A0A087YLJ7_POEFO Loading...

Solute carrier family 25 member 25

AlphaFold DB , UniProt , Accession A0A087YLJ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	32.5	Very low	246 Å²	246	115.2 Å²	115.2	100%	1.212	60%	0.598	S	S	*	*				0	76.7	0	-115.2	-171.4	-174.9	0	0	109.7
2	I	23.4	Very low	33.2	Very low	164 Å²	164	111.4 Å²	111.4	84%	0.841	61%	0.609	S	S	*	*			trans	-149.1	99.7	157.3	-56.6	-176.7	0	0	0	104.5
3	Q	23.3	Very low	34	Very low	129 Å²	129	105.4 Å²	105.4	60%	0.603	58%	0.575	S	S	*	*			trans	-63.5	138.7	168.5	-87.3	179.8	-32.8	0	0	108.4	Q5	Q3-Q5 PolarHBondContact O-N 2.75Å; Q3-Q5 VanDerWaalsContact O-N 3.14Å
4	P	29.3	Very low	35.1	Very low	93 Å²	93	99.5 Å²	99.5	60%	0.604	54%	0.541	S	S	*	.			trans	-61.9	119.5	171.6	24.3	-29.5	0	0	0	108.6	G6 T7	P4-G6 PolarHBondContact O-N 3.39Å; P4-G6 VanDerWaalsContact O-N 3.1Å; P4-T7 PolarHBondContact O-OG1 2.93Å
5	Q	27.3	Very low	35.5	Very low	169 Å²	169	98.2 Å²	98.2	79%	0.79	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.8	-175.3	-70.5	-173.3	-10.5	0	0	113.6	Q3	Q3-Q5 PolarHBondContact O-N 2.75Å; Q3-Q5 VanDerWaalsContact O-N 3.14Å
6	G	31.4	Very low	35.7	Very low	20 Å²	20	104 Å²	104	21%	0.206	56%	0.563	C	S	.	*	H	α-helix	trans	-67.7	-37.1	-179.5	0	0	0	0	0	114.4	P4 R8 L9	P4-G6 PolarHBondContact O-N 3.39Å; P4-G6 VanDerWaalsContact O-N 3.1Å; G6-R8 PolarHBondContact O-N 3.14Å; G6-L9 PolarHBondContact O-N 3.45Å
7	T	36.9	Very low	35.6	Very low	97 Å²	97	104.2 Å²	104.2	60%	0.595	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-23.4	-177.8	-15.9	0	0	0	0	112.7	P4 A11	P4-T7 PolarHBondContact O-OG1 2.93Å; T7-A11 WeakPolarHBondContact O-CB 3.14Å; T7-A11 PolarHBondContact O-N 2.82Å
8	R	33.7	Very low	35.4	Very low	175 Å²	175	112.2 Å²	112.2	66%	0.66	59%	0.593	S	S	*	*	H	α-helix	trans	-75.6	-27.4	176.8	-74.2	-173.2	-178.8	-167.2	-0.5	113.6	G6 G12	G6-R8 PolarHBondContact O-N 3.14Å; R8-G12 PolarHBondContact O-N 3.48Å; R8-G12 VanDerWaalsContact O-N 3.15Å
9	L	37.8	Very low	35.1	Very low	102 Å²	102	112.6 Å²	112.6	53%	0.534	61%	0.606	S	S	.	*	H	α-helix	trans	-72.5	-40.2	179	-108	133.3	0	0	0	111.5	G6 G12 L13	G6-L9 PolarHBondContact O-N 3.45Å; L9-G12 PolarHBondContact O-N 3.29Å; L9-L13 WeakPolarHBondContact O-CD1 3.39Å
10	V	42.8	Very low	34.8	Very low	26 Å²	26	111.7 Å²	111.7	16%	0.158	61%	0.614	C	S	.	*	H	α-helix	trans	-68	-39.3	172.6	-175.9	0	0	0	0	110.6	G12 L13 F14 L95	V10-G12 VanDerWaalsContact C-N 3.26Å; V10-G12 PolarHBondContact O-N 3.12Å; V10-L13 PolarHBondContact O-N 3.3Å; V10-F14 HydrophobicContact CG1-CD2 4.34Å; V10-F14 HydrophobicContact CG1-CE2 4.42Å; V10-F14 VanDerWaalsContact O-CD2 3.29Å; V10-F14 WeakPolarHBondContact O-CD2 3.43Å; V10-L95 HydrophobicContact CG2-CB 4.2Å; V10-L95 HydrophobicContact CG2-CD2 4.27Å
11	A	39.4	Very low	34.5	Very low	46 Å²	46	114.4 Å²	114.4	38%	0.38	62%	0.623	S	S	.	*	H	α-helix	trans	-64.9	-25.5	177	0	0	0	0	0	114.2	T7	T7-A11 WeakPolarHBondContact O-CB 3.14Å; T7-A11 PolarHBondContact O-N 2.82Å
12	G	41.3	Very low	34.3	Very low	70 Å²	70	109.5 Å²	109.5	72%	0.722	61%	0.607	S	S	*	*	H	α-helix	trans	-82.3	-16.4	176.7	0	0	0	0	0	115	R8 L9 V10	R8-G12 PolarHBondContact O-N 3.48Å; R8-G12 VanDerWaalsContact O-N 3.15Å; L9-G12 PolarHBondContact O-N 3.29Å; V10-G12 VanDerWaalsContact C-N 3.26Å; V10-G12 PolarHBondContact O-N 3.12Å
13	L	44.1	Very low	34.6	Very low	33 Å²	33	110.5 Å²	110.5	17%	0.173	61%	0.608	C	S	.	*	H	α-helix	trans	-88.2	-14.1	178.6	-79.2	156.3	0	0	0	112.9	L9 V10 R67 V70 I74 L95	L9-L13 WeakPolarHBondContact O-CD1 3.39Å; V10-L13 PolarHBondContact O-N 3.3Å; L13-R67 PolarHBondContact O-NE 3.43Å; L13-V70 HydrophobicContact CD2-CB 4.33Å; L13-V70 HydrophobicContact CD2-CG1 3.42Å; L13-V70 VanDerWaalsContact CD2-CG1 3.42Å; L13-I74 HydrophobicContact CD1-CD1 3.79Å; L13-I74 HydrophobicContact CD2-CD1 3.78Å; L13-I74 HydrophobicContact CG-CD1 4.39Å; L13-L95 HydrophobicContact CD1-CD2 4.43Å
14	F	48.3	Very low	34.8	Very low	23 Å²	23	108.4 Å²	108.4	10%	0.101	61%	0.612	C	S	.	*	S	Bend	trans	-128.6	93.5	-172.4	-62.1	-106.3	0	0	0	109.3	V10 R67 L71 D193 L196	V10-F14 HydrophobicContact CG1-CD2 4.34Å; V10-F14 HydrophobicContact CG1-CE2 4.42Å; V10-F14 VanDerWaalsContact O-CD2 3.29Å; V10-F14 WeakPolarHBondContact O-CD2 3.43Å; F14-R67 VanDerWaalsContact CA-NH2 3.28Å; F14-R67 VanDerWaalsContact CG-NH2 3.3Å; F14-L71 HydrophobicContact CZ-CD2 4.41Å; F14-D193 WeakPolarHBondContact CB-OD2 3.26Å; F14-D193 WeakPolarHBondContact CD1-OD1 3.38Å; F14-L196 HydrophobicContact CE1-CD2 3.73Å; F14-L196 HydrophobicContact CZ-CD2 4.05Å
15	C	42.1	Very low	34.7	Very low	80 Å²	80	109.1 Å²	109.1	54%	0.541	62%	0.62	S	S	.	*			trans	-6.8	134.1	-171	-149	0	0	0	0	122.5	C17	C15-C17 PolarHBondContact SG-SG 3.38Å
16	Q	38	Very low	34.8	Very low	191 Å²	191	107.6 Å²	107.6	89%	0.893	62%	0.622	S	S	*	*			trans	-87.1	92.6	150.1	-73.7	178.6	-8.6	0	0	110.1	R18	Q16-R18 PolarHBondContact O-N 2.93Å
17	C	35	Very low	34.6	Very low	108 Å²	108	114 Å²	114	73%	0.73	65%	0.651	S	S	*	*			trans	-87	102	164.3	-76.2	0	0	0	0	109.3	C15 S19	C15-C17 PolarHBondContact SG-SG 3.38Å; C17-S19 PolarHBondContact O-N 2.85Å
18	R	31.4	Very low	34.5	Very low	247 Å²	247	114.8 Å²	114.8	93%	0.932	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-68.1	116.5	162.6	-93.5	-178.9	174.2	179.4	-1.8	108.4	Q16 A20	Q16-R18 PolarHBondContact O-N 2.93Å; R18-A20 PolarHBondContact O-N 3.42Å
19	S	29.5	Very low	34.2	Very low	121 Å²	121	110.3 Å²	110.3	85%	0.846	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-61.9	117.6	164.1	-48.6	0	0	0	0	109.1	C17 E21	C17-S19 PolarHBondContact O-N 2.85Å; S19-E21 PolarHBondContact O-N 3.35Å
20	A	28.8	Very low	33.7	Very low	93 Å²	93	109.5 Å²	109.5	77%	0.769	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-72.8	116.2	171.2	0	0	0	0	0	109.7	R18	R18-A20 PolarHBondContact O-N 3.42Å
21	E	28.3	Very low	32.9	Very low	169 Å²	169	111.8 Å²	111.8	79%	0.79	71%	0.712	S	S	*	*			trans	49.6	103.3	147.8	-60.9	-178.3	160.5	0	0	119.6	S19	S19-E21 PolarHBondContact O-N 3.35Å
22	T	27.4	Very low	32.2	Very low	144 Å²	144	116.5 Å²	116.5	88%	0.883	74%	0.74	S	S	*	*			trans	-117.5	90.1	134.4	37.9	0	0	0	0	109	A24	T22-A24 PolarHBondContact O-N 3.29Å
23	H	30.2	Very low	31.5	Very low	184 Å²	184	116.6 Å²	116.6	85%	0.852	74%	0.741	S	S	*	*			trans	-72.6	111	157.3	-105.1	-80.9	0	0	0	108
24	A	27.8	Very low	31	Very low	85 Å²	85	121.1 Å²	121.1	70%	0.702	77%	0.773	S	S	*	*			trans	-138.3	88.8	161.4	0	0	0	0	0	109.6	T22	T22-A24 PolarHBondContact O-N 3.29Å
25	S	27.2	Very low	31.1	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	80%	0.803	S	S	*	*			trans	36.3	105.8	135	51.2	0	0	0	0	118.4
26	V	29	Very low	31.2	Very low	137 Å²	137	126.9 Å²	126.9	83%	0.83	81%	0.811	S	S	*	*			trans	-67.8	125.7	142.3	174	0	0	0	0	107.5
27	D	28.5	Very low	30.8	Very low	155 Å²	155	124.3 Å²	124.3	83%	0.829	81%	0.808	S	S	*	*			trans	-154	136.9	145.9	-113	-17.9	0	0	0	111.6
28	P	34	Very low	30.4	Very low	112 Å²	112	124.1 Å²	124.1	73%	0.727	81%	0.808	S	S	*	*			trans	-97.3	136.8	175	35.1	-26.9	0	0	0	112
29	G	26.8	Very low	30.9	Very low	82 Å²	82	117.5 Å²	117.5	85%	0.845	80%	0.797	S	S	*	*			trans	99.5	120.9	149.8	0	0	0	0	0	119
30	G	27.2	Very low	30.8	Very low	85 Å²	85	120.8 Å²	120.8	88%	0.876	80%	0.799	S	S	*	*				73.8	108	126.9	0	0	0	0	0	121.7
31	G	25.8	Very low	31.5	Very low	74 Å²	74	121.3 Å²	121.3	76%	0.763	80%	0.795	S	S	*	*				102.1	111.8	125.5	0	0	0	0	0	120.9
32	C	25.3	Very low	31.9	Very low	144 Å²	144	119.4 Å²	119.4	97%	0.973	80%	0.797	S	S	*	*			trans	60.8	121.1	140.7	-64.2	0	0	0	0	122.7
33	G	26.8	Very low	31.9	Very low	73 Å²	73	120.6 Å²	120.6	75%	0.753	79%	0.792	S	S	*	*			trans	147.8	134.1	147.1	0	0	0	0	0	116.4
34	P	34	Very low	31.7	Very low	128 Å²	128	118.3 Å²	118.3	83%	0.831	79%	0.787	S	S	*	*			trans	-99.4	177.9	-159.8	42.8	-37.3	0	0	0	115.5
35	P	49.5	Very low	31.7	Very low	112 Å²	112	120.1 Å²	120.1	73%	0.727	79%	0.794	S	S	*	*			trans	-94.7	-173	-157.9	44.6	-37.2	0	0	0	111.6
36	P	44.4	Very low	31.8	Very low	111 Å²	111	126.7 Å²	126.7	72%	0.721	80%	0.802	S	S	*	*				-166.2	179.2	78.4	40.3	-14.3	0	0	0	119.4
37	V	29.6	Very low	31.8	Very low	137 Å²	137	126 Å²	126	83%	0.83	80%	0.803	S	S	*	*			trans	90.5	117	146.8	-167.1	0	0	0	0	122.4
38	S	27	Very low	31.7	Very low	105 Å²	105	122.5 Å²	122.5	73%	0.734	80%	0.804	S	S	*	*			trans	-66.7	-160.2	164.7	-31	0	0	0	0	113.8
39	P	41.2	Very low	31.4	Very low	108 Å²	108	122.9 Å²	122.9	70%	0.701	81%	0.81	S	S	*	*			cis	-139.5	159.5	-15.7	37.7	-17.8	0	0	0	116.6
40	Q	28.2	Very low	31.5	Very low	190 Å²	190	126.3 Å²	126.3	89%	0.888	81%	0.809	S	S	*	*			trans	73.6	158.8	132.8	-78.9	-163.5	-20.8	0	0	125.2
41	P	44.2	Very low	31.7	Very low	103 Å²	103	130 Å²	130	67%	0.669	81%	0.806	S	S	*	*			trans	-108.7	-168	-147.4	43.9	-33.4	0	0	0	114.3
42	P	35.7	Very low	32.1	Very low	129 Å²	129	131.6 Å²	131.6	84%	0.838	80%	0.803	S	S	*	*				-150.7	-179.3	97.7	37.1	-16.3	0	0	0	116.6
43	Q	28	Very low	32.3	Very low	169 Å²	169	132.3 Å²	132.3	79%	0.79	80%	0.797	S	S	*	*			trans	-86	171.8	-163.2	-63.7	170.8	-58	0	0	116.8
44	D	26.2	Very low	32.4	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	81%	0.806	S	S	*	*			trans	88.8	110.3	145.9	-69.3	-19.5	0	0	0	121.1
45	S	26.7	Very low	32.2	Very low	124 Å²	124	137.9 Å²	137.9	87%	0.867	80%	0.798	S	S	*	*				-160.7	117.9	120.8	14	0	0	0	0	110.9
46	R	29.7	Very low	31.3	Very low	247 Å²	247	137.8 Å²	137.8	93%	0.932	80%	0.799	S	S	*	*			trans	-72.7	135.8	167.2	-72.7	174.5	173.3	178.8	-3.4	109.9
47	S	29.4	Very low	31	Very low	121 Å²	121	140.5 Å²	140.5	85%	0.846	81%	0.807	S	S	*	*			trans	-143.5	120.6	146.7	56.4	0	0	0	0	107.7
48	G	27.1	Very low	31.7	Very low	82 Å²	82	139.4 Å²	139.4	85%	0.845	80%	0.8	S	S	*	*			trans	-82.9	153	-172.4	0	0	0	0	0	113.6
49	S	27.6	Very low	32.6	Very low	121 Å²	121	138.4 Å²	138.4	85%	0.846	79%	0.793	S	S	*	*			trans	-138	116.2	151.2	55	0	0	0	0	106.9
50	D	29.1	Very low	32.8	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	79%	0.786	S	S	*	*			trans	-69.4	160	179.1	-71.6	-59	0	0	0	113.1
51	I	29.5	Very low	33.6	Very low	161 Å²	161	128.5 Å²	128.5	83%	0.826	76%	0.761	S	S	*	*			trans	95.1	133.1	161.4	-38.1	161.3	0	0	0	116
52	P	34.8	Very low	33.7	Very low	108 Å²	108	129 Å²	129	70%	0.701	76%	0.764	S	S	*	*				-138.7	177.3	-58.4	41.7	-22.7	0	0	0	113
53	D	29.6	Very low	34.7	Very low	159 Å²	159	130 Å²	130	85%	0.85	76%	0.758	S	S	*	*			trans	38.4	101.5	156.3	-90.3	-17.9	0	0	0	120.1	A55	D53-A55 PolarHBondContact O-N 3.47Å; D53-A55 VanDerWaalsContact O-N 3.09Å
54	Y	29.8	Very low	36.4	Very low	240 Å²	240	124.1 Å²	124.1	94%	0.941	73%	0.73	S	S	*	*			trans	-66.7	104.7	158	-79.7	-93.2	0	0	0	109.4
55	A	28.4	Very low	38.4	Very low	78 Å²	78	123 Å²	123	65%	0.645	72%	0.721	S	S	*	*			trans	-58	144.7	168.6	0	0	0	0	0	111.4	D53	D53-A55 PolarHBondContact O-N 3.47Å; D53-A55 VanDerWaalsContact O-N 3.09Å
56	C	31.2	Very low	40.5	Very low	111 Å²	111	123 Å²	123	75%	0.75	71%	0.706	S	S	*	*			trans	-68.8	134.8	-172.4	179.7	0	0	0	0	113.9	V58	C56-V58 VanDerWaalsContact C-N 3.26Å; C56-V58 PolarHBondContact O-N 3Å
57	D	38.8	Very low	42.6	Very low	168 Å²	168	114.2 Å²	114.2	90%	0.898	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	25.5	-169.6	-118.7	-11.5	0	0	0	117.4
58	V	42.5	Very low	45.1	Very low	114 Å²	114	108.8 Å²	108.8	69%	0.691	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	-30.1	-176.2	-179.5	0	0	0	0	116.1	C56	C56-V58 VanDerWaalsContact C-N 3.26Å; C56-V58 PolarHBondContact O-N 3Å
59	C	47.6	Very low	47.7	Very low	84 Å²	84	109.9 Å²	109.9	57%	0.568	62%	0.616	S	S	*	*	S	Bend	trans	174.6	89.5	172.6	43.3	0	0	0	0	111.6
60	G	44.8	Very low	50.2	Low	55 Å²	55	106.1 Å²	106.1	57%	0.567	59%	0.588	S	S	*	*			trans	175	44.6	175.5	0	0	0	0	0	116
61	G	44.9	Very low	52.7	Low	35 Å²	35	98.8 Å²	98.8	36%	0.361	55%	0.549	S	S	.	.	S	Bend	trans	-114.9	170.7	176.2	0	0	0	0	0	113.5	E63 Q64	G61-E63 PolarHBondContact O-N 2.93Å; G61-Q64 PolarHBondContact O-N 3.34Å
62	P	46.6	Very low	55.4	Low	114 Å²	114	91.8 Å²	91.8	74%	0.74	51%	0.513	S	S	*	.	H	α-helix	trans	-53.3	-18.6	177.6	19	-31.3	0	0	0	114.5	H66	P62-H66 WeakPolarHBondContact O-CB 3.34Å; P62-H66 PolarHBondContact O-N 3.2Å; P62-H66 VanDerWaalsContact O-N 3.15Å
63	E	55.5	Low	57.8	Low	149 Å²	149	92.1 Å²	92.1	70%	0.696	51%	0.505	S	S	*	.	H	α-helix	trans	-68	-31.9	173.9	-63.8	-175.3	165.2	0	0	113.9	G61 R67	G61-E63 PolarHBondContact O-N 2.93Å; E63-R67 WeakPolarHBondContact O-CD 3.39Å; E63-R67 WeakPolarHBondContact O-CG 3.38Å; E63-R67 PolarHBondContact O-N 3.03Å; E63-R67 VanDerWaalsContact O-N 3.11Å
64	Q	63.8	Low	60.3	Low	45 Å²	45	87.2 Å²	87.2	21%	0.21	48%	0.478	C	S	.	.	H	α-helix	trans	-73.6	-43.6	179.4	-174.4	174.4	8.3	0	0	111.4	G61 H66 R67 L68	G61-Q64 PolarHBondContact O-N 3.34Å; Q64-H66 VanDerWaalsContact C-N 3.32Å; Q64-H66 PolarHBondContact O-N 2.86Å; Q64-R67 PolarHBondContact O-N 3.45Å; Q64-L68 WeakPolarHBondContact O-CG 3.32Å; Q64-L68 PolarHBondContact O-N 3.49Å
65	E	68.6	Low	62.9	Low	114 Å²	114	75.9 Å²	75.9	53%	0.533	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-38.8	176.5	-170.2	171.4	-178.2	0	0	111.2	R67 L68 K69 F121	E65-R67 PolarHBondContact O-N 3.18Å; E65-L68 PolarHBondContact O-N 2.93Å; E65-K69 WeakPolarHBondContact O-CB 3.47Å; E65-K69 PolarHBondContact O-N 3.3Å; E65-F121 HydrophobicContact CG-CZ 4.48Å
66	H	71.8	Confident	65.8	Low	122 Å²	122	73.1 Å²	73.1	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-60.1	-42.7	172.8	-172.7	60.7	0	0	0	112.4	P62 Q64 K69 V70	P62-H66 WeakPolarHBondContact O-CB 3.34Å; P62-H66 PolarHBondContact O-N 3.2Å; P62-H66 VanDerWaalsContact O-N 3.15Å; Q64-H66 VanDerWaalsContact C-N 3.32Å; Q64-H66 PolarHBondContact O-N 2.86Å; H66-K69 WeakPolarHBondContact O-CB 3.49Å; H66-K69 PolarHBondContact O-N 3.42Å; H66-V70 WeakPolarHBondContact O-CG2 3.28Å; H66-V70 PolarHBondContact O-N 3.24Å
67	R	73.1	Confident	68.4	Low	63 Å²	63	70.4 Å²	70.4	24%	0.238	39%	0.388	C	S	.	.	H	α-helix	trans	-66.1	-43.2	177.8	-73	163.5	66.8	-168.2	1.4	113	L13 F14 E63 Q64 E65 K69 V70 L71	L13-R67 PolarHBondContact O-NE 3.43Å; F14-R67 VanDerWaalsContact CA-NH2 3.28Å; F14-R67 VanDerWaalsContact CG-NH2 3.3Å; E63-R67 WeakPolarHBondContact O-CD 3.39Å; E63-R67 WeakPolarHBondContact O-CG 3.38Å; E63-R67 PolarHBondContact O-N 3.03Å; E63-R67 VanDerWaalsContact O-N 3.11Å; Q64-R67 PolarHBondContact O-N 3.45Å; E65-R67 PolarHBondContact O-N 3.18Å; R67-K69 PolarHBondContact O-N 2.73Å; R67-V70 PolarHBondContact O-N 2.95Å; R67-L71 PolarHBondContact O-N 3.03Å
68	L	81	Confident	70.7	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-63.9	-34.7	175.8	-66.7	179.2	0	0	0	111.2	Q64 E65 L71 F72 V125 L128	Q64-L68 WeakPolarHBondContact O-CG 3.32Å; Q64-L68 PolarHBondContact O-N 3.49Å; E65-L68 PolarHBondContact O-N 2.93Å; L68-L71 PolarHBondContact O-N 3.19Å; L68-F72 WeakPolarHBondContact O-CB 3.46Å; L68-F72 PolarHBondContact O-N 3.37Å; L68-V125 HydrophobicContact CB-CG2 4.14Å; L68-V125 HydrophobicContact CD1-CB 4.49Å; L68-V125 HydrophobicContact CD1-CG1 4.03Å; L68-V125 HydrophobicContact CD1-CG2 4.09Å; L68-L128 HydrophobicContact CD2-CD1 3.65Å
69	K	82	Confident	72.8	Confident	105 Å²	105	63.8 Å²	63.8	46%	0.457	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-46	173.6	-170.1	173.9	-179.5	176.2	0	112.7	E65 H66 R67 L71 F72 E73 F121	E65-K69 WeakPolarHBondContact O-CB 3.47Å; E65-K69 PolarHBondContact O-N 3.3Å; H66-K69 WeakPolarHBondContact O-CB 3.49Å; H66-K69 PolarHBondContact O-N 3.42Å; R67-K69 PolarHBondContact O-N 2.73Å; K69-L71 VanDerWaalsContact C-N 3.31Å; K69-L71 PolarHBondContact O-N 2.72Å; K69-F72 WeakPolarHBondContact O-CB 3.34Å; K69-F72 PolarHBondContact O-N 2.76Å; K69-E73 WeakPolarHBondContact CE-OE1 3.21Å; K69-E73 WeakPolarHBondContact O-CG 3.27Å; K69-E73 PolarHBondContact O-N 3.37Å; K69-F121 VanDerWaalsContact CA-CE2 3.48Å; K69-F121 HydrophobicContact CB-CE2 3.85Å; K69-F121 HydrophobicContact CB-CZ 3.87Å; K69-F121 HydrophobicContact CG-CE2 4.23Å; K69-F121 HydrophobicContact CG-CZ 4.33Å
70	V	81.1	Confident	74.6	Confident	42 Å²	42	64.1 Å²	64.1	26%	0.255	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-41.1	175.1	175.5	0	0	0	0	111.1	L13 H66 R67 E73 I74	L13-V70 HydrophobicContact CD2-CB 4.33Å; L13-V70 HydrophobicContact CD2-CG1 3.42Å; L13-V70 VanDerWaalsContact CD2-CG1 3.42Å; H66-V70 WeakPolarHBondContact O-CG2 3.28Å; H66-V70 PolarHBondContact O-N 3.24Å; R67-V70 PolarHBondContact O-N 2.95Å; V70-E73 PolarHBondContact O-N 3.08Å; V70-I74 HydrophobicContact CG1-CD1 3.95Å; V70-I74 WeakPolarHBondContact O-CD1 3.38Å; V70-I74 VanDerWaalsContact O-CG1 3.25Å; V70-I74 WeakPolarHBondContact O-CG1 3.46Å; V70-I74 PolarHBondContact O-N 3.25Å
71	L	82.1	Confident	76.6	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-41.8	175.6	-179.9	64.5	0	0	0	111.9	F14 R67 L68 K69 I74 L75 L95 F124 L128 L197	F14-L71 HydrophobicContact CZ-CD2 4.41Å; R67-L71 PolarHBondContact O-N 3.03Å; L68-L71 PolarHBondContact O-N 3.19Å; K69-L71 VanDerWaalsContact C-N 3.31Å; K69-L71 PolarHBondContact O-N 2.72Å; L71-I74 PolarHBondContact O-N 3.41Å; L71-L75 HydrophobicContact CD1-CD1 4.07Å; L71-L75 HydrophobicContact CD1-CG 4.22Å; L71-L75 HydrophobicContact CG-CD1 3.97Å; L71-L75 HydrophobicContact CG-CG 4.47Å; L71-L75 WeakPolarHBondContact O-CB 3.42Å; L71-L75 VanDerWaalsContact O-CG 3.31Å; L71-L75 WeakPolarHBondContact O-CG 3.4Å; L71-L75 PolarHBondContact O-N 3.08Å; L71-L95 HydrophobicContact CD1-CD1 4.09Å; L71-F124 HydrophobicContact CD2-CE1 4.34Å; L71-F124 HydrophobicContact CD2-CZ 3.91Å; L71-F124 HydrophobicContact CG-CE1 4.43Å; L71-F124 HydrophobicContact CG-CZ 4.04Å; L71-L128 HydrophobicContact CD2-CD1 4.11Å; L71-L197 HydrophobicContact CD2-CD2 4.23Å
72	F	86	Confident	78.7	Confident	13 Å²	13	62 Å²	62	6%	0.057	34%	0.337	C	S	.	.	H	α-helix	trans	-58.7	-49.1	175.7	-176.7	-89.4	0	0	0	110.9	L68 K69 I74 L75 D76 G81 I83 L119 F121 F124	L68-F72 WeakPolarHBondContact O-CB 3.46Å; L68-F72 PolarHBondContact O-N 3.37Å; K69-F72 WeakPolarHBondContact O-CB 3.34Å; K69-F72 PolarHBondContact O-N 2.76Å; F72-I74 VanDerWaalsContact C-N 3.27Å; F72-I74 PolarHBondContact O-N 2.87Å; F72-L75 PolarHBondContact O-N 3.09Å; F72-L75 VanDerWaalsContact O-N 3.08Å; F72-D76 HydrophobicContact CE1-CB 4.35Å; F72-D76 WeakPolarHBondContact O-CB 3.27Å; F72-D76 PolarHBondContact O-N 2.71Å; F72-G81 WeakPolarHBondContact CZ-O 3.4Å; F72-I83 HydrophobicContact CD2-CD1 3.29Å; F72-I83 HydrophobicContact CD2-CG1 3.87Å; F72-I83 HydrophobicContact CE2-CD1 3.51Å; F72-I83 HydrophobicContact CE2-CG1 3.57Å; F72-I83 HydrophobicContact CG-CD1 4.02Å; F72-I83 HydrophobicContact CZ-CD1 4.37Å; F72-I83 HydrophobicContact CZ-CG1 4.03Å; F72-L119 WeakPolarHBondContact CE2-O 3.43Å; F72-F121 HydrophobicContact CB-CD2 3.84Å; F72-F121 HydrophobicContact CB-CE2 4.15Å; F72-F121 HydrophobicContact CD1-CD2 4.14Å; F72-F121 HydrophobicContact CD2-CB 4.36Å; F72-F121 AromaticContact CD2-CD2 3.91Å; F72-F121 HydrophobicContact CD2-CD2 3.91Å; F72-F121 HydrophobicContact CE1-CB 4.35Å; F72-F121 VanDerWaalsContact CE2-CA 3.48Å; F72-F121 HydrophobicContact CE2-CB 4.16Å; F72-F121 AromaticContact CG-CD2 3.69Å; F72-F121 HydrophobicContact CG-CD2 3.69Å; F72-F121 HydrophobicContact CG-CE2 4.48Å; F72-F121 HydrophobicContact CZ-CB 4.15Å; F72-F124 HydrophobicContact CB-CD1 4.03Å; F72-F124 HydrophobicContact CB-CE1 4Å; F72-F124 HydrophobicContact CD2-CB 3.77Å; F72-F124 AromaticContact CD2-CD1 3.6Å; F72-F124 HydrophobicContact CD2-CD1 3.6Å; F72-F124 HydrophobicContact CD2-CD2 4.49Å; F72-F124 HydrophobicContact CD2-CE1 4.26Å; F72-F124 AromaticContact CD2-CG 3.71Å; F72-F124 HydrophobicContact CD2-CG 3.71Å; F72-F124 HydrophobicContact CE2-CB 3.96Å; F72-F124 HydrophobicContact CE2-CG 4.33Å; F72-F124 HydrophobicContact CG-CD1 4.31Å
73	E	84.8	Confident	80.7	Confident	116 Å²	116	56.6 Å²	56.6	54%	0.542	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-29.2	177.9	-70.4	171.5	-173.2	0	0	113.2	K69 V70	K69-E73 WeakPolarHBondContact CE-OE1 3.21Å; K69-E73 WeakPolarHBondContact O-CG 3.27Å; K69-E73 PolarHBondContact O-N 3.37Å; V70-E73 PolarHBondContact O-N 3.08Å
74	I	82	Confident	82.3	Confident	56 Å²	56	50.8 Å²	50.8	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-75	-34.6	174.8	-71.1	167.2	0	0	0	111.6	L13 V70 L71 F72 L95	L13-I74 HydrophobicContact CD1-CD1 3.79Å; L13-I74 HydrophobicContact CD2-CD1 3.78Å; L13-I74 HydrophobicContact CG-CD1 4.39Å; V70-I74 HydrophobicContact CG1-CD1 3.95Å; V70-I74 WeakPolarHBondContact O-CD1 3.38Å; V70-I74 VanDerWaalsContact O-CG1 3.25Å; V70-I74 WeakPolarHBondContact O-CG1 3.46Å; V70-I74 PolarHBondContact O-N 3.25Å; L71-I74 PolarHBondContact O-N 3.41Å; F72-I74 VanDerWaalsContact C-N 3.27Å; F72-I74 PolarHBondContact O-N 2.87Å; I74-L95 HydrophobicContact CG2-CD1 4.49Å; I74-L95 HydrophobicContact CG2-CD2 4.29Å
75	L	84.4	Confident	83.4	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-83.7	-30.4	-178.3	-69	176.9	0	0	0	112.5	L71 F72 V77 I83 D87 L88 L92 L95 F124	L71-L75 HydrophobicContact CD1-CD1 4.07Å; L71-L75 HydrophobicContact CD1-CG 4.22Å; L71-L75 HydrophobicContact CG-CD1 3.97Å; L71-L75 HydrophobicContact CG-CG 4.47Å; L71-L75 WeakPolarHBondContact O-CB 3.42Å; L71-L75 VanDerWaalsContact O-CG 3.31Å; L71-L75 WeakPolarHBondContact O-CG 3.4Å; L71-L75 PolarHBondContact O-N 3.08Å; F72-L75 PolarHBondContact O-N 3.09Å; F72-L75 VanDerWaalsContact O-N 3.08Å; L75-V77 PolarHBondContact O-N 2.85Å; L75-V77 VanDerWaalsContact O-N 3.11Å; L75-I83 HydrophobicContact CB-CD1 3.78Å; L75-I83 HydrophobicContact CB-CG1 4.4Å; L75-I83 HydrophobicContact CB-CG2 4.39Å; L75-I83 HydrophobicContact CD1-CD1 4.41Å; L75-D87 CarbonylContact O-C 3.11Å; L75-D87 WeakPolarHBondContact O-CB 3.25Å; L75-L88 HydrophobicContact CD1-CD2 4.22Å; L75-L92 HydrophobicContact CD2-CD2 4.11Å; L75-L92 HydrophobicContact CD2-CG 4.21Å; L75-L95 HydrophobicContact CD2-CD1 4.04Å; L75-F124 HydrophobicContact CD1-CE2 3.8Å; L75-F124 HydrophobicContact CD1-CZ 3.7Å
76	D	88.2	Confident	84.3	Confident	20 Å²	20	49.3 Å²	49.3	11%	0.107	28%	0.275	C	S	.	.			trans	-74	85.7	170.5	179	4.7	0	0	0	109.8	F72 N78 G79 D80 G81 I83	F72-D76 HydrophobicContact CE1-CB 4.35Å; F72-D76 WeakPolarHBondContact O-CB 3.27Å; F72-D76 PolarHBondContact O-N 2.71Å; D76-N78 PolarHBondContact OD1-OD1 3.11Å; D76-G79 WeakPolarHBondContact OD1-CA 3.04Å; D76-G79 PolarHBondContact OD1-N 2.79Å; D76-G79 WeakPolarHBondContact OD2-CA 3.18Å; D76-D80 PolarHBondContact OD1-N 3.37Å; D76-G81 WeakPolarHBondContact OD2-CA 3.45Å; D76-G81 PolarHBondContact OD2-N 3.26Å; D76-I83 HydrophobicContact CB-CG1 4.32Å
77	V	87.8	Confident	85	Confident	54 Å²	54	43.9 Å²	43.9	33%	0.327	25%	0.25	S	S	.	.	S	Bend	trans	-77.9	-31.6	-171	179.4	0	0	0	0	112.4	L75 I90	L75-V77 PolarHBondContact O-N 2.85Å; L75-V77 VanDerWaalsContact O-N 3.11Å; V77-I90 HydrophobicContact CG1-CG2 4.07Å; V77-I90 HydrophobicContact CG2-CB 4.09Å; V77-I90 HydrophobicContact CG2-CG2 3.99Å
78	N	86.1	Confident	85.5	Confident	86 Å²	86	41 Å²	41	46%	0.46	24%	0.24	S	C	.	.	S	Bend	trans	-87.2	-15	178.8	57.8	3.5	0	0	0	112.6	D76 D80 D87	D76-N78 PolarHBondContact OD1-OD1 3.11Å; N78-D80 VanDerWaalsContact C-N 3.33Å; N78-D80 PolarHBondContact ND2-OD2 2.93Å; N78-D80 VanDerWaalsContact OD1-CG 3.31Å; N78-D80 PolarHBondContact OD1-N 3.42Å; N78-D80 PolarHBondContact OD1-OD1 2.96Å; N78-D87 PolarHBondContact ND2-OD2 2.94Å; N78-D87 VanDerWaalsContact ND2-OD2 3.14Å
79	G	86.4	Confident	85.6	Confident	58 Å²	58	42.1 Å²	42.1	60%	0.598	25%	0.248	S	C	*	.			trans	71.9	26.7	175	0	0	0	0	0	113	D76 G81	D76-G79 WeakPolarHBondContact OD1-CA 3.04Å; D76-G79 PolarHBondContact OD1-N 2.79Å; D76-G79 WeakPolarHBondContact OD2-CA 3.18Å; G79-G81 VanDerWaalsContact C-N 3.32Å
80	D	86.7	Confident	85.5	Confident	90 Å²	90	40.8 Å²	40.8	48%	0.481	25%	0.245	S	C	.	.	S	Bend	trans	-89.3	-0.5	-177.9	67.1	12.3	0	0	0	113.2	D76 N78 G82	D76-D80 PolarHBondContact OD1-N 3.37Å; N78-D80 VanDerWaalsContact C-N 3.33Å; N78-D80 PolarHBondContact ND2-OD2 2.93Å; N78-D80 VanDerWaalsContact OD1-CG 3.31Å; N78-D80 PolarHBondContact OD1-N 3.42Å; N78-D80 PolarHBondContact OD1-OD1 2.96Å; D80-G82 VanDerWaalsContact C-N 3.34Å; D80-G82 PolarHBondContact OD1-N 3.25Å
81	G	85.8	Confident	85.6	Confident	41 Å²	41	38.8 Å²	38.8	42%	0.423	23%	0.233	S	C	.	.	S	Bend	trans	83.7	8.6	179.1	0	0	0	0	0	113.8	F72 D76 G79	F72-G81 WeakPolarHBondContact CZ-O 3.4Å; D76-G81 WeakPolarHBondContact OD2-CA 3.45Å; D76-G81 PolarHBondContact OD2-N 3.26Å; G79-G81 VanDerWaalsContact C-N 3.32Å
82	G	89.1	Confident	85.4	Confident	6 Å²	6	38.9 Å²	38.9	6%	0.062	23%	0.233	C	C	.	.			trans	-133.2	142.2	174.5	0	0	0	0	0	111.8	D80 L119	D80-G82 VanDerWaalsContact C-N 3.34Å; D80-G82 PolarHBondContact OD1-N 3.25Å; G82-L119 WeakPolarHBondContact CA-O 3.3Å
83	I	89.3	Confident	84.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.253	C	S	.	.			trans	-98.4	105.8	176	-55.9	173.7	0	0	0	109.4	F72 L75 D76 D87 L88 L119 F124	F72-I83 HydrophobicContact CD2-CD1 3.29Å; F72-I83 HydrophobicContact CD2-CG1 3.87Å; F72-I83 HydrophobicContact CE2-CD1 3.51Å; F72-I83 HydrophobicContact CE2-CG1 3.57Å; F72-I83 HydrophobicContact CG-CD1 4.02Å; F72-I83 HydrophobicContact CZ-CD1 4.37Å; F72-I83 HydrophobicContact CZ-CG1 4.03Å; L75-I83 HydrophobicContact CB-CD1 3.78Å; L75-I83 HydrophobicContact CB-CG1 4.4Å; L75-I83 HydrophobicContact CB-CG2 4.39Å; L75-I83 HydrophobicContact CD1-CD1 4.41Å; D76-I83 HydrophobicContact CB-CG1 4.32Å; I83-D87 HydrophobicContact CG2-CB 4.18Å; I83-L88 HydrophobicContact CG2-CD1 4.47Å; I83-L88 HydrophobicContact CG2-CD2 3.54Å; I83-L88 HydrophobicContact CG2-CG 3.51Å; I83-L119 HydrophobicContact CB-CB 4.28Å; I83-L119 PolarHBondContact N-O 3Å; I83-L119 PolarHBondContact O-N 3.41Å; I83-L119 VanDerWaalsContact O-N 3.07Å; I83-F124 HydrophobicContact CD1-CD2 3.68Å; I83-F124 HydrophobicContact CD1-CE2 3.85Å; I83-F124 HydrophobicContact CD1-CG 4.05Å; I83-F124 HydrophobicContact CD1-CZ 4.33Å
84	C	89.1	Confident	84.3	Confident	26 Å²	26	44 Å²	44	18%	0.176	25%	0.254	C	S	.	.			trans	-91.1	175.9	173	86.4	0	0	0	0	112.9	N86 D87 L88 Q118	C84-N86 PolarHBondContact O-N 3.22Å; C84-N86 PolarHBondContact SG-N 2.99Å; C84-N86 VanDerWaalsContact SG-N 3.44Å; C84-D87 PolarHBondContact N-OD2 3.29Å; C84-D87 PolarHBondContact O-N 2.66Å; C84-D87 VanDerWaalsContact O-N 3.15Å; C84-D87 PolarHBondContact SG-OD2 3.26Å; C84-L88 PolarHBondContact O-N 3.39Å; C84-Q118 HydrophobicContact CB-CG 4.08Å
85	V	86.7	Confident	83.6	Confident	19 Å²	19	41.7 Å²	41.7	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-57.8	-35.9	179.3	176.9	0	0	0	0	112.3	S89 E101 L104 R105 V108	V85-S89 WeakPolarHBondContact O-CB 3.25Å; V85-S89 PolarHBondContact O-N 2.83Å; V85-E101 HydrophobicContact CG1-CG 4.18Å; V85-L104 HydrophobicContact CG1-CB 3.9Å; V85-R105 HydrophobicContact CB-CG 4.48Å; V85-R105 HydrophobicContact CG1-CG 3.91Å; V85-R105 HydrophobicContact CG2-CB 4.44Å; V85-R105 HydrophobicContact CG2-CG 3.73Å; V85-V108 HydrophobicContact CG2-CB 4.3Å; V85-V108 HydrophobicContact CG2-CG2 3.91Å
