 PolarHBondContact O-N 2.77Å; N412-N416 VanDerWaalsContact O-CB 3.31Å; N412-N416 WeakPolarHBondContact O-CB 2.97Å; N412-N416 PolarHBondContact O-N 2.05Å; N412-N416 PolarHBondContact O-ND2 2.93Å; N412-N416 PolarHBondContact O-OD1 2.8Å
413	V	91.5	Very high	92.8	Very high	91 Å²	91	28 Å²	28	55%	0.552	16%	0.155	S	C	*	.	H	α-helix	trans	-63.4	-56.7	-172	-179.8	0	0	0	0	111.5	C415 N416 E417	V413-C415 VanDerWaalsContact C-N 3.32Å; V413-C415 PolarHBondContact O-N 2.91Å; V413-N416 PolarHBondContact O-N 3.47Å; V413-E417 PolarHBondContact O-N 2.9Å
414	L	93	Very high	92.6	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-40.1	178.5	-176	151.9	0	0	0	111.3	A188 N193 R199 V203 V406 N416 E417 L418	A188-L414 HydrophobicContact CB-CD2 4.23Å; N193-L414 HydrophobicContact CB-CD1 3.96Å; R199-L414 HydrophobicContact CG-CD1 4.13Å; R199-L414 HydrophobicContact CG-CG 4.36Å; V203-L414 HydrophobicContact CG2-CG 4.28Å; V406-L414 HydrophobicContact CG1-CD2 3.74Å; L414-N416 PolarHBondContact O-N 3.35Å; L414-E417 PolarHBondContact O-N 3.3Å; L414-L418 WeakPolarHBondContact O-CB 3.27Å; L414-L418 PolarHBondContact O-N 3.3Å
415	C	94.4	Very high	92.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-43.9	177.6	-171.2	0	0	0	0	112	L403 V406 N412 V413 L418 I419	L403-C415 PolarHBondContact O-SG 2.75Å; V406-C415 HydrophobicContact CG1-CB 4.43Å; N412-C415 PolarHBondContact O-N 2.77Å; V413-C415 VanDerWaalsContact C-N 3.32Å; V413-C415 PolarHBondContact O-N 2.91Å; C415-L418 WeakPolarHBondContact O-CB 3.38Å; C415-L418 PolarHBondContact O-N 3.33Å; C415-I419 WeakPolarHBondContact O-CB 2.95Å; C415-I419 VanDerWaalsContact O-CG1 3.25Å; C415-I419 WeakPolarHBondContact O-CG1 3.27Å; C415-I419 PolarHBondContact O-N 3.06Å
416	N	94	Very high	92.3	Very high	25 Å²	25	32 Å²	32	13%	0.134	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-44.5	179.1	-69.9	-5.6	0	0	0	111.8	A370 M373 N412 V413 L414 L418 I419 F420	A370-N416 WeakPolarHBondContact CA-OD1 3.11Å; A370-N416 VanDerWaalsContact CB-OD1 3.22Å; A370-N416 WeakPolarHBondContact CB-OD1 3.37Å; M373-N416 PolarHBondContact SD-ND2 2.69Å; M373-N416 VanDerWaalsContact SD-ND2 3.43Å; N412-N416 VanDerWaalsContact O-CB 3.31Å; N412-N416 WeakPolarHBondContact O-CB 2.97Å; N412-N416 PolarHBondContact O-N 2.05Å; N412-N416 PolarHBondContact O-ND2 2.93Å; N412-N416 PolarHBondContact O-OD1 2.8Å; V413-N416 PolarHBondContact O-N 3.47Å; L414-N416 PolarHBondContact O-N 3.35Å; N416-L418 VanDerWaalsContact C-N 3.32Å; N416-L418 PolarHBondContact O-N 3.24Å; N416-I419 PolarHBondContact O-N 3.27Å; N416-F420 WeakPolarHBondContact O-CB 3.37Å; N416-F420 PolarHBondContact O-N 2.89Å
417	E	93.2	Very high	91.9	Very high	58 Å²	58	36.4 Å²	36.4	27%	0.271	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-40.5	174.9	-71.1	179	-179.4	0	0	111.8	R199 V203 V413 L414 F420 S421	R199-E417 WeakPolarHBondContact CD-OE2 3.47Å; R199-E417 IonicContact CZ-OE1 3.49Å; R199-E417 VanDerWaalsContact CZ-OE1 3.27Å; R199-E417 IonicContact CZ-OE2 3.14Å; R199-E417 VanDerWaalsContact NE-CD 3.33Å; R199-E417 IonicContact NE-OE1 3.66Å; R199-E417 PolarHBondContact NE-OE1 2.75Å; R199-E417 VanDerWaalsContact NE-OE1 3.14Å; R199-E417 IonicContact NE-OE2 2.9Å; R199-E417 PolarHBondContact NE-OE2 3.18Å; R199-E417 IonicContact NH2-OE1 3.26Å; R199-E417 PolarHBondContact NH2-OE1 3.1Å; R199-E417 IonicContact NH2-OE2 2.69Å; V203-E417 HydrophobicContact CG1-CB 4.39Å; V203-E417 HydrophobicContact CG2-CB 4.1Å; V413-E417 PolarHBondContact O-N 2.9Å; L414-E417 PolarHBondContact O-N 3.3Å; E417-F420 PolarHBondContact O-N 2.8Å; E417-S421 WeakPolarHBondContact O-CB 3.46Å; E417-S421 PolarHBondContact O-N 2.93Å
418	L	94.5	Very high	91.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-45.5	176	180	63.2	0	0	0	112.5	V203 L206 I210 L403 V406 L414 C415 N416 F420 S421 L422	V203-L418 HydrophobicContact CG1-CD1 4.49Å; L206-L418 HydrophobicContact CB-CD1 3.91Å; L206-L418 HydrophobicContact CD2-CD1 4.08Å; L206-L418 HydrophobicContact CD2-CD2 3.5Å; L206-L418 HydrophobicContact CD2-CG 4.41Å; L206-L418 HydrophobicContact CG-CD1 3.9Å; L206-L418 HydrophobicContact CG-CD2 3.99Å; I210-L418 HydrophobicContact CD1-CD1 4.48Å; I210-L418 HydrophobicContact CD1-CD2 4.06Å; L403-L418 HydrophobicContact CD2-CD2 3.59Å; L403-L418 HydrophobicContact CD2-CG 3.88Å; V406-L418 HydrophobicContact CG1-CD2 4.35Å; L414-L418 WeakPolarHBondContact O-CB 3.27Å; L414-L418 PolarHBondContact O-N 3.3Å; C415-L418 WeakPolarHBondContact O-CB 3.38Å; C415-L418 PolarHBondContact O-N 3.33Å; N416-L418 VanDerWaalsContact C-N 3.32Å; N416-L418 PolarHBondContact O-N 3.24Å; L418-F420 VanDerWaalsContact C-N 3.31Å; L418-F420 PolarHBondContact O-N 3.06Å; L418-S421 PolarHBondContact O-N 2.88Å; L418-L422 HydrophobicContact CG-CD1 4.41Å; L418-L422 WeakPolarHBondContact O-CG 3.26Å; L418-L422 PolarHBondContact O-N 2.79Å