86	N	86.3	Confident	82.5	Confident	109 Å²	109	43.7 Å²	43.7	58%	0.583	26%	0.263	S	S	*	.	H	α-helix	trans	-71	-42.2	178	-72.9	-12.2	0	0	0	111.3	C84 S89 I90	C84-N86 PolarHBondContact O-N 3.22Å; C84-N86 PolarHBondContact SG-N 2.99Å; C84-N86 VanDerWaalsContact SG-N 3.44Å; N86-S89 WeakPolarHBondContact O-CB 3.14Å; N86-S89 PolarHBondContact O-N 3.37Å; N86-S89 VanDerWaalsContact O-N 3.13Å; N86-I90 WeakPolarHBondContact O-CG1 3.34Å; N86-I90 PolarHBondContact O-N 2.96Å
87	D	86.6	Confident	81.4	Confident	8 Å²	8	44 Å²	44	4%	0.043	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-46.9	177.6	-65.8	-46.8	0	0	0	110.6	L75 N78 I83 C84 S89 I90 G91	L75-D87 CarbonylContact O-C 3.11Å; L75-D87 WeakPolarHBondContact O-CB 3.25Å; N78-D87 PolarHBondContact ND2-OD2 2.94Å; N78-D87 VanDerWaalsContact ND2-OD2 3.14Å; I83-D87 HydrophobicContact CG2-CB 4.18Å; C84-D87 PolarHBondContact N-OD2 3.29Å; C84-D87 PolarHBondContact O-N 2.66Å; C84-D87 VanDerWaalsContact O-N 3.15Å; C84-D87 PolarHBondContact SG-OD2 3.26Å; D87-S89 VanDerWaalsContact C-N 3.32Å; D87-S89 PolarHBondContact O-N 3.04Å; D87-I90 PolarHBondContact O-N 3.46Å; D87-G91 PolarHBondContact O-N 3.37Å
88	L	84.1	Confident	80.3	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-40.4	171.2	-73.2	178.4	0	0	0	112.9	L75 I83 C84 I90 L92 L104 M107 V108	L75-L88 HydrophobicContact CD1-CD2 4.22Å; I83-L88 HydrophobicContact CG2-CD1 4.47Å; I83-L88 HydrophobicContact CG2-CD2 3.54Å; I83-L88 HydrophobicContact CG2-CG 3.51Å; C84-L88 PolarHBondContact O-N 3.39Å; L88-I90 VanDerWaalsContact C-N 3.3Å; L88-I90 PolarHBondContact O-N 3.34Å; L88-L92 HydrophobicContact CB-CD1 4.35Å; L88-L92 HydrophobicContact CD2-CD1 4.41Å; L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 VanDerWaalsContact O-CG 3.28Å; L88-L92 WeakPolarHBondContact O-CG 3.2Å; L88-L92 PolarHBondContact O-N 3.07Å; L88-L104 HydrophobicContact CB-CD2 3.93Å; L88-M107 HydrophobicContact CD1-CB 4.15Å; L88-V108 HydrophobicContact CD1-CG2 3.58Å
89	S	82.7	Confident	79.3	Confident	30 Å²	30	46.5 Å²	46.5	21%	0.21	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-40.4	-179.5	-164.9	0	0	0	0	111.8	V85 N86 D87 K93 L104	V85-S89 WeakPolarHBondContact O-CB 3.25Å; V85-S89 PolarHBondContact O-N 2.83Å; N86-S89 WeakPolarHBondContact O-CB 3.14Å; N86-S89 PolarHBondContact O-N 3.37Å; N86-S89 VanDerWaalsContact O-N 3.13Å; D87-S89 VanDerWaalsContact C-N 3.32Å; D87-S89 PolarHBondContact O-N 3.04Å; S89-K93 WeakPolarHBondContact O-CB 3.29Å; S89-K93 VanDerWaalsContact O-CD 3.24Å; S89-K93 WeakPolarHBondContact O-CD 3.43Å; S89-K93 WeakPolarHBondContact O-CG 3.31Å; S89-K93 PolarHBondContact O-N 3.3Å; S89-L104 VanDerWaalsContact CA-CD1 3.43Å; S89-L104 VanDerWaalsContact CB-CD1 3.47Å
90	I	81.3	Confident	78.6	Confident	78 Å²	78	45.4 Å²	45.4	40%	0.4	25%	0.25	S	S	.	.	H	α-helix	trans	-80.4	-47.1	-178.8	-62.3	166.1	0	0	0	110.2	V77 N86 D87 L88 K93 K94	V77-I90 HydrophobicContact CG1-CG2 4.07Å; V77-I90 HydrophobicContact CG2-CB 4.09Å; V77-I90 HydrophobicContact CG2-CG2 3.99Å; N86-I90 WeakPolarHBondContact O-CG1 3.34Å; N86-I90 PolarHBondContact O-N 2.96Å; D87-I90 PolarHBondContact O-N 3.46Å; L88-I90 VanDerWaalsContact C-N 3.3Å; L88-I90 PolarHBondContact O-N 3.34Å; I90-K93 PolarHBondContact O-N 3.25Å; I90-K94 HydrophobicContact CG2-CD 4.47Å; I90-K94 WeakPolarHBondContact O-CG 3.47Å; I90-K94 PolarHBondContact O-N 2.85Å
91	G	81.2	Confident	77.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-48.2	-179.4	0	0	0	0	0	112.5	D87 K93 K94 L95	D87-G91 PolarHBondContact O-N 3.37Å; G91-K93 PolarHBondContact O-N 3.44Å; G91-K94 WeakPolarHBondContact O-CB 3.2Å; G91-K94 PolarHBondContact O-N 3.46Å; G91-L95 WeakPolarHBondContact O-CG 3.44Å; G91-L95 PolarHBondContact O-N 2.83Å; G91-L95 VanDerWaalsContact O-N 3.11Å
92	L	78.6	Confident	77	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-67.5	-37.3	178.7	-67.8	173.1	0	0	0	112.1	L75 L88 K94 L95 G96 V97 R99 L104 L197	L75-L92 HydrophobicContact CD2-CD2 4.11Å; L75-L92 HydrophobicContact CD2-CG 4.21Å; L88-L92 HydrophobicContact CB-CD1 4.35Å; L88-L92 HydrophobicContact CD2-CD1 4.41Å; L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 VanDerWaalsContact O-CG 3.28Å; L88-L92 WeakPolarHBondContact O-CG 3.2Å; L88-L92 PolarHBondContact O-N 3.07Å; L92-K94 VanDerWaalsContact C-N 3.32Å; L92-K94 PolarHBondContact O-N 3.38Å; L92-L95 CarbonylContact O-C 3.27Å; L92-L95 WeakPolarHBondContact O-CA 3.21Å; L92-L95 PolarHBondContact O-N 3.03Å; L92-L95 VanDerWaalsContact O-N 3.08Å; L92-G96 PolarHBondContact O-N 2.72Å; L92-V97 CarbonylContact C-O 3.53Å; L92-V97 HydrophobicContact CB-CB 4.15Å; L92-V97 HydrophobicContact CB-CG1 4.47Å; L92-V97 HydrophobicContact CD2-CB 4.41Å; L92-V97 HydrophobicContact CD2-CG1 4.49Å; L92-V97 CarbonylContact O-C 3.58Å; L92-V97 WeakPolarHBondContact O-CA 3.46Å; L92-V97 PolarHBondContact O-N 2.96Å; L92-V97 VanDerWaalsContact O-O 3.06Å; L92-R99 HydrophobicContact CD1-CG 4.05Å; L92-L104 HydrophobicContact CD1-CD2 3.61Å; L92-L197 HydrophobicContact CD2-CB 4.23Å; L92-L197 HydrophobicContact CD2-CD1 4.08Å; L92-L197 HydrophobicContact CD2-CD2 4.31Å; L92-L197 HydrophobicContact CD2-CG 4.45Å
93	K	74.9	Confident	76	Confident	109 Å²	109	50.9 Å²	50.9	47%	0.474	26%	0.26	S	S	.	.	H	α-helix	trans	-60.8	-39.9	172.6	-79.7	174.5	-171.8	162.2	0	112.1	S89 I90 G91 L95 G96 V97	S89-K93 WeakPolarHBondContact O-CB 3.29Å; S89-K93 VanDerWaalsContact O-CD 3.24Å; S89-K93 WeakPolarHBondContact O-CD 3.43Å; S89-K93 WeakPolarHBondContact O-CG 3.31Å; S89-K93 PolarHBondContact O-N 3.3Å; I90-K93 PolarHBondContact O-N 3.25Å; G91-K93 PolarHBondContact O-N 3.44Å; K93-L95 PolarHBondContact O-N 2.89Å; K93-G96 PolarHBondContact O-N 3.38Å; K93-V97 PolarHBondContact N-O 3.39Å
94	K	74	Confident	75.6	Confident	129 Å²	129	50.9 Å²	50.9	56%	0.561	26%	0.26	S	S	*	.	H	α-helix	trans	-63.7	-31.8	174.5	-74.5	175.9	179.9	174.3	0	112.3	I90 G91 L92 G96	I90-K94 HydrophobicContact CG2-CD 4.47Å; I90-K94 WeakPolarHBondContact O-CG 3.47Å; I90-K94 PolarHBondContact O-N 2.85Å; G91-K94 WeakPolarHBondContact O-CB 3.2Å; G91-K94 PolarHBondContact O-N 3.46Å; L92-K94 VanDerWaalsContact C-N 3.32Å; L92-K94 PolarHBondContact O-N 3.38Å; K94-G96 PolarHBondContact O-N 3.37Å
95	L	66.8	Low	75.1	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.037	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	4.5	174.2	-63.3	173.8	0	0	0	113.3	V10 L13 L71 I74 L75 G91 L92 K93 V97 L197	V10-L95 HydrophobicContact CG2-CB 4.2Å; V10-L95 HydrophobicContact CG2-CD2 4.27Å; L13-L95 HydrophobicContact CD1-CD2 4.43Å; L71-L95 HydrophobicContact CD1-CD1 4.09Å; I74-L95 HydrophobicContact CG2-CD1 4.49Å; I74-L95 HydrophobicContact CG2-CD2 4.29Å; L75-L95 HydrophobicContact CD2-CD1 4.04Å; G91-L95 WeakPolarHBondContact O-CG 3.44Å; G91-L95 PolarHBondContact O-N 2.83Å; G91-L95 VanDerWaalsContact O-N 3.11Å; L92-L95 CarbonylContact O-C 3.27Å; L92-L95 WeakPolarHBondContact O-CA 3.21Å; L92-L95 PolarHBondContact O-N 3.03Å; L92-L95 VanDerWaalsContact O-N 3.08Å; K93-L95 PolarHBondContact O-N 2.89Å; L95-V97 VanDerWaalsContact C-N 3.26Å; L95-V97 PolarHBondContact O-N 2.9Å; L95-L197 HydrophobicContact CD1-CD1 4.05Å
96	G	61.3	Low	74.7	Confident	42 Å²	42	59.2 Å²	59.2	43%	0.433	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	11.8	-178.9	0	0	0	0	0	114.1	L92 K93 K94	L92-G96 PolarHBondContact O-N 2.72Å; K93-G96 PolarHBondContact O-N 3.38Å; K94-G96 PolarHBondContact O-N 3.37Å
97	V	65.5	Low	74.3	Confident	28 Å²	28	54.6 Å²	54.6	17%	0.17	26%	0.261	C	S	.	.			trans	-101	107.3	-180	-177.7	0	0	0	0	108.9	L92 K93 L95 R99	L92-V97 CarbonylContact C-O 3.53Å; L92-V97 HydrophobicContact CB-CB 4.15Å; L92-V97 HydrophobicContact CB-CG1 4.47Å; L92-V97 HydrophobicContact CD2-CB 4.41Å; L92-V97 HydrophobicContact CD2-CG1 4.49Å; L92-V97 CarbonylContact O-C 3.58Å; L92-V97 WeakPolarHBondContact O-CA 3.46Å; L92-V97 PolarHBondContact O-N 2.96Å; L92-V97 VanDerWaalsContact O-O 3.06Å; K93-V97 PolarHBondContact N-O 3.39Å; L95-V97 VanDerWaalsContact C-N 3.26Å; L95-V97 PolarHBondContact O-N 2.9Å; V97-R99 HydrophobicContact CG1-CG 4.09Å; V97-R99 VanDerWaalsContact CG1-NH2 3.32Å
98	H	63	Low	74.2	Confident	145 Å²	145	54.4 Å²	54.4	67%	0.671	26%	0.26	S	S	*	.			trans	-88.1	125.1	177.6	-69.2	-83.8	0	0	0	110.7
99	R	66.8	Low	74.2	Confident	47 Å²	47	59 Å²	59	18%	0.177	29%	0.288	C	S	.	.			trans	-132.2	153.7	179.4	-61.8	-62.5	177.1	-147.6	-7.8	111.8	L92 V97 L104 L197 H198	L92-R99 HydrophobicContact CD1-CG 4.05Å; V97-R99 HydrophobicContact CG1-CG 4.09Å; V97-R99 VanDerWaalsContact CG1-NH2 3.32Å; R99-L104 HydrophobicContact CB-CD1 4.46Å; R99-L104 HydrophobicContact CB-CD2 3.56Å; R99-L104 HydrophobicContact CB-CG 3.93Å; R99-L104 HydrophobicContact CG-CD2 4.01Å; R99-L197 PolarHBondContact NE-O 3.33Å; R99-L197 PolarHBondContact NH2-O 3.37Å; R99-H198 PolarHBondContact NH1-CD2 3.04Å; R99-H198 PolarHBondContact NH1-NE2 3.43Å; R99-H198 PolarHBondContact NH2-CD2 3.44Å
100	T	70.4	Confident	74	Confident	35 Å²	35	61.1 Å²	61.1	22%	0.215	31%	0.308	C	S	.	.			trans	-86.6	149.3	175.1	66	0	0	0	0	109.9	H102 E103 L104 R521	T100-H102 PolarHBondContact O-N 2.96Å; T100-H102 VanDerWaalsContact O-N 3.07Å; T100-E103 WeakPolarHBondContact CB-OE2 3.32Å; T100-E103 PolarHBondContact N-OE2 3.2Å; T100-E103 PolarHBondContact O-N 2.88Å; T100-E103 WeakPolarHBondContact OG1-CG 3.03Å; T100-E103 PolarHBondContact OG1-OE2 3.38Å; T100-L104 WeakPolarHBondContact O-CG 3.37Å; T100-L104 PolarHBondContact O-N 3.09Å; T100-R521 VanDerWaalsContact CB-NH2 3.33Å; T100-R521 PolarHBondContact OG1-NH2 3.44Å
101	E	71.3	Confident	74	Confident	112 Å²	112	57.6 Å²	57.6	52%	0.523	29%	0.29	S	S	.	.	H	α-helix	trans	-55.8	-31.8	-177.6	-165.1	-174.3	149.7	0	0	112.7	V85 R105	V85-E101 HydrophobicContact CG1-CG 4.18Å; E101-R105 WeakPolarHBondContact O-CB 3.41Å; E101-R105 VanDerWaalsContact O-CG 3.26Å; E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.17Å; E101-R105 IonicContact OE1-CZ 2.81Å; E101-R105 VanDerWaalsContact OE1-CZ 3.31Å; E101-R105 IonicContact OE1-NE 3.51Å; E101-R105 PolarHBondContact OE1-NE 3.08Å; E101-R105 VanDerWaalsContact OE1-NE 3.09Å; E101-R105 IonicContact OE1-NH2 3.04Å; E101-R105 PolarHBondContact OE1-NH2 2.88Å
102	H	67.8	Low	74.3	Confident	100 Å²	100	58.4 Å²	58.4	46%	0.463	30%	0.295	S	S	.	.	H	α-helix	trans	-65.5	-43.6	176.1	-173.5	63.5	0	0	0	113	T100 L104 R105 R106	T100-H102 PolarHBondContact O-N 2.96Å; T100-H102 VanDerWaalsContact O-N 3.07Å; H102-L104 VanDerWaalsContact C-N 3.34Å; H102-R105 PolarHBondContact O-N 3.17Å; H102-R106 WeakPolarHBondContact O-CG 3.39Å; H102-R106 PolarHBondContact O-N 2.95Å
103	E	68.7	Low	74.7	Confident	40 Å²	40	65.3 Å²	65.3	19%	0.187	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-41.8	178	-68.9	159.7	149.1	0	0	111	T100 R105 R106 M107 P199	T100-E103 WeakPolarHBondContact CB-OE2 3.32Å; T100-E103 PolarHBondContact N-OE2 3.2Å; T100-E103 PolarHBondContact O-N 2.88Å; T100-E103 WeakPolarHBondContact OG1-CG 3.03Å; T100-E103 PolarHBondContact OG1-OE2 3.38Å; E103-R105 VanDerWaalsContact C-N 3.35Å; E103-R105 PolarHBondContact O-N 3.29Å; E103-R106 WeakPolarHBondContact O-CB 3.31Å; E103-R106 PolarHBondContact O-N 3.27Å; E103-M107 WeakPolarHBondContact O-CG 3.48Å; E103-M107 PolarHBondContact O-N 3.16Å; E103-P199 HydrophobicContact CB-CG 4.5Å; E103-P199 HydrophobicContact CG-CG 4.43Å
104	L	79.9	Confident	75.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-43.2	176.4	-59.4	-179.7	0	0	0	111.6	V85 L88 S89 L92 R99 T100 H102 R106 M107 V108	V85-L104 HydrophobicContact CG1-CB 3.9Å; L88-L104 HydrophobicContact CB-CD2 3.93Å; S89-L104 VanDerWaalsContact CA-CD1 3.43Å; S89-L104 VanDerWaalsContact CB-CD1 3.47Å; L92-L104 HydrophobicContact CD1-CD2 3.61Å; R99-L104 HydrophobicContact CB-CD1 4.46Å; R99-L104 HydrophobicContact CB-CD2 3.56Å; R99-L104 HydrophobicContact CB-CG 3.93Å; R99-L104 HydrophobicContact CG-CD2 4.01Å; T100-L104 WeakPolarHBondContact O-CG 3.37Å; T100-L104 PolarHBondContact O-N 3.09Å; H102-L104 VanDerWaalsContact C-N 3.34Å; L104-R106 VanDerWaalsContact C-N 3.32Å; L104-R106 PolarHBondContact O-N 2.9Å; L104-M107 HydrophobicContact CD2-SD 4.47Å; L104-M107 PolarHBondContact O-N 3.45Å; L104-V108 PolarHBondContact O-N 3.29Å; L104-V108 VanDerWaalsContact O-N 3.1Å
105	R	80	Confident	75.7	Confident	125 Å²	125	65.3 Å²	65.3	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-60	-40.8	173.7	-76.2	172.8	-175.5	-74.1	-0.1	112	V85 E101 H102 E103 T109	V85-R105 HydrophobicContact CB-CG 4.48Å; V85-R105 HydrophobicContact CG1-CG 3.91Å; V85-R105 HydrophobicContact CG2-CB 4.44Å; V85-R105 HydrophobicContact CG2-CG 3.73Å; E101-R105 WeakPolarHBondContact O-CB 3.41Å; E101-R105 VanDerWaalsContact O-CG 3.26Å; E101-R105 WeakPolarHBondContact O-CG 3.35Å; E101-R105 PolarHBondContact O-N 3.17Å; E101-R105 IonicContact OE1-CZ 2.81Å; E101-R105 VanDerWaalsContact OE1-CZ 3.31Å; E101-R105 IonicContact OE1-NE 3.51Å; E101-R105 PolarHBondContact OE1-NE 3.08Å; E101-R105 VanDerWaalsContact OE1-NE 3.09Å; E101-R105 IonicContact OE1-NH2 3.04Å; E101-R105 PolarHBondContact OE1-NH2 2.88Å; H102-R105 PolarHBondContact O-N 3.17Å; E103-R105 VanDerWaalsContact C-N 3.35Å; E103-R105 PolarHBondContact O-N 3.29Å; R105-T109 WeakPolarHBondContact O-CB 3.33Å; R105-T109 PolarHBondContact O-N 3.48Å; R105-T109 PolarHBondContact O-OG1 3.12Å
106	R	77.2	Confident	76.5	Confident	94 Å²	94	69.2 Å²	69.2	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-41.7	175.9	-71.2	-165.5	-59.9	-148.8	3.9	112.3	H102 E103 L104 T109 A110 E231	H102-R106 WeakPolarHBondContact O-CG 3.39Å; H102-R106 PolarHBondContact O-N 2.95Å; E103-R106 WeakPolarHBondContact O-CB 3.31Å; E103-R106 PolarHBondContact O-N 3.27Å; L104-R106 VanDerWaalsContact C-N 3.32Å; L104-R106 PolarHBondContact O-N 2.9Å; R106-T109 PolarHBondContact O-N 3.35Å; R106-A110 WeakPolarHBondContact O-CB 3.23Å; R106-A110 PolarHBondContact O-N 3.22Å; R106-E231 IonicContact CZ-OE1 2.73Å; R106-E231 IonicContact NH1-OE1 2.84Å; R106-E231 PolarHBondContact NH1-OE1 2.9Å; R106-E231 IonicContact NH2-OE1 3.13Å
107	M	78.7	Confident	77.6	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.059	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-49.1	178.1	-67.8	176.9	63.9	0	0	111.4	L88 E103 L104 A110 G111 Y127	L88-M107 HydrophobicContact CD1-CB 4.15Å; E103-M107 WeakPolarHBondContact O-CG 3.48Å; E103-M107 PolarHBondContact O-N 3.16Å; L104-M107 HydrophobicContact CD2-SD 4.47Å; L104-M107 PolarHBondContact O-N 3.45Å; M107-A110 PolarHBondContact O-N 3.19Å; M107-G111 PolarHBondContact O-N 3Å; M107-Y127 HydrophobicContact CE-CE1 4.22Å
108	V	84.4	Confident	78.8	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.024	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-53.4	176.7	178.1	0	0	0	0	110.2	V85 L88 L104 A110 G111 D112 L119	V85-V108 HydrophobicContact CG2-CB 4.3Å; V85-V108 HydrophobicContact CG2-CG2 3.91Å; L88-V108 HydrophobicContact CD1-CG2 3.58Å; L104-V108 PolarHBondContact O-N 3.29Å; L104-V108 VanDerWaalsContact O-N 3.1Å; V108-A110 PolarHBondContact O-N 3.37Å; V108-A110 VanDerWaalsContact O-N 3.1Å; V108-G111 PolarHBondContact O-N 3.14Å; V108-D112 WeakPolarHBondContact O-CB 3.24Å; V108-D112 PolarHBondContact O-N 3.31Å; V108-L119 HydrophobicContact CG1-CG 4.32Å; V108-L119 WeakPolarHBondContact O-CD2 3.39Å
109	T	83.9	Confident	80	Confident	99 Å²	99	63.7 Å²	63.7	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-61	-27.7	-177.8	-47.9	0	0	0	0	113.3	R105 R106	R105-T109 WeakPolarHBondContact O-CB 3.33Å; R105-T109 PolarHBondContact O-N 3.48Å; R105-T109 PolarHBondContact O-OG1 3.12Å; R106-T109 PolarHBondContact O-N 3.35Å
110	A	79	Confident	81.1	Confident	75 Å²	75	64.3 Å²	64.3	62%	0.62	34%	0.335	S	S	*	.	H	α-helix	trans	-81.1	-25.5	179.6	0	0	0	0	0	113.4	R106 M107 V108 Y127	R106-A110 WeakPolarHBondContact O-CB 3.23Å; R106-A110 PolarHBondContact O-N 3.22Å; M107-A110 PolarHBondContact O-N 3.19Å; V108-A110 PolarHBondContact O-N 3.37Å; V108-A110 VanDerWaalsContact O-N 3.1Å; A110-Y127 HydrophobicContact CB-CD2 4.21Å; A110-Y127 HydrophobicContact CB-CE2 3.9Å
111	G	81.4	Confident	82	Confident	4 Å²	4	65.4 Å²	65.4	4%	0.041	34%	0.337	C	S	.	.	H	α-helix	trans	-95.5	-28.8	177.8	0	0	0	0	0	113.8	M107 V108 K113	M107-G111 PolarHBondContact O-N 3Å; V108-G111 PolarHBondContact O-N 3.14Å; G111-K113 PolarHBondContact O-N 3.12Å
112	D	86.4	Confident	82.8	Confident	17 Å²	17	67.6 Å²	67.6	9%	0.091	35%	0.347	C	S	.	.			trans	-70.7	103.7	-177.7	177.9	2.1	0	0	0	109.9	V108 L115 D116 G117 Q118 L119	V108-D112 WeakPolarHBondContact O-CB 3.24Å; V108-D112 PolarHBondContact O-N 3.31Å; D112-L115 WeakPolarHBondContact OD1-CA 3.08Å; D112-L115 PolarHBondContact OD1-N 2.87Å; D112-L115 WeakPolarHBondContact OD2-CA 3.31Å; D112-D116 PolarHBondContact OD1-N 3.42Å; D112-G117 VanDerWaalsContact OD2-CA 3.29Å; D112-G117 WeakPolarHBondContact OD2-CA 3.33Å; D112-G117 PolarHBondContact OD2-N 2.82Å; D112-Q118 WeakPolarHBondContact CB-O 3.47Å; D112-L119 HydrophobicContact CB-CD2 4.09Å
113	K	86.9	Confident	83.8	Confident	148 Å²	148	63.5 Å²	63.5	64%	0.643	33%	0.328	S	S	*	.	S	Bend	trans	-93.8	-31.3	-176.1	-70.5	-171.8	177.7	-176.4	0	112	G111 E123	G111-K113 PolarHBondContact O-N 3.12Å; K113-E123 WeakPolarHBondContact CA-OE1 3.45Å; K113-E123 WeakPolarHBondContact CB-OE1 3.4Å; K113-E123 PolarHBondContact N-OE1 3.46Å
114	D	84.3	Confident	84.7	Confident	99 Å²	99	61.9 Å²	61.9	53%	0.529	32%	0.321	S	S	.	.	S	Bend	trans	-90.8	-5.6	-179.8	73.3	6.2	0	0	0	113.6	D116 E123	D114-D116 VanDerWaalsContact C-N 3.35Å; D114-D116 WeakPolarHBondContact OD1-CB 3.5Å; D114-D116 PolarHBondContact OD1-N 3.21Å; D114-E123 PolarHBondContact N-OE1 3.2Å
115	L	86.1	Confident	85	Confident	139 Å²	139	62.4 Å²	62.4	73%	0.728	32%	0.324	S	S	*	.			trans	65.9	32.2	175.1	-55.2	173.2	0	0	0	113.3	D112 G117	D112-L115 WeakPolarHBondContact OD1-CA 3.08Å; D112-L115 PolarHBondContact OD1-N 2.87Å; D112-L115 WeakPolarHBondContact OD2-CA 3.31Å; L115-G117 VanDerWaalsContact C-N 3.27Å
116	D	83.9	Confident	85.2	Confident	88 Å²	88	59.1 Å²	59.1	47%	0.471	31%	0.314	S	S	.	.	S	Bend	trans	-81.4	-7.6	178	85.6	-11.2	0	0	0	113.4	D112 D114 Q118	D112-D116 PolarHBondContact OD1-N 3.42Å; D114-D116 VanDerWaalsContact C-N 3.35Å; D114-D116 WeakPolarHBondContact OD1-CB 3.5Å; D114-D116 PolarHBondContact OD1-N 3.21Å; D116-Q118 WeakPolarHBondContact OD1-CA 3.38Å; D116-Q118 WeakPolarHBondContact OD1-CB 3.25Å; D116-Q118 PolarHBondContact OD1-N 2.91Å
117	G	83.9	Confident	85.6	Confident	40 Å²	40	56.4 Å²	56.4	41%	0.412	30%	0.304	S	S	.	.	S	Bend	trans	85.9	9.7	178.7	0	0	0	0	0	114.4	D112 L115	D112-G117 VanDerWaalsContact OD2-CA 3.29Å; D112-G117 WeakPolarHBondContact OD2-CA 3.33Å; D112-G117 PolarHBondContact OD2-N 2.82Å; L115-G117 VanDerWaalsContact C-N 3.27Å
118	Q	90.4	Very high	85.8	Confident	56 Å²	56	56 Å²	56	26%	0.262	30%	0.302	S	S	.	.	S	Bend	trans	-132.3	174.5	179	-54.1	-169.8	76.7	0	0	109.8	C84 D112 D116	C84-Q118 HydrophobicContact CB-CG 4.08Å; D112-Q118 WeakPolarHBondContact CB-O 3.47Å; D116-Q118 WeakPolarHBondContact OD1-CA 3.38Å; D116-Q118 WeakPolarHBondContact OD1-CB 3.25Å; D116-Q118 PolarHBondContact OD1-N 2.91Å
119	L	88.8	Confident	85.6	Confident	3 Å²	3	61 Å²	61	2%	0.016	32%	0.32	C	S	.	.			trans	-118.2	113.1	171.2	-63.9	177	0	0	0	108.3	F72 G82 I83 V108 D112 E123 F124	F72-L119 WeakPolarHBondContact CE2-O 3.43Å; G82-L119 WeakPolarHBondContact CA-O 3.3Å; I83-L119 HydrophobicContact CB-CB 4.28Å; I83-L119 PolarHBondContact N-O 3Å; I83-L119 PolarHBondContact O-N 3.41Å; I83-L119 VanDerWaalsContact O-N 3.07Å; V108-L119 HydrophobicContact CG1-CG 4.32Å; V108-L119 WeakPolarHBondContact O-CD2 3.39Å; D112-L119 HydrophobicContact CB-CD2 4.09Å; L119-E123 HydrophobicContact CD2-CB 4.3Å; L119-F124 HydrophobicContact CB-CB 4.37Å; L119-F124 HydrophobicContact CD1-CD2 4.38Å
120	D	90.6	Very high	85.3	Confident	61 Å²	61	59.1 Å²	59.1	33%	0.326	31%	0.307	S	S	.	.			trans	-69.5	171.3	167.8	80.8	24.5	0	0	0	110.9	Q122 E123 F124	D120-Q122 VanDerWaalsContact C-N 3.25Å; D120-Q122 PolarHBondContact O-N 3.42Å; D120-Q122 WeakPolarHBondContact OD1-CA 3.49Å; D120-Q122 WeakPolarHBondContact OD1-CB 3.47Å; D120-Q122 PolarHBondContact OD1-N 3.03Å; D120-E123 PolarHBondContact N-OE2 3.49Å; D120-E123 PolarHBondContact O-N 3.07Å; D120-E123 WeakPolarHBondContact OD1-CG 3.35Å; D120-E123 PolarHBondContact OD1-N 3.39Å; D120-F124 VanDerWaalsContact O-CB 3.24Å; D120-F124 WeakPolarHBondContact O-CB 3.36Å; D120-F124 PolarHBondContact O-N 2.79Å
121	F	89	Confident	85.4	Confident	58 Å²	58	56 Å²	56	25%	0.254	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-37.7	-178.7	179.8	-113.4	0	0	0	113	E65 K69 F72 V125	E65-F121 HydrophobicContact CG-CZ 4.48Å; K69-F121 VanDerWaalsContact CA-CE2 3.48Å; K69-F121 HydrophobicContact CB-CE2 3.85Å; K69-F121 HydrophobicContact CB-CZ 3.87Å; K69-F121 HydrophobicContact CG-CE2 4.23Å; K69-F121 HydrophobicContact CG-CZ 4.33Å; F72-F121 HydrophobicContact CB-CD2 3.84Å; F72-F121 HydrophobicContact CB-CE2 4.15Å; F72-F121 HydrophobicContact CD1-CD2 4.14Å; F72-F121 HydrophobicContact CD2-CB 4.36Å; F72-F121 AromaticContact CD2-CD2 3.91Å; F72-F121 HydrophobicContact CD2-CD2 3.91Å; F72-F121 HydrophobicContact CE1-CB 4.35Å; F72-F121 VanDerWaalsContact CE2-CA 3.48Å; F72-F121 HydrophobicContact CE2-CB 4.16Å; F72-F121 AromaticContact CG-CD2 3.69Å; F72-F121 HydrophobicContact CG-CD2 3.69Å; F72-F121 HydrophobicContact CG-CE2 4.48Å; F72-F121 HydrophobicContact CZ-CB 4.15Å; F121-V125 HydrophobicContact CD1-CG2 4.49Å; F121-V125 HydrophobicContact CD2-CG2 4.14Å; F121-V125 HydrophobicContact CE1-CG2 4.07Å; F121-V125 HydrophobicContact CE2-CG2 3.65Å; F121-V125 HydrophobicContact CZ-CG2 3.63Å; F121-V125 WeakPolarHBondContact O-CB 3.49Å; F121-V125 WeakPolarHBondContact O-CG2 3.41Å; F121-V125 PolarHBondContact O-N 2.96Å
122	Q	87.9	Confident	85.4	Confident	157 Å²	157	57.1 Å²	57.1	73%	0.734	28%	0.284	S	S	*	.	H	α-helix	trans	-72.9	-41.5	-177.3	-173.9	172.4	-6.7	0	0	111.4	D120 Q126	D120-Q122 VanDerWaalsContact C-N 3.25Å; D120-Q122 PolarHBondContact O-N 3.42Å; D120-Q122 WeakPolarHBondContact OD1-CA 3.49Å; D120-Q122 WeakPolarHBondContact OD1-CB 3.47Å; D120-Q122 PolarHBondContact OD1-N 3.03Å; Q122-Q126 VanDerWaalsContact O-CB 3.32Å; Q122-Q126 WeakPolarHBondContact O-CB 3.23Å; Q122-Q126 PolarHBondContact O-N 3.1Å
123	E	88.7	Confident	85	Confident	14 Å²	14	62.1 Å²	62.1	7%	0.065	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-44.1	174.1	-70.1	-178.4	140.7	0	0	111.8	K113 D114 L119 D120 Q126 Y127	K113-E123 WeakPolarHBondContact CA-OE1 3.45Å; K113-E123 WeakPolarHBondContact CB-OE1 3.4Å; K113-E123 PolarHBondContact N-OE1 3.46Å; D114-E123 PolarHBondContact N-OE1 3.2Å; L119-E123 HydrophobicContact CD2-CB 4.3Å; D120-E123 PolarHBondContact N-OE2 3.49Å; D120-E123 PolarHBondContact O-N 3.07Å; D120-E123 WeakPolarHBondContact OD1-CG 3.35Å; D120-E123 PolarHBondContact OD1-N 3.39Å; E123-Q126 PolarHBondContact O-N 3.41Å; E123-Y127 WeakPolarHBondContact O-CB 3.44Å; E123-Y127 PolarHBondContact O-N 3.48Å
124	F	87.6	Confident	84.4	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-47.7	175.1	177.4	-105.7	0	0	0	112.2	L71 F72 L75 I83 L119 D120 Q126 Y127 L128	L71-F124 HydrophobicContact CD2-CE1 4.34Å; L71-F124 HydrophobicContact CD2-CZ 3.91Å; L71-F124 HydrophobicContact CG-CE1 4.43Å; L71-F124 HydrophobicContact CG-CZ 4.04Å; F72-F124 HydrophobicContact CB-CD1 4.03Å; F72-F124 HydrophobicContact CB-CE1 4Å; F72-F124 HydrophobicContact CD2-CB 3.77Å; F72-F124 AromaticContact CD2-CD1 3.6Å; F72-F124 HydrophobicContact CD2-CD1 3.6Å; F72-F124 HydrophobicContact CD2-CD2 4.49Å; F72-F124 HydrophobicContact CD2-CE1 4.26Å; F72-F124 AromaticContact CD2-CG 3.71Å; F72-F124 HydrophobicContact CD2-CG 3.71Å; F72-F124 HydrophobicContact CE2-CB 3.96Å; F72-F124 HydrophobicContact CE2-CG 4.33Å; F72-F124 HydrophobicContact CG-CD1 4.31Å; L75-F124 HydrophobicContact CD1-CE2 3.8Å; L75-F124 HydrophobicContact CD1-CZ 3.7Å; I83-F124 HydrophobicContact CD1-CD2 3.68Å; I83-F124 HydrophobicContact CD1-CE2 3.85Å; I83-F124 HydrophobicContact CD1-CG 4.05Å; I83-F124 HydrophobicContact CD1-CZ 4.33Å; L119-F124 HydrophobicContact CB-CB 4.37Å; L119-F124 HydrophobicContact CD1-CD2 4.38Å; D120-F124 VanDerWaalsContact O-CB 3.24Å; D120-F124 WeakPolarHBondContact O-CB 3.36Å; D120-F124 PolarHBondContact O-N 2.79Å; F124-Q126 VanDerWaalsContact C-N 3.31Å; F124-Q126 PolarHBondContact O-N 3.42Å; F124-Y127 PolarHBondContact O-N 2.88Å; F124-L128 HydrophobicContact CD1-CD1 4.1Å; F124-L128 HydrophobicContact CE1-CD1 3.47Å; F124-L128 VanDerWaalsContact CE1-CD1 3.47Å; F124-L128 HydrophobicContact CE1-CG 4.47Å; F124-L128 HydrophobicContact CE2-CD1 3.95Å; F124-L128 HydrophobicContact CE2-CG 4.3Å; F124-L128 HydrophobicContact CZ-CD1 3.39Å; F124-L128 HydrophobicContact CZ-CG 4.22Å; F124-L128 WeakPolarHBondContact O-CG 3.33Å; F124-L128 PolarHBondContact O-N 3.25Å
125	V	86.3	Confident	84.1	Confident	12 Å²	12	54.8 Å²	54.8	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-41.7	176.5	167.7	0	0	0	0	110.8	L68 F121 L128 R129	L68-V125 HydrophobicContact CB-CG2 4.14Å; L68-V125 HydrophobicContact CD1-CB 4.49Å; L68-V125 HydrophobicContact CD1-CG1 4.03Å; L68-V125 HydrophobicContact CD1-CG2 4.09Å; F121-V125 HydrophobicContact CD1-CG2 4.49Å; F121-V125 HydrophobicContact CD2-CG2 4.14Å; F121-V125 HydrophobicContact CE1-CG2 4.07Å; F121-V125 HydrophobicContact CE2-CG2 3.65Å; F121-V125 HydrophobicContact CZ-CG2 3.63Å; F121-V125 WeakPolarHBondContact O-CB 3.49Å; F121-V125 WeakPolarHBondContact O-CG2 3.41Å; F121-V125 PolarHBondContact O-N 2.96Å; V125-L128 PolarHBondContact O-N 3.21Å; V125-R129 HydrophobicContact CG1-CG 4.45Å; V125-R129 WeakPolarHBondContact O-CB 3.32Å; V125-R129 VanDerWaalsContact O-CG 3.28Å; V125-R129 WeakPolarHBondContact O-CG 3.29Å; V125-R129 PolarHBondContact O-N 2.99Å
126	Q	83.3	Confident	83.8	Confident	56 Å²	56	52.3 Å²	52.3	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-66.8	-43.8	179.6	-174.3	58.4	47.9	0	0	111.8	Q122 E123 F124 L128 R129 D130	Q122-Q126 VanDerWaalsContact O-CB 3.32Å; Q122-Q126 WeakPolarHBondContact O-CB 3.23Å; Q122-Q126 PolarHBondContact O-N 3.1Å; E123-Q126 PolarHBondContact O-N 3.41Å; F124-Q126 VanDerWaalsContact C-N 3.31Å; F124-Q126 PolarHBondContact O-N 3.42Å; Q126-L128 PolarHBondContact O-N 3.41Å; Q126-R129 PolarHBondContact O-N 3.3Å; Q126-D130 PolarHBondContact NE2-OD1 3.47Å; Q126-D130 VanDerWaalsContact NE2-OD1 3.15Å; Q126-D130 PolarHBondContact NE2-OD2 2.98Å; Q126-D130 PolarHBondContact O-N 2.87Å
127	Y	85.2	Confident	83.3	Confident	36 Å²	36	54.1 Å²	54.1	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-56.5	-49.9	174.6	171.3	-94	0	0	0	111.2	M107 A110 E123 F124 R129 D130 H131	M107-Y127 HydrophobicContact CE-CE1 4.22Å; A110-Y127 HydrophobicContact CB-CD2 4.21Å; A110-Y127 HydrophobicContact CB-CE2 3.9Å; E123-Y127 WeakPolarHBondContact O-CB 3.44Å; E123-Y127 PolarHBondContact O-N 3.48Å; F124-Y127 PolarHBondContact O-N 2.88Å; Y127-R129 PolarHBondContact O-N 3.27Å; Y127-D130 PolarHBondContact O-N 3.37Å; Y127-H131 WeakPolarHBondContact O-CB 3.49Å; Y127-H131 PolarHBondContact O-N 3.24Å
128	L	84	Confident	83.1	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-40.1	179.5	-72.7	-178.1	0	0	0	112.4	L68 L71 F124 V125 Q126 D130 H131 E132 L196	L68-L128 HydrophobicContact CD2-CD1 3.65Å; L71-L128 HydrophobicContact CD2-CD1 4.11Å; F124-L128 HydrophobicContact CD1-CD1 4.1Å; F124-L128 HydrophobicContact CE1-CD1 3.47Å; F124-L128 VanDerWaalsContact CE1-CD1 3.47Å; F124-L128 HydrophobicContact CE1-CG 4.47Å; F124-L128 HydrophobicContact CE2-CD1 3.95Å; F124-L128 HydrophobicContact CE2-CG 4.3Å; F124-L128 HydrophobicContact CZ-CD1 3.39Å; F124-L128 HydrophobicContact CZ-CG 4.22Å; F124-L128 WeakPolarHBondContact O-CG 3.33Å; F124-L128 PolarHBondContact O-N 3.25Å; V125-L128 PolarHBondContact O-N 3.21Å; Q126-L128 PolarHBondContact O-N 3.41Å; L128-D130 VanDerWaalsContact C-N 3.34Å; L128-D130 PolarHBondContact O-N 2.86Å; L128-H131 PolarHBondContact O-N 3.32Å; L128-E132 WeakPolarHBondContact O-CB 3.45Å; L128-E132 WeakPolarHBondContact O-CG 3.05Å; L128-E132 PolarHBondContact O-N 3.22Å; L128-L196 HydrophobicContact CD2-CD1 4.2Å; L128-L196 HydrophobicContact CD2-CG 4.37Å
129	R	80.5	Confident	82.6	Confident	109 Å²	109	50.1 Å²	50.1	41%	0.411	23%	0.229	S	C	.	.	H	α-helix	trans	-62.1	-41.3	175.3	-77.7	175.8	175.5	175.3	1.5	112.3	V125 Q126 Y127 K133	V125-R129 HydrophobicContact CG1-CG 4.45Å; V125-R129 WeakPolarHBondContact O-CB 3.32Å; V125-R129 VanDerWaalsContact O-CG 3.28Å; V125-R129 WeakPolarHBondContact O-CG 3.29Å; V125-R129 PolarHBondContact O-N 2.99Å; Q126-R129 PolarHBondContact O-N 3.3Å; Y127-R129 PolarHBondContact O-N 3.27Å; R129-K133 WeakPolarHBondContact O-CG 3.18Å; R129-K133 PolarHBondContact O-N 3.26Å; R129-K133 VanDerWaalsContact O-N 3.1Å
130	D	77.1	Confident	82.2	Confident	61 Å²	61	56 Å²	56	33%	0.326	25%	0.254	S	S	.	.	H	α-helix	trans	-72.2	-33.9	178.6	-69.8	-25.7	0	0	0	111.7	Q126 Y127 L128 K133 K134	Q126-D130 PolarHBondContact NE2-OD1 3.47Å; Q126-D130 VanDerWaalsContact NE2-OD1 3.15Å; Q126-D130 PolarHBondContact NE2-OD2 2.98Å; Q126-D130 PolarHBondContact O-N 2.87Å; Y127-D130 PolarHBondContact O-N 3.37Å; L128-D130 VanDerWaalsContact C-N 3.34Å; L128-D130 PolarHBondContact O-N 2.86Å; D130-K133 PolarHBondContact O-N 3.3Å; D130-K133 IonicContact OD1-NZ 2.61Å; D130-K133 PolarHBondContact OD1-NZ 3.21Å; D130-K134 WeakPolarHBondContact O-CG 3.45Å; D130-K134 PolarHBondContact O-N 3.39Å
131	H	80.9	Confident	81.6	Confident	9 Å²	9	55.5 Å²	55.5	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-46.5	170.7	-168.6	54.9	0	0	0	112.3	Y127 L128 K133 K134 L135 H195 L196 H198 A200	Y127-H131 WeakPolarHBondContact O-CB 3.49Å; Y127-H131 PolarHBondContact O-N 3.24Å; L128-H131 PolarHBondContact O-N 3.32Å; H131-K133 VanDerWaalsContact C-N 3.31Å; H131-K133 PolarHBondContact O-N 3.04Å; H131-K134 WeakPolarHBondContact O-CB 3.46Å; H131-K134 PolarHBondContact O-N 3.11Å; H131-K134 VanDerWaalsContact O-N 3.1Å; H131-L135 WeakPolarHBondContact O-CG 3.45Å; H131-L135 PolarHBondContact O-N 2.95Å; H131-H195 PolarHBondContact NE2-O 3.16Å; H131-L196 PolarHBondContact CD2-O 2.91Å; H131-H198 PolarHBondContact CE1-O 3.37Å; H131-H198 PolarHBondContact NE2-O 2.92Å; H131-A200 PolarHBondContact CE1-O 3.38Å
132	E	81.4	Confident	81.2	Confident	28 Å²	28	53.1 Å²	53.1	13%	0.131	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-41.2	175.3	-78.3	-177.1	-176.3	0	0	112.2	L128 K134 L135 R136 R192 L196	L128-E132 WeakPolarHBondContact O-CB 3.45Å; L128-E132 WeakPolarHBondContact O-CG 3.05Å; L128-E132 PolarHBondContact O-N 3.22Å; E132-K134 VanDerWaalsContact C-N 3.33Å; E132-K134 PolarHBondContact O-N 2.91Å; E132-L135 PolarHBondContact O-N 3.45Å; E132-R136 WeakPolarHBondContact O-CB 3.36Å; E132-R136 PolarHBondContact O-N 2.55Å; E132-R192 HydrophobicContact CG-CG 4.27Å; E132-L196 HydrophobicContact CG-CD1 3.53Å
133	K	77.3	Confident	81	Confident	122 Å²	122	46 Å²	46	53%	0.53	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-43.6	175.3	-72.9	170.8	-163.7	159.5	0	111.7	R129 D130 H131 R136 L137	R129-K133 WeakPolarHBondContact O-CG 3.18Å; R129-K133 PolarHBondContact O-N 3.26Å; R129-K133 VanDerWaalsContact O-N 3.1Å; D130-K133 PolarHBondContact O-N 3.3Å; D130-K133 IonicContact OD1-NZ 2.61Å; D130-K133 PolarHBondContact OD1-NZ 3.21Å; H131-K133 VanDerWaalsContact C-N 3.31Å; H131-K133 PolarHBondContact O-N 3.04Å; K133-R136 WeakPolarHBondContact O-CB 2.99Å; K133-R136 PolarHBondContact O-N 3.44Å; K133-L137 WeakPolarHBondContact O-CG 3.3Å; K133-L137 PolarHBondContact O-N 2.72Å
134	K	76.2	Confident	80.6	Confident	92 Å²	92	51 Å²	51	40%	0.4	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-45.3	176.4	-66.7	179.9	-176.9	-179.6	0	111.2	D130 H131 E132 R136 L137 V138 D201	D130-K134 WeakPolarHBondContact O-CG 3.45Å; D130-K134 PolarHBondContact O-N 3.39Å; H131-K134 WeakPolarHBondContact O-CB 3.46Å; H131-K134 PolarHBondContact O-N 3.11Å; H131-K134 VanDerWaalsContact O-N 3.1Å; E132-K134 VanDerWaalsContact C-N 3.33Å; E132-K134 PolarHBondContact O-N 2.91Å; K134-R136 PolarHBondContact O-N 3.46Å; K134-L137 WeakPolarHBondContact O-CB 3.43Å; K134-L137 PolarHBondContact O-N 3.47Å; K134-L137 VanDerWaalsContact O-N 3.09Å; K134-V138 PolarHBondContact O-N 3.45Å; K134-V138 VanDerWaalsContact O-N 3.12Å; K134-D201 HydrophobicContact CD-CB 3.79Å; K134-D201 IonicContact NZ-OD2 3.51Å; K134-D201 PolarHBondContact NZ-OD2 3.01Å
135	L	77.4	Confident	80.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.5	-35.1	175.2	-69.1	177.9	0	0	0	112.4	H131 E132 V138 F139 W188 W191 H195 I206	H131-L135 WeakPolarHBondContact O-CG 3.45Å; H131-L135 PolarHBondContact O-N 2.95Å; E132-L135 PolarHBondContact O-N 3.45Å; L135-V138 PolarHBondContact O-N 3.39Å; L135-F139 WeakPolarHBondContact O-CB 3.4Å; L135-F139 PolarHBondContact O-N 3.29Å; L135-W188 HydrophobicContact CB-CH2 4.2Å; L135-W188 HydrophobicContact CB-CZ3 4.45Å; L135-W191 PolarHBondContact O-NE1 3.18Å; L135-H195 HydrophobicContact CD1-CB 3.78Å; L135-H195 HydrophobicContact CD2-CB 3.65Å; L135-H195 HydrophobicContact CG-CB 4.38Å; L135-I206 HydrophobicContact CD2-CD1 4.03Å
136	R	80	Confident	80.4	Confident	88 Å²	88	61 Å²	61	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-36.6	175.9	-166.3	67.4	167.6	150.9	-4.1	112.4	E132 K133 K134 V138 K140 W188	E132-R136 WeakPolarHBondContact O-CB 3.36Å; E132-R136 PolarHBondContact O-N 2.55Å; K133-R136 WeakPolarHBondContact O-CB 2.99Å; K133-R136 PolarHBondContact O-N 3.44Å; K134-R136 PolarHBondContact O-N 3.46Å; R136-V138 VanDerWaalsContact C-N 3.35Å; R136-K140 WeakPolarHBondContact O-CG 3.31Å; R136-K140 PolarHBondContact O-N 2.98Å; R136-K140 VanDerWaalsContact O-N 3.09Å; R136-W188 VanDerWaalsContact CA-CZ3 3.41Å; R136-W188 HydrophobicContact CB-CH2 3.57Å; R136-W188 HydrophobicContact CB-CZ2 4.2Å; R136-W188 HydrophobicContact CB-CZ3 3.88Å; R136-W188 VanDerWaalsContact CD-CE3 3.46Å; R136-W188 VanDerWaalsContact CD-CZ3 3.44Å; R136-W188 HydrophobicContact CG-CH2 4.17Å; R136-W188 HydrophobicContact CG-CZ2 4.47Å; R136-W188 HydrophobicContact CG-CZ3 4.28Å; R136-W188 VanDerWaalsContact NH1-CB 3.34Å
137	L	73.5	Confident	80.5	Confident	126 Å²	126	62.6 Å²	62.6	66%	0.66	29%	0.29	S	S	*	.	H	α-helix	trans	-66	-41.1	174.4	-64.3	174.5	0	0	0	110.9	K133 K134 S141	K133-L137 WeakPolarHBondContact O-CG 3.3Å; K133-L137 PolarHBondContact O-N 2.72Å; K134-L137 WeakPolarHBondContact O-CB 3.43Å; K134-L137 PolarHBondContact O-N 3.47Å; K134-L137 VanDerWaalsContact O-N 3.09Å; L137-S141 PolarHBondContact O-N 3.39Å; L137-S141 VanDerWaalsContact O-N 3.11Å
138	V	78.1	Confident	80.4	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-63.5	-48.3	174.8	177.5	0	0	0	0	111.1	K134 L135 R136 K140 S141 L142 W191 I203 I206	K134-V138 PolarHBondContact O-N 3.45Å; K134-V138 VanDerWaalsContact O-N 3.12Å; L135-V138 PolarHBondContact O-N 3.39Å; R136-V138 VanDerWaalsContact C-N 3.35Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 2.98Å; V138-S141 WeakPolarHBondContact O-CB 3.21Å; V138-S141 PolarHBondContact O-N 3.33Å; V138-S141 PolarHBondContact O-OG 2.75Å; V138-L142 HydrophobicContact CG1-CD1 4.06Å; V138-L142 HydrophobicContact CG1-CG 4.47Å; V138-L142 PolarHBondContact O-N 3.07Å; V138-L142 VanDerWaalsContact O-N 3.15Å; V138-W191 HydrophobicContact CB-CZ2 4.28Å; V138-W191 HydrophobicContact CG1-CH2 4.21Å; V138-W191 HydrophobicContact CG1-CZ2 3.56Å; V138-I203 HydrophobicContact CB-CG1 4.33Å; V138-I203 HydrophobicContact CG1-CG1 3.59Å; V138-I203 HydrophobicContact CG2-CG1 4.19Å; V138-I206 HydrophobicContact CB-CD1 4.37Å; V138-I206 HydrophobicContact CG1-CD1 3.91Å; V138-I206 HydrophobicContact CG2-CD1 4.25Å
139	F	81	Confident	80.7	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.009	32%	0.32	C	S	.	.	H	α-helix	trans	-53.3	-50	178	-176.8	-89.8	0	0	0	111.7	L135 S141 L142 D143 G148 I150 W188 W191	L135-F139 WeakPolarHBondContact O-CB 3.4Å; L135-F139 PolarHBondContact O-N 3.29Å; F139-S141 PolarHBondContact O-N 3.33Å; F139-L142 PolarHBondContact O-N 3.5Å; F139-L142 VanDerWaalsContact O-N 3.1Å; F139-D143 HydrophobicContact CE1-CB 4.31Å; F139-D143 PolarHBondContact O-N 3.08Å; F139-G148 WeakPolarHBondContact CZ-O 3.42Å; F139-I150 HydrophobicContact CD2-CD1 3.39Å; F139-I150 HydrophobicContact CD2-CG1 4.12Å; F139-I150 HydrophobicContact CE2-CD1 3.51Å; F139-I150 HydrophobicContact CE2-CG1 3.76Å; F139-I150 HydrophobicContact CG-CD1 4.15Å; F139-I150 HydrophobicContact CZ-CD1 4.31Å; F139-I150 HydrophobicContact CZ-CG1 4.13Å; F139-W188 HydrophobicContact CB-CE3 3.97Å; F139-W188 HydrophobicContact CB-CZ3 3.96Å; F139-W188 HydrophobicContact CD1-CE3 4.35Å; F139-W188 HydrophobicContact CD2-CE3 4.13Å; F139-W188 AromaticContact CG-CE3 3.88Å; F139-W188 HydrophobicContact CG-CE3 3.88Å; F139-W188 HydrophobicContact CG-CZ3 4.38Å; F139-W188 HydrophobicContact CZ-CB 4.46Å; F139-W191 HydrophobicContact CB-CG 4.36Å; F139-W191 HydrophobicContact CD2-CB 3.6Å; F139-W191 AromaticContact CD2-CD1 3.85Å; F139-W191 AromaticContact CD2-CD2 3.92Å; F139-W191 HydrophobicContact CD2-CD2 3.92Å; F139-W191 HydrophobicContact CD2-CE3 4.48Å; F139-W191 AromaticContact CD2-CG 3.49Å; F139-W191 HydrophobicContact CD2-CG 3.49Å; F139-W191 VanDerWaalsContact CD2-CG 3.49Å; F139-W191 HydrophobicContact CE2-CB 3.92Å; F139-W191 HydrophobicContact CE2-CG 4.27Å; F139-W191 HydrophobicContact CG-CG 4.38Å
140	K	79.8	Confident	81.1	Confident	126 Å²	126	62.4 Å²	62.4	55%	0.548	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-26.8	177.6	-74.6	-175.4	174.7	-170.8	0	114.3	R136 V138 L142	R136-K140 WeakPolarHBondContact O-CG 3.31Å; R136-K140 PolarHBondContact O-N 2.98Å; R136-K140 VanDerWaalsContact O-N 3.09Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 2.98Å; K140-L142 VanDerWaalsContact C-N 3.34Å
141	S	78.3	Confident	81.7	Confident	51 Å²	51	61.1 Å²	61.1	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-77.6	-23.9	177	71.9	0	0	0	0	112.9	L137 V138 F139 I203	L137-S141 PolarHBondContact O-N 3.39Å; L137-S141 VanDerWaalsContact O-N 3.11Å; V138-S141 WeakPolarHBondContact O-CB 3.21Å; V138-S141 PolarHBondContact O-N 3.33Å; V138-S141 PolarHBondContact O-OG 2.75Å; F139-S141 PolarHBondContact O-N 3.33Å; S141-I203 WeakPolarHBondContact OG-CD1 3.35Å
142	L	80.2	Confident	81.9	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-89.1	-37.7	177	-65.2	174.8	0	0	0	111.9	V138 F139 K140 R144 I150 E154 S158 W191 W210	V138-L142 HydrophobicContact CG1-CD1 4.06Å; V138-L142 HydrophobicContact CG1-CG 4.47Å; V138-L142 PolarHBondContact O-N 3.07Å; V138-L142 VanDerWaalsContact O-N 3.15Å; F139-L142 PolarHBondContact O-N 3.5Å; F139-L142 VanDerWaalsContact O-N 3.1Å; K140-L142 VanDerWaalsContact C-N 3.34Å; L142-R144 PolarHBondContact O-N 2.85Å; L142-I150 HydrophobicContact CB-CD1 3.8Å; L142-I150 HydrophobicContact CB-CG1 4.24Å; L142-I150 HydrophobicContact CD1-CD1 4.15Å; L142-E154 WeakPolarHBondContact O-CB 3.38Å; L142-S158 VanDerWaalsContact CD2-CB 3.41Å; L142-W191 HydrophobicContact CD1-CH2 3.31Å; L142-W191 HydrophobicContact CD1-CZ2 3.98Å; L142-W191 HydrophobicContact CD1-CZ3 3.76Å; L142-W210 HydrophobicContact CD1-CH2 4.41Å
143	D	84.6	Confident	82.2	Confident	9 Å²	9	65.7 Å²	65.7	5%	0.048	32%	0.317	C	S	.	.			trans	-73.9	86.1	172.9	175.8	12.5	0	0	0	110.3	F139 N146 D147 G148 I150	F139-D143 HydrophobicContact CE1-CB 4.31Å; F139-D143 PolarHBondContact O-N 3.08Å; D143-N146 WeakPolarHBondContact OD1-CA 3.4Å; D143-N146 PolarHBondContact OD1-N 3.11Å; D143-N146 WeakPolarHBondContact OD2-CA 3.31Å; D143-D147 PolarHBondContact OD1-N 3.5Å; D143-D147 VanDerWaalsContact OD1-N 3.09Å; D143-G148 VanDerWaalsContact OD2-CA 3.26Å; D143-G148 WeakPolarHBondContact OD2-CA 3.33Å; D143-G148 PolarHBondContact OD2-N 2.92Å; D143-I150 HydrophobicContact CB-CG1 4.31Å
144	R	80.6	Confident	82.7	Confident	118 Å²	118	60 Å²	60	45%	0.445	29%	0.292	S	S	.	.	S	Bend	trans	-84.8	-28.8	-176.1	-60.2	-179.3	99.8	147.2	3.8	111.6	L142 N146 E154 D161	L142-R144 PolarHBondContact O-N 2.85Å; R144-N146 PolarHBondContact O-N 2.79Å; R144-E154 PolarHBondContact N-OE1 2.97Å; R144-D161 IonicContact CZ-OD2 3.15Å; R144-D161 IonicContact NH1-OD2 2.52Å; R144-D161 PolarHBondContact NH1-OD2 3.4Å; R144-D161 IonicContact NH2-OD2 2.86Å; R144-D161 PolarHBondContact NH2-OD2 3.45Å
145	K	85.3	Confident	83	Confident	96 Å²	96	55.7 Å²	55.7	42%	0.417	27%	0.273	S	S	.	.	S	Bend	trans	-72.9	-15.5	173.2	-77.9	171	-87	-165	0	111.6	D147 D151 E154	K145-D147 PolarHBondContact O-N 3.22Å; K145-D151 IonicContact NZ-OD1 2.95Å; K145-D151 PolarHBondContact NZ-OD1 2.92Å; K145-D151 IonicContact NZ-OD2 3.97Å; K145-D151 PolarHBondContact NZ-OD2 3.48Å; K145-E154 WeakPolarHBondContact CB-OE1 3.44Å; K145-E154 VanDerWaalsContact CE-CG 3.42Å; K145-E154 VanDerWaalsContact CE-OE1 3.27Å; K145-E154 WeakPolarHBondContact CE-OE1 3.33Å; K145-E154 PolarHBondContact N-OE1 2.91Å
146	N	83.9	Confident	83.1	Confident	131 Å²	131	57.4 Å²	57.4	70%	0.701	28%	0.282	S	S	*	.			trans	54.8	39.9	179.8	-170	68.5	0	0	0	111	D143 R144	D143-N146 WeakPolarHBondContact OD1-CA 3.4Å; D143-N146 PolarHBondContact OD1-N 3.11Å; D143-N146 WeakPolarHBondContact OD2-CA 3.31Å; R144-N146 PolarHBondContact O-N 2.79Å
147	D	85.6	Confident	83	Confident	91 Å²	91	58 Å²	58	49%	0.487	29%	0.289	S	S	.	.	S	Bend	trans	-98.9	1.3	178.5	68.2	13.3	0	0	0	112.2	D143 K145 R149	D143-D147 PolarHBondContact OD1-N 3.5Å; D143-D147 VanDerWaalsContact OD1-N 3.09Å; K145-D147 PolarHBondContact O-N 3.22Å; D147-R149 VanDerWaalsContact C-N 3.29Å; D147-R149 PolarHBondContact OD1-N 2.98Å; D147-R149 VanDerWaalsContact OD1-O 3.05Å
148	G	83.6	Confident	83	Confident	36 Å²	36	52.6 Å²	52.6	37%	0.371	26%	0.261	S	S	.	.	S	Bend	trans	79.2	11.3	178.5	0	0	0	0	0	113.5	F139 D143	F139-G148 WeakPolarHBondContact CZ-O 3.42Å; D143-G148 VanDerWaalsContact OD2-CA 3.26Å; D143-G148 WeakPolarHBondContact OD2-CA 3.33Å; D143-G148 PolarHBondContact OD2-N 2.92Å
149	R	90	Very high	82.6	Confident	107 Å²	107	52.3 Å²	52.3	40%	0.404	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.8	177	-64.4	177.4	177.4	-105.4	-7.1	109.3	D147 T185 I186	D147-R149 VanDerWaalsContact C-N 3.29Å; D147-R149 PolarHBondContact OD1-N 2.98Å; D147-R149 VanDerWaalsContact OD1-O 3.05Å; R149-T185 PolarHBondContact NH1-OG1 3.45Å; R149-T185 VanDerWaalsContact NH1-OG1 3.09Å; R149-I186 CarbonylContact C-O 3.5Å; R149-I186 WeakPolarHBondContact CA-O 3.43Å
150	I	87.8	Confident	82	Confident	1 Å²	1	59 Å²	59	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.2	173.6	-60.9	170.3	0	0	0	108.2	F139 L142 D143 E154 I155 L175 T185 I186 W191	F139-I150 HydrophobicContact CD2-CD1 3.39Å; F139-I150 HydrophobicContact CD2-CG1 4.12Å; F139-I150 HydrophobicContact CE2-CD1 3.51Å; F139-I150 HydrophobicContact CE2-CG1 3.76Å; F139-I150 HydrophobicContact CG-CD1 4.15Å; F139-I150 HydrophobicContact CZ-CD1 4.31Å; F139-I150 HydrophobicContact CZ-CG1 4.13Å; L142-I150 HydrophobicContact CB-CD1 3.8Å; L142-I150 HydrophobicContact CB-CG1 4.24Å; L142-I150 HydrophobicContact CD1-CD1 4.15Å; D143-I150 HydrophobicContact CB-CG1 4.31Å; I150-E154 WeakPolarHBondContact CA-OE2 3.44Å; I150-E154 HydrophobicContact CG2-CB 4.42Å; I150-I155 HydrophobicContact CG2-CD1 4.06Å; I150-I155 HydrophobicContact CG2-CG1 3.62Å; I150-L175 WeakPolarHBondContact O-CD2 3.34Å; I150-T185 CarbonylContact O-C 3.58Å; I150-T185 WeakPolarHBondContact O-CA 3.41Å; I150-I186 HydrophobicContact CB-CB 4.33Å; I150-I186 PolarHBondContact N-O 3.03Å; I150-I186 PolarHBondContact O-N 3.12Å; I150-W191 HydrophobicContact CD1-CD2 4.33Å; I150-W191 HydrophobicContact CD1-CE3 3.82Å; I150-W191 HydrophobicContact CD1-CZ3 4.08Å
151	D	89.8	Confident	81.1	Confident	33 Å²	33	57.7 Å²	57.7	18%	0.176	28%	0.283	C	S	.	.			trans	-109.8	178.1	175.3	75	20.9	0	0	0	114.6	K145 Q153 E154 I155 T185	K145-D151 IonicContact NZ-OD1 2.95Å; K145-D151 PolarHBondContact NZ-OD1 2.92Å; K145-D151 IonicContact NZ-OD2 3.97Å; K145-D151 PolarHBondContact NZ-OD2 3.48Å; D151-Q153 VanDerWaalsContact C-N 3.25Å; D151-Q153 PolarHBondContact O-N 3.37Å; D151-Q153 WeakPolarHBondContact OD1-CB 3.34Å; D151-Q153 PolarHBondContact OD1-N 3.06Å; D151-Q153 VanDerWaalsContact OD1-N 3.13Å; D151-E154 PolarHBondContact N-OE2 3.07Å; D151-E154 VanDerWaalsContact N-OE2 3.11Å; D151-E154 PolarHBondContact O-N 2.84Å; D151-E154 PolarHBondContact OD1-N 3.46Å; D151-I155 PolarHBondContact O-N 3.47Å; D151-T185 HydrophobicContact CB-CG2 4.26Å
152	S	86.5	Confident	80	Confident	18 Å²	18	58.5 Å²	58.5	13%	0.126	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-36	-172.8	57.7	0	0	0	0	110.9	I155 M156	S152-I155 PolarHBondContact O-N 3.04Å; S152-M156 WeakPolarHBondContact O-CB 3.27Å; S152-M156 WeakPolarHBondContact O-CG 3.21Å; S152-M156 PolarHBondContact O-N 2.91Å
153	Q	86.3	Confident	78.5	Confident	116 Å²	116	58.8 Å²	58.8	54%	0.542	29%	0.288	S	S	.	.	H	α-helix	trans	-68.4	-40.1	179.2	-62.5	-175.7	-6.6	0	0	111.2	D151 M156 Q157	D151-Q153 VanDerWaalsContact C-N 3.25Å; D151-Q153 PolarHBondContact O-N 3.37Å; D151-Q153 WeakPolarHBondContact OD1-CB 3.34Å; D151-Q153 PolarHBondContact OD1-N 3.06Å; D151-Q153 VanDerWaalsContact OD1-N 3.13Å; Q153-M156 PolarHBondContact O-N 2.73Å; Q153-Q157 WeakPolarHBondContact O-CB 3.37Å; Q153-Q157 PolarHBondContact O-N 3.11Å
154	E	88.6	Confident	77.2	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-40.1	176.8	-74.7	178.6	138.4	0	0	112.8	L142 R144 K145 I150 D151 Q157 S158	L142-E154 WeakPolarHBondContact O-CB 3.38Å; R144-E154 PolarHBondContact N-OE1 2.97Å; K145-E154 WeakPolarHBondContact CB-OE1 3.44Å; K145-E154 VanDerWaalsContact CE-CG 3.42Å; K145-E154 VanDerWaalsContact CE-OE1 3.27Å; K145-E154 WeakPolarHBondContact CE-OE1 3.33Å; K145-E154 PolarHBondContact N-OE1 2.91Å; I150-E154 WeakPolarHBondContact CA-OE2 3.44Å; I150-E154 HydrophobicContact CG2-CB 4.42Å; D151-E154 PolarHBondContact N-OE2 3.07Å; D151-E154 VanDerWaalsContact N-OE2 3.11Å; D151-E154 PolarHBondContact O-N 2.84Å; D151-E154 PolarHBondContact OD1-N 3.46Å; E154-Q157 PolarHBondContact O-N 3.33Å; E154-S158 WeakPolarHBondContact O-CB 3.46Å; E154-S158 PolarHBondContact O-N 3.05Å; E154-S158 PolarHBondContact O-OG 3.39Å
155	I	82.3	Confident	76.3	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-51.3	171.6	-70.8	176.5	0	0	0	110.2	I150 D151 S152 Q157 S158 L159 L166 A171 I174 L175	I150-I155 HydrophobicContact CG2-CD1 4.06Å; I150-I155 HydrophobicContact CG2-CG1 3.62Å; D151-I155 PolarHBondContact O-N 3.47Å; S152-I155 PolarHBondContact O-N 3.04Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 2.98Å; I155-S158 PolarHBondContact O-N 3.48Å; I155-L159 HydrophobicContact CG2-CD1 3.61Å; I155-L159 VanDerWaalsContact O-CB 3.29Å; I155-L159 WeakPolarHBondContact O-CB 3.18Å; I155-L159 WeakPolarHBondContact O-CD1 3.34Å; I155-L159 WeakPolarHBondContact O-CG 3.18Å; I155-L159 PolarHBondContact O-N 3.23Å; I155-L166 HydrophobicContact CG2-CD1 4.15Å; I155-A171 HydrophobicContact CB-CB 4.5Å; I155-A171 HydrophobicContact CG2-CB 4.14Å; I155-I174 HydrophobicContact CD1-CG2 3.99Å; I155-I174 HydrophobicContact CG2-CD1 3.98Å; I155-L175 HydrophobicContact CD1-CD2 3.4Å; I155-L175 HydrophobicContact CD1-CG 3.78Å
156	M	79.4	Confident	75.2	Confident	35 Å²	35	56.6 Å²	56.6	17%	0.172	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-41.7	179.2	-74.1	174.7	72.6	0	0	112.2	S152 Q153 R160 L166 E168 A171	S152-M156 WeakPolarHBondContact O-CB 3.27Å; S152-M156 WeakPolarHBondContact O-CG 3.21Å; S152-M156 PolarHBondContact O-N 2.91Å; Q153-M156 PolarHBondContact O-N 2.73Å; M156-R160 WeakPolarHBondContact O-CB 3.26Å; M156-R160 PolarHBondContact O-N 2.95Å; M156-L166 WeakPolarHBondContact CE-O 3.3Å; M156-L166 HydrophobicContact CG-CB 4.3Å; M156-E168 HydrophobicContact CE-CB 4.41Å; M156-E168 HydrophobicContact SD-CB 4.04Å; M156-E168 HydrophobicContact SD-CG 4.36Å; M156-A171 HydrophobicContact CG-CB 3.51Å; M156-A171 HydrophobicContact SD-CB 4.21Å
157	Q	78.8	Confident	74.8	Confident	102 Å²	102	53.6 Å²	53.6	48%	0.477	27%	0.271	S	S	.	.	H	α-helix	trans	-75	-40.8	-176.8	-162	170.7	11.1	0	0	111.6	Q153 E154 I155 L159 R160 D161	Q153-Q157 WeakPolarHBondContact O-CB 3.37Å; Q153-Q157 PolarHBondContact O-N 3.11Å; E154-Q157 PolarHBondContact O-N 3.33Å; I155-Q157 VanDerWaalsContact C-N 3.31Å; I155-Q157 PolarHBondContact O-N 2.98Å; Q157-L159 VanDerWaalsContact C-N 3.3Å; Q157-L159 PolarHBondContact O-N 2.77Å; Q157-R160 PolarHBondContact O-N 3.38Å; Q157-D161 VanDerWaalsContact O-CG 3.32Å; Q157-D161 PolarHBondContact O-N 3.27Å
158	S	72.1	Confident	74.4	Confident	11 Å²	11	54.4 Å²	54.4	8%	0.077	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-37.8	175.5	-58.8	0	0	0	0	111.7	L142 E154 I155 L162	L142-S158 VanDerWaalsContact CD2-CB 3.41Å; E154-S158 WeakPolarHBondContact O-CB 3.46Å; E154-S158 PolarHBondContact O-N 3.05Å; E154-S158 PolarHBondContact O-OG 3.39Å; I155-S158 PolarHBondContact O-N 3.48Å; S158-L162 WeakPolarHBondContact O-CG 3.37Å; S158-L162 PolarHBondContact O-N 3.3Å
159	L	69.7	Low	74	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-73.2	-37.2	174.7	-78.2	160.6	0	0	0	112.4	I155 Q157 D161 L162 G163 I164 L166 I174 I207 W210 L216	I155-L159 HydrophobicContact CG2-CD1 3.61Å; I155-L159 VanDerWaalsContact O-CB 3.29Å; I155-L159 WeakPolarHBondContact O-CB 3.18Å; I155-L159 WeakPolarHBondContact O-CD1 3.34Å; I155-L159 WeakPolarHBondContact O-CG 3.18Å; I155-L159 PolarHBondContact O-N 3.23Å; Q157-L159 VanDerWaalsContact C-N 3.3Å; Q157-L159 PolarHBondContact O-N 2.77Å; L159-D161 VanDerWaalsContact C-N 3.3Å; L159-D161 PolarHBondContact O-N 3.12Å; L159-L162 CarbonylContact O-C 3.09Å; L159-L162 WeakPolarHBondContact O-CA 3.33Å; L159-L162 WeakPolarHBondContact O-CB 3.46Å; L159-L162 PolarHBondContact O-N 3.33Å; L159-G163 PolarHBondContact O-N 2.99Å; L159-G163 VanDerWaalsContact O-N 3.17Å; L159-I164 CarbonylContact C-O 3.59Å; L159-I164 HydrophobicContact CB-CB 4.13Å; L159-I164 HydrophobicContact CB-CG2 4.24Å; L159-I164 HydrophobicContact CD2-CB 4.04Å; L159-I164 HydrophobicContact CD2-CD1 3.78Å; L159-I164 HydrophobicContact CD2-CG2 4.05Å; L159-I164 WeakPolarHBondContact O-CA 3.27Å; L159-I164 WeakPolarHBondContact O-CB 3.32Å; L159-I164 PolarHBondContact O-N 2.87Å; L159-I164 VanDerWaalsContact O-O 3.11Å; L159-L166 HydrophobicContact CB-CD1 4.5Å; L159-L166 HydrophobicContact CB-CG 4.35Å; L159-L166 HydrophobicContact CD1-CD1 3.27Å; L159-L166 HydrophobicContact CD1-CG 3.95Å; L159-L166 HydrophobicContact CG-CD1 4.45Å; L159-I174 HydrophobicContact CD1-CD1 4.44Å; L159-I207 HydrophobicContact CD2-CB 4.35Å; L159-I207 HydrophobicContact CD2-CD1 3.53Å; L159-I207 HydrophobicContact CD2-CG1 3.74Å; L159-I207 HydrophobicContact CD2-CG2 3.65Å; L159-I207 HydrophobicContact CG-CD1 4.44Å; L159-W210 HydrophobicContact CD1-CZ3 4.48Å; L159-L216 HydrophobicContact CD1-CD1 3.97Å; L159-L216 HydrophobicContact CD2-CD1 4.41Å
160	R	68.3	Low	73	Confident	142 Å²	142	57.1 Å²	57.1	54%	0.536	28%	0.28	S	S	.	.	H	α-helix	trans	-60.3	-40.1	174.1	-175.8	-176.4	-65.7	-166.4	-0.4	111.8	M156 Q157 L162 G163 I164	M156-R160 WeakPolarHBondContact O-CB 3.26Å; M156-R160 PolarHBondContact O-N 2.95Å; Q157-R160 PolarHBondContact O-N 3.38Å; R160-L162 PolarHBondContact O-N 2.86Å; R160-G163 WeakPolarHBondContact O-CA 3.21Å; R160-G163 PolarHBondContact O-N 2.8Å; R160-I164 WeakPolarHBondContact CA-O 3.15Å; R160-I164 PolarHBondContact N-O 3.32Å; R160-I164 VanDerWaalsContact N-O 3.15Å
161	D	61.9	Low	72.5	Confident	100 Å²	100	57.1 Å²	57.1	54%	0.535	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-26.3	176.7	-71.9	-2.5	0	0	0	112.4	R144 Q157 L159 G163	R144-D161 IonicContact CZ-OD2 3.15Å; R144-D161 IonicContact NH1-OD2 2.52Å; R144-D161 PolarHBondContact NH1-OD2 3.4Å; R144-D161 IonicContact NH2-OD2 2.86Å; R144-D161 PolarHBondContact NH2-OD2 3.45Å; Q157-D161 VanDerWaalsContact O-CG 3.32Å; Q157-D161 PolarHBondContact O-N 3.27Å; L159-D161 VanDerWaalsContact C-N 3.3Å; L159-D161 PolarHBondContact O-N 3.12Å; D161-G163 VanDerWaalsContact C-N 3.26Å
162	L	55.7	Low	72	Confident	68 Å²	68	58.1 Å²	58.1	36%	0.356	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	4.6	171.8	-62.2	170.2	0	0	0	112.8	S158 L159 R160 I203 I207	S158-L162 WeakPolarHBondContact O-CG 3.37Å; S158-L162 PolarHBondContact O-N 3.3Å; L159-L162 CarbonylContact O-C 3.09Å; L159-L162 WeakPolarHBondContact O-CA 3.33Å; L159-L162 WeakPolarHBondContact O-CB 3.46Å; L159-L162 PolarHBondContact O-N 3.33Å; R160-L162 PolarHBondContact O-N 2.86Å; L162-I203 HydrophobicContact CD1-CG2 3.6Å; L162-I207 HydrophobicContact CD1-CD1 3.23Å
163	G	48.8	Very low	71.4	Confident	13 Å²	13	62.3 Å²	62.3	13%	0.134	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	15.8	179.3	0	0	0	0	0	114.4	L159 R160 D161 M332	L159-G163 PolarHBondContact O-N 2.99Å; L159-G163 VanDerWaalsContact O-N 3.17Å; R160-G163 WeakPolarHBondContact O-CA 3.21Å; R160-G163 PolarHBondContact O-N 2.8Å; D161-G163 VanDerWaalsContact C-N 3.26Å; G163-M332 WeakPolarHBondContact O-CB 2.93Å; G163-M332 WeakPolarHBondContact O-CE 3.48Å; G163-M332 VanDerWaalsContact O-SD 3.4Å
164	I	56.8	Low	70.9	Confident	32 Å²	32	56.8 Å²	56.8	16%	0.164	28%	0.275	C	S	.	.			trans	-101.5	115.6	176.1	-65.8	167.1	0	0	0	108.7	L159 R160 L166 I207 V218	L159-I164 CarbonylContact C-O 3.59Å; L159-I164 HydrophobicContact CB-CB 4.13Å; L159-I164 HydrophobicContact CB-CG2 4.24Å; L159-I164 HydrophobicContact CD2-CB 4.04Å; L159-I164 HydrophobicContact CD2-CD1 3.78Å; L159-I164 HydrophobicContact CD2-CG2 4.05Å; L159-I164 WeakPolarHBondContact O-CA 3.27Å; L159-I164 WeakPolarHBondContact O-CB 3.32Å; L159-I164 PolarHBondContact O-N 2.87Å; L159-I164 VanDerWaalsContact O-O 3.11Å; R160-I164 WeakPolarHBondContact CA-O 3.15Å; R160-I164 PolarHBondContact N-O 3.32Å; R160-I164 VanDerWaalsContact N-O 3.15Å; I164-L166 HydrophobicContact CG2-CD2 3.65Å; I164-L166 HydrophobicContact CG2-CG 4.23Å; I164-I207 HydrophobicContact CD1-CG2 3.61Å; I164-V218 HydrophobicContact CG2-CG2 3.82Å