419	I	94.8	Very high	91.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-42.4	176.6	-70.1	169.7	0	0	0	110.2	F366 I367 A370 L371 L403 C415 N416 L422 W423	F366-I419 HydrophobicContact CE1-CD1 4.21Å; F366-I419 HydrophobicContact CZ-CD1 4.38Å; I367-I419 HydrophobicContact CD1-CD1 3.91Å; I367-I419 HydrophobicContact CD1-CG1 4.31Å; I367-I419 HydrophobicContact CD1-CG2 4.46Å; I367-I419 HydrophobicContact CG2-CG2 4.04Å; A370-I419 HydrophobicContact CB-CB 4.32Å; A370-I419 HydrophobicContact CB-CD1 3.4Å; A370-I419 VanDerWaalsContact CB-CD1 3.4Å; A370-I419 HydrophobicContact CB-CG1 4.43Å; A370-I419 HydrophobicContact CB-CG2 4.18Å; L371-I419 HydrophobicContact CD2-CG2 3.78Å; L371-I419 HydrophobicContact CG-CG2 3.83Å; L403-I419 HydrophobicContact CD1-CD1 4.49Å; L403-I419 HydrophobicContact CD1-CG1 3.89Å; L403-I419 HydrophobicContact CD2-CG1 3.87Å; L403-I419 HydrophobicContact CG-CG1 4.32Å; C415-I419 WeakPolarHBondContact O-CB 2.95Å; C415-I419 VanDerWaalsContact O-CG1 3.25Å; C415-I419 WeakPolarHBondContact O-CG1 3.27Å; C415-I419 PolarHBondContact O-N 3.06Å; N416-I419 PolarHBondContact O-N 3.27Å; I419-L422 PolarHBondContact O-N 3.19Å; I419-W423 WeakPolarHBondContact O-CB 3.36Å; I419-W423 PolarHBondContact O-N 3.1Å
420	F	93.4	Very high	90.6	Very high	54 Å²	54	43.9 Å²	43.9	24%	0.237	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-41.8	176.7	-178.1	-107.3	0	0	0	112.7	L371 S374 A376 N416 E417 L418 W423 T424	L371-F420 HydrophobicContact CD2-CB 4.5Å; L371-F420 HydrophobicContact CD2-CD2 4.38Å; S374-F420 WeakPolarHBondContact OG-CD2 3.46Å; A376-F420 HydrophobicContact CB-CE2 3.93Å; A376-F420 HydrophobicContact CB-CZ 4.09Å; N416-F420 WeakPolarHBondContact O-CB 3.37Å; N416-F420 PolarHBondContact O-N 2.89Å; E417-F420 PolarHBondContact O-N 2.8Å; L418-F420 VanDerWaalsContact C-N 3.31Å; L418-F420 PolarHBondContact O-N 3.06Å; F420-W423 PolarHBondContact O-N 3.07Å; F420-T424 WeakPolarHBondContact O-CB 3.35Å; F420-T424 PolarHBondContact O-N 3.39Å; F420-T424 PolarHBondContact O-OG1 3.05Å
421	S	92.7	Very high	89.7	Confident	18 Å²	18	49.2 Å²	49.2	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-45.7	174.4	-173.6	0	0	0	0	111.5	S207 E417 L418 T424 R425	S207-S421 WeakPolarHBondContact CB-OG 3.37Å; S207-S421 PolarHBondContact OG-OG 3.33Å; S207-S421 VanDerWaalsContact OG-OG 3.04Å; E417-S421 WeakPolarHBondContact O-CB 3.46Å; E417-S421 PolarHBondContact O-N 2.93Å; L418-S421 PolarHBondContact O-N 2.88Å; S421-T424 PolarHBondContact O-N 3.47Å; S421-R425 WeakPolarHBondContact O-CG 3.41Å; S421-R425 PolarHBondContact O-N 2.84Å; S421-R425 VanDerWaalsContact O-N 3.11Å
422	L	93.7	Very high	87.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-40.4	176.2	-71.9	169.2	0	0	0	112.4	S207 I210 D211 F390 L395 L403 L418 I419 R425 Y426	S207-L422 WeakPolarHBondContact O-CD2 3.39Å; I210-L422 HydrophobicContact CB-CD2 4.5Å; I210-L422 HydrophobicContact CG2-CD1 4.24Å; I210-L422 HydrophobicContact CG2-CD2 4.34Å; D211-L422 HydrophobicContact CB-CD2 4.47Å; F390-L422 HydrophobicContact CE2-CB 4.4Å; F390-L422 HydrophobicContact CZ-CB 4.09Å; L395-L422 HydrophobicContact CD2-CD1 4.14Å; L403-L422 HydrophobicContact CD1-CD1 4.25Å; L403-L422 HydrophobicContact CD2-CD1 3.98Å; L418-L422 HydrophobicContact CG-CD1 4.41Å; L418-L422 WeakPolarHBondContact O-CG 3.26Å; L418-L422 PolarHBondContact O-N 2.79Å; I419-L422 PolarHBondContact O-N 3.19Å; L422-R425 PolarHBondContact O-N 3.4Å; L422-Y426 WeakPolarHBondContact O-CB 3.3Å; L422-Y426 PolarHBondContact O-N 3.49Å
423	W	92	Very high	85.4	Confident	2 Å²	2	54 Å²	54	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.3	173.9	-114.2	0	0	0	112.2	L371 P378 H386 L387 F390 I419 F420 Y426 R427	L371-W423 HydrophobicContact CD1-CB 4.48Å; L371-W423 HydrophobicContact CD1-CD2 4.15Å; L371-W423 HydrophobicContact CD1-CE3 4.41Å; L371-W423 HydrophobicContact CD1-CG 4.18Å; L371-W423 HydrophobicContact CD2-CB 3.77Å; L371-W423 HydrophobicContact CD2-CG 3.91Å; P378-W423 HydrophobicContact CB-CZ2 4.23Å; H386-W423 HydrophobicContact CB-CH2 4.01Å; L387-W423 HydrophobicContact CD1-CZ3 4.46Å; F390-W423 HydrophobicContact CB-CE3 3.88Å; F390-W423 HydrophobicContact CB-CZ3 3.53Å; F390-W423 AromaticContact CD1-CE3 3.66Å; F390-W423 HydrophobicContact CD1-CE3 3.66Å; F390-W423 HydrophobicContact CD1-CZ3 4.06Å; F390-W423 AromaticContact CD2-CE3 3.86Å; F390-W423 HydrophobicContact CD2-CE3 3.86Å; F390-W423 HydrophobicContact CD2-CZ3 4.36Å; F390-W423 HydrophobicContact CE1-CB 4.44Å; F390-W423 HydrophobicContact CE1-CE3 4.06Å; F390-W423 HydrophobicContact CE2-CB 4.46Å; F390-W423 HydrophobicContact CE2-CE3 4.23Å; F390-W423 AromaticContact CG-CE3 3.53Å; F390-W423 HydrophobicContact CG-CE3 3.53Å; F390-W423 AromaticContact CG-CZ3 3.76Å; F390-W423 HydrophobicContact CG-CZ3 3.76Å; F390-W423 HydrophobicContact CZ-CB 4.08Å; F390-W423 HydrophobicContact CZ-CE3 4.34Å; I419-W423 WeakPolarHBondContact O-CB 3.36Å; I419-W423 PolarHBondContact O-N 3.1Å; F420-W423 PolarHBondContact O-N 3.07Å; W423-Y426 AromaticContact CE3-CD1 3.97Å; W423-Y426 HydrophobicContact CE3-CD1 3.97Å; W423-Y426 AromaticContact CZ3-CD1 3.85Å; W423-Y426 HydrophobicContact CZ3-CD1 3.85Å; W423-Y426 HydrophobicContact CZ3-CE1 4.03Å; W423-Y426 WeakPolarHBondContact O-CB 3.45Å; W423-Y426 PolarHBondContact O-N 3.15Å; W423-R427 HydrophobicContact CD2-CG 4.38Å; W423-R427 HydrophobicContact CZ2-CG 4.26Å; W423-R427 WeakPolarHBondContact O-CG 3.45Å; W423-R427 PolarHBondContact O-N 3.3Å
424	T	90.3	Very high	83.3	Confident	46 Å²	46	59 Å²	59	28%	0.282	28%	0.279	S	S	.	.	H	α-helix	trans	-62.6	-47.3	177.4	-59.6	0	0	0	0	111.1	F420 S421 Y426 R427 E428	F420-T424 WeakPolarHBondContact O-CB 3.35Å; F420-T424 PolarHBondContact O-N 3.39Å; F420-T424 PolarHBondContact O-OG1 3.05Å; S421-T424 PolarHBondContact O-N 3.47Å; T424-Y426 VanDerWaalsContact C-N 3.32Å; T424-Y426 PolarHBondContact O-N 2.02Å; T424-R427 PolarHBondContact O-N 2.86Å; T424-R427 VanDerWaalsContact O-N 3.15Å; T424-E428 WeakPolarHBondContact O-CG 3.45Å; T424-E428 PolarHBondContact O-N 3.46Å
425	R	89.6	Confident	80.7	Confident	61 Å²	61	61.4 Å²	61.4	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-41.8	173.9	-69.9	175.7	70.8	98.9	-4.4	112.3	D211 S421 L422 E428 M429	D211-R425 IonicContact OD2-CZ 3.27Å; D211-R425 IonicContact OD2-NE 3.77Å; D211-R425 PolarHBondContact OD2-NE 2.87Å; D211-R425 IonicContact OD2-NH2 3.88Å; D211-R425 PolarHBondContact OD2-NH2 3.37Å; S421-R425 WeakPolarHBondContact O-CG 3.41Å; S421-R425 PolarHBondContact O-N 2.84Å; S421-R425 VanDerWaalsContact O-N 3.11Å; L422-R425 PolarHBondContact O-N 3.4Å; R425-E428 PolarHBondContact O-N 3.39Å; R425-M429 PolarHBondContact O-N 2.95Å; R425-M429 VanDerWaalsContact O-N 3.09Å
426	Y	89.8	Confident	78.3	Confident	5 Å²	5	63.9 Å²	63.9	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-44.9	175.4	173.3	-100.9	0	0	0	112.3	N389 F390 Y394 L422 W423 T424 M429 H430	N389-Y426 PolarHBondContact ND2-OH 2.89Å; F390-Y426 HydrophobicContact CB-CD1 4Å; F390-Y426 HydrophobicContact CB-CE1 3.86Å; F390-Y426 HydrophobicContact CB-CE2 4.43Å; F390-Y426 HydrophobicContact CB-CG 4.37Å; F390-Y426 AromaticContact CD2-CD1 3.78Å; F390-Y426 HydrophobicContact CD2-CD1 3.78Å; F390-Y426 AromaticContact CD2-CD2 3.86Å; F390-Y426 HydrophobicContact CD2-CD2 3.86Å; F390-Y426 HydrophobicContact CD2-CE1 4.45Å; F390-Y426 HydrophobicContact CD2-CE2 4.49Å; F390-Y426 AromaticContact CD2-CG 3.46Å; F390-Y426 HydrophobicContact CD2-CG 3.46Å; F390-Y426 VanDerWaalsContact CD2-CG 3.46Å; F390-Y426 HydrophobicContact CE2-CG 4.17Å; F390-Y426 HydrophobicContact CG-CD1 4.27Å; F390-Y426 HydrophobicContact CG-CG 4.35Å; Y394-Y426 HydrophobicContact CD1-CD2 4.15Å; Y394-Y426 AromaticContact CD2-CD2 3.79Å; Y394-Y426 HydrophobicContact CD2-CD2 3.79Å; Y394-Y426 HydrophobicContact CD2-CE2 4.49Å; Y394-Y426 AromaticContact CG-CD2 3.58Å; Y394-Y426 HydrophobicContact CG-CD2 3.58Å; Y394-Y426 HydrophobicContact CG-CE2 4.21Å; Y394-Y426 HydrophobicContact CG-CG 4.41Å; L422-Y426 WeakPolarHBondContact O-CB 3.3Å; L422-Y426 PolarHBondContact O-N 3.49Å; W423-Y426 AromaticContact CE3-CD1 3.97Å; W423-Y426 HydrophobicContact CE3-CD1 3.97Å; W423-Y426 AromaticContact CZ3-CD1 3.85Å; W423-Y426 HydrophobicContact CZ3-CD1 3.85Å; W423-Y426 HydrophobicContact CZ3-CE1 4.03Å; W423-Y426 WeakPolarHBondContact O-CB 3.45Å; W423-Y426 PolarHBondContact O-N 3.15Å; T424-Y426 VanDerWaalsContact C-N 3.32Å; T424-Y426 PolarHBondContact O-N 2.02Å; Y426-M429 PolarHBondContact O-N 3.24Å; Y426-H430 AromaticContact CD2-CD2 3.63Å; Y426-H430 AromaticContact CD2-NE2 3.86Å; Y426-H430 AromaticContact CE1-CD2 3.8Å; Y426-H430 AromaticContact CE2-CD2 3.17Å; Y426-H430 WeakPolarHBondContact CE2-CD2 3.35Å; Y426-H430 AromaticContact CE2-NE2 3.06Å; Y426-H430 WeakPolarHBondContact CE2-NE2 3.39Å; Y426-H430 AromaticContact CZ-CD2 3.24Å; Y426-H430 AromaticContact CZ-NE2 3.32Å; Y426-H430 VanDerWaalsContact CZ-NE2 3.32Å; Y426-H430 PolarHBondContact O-CD2 2.93Å; Y426-H430 PolarHBondContact O-N 3.41Å; Y426-H430 VanDerWaalsContact O-N 3.16Å; Y426-H430 PolarHBondContact OH-NE2 3.13Å
427	R	86.2	Confident	76.1	Confident	94 Å²	94	68 Å²	68	36%	0.355	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-40	177.6	-70.4	-179.1	75	-170.4	10.1	112.1	W423 T424 H430 K431	W423-R427 HydrophobicContact CD2-CG 4.38Å; W423-R427 HydrophobicContact CZ2-CG 4.26Å; W423-R427 WeakPolarHBondContact O-CG 3.45Å; W423-R427 PolarHBondContact O-N 3.3Å; T424-R427 PolarHBondContact O-N 2.86Å; T424-R427 VanDerWaalsContact O-N 3.15Å; R427-H430 PolarHBondContact O-N 2.94Å; R427-K431 WeakPolarHBondContact O-CB 3.41Å; R427-K431 VanDerWaalsContact O-CG 3.31Å; R427-K431 WeakPolarHBondContact O-CG 3.38Å; R427-K431 PolarHBondContact O-N 3.47Å