165	H	60.7	Low	70.6	Confident	129 Å²	129	56.8 Å²	56.8	60%	0.597	28%	0.275	S	S	*	.			trans	-92.4	110.3	176.4	-68.6	-69.1	0	0	0	110.2
166	L	63.3	Low	70.4	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.089	30%	0.303	C	S	.	.			trans	-96.3	147.5	171.4	-60.6	-164.4	0	0	0	111.6	I155 M156 L159 I164 Q170 A171 I174 L216	I155-L166 HydrophobicContact CG2-CD1 4.15Å; M156-L166 WeakPolarHBondContact CE-O 3.3Å; M156-L166 HydrophobicContact CG-CB 4.3Å; L159-L166 HydrophobicContact CB-CD1 4.5Å; L159-L166 HydrophobicContact CB-CG 4.35Å; L159-L166 HydrophobicContact CD1-CD1 3.27Å; L159-L166 HydrophobicContact CD1-CG 3.95Å; L159-L166 HydrophobicContact CG-CD1 4.45Å; I164-L166 HydrophobicContact CG2-CD2 3.65Å; I164-L166 HydrophobicContact CG2-CG 4.23Å; L166-Q170 HydrophobicContact CB-CB 4.41Å; L166-A171 HydrophobicContact CD1-CB 4.36Å; L166-I174 HydrophobicContact CD1-CD1 3.77Å; L166-L216 HydrophobicContact CD1-CD1 4.07Å; L166-L216 HydrophobicContact CD1-CD2 3.67Å; L166-L216 HydrophobicContact CD1-CG 4.47Å; L166-L216 HydrophobicContact CD2-CD1 4.03Å; L166-L216 HydrophobicContact CD2-CD2 3.09Å; L166-L216 HydrophobicContact CD2-CG 4.12Å; L166-L216 HydrophobicContact CG-CD2 3.98Å
167	T	75.2	Confident	70.1	Confident	68 Å²	68	64.7 Å²	64.7	42%	0.417	31%	0.31	S	S	.	.			trans	-74.6	158.2	158	67.4	0	0	0	0	109.8	E169 Q170 A171	T167-E169 VanDerWaalsContact C-N 3.25Å; T167-E169 PolarHBondContact O-N 3.39Å; T167-Q170 PolarHBondContact O-N 2.96Å; T167-Q170 VanDerWaalsContact OG1-CG 3.27Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.43Å; T167-Q170 PolarHBondContact OG1-N 3.43Å; T167-Q170 PolarHBondContact OG1-OE1 3.25Å; T167-A171 PolarHBondContact O-N 2.91Å; T167-A171 VanDerWaalsContact O-N 3.14Å
168	E	77.8	Confident	70	Confident	107 Å²	107	60 Å²	60	50%	0.5	29%	0.288	S	S	.	.	H	α-helix	trans	-59.6	-40	175.4	-172.3	165.8	-157.6	0	0	111.3	M156 Q170 A171 E172	M156-E168 HydrophobicContact CE-CB 4.41Å; M156-E168 HydrophobicContact SD-CB 4.04Å; M156-E168 HydrophobicContact SD-CG 4.36Å; E168-Q170 VanDerWaalsContact C-N 3.32Å; E168-Q170 PolarHBondContact O-N 3.49Å; E168-A171 PolarHBondContact O-N 3.3Å; E168-A171 VanDerWaalsContact O-N 3.15Å; E168-E172 WeakPolarHBondContact O-CG 3.18Å; E168-E172 PolarHBondContact O-N 2.86Å
169	E	73.4	Confident	70.4	Confident	144 Å²	144	60.5 Å²	60.5	67%	0.673	29%	0.29	S	S	*	.	H	α-helix	trans	-57.3	-41.5	174.7	-63.1	169.3	177	0	0	112.7	T167 E172 E173	T167-E169 VanDerWaalsContact C-N 3.25Å; T167-E169 PolarHBondContact O-N 3.39Å; E169-E172 PolarHBondContact O-N 3.37Å; E169-E173 PolarHBondContact O-N 3.45Å
170	Q	69.8	Low	70.7	Confident	57 Å²	57	65.7 Å²	65.7	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-69	-38.9	177.4	-73.4	172.2	-41.1	0	0	111.9	L166 T167 E168 E173 I174 L216	L166-Q170 HydrophobicContact CB-CB 4.41Å; T167-Q170 PolarHBondContact O-N 2.96Å; T167-Q170 VanDerWaalsContact OG1-CG 3.27Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.43Å; T167-Q170 PolarHBondContact OG1-N 3.43Å; T167-Q170 PolarHBondContact OG1-OE1 3.25Å; E168-Q170 VanDerWaalsContact C-N 3.32Å; E168-Q170 PolarHBondContact O-N 3.49Å; Q170-E173 PolarHBondContact O-N 3.44Å; Q170-I174 WeakPolarHBondContact O-CG1 3.21Å; Q170-I174 PolarHBondContact O-N 2.88Å; Q170-I174 VanDerWaalsContact O-N 3.16Å; Q170-L216 HydrophobicContact CB-CD2 4.23Å
171	A	77.4	Confident	71.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.3	-38.4	176	0	0	0	0	0	111.6	I155 M156 L166 T167 E168 E173 I174 L175	I155-A171 HydrophobicContact CB-CB 4.5Å; I155-A171 HydrophobicContact CG2-CB 4.14Å; M156-A171 HydrophobicContact CG-CB 3.51Å; M156-A171 HydrophobicContact SD-CB 4.21Å; L166-A171 HydrophobicContact CD1-CB 4.36Å; T167-A171 PolarHBondContact O-N 2.91Å; T167-A171 VanDerWaalsContact O-N 3.14Å; E168-A171 PolarHBondContact O-N 3.3Å; E168-A171 VanDerWaalsContact O-N 3.15Å; A171-E173 VanDerWaalsContact C-N 3.33Å; A171-E173 PolarHBondContact O-N 3.12Å; A171-I174 WeakPolarHBondContact O-CB 3.4Å; A171-I174 PolarHBondContact O-N 2.83Å; A171-L175 WeakPolarHBondContact O-CG 3.29Å; A171-L175 PolarHBondContact O-N 3.44Å
172	E	79.9	Confident	71.7	Confident	54 Å²	54	61 Å²	61	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-37.5	172.2	-76.9	-170.3	-162.3	0	0	113.1	E168 E169 L175 R176 M184	E168-E172 WeakPolarHBondContact O-CG 3.18Å; E168-E172 PolarHBondContact O-N 2.86Å; E169-E172 PolarHBondContact O-N 3.37Å; E172-L175 WeakPolarHBondContact O-CB 3.33Å; E172-L175 PolarHBondContact O-N 2.98Å; E172-R176 VanDerWaalsContact O-CG 3.3Å; E172-R176 WeakPolarHBondContact O-CG 3.27Å; E172-R176 PolarHBondContact O-N 3.39Å; E172-R176 IonicContact OE2-CZ 3.63Å; E172-R176 IonicContact OE2-NH2 3.31Å; E172-R176 PolarHBondContact OE2-NH2 3.14Å; E172-M184 HydrophobicContact CB-CE 3.77Å; E172-M184 HydrophobicContact CG-CE 3.53Å
173	E	74.2	Confident	73	Confident	107 Å²	107	60.8 Å²	60.8	50%	0.5	31%	0.314	S	S	.	.	H	α-helix	trans	-66.3	-39.4	177	-169.2	169.7	-161.1	0	0	111.9	E169 Q170 A171 R176 S177 I215	E169-E173 PolarHBondContact O-N 3.45Å; Q170-E173 PolarHBondContact O-N 3.44Å; A171-E173 VanDerWaalsContact C-N 3.33Å; A171-E173 PolarHBondContact O-N 3.12Å; E173-R176 PolarHBondContact O-N 3.42Å; E173-S177 PolarHBondContact O-N 3.1Å; E173-S177 VanDerWaalsContact O-N 3.08Å; E173-I215 HydrophobicContact CB-CG2 4.16Å; E173-I215 HydrophobicContact CG-CG2 4.05Å
174	I	74.6	Confident	74.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-49.1	171.5	-65	168.4	0	0	0	110.1	I155 L159 L166 Q170 A171 S177 M178 W210 I215 L216	I155-I174 HydrophobicContact CD1-CG2 3.99Å; I155-I174 HydrophobicContact CG2-CD1 3.98Å; L159-I174 HydrophobicContact CD1-CD1 4.44Å; L166-I174 HydrophobicContact CD1-CD1 3.77Å; Q170-I174 WeakPolarHBondContact O-CG1 3.21Å; Q170-I174 PolarHBondContact O-N 2.88Å; Q170-I174 VanDerWaalsContact O-N 3.16Å; A171-I174 WeakPolarHBondContact O-CB 3.4Å; A171-I174 PolarHBondContact O-N 2.83Å; I174-S177 WeakPolarHBondContact O-CB 3.44Å; I174-S177 PolarHBondContact O-N 3.2Å; I174-S177 PolarHBondContact O-OG 2.89Å; I174-M178 HydrophobicContact CG2-CE 3.37Å; I174-M178 WeakPolarHBondContact O-CE 3.38Å; I174-W210 HydrophobicContact CD1-CE3 4.38Å; I174-W210 HydrophobicContact CG2-CD2 4.19Å; I174-W210 HydrophobicContact CG2-CE3 4.4Å; I174-W210 HydrophobicContact CG2-CH2 4.43Å; I174-W210 HydrophobicContact CG2-CZ2 4.21Å; I174-I215 HydrophobicContact CB-CG2 4.29Å; I174-I215 HydrophobicContact CD1-CG2 4.4Å; I174-I215 HydrophobicContact CG1-CB 4.3Å; I174-I215 HydrophobicContact CG1-CG2 3.32Å; I174-L216 HydrophobicContact CD1-CD1 3.63Å; I174-L216 HydrophobicContact CD1-CD2 3.84Å; I174-L216 HydrophobicContact CD1-CG 3.74Å; I174-L216 HydrophobicContact CG1-CG 4.4Å
175	L	82	Confident	76	Confident	1 Å²	1	63 Å²	63	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-51.8	177.6	-68.5	171.4	0	0	0	111.1	I150 I155 A171 E172 S177 M178 D179 M184 I186	I150-L175 WeakPolarHBondContact O-CD2 3.34Å; I155-L175 HydrophobicContact CD1-CD2 3.4Å; I155-L175 HydrophobicContact CD1-CG 3.78Å; A171-L175 WeakPolarHBondContact O-CG 3.29Å; A171-L175 PolarHBondContact O-N 3.44Å; E172-L175 WeakPolarHBondContact O-CB 3.33Å; E172-L175 PolarHBondContact O-N 2.98Å; L175-S177 PolarHBondContact O-N 3.42Å; L175-S177 VanDerWaalsContact O-N 3.09Å; L175-M178 PolarHBondContact O-N 2.94Å; L175-D179 WeakPolarHBondContact O-CB 3.25Å; L175-D179 PolarHBondContact O-N 2.93Å; L175-M184 WeakPolarHBondContact CD1-O 3.5Å; L175-I186 HydrophobicContact CD2-CD1 4.4Å; L175-I186 HydrophobicContact CD2-CG1 3.62Å
176	R	79.6	Confident	77.3	Confident	158 Å²	158	56.9 Å²	56.9	60%	0.596	29%	0.294	S	S	*	.	H	α-helix	trans	-59.1	-26.3	-179.5	-71.8	177.3	-159.3	-168.9	11.3	113.7	E172 E173 M178 M184	E172-R176 VanDerWaalsContact O-CG 3.3Å; E172-R176 WeakPolarHBondContact O-CG 3.27Å; E172-R176 PolarHBondContact O-N 3.39Å; E172-R176 IonicContact OE2-CZ 3.63Å; E172-R176 IonicContact OE2-NH2 3.31Å; E172-R176 PolarHBondContact OE2-NH2 3.14Å; E173-R176 PolarHBondContact O-N 3.42Å; R176-M178 VanDerWaalsContact C-N 3.27Å; R176-M184 HydrophobicContact CG-CE 4.39Å; R176-M184 HydrophobicContact CG-SD 3.68Å
177	S	71.6	Confident	78.5	Confident	45 Å²	45	57.8 Å²	57.8	32%	0.315	30%	0.299	S	S	.	.	H	α-helix	trans	-71	-24.7	176.6	80.1	0	0	0	0	113.2	E173 I174 L175 Y194	E173-S177 PolarHBondContact O-N 3.1Å; E173-S177 VanDerWaalsContact O-N 3.08Å; I174-S177 WeakPolarHBondContact O-CB 3.44Å; I174-S177 PolarHBondContact O-N 3.2Å; I174-S177 PolarHBondContact O-OG 2.89Å; L175-S177 PolarHBondContact O-N 3.42Å; L175-S177 VanDerWaalsContact O-N 3.09Å; S177-Y194 WeakPolarHBondContact O-CE2 3.32Å
178	M	78	Confident	78.9	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.02	29%	0.286	C	S	.	.	H	α-helix	trans	-107.9	-31.5	-177	-65.5	-176.1	-79.9	0	0	112.8	I174 L175 R176 K180 I186 W191 Y194 H195 W210	I174-M178 HydrophobicContact CG2-CE 3.37Å; I174-M178 WeakPolarHBondContact O-CE 3.38Å; L175-M178 PolarHBondContact O-N 2.94Å; R176-M178 VanDerWaalsContact C-N 3.27Å; M178-K180 PolarHBondContact O-N 3.39Å; M178-I186 HydrophobicContact CB-CD1 3.49Å; M178-I186 VanDerWaalsContact CB-CD1 3.49Å; M178-I186 HydrophobicContact CB-CG1 4.06Å; M178-I186 HydrophobicContact CE-CG1 4.32Å; M178-W191 HydrophobicContact SD-CE3 4.21Å; M178-W191 HydrophobicContact SD-CZ3 4.21Å; M178-Y194 HydrophobicContact CB-CD2 4.17Å; M178-Y194 HydrophobicContact CB-CG 4.35Å; M178-Y194 HydrophobicContact CG-CD1 3.76Å; M178-Y194 HydrophobicContact CG-CD2 3.56Å; M178-Y194 HydrophobicContact CG-CE1 3.89Å; M178-Y194 HydrophobicContact CG-CE2 3.69Å; M178-Y194 HydrophobicContact CG-CG 3.58Å; M178-Y194 HydrophobicContact SD-CD1 3.97Å; M178-Y194 HydrophobicContact SD-CE1 4.21Å; M178-Y194 HydrophobicContact SD-CG 4.25Å; M178-H195 VanDerWaalsContact SD-CE1 3.6Å; M178-W210 HydrophobicContact CE-CZ2 3.9Å; M178-W210 HydrophobicContact SD-CZ2 4.22Å
179	D	80.6	Confident	78.9	Confident	21 Å²	21	55 Å²	55	11%	0.112	28%	0.282	C	S	.	.			trans	-69.5	110.1	-177	178.2	10.4	0	0	0	110.1	L175 N181 G182 T183 M184 I186	L175-D179 WeakPolarHBondContact O-CB 3.25Å; L175-D179 PolarHBondContact O-N 2.93Å; D179-N181 PolarHBondContact OD1-N 2.8Å; D179-N181 PolarHBondContact OD1-OD1 2.9Å; D179-G182 WeakPolarHBondContact OD1-CA 3.37Å; D179-G182 PolarHBondContact OD1-N 3.05Å; D179-G182 VanDerWaalsContact OD2-CA 3.22Å; D179-G182 WeakPolarHBondContact OD2-CA 3.49Å; D179-T183 PolarHBondContact OD1-N 3.07Å; D179-T183 PolarHBondContact OD2-N 2.97Å; D179-M184 WeakPolarHBondContact OD2-CA 3.24Å; D179-M184 PolarHBondContact OD2-N 3.3Å; D179-I186 VanDerWaalsContact CA-CD1 3.5Å; D179-I186 HydrophobicContact CB-CD1 3.64Å
180	K	74.9	Confident	79.4	Confident	113 Å²	113	48.5 Å²	48.5	49%	0.491	25%	0.252	S	S	.	.	S	Bend	trans	-93.1	-29.7	-179.9	-67.6	179.8	-175.4	169.5	0	111.2	M178 E190 D193	M178-K180 PolarHBondContact O-N 3.39Å; K180-E190 PolarHBondContact N-OE1 3.42Å; K180-D193 IonicContact NZ-OD2 2.96Å; K180-D193 PolarHBondContact NZ-OD2 3.44Å; K180-D193 VanDerWaalsContact NZ-OD2 3.15Å
181	N	76.2	Confident	80	Confident	82 Å²	82	45.8 Å²	45.8	44%	0.439	24%	0.24	S	C	.	.	S	Bend	trans	-92.4	-6.5	-174.1	63.6	30.2	0	0	0	113.3	D179 T183 E190	D179-N181 PolarHBondContact OD1-N 2.8Å; D179-N181 PolarHBondContact OD1-OD1 2.9Å; N181-T183 VanDerWaalsContact C-N 3.35Å; N181-T183 HydrophobicContact CB-CG2 4.42Å; N181-T183 WeakPolarHBondContact OD1-CB 3.47Å; N181-T183 WeakPolarHBondContact OD1-CG2 3.4Å; N181-T183 PolarHBondContact OD1-N 3.06Å; N181-T183 PolarHBondContact OD1-OG1 3.46Å; N181-E190 PolarHBondContact N-OE1 3.05Å; N181-E190 VanDerWaalsContact N-OE1 3.13Å; N181-E190 PolarHBondContact ND2-OE1 3.08Å; N181-E190 VanDerWaalsContact ND2-OE1 3.1Å; N181-E190 PolarHBondContact OD1-OE1 2.79Å
182	G	75.6	Confident	80.3	Confident	61 Å²	61	46.7 Å²	46.7	63%	0.629	24%	0.243	S	C	*	.	S	Bend	trans	75	22.3	177.5	0	0	0	0	0	113.5	D179 M184	D179-G182 WeakPolarHBondContact OD1-CA 3.37Å; D179-G182 PolarHBondContact OD1-N 3.05Å; D179-G182 VanDerWaalsContact OD2-CA 3.22Å; D179-G182 WeakPolarHBondContact OD2-CA 3.49Å; G182-M184 VanDerWaalsContact C-N 3.29Å
183	T	82.4	Confident	80.1	Confident	63 Å²	63	45.1 Å²	45.1	39%	0.387	24%	0.236	S	C	.	.	S	Bend	trans	-81.1	-7.6	-177.8	59.5	0	0	0	0	113.8	D179 N181 T185	D179-T183 PolarHBondContact OD1-N 3.07Å; D179-T183 PolarHBondContact OD2-N 2.97Å; N181-T183 VanDerWaalsContact C-N 3.35Å; N181-T183 HydrophobicContact CB-CG2 4.42Å; N181-T183 WeakPolarHBondContact OD1-CB 3.47Å; N181-T183 WeakPolarHBondContact OD1-CG2 3.4Å; N181-T183 PolarHBondContact OD1-N 3.06Å; N181-T183 PolarHBondContact OD1-OG1 3.46Å; T183-T185 PolarHBondContact O-N 2.86Å; T183-T185 PolarHBondContact OG1-O 3.5Å; T183-T185 VanDerWaalsContact OG1-O 3.04Å; T183-T185 PolarHBondContact OG1-OG1 3.25Å
184	M	83.4	Confident	80.2	Confident	63 Å²	63	43.5 Å²	43.5	31%	0.31	23%	0.226	S	C	.	.	S	Bend	trans	55.7	26.6	-171.1	-67.2	-69.3	-68.6	0	0	112.8	E172 L175 R176 D179 G182	E172-M184 HydrophobicContact CB-CE 3.77Å; E172-M184 HydrophobicContact CG-CE 3.53Å; L175-M184 WeakPolarHBondContact CD1-O 3.5Å; R176-M184 HydrophobicContact CG-CE 4.39Å; R176-M184 HydrophobicContact CG-SD 3.68Å; D179-M184 WeakPolarHBondContact OD2-CA 3.24Å; D179-M184 PolarHBondContact OD2-N 3.3Å; G182-M184 VanDerWaalsContact C-N 3.29Å
185	T	86.3	Confident	80.4	Confident	29 Å²	29	43.5 Å²	43.5	18%	0.178	23%	0.226	C	C	.	.	S	Bend	trans	-141.6	147.3	173.7	61.2	0	0	0	0	108	R149 I150 D151 T183	R149-T185 PolarHBondContact NH1-OG1 3.45Å; R149-T185 VanDerWaalsContact NH1-OG1 3.09Å; I150-T185 CarbonylContact O-C 3.58Å; I150-T185 WeakPolarHBondContact O-CA 3.41Å; D151-T185 HydrophobicContact CB-CG2 4.26Å; T183-T185 PolarHBondContact O-N 2.86Å; T183-T185 PolarHBondContact OG1-O 3.5Å; T183-T185 VanDerWaalsContact OG1-O 3.04Å; T183-T185 PolarHBondContact OG1-OG1 3.25Å
186	I	87.4	Confident	80.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.9	179.2	-56.6	-55.6	0	0	0	109.9	R149 I150 L175 M178 D179 E190 W191	R149-I186 CarbonylContact C-O 3.5Å; R149-I186 WeakPolarHBondContact CA-O 3.43Å; I150-I186 HydrophobicContact CB-CB 4.33Å; I150-I186 PolarHBondContact N-O 3.03Å; I150-I186 PolarHBondContact O-N 3.12Å; L175-I186 HydrophobicContact CD2-CD1 4.4Å; L175-I186 HydrophobicContact CD2-CG1 3.62Å; M178-I186 HydrophobicContact CB-CD1 3.49Å; M178-I186 VanDerWaalsContact CB-CD1 3.49Å; M178-I186 HydrophobicContact CB-CG1 4.06Å; M178-I186 HydrophobicContact CE-CG1 4.32Å; D179-I186 VanDerWaalsContact CA-CD1 3.5Å; D179-I186 HydrophobicContact CB-CD1 3.64Å; I186-E190 HydrophobicContact CG2-CB 3.95Å; I186-W191 HydrophobicContact CG2-CB 3.87Å; I186-W191 HydrophobicContact CG2-CE3 4.3Å
187	D	87.4	Confident	79.6	Confident	36 Å²	36	37 Å²	37	19%	0.193	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	176.8	170.7	69.1	39.3	0	0	0	112.3	D189 E190 W191	D187-D189 VanDerWaalsContact C-N 3.31Å; D187-D189 PolarHBondContact O-N 2.87Å; D187-D189 WeakPolarHBondContact OD1-CA 3.35Å; D187-D189 PolarHBondContact OD1-N 3.36Å; D187-E190 PolarHBondContact N-OE2 3.42Å; D187-E190 PolarHBondContact OD1-N 3.34Å; D187-W191 VanDerWaalsContact O-CB 3.3Å; D187-W191 WeakPolarHBondContact O-CB 3.45Å; D187-W191 PolarHBondContact O-N 2.65Å
188	W	84.1	Confident	79.4	Confident	35 Å²	35	35.5 Å²	35.5	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-38	-179.3	171.2	-116.8	0	0	0	113.5	L135 R136 F139 W191 R192	L135-W188 HydrophobicContact CB-CH2 4.2Å; L135-W188 HydrophobicContact CB-CZ3 4.45Å; R136-W188 VanDerWaalsContact CA-CZ3 3.41Å; R136-W188 HydrophobicContact CB-CH2 3.57Å; R136-W188 HydrophobicContact CB-CZ2 4.2Å; R136-W188 HydrophobicContact CB-CZ3 3.88Å; R136-W188 VanDerWaalsContact CD-CE3 3.46Å; R136-W188 VanDerWaalsContact CD-CZ3 3.44Å; R136-W188 HydrophobicContact CG-CH2 4.17Å; R136-W188 HydrophobicContact CG-CZ2 4.47Å; R136-W188 HydrophobicContact CG-CZ3 4.28Å; R136-W188 VanDerWaalsContact NH1-CB 3.34Å; F139-W188 HydrophobicContact CB-CE3 3.97Å; F139-W188 HydrophobicContact CB-CZ3 3.96Å; F139-W188 HydrophobicContact CD1-CE3 4.35Å; F139-W188 HydrophobicContact CD2-CE3 4.13Å; F139-W188 AromaticContact CG-CE3 3.88Å; F139-W188 HydrophobicContact CG-CE3 3.88Å; F139-W188 HydrophobicContact CG-CZ3 4.38Å; F139-W188 HydrophobicContact CZ-CB 4.46Å; W188-W191 AromaticContact CZ3-CD1 3.67Å; W188-R192 HydrophobicContact CH2-CB 4.38Å; W188-R192 HydrophobicContact CZ2-CB 4.16Å; W188-R192 HydrophobicContact CZ2-CG 4.36Å; W188-R192 VanDerWaalsContact O-CB 3.22Å; W188-R192 WeakPolarHBondContact O-CB 3.29Å; W188-R192 PolarHBondContact O-N 3.19Å
189	D	79.3	Confident	78.5	Confident	80 Å²	80	36.3 Å²	36.3	43%	0.428	20%	0.197	S	C	.	.	H	α-helix	trans	-72.2	-41.5	-175.9	-74.5	-58.4	0	0	0	110.5	D187 R192 D193	D187-D189 VanDerWaalsContact C-N 3.31Å; D187-D189 PolarHBondContact O-N 2.87Å; D187-D189 WeakPolarHBondContact OD1-CA 3.35Å; D187-D189 PolarHBondContact OD1-N 3.36Å; D189-R192 IonicContact OD1-CZ 2.69Å; D189-R192 IonicContact OD1-NH1 3.82Å; D189-R192 PolarHBondContact OD1-NH1 3.38Å; D189-R192 IonicContact OD1-NH2 3.15Å; D189-R192 PolarHBondContact OD1-NH2 2.91Å; D189-D193 VanDerWaalsContact O-CB 3.29Å; D189-D193 WeakPolarHBondContact O-CB 3.24Å; D189-D193 PolarHBondContact O-N 3.29Å
190	E	82.1	Confident	77.6	Confident	9 Å²	9	35.4 Å²	35.4	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-45.5	172.6	-69.7	178.3	142.3	0	0	111.7	K180 N181 I186 D187 Y194	K180-E190 PolarHBondContact N-OE1 3.42Å; N181-E190 PolarHBondContact N-OE1 3.05Å; N181-E190 VanDerWaalsContact N-OE1 3.13Å; N181-E190 PolarHBondContact ND2-OE1 3.08Å; N181-E190 VanDerWaalsContact ND2-OE1 3.1Å; N181-E190 PolarHBondContact OD1-OE1 2.79Å; I186-E190 HydrophobicContact CG2-CB 3.95Å; D187-E190 PolarHBondContact N-OE2 3.42Å; D187-E190 PolarHBondContact OD1-N 3.34Å; E190-Y194 WeakPolarHBondContact O-CB 3.41Å; E190-Y194 PolarHBondContact O-N 3.19Å; E190-Y194 VanDerWaalsContact O-N 3.08Å
191	W	83.5	Confident	77.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-48.4	176.6	179.3	-93.1	0	0	0	112.6	L135 V138 F139 L142 I150 M178 I186 D187 W188 H195 I206 W210	L135-W191 PolarHBondContact O-NE1 3.18Å; V138-W191 HydrophobicContact CB-CZ2 4.28Å; V138-W191 HydrophobicContact CG1-CH2 4.21Å; V138-W191 HydrophobicContact CG1-CZ2 3.56Å; F139-W191 HydrophobicContact CB-CG 4.36Å; F139-W191 HydrophobicContact CD2-CB 3.6Å; F139-W191 AromaticContact CD2-CD1 3.85Å; F139-W191 AromaticContact CD2-CD2 3.92Å; F139-W191 HydrophobicContact CD2-CD2 3.92Å; F139-W191 HydrophobicContact CD2-CE3 4.48Å; F139-W191 AromaticContact CD2-CG 3.49Å; F139-W191 HydrophobicContact CD2-CG 3.49Å; F139-W191 VanDerWaalsContact CD2-CG 3.49Å; F139-W191 HydrophobicContact CE2-CB 3.92Å; F139-W191 HydrophobicContact CE2-CG 4.27Å; F139-W191 HydrophobicContact CG-CG 4.38Å; L142-W191 HydrophobicContact CD1-CH2 3.31Å; L142-W191 HydrophobicContact CD1-CZ2 3.98Å; L142-W191 HydrophobicContact CD1-CZ3 3.76Å; I150-W191 HydrophobicContact CD1-CD2 4.33Å; I150-W191 HydrophobicContact CD1-CE3 3.82Å; I150-W191 HydrophobicContact CD1-CZ3 4.08Å; M178-W191 HydrophobicContact SD-CE3 4.21Å; M178-W191 HydrophobicContact SD-CZ3 4.21Å; I186-W191 HydrophobicContact CG2-CB 3.87Å; I186-W191 HydrophobicContact CG2-CE3 4.3Å; D187-W191 VanDerWaalsContact O-CB 3.3Å; D187-W191 WeakPolarHBondContact O-CB 3.45Å; D187-W191 PolarHBondContact O-N 2.65Å; W188-W191 AromaticContact CZ3-CD1 3.67Å; W191-H195 AromaticContact CD2-ND1 3.9Å; W191-H195 AromaticContact CE2-ND1 3.91Å; W191-H195 AromaticContact CE3-CE1 3.86Å; W191-H195 AromaticContact CH2-CE1 3.78Å; W191-H195 AromaticContact CZ2-CE1 3.95Å; W191-H195 AromaticContact CZ3-CE1 3.75Å; W191-H195 PolarHBondContact O-N 2.76Å; W191-H195 PolarHBondContact O-ND1 3.23Å; W191-I206 HydrophobicContact CH2-CG2 4.1Å; W191-I206 HydrophobicContact CZ2-CD1 3.96Å; W191-W210 AromaticContact CH2-CH2 3.9Å; W191-W210 HydrophobicContact CH2-CH2 3.9Å; W191-W210 AromaticContact CH2-CZ2 3.79Å; W191-W210 HydrophobicContact CH2-CZ2 3.79Å; W191-W210 AromaticContact CZ3-CH2 3.98Å; W191-W210 HydrophobicContact CZ3-CH2 3.98Å; W191-W210 AromaticContact CZ3-CZ2 3.76Å; W191-W210 HydrophobicContact CZ3-CZ2 3.76Å
192	R	82.6	Confident	76.5	Confident	18 Å²	18	31 Å²	31	7%	0.068	17%	0.174	C	C	.	.	H	α-helix	trans	-59	-56.2	178.3	178	-163.2	64.2	-136.2	-12.3	109.3	E132 W188 D189 Y194 H195 L196	E132-R192 HydrophobicContact CG-CG 4.27Å; W188-R192 HydrophobicContact CH2-CB 4.38Å; W188-R192 HydrophobicContact CZ2-CB 4.16Å; W188-R192 HydrophobicContact CZ2-CG 4.36Å; W188-R192 VanDerWaalsContact O-CB 3.22Å; W188-R192 WeakPolarHBondContact O-CB 3.29Å; W188-R192 PolarHBondContact O-N 3.19Å; D189-R192 IonicContact OD1-CZ 2.69Å; D189-R192 IonicContact OD1-NH1 3.82Å; D189-R192 PolarHBondContact OD1-NH1 3.38Å; D189-R192 IonicContact OD1-NH2 3.15Å; D189-R192 PolarHBondContact OD1-NH2 2.91Å; R192-Y194 VanDerWaalsContact C-N 3.26Å; R192-Y194 PolarHBondContact O-N 3.48Å; R192-H195 PolarHBondContact O-N 2.86Å; R192-H195 VanDerWaalsContact O-N 3.12Å; R192-L196 HydrophobicContact CG-CD1 4.49Å; R192-L196 WeakPolarHBondContact O-CA 3.43Å; R192-L196 VanDerWaalsContact O-CB 3.23Å; R192-L196 WeakPolarHBondContact O-CB 3.23Å; R192-L196 PolarHBondContact O-N 3.28Å
193	D	75.6	Confident	75.9	Confident	21 Å²	21	30.3 Å²	30.3	11%	0.112	16%	0.155	C	C	.	.	H	α-helix	trans	-62.2	-35	-172.3	-71.8	1.7	0	0	0	112.4	F14 K180 D189	F14-D193 WeakPolarHBondContact CB-OD2 3.26Å; F14-D193 WeakPolarHBondContact CD1-OD1 3.38Å; K180-D193 IonicContact NZ-OD2 2.96Å; K180-D193 PolarHBondContact NZ-OD2 3.44Å; K180-D193 VanDerWaalsContact NZ-OD2 3.15Å; D189-D193 VanDerWaalsContact O-CB 3.29Å; D189-D193 WeakPolarHBondContact O-CB 3.24Å; D189-D193 PolarHBondContact O-N 3.29Å
194	Y	76.9	Confident	74.8	Confident	73 Å²	73	29.6 Å²	29.6	29%	0.286	15%	0.152	S	C	.	.	H	α-helix	trans	-68.7	-37.9	177.4	-171.5	-88.3	0	0	0	112.5	S177 M178 E190 R192	S177-Y194 WeakPolarHBondContact O-CE2 3.32Å; M178-Y194 HydrophobicContact CB-CD2 4.17Å; M178-Y194 HydrophobicContact CB-CG 4.35Å; M178-Y194 HydrophobicContact CG-CD1 3.76Å; M178-Y194 HydrophobicContact CG-CD2 3.56Å; M178-Y194 HydrophobicContact CG-CE1 3.89Å; M178-Y194 HydrophobicContact CG-CE2 3.69Å; M178-Y194 HydrophobicContact CG-CG 3.58Å; M178-Y194 HydrophobicContact SD-CD1 3.97Å; M178-Y194 HydrophobicContact SD-CE1 4.21Å; M178-Y194 HydrophobicContact SD-CG 4.25Å; E190-Y194 WeakPolarHBondContact O-CB 3.41Å; E190-Y194 PolarHBondContact O-N 3.19Å; E190-Y194 VanDerWaalsContact O-N 3.08Å; R192-Y194 VanDerWaalsContact C-N 3.26Å; R192-Y194 PolarHBondContact O-N 3.48Å
195	H	78.1	Confident	73.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-101.6	-8.9	-174.3	-64	91.8	0	0	0	115	H131 L135 M178 W191 R192 L197 H198 I206 W210	H131-H195 PolarHBondContact NE2-O 3.16Å; L135-H195 HydrophobicContact CD1-CB 3.78Å; L135-H195 HydrophobicContact CD2-CB 3.65Å; L135-H195 HydrophobicContact CG-CB 4.38Å; M178-H195 VanDerWaalsContact SD-CE1 3.6Å; W191-H195 AromaticContact CD2-ND1 3.9Å; W191-H195 AromaticContact CE2-ND1 3.91Å; W191-H195 AromaticContact CE3-CE1 3.86Å; W191-H195 AromaticContact CH2-CE1 3.78Å; W191-H195 AromaticContact CZ2-CE1 3.95Å; W191-H195 AromaticContact CZ3-CE1 3.75Å; W191-H195 PolarHBondContact O-N 2.76Å; W191-H195 PolarHBondContact O-ND1 3.23Å; R192-H195 PolarHBondContact O-N 2.86Å; R192-H195 VanDerWaalsContact O-N 3.12Å; H195-L197 VanDerWaalsContact C-N 3.29Å; H195-L197 PolarHBondContact O-N 3.29Å; H195-H198 WeakPolarHBondContact O-CA 3.41Å; H195-H198 VanDerWaalsContact O-CB 3.28Å; H195-H198 WeakPolarHBondContact O-CB 3.26Å; H195-H198 PolarHBondContact O-N 2.84Å; H195-I206 WeakPolarHBondContact NE2-CG2 3.11Å; H195-W210 AromaticContact NE2-NE1 3.81Å
196	L	77.1	Confident	72.9	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.021	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-39.4	-172.3	-173.8	64	0	0	0	112.9	F14 L128 H131 E132 R192 H198	F14-L196 HydrophobicContact CE1-CD2 3.73Å; F14-L196 HydrophobicContact CZ-CD2 4.05Å; L128-L196 HydrophobicContact CD2-CD1 4.2Å; L128-L196 HydrophobicContact CD2-CG 4.37Å; H131-L196 PolarHBondContact CD2-O 2.91Å; E132-L196 HydrophobicContact CG-CD1 3.53Å; R192-L196 HydrophobicContact CG-CD1 4.49Å; R192-L196 WeakPolarHBondContact O-CA 3.43Å; R192-L196 VanDerWaalsContact O-CB 3.23Å; R192-L196 WeakPolarHBondContact O-CB 3.23Å; R192-L196 PolarHBondContact O-N 3.28Å; L196-H198 VanDerWaalsContact C-N 3.33Å
197	L	69.4	Low	71.8	Confident	18 Å²	18	29.5 Å²	29.5	9%	0.094	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	15.1	176.8	-58.2	178.6	0	0	0	112.3	L71 L92 L95 R99 H195	L71-L197 HydrophobicContact CD2-CD2 4.23Å; L92-L197 HydrophobicContact CD2-CB 4.23Å; L92-L197 HydrophobicContact CD2-CD1 4.08Å; L92-L197 HydrophobicContact CD2-CD2 4.31Å; L92-L197 HydrophobicContact CD2-CG 4.45Å; L95-L197 HydrophobicContact CD1-CD1 4.05Å; R99-L197 PolarHBondContact NE-O 3.33Å; R99-L197 PolarHBondContact NH2-O 3.37Å; H195-L197 VanDerWaalsContact C-N 3.29Å; H195-L197 PolarHBondContact O-N 3.29Å
198	H	67.1	Low	70.3	Confident	15 Å²	15	31.7 Å²	31.7	7%	0.069	16%	0.16	C	C	.	.			trans	-103.1	126.8	175.6	-160.1	-73	0	0	0	110.4	R99 H131 H195 L196 A200 H209	R99-H198 PolarHBondContact NH1-CD2 3.04Å; R99-H198 PolarHBondContact NH1-NE2 3.43Å; R99-H198 PolarHBondContact NH2-CD2 3.44Å; H131-H198 PolarHBondContact CE1-O 3.37Å; H131-H198 PolarHBondContact NE2-O 2.92Å; H195-H198 WeakPolarHBondContact O-CA 3.41Å; H195-H198 VanDerWaalsContact O-CB 3.28Å; H195-H198 WeakPolarHBondContact O-CB 3.26Å; H195-H198 PolarHBondContact O-N 2.84Å; L196-H198 VanDerWaalsContact C-N 3.33Å; H198-A200 WeakPolarHBondContact ND1-CB 3.44Å; H198-A200 PolarHBondContact ND1-N 3.17Å; H198-A200 PolarHBondContact O-N 3.45Å; H198-H209 AromaticContact CD2-CD2 3.35Å; H198-H209 PolarHBondContact CD2-CD2 3.25Å; H198-H209 AromaticContact CD2-CE1 3.63Å; H198-H209 AromaticContact CD2-CG 3.78Å; H198-H209 AromaticContact CD2-ND1 3.95Å; H198-H209 AromaticContact CD2-NE2 3.21Å; H198-H209 PolarHBondContact CD2-NE2 3.34Å; H198-H209 AromaticContact CE1-CD2 3.52Å; H198-H209 AromaticContact CE1-CG 3.63Å; H198-H209 AromaticContact NE2-CD2 2.79Å; H198-H209 PolarHBondContact NE2-CD2 3.43Å; H198-H209 AromaticContact NE2-CE1 3.91Å; H198-H209 AromaticContact NE2-CG 3.34Å; H198-H209 VanDerWaalsContact NE2-CG 3.34Å; H198-H209 AromaticContact NE2-ND1 3.99Å; H198-H209 AromaticContact NE2-NE2 3.2Å; H198-H209 PolarHBondContact NE2-NE2 2.83Å
199	P	58.6	Low	69.3	Low	21 Å²	21	31.5 Å²	31.5	14%	0.136	16%	0.161	C	C	.	.			trans	-70.4	0.3	-177.7	29.9	-37.4	0	0	0	114.3	E103 D201	E103-P199 HydrophobicContact CB-CG 4.5Å; E103-P199 HydrophobicContact CG-CG 4.43Å; P199-D201 PolarHBondContact O-N 3.09Å
200	A	62.3	Low	68.5	Low	2 Å²	2	27.9 Å²	27.9	2%	0.017	14%	0.141	C	C	.	.			trans	-77.3	118.8	-177.3	0	0	0	0	0	108.8	H131 H198 E205 I206	H131-A200 PolarHBondContact CE1-O 3.38Å; H198-A200 WeakPolarHBondContact ND1-CB 3.44Å; H198-A200 PolarHBondContact ND1-N 3.17Å; H198-A200 PolarHBondContact O-N 3.45Å; A200-E205 WeakPolarHBondContact CA-OE2 3.49Å; A200-E205 HydrophobicContact CB-CB 3.69Å; A200-I206 HydrophobicContact CB-CB 4.47Å; A200-I206 HydrophobicContact CB-CG1 3.58Å
201	D	64.6	Low	67.3	Low	53 Å²	53	31.4 Å²	31.4	28%	0.283	16%	0.156	S	C	.	.			trans	-114.4	3.5	-171.1	78.5	-12.6	0	0	0	113.5	K134 P199 E205	K134-D201 HydrophobicContact CD-CB 3.79Å; K134-D201 IonicContact NZ-OD2 3.51Å; K134-D201 PolarHBondContact NZ-OD2 3.01Å; P199-D201 PolarHBondContact O-N 3.09Å; D201-E205 PolarHBondContact N-OE2 2.95Å
202	N	63	Low	65.6	Low	48 Å²	48	38.4 Å²	38.4	26%	0.257	19%	0.189	S	C	.	.	S	Bend	trans	-144.9	160.2	-179.6	60.8	71.2	0	0	0	112.1	P204 E205 I206	N202-P204 VanDerWaalsContact OD1-CD 3.24Å; N202-P204 WeakPolarHBondContact OD1-CD 3.43Å; N202-E205 PolarHBondContact ND2-OE1 2.86Å; N202-E205 PolarHBondContact O-N 3.09Å; N202-E205 WeakPolarHBondContact OD1-CB 3.25Å; N202-E205 WeakPolarHBondContact OD1-CG 3.17Å; N202-E205 PolarHBondContact OD1-N 3.49Å; N202-I206 WeakPolarHBondContact O-CG1 3.34Å; N202-I206 PolarHBondContact O-N 3.33Å
203	I	63	Low	63.7	Low	47 Å²	47	39.5 Å²	39.5	24%	0.241	20%	0.199	C	C	.	.	H	α-helix	trans	-53.8	-49.8	-178.9	-65.2	163.1	0	0	0	111.8	V138 S141 L162 E205 I206 I207	V138-I203 HydrophobicContact CB-CG1 4.33Å; V138-I203 HydrophobicContact CG1-CG1 3.59Å; V138-I203 HydrophobicContact CG2-CG1 4.19Å; S141-I203 WeakPolarHBondContact OG-CD1 3.35Å; L162-I203 HydrophobicContact CD1-CG2 3.6Å; I203-E205 VanDerWaalsContact C-N 3.34Å; I203-E205 PolarHBondContact O-N 3.12Å; I203-I206 PolarHBondContact O-N 3.36Å; I203-I207 HydrophobicContact CG2-CD1 3.36Å; I203-I207 HydrophobicContact CG2-CG1 4.2Å; I203-I207 WeakPolarHBondContact O-CB 3.28Å; I203-I207 WeakPolarHBondContact O-CD1 3.49Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 2.71Å
204	P	59.5	Low	62.4	Low	48 Å²	48	42.7 Å²	42.7	31%	0.312	22%	0.219	S	C	.	.	H	α-helix	trans	-57.2	-40.8	177.9	-27	34.5	0	0	0	114.6	N202 I207 L208	N202-P204 VanDerWaalsContact OD1-CD 3.24Å; N202-P204 WeakPolarHBondContact OD1-CD 3.43Å; P204-I207 PolarHBondContact O-N 3.38Å; P204-L208 VanDerWaalsContact O-CB 3.3Å; P204-L208 WeakPolarHBondContact O-CB 3.18Å; P204-L208 WeakPolarHBondContact O-CD1 3.38Å; P204-L208 WeakPolarHBondContact O-CG 3.18Å; P204-L208 PolarHBondContact O-N 2.85Å
205	E	61.9	Low	60.7	Low	75 Å²	75	40.3 Å²	40.3	35%	0.35	21%	0.212	S	C	.	.	H	α-helix	trans	-71.3	-37	178.8	-77.5	178.7	-161.1	0	0	112.8	A200 D201 N202 I203 I207 L208 H209	A200-E205 WeakPolarHBondContact CA-OE2 3.49Å; A200-E205 HydrophobicContact CB-CB 3.69Å; D201-E205 PolarHBondContact N-OE2 2.95Å; N202-E205 PolarHBondContact ND2-OE1 2.86Å; N202-E205 PolarHBondContact O-N 3.09Å; N202-E205 WeakPolarHBondContact OD1-CB 3.25Å; N202-E205 WeakPolarHBondContact OD1-CG 3.17Å; N202-E205 PolarHBondContact OD1-N 3.49Å; I203-E205 VanDerWaalsContact C-N 3.34Å; I203-E205 PolarHBondContact O-N 3.12Å; E205-I207 VanDerWaalsContact C-N 3.32Å; E205-L208 PolarHBondContact O-N 3.5Å; E205-H209 WeakPolarHBondContact O-CB 3.25Å; E205-H209 PolarHBondContact O-N 3.17Å
206	I	68.3	Low	58.5	Low	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-39.2	174.5	-70.3	170	0	0	0	110.1	L135 V138 W191 H195 A200 N202 I203 H209 W210	L135-I206 HydrophobicContact CD2-CD1 4.03Å; V138-I206 HydrophobicContact CB-CD1 4.37Å; V138-I206 HydrophobicContact CG1-CD1 3.91Å; V138-I206 HydrophobicContact CG2-CD1 4.25Å; W191-I206 HydrophobicContact CH2-CG2 4.1Å; W191-I206 HydrophobicContact CZ2-CD1 3.96Å; H195-I206 WeakPolarHBondContact NE2-CG2 3.11Å; A200-I206 HydrophobicContact CB-CB 4.47Å; A200-I206 HydrophobicContact CB-CG1 3.58Å; N202-I206 WeakPolarHBondContact O-CG1 3.34Å; N202-I206 PolarHBondContact O-N 3.33Å; I203-I206 PolarHBondContact O-N 3.36Å; I206-H209 WeakPolarHBondContact O-CB 3.27Å; I206-H209 PolarHBondContact O-N 2.73Å; I206-W210 HydrophobicContact CG2-CD2 4.15Å; I206-W210 HydrophobicContact CG2-CH2 3.91Å; I206-W210 HydrophobicContact CG2-CZ2 3.48Å; I206-W210 VanDerWaalsContact CG2-CZ2 3.48Å; I206-W210 HydrophobicContact CG2-CZ3 4.4Å; I206-W210 PolarHBondContact O-N 2.99Å
207	I	63.6	Low	56.3	Low	14 Å²	14	42.9 Å²	42.9	7%	0.072	23%	0.225	C	C	.	.	H	α-helix	trans	-69.8	-42	175.2	-66.5	167.1	0	0	0	111.5	L159 L162 I164 I203 P204 E205 H209 W210 K211	L159-I207 HydrophobicContact CD2-CB 4.35Å; L159-I207 HydrophobicContact CD2-CD1 3.53Å; L159-I207 HydrophobicContact CD2-CG1 3.74Å; L159-I207 HydrophobicContact CD2-CG2 3.65Å; L159-I207 HydrophobicContact CG-CD1 4.44Å; L162-I207 HydrophobicContact CD1-CD1 3.23Å; I164-I207 HydrophobicContact CD1-CG2 3.61Å; I203-I207 HydrophobicContact CG2-CD1 3.36Å; I203-I207 HydrophobicContact CG2-CG1 4.2Å; I203-I207 WeakPolarHBondContact O-CB 3.28Å; I203-I207 WeakPolarHBondContact O-CD1 3.49Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 2.71Å; P204-I207 PolarHBondContact O-N 3.38Å; E205-I207 VanDerWaalsContact C-N 3.32Å; I207-H209 PolarHBondContact O-N 2.73Å; I207-W210 HydrophobicContact CG1-CE3 4.03Å; I207-W210 HydrophobicContact CG1-CZ3 4.07Å; I207-W210 PolarHBondContact O-N 3.29Å; I207-K211 WeakPolarHBondContact O-CB 3.32Å; I207-K211 PolarHBondContact O-N 2.87Å
208	L	56.8	Low	54.4	Low	82 Å²	82	44 Å²	44	43%	0.429	23%	0.232	S	C	.	.	H	α-helix	trans	-59.3	-38.7	171.7	-87.7	158.5	0	0	0	110.6	P204 E205 K211 H212	P204-L208 VanDerWaalsContact O-CB 3.3Å; P204-L208 WeakPolarHBondContact O-CB 3.18Å; P204-L208 WeakPolarHBondContact O-CD1 3.38Å; P204-L208 WeakPolarHBondContact O-CG 3.18Å; P204-L208 PolarHBondContact O-N 2.85Å; E205-L208 PolarHBondContact O-N 3.5Å; L208-K211 CarbonylContact O-C 3.57Å; L208-K211 WeakPolarHBondContact O-CB 3.43Å; L208-K211 PolarHBondContact O-N 2.81Å; L208-H212 WeakPolarHBondContact O-CB 3.41Å; L208-H212 PolarHBondContact O-CD2 2.97Å; L208-H212 PolarHBondContact O-N 3.04Å
209	H	61.9	Low	52.6	Low	32 Å²	32	43.9 Å²	43.9	15%	0.148	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-48.9	172.2	170.9	-106.3	0	0	0	111.2	H198 E205 I206 I207 K211 H212 S213	H198-H209 AromaticContact CD2-CD2 3.35Å; H198-H209 PolarHBondContact CD2-CD2 3.25Å; H198-H209 AromaticContact CD2-CE1 3.63Å; H198-H209 AromaticContact CD2-CG 3.78Å; H198-H209 AromaticContact CD2-ND1 3.95Å; H198-H209 AromaticContact CD2-NE2 3.21Å; H198-H209 PolarHBondContact CD2-NE2 3.34Å; H198-H209 AromaticContact CE1-CD2 3.52Å; H198-H209 AromaticContact CE1-CG 3.63Å; H198-H209 AromaticContact NE2-CD2 2.79Å; H198-H209 PolarHBondContact NE2-CD2 3.43Å; H198-H209 AromaticContact NE2-CE1 3.91Å; H198-H209 AromaticContact NE2-CG 3.34Å; H198-H209 VanDerWaalsContact NE2-CG 3.34Å; H198-H209 AromaticContact NE2-ND1 3.99Å; H198-H209 AromaticContact NE2-NE2 3.2Å; H198-H209 PolarHBondContact NE2-NE2 2.83Å; E205-H209 WeakPolarHBondContact O-CB 3.25Å; E205-H209 PolarHBondContact O-N 3.17Å; I206-H209 WeakPolarHBondContact O-CB 3.27Å; I206-H209 PolarHBondContact O-N 2.73Å; I207-H209 PolarHBondContact O-N 2.73Å; H209-K211 PolarHBondContact O-N 3.37Å; H209-H212 PolarHBondContact O-N 3.17Å; H209-H212 VanDerWaalsContact O-N 3.16Å; H209-S213 PolarHBondContact CD2-OG 3.46Å; H209-S213 PolarHBondContact NE2-OG 3.07Å; H209-S213 WeakPolarHBondContact O-CA 3.38Å; H209-S213 WeakPolarHBondContact O-CB 3.48Å; H209-S213 PolarHBondContact O-N 2.95Å; H209-S213 PolarHBondContact O-OG 2.87Å
210	W	63.5	Low	51	Low	4 Å²	4	48.2 Å²	48.2	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-31	174.2	-61.3	-28.3	0	0	0	112.9	L142 L159 I174 M178 W191 H195 I206 I207 I215 L216	L142-W210 HydrophobicContact CD1-CH2 4.41Å; L159-W210 HydrophobicContact CD1-CZ3 4.48Å; I174-W210 HydrophobicContact CD1-CE3 4.38Å; I174-W210 HydrophobicContact CG2-CD2 4.19Å; I174-W210 HydrophobicContact CG2-CE3 4.4Å; I174-W210 HydrophobicContact CG2-CH2 4.43Å; I174-W210 HydrophobicContact CG2-CZ2 4.21Å; M178-W210 HydrophobicContact CE-CZ2 3.9Å; M178-W210 HydrophobicContact SD-CZ2 4.22Å; W191-W210 AromaticContact CH2-CH2 3.9Å; W191-W210 HydrophobicContact CH2-CH2 3.9Å; W191-W210 AromaticContact CH2-CZ2 3.79Å; W191-W210 HydrophobicContact CH2-CZ2 3.79Å; W191-W210 AromaticContact CZ3-CH2 3.98Å; W191-W210 HydrophobicContact CZ3-CH2 3.98Å; W191-W210 AromaticContact CZ3-CZ2 3.76Å; W191-W210 HydrophobicContact CZ3-CZ2 3.76Å; H195-W210 AromaticContact NE2-NE1 3.81Å; I206-W210 HydrophobicContact CG2-CD2 4.15Å; I206-W210 HydrophobicContact CG2-CH2 3.91Å; I206-W210 HydrophobicContact CG2-CZ2 3.48Å; I206-W210 VanDerWaalsContact CG2-CZ2 3.48Å; I206-W210 HydrophobicContact CG2-CZ3 4.4Å; I206-W210 PolarHBondContact O-N 2.99Å; I207-W210 HydrophobicContact CG1-CE3 4.03Å; I207-W210 HydrophobicContact CG1-CZ3 4.07Å; I207-W210 PolarHBondContact O-N 3.29Å; W210-I215 PolarHBondContact O-N 3.4Å; W210-I215 VanDerWaalsContact O-N 3.07Å; W210-L216 HydrophobicContact CB-CD1 4.21Å; W210-L216 HydrophobicContact CB-CG 4.43Å; W210-L216 HydrophobicContact CE3-CD1 4.46Å; W210-L216 PolarHBondContact O-N 3.21Å
211	K	55.9	Low	49.2	Very low	83 Å²	83	50.5 Å²	50.5	36%	0.361	27%	0.27	S	S	.	.	H	α-helix	trans	-70.7	-43.8	174.1	176.4	172.7	-171.4	-170.9	0	113.2	I207 L208 H209 L216	I207-K211 WeakPolarHBondContact O-CB 3.32Å; I207-K211 PolarHBondContact O-N 2.87Å; L208-K211 CarbonylContact O-C 3.57Å; L208-K211 WeakPolarHBondContact O-CB 3.43Å; L208-K211 PolarHBondContact O-N 2.81Å; H209-K211 PolarHBondContact O-N 3.37Å; K211-L216 WeakPolarHBondContact CA-O 3.27Å; K211-L216 WeakPolarHBondContact CB-O 3.31Å; K211-L216 VanDerWaalsContact CG-O 3.31Å; K211-L216 WeakPolarHBondContact CG-O 3.24Å
212	H	47.2	Very low	47.6	Very low	146 Å²	146	55.2 Å²	55.2	68%	0.676	29%	0.294	S	S	*	.	H	α-helix	trans	-82.4	-23.4	-179.6	-76.7	-67.9	0	0	0	113.5	L208 H209 T214	L208-H212 WeakPolarHBondContact O-CB 3.41Å; L208-H212 PolarHBondContact O-CD2 2.97Å; L208-H212 PolarHBondContact O-N 3.04Å; H209-H212 PolarHBondContact O-N 3.17Å; H209-H212 VanDerWaalsContact O-N 3.16Å; H212-T214 VanDerWaalsContact C-N 3.35Å; H212-T214 PolarHBondContact O-N 3.4Å
213	S	44.2	Very low	46	Very low	42 Å²	42	56.2 Å²	56.2	29%	0.294	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	31.9	-173.6	-40.8	0	0	0	0	112.4	H209	H209-S213 PolarHBondContact CD2-OG 3.46Å; H209-S213 PolarHBondContact NE2-OG 3.07Å; H209-S213 WeakPolarHBondContact O-CA 3.38Å; H209-S213 WeakPolarHBondContact O-CB 3.48Å; H209-S213 PolarHBondContact O-N 2.95Å; H209-S213 PolarHBondContact O-OG 2.87Å
214	T	47.6	Very low	44.4	Very low	87 Å²	87	55.6 Å²	55.6	53%	0.534	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	26.5	169.1	56.8	0	0	0	0	118.7	H212 A425	H212-T214 VanDerWaalsContact C-N 3.35Å; H212-T214 PolarHBondContact O-N 3.4Å; T214-A425 HydrophobicContact CG2-CB 3.74Å
215	I	41.3	Very low	43.1	Very low	24 Å²	24	55.2 Å²	55.2	12%	0.123	29%	0.294	C	S	.	.	S	Bend	trans	-125.4	-27.5	177.5	-52.9	173.9	0	0	0	114.7	E173 I174 W210	E173-I215 HydrophobicContact CB-CG2 4.16Å; E173-I215 HydrophobicContact CG-CG2 4.05Å; I174-I215 HydrophobicContact CB-CG2 4.29Å; I174-I215 HydrophobicContact CD1-CG2 4.4Å; I174-I215 HydrophobicContact CG1-CB 4.3Å; I174-I215 HydrophobicContact CG1-CG2 3.32Å; W210-I215 PolarHBondContact O-N 3.4Å; W210-I215 VanDerWaalsContact O-N 3.07Å
216	L	31.8	Very low	41.9	Very low	5 Å²	5	57.9 Å²	57.9	3%	0.026	31%	0.311	C	S	.	.			trans	-128	89.4	-178.3	-70.6	-175.5	0	0	0	114.8	L159 L166 Q170 I174 W210 K211 V218	L159-L216 HydrophobicContact CD1-CD1 3.97Å; L159-L216 HydrophobicContact CD2-CD1 4.41Å; L166-L216 HydrophobicContact CD1-CD1 4.07Å; L166-L216 HydrophobicContact CD1-CD2 3.67Å; L166-L216 HydrophobicContact CD1-CG 4.47Å; L166-L216 HydrophobicContact CD2-CD1 4.03Å; L166-L216 HydrophobicContact CD2-CD2 3.09Å; L166-L216 HydrophobicContact CD2-CG 4.12Å; L166-L216 HydrophobicContact CG-CD2 3.98Å; Q170-L216 HydrophobicContact CB-CD2 4.23Å; I174-L216 HydrophobicContact CD1-CD1 3.63Å; I174-L216 HydrophobicContact CD1-CD2 3.84Å; I174-L216 HydrophobicContact CD1-CG 3.74Å; I174-L216 HydrophobicContact CG1-CG 4.4Å; W210-L216 HydrophobicContact CB-CD1 4.21Å; W210-L216 HydrophobicContact CB-CG 4.43Å; W210-L216 HydrophobicContact CE3-CD1 4.46Å; W210-L216 PolarHBondContact O-N 3.21Å; K211-L216 WeakPolarHBondContact CA-O 3.27Å; K211-L216 WeakPolarHBondContact CB-O 3.31Å; K211-L216 VanDerWaalsContact CG-O 3.31Å; K211-L216 WeakPolarHBondContact CG-O 3.24Å; L216-V218 PolarHBondContact O-N 2.89Å
217	D	31.6	Very low	40.5	Very low	52 Å²	52	60.6 Å²	60.6	28%	0.278	32%	0.323	S	S	.	.			trans	-95.5	83.5	177.1	-160.1	-10.5	0	0	0	112.1	G219 K413	D217-G219 PolarHBondContact O-N 2.91Å; D217-K413 IonicContact OD1-NZ 2.74Å; D217-K413 PolarHBondContact OD1-NZ 2.9Å; D217-K413 WeakPolarHBondContact OD2-CE 3.28Å; D217-K413 IonicContact OD2-NZ 3.59Å; D217-K413 PolarHBondContact OD2-NZ 2.99Å
218	V	29.3	Very low	39.8	Very low	41 Å²	41	61.8 Å²	61.8	25%	0.248	33%	0.328	C	S	.	.			trans	-79.6	110.9	164.3	-178.1	0	0	0	0	107.9	I164 L216 E220 M332	I164-V218 HydrophobicContact CG2-CG2 3.82Å; L216-V218 PolarHBondContact O-N 2.89Å; V218-E220 PolarHBondContact O-N 3.23Å; V218-M332 HydrophobicContact CG1-CE 3.54Å
219	G	27.8	Very low	39.2	Very low	14 Å²	14	61.2 Å²	61.2	14%	0.144	33%	0.328	C	S	.	.			trans	-36.9	121.7	-174.5	0	0	0	0	0	114.8	D217 S221	D217-G219 PolarHBondContact O-N 2.91Å; G219-S221 PolarHBondContact O-N 3.06Å; G219-S221 VanDerWaalsContact O-N 3.13Å
220	E	25.6	Very low	38.3	Very low	111 Å²	111	63.1 Å²	63.1	52%	0.519	35%	0.35	S	S	.	.			trans	-59.7	116.9	166	-75.2	-173.1	159.3	0	0	109.8	V218	V218-E220 PolarHBondContact O-N 3.23Å
221	S	25.7	Very low	37.2	Very low	50 Å²	50	67.3 Å²	67.3	35%	0.35	37%	0.369	S	S	.	.			trans	-91.3	104.7	175.2	29.5	0	0	0	0	108.3	G219 I223 V224	G219-S221 PolarHBondContact O-N 3.06Å; G219-S221 VanDerWaalsContact O-N 3.13Å; S221-I223 PolarHBondContact O-N 3.23Å; S221-V224 PolarHBondContact O-N 3.19Å
222	I	30.5	Very low	37.1	Very low	152 Å²	152	66 Å²	66	78%	0.779	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	8.9	172.3	-63.9	171.9	0	0	0	112.8
223	I	29.2	Very low	37.3	Very low	70 Å²	70	63.5 Å²	63.5	36%	0.359	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-25.9	-178.3	-51.6	179.3	0	0	0	111.7	S221 K312 A402	S221-I223 PolarHBondContact O-N 3.23Å; I223-K312 PolarHBondContact O-NZ 3.39Å; I223-A402 HydrophobicContact CD1-CB 3.8Å
224	V	30.3	Very low	37.4	Very low	34 Å²	34	70.2 Å²	70.2	21%	0.206	38%	0.375	C	S	.	.	S	Bend	trans	-88.3	126.5	171.5	-168.3	0	0	0	0	106.4	S221 D226 Y316	S221-V224 PolarHBondContact O-N 3.19Å; V224-D226 PolarHBondContact O-N 2.88Å; V224-D226 VanDerWaalsContact O-N 3.14Å; V224-Y316 HydrophobicContact CG1-CE2 4.45Å
225	P	31.2	Very low	37.9	Very low	39 Å²	39	69.8 Å²	69.8	25%	0.253	37%	0.373	S	S	.	.			trans	-52.6	127.1	166.3	-13.6	26.6	0	0	0	106.3	E227 K312	P225-E227 PolarHBondContact O-N 3.47Å; P225-K312 HydrophobicContact CG-CD 4.12Å; P225-K312 HydrophobicContact CG-CG 4.47Å
226	D	36.5	Very low	38.9	Very low	132 Å²	132	70.3 Å²	70.3	71%	0.706	39%	0.385	S	S	*	.			trans	-44.5	118	169.8	-72.2	-34.9	0	0	0	106.4	V224 F228	V224-D226 PolarHBondContact O-N 2.88Å; V224-D226 VanDerWaalsContact O-N 3.14Å; D226-F228 VanDerWaalsContact C-N 3.29Å; D226-F228 PolarHBondContact O-N 3.11Å
227	E	40.1	Very low	40.5	Very low	58 Å²	58	73.5 Å²	73.5	27%	0.271	40%	0.4	S	S	.	.			trans	-54.7	107.8	171.7	-109	179.1	148.7	0	0	103.8	P225 T229 Y316 K320 R335	P225-E227 PolarHBondContact O-N 3.47Å; E227-T229 PolarHBondContact O-N 3.06Å; E227-Y316 HydrophobicContact CG-CE1 4.33Å; E227-K320 IonicContact OE1-NZ 2.65Å; E227-K320 PolarHBondContact OE1-NZ 3.44Å; E227-R335 IonicContact OE2-CZ 2.69Å; E227-R335 VanDerWaalsContact OE2-CZ 3.31Å; E227-R335 IonicContact OE2-NE 3.12Å; E227-R335 PolarHBondContact OE2-NE 3.07Å; E227-R335 IonicContact OE2-NH2 2.67Å; E227-R335 PolarHBondContact OE2-NH2 3.37Å
228	F	47.7	Very low	42.2	Very low	40 Å²	40	76.6 Å²	76.6	18%	0.175	41%	0.408	C	S	.	.			trans	-49.7	118.9	170.6	-70.8	-72.3	0	0	0	105.2	D226 E232 K233 W238 H241 L242 F313	D226-F228 VanDerWaalsContact C-N 3.29Å; D226-F228 PolarHBondContact O-N 3.11Å; F228-E232 VanDerWaalsContact CA-OE2 3.29Å; F228-E232 WeakPolarHBondContact CA-OE2 3.32Å; F228-E232 HydrophobicContact CB-CB 4.19Å; F228-E232 HydrophobicContact CD1-CB 4.44Å; F228-K233 HydrophobicContact CB-CG 3.99Å; F228-W238 HydrophobicContact CD1-CB 4.37Å; F228-W238 HydrophobicContact CE1-CB 4.47Å; F228-H241 HydrophobicContact CE1-CB 4.36Å; F228-L242 HydrophobicContact CE2-CD2 4.33Å; F228-L242 HydrophobicContact CZ-CD2 3.73Å; F228-L242 HydrophobicContact CZ-CG 4Å; F228-F313 AromaticContact CD2-CE2 3.99Å; F228-F313 HydrophobicContact CD2-CE2 3.99Å; F228-F313 HydrophobicContact CE2-CE2 4.26Å
229	T	44.3	Very low	44.3	Very low	70 Å²	70	80.1 Å²	80.1	43%	0.429	42%	0.417	S	S	.	.			trans	-53.3	150.8	-175.7	51.6	0	0	0	0	108.4	E227 E231 E232 K233	E227-T229 PolarHBondContact O-N 3.06Å; T229-E231 PolarHBondContact O-N 3.37Å; T229-E232 PolarHBondContact N-OE2 2.9Å; T229-E232 PolarHBondContact O-N 3.21Å; T229-E232 VanDerWaalsContact OG1-CG 3.24Å; T229-E232 WeakPolarHBondContact OG1-CG 3.49Å; T229-E232 PolarHBondContact OG1-N 2.95Å; T229-E232 PolarHBondContact OG1-OE2 3.41Å; T229-K233 PolarHBondContact O-N 3.19Å; T229-K233 VanDerWaalsContact O-N 3.11Å
230	A	43.6	Very low	46.7	Very low	72 Å²	72	82.8 Å²	82.8	60%	0.595	42%	0.423	S	S	*	.	H	α-helix	trans	-52.7	-25.8	176.4	0	0	0	0	0	111.6	K234	A230-K234 WeakPolarHBondContact O-CB 3.49Å; A230-K234 VanDerWaalsContact O-CG 3.26Å; A230-K234 WeakPolarHBondContact O-CG 3.48Å; A230-K234 PolarHBondContact O-N 3.31Å
231	E	41	Very low	48.8	Very low	91 Å²	91	79 Å²	79	43%	0.425	41%	0.405	S	S	.	.	H	α-helix	trans	-71.2	-45.8	172.6	-59.4	-175.2	169	0	0	113.8	R106 T229 K233 K234 T235	R106-E231 IonicContact CZ-OE1 2.73Å; R106-E231 IonicContact NH1-OE1 2.84Å; R106-E231 PolarHBondContact NH1-OE1 2.9Å; R106-E231 IonicContact NH2-OE1 3.13Å; T229-E231 PolarHBondContact O-N 3.37Å; E231-K233 VanDerWaalsContact C-N 3.28Å; E231-K233 PolarHBondContact O-N 3.44Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.14Å; E231-T235 WeakPolarHBondContact O-CB 3.41Å; E231-T235 VanDerWaalsContact O-CG2 3.27Å; E231-T235 WeakPolarHBondContact O-CG2 3.44Å; E231-T235 PolarHBondContact O-N 2.96Å; E231-T235 PolarHBondContact O-OG1 2.94Å
232	E	51.8	Low	51	Low	56 Å²	56	80.1 Å²	80.1	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-32.5	175.8	-75.7	167.9	138.5	0	0	112.7	F228 T229 T235	F228-E232 VanDerWaalsContact CA-OE2 3.29Å; F228-E232 WeakPolarHBondContact CA-OE2 3.32Å; F228-E232 HydrophobicContact CB-CB 4.19Å; F228-E232 HydrophobicContact CD1-CB 4.44Å; T229-E232 PolarHBondContact N-OE2 2.9Å; T229-E232 PolarHBondContact O-N 3.21Å; T229-E232 VanDerWaalsContact OG1-CG 3.24Å; T229-E232 WeakPolarHBondContact OG1-CG 3.49Å; T229-E232 PolarHBondContact OG1-N 2.95Å; T229-E232 PolarHBondContact OG1-OE2 3.41Å; E232-T235 PolarHBondContact O-OG1 2.98Å
233	K	52.3	Low	53.3	Low	93 Å²	93	76.6 Å²	76.6	40%	0.404	39%	0.392	S	S	.	.	H	α-helix	trans	-71.2	-34.8	173.1	-68.8	-177	177.5	-177.7	0	111.9	F228 T229 E231 E317	F228-K233 HydrophobicContact CB-CG 3.99Å; T229-K233 PolarHBondContact O-N 3.19Å; T229-K233 VanDerWaalsContact O-N 3.11Å; E231-K233 VanDerWaalsContact C-N 3.28Å; E231-K233 PolarHBondContact O-N 3.44Å; K233-E317 IonicContact NZ-OE1 3.31Å; K233-E317 PolarHBondContact NZ-OE1 3.14Å
234	K	46.9	Very low	55.5	Low	183 Å²	183	73.3 Å²	73.3	80%	0.796	38%	0.375	S	S	*	.	H	α-helix	trans	-80.2	-34.4	179	-77.8	176.3	-179	178.9	0	114	A230 E231 G236	A230-K234 WeakPolarHBondContact O-CB 3.49Å; A230-K234 VanDerWaalsContact O-CG 3.26Å; A230-K234 WeakPolarHBondContact O-CG 3.48Å; A230-K234 PolarHBondContact O-N 3.31Å; E231-K234 PolarHBondContact O-N 3.36Å; E231-K234 VanDerWaalsContact O-N 3.14Å; K234-G236 VanDerWaalsContact C-N 3.26Å; K234-G236 PolarHBondContact O-N 2.87Å
235	T	57.4	Low	57.4	Low	78 Å²	78	73.2 Å²	73.2	48%	0.479	38%	0.381	S	S	.	.	S	Bend	trans	-74.5	-12	-178.5	53	0	0	0	0	114.1	E231 E232 M237	E231-T235 WeakPolarHBondContact O-CB 3.41Å; E231-T235 VanDerWaalsContact O-CG2 3.27Å; E231-T235 WeakPolarHBondContact O-CG2 3.44Å; E231-T235 PolarHBondContact O-N 2.96Å; E231-T235 PolarHBondContact O-OG1 2.94Å; E232-T235 PolarHBondContact O-OG1 2.98Å; T235-M237 HydrophobicContact CG2-CE 4.3Å; T235-M237 PolarHBondContact O-N 3.26Å
236	G	61.5	Low	59.5	Low	36 Å²	36	72.6 Å²	72.6	37%	0.371	38%	0.382	S	S	.	.	S	Bend	trans	69.2	8.9	-179.5	0	0	0	0	0	114.6	K234 W239	K234-G236 VanDerWaalsContact C-N 3.26Å; K234-G236 PolarHBondContact O-N 2.87Å; G236-W239 PolarHBondContact O-NE1 3.41Å
237	M	66.8	Low	61.5	Low	72 Å²	72	67.4 Å²	67.4	36%	0.355	36%	0.36	S	S	.	.			trans	-93	-4.2	-178.7	-68.2	-168.7	-75.1	0	0	114.2	T235 W239 R240	T235-M237 HydrophobicContact CG2-CE 4.3Å; T235-M237 PolarHBondContact O-N 3.26Å; M237-W239 PolarHBondContact O-N 3.48Å; M237-W239 VanDerWaalsContact O-N 3.12Å; M237-R240 VanDerWaalsContact O-CB 3.29Å; M237-R240 WeakPolarHBondContact O-CB 3.4Å; M237-R240 PolarHBondContact O-N 3.3Å
238	W	66.8	Low	63.1	Low	117 Å²	117	64.7 Å²	64.7	44%	0.443	35%	0.347	S	S	.	.	H	α-helix	trans	-51.8	-35.7	179.5	66.4	-87.4	0	0	0	113.9	F228 R240 H241 L242	F228-W238 HydrophobicContact CD1-CB 4.37Å; F228-W238 HydrophobicContact CE1-CB 4.47Å; W238-R240 PolarHBondContact O-N 3.02Å; W238-H241 PolarHBondContact O-N 2.93Å; W238-L242 HydrophobicContact CE3-CD1 3.33Å; W238-L242 HydrophobicContact CE3-CG 4.18Å; W238-L242 HydrophobicContact CZ3-CD1 3.23Å; W238-L242 HydrophobicContact CZ3-CG 4.48Å; W238-L242 PolarHBondContact O-N 2.87Å; W238-L242 VanDerWaalsContact O-N 3.08Å
239	W	73.7	Confident	64.4	Low	114 Å²	114	63.1 Å²	63.1	43%	0.432	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-29.1	178.2	69.8	-94.2	0	0	0	112.3	G236 M237 L242 V243 L516	G236-W239 PolarHBondContact O-NE1 3.41Å; M237-W239 PolarHBondContact O-N 3.48Å; M237-W239 VanDerWaalsContact O-N 3.12Å; W239-L242 PolarHBondContact O-N 3.44Å; W239-V243 HydrophobicContact CE3-CG2 4.07Å; W239-V243 WeakPolarHBondContact O-CB 3.29Å; W239-V243 VanDerWaalsContact O-CG2 3.25Å; W239-V243 WeakPolarHBondContact O-CG2 3.34Å; W239-V243 PolarHBondContact O-N 3.31Å; W239-L516 HydrophobicContact CZ3-CD2 4.34Å
240	R	78.7	Confident	66.2	Low	71 Å²	71	60.9 Å²	60.9	27%	0.268	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-41.5	177.6	-62.4	177.6	172.4	-178.3	1.2	110.9	M237 W238 V243 A244 L516 V518	M237-R240 VanDerWaalsContact O-CB 3.29Å; M237-R240 WeakPolarHBondContact O-CB 3.4Å; M237-R240 PolarHBondContact O-N 3.3Å; W238-R240 PolarHBondContact O-N 3.02Å; R240-V243 PolarHBondContact O-N 3.39Å; R240-A244 VanDerWaalsContact O-CB 3.27Å; R240-A244 WeakPolarHBondContact O-CB 3.24Å; R240-A244 PolarHBondContact O-N 3.39Å; R240-L516 HydrophobicContact CB-CB 4.16Å; R240-L516 HydrophobicContact CB-CD1 4.28Å; R240-L516 VanDerWaalsContact CD-O 3.26Å; R240-L516 WeakPolarHBondContact CD-O 3.17Å; R240-L516 HydrophobicContact CG-CB 4.31Å; R240-L516 VanDerWaalsContact CZ-O 3.27Å; R240-L516 PolarHBondContact NE-O 3.43Å; R240-L516 PolarHBondContact NH1-O 3.01Å; R240-L516 VanDerWaalsContact NH1-O 3.12Å; R240-L516 WeakPolarHBondContact O-CD1 3.39Å; R240-V518 HydrophobicContact CB-CG2 3.57Å; R240-V518 HydrophobicContact CG-CG2 4.28Å
241	H	69.6	Low	68.1	Low	30 Å²	30	60.4 Å²	60.4	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-41.5	173.5	-71	-91.3	0	0	0	111.7	F228 W238 A244 G245 Y509 V518	F228-H241 HydrophobicContact CE1-CB 4.36Å; W238-H241 PolarHBondContact O-N 2.93Å; H241-A244 PolarHBondContact O-N 2.96Å; H241-G245 PolarHBondContact O-N 3.49Å; H241-Y509 PolarHBondContact ND1-OH 3.23Å; H241-V518 VanDerWaalsContact NE2-CG1 3.35Å; H241-V518 WeakPolarHBondContact NE2-CG1 3.41Å
242	L	71.4	Confident	69.9	Low	75 Å²	75	56.2 Å²	56.2	39%	0.393	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-41.8	175.5	-72	-177.4	0	0	0	113	F228 W238 W239 G246	F228-L242 HydrophobicContact CE2-CD2 4.33Å; F228-L242 HydrophobicContact CZ-CD2 3.73Å; F228-L242 HydrophobicContact CZ-CG 4Å; W238-L242 HydrophobicContact CE3-CD1 3.33Å; W238-L242 HydrophobicContact CE3-CG 4.18Å; W238-L242 HydrophobicContact CZ3-CD1 3.23Å; W238-L242 HydrophobicContact CZ3-CG 4.48Å; W238-L242 PolarHBondContact O-N 2.87Å; W238-L242 VanDerWaalsContact O-N 3.08Å; W239-L242 PolarHBondContact O-N 3.44Å; L242-G246 PolarHBondContact O-N 2.86Å
243	V	79	Confident	71.4	Confident	78 Å²	78	57 Å²	57	47%	0.473	30%	0.302	S	S	.	.	H	α-helix	trans	-67.8	-42.2	176.8	171.1	0	0	0	0	110.6	W239 R240 G247 L516	W239-V243 HydrophobicContact CE3-CG2 4.07Å; W239-V243 WeakPolarHBondContact O-CB 3.29Å; W239-V243 VanDerWaalsContact O-CG2 3.25Å; W239-V243 WeakPolarHBondContact O-CG2 3.34Å; W239-V243 PolarHBondContact O-N 3.31Å; R240-V243 PolarHBondContact O-N 3.39Å; V243-G247 PolarHBondContact O-N 2.96Å; V243-L516 HydrophobicContact CB-CD1 4.21Å; V243-L516 HydrophobicContact CG1-CD1 4.05Å
244	A	75.7	Confident	73.3	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-47.6	174.8	0	0	0	0	0	111.5	R240 H241 A248 Y509 L512 K513 L516	R240-A244 VanDerWaalsContact O-CB 3.27Å; R240-A244 WeakPolarHBondContact O-CB 3.24Å; R240-A244 PolarHBondContact O-N 3.39Å; H241-A244 PolarHBondContact O-N 2.96Å; A244-A248 WeakPolarHBondContact O-CB 3.45Å; A244-A248 PolarHBondContact O-N 3.45Å; A244-Y509 HydrophobicContact CB-CD2 3.83Å; A244-Y509 HydrophobicContact CB-CE2 3.85Å; A244-L512 HydrophobicContact CB-CB 3.89Å; A244-K513 HydrophobicContact CB-CB 4.45Å; A244-L516 HydrophobicContact CB-CD1 4.22Å
245	G	70.3	Confident	75.2	Confident	33 Å²	33	49.7 Å²	49.7	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-44	177.7	0	0	0	0	0	112.8	H241 G249	H241-G245 PolarHBondContact O-N 3.49Å; G245-G249 PolarHBondContact O-N 2.95Å
246	G	74.4	Confident	76.7	Confident	25 Å²	25	46.3 Å²	46.3	26%	0.258	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-44.8	176.2	0	0	0	0	0	112.5	L242 G249 A250	L242-G246 PolarHBondContact O-N 2.86Å; G246-G249 PolarHBondContact O-N 3.09Å; G246-A250 WeakPolarHBondContact O-CB 3.3Å; G246-A250 PolarHBondContact O-N 3.44Å
247	G	77.9	Confident	78.1	Confident	24 Å²	24	44.8 Å²	44.8	25%	0.247	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-48.2	176.2	0	0	0	0	0	112.4	V243 G249 A250 V251	V243-G247 PolarHBondContact O-N 2.96Å; G247-G249 VanDerWaalsContact C-N 3.33Å; G247-G249 PolarHBondContact O-N 3.28Å; G247-A250 PolarHBondContact O-N 3.41Å; G247-A250 VanDerWaalsContact O-N 3.14Å; G247-V251 WeakPolarHBondContact O-CG2 3.07Å; G247-V251 PolarHBondContact O-N 2.93Å
248	A	75.4	Confident	79.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-45.9	173.9	0	0	0	0	0	112.2	A244 A250 V251 S252 S505 V508	A244-A248 WeakPolarHBondContact O-CB 3.45Å; A244-A248 PolarHBondContact O-N 3.45Å; A248-A250 VanDerWaalsContact C-N 3.31Å; A248-A250 PolarHBondContact O-N 3.18Å; A248-V251 PolarHBondContact O-N 3.5Å; A248-S252 VanDerWaalsContact O-CB 3.25Å; A248-S252 WeakPolarHBondContact O-CB 3.13Å; A248-S252 PolarHBondContact O-N 3.27Å; A248-S505 WeakPolarHBondContact CB-O 3.38Å; A248-V508 HydrophobicContact CB-CB 4.13Å; A248-V508 HydrophobicContact CB-CG1 4.04Å