428	E	86.5	Confident	73.9	Confident	114 Å²	114	70.9 Å²	70.9	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-45.7	176.3	-73.5	170.9	-177.6	0	0	111.6	T424 R425 H430 K431 M432	T424-E428 WeakPolarHBondContact O-CG 3.45Å; T424-E428 PolarHBondContact O-N 3.46Å; R425-E428 PolarHBondContact O-N 3.39Å; E428-H430 VanDerWaalsContact C-N 3.3Å; E428-H430 PolarHBondContact O-N 3.33Å; E428-K431 PolarHBondContact O-N 2.97Å; E428-M432 PolarHBondContact O-N 3.08Å
429	M	83.8	Confident	71.8	Confident	67 Å²	67	74.7 Å²	74.7	33%	0.33	39%	0.386	S	S	.	.	H	α-helix	trans	-61.2	-36.2	175.9	-76.1	-172.6	-77.8	0	0	113.5	R215 Y394 R425 Y426	R215-M429 VanDerWaalsContact CZ-SD 3.59Å; R215-M429 PolarHBondContact NH2-SD 2.97Å; Y394-M429 HydrophobicContact CD2-CE 4.05Å; Y394-M429 HydrophobicContact CE2-CE 3.3Å; R425-M429 PolarHBondContact O-N 2.95Å; R425-M429 VanDerWaalsContact O-N 3.09Å; Y426-M429 PolarHBondContact O-N 3.24Å
430	H	78	Confident	69.5	Low	110 Å²	110	80.7 Å²	80.7	51%	0.509	42%	0.418	S	S	.	.	H	α-helix	trans	-85.1	-17.9	-179.8	-82.8	-72.7	0	0	0	114.2	Y426 R427 E428	Y426-H430 AromaticContact CD2-CD2 3.63Å; Y426-H430 AromaticContact CD2-NE2 3.86Å; Y426-H430 AromaticContact CE1-CD2 3.8Å; Y426-H430 AromaticContact CE2-CD2 3.17Å; Y426-H430 WeakPolarHBondContact CE2-CD2 3.35Å; Y426-H430 AromaticContact CE2-NE2 3.06Å; Y426-H430 WeakPolarHBondContact CE2-NE2 3.39Å; Y426-H430 AromaticContact CZ-CD2 3.24Å; Y426-H430 AromaticContact CZ-NE2 3.32Å; Y426-H430 VanDerWaalsContact CZ-NE2 3.32Å; Y426-H430 PolarHBondContact O-CD2 2.93Å; Y426-H430 PolarHBondContact O-N 3.41Å; Y426-H430 VanDerWaalsContact O-N 3.16Å; Y426-H430 PolarHBondContact OH-NE2 3.13Å; R427-H430 PolarHBondContact O-N 2.94Å; E428-H430 VanDerWaalsContact C-N 3.3Å; E428-H430 PolarHBondContact O-N 3.33Å
431	K	72.3	Confident	67.4	Low	152 Å²	152	81.3 Å²	81.3	66%	0.661	43%	0.43	S	S	*	.	H	α-helix	trans	-77.8	-24	172.4	-78.5	177.7	179.8	-177.1	0	112.7	R427 E428 P433	R427-K431 WeakPolarHBondContact O-CB 3.41Å; R427-K431 VanDerWaalsContact O-CG 3.31Å; R427-K431 WeakPolarHBondContact O-CG 3.38Å; R427-K431 PolarHBondContact O-N 3.47Å; E428-K431 PolarHBondContact O-N 2.97Å; K431-P433 WeakPolarHBondContact O-CD 3.22Å
432	M	45.7	Very low	65.6	Low	136 Å²	136	83.9 Å²	83.9	67%	0.67	45%	0.445	S	S	*	.	S	Bend	trans	-72	112.2	173.9	-70.6	-167.1	178.9	0	0	109.8	E428 K434	E428-M432 PolarHBondContact O-N 3.08Å; M432-K434 PolarHBondContact O-N 3.18Å
433	P	45.1	Very low	63.5	Low	92 Å²	92	88.7 Å²	88.7	60%	0.597	47%	0.47	S	S	*	.			trans	-60.8	140.1	172.4	25.5	-31.2	0	0	0	108.4	K431 A435 A436	K431-P433 WeakPolarHBondContact O-CD 3.22Å; P433-A435 PolarHBondContact O-N 3.47Å; P433-A436 PolarHBondContact O-N 3Å
434	K	47.3	Very low	61.5	Low	195 Å²	195	94 Å²	94	85%	0.848	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-9.9	175.5	-72.3	176.1	175.3	174.7	0	114.7	M432	M432-K434 PolarHBondContact O-N 3.18Å
435	A	37.2	Very low	59.5	Low	61 Å²	61	98.9 Å²	98.9	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-31.4	173.4	0	0	0	0	0	114.3	P433 V437 L438 V439	P433-A435 PolarHBondContact O-N 3.47Å; A435-V437 PolarHBondContact O-N 3.06Å; A435-L438 PolarHBondContact O-N 3.49Å; A435-V439 WeakPolarHBondContact O-CG2 3.36Å; A435-V439 PolarHBondContact O-N 3.46Å
436	A	44.6	Very low	57.4	Low	51 Å²	51	101.9 Å²	101.9	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-71.3	-28.6	-174.9	0	0	0	0	0	113.9	P433	P433-A436 PolarHBondContact O-N 3Å
437	V	47.9	Very low	55	Low	112 Å²	112	110.2 Å²	110.2	68%	0.679	58%	0.583	S	S	*	*	H	α-helix	trans	-79	-24	-179.7	-179.4	0	0	0	0	112.4	A435 S441	A435-V437 PolarHBondContact O-N 3.06Å; V437-S441 PolarHBondContact O-OG 2.84Å
438	L	46.7	Very low	52.6	Low	118 Å²	118	111 Å²	111	62%	0.618	60%	0.601	S	S	*	*	H	α-helix	trans	-80.5	-28	173.8	-83.5	161.6	0	0	0	112.4	A435 S441 V442	A435-L438 PolarHBondContact O-N 3.49Å; L438-S441 PolarHBondContact O-N 3.32Å; L438-V442 WeakPolarHBondContact O-CB 3.12Å; L438-V442 WeakPolarHBondContact O-CG2 3.16Å; L438-V442 PolarHBondContact O-N 3.02Å; L438-V442 VanDerWaalsContact O-N 3.07Å
439	V	50.5	Low	50.5	Low	80 Å²	80	114.7 Å²	114.7	49%	0.485	62%	0.618	S	S	.	*	H	α-helix	trans	-71.8	-42.5	179.8	175.7	0	0	0	0	111.4	A435 S441 V442 D443	A435-V439 WeakPolarHBondContact O-CG2 3.36Å; A435-V439 PolarHBondContact O-N 3.46Å; V439-S441 VanDerWaalsContact C-N 3.26Å; V439-S441 PolarHBondContact O-N 2.92Å; V439-V442 PolarHBondContact O-N 2.99Å; V439-D443 WeakPolarHBondContact CG1-OD2 3.47Å; V439-D443 WeakPolarHBondContact O-CB 3.45Å; V439-D443 PolarHBondContact O-N 2.88Å