249	G	74.1	Confident	80.6	Confident	8 Å²	8	38.2 Å²	38.2	8%	0.082	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-33.1	176.1	0	0	0	0	0	113.6	G245 G246 G247 R253	G245-G249 PolarHBondContact O-N 2.95Å; G246-G249 PolarHBondContact O-N 3.09Å; G247-G249 VanDerWaalsContact C-N 3.33Å; G247-G249 PolarHBondContact O-N 3.28Å; G249-R253 WeakPolarHBondContact O-CB 3.4Å; G249-R253 WeakPolarHBondContact O-CG 3.16Å; G249-R253 PolarHBondContact O-N 3.09Å; G249-R253 PolarHBondContact O-NH1 2.72Å; G249-R253 VanDerWaalsContact O-NH1 3.1Å
250	A	81.8	Confident	81.2	Confident	22 Å²	22	33.7 Å²	33.7	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-73.6	-44.9	177.5	0	0	0	0	0	112.2	G246 G247 A248 T254 V302 I305	G246-A250 WeakPolarHBondContact O-CB 3.3Å; G246-A250 PolarHBondContact O-N 3.44Å; G247-A250 PolarHBondContact O-N 3.41Å; G247-A250 VanDerWaalsContact O-N 3.14Å; A248-A250 VanDerWaalsContact C-N 3.31Å; A248-A250 PolarHBondContact O-N 3.18Å; A250-T254 WeakPolarHBondContact O-CB 3.35Å; A250-T254 PolarHBondContact O-N 3.14Å; A250-T254 PolarHBondContact O-OG1 3.04Å; A250-V302 HydrophobicContact CB-CG1 3.79Å; A250-V302 HydrophobicContact CB-CG2 4.43Å; A250-I305 HydrophobicContact CB-CD1 4.2Å
251	V	84.1	Confident	81.9	Confident	62 Å²	62	30.5 Å²	30.5	38%	0.376	19%	0.194	S	C	.	.	H	α-helix	trans	-64.4	-49.4	177.6	176.3	0	0	0	0	110.2	G247 A248 R253 T254 C255 I504 V508	G247-V251 WeakPolarHBondContact O-CG2 3.07Å; G247-V251 PolarHBondContact O-N 2.93Å; A248-V251 PolarHBondContact O-N 3.5Å; V251-R253 PolarHBondContact O-N 3.37Å; V251-T254 PolarHBondContact O-N 3.38Å; V251-T254 VanDerWaalsContact O-N 3.1Å; V251-C255 PolarHBondContact O-N 2.83Å; V251-C255 PolarHBondContact O-SG 3.25Å; V251-C255 VanDerWaalsContact O-SG 3.37Å; V251-I504 HydrophobicContact CG1-CG2 3.98Å; V251-V508 HydrophobicContact CB-CG1 4.29Å; V251-V508 HydrophobicContact CB-CG2 4.26Å; V251-V508 HydrophobicContact CG1-CG2 3.91Å; V251-V508 HydrophobicContact CG2-CG1 4.18Å
252	S	79.3	Confident	83	Confident	4 Å²	4	29 Å²	29	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-57.9	-47.1	179	177	0	0	0	0	112.6	A248 T254 C255 T256 S501	A248-S252 VanDerWaalsContact O-CB 3.25Å; A248-S252 WeakPolarHBondContact O-CB 3.13Å; A248-S252 PolarHBondContact O-N 3.27Å; S252-T254 VanDerWaalsContact C-N 3.31Å; S252-T254 PolarHBondContact O-N 3.01Å; S252-C255 PolarHBondContact O-N 3.5Å; S252-T256 WeakPolarHBondContact O-CG2 3.44Å; S252-T256 PolarHBondContact O-N 3.15Å; S252-T256 PolarHBondContact O-OG1 3.08Å; S252-S501 VanDerWaalsContact OG-CA 3.29Å; S252-S501 WeakPolarHBondContact OG-CA 3.37Å; S252-S501 PolarHBondContact OG-O 3.2Å; S252-S501 PolarHBondContact OG-OG 3.41Å
253	R	82.9	Confident	84	Confident	71 Å²	71	26.7 Å²	26.7	27%	0.268	17%	0.174	S	C	.	.	H	α-helix	trans	-63.2	-35.2	175.7	-75.4	-178.5	-175.6	90	-11	112.7	G249 V251 T256 A257 N298 N301	G249-R253 WeakPolarHBondContact O-CB 3.4Å; G249-R253 WeakPolarHBondContact O-CG 3.16Å; G249-R253 PolarHBondContact O-N 3.09Å; G249-R253 PolarHBondContact O-NH1 2.72Å; G249-R253 VanDerWaalsContact O-NH1 3.1Å; V251-R253 PolarHBondContact O-N 3.37Å; R253-T256 PolarHBondContact O-OG1 3.12Å; R253-A257 WeakPolarHBondContact O-CA 3.11Å; R253-A257 WeakPolarHBondContact O-CB 3.27Å; R253-A257 PolarHBondContact O-N 3.08Å; R253-N298 PolarHBondContact O-OD1 3.1Å; R253-N301 WeakPolarHBondContact CD-O 3.26Å
254	T	91.2	Very high	84.6	Confident	51 Å²	51	23.6 Å²	23.6	31%	0.313	16%	0.155	S	C	.	.	H	α-helix	trans	-71.5	-40.8	179	-60.2	0	0	0	0	112.1	A250 V251 S252 T256 A257 W295 N298	A250-T254 WeakPolarHBondContact O-CB 3.35Å; A250-T254 PolarHBondContact O-N 3.14Å; A250-T254 PolarHBondContact O-OG1 3.04Å; V251-T254 PolarHBondContact O-N 3.38Å; V251-T254 VanDerWaalsContact O-N 3.1Å; S252-T254 VanDerWaalsContact C-N 3.31Å; S252-T254 PolarHBondContact O-N 3.01Å; T254-T256 VanDerWaalsContact C-N 3.32Å; T254-T256 PolarHBondContact O-N 3.24Å; T254-A257 WeakPolarHBondContact O-CB 3.44Å; T254-A257 PolarHBondContact O-N 2.93Å; T254-W295 PolarHBondContact O-NE1 3.34Å; T254-N298 PolarHBondContact OG1-ND2 3.22Å; T254-N298 VanDerWaalsContact OG1-ND2 3.07Å
255	C	88.3	Confident	85.3	Confident	72 Å²	72	24 Å²	24	49%	0.486	16%	0.157	S	C	.	.	H	α-helix	trans	-65.1	-36.4	174.9	-67.4	0	0	0	0	112.1	V251 S252 I504	V251-C255 PolarHBondContact O-N 2.83Å; V251-C255 PolarHBondContact O-SG 3.25Å; V251-C255 VanDerWaalsContact O-SG 3.37Å; S252-C255 PolarHBondContact O-N 3.5Å; C255-I504 HydrophobicContact CB-CD1 3.62Å
256	T	87.4	Confident	86.3	Confident	8 Å²	8	23.4 Å²	23.4	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-91.7	-4.9	-178.6	57.4	0	0	0	0	114.4	S252 R253 T254 P258 L259 D260 K497 P500	S252-T256 WeakPolarHBondContact O-CG2 3.44Å; S252-T256 PolarHBondContact O-N 3.15Å; S252-T256 PolarHBondContact O-OG1 3.08Å; R253-T256 PolarHBondContact O-OG1 3.12Å; T254-T256 VanDerWaalsContact C-N 3.32Å; T254-T256 PolarHBondContact O-N 3.24Å; T256-P258 VanDerWaalsContact C-CD 3.43Å; T256-L259 PolarHBondContact O-N 3.1Å; T256-D260 PolarHBondContact O-N 3.26Å; T256-K497 HydrophobicContact CG2-CB 4.33Å; T256-P500 HydrophobicContact CG2-CB 4.32Å
257	A	90.8	Very high	87	Confident	3 Å²	3	22.3 Å²	22.3	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-52.9	-39.8	-178.4	0	0	0	0	0	114.9	R253 T254 L259 D260 R261 W295 N298	R253-A257 WeakPolarHBondContact O-CA 3.11Å; R253-A257 WeakPolarHBondContact O-CB 3.27Å; R253-A257 PolarHBondContact O-N 3.08Å; T254-A257 WeakPolarHBondContact O-CB 3.44Å; T254-A257 PolarHBondContact O-N 2.93Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.11Å; A257-D260 WeakPolarHBondContact O-CB 3.12Å; A257-D260 PolarHBondContact O-N 2.95Å; A257-R261 PolarHBondContact O-N 2.9Å; A257-W295 HydrophobicContact CB-CG 4.33Å; A257-N298 HydrophobicContact CB-CB 3.94Å; A257-N298 WeakPolarHBondContact CB-OD1 3.34Å
258	P	94.9	Very high	87.5	Confident	18 Å²	18	22 Å²	22	12%	0.117	13%	0.127	C	C	.	.	H	α-helix	trans	-59.8	-41.4	176.5	-26.3	36.8	0	0	0	113.3	T256 L262 F282 L294 W295	T256-P258 VanDerWaalsContact C-CD 3.43Å; P258-L262 WeakPolarHBondContact O-CB 3.29Å; P258-L262 PolarHBondContact O-N 2.8Å; P258-F282 HydrophobicContact CB-CE1 3.85Å; P258-F282 HydrophobicContact CB-CZ 4.46Å; P258-L294 HydrophobicContact CB-CB 4.08Å; P258-L294 HydrophobicContact CG-CB 4.12Å; P258-W295 HydrophobicContact CG-CD2 4.45Å; P258-W295 HydrophobicContact CG-CH2 4.2Å; P258-W295 HydrophobicContact CG-CZ2 3.77Å
259	L	91.1	Very high	87.9	Confident	34 Å²	34	24.9 Å²	24.9	18%	0.178	14%	0.14	C	C	.	.	H	α-helix	trans	-69.7	-38.6	176.7	-70.9	168	0	0	0	111.3	T256 A257 L262 K263 F282 P493 M496 K497	T256-L259 PolarHBondContact O-N 3.1Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.11Å; L259-L262 PolarHBondContact O-N 3.14Å; L259-K263 WeakPolarHBondContact O-CB 3.33Å; L259-K263 PolarHBondContact O-N 2.77Å; L259-F282 HydrophobicContact CD2-CE2 4.31Å; L259-F282 HydrophobicContact CD2-CZ 3.9Å; L259-F282 HydrophobicContact CG-CZ 4.45Å; L259-P493 HydrophobicContact CD2-CB 4.38Å; L259-M496 HydrophobicContact CD1-CB 4.38Å; L259-M496 HydrophobicContact CD2-CB 4.33Å; L259-M496 HydrophobicContact CD2-CE 4.02Å; L259-K497 HydrophobicContact CB-CB 4.04Å; L259-K497 HydrophobicContact CD1-CB 3.81Å
260	D	87.1	Confident	88	Confident	18 Å²	18	24.8 Å²	24.8	10%	0.096	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-45.7	174.9	-114.3	25	0	0	0	111.6	T256 A257 K263 V264 N301 K357 K497	T256-D260 PolarHBondContact O-N 3.26Å; A257-D260 WeakPolarHBondContact O-CB 3.12Å; A257-D260 PolarHBondContact O-N 2.95Å; D260-K263 WeakPolarHBondContact O-CB 3.09Å; D260-K263 PolarHBondContact O-N 3.1Å; D260-V264 WeakPolarHBondContact O-CG2 3.27Å; D260-V264 PolarHBondContact O-N 3.25Å; D260-N301 PolarHBondContact OD2-ND2 3.01Å; D260-K357 IonicContact OD2-NZ 2.68Å; D260-K357 PolarHBondContact OD2-NZ 2.65Å; D260-K497 VanDerWaalsContact OD1-CD 3.24Å; D260-K497 WeakPolarHBondContact OD1-CD 3.24Å; D260-K497 IonicContact OD1-NZ 3.97Å; D260-K497 PolarHBondContact OD1-NZ 3.25Å
261	R	93	Very high	87.5	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-68.1	-42.2	176.6	-171.7	-178.4	169.6	-132.3	-4.1	111.4	A257 K263 V264 L265 M285 S293 L294 A361	A257-R261 PolarHBondContact O-N 2.9Å; R261-K263 VanDerWaalsContact C-N 3.34Å; R261-K263 PolarHBondContact O-N 2.97Å; R261-V264 PolarHBondContact O-N 3.31Å; R261-L265 HydrophobicContact CG-CD1 4.37Å; R261-L265 PolarHBondContact O-N 2.92Å; R261-M285 HydrophobicContact CB-CE 3.73Å; R261-M285 VanDerWaalsContact CD-CE 3.5Å; R261-M285 HydrophobicContact CG-CE 3.63Å; R261-S293 VanDerWaalsContact CD-O 3.29Å; R261-S293 WeakPolarHBondContact CD-O 3.31Å; R261-S293 PolarHBondContact NE-O 3.18Å; R261-S293 VanDerWaalsContact NH1-CB 3.29Å; R261-S293 PolarHBondContact NH1-O 3.24Å; R261-S293 PolarHBondContact NH1-OG 2.67Å; R261-L294 WeakPolarHBondContact CD-O 3.4Å; R261-A361 HydrophobicContact CG-CB 4.34Å; R261-A361 PolarHBondContact NE-O 3.27Å
262	L	93.2	Very high	86.3	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.6	-44.4	175.8	177.2	63.2	0	0	0	111.4	P258 L259 V264 L265 M266 I278 F282 M285 P493	P258-L262 WeakPolarHBondContact O-CB 3.29Å; P258-L262 PolarHBondContact O-N 2.8Å; L259-L262 PolarHBondContact O-N 3.14Å; L262-V264 PolarHBondContact O-N 2.93Å; L262-L265 PolarHBondContact O-N 2.86Å; L262-M266 HydrophobicContact CD1-CG 4.05Å; L262-M266 HydrophobicContact CD1-SD 4.05Å; L262-M266 HydrophobicContact CD2-SD 4.45Å; L262-M266 HydrophobicContact CG-CG 4.38Å; L262-M266 HydrophobicContact CG-SD 3.98Å; L262-M266 WeakPolarHBondContact O-CG 3.29Å; L262-M266 PolarHBondContact O-N 3.45Å; L262-I278 HydrophobicContact CD2-CB 4.28Å; L262-I278 HydrophobicContact CD2-CG1 4.41Å; L262-I278 HydrophobicContact CD2-CG2 3.79Å; L262-F282 HydrophobicContact CB-CE1 4.19Å; L262-F282 HydrophobicContact CB-CZ 4.26Å; L262-F282 HydrophobicContact CD2-CD2 3.8Å; L262-F282 HydrophobicContact CD2-CE1 4.2Å; L262-F282 HydrophobicContact CD2-CE2 3.43Å; L262-F282 VanDerWaalsContact CD2-CE2 3.43Å; L262-F282 HydrophobicContact CD2-CG 4.34Å; L262-F282 HydrophobicContact CD2-CZ 3.65Å; L262-M285 HydrophobicContact CB-SD 4.17Å; L262-M285 HydrophobicContact CD1-SD 4.18Å; L262-P493 HydrophobicContact CD2-CB 4.18Å; L262-P493 HydrophobicContact CG-CB 4.33Å; L262-P493 HydrophobicContact CG-CG 4.46Å
263	K	91.9	Very high	85.3	Confident	26 Å²	26	35.3 Å²	35.3	11%	0.113	19%	0.191	C	C	.	.	H	α-helix	trans	-52.8	-53.2	173.7	173	-169.9	178	175.8	0	110.7	L259 D260 R261 L265 M266 Q267 P493 N494	L259-K263 WeakPolarHBondContact O-CB 3.33Å; L259-K263 PolarHBondContact O-N 2.77Å; D260-K263 WeakPolarHBondContact O-CB 3.09Å; D260-K263 PolarHBondContact O-N 3.1Å; R261-K263 VanDerWaalsContact C-N 3.34Å; R261-K263 PolarHBondContact O-N 2.97Å; K263-L265 VanDerWaalsContact C-N 3.34Å; K263-L265 PolarHBondContact O-N 3.42Å; K263-M266 PolarHBondContact O-N 3.07Å; K263-Q267 VanDerWaalsContact CE-NE2 3.3Å; K263-Q267 HydrophobicContact CG-CG 4.3Å; K263-Q267 WeakPolarHBondContact O-CB 3.27Å; K263-Q267 VanDerWaalsContact O-CG 3.29Å; K263-Q267 WeakPolarHBondContact O-CG 3.26Å; K263-Q267 PolarHBondContact O-N 3.3Å; K263-P493 HydrophobicContact CB-CB 4.31Å; K263-P493 HydrophobicContact CB-CG 4.03Å; K263-N494 HydrophobicContact CD-CB 3.92Å; K263-N494 WeakPolarHBondContact CE-OD1 3.27Å; K263-N494 HydrophobicContact CG-CB 4.47Å; K263-N494 PolarHBondContact NZ-OD1 3.39Å
264	V	91.2	Very high	84.6	Confident	12 Å²	12	35.5 Å²	35.5	7%	0.073	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-41.9	-177.8	173.1	0	0	0	0	111.3	D260 R261 L262 Q267 V268 T358 A361 L362 T455	D260-V264 WeakPolarHBondContact O-CG2 3.27Å; D260-V264 PolarHBondContact O-N 3.25Å; R261-V264 PolarHBondContact O-N 3.31Å; L262-V264 PolarHBondContact O-N 2.93Å; V264-Q267 PolarHBondContact O-N 3.41Å; V264-V268 WeakPolarHBondContact O-CB 3.45Å; V264-V268 VanDerWaalsContact O-CG2 3.32Å; V264-V268 WeakPolarHBondContact O-CG2 3.29Å; V264-V268 PolarHBondContact O-N 2.69Å; V264-T358 HydrophobicContact CG1-CG2 4.17Å; V264-A361 HydrophobicContact CG1-CB 4.19Å; V264-L362 HydrophobicContact CG1-CD1 4.12Å; V264-L362 HydrophobicContact CG1-CD2 3.73Å; V264-L362 HydrophobicContact CG1-CG 3.72Å; V264-T455 HydrophobicContact CG1-CG2 4.08Å
265	L	90.9	Very high	83.3	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-45.4	175.5	-78	168.1	0	0	0	112.3	R261 L262 K263 V268 H269 M285 L362	R261-L265 HydrophobicContact CG-CD1 4.37Å; R261-L265 PolarHBondContact O-N 2.92Å; L262-L265 PolarHBondContact O-N 2.86Å; K263-L265 VanDerWaalsContact C-N 3.34Å; K263-L265 PolarHBondContact O-N 3.42Å; L265-V268 PolarHBondContact O-N 2.79Å; L265-H269 WeakPolarHBondContact O-CB 3.45Å; L265-H269 PolarHBondContact O-N 3.5Å; L265-M285 HydrophobicContact CD1-CE 4.25Å; L265-M285 HydrophobicContact CD1-CG 3.32Å; L265-M285 HydrophobicContact CD1-SD 3.71Å; L265-L362 HydrophobicContact CD2-CD2 3.8Å; L265-L362 HydrophobicContact CG-CD2 4.33Å
266	M	90.7	Very high	82.6	Confident	22 Å²	22	34.6 Å²	34.6	11%	0.108	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-36.3	177.6	-69.5	-178.8	66.3	0	0	112.4	L262 K263 V268 A270 M276 P493	L262-M266 HydrophobicContact CD1-CG 4.05Å; L262-M266 HydrophobicContact CD1-SD 4.05Å; L262-M266 HydrophobicContact CD2-SD 4.45Å; L262-M266 HydrophobicContact CG-CG 4.38Å; L262-M266 HydrophobicContact CG-SD 3.98Å; L262-M266 WeakPolarHBondContact O-CG 3.29Å; L262-M266 PolarHBondContact O-N 3.45Å; K263-M266 PolarHBondContact O-N 3.07Å; M266-V268 PolarHBondContact O-N 3.49Å; M266-A270 VanDerWaalsContact O-CB 3.23Å; M266-A270 WeakPolarHBondContact O-CB 3.33Å; M266-A270 PolarHBondContact O-N 2.87Å; M266-M276 VanDerWaalsContact CE-O 3.23Å; M266-M276 WeakPolarHBondContact CE-O 3.43Å; M266-M276 HydrophobicContact CG-CB 4.3Å; M266-P493 HydrophobicContact SD-CG 3.84Å
267	Q	90.4	Very high	82.4	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.009	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-30.9	176.2	-79.9	-170.7	-29.7	0	0	112.2	K263 V264 Y448 L452 T455 R456 R489	K263-Q267 VanDerWaalsContact CE-NE2 3.3Å; K263-Q267 HydrophobicContact CG-CG 4.3Å; K263-Q267 WeakPolarHBondContact O-CB 3.27Å; K263-Q267 VanDerWaalsContact O-CG 3.29Å; K263-Q267 WeakPolarHBondContact O-CG 3.26Å; K263-Q267 PolarHBondContact O-N 3.3Å; V264-Q267 PolarHBondContact O-N 3.41Å; Q267-Y448 PolarHBondContact NE2-OH 3.42Å; Q267-L452 HydrophobicContact CB-CD1 3.57Å; Q267-L452 HydrophobicContact CG-CD1 3.54Å; Q267-L452 WeakPolarHBondContact O-CD1 3.23Å; Q267-T455 HydrophobicContact CB-CG2 4.16Å; Q267-T455 VanDerWaalsContact OE1-CB 3.26Å; Q267-T455 VanDerWaalsContact OE1-CG2 3.31Å; Q267-T455 PolarHBondContact OE1-OG1 2.61Å; Q267-R456 PolarHBondContact O-NE 3.19Å; Q267-R489 VanDerWaalsContact CG-O 3.24Å; Q267-R489 WeakPolarHBondContact CG-O 3.48Å
268	V	88.4	Confident	82.3	Confident	18 Å²	18	46.1 Å²	46.1	11%	0.109	24%	0.239	C	C	.	.	H	α-helix	trans	-104.1	-45.5	-169.1	172.2	0	0	0	0	113.3	V264 L265 M266 L362 T455 R456 A459 L463	V264-V268 WeakPolarHBondContact O-CB 3.45Å; V264-V268 VanDerWaalsContact O-CG2 3.32Å; V264-V268 WeakPolarHBondContact O-CG2 3.29Å; V264-V268 PolarHBondContact O-N 2.69Å; L265-V268 PolarHBondContact O-N 2.79Å; M266-V268 PolarHBondContact O-N 3.49Å; V268-L362 HydrophobicContact CB-CD1 4.43Å; V268-L362 HydrophobicContact CB-CD2 4.08Å; V268-L362 HydrophobicContact CG1-CD1 4.15Å; V268-L362 HydrophobicContact CG1-CD2 4.19Å; V268-L362 HydrophobicContact CG2-CD1 3.99Å; V268-L362 HydrophobicContact CG2-CD2 4.26Å; V268-T455 HydrophobicContact CG2-CG2 3.87Å; V268-R456 HydrophobicContact CG2-CG 4.49Å; V268-A459 HydrophobicContact CB-CB 4.48Å; V268-A459 HydrophobicContact CG1-CB 3.8Å; V268-A459 HydrophobicContact CG2-CB 3.76Å; V268-L463 HydrophobicContact CG1-CD1 3.17Å; V268-L463 HydrophobicContact CG1-CG 4.46Å
269	H	84.1	Confident	81.9	Confident	60 Å²	60	47.8 Å²	47.8	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-99.4	-20.4	-172.5	-65.7	107.2	0	0	0	114.5	L265 S271 M276 L463	L265-H269 WeakPolarHBondContact O-CB 3.45Å; L265-H269 PolarHBondContact O-N 3.5Å; H269-S271 PolarHBondContact O-N 2.87Å; H269-M276 HydrophobicContact CB-SD 3.88Å; H269-L463 VanDerWaalsContact NE2-CD2 3.31Å; H269-L463 WeakPolarHBondContact NE2-CD2 3.47Å
270	A	75.4	Confident	81.7	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.041	27%	0.269	C	S	.	.			trans	-74.8	130.4	179.7	0	0	0	0	0	109.8	M266 N274 M276 R489	M266-A270 VanDerWaalsContact O-CB 3.23Å; M266-A270 WeakPolarHBondContact O-CB 3.33Å; M266-A270 PolarHBondContact O-N 2.87Å; A270-N274 WeakPolarHBondContact CA-O 3.27Å; A270-M276 HydrophobicContact CB-CB 4.13Å; A270-M276 HydrophobicContact CB-CG 4.15Å; A270-M276 HydrophobicContact CB-SD 4.36Å; A270-R489 WeakPolarHBondContact O-CD 3.38Å; A270-R489 PolarHBondContact O-NH1 3.38Å
271	S	70.6	Confident	81.8	Confident	39 Å²	39	47.9 Å²	47.9	27%	0.273	26%	0.264	S	S	.	.			trans	-130.4	173.8	-177.8	-173	0	0	0	0	110.1	H269 T273 N274	H269-S271 PolarHBondContact O-N 2.87Å; S271-T273 PolarHBondContact O-N 3.27Å; S271-N274 PolarHBondContact N-O 3.16Å; S271-N274 VanDerWaalsContact N-O 3.09Å; S271-N274 CarbonylContact O-C 3.42Å; S271-N274 VanDerWaalsContact O-C 3.27Å; S271-N274 PolarHBondContact O-N 3.19Å; S271-N274 VanDerWaalsContact O-N 3.17Å; S271-N274 VanDerWaalsContact O-O 3.12Å
272	K	60.7	Low	81.8	Confident	134 Å²	134	50.1 Å²	50.1	58%	0.583	27%	0.274	S	S	*	.	S	Bend	trans	-57.2	-34.7	170.1	-88.7	-174.3	-178.4	157	0	112	T481 E482	K272-T481 VanDerWaalsContact CD-O 3.28Å; K272-T481 WeakPolarHBondContact CD-O 3.39Å; K272-T481 WeakPolarHBondContact CE-O 3.48Å; K272-T481 PolarHBondContact NZ-O 3.48Å; K272-E482 WeakPolarHBondContact CE-O 3.21Å
273	T	57.8	Low	81.7	Confident	136 Å²	136	53.9 Å²	53.9	83%	0.834	29%	0.294	S	S	*	.	S	Bend	trans	-85.8	-14.4	178.9	52.3	0	0	0	0	113.6	S271	S271-T273 PolarHBondContact O-N 3.27Å
274	N	67.4	Low	81.6	Confident	75 Å²	75	57 Å²	57	40%	0.401	31%	0.309	S	S	.	.			trans	-132	82	-177.9	-173.5	15.4	0	0	0	110	A270 S271 M276	A270-N274 WeakPolarHBondContact CA-O 3.27Å; S271-N274 PolarHBondContact N-O 3.16Å; S271-N274 VanDerWaalsContact N-O 3.09Å; S271-N274 CarbonylContact O-C 3.42Å; S271-N274 VanDerWaalsContact O-C 3.27Å; S271-N274 PolarHBondContact O-N 3.19Å; S271-N274 VanDerWaalsContact O-N 3.17Å; S271-N274 VanDerWaalsContact O-O 3.12Å; N274-M276 PolarHBondContact O-N 3.5Å; N274-M276 VanDerWaalsContact O-N 3.08Å
275	S	64.3	Low	81.6	Confident	96 Å²	96	56.4 Å²	56.4	67%	0.671	31%	0.305	S	S	*	.			trans	-77.2	91.1	175.3	-170.8	0	0	0	0	109.7	R277	S275-R277 PolarHBondContact O-N 3.07Å; S275-R277 VanDerWaalsContact O-N 3.12Å
276	M	73.6	Confident	81.7	Confident	9 Å²	9	59.2 Å²	59.2	4%	0.044	32%	0.319	C	S	.	.			trans	-71.9	102.9	172.2	-64.8	-176	66.1	0	0	109.3	M266 H269 A270 N274 Q284	M266-M276 VanDerWaalsContact CE-O 3.23Å; M266-M276 WeakPolarHBondContact CE-O 3.43Å; M266-M276 HydrophobicContact CG-CB 4.3Å; H269-M276 HydrophobicContact CB-SD 3.88Å; A270-M276 HydrophobicContact CB-CB 4.13Å; A270-M276 HydrophobicContact CB-CG 4.15Å; A270-M276 HydrophobicContact CB-SD 4.36Å; N274-M276 PolarHBondContact O-N 3.5Å; N274-M276 VanDerWaalsContact O-N 3.08Å; M276-Q284 VanDerWaalsContact CE-OE1 3.24Å
277	R	84.2	Confident	81.7	Confident	195 Å²	195	67.5 Å²	67.5	74%	0.736	35%	0.35	S	S	*	.			trans	-70.9	156.9	166.5	-62.3	-180	-179.9	170.9	-0.6	109.2	S275 G279 S280 G281	S275-R277 PolarHBondContact O-N 3.07Å; S275-R277 VanDerWaalsContact O-N 3.12Å; R277-G279 PolarHBondContact O-N 3.11Å; R277-S280 PolarHBondContact N-OG 2.78Å; R277-S280 VanDerWaalsContact N-OG 3.12Å; R277-S280 PolarHBondContact O-N 3.06Å; R277-S280 PolarHBondContact O-OG 2.66Å; R277-G281 PolarHBondContact O-N 3.39Å
278	I	87.8	Confident	81.6	Confident	58 Å²	58	70.6 Å²	70.6	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-54.8	-50.8	-178.7	-70.5	153.6	0	0	0	111.4	L262 S280 G281 F282 A492 M496	L262-I278 HydrophobicContact CD2-CB 4.28Å; L262-I278 HydrophobicContact CD2-CG1 4.41Å; L262-I278 HydrophobicContact CD2-CG2 3.79Å; I278-S280 PolarHBondContact O-N 3.45Å; I278-G281 PolarHBondContact O-N 2.91Å; I278-F282 HydrophobicContact CG2-CD2 3.97Å; I278-F282 HydrophobicContact CG2-CE2 3.82Å; I278-F282 WeakPolarHBondContact O-CD2 3.43Å; I278-F282 PolarHBondContact O-N 3.35Å; I278-A492 HydrophobicContact CD1-CB 4.09Å; I278-M496 HydrophobicContact CD1-CE 3.37Å; I278-M496 HydrophobicContact CD1-SD 4.1Å; I278-M496 HydrophobicContact CG1-CE 3.84Å; I278-M496 HydrophobicContact CG2-CE 3.99Å
279	G	86.9	Confident	81.5	Confident	52 Å²	52	71 Å²	71	54%	0.536	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-40.6	-179.9	0	0	0	0	0	113.4	R277 G281 F282 L283	R277-G279 PolarHBondContact O-N 3.11Å; G279-G281 VanDerWaalsContact C-N 3.34Å; G279-F282 PolarHBondContact O-N 3.14Å; G279-L283 WeakPolarHBondContact O-CB 3.24Å; G279-L283 PolarHBondContact O-N 3.35Å
280	S	86.6	Confident	81.9	Confident	55 Å²	55	69.7 Å²	69.7	39%	0.385	38%	0.375	S	S	.	.	H	α-helix	trans	-70.2	-32.3	177.3	62.1	0	0	0	0	112.3	R277 I278 L283 Q284	R277-S280 PolarHBondContact N-OG 2.78Å; R277-S280 VanDerWaalsContact N-OG 3.12Å; R277-S280 PolarHBondContact O-N 3.06Å; R277-S280 PolarHBondContact O-OG 2.66Å; I278-S280 PolarHBondContact O-N 3.45Å; S280-L283 PolarHBondContact O-N 2.88Å; S280-Q284 WeakPolarHBondContact O-CB 3.2Å; S280-Q284 PolarHBondContact O-N 2.85Å
281	G	89	Confident	82.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.5	-47.5	172.4	0	0	0	0	0	112.4	R277 I278 G279 L283 Q284 M285	R277-G281 PolarHBondContact O-N 3.39Å; I278-G281 PolarHBondContact O-N 2.91Å; G279-G281 VanDerWaalsContact C-N 3.34Å; G281-L283 PolarHBondContact O-N 3.42Å; G281-Q284 PolarHBondContact O-N 3.3Å; G281-M285 VanDerWaalsContact O-CG 3.23Å; G281-M285 WeakPolarHBondContact O-CG 3.28Å; G281-M285 PolarHBondContact O-N 2.9Å
282	F	92.9	Very high	83.7	Confident	50 Å²	50	83 Å²	83	22%	0.219	43%	0.428	C	S	.	.	H	α-helix	trans	-61.4	-43.8	173.4	-79.4	-57.7	0	0	0	112.3	P258 L259 L262 I278 G279 Q284 M285 I286 L294	P258-F282 HydrophobicContact CB-CE1 3.85Å; P258-F282 HydrophobicContact CB-CZ 4.46Å; L259-F282 HydrophobicContact CD2-CE2 4.31Å; L259-F282 HydrophobicContact CD2-CZ 3.9Å; L259-F282 HydrophobicContact CG-CZ 4.45Å; L262-F282 HydrophobicContact CB-CE1 4.19Å; L262-F282 HydrophobicContact CB-CZ 4.26Å; L262-F282 HydrophobicContact CD2-CD2 3.8Å; L262-F282 HydrophobicContact CD2-CE1 4.2Å; L262-F282 HydrophobicContact CD2-CE2 3.43Å; L262-F282 VanDerWaalsContact CD2-CE2 3.43Å; L262-F282 HydrophobicContact CD2-CG 4.34Å; L262-F282 HydrophobicContact CD2-CZ 3.65Å; I278-F282 HydrophobicContact CG2-CD2 3.97Å; I278-F282 HydrophobicContact CG2-CE2 3.82Å; I278-F282 WeakPolarHBondContact O-CD2 3.43Å; I278-F282 PolarHBondContact O-N 3.35Å; G279-F282 PolarHBondContact O-N 3.14Å; F282-Q284 VanDerWaalsContact C-N 3.31Å; F282-Q284 PolarHBondContact O-N 2.67Å; F282-M285 HydrophobicContact CD1-SD 4Å; F282-M285 WeakPolarHBondContact O-CB 3.35Å; F282-M285 PolarHBondContact O-N 3.27Å; F282-I286 WeakPolarHBondContact O-CG1 3.38Å; F282-I286 PolarHBondContact O-N 3.29Å; F282-L294 HydrophobicContact CD1-CD2 3.77Å; F282-L294 HydrophobicContact CE1-CD2 4.28Å
283	L	91.1	Very high	85.2	Confident	80 Å²	80	76.7 Å²	76.7	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-40.7	177.4	-175.6	60.7	0	0	0	111.7	G279 S280 G281 I286 R287	G279-L283 WeakPolarHBondContact O-CB 3.24Å; G279-L283 PolarHBondContact O-N 3.35Å; S280-L283 PolarHBondContact O-N 2.88Å; G281-L283 PolarHBondContact O-N 3.42Å; L283-I286 PolarHBondContact O-N 2.84Å; L283-R287 HydrophobicContact CD1-CG 4.33Å; L283-R287 HydrophobicContact CG-CG 4.45Å; L283-R287 VanDerWaalsContact O-CB 3.32Å; L283-R287 WeakPolarHBondContact O-CB 3.36Å; L283-R287 VanDerWaalsContact O-CG 3.25Å; L283-R287 WeakPolarHBondContact O-CG 3.39Å; L283-R287 PolarHBondContact O-N 3.09Å
284	Q	88.9	Confident	86.9	Confident	90 Å²	90	71.1 Å²	71.1	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-44.7	174.9	-178.1	179.4	-4.5	0	0	111.6	M276 S280 G281 F282 I286 R287 E288	M276-Q284 VanDerWaalsContact CE-OE1 3.24Å; S280-Q284 WeakPolarHBondContact O-CB 3.2Å; S280-Q284 PolarHBondContact O-N 2.85Å; G281-Q284 PolarHBondContact O-N 3.3Å; F282-Q284 VanDerWaalsContact C-N 3.31Å; F282-Q284 PolarHBondContact O-N 2.67Å; Q284-I286 VanDerWaalsContact C-N 3.35Å; Q284-I286 PolarHBondContact O-N 2.83Å; Q284-R287 PolarHBondContact O-N 3.41Å; Q284-E288 WeakPolarHBondContact O-CB 3.39Å; Q284-E288 PolarHBondContact O-N 2.95Å
285	M	91.4	Very high	88.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-47.6	176.6	-68	159.7	76	0	0	111.4	R261 L262 L265 G281 F282 E288 G289 S293 L294	R261-M285 HydrophobicContact CB-CE 3.73Å; R261-M285 VanDerWaalsContact CD-CE 3.5Å; R261-M285 HydrophobicContact CG-CE 3.63Å; L262-M285 HydrophobicContact CB-SD 4.17Å; L262-M285 HydrophobicContact CD1-SD 4.18Å; L265-M285 HydrophobicContact CD1-CE 4.25Å; L265-M285 HydrophobicContact CD1-CG 3.32Å; L265-M285 HydrophobicContact CD1-SD 3.71Å; G281-M285 VanDerWaalsContact O-CG 3.23Å; G281-M285 WeakPolarHBondContact O-CG 3.28Å; G281-M285 PolarHBondContact O-N 2.9Å; F282-M285 HydrophobicContact CD1-SD 4Å; F282-M285 WeakPolarHBondContact O-CB 3.35Å; F282-M285 PolarHBondContact O-N 3.27Å; M285-E288 PolarHBondContact O-N 3.18Å; M285-G289 PolarHBondContact O-N 3.15Å; M285-S293 PolarHBondContact O-OG 3.44Å; M285-L294 HydrophobicContact CB-CD2 3.94Å; M285-L294 HydrophobicContact CE-CD2 3.56Å; M285-L294 HydrophobicContact SD-CD2 4.15Å
286	I	93.8	Very high	89.5	Confident	67 Å²	67	69 Å²	69	34%	0.344	34%	0.337	S	S	.	.	H	α-helix	trans	-67	-42	-179.7	-65.3	167.8	0	0	0	110.9	F282 L283 Q284 E288 G290 L294	F282-I286 WeakPolarHBondContact O-CG1 3.38Å; F282-I286 PolarHBondContact O-N 3.29Å; L283-I286 PolarHBondContact O-N 2.84Å; Q284-I286 VanDerWaalsContact C-N 3.35Å; Q284-I286 PolarHBondContact O-N 2.83Å; I286-E288 VanDerWaalsContact C-N 3.3Å; I286-E288 PolarHBondContact O-N 3.42Å; I286-G290 WeakPolarHBondContact O-CA 3.48Å; I286-G290 PolarHBondContact O-N 2.79Å; I286-L294 HydrophobicContact CG1-CD2 4.15Å; I286-L294 HydrophobicContact CG1-CG 4.41Å
287	R	90.6	Very high	90.2	Very high	197 Å²	197	69.1 Å²	69.1	74%	0.743	34%	0.341	S	S	*	.	H	α-helix	trans	-63.2	-35.2	176.3	-77	177.9	179.2	-179.4	-0.7	112.7	L283 Q284	L283-R287 HydrophobicContact CD1-CG 4.33Å; L283-R287 HydrophobicContact CG-CG 4.45Å; L283-R287 VanDerWaalsContact O-CB 3.32Å; L283-R287 WeakPolarHBondContact O-CB 3.36Å; L283-R287 VanDerWaalsContact O-CG 3.25Å; L283-R287 WeakPolarHBondContact O-CG 3.39Å; L283-R287 PolarHBondContact O-N 3.09Å; Q284-R287 PolarHBondContact O-N 3.41Å