440	D	46.2	Very low	48.3	Very low	126 Å²	126	117.8 Å²	117.8	67%	0.674	64%	0.641	S	S	*	*	H	α-helix	trans	-66.8	-25.8	176.1	-100.3	-8.1	0	0	0	113.7	T444	D440-T444 PolarHBondContact O-OG1 3.3Å
441	S	49.9	Very low	46.2	Very low	68 Å²	68	121.2 Å²	121.2	48%	0.476	66%	0.659	S	S	.	*	H	α-helix	trans	-87.9	-20.6	179	-55.1	0	0	0	0	113.2	V437 L438 V439	V437-S441 PolarHBondContact O-OG 2.84Å; L438-S441 PolarHBondContact O-N 3.32Å; V439-S441 VanDerWaalsContact C-N 3.26Å; V439-S441 PolarHBondContact O-N 2.92Å
442	V	54.1	Low	44.7	Very low	72 Å²	72	118.3 Å²	118.3	44%	0.436	66%	0.663	S	S	.	*	H	α-helix	trans	-92.4	-33.6	177.2	172.5	0	0	0	0	110.7	L438 V439 T444 L445 N446	L438-V442 WeakPolarHBondContact O-CB 3.12Å; L438-V442 WeakPolarHBondContact O-CG2 3.16Å; L438-V442 PolarHBondContact O-N 3.02Å; L438-V442 VanDerWaalsContact O-N 3.07Å; V439-V442 PolarHBondContact O-N 2.99Å; V442-T444 VanDerWaalsContact C-N 3.31Å; V442-T444 PolarHBondContact O-N 2.99Å; V442-L445 PolarHBondContact O-N 2.52Å; V442-N446 WeakPolarHBondContact O-CB 3.25Å; V442-N446 PolarHBondContact O-N 3.21Å
443	D	48.9	Very low	44.1	Very low	101 Å²	101	119.5 Å²	119.5	54%	0.54	67%	0.673	S	S	.	*	H	α-helix	trans	-75	-18.8	176.6	-74.6	-25.5	0	0	0	113.6	V439	V439-D443 WeakPolarHBondContact CG1-OD2 3.47Å; V439-D443 WeakPolarHBondContact O-CB 3.45Å; V439-D443 PolarHBondContact O-N 2.88Å
444	T	50.1	Low	43.8	Very low	112 Å²	112	125 Å²	125	69%	0.687	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-15.4	170.6	36.3	0	0	0	0	114	D440 V442	D440-T444 PolarHBondContact O-OG1 3.3Å; V442-T444 VanDerWaalsContact C-N 3.31Å; V442-T444 PolarHBondContact O-N 2.99Å
445	L	48.1	Very low	43.3	Very low	150 Å²	150	127.4 Å²	127.4	79%	0.785	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-16.2	176.7	-119	88.6	0	0	0	114	V442	V442-L445 PolarHBondContact O-N 2.52Å
446	N	47	Very low	43.1	Very low	123 Å²	123	130 Å²	130	66%	0.658	71%	0.708	S	S	*	*	S	Bend	trans	-103.1	19.8	-175.2	-94.8	-7.9	0	0	0	115.2	V442 P448	V442-N446 WeakPolarHBondContact O-CB 3.25Å; V442-N446 PolarHBondContact O-N 3.21Å; N446-P448 VanDerWaalsContact O-CD 3.31Å; N446-P448 WeakPolarHBondContact O-CD 3.21Å
447	K	39.2	Very low	42.8	Very low	181 Å²	181	132.8 Å²	132.8	79%	0.787	73%	0.725	S	S	*	*			trans	-96.3	104.2	165.4	-95.6	-180	176.3	173.4	0	110.1	Q449	K447-Q449 PolarHBondContact O-N 2.63Å
448	P	36.3	Very low	42.3	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	74%	0.735	S	S	*	*			trans	-74.6	115	168.6	6.8	10.3	0	0	0	108	N446 T450	N446-P448 VanDerWaalsContact O-CD 3.31Å; N446-P448 WeakPolarHBondContact O-CD 3.21Å; P448-T450 VanDerWaalsContact C-N 3.28Å; P448-T450 PolarHBondContact O-N 2.79Å; P448-T450 VanDerWaalsContact O-N 3.1Å
449	Q	41.8	Very low	41.9	Very low	191 Å²	191	134.6 Å²	134.6	89%	0.893	74%	0.738	S	S	*	*			trans	-76.8	86.1	161.8	-74.8	-173.8	-21.5	0	0	108.2	K447 M451	K447-Q449 PolarHBondContact O-N 2.63Å; Q449-M451 PolarHBondContact O-N 3.45Å
450	T	37.9	Very low	41.6	Very low	132 Å²	132	136.2 Å²	136.2	81%	0.81	75%	0.749	S	S	*	*			trans	-73.2	112.7	161.9	30.6	0	0	0	0	108.9	P448	P448-T450 VanDerWaalsContact C-N 3.28Å; P448-T450 PolarHBondContact O-N 2.79Å; P448-T450 VanDerWaalsContact O-N 3.1Å
451	M	34	Very low	41.2	Very low	182 Å²	182	135.3 Å²	135.3	90%	0.897	75%	0.753	S	S	*	*			trans	-69.3	156.3	162.2	-72.6	-155.3	-88.3	0	0	111.1	Q449	Q449-M451 PolarHBondContact O-N 3.45Å
452	A	39.4	Very low	40.8	Very low	91 Å²	91	137.7 Å²	137.7	75%	0.752	77%	0.77	S	S	*	*			trans	105.2	107.7	150.8	0	0	0	0	0	118.6
453	N	34.4	Very low	40.2	Very low	162 Å²	162	140.6 Å²	140.6	87%	0.866	79%	0.788	S	S	*	*			trans	50.9	108.9	133.2	-80.8	-11.3	0	0	0	119.5
454	E	38.4	Very low	39.9	Very low	208 Å²	208	140.7 Å²	140.7	97%	0.972	79%	0.794	S	S	*	*			trans	-126.1	133.9	144.3	-82.3	-170.6	122.9	0	0	112.7
455	R	36.7	Very low	39.5	Very low	245 Å²	245	142.1 Å²	142.1	93%	0.925	80%	0.803	S	S	*	*			trans	-65	142.2	-169.5	-104.5	163.9	-179.3	165.1	1.1	113.8
456	S	32.9	Very low	39	Very low	114 Å²	114	138 Å²	138	80%	0.797	80%	0.797	S	S	*	*			trans	-54.8	138.5	154.7	52.7	0	0	0	0	113.6
457	S	38.8	Very low	38.6	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	81%	0.812	S	S	*	*			trans	-155.4	119.2	146.8	-169.6	0	0	0	0	112.3
458	F	37	Very low	38.6	Very low	203 Å²	203	136.6 Å²	136.6	89%	0.89	81%	0.807	S	S	*	*			trans	73.1	120.6	146.8	-117	-105.3	0	0	0	121.8
459	G	39.1	Very low	38.8	Very low	65 Å²	65	138.2 Å²	138.2	67%	0.67	81%	0.814	S	S	*	*			trans	-84	-140.7	177.4	0	0	0	0	0	114.3
460	P	43.6	Very low	38.8	Very low	113 Å²	113	137.3 Å²	137.3	73%	0.734	81%	0.81	S	S	*	*			cis	-141.2	173.9	1.8	40.1	-20.8	0	0	0	117
461	S	37.8	Very low	39.4	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	81%	0.806	S	S	*	*			trans	63.6	136.6	149.5	64.8	0	0	0	0	118.9
462	S	41.6	Very low	40.1	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	81%	0.805	S	S	*	*			cis	-166.5	153.5	28.8	37.7	0	0	0	0	111.1
463	T	40.6	Very low	40.2	Very low	134 Å²	134	133.5 Å²	133.5	82%	0.822	81%	0.807	S	S	*	*			trans	-85.2	-168.3	179.5	10	0	0	0	0	112.5
464	P	43.9	Very low	40.3	Very low	102 Å²	102	131.7 Å²	131.7	66%	0.662	81%	0.807	S	S	*	*			cis	-140.7	-157.2	-39.5	36.4	-15.3	0	0	0	112.8
465	T	40.1	Very low	40.4	Very low	143 Å²	143	133.8 Å²	133.8	88%	0.877	81%	0.807	S	S	*	*			trans	98.7	133.9	163.5	68.9	0	0	0	0	115.5
466	G	38.4	Very low	40.2	Very low	64 Å²	64	127.3 Å²	127.3	66%	0.66	80%	0.799	S	S	*	*			cis	160.2	151.4	2.3	0	0	0	0	0	108.7
467	E	39.7	Very low	40.6	Very low	208 Å²	208	128.1 Å²	128.1	97%	0.972	80%	0.799	S	S	*	*			trans	77.8	138.5	162.3	-51.4	179.7	156.2	0	0	118.3
468	G	38.7	Very low	40.6	Very low	66 Å²	66	129 Å²	129	68%	0.68	80%	0.8	S	S	*	*			cis	167.3	160.4	-0.7	0	0	0	0	0	110.6
469	V	40.9	Very low	40.5	Very low	144 Å²	144	125.6 Å²	125.6	87%	0.873	80%	0.798	S	S	*	*			trans	80.3	138.3	153.8	-168.6	0	0	0	0	118.2
470	E	41	Very low	40.4	Very low	172 Å²	172	131.2 Å²	131.2	80%	0.804	81%	0.812	S	S	*	*			cis	-178	154.4	-19.9	-174.2	177.2	-166.8	0	0	107.9
471	P	50.2	Low	39.9	Very low	111 Å²	111	130.4 Å²	130.4	72%	0.721	81%	0.809	S	S	*	*			trans	-118.8	176.5	176	40.9	-28.7	0	0	0	114.7
472	P	48.3	Very low	39.8	Very low	135 Å²	135	132.6 Å²	132.6	88%	0.877	81%	0.812	S	S	*	*			trans	-146.9	167.1	135.6	34.9	-17	0	0	0	112.9
473	G	42.9	Very low	39.3	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	81%	0.81	S	S	*	*			cis	-173.6	156	6	0	0	0	0	0	110
474	S	36.4	Very low	38.9	Very low	124 Å²	124	128.6 Å²	128.6	87%	0.867	81%	0.807	S	S	*	*			trans	-97.2	150.3	-174.8	47.8	0	0	0	0	112.8
475	R	39.5	Very low	38.3	Very low	253 Å²	253	133.9 Å²	133.9	96%	0.955	82%	0.819	S	S	*	*			trans	-127.3	119.5	165.5	-149	178.2	-155	176.5	6.2	109.2
476	S	33.5	Very low	37.9	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	82%	0.816	S	S	*	*			trans	-106.1	137.8	176.9	49.2	0	0	0	0	110.1
477	T	40.9	Very low	37.6	Very low	131 Å²	131	139.8 Å²	139.8	80%	0.804	83%	0.826	S	S	*	*			trans	-148	102.9	156.7	41	0	0	0	0	110.1
478	T	38.5	Very low	37.4	Very low	130 Å²	130	134.4 Å²	134.4	80%	0.798	81%	0.812	S	S	*	*			trans	51.3	124	137.4	50.9	0	0	0	0	121.9
479	P	34.9	Very low	37.1	Very low	131 Å²	131	137.1 Å²	137.1	85%	0.851	82%	0.815	S	S	*	*			trans	-96.5	136	163.3	34.7	-25.5	0	0	0	112.2
480	L	37.7	Very low	37	Very low	183 Å²	183	136.2 Å²	136.2	96%	0.958	81%	0.812	S	S	*	*			trans	-89.8	114.3	169.9	-128.1	97.8	0	0	0	109.9
481	S	32.3	Very low	36.8	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	82%	0.815	S	S	*	*			trans	-76	132.3	164.9	160.4	0	0	0	0	110
482	N	35.5	Very low	36	Very low	154 Å²	154	140 Å²	140	82%	0.824	82%	0.822	S	S	*	*			trans	-169.8	115.3	130.5	-99.3	-15.7	0	0	0	115
483	A	32	Very low	35.2	Very low	92 Å²	92	143 Å²	143	76%	0.76	82%	0.822	S	S	*	*			trans	65.1	76	130.8	0	0	0	0	0	120.4
484	G	30.6	Very low	34.9	Very low	74 Å²	74	144.3 Å²	144.3	76%	0.763	82%	0.819	S	S	*	*			trans	-93.5	107	147.8	0	0	0	0	0	110.2	V486	G484-V486 PolarHBondContact O-N 3.21Å
485	K	32.2	Very low	34.9	Very low	213 Å²	213	144.4 Å²	144.4	93%	0.926	81%	0.814	S	S	*	*			trans	-60.6	114.3	175.5	-88.4	172.6	174	172.1	0	110.4	F487	K485-F487 PolarHBondContact O-N 2.95Å
486	V	32.5	Very low	35.2	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	80%	0.8	S	S	*	*			trans	-67.9	119	165.6	173.9	0	0	0	0	108.3	G484 S488	G484-V486 PolarHBondContact O-N 3.21Å; V486-S488 PolarHBondContact O-N 2.91Å
487	F	32.1	Very low	35.8	Very low	198 Å²	198	137.5 Å²	137.5	87%	0.868	80%	0.8	S	S	*	*			trans	-79.4	95.4	173	-156.4	-93	0	0	0	108.7	K485	K485-F487 PolarHBondContact O-N 2.95Å
488	S	34	Very low	36.5	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.2	123.6	171	51.2	0	0	0	0	110.4	V486	V486-S488 PolarHBondContact O-N 2.91Å
489	T	33.6	Very low	37.3	Very low	123 Å²	123	136.1 Å²	136.1	76%	0.755	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-61	136.3	168.3	35.5	0	0	0	0	110.9
490	P	39.4	Very low	37.7	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-76.3	130.2	-179.9	28.5	-29.7	0	0	0	110.9
491	K	35.8	Very low	37.7	Very low	202 Å²	202	132.1 Å²	132.1	88%	0.878	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-65	132.9	169	-71.5	175.3	175.8	176.3	0	110.2	F493	K491-F493 PolarHBondContact O-N 2.77Å
492	N	32.8	Very low	38.1	Very low	162 Å²	162	135 Å²	135	87%	0.866	79%	0.789	S	S	*	*			trans	12.2	101.8	155.4	-62.9	-13.1	0	0	0	116.8	S494	N492-S494 PolarHBondContact O-N 3.35Å