288	E	88.4	Confident	90.5	Very high	67 Å²	67	60.6 Å²	60.6	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-75.4	-36.8	-177.4	-166.4	-149.4	119.9	0	0	113.3	Q284 M285 I286 R296 K364 T365	Q284-E288 WeakPolarHBondContact O-CB 3.39Å; Q284-E288 PolarHBondContact O-N 2.95Å; M285-E288 PolarHBondContact O-N 3.18Å; I286-E288 VanDerWaalsContact C-N 3.3Å; I286-E288 PolarHBondContact O-N 3.42Å; E288-R296 IonicContact OE1-CZ 3.81Å; E288-R296 IonicContact OE1-NH1 3.03Å; E288-R296 PolarHBondContact OE1-NH1 3.46Å; E288-K364 VanDerWaalsContact OE1-CA 3.27Å; E288-K364 WeakPolarHBondContact OE1-CA 3.44Å; E288-T365 PolarHBondContact O-OG1 3.11Å; E288-T365 PolarHBondContact OE1-N 3.15Å
289	G	85.4	Confident	90.7	Very high	26 Å²	26	59.8 Å²	59.8	27%	0.268	32%	0.315	S	S	.	.	H	α-helix	trans	-150.4	18.9	-170.5	0	0	0	0	0	115.9	M285	M285-G289 PolarHBondContact O-N 3.15Å
290	G	92.5	Very high	90.8	Very high	33 Å²	33	57.5 Å²	57.5	34%	0.34	29%	0.291	S	S	.	.			trans	69	-173.2	-176.9	0	0	0	0	0	113.8	I286 R292 S293	I286-G290 WeakPolarHBondContact O-CA 3.48Å; I286-G290 PolarHBondContact O-N 2.79Å; G290-R292 VanDerWaalsContact C-N 3.34Å; G290-R292 PolarHBondContact O-N 2.73Å; G290-S293 VanDerWaalsContact O-CB 3.25Å; G290-S293 WeakPolarHBondContact O-CB 3.17Å; G290-S293 PolarHBondContact O-N 2.69Å; G290-S293 VanDerWaalsContact O-N 3.11Å; G290-S293 PolarHBondContact O-OG 3.09Å
291	V	93.1	Very high	90.7	Very high	91 Å²	91	55.2 Å²	55.2	55%	0.552	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-61.8	-40.1	-177.8	179.1	0	0	0	0	112	S293 L294 W295	V291-S293 PolarHBondContact O-N 2.89Å; V291-S293 VanDerWaalsContact O-N 3.09Å; V291-L294 HydrophobicContact CG1-CD1 4.44Å; V291-L294 WeakPolarHBondContact O-CB 3.31Å; V291-L294 VanDerWaalsContact O-CG 3.3Å; V291-L294 WeakPolarHBondContact O-CG 3.22Å; V291-L294 PolarHBondContact O-N 3.42Å; V291-L294 VanDerWaalsContact O-N 3.08Å; V291-W295 HydrophobicContact CG1-CZ3 4.14Å; V291-W295 WeakPolarHBondContact O-CZ3 3.43Å
292	R	91.1	Very high	90.6	Very high	232 Å²	232	57.4 Å²	57.4	88%	0.875	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-60.5	-22.8	177.7	-69.6	-174.9	179.5	176	0.3	113	G290 L294 W295	G290-R292 VanDerWaalsContact C-N 3.34Å; G290-R292 PolarHBondContact O-N 2.73Å; R292-L294 PolarHBondContact O-N 3.18Å; R292-W295 PolarHBondContact O-N 2.89Å
293	S	91.9	Very high	90.5	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.014	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-61.5	-30.5	177.5	78.6	0	0	0	0	112.1	R261 M285 G290 V291 W295 R296	R261-S293 VanDerWaalsContact CD-O 3.29Å; R261-S293 WeakPolarHBondContact CD-O 3.31Å; R261-S293 PolarHBondContact NE-O 3.18Å; R261-S293 VanDerWaalsContact NH1-CB 3.29Å; R261-S293 PolarHBondContact NH1-O 3.24Å; R261-S293 PolarHBondContact NH1-OG 2.67Å; M285-S293 PolarHBondContact O-OG 3.44Å; G290-S293 VanDerWaalsContact O-CB 3.25Å; G290-S293 WeakPolarHBondContact O-CB 3.17Å; G290-S293 PolarHBondContact O-N 2.69Å; G290-S293 VanDerWaalsContact O-N 3.11Å; G290-S293 PolarHBondContact O-OG 3.09Å; V291-S293 PolarHBondContact O-N 2.89Å; V291-S293 VanDerWaalsContact O-N 3.09Å; S293-W295 PolarHBondContact O-N 2.7Å; S293-R296 WeakPolarHBondContact O-CB 3.38Å; S293-R296 VanDerWaalsContact O-CG 3.31Å; S293-R296 WeakPolarHBondContact O-CG 3.31Å; S293-R296 PolarHBondContact O-N 3.01Å
294	L	94	Very high	90.2	Very high	19 Å²	19	56.7 Å²	56.7	10%	0.099	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.4	-28.6	-176.8	-62.4	175.8	0	0	0	112.7	P258 R261 F282 M285 I286 V291 R292	P258-L294 HydrophobicContact CB-CB 4.08Å; P258-L294 HydrophobicContact CG-CB 4.12Å; R261-L294 WeakPolarHBondContact CD-O 3.4Å; F282-L294 HydrophobicContact CD1-CD2 3.77Å; F282-L294 HydrophobicContact CE1-CD2 4.28Å; M285-L294 HydrophobicContact CB-CD2 3.94Å; M285-L294 HydrophobicContact CE-CD2 3.56Å; M285-L294 HydrophobicContact SD-CD2 4.15Å; I286-L294 HydrophobicContact CG1-CD2 4.15Å; I286-L294 HydrophobicContact CG1-CG 4.41Å; V291-L294 HydrophobicContact CG1-CD1 4.44Å; V291-L294 WeakPolarHBondContact O-CB 3.31Å; V291-L294 VanDerWaalsContact O-CG 3.3Å; V291-L294 WeakPolarHBondContact O-CG 3.22Å; V291-L294 PolarHBondContact O-N 3.42Å; V291-L294 VanDerWaalsContact O-N 3.08Å; R292-L294 PolarHBondContact O-N 3.18Å
295	W	94.4	Very high	89.7	Confident	99 Å²	99	53.3 Å²	53.3	38%	0.375	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-96	11.7	179.5	-71.1	-93.7	0	0	0	115.1	T254 A257 P258 V291 R292 S293 G297 N298	T254-W295 PolarHBondContact O-NE1 3.34Å; A257-W295 HydrophobicContact CB-CG 4.33Å; P258-W295 HydrophobicContact CG-CD2 4.45Å; P258-W295 HydrophobicContact CG-CH2 4.2Å; P258-W295 HydrophobicContact CG-CZ2 3.77Å; V291-W295 HydrophobicContact CG1-CZ3 4.14Å; V291-W295 WeakPolarHBondContact O-CZ3 3.43Å; R292-W295 PolarHBondContact O-N 2.89Å; S293-W295 PolarHBondContact O-N 2.7Å; W295-G297 PolarHBondContact O-N 3.01Å; W295-N298 HydrophobicContact CB-CB 4.22Å; W295-N298 WeakPolarHBondContact O-CB 3.36Å; W295-N298 PolarHBondContact O-N 2.92Å
296	R	92.1	Very high	89.2	Confident	28 Å²	28	55.4 Å²	55.4	11%	0.106	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	128.6	175.8	-75.7	176.2	-178.6	170.7	10.6	110.8	E288 S293 N298 R363 T365	E288-R296 IonicContact OE1-CZ 3.81Å; E288-R296 IonicContact OE1-NH1 3.03Å; E288-R296 PolarHBondContact OE1-NH1 3.46Å; S293-R296 WeakPolarHBondContact O-CB 3.38Å; S293-R296 VanDerWaalsContact O-CG 3.31Å; S293-R296 WeakPolarHBondContact O-CG 3.31Å; S293-R296 PolarHBondContact O-N 3.01Å; R296-N298 VanDerWaalsContact C-N 3.32Å; R296-R363 PolarHBondContact NH1-O 2.88Å; R296-T365 PolarHBondContact NH2-OG1 3.11Å
297	G	88.2	Confident	88.9	Confident	11 Å²	11	55 Å²	55	11%	0.113	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-11.6	-175	0	0	0	0	0	114.6	W295 G299 I300 N301	W295-G297 PolarHBondContact O-N 3.01Å; G297-G299 VanDerWaalsContact C-N 3.29Å; G297-G299 PolarHBondContact O-N 3.41Å; G297-I300 PolarHBondContact O-N 3.49Å; G297-N301 PolarHBondContact O-N 3.02Å
298	N	91.1	Very high	88.4	Confident	16 Å²	16	48.3 Å²	48.3	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-33.6	-178.3	-171.5	53.5	0	0	0	113.2	R253 T254 A257 W295 R296 I300 N301 V302	R253-N298 PolarHBondContact O-OD1 3.1Å; T254-N298 PolarHBondContact OG1-ND2 3.22Å; T254-N298 VanDerWaalsContact OG1-ND2 3.07Å; A257-N298 HydrophobicContact CB-CB 3.94Å; A257-N298 WeakPolarHBondContact CB-OD1 3.34Å; W295-N298 HydrophobicContact CB-CB 4.22Å; W295-N298 WeakPolarHBondContact O-CB 3.36Å; W295-N298 PolarHBondContact O-N 2.92Å; R296-N298 VanDerWaalsContact C-N 3.32Å; N298-I300 VanDerWaalsContact C-N 3.28Å; N298-I300 PolarHBondContact O-N 2.68Å; N298-N301 WeakPolarHBondContact O-CA 3.29Å; N298-N301 WeakPolarHBondContact O-CB 3.38Å; N298-N301 PolarHBondContact O-N 3.25Å; N298-V302 PolarHBondContact O-N 2.77Å
299	G	91.3	Very high	87.8	Confident	40 Å²	40	48.1 Å²	48.1	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-55.4	-43	177.7	0	0	0	0	0	112.6	G297 V302 I303	G297-G299 VanDerWaalsContact C-N 3.29Å; G297-G299 PolarHBondContact O-N 3.41Å; G299-V302 PolarHBondContact O-N 2.92Å; G299-I303 WeakPolarHBondContact O-CB 3.47Å; G299-I303 WeakPolarHBondContact O-CD1 3.2Å; G299-I303 WeakPolarHBondContact O-CG1 3.42Å; G299-I303 PolarHBondContact O-N 3.37Å
300	I	89.6	Confident	87.6	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-40.3	176.3	-63.2	-173.8	0	0	0	111.2	G297 N298 V302 I303 K304 M353 L356 K357 L360 I371	G297-I300 PolarHBondContact O-N 3.49Å; N298-I300 VanDerWaalsContact C-N 3.28Å; N298-I300 PolarHBondContact O-N 2.68Å; I300-V302 PolarHBondContact O-N 3.14Å; I300-I303 PolarHBondContact O-N 2.7Å; I300-K304 WeakPolarHBondContact O-CB 3.12Å; I300-K304 WeakPolarHBondContact O-CG 3.47Å; I300-K304 PolarHBondContact O-N 2.76Å; I300-M353 HydrophobicContact CG2-CB 4.04Å; I300-M353 HydrophobicContact CG2-CE 4.39Å; I300-M353 WeakPolarHBondContact CG2-O 3.32Å; I300-L356 HydrophobicContact CD1-CB 3.45Å; I300-L356 VanDerWaalsContact CD1-CB 3.45Å; I300-K357 HydrophobicContact CB-CB 4.32Å; I300-K357 HydrophobicContact CG2-CB 3.97Å; I300-L360 HydrophobicContact CD1-CD1 3.44Å; I300-L360 VanDerWaalsContact CD1-CD1 3.44Å; I300-L360 HydrophobicContact CD1-CG 4.47Å; I300-L360 HydrophobicContact CG1-CD1 4.07Å; I300-I371 HydrophobicContact CD1-CG1 4.21Å; I300-I371 HydrophobicContact CD1-CG2 3.93Å; I300-I371 HydrophobicContact CG1-CD1 3.77Å; I300-I371 HydrophobicContact CG1-CG1 3.96Å; I300-I371 HydrophobicContact CG1-CG2 4.23Å
301	N	83.7	Confident	87.2	Confident	6 Å²	6	50 Å²	50	3%	0.032	28%	0.28	C	S	.	.	H	α-helix	trans	-56.5	-35.2	177	-104.6	-10.5	0	0	0	112.9	R253 D260 G297 N298 I305 K357	R253-N301 WeakPolarHBondContact CD-O 3.26Å; D260-N301 PolarHBondContact OD2-ND2 3.01Å; G297-N301 PolarHBondContact O-N 3.02Å; N298-N301 WeakPolarHBondContact O-CA 3.29Å; N298-N301 WeakPolarHBondContact O-CB 3.38Å; N298-N301 PolarHBondContact O-N 3.25Å; N301-I305 WeakPolarHBondContact O-CG1 3.44Å; N301-K357 WeakPolarHBondContact ND2-CE 3.46Å; N301-K357 PolarHBondContact ND2-NZ 3Å; N301-K357 WeakPolarHBondContact OD1-CD 3.26Å; N301-K357 WeakPolarHBondContact OD1-CE 3.46Å; N301-K357 PolarHBondContact OD1-NZ 3.01Å
302	V	87.9	Confident	86.6	Confident	47 Å²	47	48.3 Å²	48.3	29%	0.285	27%	0.265	S	S	.	.	H	α-helix	trans	-83.1	-48.6	177.6	175.9	0	0	0	0	111	A250 N298 G299 I300 K304 I305	A250-V302 HydrophobicContact CB-CG1 3.79Å; A250-V302 HydrophobicContact CB-CG2 4.43Å; N298-V302 PolarHBondContact O-N 2.77Å; G299-V302 PolarHBondContact O-N 2.92Å; I300-V302 PolarHBondContact O-N 3.14Å; V302-K304 VanDerWaalsContact C-N 3.26Å; V302-K304 PolarHBondContact O-N 2.97Å; V302-I305 WeakPolarHBondContact O-CB 3.44Å; V302-I305 VanDerWaalsContact O-CG1 3.29Å; V302-I305 WeakPolarHBondContact O-CG1 3.48Å; V302-I305 PolarHBondContact O-N 3.31Å
303	I	90.4	Very high	85.9	Confident	99 Å²	99	41 Å²	41	51%	0.508	24%	0.24	S	C	.	.	H	α-helix	trans	-59.3	-38.6	-177.3	-68.6	165.8	0	0	0	111.4	G299 I300 I305 P307 M353 I371	G299-I303 WeakPolarHBondContact O-CB 3.47Å; G299-I303 WeakPolarHBondContact O-CD1 3.2Å; G299-I303 WeakPolarHBondContact O-CG1 3.42Å; G299-I303 PolarHBondContact O-N 3.37Å; I300-I303 PolarHBondContact O-N 2.7Å; I303-I305 PolarHBondContact O-N 3.14Å; I303-P307 WeakPolarHBondContact O-CD 3.35Å; I303-M353 HydrophobicContact CB-CE 4.47Å; I303-M353 HydrophobicContact CG2-CE 3.92Å; I303-I371 HydrophobicContact CD1-CD1 4.19Å
304	K	85.3	Confident	85.5	Confident	16 Å²	16	46.3 Å²	46.3	7%	0.07	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.1	-176.2	74.9	177.9	-170.1	164.6	0	114.2	I300 V302 G306 P307 E308 I350 M353 E354	I300-K304 WeakPolarHBondContact O-CB 3.12Å; I300-K304 WeakPolarHBondContact O-CG 3.47Å; I300-K304 PolarHBondContact O-N 2.76Å; V302-K304 VanDerWaalsContact C-N 3.26Å; V302-K304 PolarHBondContact O-N 2.97Å; K304-G306 PolarHBondContact O-N 3.41Å; K304-P307 WeakPolarHBondContact O-CD 3.27Å; K304-E308 WeakPolarHBondContact O-CB 3.43Å; K304-E308 PolarHBondContact O-N 3.06Å; K304-I350 HydrophobicContact CB-CG2 4.31Å; K304-M353 HydrophobicContact CB-CE 3.73Å; K304-M353 HydrophobicContact CB-SD 4.08Å; K304-E354 IonicContact NZ-OE1 2.72Å; K304-E354 PolarHBondContact NZ-OE1 3.21Å; K304-E354 IonicContact NZ-OE2 3.71Å; K304-E354 PolarHBondContact NZ-OE2 2.77Å
305	I	77.6	Confident	85	Confident	18 Å²	18	45.8 Å²	45.8	9%	0.092	26%	0.264	C	S	.	.	H	α-helix	trans	-56.2	-51	-175.4	-59.5	170	0	0	0	110.7	A250 N301 V302 I303 S309	A250-I305 HydrophobicContact CB-CD1 4.2Å; N301-I305 WeakPolarHBondContact O-CG1 3.44Å; V302-I305 WeakPolarHBondContact O-CB 3.44Å; V302-I305 VanDerWaalsContact O-CG1 3.29Å; V302-I305 WeakPolarHBondContact O-CG1 3.48Å; V302-I305 PolarHBondContact O-N 3.31Å; I303-I305 PolarHBondContact O-N 3.14Å; I305-S309 WeakPolarHBondContact O-CB 3.26Å; I305-S309 PolarHBondContact O-N 3.44Å; I305-S309 PolarHBondContact O-OG 2.76Å
306	G	80.9	Confident	84.3	Confident	45 Å²	45	41.3 Å²	41.3	46%	0.464	25%	0.247	S	C	.	.	H	α-helix	trans	-61.9	-58.3	-177.7	0	0	0	0	0	112.8	K304 E308 S309 A310	K304-G306 PolarHBondContact O-N 3.41Å; G306-E308 VanDerWaalsContact C-N 3.31Å; G306-E308 PolarHBondContact O-N 3.1Å; G306-S309 PolarHBondContact O-N 3.47Å; G306-A310 WeakPolarHBondContact O-CB 3.48Å; G306-A310 PolarHBondContact O-N 2.85Å
307	P	87	Confident	83.7	Confident	57 Å²	57	41.4 Å²	41.4	37%	0.37	25%	0.249	S	C	.	.	H	α-helix	trans	-58.3	-39.2	177.9	-26.8	36.1	0	0	0	113.6	I303 K304 A310 I311 I350	I303-P307 WeakPolarHBondContact O-CD 3.35Å; K304-P307 WeakPolarHBondContact O-CD 3.27Å; P307-A310 PolarHBondContact O-N 3.25Å; P307-I311 WeakPolarHBondContact O-CB 3.19Å; P307-I311 WeakPolarHBondContact O-CG1 3.4Å; P307-I311 PolarHBondContact O-N 3.23Å; P307-I350 HydrophobicContact CB-CD1 3.8Å
308	E	80.1	Confident	83.6	Confident	58 Å²	58	45.9 Å²	45.9	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-61.5	-50.4	177.5	-176	-179.5	168.4	0	0	111.3	K304 G306 K312 I350	K304-E308 WeakPolarHBondContact O-CB 3.43Å; K304-E308 PolarHBondContact O-N 3.06Å; G306-E308 VanDerWaalsContact C-N 3.31Å; G306-E308 PolarHBondContact O-N 3.1Å; E308-K312 VanDerWaalsContact O-CB 3.31Å; E308-K312 WeakPolarHBondContact O-CB 3.3Å; E308-K312 PolarHBondContact O-N 3.01Å; E308-I350 HydrophobicContact CB-CD1 4.27Å; E308-I350 HydrophobicContact CB-CG1 3.94Å; E308-I350 HydrophobicContact CG-CG1 4.31Å
309	S	76.6	Confident	83.3	Confident	63 Å²	63	45.9 Å²	45.9	44%	0.441	27%	0.267	S	S	.	.	H	α-helix	trans	-63.2	-42.6	176.8	-65.7	0	0	0	0	112.4	I305 G306 K312 F313	I305-S309 WeakPolarHBondContact O-CB 3.26Å; I305-S309 PolarHBondContact O-N 3.44Å; I305-S309 PolarHBondContact O-OG 2.76Å; G306-S309 PolarHBondContact O-N 3.47Å; S309-K312 PolarHBondContact O-N 3.36Å; S309-F313 WeakPolarHBondContact O-CB 3.16Å; S309-F313 PolarHBondContact O-N 3.1Å
310	A	81.1	Confident	82.6	Confident	59 Å²	59	45.9 Å²	45.9	49%	0.488	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-46	-179.4	0	0	0	0	0	112.3	G306 P307 F313 M314	G306-A310 WeakPolarHBondContact O-CB 3.48Å; G306-A310 PolarHBondContact O-N 2.85Å; P307-A310 PolarHBondContact O-N 3.25Å; A310-F313 PolarHBondContact O-N 3.11Å; A310-M314 VanDerWaalsContact O-CB 3.3Å; A310-M314 WeakPolarHBondContact O-CB 3.49Å; A310-M314 PolarHBondContact O-N 3.22Å
311	I	84.4	Confident	82.2	Confident	40 Å²	40	53.7 Å²	53.7	21%	0.205	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-41.3	178.6	-64.5	167.2	0	0	0	110.3	P307 F313 M314 A315 I345 A346 I350	P307-I311 WeakPolarHBondContact O-CB 3.19Å; P307-I311 WeakPolarHBondContact O-CG1 3.4Å; P307-I311 PolarHBondContact O-N 3.23Å; I311-F313 PolarHBondContact O-N 3.44Å; I311-M314 PolarHBondContact O-N 2.85Å; I311-A315 WeakPolarHBondContact O-CB 3.37Å; I311-A315 PolarHBondContact O-N 3.41Å; I311-I345 HydrophobicContact CG2-CG2 4.4Å; I311-A346 HydrophobicContact CB-CB 4.42Å; I311-A346 HydrophobicContact CG2-CB 4.11Å; I311-I350 HydrophobicContact CD1-CD1 4.08Å; I311-I350 HydrophobicContact CD1-CG1 4.47Å
312	K	79.8	Confident	82.2	Confident	55 Å²	55	60.7 Å²	60.7	24%	0.239	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-48.2	177	-172.1	-177.7	-179.3	-172.3	0	111	I223 P225 E308 S309 A315 Y316 A346	I223-K312 PolarHBondContact O-NZ 3.39Å; P225-K312 HydrophobicContact CG-CD 4.12Å; P225-K312 HydrophobicContact CG-CG 4.47Å; E308-K312 VanDerWaalsContact O-CB 3.31Å; E308-K312 WeakPolarHBondContact O-CB 3.3Å; E308-K312 PolarHBondContact O-N 3.01Å; S309-K312 PolarHBondContact O-N 3.36Å; K312-A315 PolarHBondContact O-N 2.92Å; K312-Y316 WeakPolarHBondContact O-CB 3.49Å; K312-Y316 PolarHBondContact O-N 3.3Å; K312-A346 HydrophobicContact CB-CB 3.8Å; K312-A346 HydrophobicContact CG-CB 4.44Å
313	F	76.6	Confident	81.8	Confident	79 Å²	79	61.6 Å²	61.6	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-50.5	178.3	-176.3	-96.7	0	0	0	111.5	F228 S309 A310 I311 A315 Y316 E317	F228-F313 AromaticContact CD2-CE2 3.99Å; F228-F313 HydrophobicContact CD2-CE2 3.99Å; F228-F313 HydrophobicContact CE2-CE2 4.26Å; S309-F313 WeakPolarHBondContact O-CB 3.16Å; S309-F313 PolarHBondContact O-N 3.1Å; A310-F313 PolarHBondContact O-N 3.11Å; I311-F313 PolarHBondContact O-N 3.44Å; F313-A315 VanDerWaalsContact C-N 3.32Å; F313-A315 PolarHBondContact O-N 3.42Å; F313-Y316 WeakPolarHBondContact O-CB 3.29Å; F313-Y316 PolarHBondContact O-N 3Å; F313-Y316 VanDerWaalsContact O-N 3.17Å; F313-E317 HydrophobicContact CE1-CG 4.3Å; F313-E317 WeakPolarHBondContact CE2-OE1 3.13Å; F313-E317 VanDerWaalsContact CZ-CD 3.48Å; F313-E317 HydrophobicContact CZ-CG 4.27Å; F313-E317 VanDerWaalsContact CZ-OE1 3.26Å; F313-E317 WeakPolarHBondContact CZ-OE1 3.45Å; F313-E317 PolarHBondContact O-N 3.33Å
314	M	83	Confident	80.6	Confident	113 Å²	113	57.7 Å²	57.7	56%	0.557	31%	0.308	S	S	*	.	H	α-helix	trans	-56.8	-45.8	177.8	-178.3	-173.1	70.8	0	0	112	A310 I311 E317 Q318	A310-M314 VanDerWaalsContact O-CB 3.3Å; A310-M314 WeakPolarHBondContact O-CB 3.49Å; A310-M314 PolarHBondContact O-N 3.22Å; I311-M314 PolarHBondContact O-N 2.85Å; M314-E317 PolarHBondContact O-N 3.35Å; M314-Q318 VanDerWaalsContact O-CG 3.27Å; M314-Q318 WeakPolarHBondContact O-CG 3.2Å; M314-Q318 PolarHBondContact O-N 3.47Å; M314-Q318 VanDerWaalsContact O-N 3.11Å
315	A	83.7	Confident	79	Confident	8 Å²	8	61.6 Å²	61.6	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-63.6	-43	178.7	0	0	0	0	0	111.5	I311 K312 F313 Q318 I319 A342 I345	I311-A315 WeakPolarHBondContact O-CB 3.37Å; I311-A315 PolarHBondContact O-N 3.41Å; K312-A315 PolarHBondContact O-N 2.92Å; F313-A315 VanDerWaalsContact C-N 3.32Å; F313-A315 PolarHBondContact O-N 3.42Å; A315-Q318 PolarHBondContact O-N 3.3Å; A315-I319 WeakPolarHBondContact O-CB 3.33Å; A315-I319 VanDerWaalsContact O-CD1 3.25Å; A315-I319 WeakPolarHBondContact O-CD1 3.4Å; A315-I319 WeakPolarHBondContact O-CG1 3.44Å; A315-I319 PolarHBondContact O-N 3.37Å; A315-A342 HydrophobicContact CB-CB 3.94Å; A315-I345 HydrophobicContact CB-CB 4.19Å; A315-I345 HydrophobicContact CB-CD1 4.24Å; A315-I345 HydrophobicContact CB-CG2 4.01Å
316	Y	79.8	Confident	77.8	Confident	5 Å²	5	68.6 Å²	68.6	2%	0.02	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-50.2	177.4	-175.9	-100.8	0	0	0	111.7	V224 E227 K312 F313 Q318 I319 K320 A342	V224-Y316 HydrophobicContact CG1-CE2 4.45Å; E227-Y316 HydrophobicContact CG-CE1 4.33Å; K312-Y316 WeakPolarHBondContact O-CB 3.49Å; K312-Y316 PolarHBondContact O-N 3.3Å; F313-Y316 WeakPolarHBondContact O-CB 3.29Å; F313-Y316 PolarHBondContact O-N 3Å; F313-Y316 VanDerWaalsContact O-N 3.17Å; Y316-Q318 VanDerWaalsContact C-N 3.33Å; Y316-Q318 PolarHBondContact O-N 3.43Å; Y316-I319 PolarHBondContact O-N 3.04Å; Y316-K320 WeakPolarHBondContact O-CB 3.33Å; Y316-K320 PolarHBondContact O-N 2.92Å; Y316-A342 HydrophobicContact CD2-CB 4.38Å
317	E	80.3	Confident	76.3	Confident	29 Å²	29	72.4 Å²	72.4	14%	0.136	38%	0.381	C	S	.	.	H	α-helix	trans	-61.9	-38.2	179.2	-104.4	63.1	-171.7	0	0	112.6	K233 F313 M314 R321	K233-E317 IonicContact NZ-OE1 3.31Å; K233-E317 PolarHBondContact NZ-OE1 3.14Å; F313-E317 HydrophobicContact CE1-CG 4.3Å; F313-E317 WeakPolarHBondContact CE2-OE1 3.13Å; F313-E317 VanDerWaalsContact CZ-CD 3.48Å; F313-E317 HydrophobicContact CZ-CG 4.27Å; F313-E317 VanDerWaalsContact CZ-OE1 3.26Å; F313-E317 WeakPolarHBondContact CZ-OE1 3.45Å; F313-E317 PolarHBondContact O-N 3.33Å; M314-E317 PolarHBondContact O-N 3.35Å; E317-R321 VanDerWaalsContact O-CG 3.28Å; E317-R321 WeakPolarHBondContact O-CG 3.33Å; E317-R321 PolarHBondContact O-N 2.9Å
318	Q	85.4	Confident	74.6	Confident	106 Å²	106	78.7 Å²	78.7	50%	0.495	41%	0.405	S	S	.	.	H	α-helix	trans	-70.2	-41.9	177.4	-66.3	-61.9	-17.2	0	0	112.2	M314 A315 Y316 R321 L322	M314-Q318 VanDerWaalsContact O-CG 3.27Å; M314-Q318 WeakPolarHBondContact O-CG 3.2Å; M314-Q318 PolarHBondContact O-N 3.47Å; M314-Q318 VanDerWaalsContact O-N 3.11Å; A315-Q318 PolarHBondContact O-N 3.3Å; Y316-Q318 VanDerWaalsContact C-N 3.33Å; Y316-Q318 PolarHBondContact O-N 3.43Å; Q318-R321 PolarHBondContact O-N 3.07Å; Q318-L322 WeakPolarHBondContact O-CB 3.41Å; Q318-L322 PolarHBondContact O-N 3.02Å
319	I	85.1	Confident	73.3	Confident	16 Å²	16	79 Å²	79	8%	0.082	41%	0.411	C	S	.	.	H	α-helix	trans	-65.8	-42.4	177.3	-64	157.4	0	0	0	110.2	A315 Y316 R321 L322 I323 L341 A342 I345	A315-I319 WeakPolarHBondContact O-CB 3.33Å; A315-I319 VanDerWaalsContact O-CD1 3.25Å; A315-I319 WeakPolarHBondContact O-CD1 3.4Å; A315-I319 WeakPolarHBondContact O-CG1 3.44Å; A315-I319 PolarHBondContact O-N 3.37Å; Y316-I319 PolarHBondContact O-N 3.04Å; I319-R321 PolarHBondContact O-N 3.24Å; I319-L322 WeakPolarHBondContact O-CB 3.24Å; I319-L322 PolarHBondContact O-N 2.95Å; I319-L322 VanDerWaalsContact O-N 3.11Å; I319-I323 HydrophobicContact CG2-CD1 3.58Å; I319-I323 HydrophobicContact CG2-CG1 4.26Å; I319-I323 WeakPolarHBondContact O-CG1 3.38Å; I319-I323 PolarHBondContact O-N 2.87Å; I319-L341 HydrophobicContact CD1-CB 3.8Å; I319-L341 HydrophobicContact CD1-CD2 3.71Å; I319-L341 HydrophobicContact CD1-CG 3.58Å; I319-L341 HydrophobicContact CG1-CD2 3.93Å; I319-L341 HydrophobicContact CG1-CG 4.35Å; I319-L341 HydrophobicContact CG2-CD2 4.21Å; I319-A342 HydrophobicContact CD1-CB 4.05Å; I319-I345 HydrophobicContact CD1-CD1 4.06Å
320	K	76.6	Confident	72.4	Confident	40 Å²	40	76.1 Å²	76.1	17%	0.174	39%	0.391	C	S	.	.	H	α-helix	trans	-56.9	-46.8	174.4	171.7	163.2	-176.7	177.7	0	111.7	E227 Y316 L322 I323 G324 L330	E227-K320 IonicContact OE1-NZ 2.65Å; E227-K320 PolarHBondContact OE1-NZ 3.44Å; Y316-K320 WeakPolarHBondContact O-CB 3.33Å; Y316-K320 PolarHBondContact O-N 2.92Å; K320-L322 VanDerWaalsContact C-N 3.26Å; K320-L322 PolarHBondContact O-N 3.15Å; K320-I323 PolarHBondContact O-N 2.8Å; K320-G324 PolarHBondContact O-N 2.79Å; K320-L330 HydrophobicContact CB-CD1 3.86Å; K320-L330 HydrophobicContact CD-CD1 3.64Å; K320-L330 HydrophobicContact CD-CG 3.99Å; K320-L330 HydrophobicContact CG-CD1 3.54Å; K320-L330 HydrophobicContact CG-CD2 4.24Å; K320-L330 HydrophobicContact CG-CG 3.92Å
321	R	81.3	Confident	71.3	Confident	168 Å²	168	74.3 Å²	74.3	63%	0.634	38%	0.378	S	S	*	.	H	α-helix	trans	-61.7	-34.8	176.4	-74.6	173.2	-176.7	-170.6	0.2	112.8	E317 Q318 I319	E317-R321 VanDerWaalsContact O-CG 3.28Å; E317-R321 WeakPolarHBondContact O-CG 3.33Å; E317-R321 PolarHBondContact O-N 2.9Å; Q318-R321 PolarHBondContact O-N 3.07Å; I319-R321 PolarHBondContact O-N 3.24Å
322	L	83.8	Confident	70	Confident	154 Å²	154	76 Å²	76	81%	0.806	39%	0.386	S	S	*	.	H	α-helix	trans	-74.1	-33.5	179.5	-163	119.9	0	0	0	112.4	Q318 I319 K320	Q318-L322 WeakPolarHBondContact O-CB 3.41Å; Q318-L322 PolarHBondContact O-N 3.02Å; I319-L322 WeakPolarHBondContact O-CB 3.24Å; I319-L322 PolarHBondContact O-N 2.95Å; I319-L322 VanDerWaalsContact O-N 3.11Å; K320-L322 VanDerWaalsContact C-N 3.26Å; K320-L322 PolarHBondContact O-N 3.15Å
323	I	78.4	Confident	69.1	Low	65 Å²	65	78.5 Å²	78.5	33%	0.333	41%	0.406	S	S	.	.	H	α-helix	trans	-84.6	-45.8	-179.6	-66.1	173.4	0	0	0	111.8	I319 K320 L330 E334 S338	I319-I323 HydrophobicContact CG2-CD1 3.58Å; I319-I323 HydrophobicContact CG2-CG1 4.26Å; I319-I323 WeakPolarHBondContact O-CG1 3.38Å; I319-I323 PolarHBondContact O-N 2.87Å; K320-I323 PolarHBondContact O-N 2.8Å; I323-L330 HydrophobicContact CG2-CD2 4.4Å; I323-E334 HydrophobicContact CG2-CB 4.16Å; I323-E334 HydrophobicContact CG2-CG 3.97Å; I323-S338 WeakPolarHBondContact CD1-OG 3.36Å
324	G	66	Low	68.7	Low	17 Å²	17	77.8 Å²	77.8	18%	0.175	40%	0.404	C	S	.	.			trans	-117.6	54.9	-167.1	0	0	0	0	0	113.5	K320 N326 Q327	K320-G324 PolarHBondContact O-N 2.79Å; G324-N326 PolarHBondContact O-N 3.18Å; G324-Q327 PolarHBondContact O-N 3.1Å
325	S	51.6	Low	67.9	Low	99 Å²	99	76.3 Å²	76.3	69%	0.692	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-7.7	-174.7	-170.2	0	0	0	0	115.6
326	N	52.5	Low	67.1	Low	164 Å²	164	82 Å²	82	88%	0.877	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.2	12.2	-178.9	-80.6	-21.5	0	0	0	115.9	G324	G324-N326 PolarHBondContact O-N 3.18Å
327	Q	49.9	Very low	66.8	Low	126 Å²	126	85.1 Å²	85.1	59%	0.589	44%	0.435	S	S	*	.			trans	-122.3	129.4	179.5	-78.3	-179	-21.6	0	0	111.6	G324 T329	G324-Q327 PolarHBondContact O-N 3.1Å; Q327-T329 PolarHBondContact O-N 3.25Å
328	E	51	Low	66.6	Low	188 Å²	188	83.8 Å²	83.8	88%	0.879	43%	0.428	S	S	*	.	S	Bend	trans	-67	-26.9	177.5	-68.1	-165.3	148.2	0	0	112.3
329	T	53.4	Low	66	Low	64 Å²	64	79 Å²	79	39%	0.393	41%	0.407	S	S	.	.	S	Bend	trans	-121.7	118.5	-178.8	55.7	0	0	0	0	111	Q327	Q327-T329 PolarHBondContact O-N 3.25Å
330	L	57.6	Low	65.6	Low	3 Å²	3	80.9 Å²	80.9	2%	0.016	42%	0.422	C	S	.	.			trans	-74.2	144.8	171.7	-72.1	179.3	0	0	0	110.9	K320 I323 E334 R335	K320-L330 HydrophobicContact CB-CD1 3.86Å; K320-L330 HydrophobicContact CD-CD1 3.64Å; K320-L330 HydrophobicContact CD-CG 3.99Å; K320-L330 HydrophobicContact CG-CD1 3.54Å; K320-L330 HydrophobicContact CG-CD2 4.24Å; K320-L330 HydrophobicContact CG-CG 3.92Å; I323-L330 HydrophobicContact CG2-CD2 4.4Å; L330-E334 HydrophobicContact CB-CB 4.13Å; L330-E334 HydrophobicContact CD2-CB 4.15Å; L330-E334 WeakPolarHBondContact CD2-OE2 3.41Å; L330-E334 HydrophobicContact CG-CB 4.5Å; L330-R335 HydrophobicContact CB-CG 3.63Å; L330-R335 HydrophobicContact CD1-CG 4.25Å; L330-R335 PolarHBondContact O-NE 3.07Å; L330-R335 PolarHBondContact O-NH1 2.98Å
331	G	57.3	Low	65.9	Low	22 Å²	22	83 Å²	83	23%	0.227	44%	0.435	C	S	.	.			trans	-64.5	160.5	169.5	0	0	0	0	0	112.4	T333 E334 R335	G331-T333 VanDerWaalsContact C-N 3.35Å; G331-T333 PolarHBondContact O-N 3.49Å; G331-E334 PolarHBondContact N-OE2 2.81Å; G331-E334 PolarHBondContact O-N 3.19Å; G331-E334 VanDerWaalsContact O-N 3.14Å; G331-R335 WeakPolarHBondContact O-CG 3.42Å; G331-R335 PolarHBondContact O-N 3.01Å
332	M	56.5	Low	65.9	Low	76 Å²	76	75 Å²	75	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-54.6	-46.7	-179.2	-179.2	-171.6	-74.9	0	0	112.9	G163 V218 E334 R335 F336	G163-M332 WeakPolarHBondContact O-CB 2.93Å; G163-M332 WeakPolarHBondContact O-CE 3.48Å; G163-M332 VanDerWaalsContact O-SD 3.4Å; V218-M332 HydrophobicContact CG1-CE 3.54Å; M332-E334 VanDerWaalsContact C-N 3.32Å; M332-E334 PolarHBondContact O-N 2.76Å; M332-R335 PolarHBondContact O-N 3.25Å; M332-F336 WeakPolarHBondContact O-CB 3.42Å; M332-F336 PolarHBondContact O-N 3.25Å
333	T	61	Low	65.6	Low	106 Å²	106	68.9 Å²	68.9	65%	0.65	38%	0.379	S	S	*	.	H	α-helix	trans	-62.2	-40.9	178.9	-51.9	0	0	0	0	111.4	G331 F336 V337	G331-T333 VanDerWaalsContact C-N 3.35Å; G331-T333 PolarHBondContact O-N 3.49Å; T333-F336 PolarHBondContact O-N 3Å; T333-V337 HydrophobicContact CG2-CG2 4.47Å; T333-V337 WeakPolarHBondContact O-CB 3.44Å; T333-V337 VanDerWaalsContact O-CG2 3.24Å; T333-V337 WeakPolarHBondContact O-CG2 3.49Å; T333-V337 PolarHBondContact O-N 3.07Å