493	F	32.2	Very low	38.1	Very low	196 Å²	196	133.3 Å²	133.3	86%	0.86	78%	0.784	S	S	*	*			trans	-86.6	101.7	163.2	-153.7	-94.6	0	0	0	108.9	K491 T495	K491-F493 PolarHBondContact O-N 2.77Å; F493-T495 PolarHBondContact O-N 3.02Å
494	S	36.4	Very low	38.4	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.5	116.9	165.2	48	0	0	0	0	109.2	N492	N492-S494 PolarHBondContact O-N 3.35Å
495	T	36.7	Very low	38.7	Very low	126 Å²	126	145 Å²	145	77%	0.773	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-61.2	131.5	172.5	34.7	0	0	0	0	111.4	F493	F493-T495 PolarHBondContact O-N 3.02Å
496	P	45	Very low	38.8	Very low	102 Å²	102	139.8 Å²	139.8	66%	0.662	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.5	153	169.4	30.5	-31.4	0	0	0	110.7
497	P	47.5	Very low	39.1	Very low	115 Å²	115	140 Å²	140	75%	0.747	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.7	152.9	-178.7	30.2	-33.8	0	0	0	111.3
498	P	55.5	Low	39.5	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.4	148.5	178	29.1	-33.2	0	0	0	111.2
499	P	54.7	Low	40.2	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.5	154.1	173.6	28.7	-32.6	0	0	0	111
500	P	43.5	Very low	40.7	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.2	139	-176.1	28	-32.9	0	0	0	111	I502	P500-I502 PolarHBondContact O-N 3.1Å; P500-I502 VanDerWaalsContact O-N 3.13Å
501	S	37.9	Very low	40.5	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	80%	0.798	S	S	*	*			trans	-57.7	108.8	174.5	30.5	0	0	0	0	111	T503	S501-T503 PolarHBondContact O-N 3.27Å
502	I	40.1	Very low	40.9	Very low	157 Å²	157	143.5 Å²	143.5	81%	0.805	80%	0.798	S	S	*	*			trans	-76.8	103.1	165.7	-64.4	177.1	0	0	0	107.7	P500 R504	P500-I502 PolarHBondContact O-N 3.1Å; P500-I502 VanDerWaalsContact O-N 3.13Å; I502-R504 PolarHBondContact O-N 2.85Å
503	T	35.5	Very low	41.5	Very low	120 Å²	120	140.5 Å²	140.5	74%	0.736	79%	0.787	S	S	*	*			trans	-53.1	101.1	165.8	-47.1	0	0	0	0	109.6	S501 Q505	S501-T503 PolarHBondContact O-N 3.27Å; T503-Q505 PolarHBondContact O-N 2.88Å; T503-Q505 VanDerWaalsContact O-N 3.1Å
504	R	38.2	Very low	41.5	Very low	239 Å²	239	137.1 Å²	137.1	90%	0.902	78%	0.784	S	S	*	*			trans	-71.2	104.2	165.1	-99.8	-174.9	177.2	-178.3	-0.2	108	I502 A506	I502-R504 PolarHBondContact O-N 2.85Å; R504-A506 PolarHBondContact O-N 3.08Å
505	Q	38	Very low	41.6	Very low	173 Å²	173	140 Å²	140	81%	0.808	79%	0.791	S	S	*	*			trans	-50.7	123.2	164.7	-73.6	175.5	-17.2	0	0	109.2	T503 V507	T503-Q505 PolarHBondContact O-N 2.88Å; T503-Q505 VanDerWaalsContact O-N 3.1Å; Q505-V507 PolarHBondContact O-N 3.02Å
506	A	34	Very low	41.4	Very low	102 Å²	102	139.7 Å²	139.7	84%	0.843	79%	0.789	S	S	*	*			trans	-63.2	103.3	171.1	0	0	0	0	0	108.8	R504 K508	R504-A506 PolarHBondContact O-N 3.08Å; A506-K508 PolarHBondContact O-N 3.08Å
507	V	37.6	Very low	40.8	Very low	138 Å²	138	140 Å²	140	84%	0.836	79%	0.794	S	S	*	*			trans	-71.2	109	165.5	174.9	0	0	0	0	106.8	Q505	Q505-V507 PolarHBondContact O-N 3.02Å
508	K	41.9	Very low	40.2	Very low	185 Å²	185	138.7 Å²	138.7	80%	0.804	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-52.8	132.4	171	-108.7	172.5	175.2	173.9	0	109.9	A506	A506-K508 PolarHBondContact O-N 3.08Å
509	P	47.4	Very low	39	Very low	111 Å²	111	144.3 Å²	144.3	72%	0.721	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.8	140.5	165.5	28.6	-31.1	0	0	0	109.2	K511	P509-K511 PolarHBondContact O-N 3.22Å
510	P	43.8	Very low	38.1	Very low	126 Å²	126	144.6 Å²	144.6	82%	0.818	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-67.6	130.2	175.2	26.4	-27.8	0	0	0	109.4	E512	P510-E512 PolarHBondContact O-N 3.02Å
511	K	36.9	Very low	37.5	Very low	208 Å²	208	149.7 Å²	149.7	90%	0.904	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-64.9	116.9	169.9	-81.2	177.4	169.8	-176.8	0	108.9	P509	P509-K511 PolarHBondContact O-N 3.22Å
512	E	42.4	Very low	37.2	Very low	187 Å²	187	154.3 Å²	154.3	87%	0.874	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.4	136.9	161.7	-81.9	-177.7	163.6	0	0	110.3	P510	P510-E512 PolarHBondContact O-N 3.02Å
513	P	45.2	Very low	36.8	Very low	99 Å²	99	154.3 Å²	154.3	64%	0.643	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.3	158.3	-179.9	32.3	-33.2	0	0	0	111.8	L515	P513-L515 PolarHBondContact O-N 2.96Å
514	P	33.9	Very low	36.4	Very low	124 Å²	124	158.3 Å²	158.3	81%	0.805	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.8	117.4	-177.3	31.2	-30.5	0	0	0	109.7	T516	P514-T516 PolarHBondContact O-N 3.18Å
515	L	38.3	Very low	36.1	Very low	166 Å²	166	156.3 Å²	156.3	87%	0.869	81%	0.807	S	S	*	*			trans	-90.2	95.4	166.9	-103.3	127.7	0	0	0	110	P513	P513-L515 PolarHBondContact O-N 2.96Å
516	T	32.4	Very low	35.6	Very low	120 Å²	120	151.8 Å²	151.8	74%	0.736	81%	0.807	S	S	*	*			trans	-47.1	127.2	146.6	44.4	0	0	0	0	110.9	P514	P514-T516 PolarHBondContact O-N 3.18Å
517	S	32.2	Very low	35.5	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	80%	0.799	S	S	*	*				169	145.1	115.6	64.6	0	0	0	0	112.7
518	A	34.4	Very low	35.1	Very low	88 Å²	88	152.8 Å²	152.8	73%	0.727	80%	0.801	S	S	*	*			trans	68.2	89.1	145.5	0	0	0	0	0	119	P520	A518-P520 WeakPolarHBondContact O-CD 3.44Å
519	R	30	Very low	34.7	Very low	235 Å²	235	150.8 Å²	150.8	89%	0.887	80%	0.799	S	S	*	*			trans	-44.1	138.1	139.6	-125.8	178.1	-171.5	176.9	3.4	110.5
520	P	36.5	Very low	33.8	Very low	120 Å²	120	154 Å²	154	78%	0.779	80%	0.804	S	S	*	*			trans	-120.9	117.7	140.6	21.6	-3.6	0	0	0	110.4	A518	A518-P520 WeakPolarHBondContact O-CD 3.44Å
521	R	29.9	Very low	33.3	Very low	223 Å²	223	153.7 Å²	153.7	84%	0.842	80%	0.8	S	S	*	*			trans	-58.3	127.8	150.8	-81.2	176.6	164.7	-178.2	-4.5	107.7
522	R	31.6	Very low	33.1	Very low	211 Å²	211	148.7 Å²	148.7	80%	0.796	79%	0.787	S	S	*	*				171.3	138.7	122.5	-103.8	-179.1	161.8	169.5	-2.4	113.8
523	K	32.4	Very low	32.5	Very low	157 Å²	157	146.3 Å²	146.3	68%	0.683	78%	0.776	S	S	*	*			trans	78.1	85.5	139.5	-72.1	179.1	175.2	-168.7	0	117.3	K525	K523-K525 PolarHBondContact O-N 3.42Å
524	Q	28	Very low	31.9	Very low	204 Å²	204	148.3 Å²	148.3	95%	0.953	78%	0.778	S	S	*	*				-20.5	107.5	123.2	-144	162.2	8.1	0	0	111.6
525	K	31.5	Very low	31.6	Very low	196 Å²	196	151.1 Å²	151.1	85%	0.852	78%	0.78	S	S	*	*			trans	-144.2	114	162.5	-160.6	174.5	-176.4	-171.5	0	105.9	K523 S527	K523-K525 PolarHBondContact O-N 3.42Å; K525-S527 PolarHBondContact O-N 3.05Å
526	G	27.9	Very low	31.4	Very low	78 Å²	78	151.7 Å²	151.7	80%	0.804	78%	0.776	S	S	*	*			trans	-55.9	135.5	174	0	0	0	0	0	109.8
527	S	31.5	Very low	31.6	Very low	98 Å²	98	156.2 Å²	156.2	69%	0.685	80%	0.803	S	S	*	*			trans	-123.4	116.8	159	-169	0	0	0	0	104.5	K525 D529	K525-S527 PolarHBondContact O-N 3.05Å; S527-D529 PolarHBondContact O-N 2.89Å
528	D	29.2	Very low	31.5	Very low	163 Å²	163	158.6 Å²	158.6	87%	0.872	81%	0.805	S	S	*	*			trans	-60.5	108.9	171.2	-59.7	-58.1	0	0	0	107.7
529	D	32.6	Very low	31.4	Very low	144 Å²	144	162.3 Å²	162.3	77%	0.77	81%	0.809	S	S	*	*			trans	-91.1	105.6	169.1	-77.7	-29.7	0	0	0	108.1	S527 V531	S527-D529 PolarHBondContact O-N 2.89Å; D529-V531 PolarHBondContact O-N 3.5Å; D529-V531 VanDerWaalsContact O-N 3.08Å
530	E	29.7	Very low	31.5	Very low	177 Å²	177	158.2 Å²	158.2	83%	0.827	81%	0.805	S	S	*	*			trans	-61.9	99.6	175.8	-159.6	-179.5	158.7	0	0	109.6	V532	E530-V532 PolarHBondContact O-N 3.34Å; E530-V532 VanDerWaalsContact O-N 3.08Å
531	V	32.7	Very low	31.2	Very low	121 Å²	121	160.5 Å²	160.5	73%	0.733	81%	0.806	S	S	*	*			trans	-72.6	97	168.2	179	0	0	0	0	107.4	D529 Q533	D529-V531 PolarHBondContact O-N 3.5Å; D529-V531 VanDerWaalsContact O-N 3.08Å; V531-Q533 VanDerWaalsContact C-N 3.3Å; V531-Q533 HydrophobicContact CG1-CG 4.43Å; V531-Q533 PolarHBondContact O-N 3.3Å
532	V	32.6	Very low	31.3	Very low	103 Å²	103	156.6 Å²	156.6	62%	0.624	80%	0.804	S	S	*	*			trans	-71.5	90.7	168.2	-179.4	0	0	0	0	108.1	E530 M534	E530-V532 PolarHBondContact O-N 3.34Å; E530-V532 VanDerWaalsContact O-N 3.08Å; V532-M534 HydrophobicContact CG1-CG 4.38Å; V532-M534 PolarHBondContact O-N 3.2Å
533	Q	29	Very low	31.2	Very low	136 Å²	136	152.9 Å²	152.9	64%	0.636	81%	0.805	S	S	*	*			trans	-70	106.9	159.8	-92.2	-171.7	-55.2	0	0	108.3	V531 Q535	V531-Q533 VanDerWaalsContact C-N 3.3Å; V531-Q533 HydrophobicContact CG1-CG 4.43Å; V531-Q533 PolarHBondContact O-N 3.3Å; Q533-Q535 PolarHBondContact O-N 3.38Å
534	M	33.9	Very low	31.2	Very low	141 Å²	141	152.6 Å²	152.6	70%	0.695	81%	0.813	S	S	*	*			trans	-79.2	102	157.5	-76	-172.5	-173.7	0	0	108.2	V532 F536	V532-M534 HydrophobicContact CG1-CG 4.38Å; V532-M534 PolarHBondContact O-N 3.2Å; M534-F536 HydrophobicContact CB-CD2 4.14Å; M534-F536 HydrophobicContact CB-CE2 3.66Å; M534-F536 HydrophobicContact CB-CZ 4.34Å; M534-F536 HydrophobicContact CG-CE2 4.37Å; M534-F536 HydrophobicContact SD-CE2 3.89Å; M534-F536 HydrophobicContact SD-CZ 3.8Å
535	Q	26.2	Very low	31.4	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	80%	0.803	S	S	*	*			trans	-70	121.3	156.5	-82.5	179.3	-57.1	0	0	108	Q533	Q533-Q535 PolarHBondContact O-N 3.38Å
536	F	35.6	Very low	31.4	Very low	179 Å²	179	144.8 Å²	144.8	79%	0.785	80%	0.799	S	S	*	*			trans	-100.5	130	163.6	-74.6	-82.4	0	0	0	108.9	M534	M534-F536 HydrophobicContact CB-CD2 4.14Å; M534-F536 HydrophobicContact CB-CE2 3.66Å; M534-F536 HydrophobicContact CB-CZ 4.34Å; M534-F536 HydrophobicContact CG-CE2 4.37Å; M534-F536 HydrophobicContact SD-CE2 3.89Å; M534-F536 HydrophobicContact SD-CZ 3.8Å
537	V	35.7	Very low	31.7	Very low	214 Å²	214	150.8 Å²	150.8	100%	1.297	80%	0.798	S	S	*	*			trans	-71.1	0	167.6	173	0	0	0	0	110

Retrieved 537 of 537 residues in 200 ms (Link to these results)

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