334	E	68.4	Low	65.8	Low	64 Å²	64	67.5 Å²	67.5	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-40.8	178.1	-61.6	176.1	150.7	0	0	111.5	I323 L330 G331 M332 S338	I323-E334 HydrophobicContact CG2-CB 4.16Å; I323-E334 HydrophobicContact CG2-CG 3.97Å; L330-E334 HydrophobicContact CB-CB 4.13Å; L330-E334 HydrophobicContact CD2-CB 4.15Å; L330-E334 WeakPolarHBondContact CD2-OE2 3.41Å; L330-E334 HydrophobicContact CG-CB 4.5Å; G331-E334 PolarHBondContact N-OE2 2.81Å; G331-E334 PolarHBondContact O-N 3.19Å; G331-E334 VanDerWaalsContact O-N 3.14Å; M332-E334 VanDerWaalsContact C-N 3.32Å; M332-E334 PolarHBondContact O-N 2.76Å; E334-S338 WeakPolarHBondContact O-CB 3.47Å; E334-S338 PolarHBondContact O-N 3.04Å; E334-S338 PolarHBondContact O-OG 2.71Å
335	R	66.7	Low	66.9	Low	82 Å²	82	69.8 Å²	69.8	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-62.8	-43.3	173	-72.1	178.5	163.9	141.7	-9	111.6	E227 L330 G331 M332 S338 G339	E227-R335 IonicContact OE2-CZ 2.69Å; E227-R335 VanDerWaalsContact OE2-CZ 3.31Å; E227-R335 IonicContact OE2-NE 3.12Å; E227-R335 PolarHBondContact OE2-NE 3.07Å; E227-R335 IonicContact OE2-NH2 2.67Å; E227-R335 PolarHBondContact OE2-NH2 3.37Å; L330-R335 HydrophobicContact CB-CG 3.63Å; L330-R335 HydrophobicContact CD1-CG 4.25Å; L330-R335 PolarHBondContact O-NE 3.07Å; L330-R335 PolarHBondContact O-NH1 2.98Å; G331-R335 WeakPolarHBondContact O-CG 3.42Å; G331-R335 PolarHBondContact O-N 3.01Å; M332-R335 PolarHBondContact O-N 3.25Å; R335-S338 PolarHBondContact O-N 2.86Å; R335-G339 PolarHBondContact O-N 3.14Å
336	F	67.6	Low	68.5	Low	128 Å²	128	65.3 Å²	65.3	56%	0.561	35%	0.353	S	S	*	.	H	α-helix	trans	-64.1	-46.5	178.2	179.6	-95.6	0	0	0	111.6	M332 T333 G339 S340	M332-F336 WeakPolarHBondContact O-CB 3.42Å; M332-F336 PolarHBondContact O-N 3.25Å; T333-F336 PolarHBondContact O-N 3Å; F336-G339 PolarHBondContact O-N 2.86Å; F336-S340 WeakPolarHBondContact O-CB 3.16Å; F336-S340 PolarHBondContact O-N 3.09Å; F336-S340 PolarHBondContact O-OG 3.35Å
337	V	73.3	Confident	70.1	Confident	71 Å²	71	59.1 Å²	59.1	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-46.6	176.6	170.5	0	0	0	0	110.5	T333 G339 S340 L341	T333-V337 HydrophobicContact CG2-CG2 4.47Å; T333-V337 WeakPolarHBondContact O-CB 3.44Å; T333-V337 VanDerWaalsContact O-CG2 3.24Å; T333-V337 WeakPolarHBondContact O-CG2 3.49Å; T333-V337 PolarHBondContact O-N 3.07Å; V337-G339 PolarHBondContact O-N 2.73Å; V337-S340 PolarHBondContact O-N 3.41Å; V337-L341 VanDerWaalsContact O-CB 3.31Å; V337-L341 WeakPolarHBondContact O-CB 3.3Å; V337-L341 PolarHBondContact O-N 3.11Å
338	S	75.5	Confident	72.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-46.5	177.9	-58.9	0	0	0	0	111.7	I323 E334 R335 A342	I323-S338 WeakPolarHBondContact CD1-OG 3.36Å; E334-S338 WeakPolarHBondContact O-CB 3.47Å; E334-S338 PolarHBondContact O-N 3.04Å; E334-S338 PolarHBondContact O-OG 2.71Å; R335-S338 PolarHBondContact O-N 2.86Å; S338-A342 WeakPolarHBondContact O-CB 3.14Å; S338-A342 PolarHBondContact O-N 3.34Å
339	G	72.9	Confident	74.1	Confident	5 Å²	5	48.4 Å²	48.4	5%	0.052	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-43	178	0	0	0	0	0	112.6	R335 F336 V337 G343	R335-G339 PolarHBondContact O-N 3.14Å; F336-G339 PolarHBondContact O-N 2.86Å; V337-G339 PolarHBondContact O-N 2.73Å; G339-G343 PolarHBondContact O-N 2.97Å
340	S	76.4	Confident	75.8	Confident	57 Å²	57	45.6 Å²	45.6	40%	0.399	26%	0.261	S	S	.	.	H	α-helix	trans	-65.9	-45.4	178.3	-63.4	0	0	0	0	111.9	F336 V337 G343 A344	F336-S340 WeakPolarHBondContact O-CB 3.16Å; F336-S340 PolarHBondContact O-N 3.09Å; F336-S340 PolarHBondContact O-OG 3.35Å; V337-S340 PolarHBondContact O-N 3.41Å; S340-G343 PolarHBondContact O-N 2.9Å; S340-A344 WeakPolarHBondContact O-CB 3.39Å; S340-A344 PolarHBondContact O-N 3.19Å
341	L	82.3	Confident	77.4	Confident	85 Å²	85	45.4 Å²	45.4	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-69.5	-41	178.7	-179	62.6	0	0	0	111.5	I319 V337 G343 A344 I345	I319-L341 HydrophobicContact CD1-CB 3.8Å; I319-L341 HydrophobicContact CD1-CD2 3.71Å; I319-L341 HydrophobicContact CD1-CG 3.58Å; I319-L341 HydrophobicContact CG1-CD2 3.93Å; I319-L341 HydrophobicContact CG1-CG 4.35Å; I319-L341 HydrophobicContact CG2-CD2 4.21Å; V337-L341 VanDerWaalsContact O-CB 3.31Å; V337-L341 WeakPolarHBondContact O-CB 3.3Å; V337-L341 PolarHBondContact O-N 3.11Å; L341-G343 VanDerWaalsContact C-N 3.33Å; L341-G343 PolarHBondContact O-N 2.98Å; L341-A344 PolarHBondContact O-N 2.63Å; L341-I345 HydrophobicContact CD1-CD1 4.38Å; L341-I345 HydrophobicContact CD1-CG1 4.5Å; L341-I345 HydrophobicContact CG-CD1 4.12Å; L341-I345 VanDerWaalsContact O-CG1 3.32Å; L341-I345 WeakPolarHBondContact O-CG1 3.24Å; L341-I345 PolarHBondContact O-N 3.4Å
342	A	81.2	Confident	79.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-43	173	0	0	0	0	0	111.8	A315 Y316 I319 S338 I345 A346	A315-A342 HydrophobicContact CB-CB 3.94Å; Y316-A342 HydrophobicContact CD2-CB 4.38Å; I319-A342 HydrophobicContact CD1-CB 4.05Å; S338-A342 WeakPolarHBondContact O-CB 3.14Å; S338-A342 PolarHBondContact O-N 3.34Å; A342-I345 PolarHBondContact O-N 3.13Å; A342-A346 WeakPolarHBondContact O-CB 3.31Å; A342-A346 PolarHBondContact O-N 3.27Å
343	G	78.1	Confident	80.9	Confident	25 Å²	25	44.3 Å²	44.3	26%	0.258	25%	0.252	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173.9	0	0	0	0	0	112.3	G339 S340 L341 Q347	G339-G343 PolarHBondContact O-N 2.97Å; S340-G343 PolarHBondContact O-N 2.9Å; L341-G343 VanDerWaalsContact C-N 3.33Å; L341-G343 PolarHBondContact O-N 2.98Å; G343-Q347 WeakPolarHBondContact O-CB 3.27Å; G343-Q347 PolarHBondContact O-N 3.23Å
344	A	83.6	Confident	82.2	Confident	35 Å²	35	40 Å²	40	29%	0.289	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-49.1	175.5	0	0	0	0	0	111.7	S340 L341 A346 Q347 S348	S340-A344 WeakPolarHBondContact O-CB 3.39Å; S340-A344 PolarHBondContact O-N 3.19Å; L341-A344 PolarHBondContact O-N 2.63Å; A344-A346 PolarHBondContact O-N 2.9Å; A344-Q347 PolarHBondContact O-N 3.28Å; A344-S348 PolarHBondContact O-N 2.95Å; A344-S348 PolarHBondContact O-OG 3.01Å
345	I	89	Confident	83.3	Confident	66 Å²	66	36.9 Å²	36.9	34%	0.338	21%	0.21	S	C	.	.	H	α-helix	trans	-59.9	-47.1	178.9	-69.2	168.1	0	0	0	111.4	I311 A315 I319 L341 A342 Q347 S348 S349	I311-I345 HydrophobicContact CG2-CG2 4.4Å; A315-I345 HydrophobicContact CB-CB 4.19Å; A315-I345 HydrophobicContact CB-CD1 4.24Å; A315-I345 HydrophobicContact CB-CG2 4.01Å; I319-I345 HydrophobicContact CD1-CD1 4.06Å; L341-I345 HydrophobicContact CD1-CD1 4.38Å; L341-I345 HydrophobicContact CD1-CG1 4.5Å; L341-I345 HydrophobicContact CG-CD1 4.12Å; L341-I345 VanDerWaalsContact O-CG1 3.32Å; L341-I345 WeakPolarHBondContact O-CG1 3.24Å; L341-I345 PolarHBondContact O-N 3.4Å; A342-I345 PolarHBondContact O-N 3.13Å; I345-Q347 VanDerWaalsContact C-N 3.33Å; I345-Q347 PolarHBondContact O-N 3.13Å; I345-S348 PolarHBondContact O-N 2.82Å; I345-S349 WeakPolarHBondContact O-CB 3.43Å; I345-S349 PolarHBondContact O-N 3.13Å; I345-S349 PolarHBondContact O-OG 2.91Å
346	A	84.1	Confident	84.6	Confident	4 Å²	4	33.8 Å²	33.8	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-46.1	176.4	0	0	0	0	0	110.9	I311 K312 A342 A344 S348 S349 I350	I311-A346 HydrophobicContact CB-CB 4.42Å; I311-A346 HydrophobicContact CG2-CB 4.11Å; K312-A346 HydrophobicContact CB-CB 3.8Å; K312-A346 HydrophobicContact CG-CB 4.44Å; A342-A346 WeakPolarHBondContact O-CB 3.31Å; A342-A346 PolarHBondContact O-N 3.27Å; A344-A346 PolarHBondContact O-N 2.9Å; A346-S348 PolarHBondContact O-N 2.78Å; A346-S349 PolarHBondContact O-N 2.96Å; A346-I350 WeakPolarHBondContact O-CB 3.22Å; A346-I350 WeakPolarHBondContact O-CG1 3.34Å; A346-I350 PolarHBondContact O-N 2.93Å
347	Q	86.3	Confident	85.7	Confident	35 Å²	35	29.3 Å²	29.3	16%	0.164	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-38.9	179.5	-176.7	60.1	82.4	0	0	112.7	G343 A344 I345 Y351 N394 M395 I398	G343-Q347 WeakPolarHBondContact O-CB 3.27Å; G343-Q347 PolarHBondContact O-N 3.23Å; A344-Q347 PolarHBondContact O-N 3.28Å; I345-Q347 VanDerWaalsContact C-N 3.33Å; I345-Q347 PolarHBondContact O-N 3.13Å; Q347-Y351 WeakPolarHBondContact O-CB 3.41Å; Q347-Y351 PolarHBondContact O-N 2.91Å; Q347-N394 WeakPolarHBondContact CG-ND2 3.14Å; Q347-M395 HydrophobicContact CB-CE 3.87Å; Q347-M395 HydrophobicContact CG-CE 3.26Å; Q347-I398 HydrophobicContact CG-CD1 4.19Å
348	S	91.3	Very high	86.6	Confident	31 Å²	31	26.2 Å²	26.2	22%	0.217	16%	0.161	C	C	.	.	H	α-helix	trans	-65.6	-38.5	174.4	-51.4	0	0	0	0	112	A344 I345 A346 Y388 Y391	A344-S348 PolarHBondContact O-N 2.95Å; A344-S348 PolarHBondContact O-OG 3.01Å; I345-S348 PolarHBondContact O-N 2.82Å; A346-S348 PolarHBondContact O-N 2.78Å; S348-Y388 WeakPolarHBondContact O-CE1 3.45Å; S348-Y388 PolarHBondContact O-OH 3.06Å; S348-Y391 PolarHBondContact OG-OH 2.92Å
349	S	92.7	Very high	87.4	Confident	58 Å²	58	26.2 Å²	26.2	41%	0.406	16%	0.161	S	C	.	.	H	α-helix	trans	-71.7	-39.3	-179.3	-56.3	0	0	0	0	112.2	I345 A346 P352	I345-S349 WeakPolarHBondContact O-CB 3.43Å; I345-S349 PolarHBondContact O-N 3.13Å; I345-S349 PolarHBondContact O-OG 2.91Å; A346-S349 PolarHBondContact O-N 2.96Å; S349-P352 WeakPolarHBondContact O-CD 3.18Å
350	I	90.1	Very high	88.3	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-83.3	-13.1	-179.8	-63.2	-63.2	0	0	0	112.6	K304 P307 E308 I311 A346 P352 M353 E354	K304-I350 HydrophobicContact CB-CG2 4.31Å; P307-I350 HydrophobicContact CB-CD1 3.8Å; E308-I350 HydrophobicContact CB-CD1 4.27Å; E308-I350 HydrophobicContact CB-CG1 3.94Å; E308-I350 HydrophobicContact CG-CG1 4.31Å; I311-I350 HydrophobicContact CD1-CD1 4.08Å; I311-I350 HydrophobicContact CD1-CG1 4.47Å; A346-I350 WeakPolarHBondContact O-CB 3.22Å; A346-I350 WeakPolarHBondContact O-CG1 3.34Å; A346-I350 PolarHBondContact O-N 2.93Å; I350-P352 VanDerWaalsContact C-CD 3.42Å; I350-P352 VanDerWaalsContact C-N 3.35Å; I350-P352 VanDerWaalsContact O-N 3.16Å; I350-M353 HydrophobicContact CD1-SD 4.1Å; I350-M353 HydrophobicContact CG2-CB 4.36Å; I350-M353 HydrophobicContact CG2-SD 4.5Å; I350-M353 WeakPolarHBondContact O-CA 3.24Å; I350-M353 VanDerWaalsContact O-CB 3.31Å; I350-M353 WeakPolarHBondContact O-CB 3.48Å; I350-M353 PolarHBondContact O-N 3.5Å; I350-E354 PolarHBondContact O-N 3.03Å
351	Y	91.9	Very high	89	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-52	-40.2	-174.1	-155.2	-91.7	0	0	0	115.4	Q347 M353 E354 V355 F387 Y388 K389 G390 Y391 N394 Q458	Q347-Y351 WeakPolarHBondContact O-CB 3.41Å; Q347-Y351 PolarHBondContact O-N 2.91Å; Y351-M353 PolarHBondContact O-N 3.06Å; Y351-E354 WeakPolarHBondContact O-CB 3.37Å; Y351-E354 PolarHBondContact O-N 2.99Å; Y351-V355 HydrophobicContact CD1-CG2 4.08Å; Y351-V355 HydrophobicContact CE1-CG2 3.73Å; Y351-V355 PolarHBondContact O-N 3.27Å; Y351-V355 VanDerWaalsContact O-N 3.17Å; Y351-F387 VanDerWaalsContact CD1-O 3.31Å; Y351-F387 WeakPolarHBondContact CD1-O 3.49Å; Y351-Y388 HydrophobicContact CD1-CD1 4Å; Y351-Y388 HydrophobicContact CD1-CG 4.43Å; Y351-Y388 HydrophobicContact CG-CD1 4.36Å; Y351-K389 WeakPolarHBondContact CE1-O 3.34Å; Y351-K389 PolarHBondContact OH-O 3.47Å; Y351-G390 WeakPolarHBondContact OH-CA 3.41Å; Y351-G390 PolarHBondContact OH-O 3.08Å; Y351-Y391 HydrophobicContact CD1-CD2 4.27Å; Y351-Y391 AromaticContact CD2-CD2 3.7Å; Y351-Y391 HydrophobicContact CD2-CD2 3.7Å; Y351-Y391 HydrophobicContact CD2-CE2 4.45Å; Y351-Y391 HydrophobicContact CE2-CD2 4.04Å; Y351-Y391 AromaticContact CG-CD2 3.83Å; Y351-Y391 HydrophobicContact CG-CD2 3.83Å; Y351-Y391 VanDerWaalsContact CZ-CA 3.46Å; Y351-Y391 PolarHBondContact OH-N 3.22Å; Y351-N394 HydrophobicContact CE2-CB 3.78Å; Y351-Q458 PolarHBondContact OH-NE2 3.25Å
352	P	94.8	Very high	89.3	Confident	30 Å²	30	20.5 Å²	20.5	20%	0.195	13%	0.125	C	C	.	.	H	α-helix	trans	-55.3	-35.4	174	-28.8	38.1	0	0	0	113.9	S349 I350 V355 L356 F387 Y388	S349-P352 WeakPolarHBondContact O-CD 3.18Å; I350-P352 VanDerWaalsContact C-CD 3.42Å; I350-P352 VanDerWaalsContact C-N 3.35Å; I350-P352 VanDerWaalsContact O-N 3.16Å; P352-V355 PolarHBondContact O-N 3.49Å; P352-L356 WeakPolarHBondContact O-CG 3.48Å; P352-L356 PolarHBondContact O-N 2.78Å; P352-L356 VanDerWaalsContact O-N 3.09Å; P352-F387 HydrophobicContact CB-CB 3.98Å; P352-F387 HydrophobicContact CB-CD1 3.95Å; P352-F387 HydrophobicContact CB-CG 4.32Å; P352-F387 HydrophobicContact CG-CB 4.27Å; P352-Y388 HydrophobicContact CG-CE2 3.92Å
353	M	91.3	Very high	89.6	Confident	45 Å²	45	23.2 Å²	23.2	22%	0.222	14%	0.135	C	C	.	.	H	α-helix	trans	-70.7	-34.1	176.4	-56.5	-178.6	74.1	0	0	111.6	I300 I303 K304 I350 Y351 V355 L356 K357	I300-M353 HydrophobicContact CG2-CB 4.04Å; I300-M353 HydrophobicContact CG2-CE 4.39Å; I300-M353 WeakPolarHBondContact CG2-O 3.32Å; I303-M353 HydrophobicContact CB-CE 4.47Å; I303-M353 HydrophobicContact CG2-CE 3.92Å; K304-M353 HydrophobicContact CB-CE 3.73Å; K304-M353 HydrophobicContact CB-SD 4.08Å; I350-M353 HydrophobicContact CD1-SD 4.1Å; I350-M353 HydrophobicContact CG2-CB 4.36Å; I350-M353 HydrophobicContact CG2-SD 4.5Å; I350-M353 WeakPolarHBondContact O-CA 3.24Å; I350-M353 VanDerWaalsContact O-CB 3.31Å; I350-M353 WeakPolarHBondContact O-CB 3.48Å; I350-M353 PolarHBondContact O-N 3.5Å; Y351-M353 PolarHBondContact O-N 3.06Å; M353-V355 VanDerWaalsContact C-N 3.35Å; M353-L356 PolarHBondContact O-N 2.79Å; M353-K357 WeakPolarHBondContact O-CB 3.17Å; M353-K357 PolarHBondContact O-N 3.39Å
354	E	88.1	Confident	90	Very high	14 Å²	14	28.9 Å²	28.9	7%	0.065	15%	0.153	C	C	.	.	H	α-helix	trans	-62.5	-42.2	173.6	-65.5	-64.9	162.3	0	0	111.7	K304 I350 Y351 K357 T358	K304-E354 IonicContact NZ-OE1 2.72Å; K304-E354 PolarHBondContact NZ-OE1 3.21Å; K304-E354 IonicContact NZ-OE2 3.71Å; K304-E354 PolarHBondContact NZ-OE2 2.77Å; I350-E354 PolarHBondContact O-N 3.03Å; Y351-E354 WeakPolarHBondContact O-CB 3.37Å; Y351-E354 PolarHBondContact O-N 2.99Å; E354-K357 WeakPolarHBondContact O-CB 3.33Å; E354-K357 PolarHBondContact O-N 3.13Å; E354-T358 PolarHBondContact O-N 2.87Å; E354-T358 VanDerWaalsContact O-N 3.11Å; E354-T358 PolarHBondContact O-OG1 3.22Å
355	V	92.8	Very high	90	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-47.3	176.1	178.9	0	0	0	0	110.6	Y351 P352 M353 K357 T358 R359 F387 Q458	Y351-V355 HydrophobicContact CD1-CG2 4.08Å; Y351-V355 HydrophobicContact CE1-CG2 3.73Å; Y351-V355 PolarHBondContact O-N 3.27Å; Y351-V355 VanDerWaalsContact O-N 3.17Å; P352-V355 PolarHBondContact O-N 3.49Å; M353-V355 VanDerWaalsContact C-N 3.35Å; V355-K357 VanDerWaalsContact C-N 3.3Å; V355-K357 PolarHBondContact O-N 3.02Å; V355-T358 PolarHBondContact O-N 3.35Å; V355-R359 HydrophobicContact CG1-CG 4.27Å; V355-R359 VanDerWaalsContact O-CG 3.24Å; V355-R359 WeakPolarHBondContact O-CG 3.32Å; V355-R359 PolarHBondContact O-N 3.41Å; V355-F387 WeakPolarHBondContact CG2-O 3.45Å; V355-Q458 HydrophobicContact CG2-CG 4.15Å
356	L	93.5	Very high	89.6	Confident	17 Å²	17	31.7 Å²	31.7	9%	0.089	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-40.6	177	-76	164.5	0	0	0	112.3	I300 P352 M353 R359 L360 C374 A375 I378 F387	I300-L356 HydrophobicContact CD1-CB 3.45Å; I300-L356 VanDerWaalsContact CD1-CB 3.45Å; P352-L356 WeakPolarHBondContact O-CG 3.48Å; P352-L356 PolarHBondContact O-N 2.78Å; P352-L356 VanDerWaalsContact O-N 3.09Å; M353-L356 PolarHBondContact O-N 2.79Å; L356-R359 PolarHBondContact O-N 3.14Å; L356-L360 WeakPolarHBondContact O-CB 3.44Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 2.99Å; L356-C374 HydrophobicContact CD2-CB 4.33Å; L356-A375 HydrophobicContact CD1-CB 4.27Å; L356-A375 HydrophobicContact CD2-CB 3.78Å; L356-I378 HydrophobicContact CD2-CD1 3.8Å; L356-F387 HydrophobicContact CD1-CE1 4.11Å; L356-F387 HydrophobicContact CD2-CE1 4.12Å; L356-F387 HydrophobicContact CG-CD1 4.41Å; L356-F387 HydrophobicContact CG-CE1 4Å
357	K	91.6	Very high	89.7	Confident	33 Å²	33	35 Å²	35	14%	0.143	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-53.3	174.7	174.7	-163.8	171.1	169.5	0	110.3	D260 I300 N301 M353 E354 V355 R359 L360 A361	D260-K357 IonicContact OD2-NZ 2.68Å; D260-K357 PolarHBondContact OD2-NZ 2.65Å; I300-K357 HydrophobicContact CB-CB 4.32Å; I300-K357 HydrophobicContact CG2-CB 3.97Å; N301-K357 WeakPolarHBondContact ND2-CE 3.46Å; N301-K357 PolarHBondContact ND2-NZ 3Å; N301-K357 WeakPolarHBondContact OD1-CD 3.26Å; N301-K357 WeakPolarHBondContact OD1-CE 3.46Å; N301-K357 PolarHBondContact OD1-NZ 3.01Å; M353-K357 WeakPolarHBondContact O-CB 3.17Å; M353-K357 PolarHBondContact O-N 3.39Å; E354-K357 WeakPolarHBondContact O-CB 3.33Å; E354-K357 PolarHBondContact O-N 3.13Å; V355-K357 VanDerWaalsContact C-N 3.3Å; V355-K357 PolarHBondContact O-N 3.02Å; K357-R359 VanDerWaalsContact C-N 3.33Å; K357-R359 PolarHBondContact O-N 2.77Å; K357-L360 PolarHBondContact O-N 2.78Å; K357-A361 WeakPolarHBondContact O-CB 3.33Å; K357-A361 PolarHBondContact O-N 2.87Å
358	T	91.6	Very high	89.8	Confident	6 Å²	6	34 Å²	34	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-42.6	-178.2	-63.8	0	0	0	0	111.2	V264 E354 V355 A361 L362 T455 Q458	V264-T358 HydrophobicContact CG1-CG2 4.17Å; E354-T358 PolarHBondContact O-N 2.87Å; E354-T358 VanDerWaalsContact O-N 3.11Å; E354-T358 PolarHBondContact O-OG1 3.22Å; V355-T358 PolarHBondContact O-N 3.35Å; T358-A361 PolarHBondContact O-N 3.37Å; T358-L362 HydrophobicContact CG2-CD1 3.91Å; T358-L362 WeakPolarHBondContact O-CG 3.27Å; T358-L362 PolarHBondContact O-N 2.92Å; T358-L362 VanDerWaalsContact O-N 3.17Å; T358-T455 HydrophobicContact CG2-CG2 4.08Å; T358-Q458 HydrophobicContact CG2-CB 3.77Å; T358-Q458 PolarHBondContact OG1-OE1 2.96Å
359	R	91.4	Very high	89.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-45.5	176.7	-68.8	-75.8	-163.1	-144.5	-4.8	112.6	V355 L356 K357 L362 R363 I378 E382 Q458 A459 A461 S462	V355-R359 HydrophobicContact CG1-CG 4.27Å; V355-R359 VanDerWaalsContact O-CG 3.24Å; V355-R359 WeakPolarHBondContact O-CG 3.32Å; V355-R359 PolarHBondContact O-N 3.41Å; L356-R359 PolarHBondContact O-N 3.14Å; K357-R359 VanDerWaalsContact C-N 3.33Å; K357-R359 PolarHBondContact O-N 2.77Å; R359-L362 PolarHBondContact O-N 3.26Å; R359-R363 PolarHBondContact O-N 3.49Å; R359-I378 HydrophobicContact CB-CD1 4.29Å; R359-I378 HydrophobicContact CG-CD1 3.83Å; R359-E382 IonicContact CZ-OE1 2.87Å; R359-E382 IonicContact NE-OE1 2.76Å; R359-E382 IonicContact NH2-OE1 3.74Å; R359-E382 PolarHBondContact NH2-OE1 3.33Å; R359-E382 IonicContact NH2-OE2 2.69Å; R359-E382 PolarHBondContact NH2-OE2 3.02Å; R359-Q458 PolarHBondContact NE-O 3.42Å; R359-Q458 PolarHBondContact NH1-O 3.03Å; R359-Q458 VanDerWaalsContact NH1-O 3.08Å; R359-Q458 PolarHBondContact NH2-O 3.46Å; R359-A459 PolarHBondContact NH1-O 2.95Å; R359-A461 VanDerWaalsContact NH2-CB 3.26Å; R359-S462 VanDerWaalsContact CD-OG 3.23Å; R359-S462 WeakPolarHBondContact CD-OG 3.19Å; R359-S462 PolarHBondContact NH1-OG 3.08Å
360	L	91.9	Very high	89.2	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-70.8	-32.3	178.4	-72.6	177.4	0	0	0	113	I300 L356 K357 L362 R363 Y368 I371 C374	I300-L360 HydrophobicContact CD1-CD1 3.44Å; I300-L360 VanDerWaalsContact CD1-CD1 3.44Å; I300-L360 HydrophobicContact CD1-CG 4.47Å; I300-L360 HydrophobicContact CG1-CD1 4.07Å; L356-L360 WeakPolarHBondContact O-CB 3.44Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 2.99Å; K357-L360 PolarHBondContact O-N 2.78Å; L360-L362 VanDerWaalsContact C-N 3.31Å; L360-R363 WeakPolarHBondContact O-CG 3.39Å; L360-R363 PolarHBondContact O-N 2.77Å; L360-Y368 HydrophobicContact CD2-CD2 4.12Å; L360-I371 HydrophobicContact CD1-CB 4.3Å; L360-I371 HydrophobicContact CD1-CG1 3.65Å; L360-C374 HydrophobicContact CD2-CB 3.71Å; L360-C374 HydrophobicContact CG-CB 4.29Å
361	A	90.8	Very high	89.3	Confident	4 Å²	4	38.9 Å²	38.9	3%	0.033	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-37	176	0	0	0	0	0	112	R261 V264 K357 T358	R261-A361 HydrophobicContact CG-CB 4.34Å; R261-A361 PolarHBondContact NE-O 3.27Å; V264-A361 HydrophobicContact CG1-CB 4.19Å; K357-A361 WeakPolarHBondContact O-CB 3.33Å; K357-A361 PolarHBondContact O-N 2.87Å; T358-A361 PolarHBondContact O-N 3.37Å
362	L	89.6	Confident	89.3	Confident	16 Å²	16	46 Å²	46	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-88.2	-9	179.9	-65	169.6	0	0	0	114	V264 L265 V268 T358 R359 L360 A459	V264-L362 HydrophobicContact CG1-CD1 4.12Å; V264-L362 HydrophobicContact CG1-CD2 3.73Å; V264-L362 HydrophobicContact CG1-CG 3.72Å; L265-L362 HydrophobicContact CD2-CD2 3.8Å; L265-L362 HydrophobicContact CG-CD2 4.33Å; V268-L362 HydrophobicContact CB-CD1 4.43Å; V268-L362 HydrophobicContact CB-CD2 4.08Å; V268-L362 HydrophobicContact CG1-CD1 4.15Å; V268-L362 HydrophobicContact CG1-CD2 4.19Å; V268-L362 HydrophobicContact CG2-CD1 3.99Å; V268-L362 HydrophobicContact CG2-CD2 4.26Å; T358-L362 HydrophobicContact CG2-CD1 3.91Å; T358-L362 WeakPolarHBondContact O-CG 3.27Å; T358-L362 PolarHBondContact O-N 2.92Å; T358-L362 VanDerWaalsContact O-N 3.17Å; R359-L362 PolarHBondContact O-N 3.26Å; L360-L362 VanDerWaalsContact C-N 3.31Å; L362-A459 HydrophobicContact CD1-CB 3.4Å
363	R	87.8	Confident	89.2	Confident	57 Å²	57	47.4 Å²	47.4	22%	0.215	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-60.2	143.7	-175.8	83.3	-173	173.7	157	-3.1	111.6	R296 R359 L360 Y368	R296-R363 PolarHBondContact NH1-O 2.88Å; R359-R363 PolarHBondContact O-N 3.49Å; L360-R363 WeakPolarHBondContact O-CG 3.39Å; L360-R363 PolarHBondContact O-N 2.77Å; R363-Y368 HydrophobicContact CB-CD2 3.79Å; R363-Y368 HydrophobicContact CB-CE2 4.08Å; R363-Y368 PolarHBondContact NH1-O 3.26Å
364	K	85.4	Confident	89.3	Confident	144 Å²	144	45.2 Å²	45.2	63%	0.626	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-79.4	156.8	168.7	-64.3	-175.6	-177.7	179	0	111.5	E288 G366 Q367	E288-K364 VanDerWaalsContact OE1-CA 3.27Å; E288-K364 WeakPolarHBondContact OE1-CA 3.44Å; K364-G366 PolarHBondContact O-N 2.94Å; K364-Q367 WeakPolarHBondContact O-CB 3.42Å; K364-Q367 PolarHBondContact O-N 2.91Å; K364-Q367 VanDerWaalsContact O-N 3.14Å
365	T	84.2	Confident	89.5	Confident	82 Å²	82	45.6 Å²	45.6	50%	0.503	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	127.1	172.8	-53.2	0	0	0	0	110.2	E288 R296 Q367	E288-T365 PolarHBondContact O-OG1 3.11Å; E288-T365 PolarHBondContact OE1-N 3.15Å; R296-T365 PolarHBondContact NH2-OG1 3.11Å; T365-Q367 VanDerWaalsContact C-N 3.34Å; T365-Q367 PolarHBondContact O-N 3.01Å
366	G	81.3	Confident	89.6	Confident	78 Å²	78	51.6 Å²	51.6	80%	0.804	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-3.8	179.6	0	0	0	0	0	116.3	K364	K364-G366 PolarHBondContact O-N 2.94Å
367	Q	86.2	Confident	89.5	Confident	73 Å²	73	53.1 Å²	53.1	34%	0.341	30%	0.298	S	S	.	.	S	Bend	trans	-70.3	-35.9	-177.5	-175.7	177.3	-2	0	0	113.9	K364 T365	K364-Q367 WeakPolarHBondContact O-CB 3.42Å; K364-Q367 PolarHBondContact O-N 2.91Å; K364-Q367 VanDerWaalsContact O-N 3.14Å; T365-Q367 VanDerWaalsContact C-N 3.34Å; T365-Q367 PolarHBondContact O-N 3.01Å
368	Y	87.4	Confident	89.5	Confident	16 Å²	16	51.6 Å²	51.6	6%	0.063	29%	0.292	C	S	.	.			trans	-139	135.7	178.6	-55.6	-59.4	0	0	0	109.4	L360 R363 C374 H377	L360-Y368 HydrophobicContact CD2-CD2 4.12Å; R363-Y368 HydrophobicContact CB-CD2 3.79Å; R363-Y368 HydrophobicContact CB-CE2 4.08Å; R363-Y368 PolarHBondContact NH1-O 3.26Å; Y368-C374 HydrophobicContact CD1-CB 4.05Å; Y368-C374 HydrophobicContact CD2-CB 3.98Å; Y368-C374 HydrophobicContact CE1-CB 4.43Å; Y368-C374 HydrophobicContact CE2-CB 4.37Å; Y368-C374 HydrophobicContact CG-CB 3.81Å; Y368-H377 HydrophobicContact CD1-CB 4.4Å; Y368-H377 HydrophobicContact CE1-CB 3.81Å; Y368-H377 AromaticContact CE1-CG 3.8Å; Y368-H377 AromaticContact CE1-ND1 3.72Å
369	S	83.8	Confident	89.5	Confident	108 Å²	108	55.5 Å²	55.5	76%	0.755	31%	0.312	S	S	*	.	S	Bend	trans	-70.4	-31.6	174.2	58.3	0	0	0	0	112.3	D373	S369-D373 PolarHBondContact N-OD2 2.82Å; S369-D373 WeakPolarHBondContact OG-CB 3.41Å; S369-D373 PolarHBondContact OG-OD2 2.97Å
370	G	87.8	Confident	89.6	Confident	25 Å²	25	62 Å²	62	26%	0.258	34%	0.343	S	S	.	.	S	Bend	trans	-169.6	-166.8	-178.7	0	0	0	0	0	114.4	C374	G370-C374 WeakPolarHBondContact O-CB 3.35Å; G370-C374 PolarHBondContact O-N 3.01Å; G370-C374 VanDerWaalsContact O-N 3.12Å
371	I	91.8	Very high	89.4	Confident	61 Å²	61	71 Å²	71	31%	0.313	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-47.7	-179.9	-61.4	165.5	0	0	0	110.9	I300 I303 L360 D373 C374 A375	I300-I371 HydrophobicContact CD1-CG1 4.21Å; I300-I371 HydrophobicContact CD1-CG2 3.93Å; I300-I371 HydrophobicContact CG1-CD1 3.77Å; I300-I371 HydrophobicContact CG1-CG1 3.96Å; I300-I371 HydrophobicContact CG1-CG2 4.23Å; I303-I371 HydrophobicContact CD1-CD1 4.19Å; L360-I371 HydrophobicContact CD1-CB 4.3Å; L360-I371 HydrophobicContact CD1-CG1 3.65Å; I371-D373 PolarHBondContact O-N 3.45Å; I371-C374 WeakPolarHBondContact O-CB 3.28Å; I371-C374 PolarHBondContact O-N 3.48Å; I371-A375 PolarHBondContact O-N 3.4Å
372	L	92.9	Very high	89.3	Confident	150 Å²	150	73.3 Å²	73.3	79%	0.785	39%	0.386	S	S	*	.	H	α-helix	trans	-64.1	-40.3	-179.1	-66.4	175.2	0	0	0	112.2	A375 K376	L372-A375 PolarHBondContact O-N 2.96Å; L372-K376 WeakPolarHBondContact O-CB 3.24Å; L372-K376 PolarHBondContact O-N 3.34Å
373	D	93.2	Very high	89.3	Confident	59 Å²	59	73.8 Å²	73.8	32%	0.316	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-42.2	176.6	-173.6	32.4	0	0	0	111.6	S369 I371 A375 K376 H377	S369-D373 PolarHBondContact N-OD2 2.82Å; S369-D373 WeakPolarHBondContact OG-CB 3.41Å; S369-D373 PolarHBondContact OG-OD2 2.97Å; I371-D373 PolarHBondContact O-N 3.45Å; D373-A375 PolarHBondContact O-N 3.2Å; D373-K376 PolarHBondContact O-N 3.36Å; D373-H377 WeakPolarHBondContact O-CB 3.14Å; D373-H377 PolarHBondContact O-N 2.82Å
374	C	91.6	Very high	89.4	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-59.8	-45.2	172	-174	0	0	0	0	111.9	L356 L360 Y368 G370 I371 H377 I378	L356-C374 HydrophobicContact CD2-CB 4.33Å; L360-C374 HydrophobicContact CD2-CB 3.71Å; L360-C374 HydrophobicContact CG-CB 4.29Å; Y368-C374 HydrophobicContact CD1-CB 4.05Å; Y368-C374 HydrophobicContact CD2-CB 3.98Å; Y368-C374 HydrophobicContact CE1-CB 4.43Å; Y368-C374 HydrophobicContact CE2-CB 4.37Å; Y368-C374 HydrophobicContact CG-CB 3.81Å; G370-C374 WeakPolarHBondContact O-CB 3.35Å; G370-C374 PolarHBondContact O-N 3.01Å; G370-C374 VanDerWaalsContact O-N 3.12Å; I371-C374 WeakPolarHBondContact O-CB 3.28Å; I371-C374 PolarHBondContact O-N 3.48Å; C374-H377 PolarHBondContact O-N 3.07Å; C374-I378 VanDerWaalsContact O-CG1 3.28Å; C374-I378 WeakPolarHBondContact O-CG1 3.18Å; C374-I378 PolarHBondContact O-N 3.33Å
375	A	93.8	Very high	89.7	Confident	22 Å²	22	72.7 Å²	72.7	18%	0.182	41%	0.414	C	S	.	.	H	α-helix	trans	-62.9	-45.3	177.2	0	0	0	0	0	112.4	L356 I371 L372 D373 H377 I378 L379 F387	L356-A375 HydrophobicContact CD1-CB 4.27Å; L356-A375 HydrophobicContact CD2-CB 3.78Å; I371-A375 PolarHBondContact O-N 3.4Å; L372-A375 PolarHBondContact O-N 2.96Å; D373-A375 PolarHBondContact O-N 3.2Å; A375-H377 VanDerWaalsContact C-N 3.31Å; A375-H377 PolarHBondContact O-N 2.79Å; A375-I378 PolarHBondContact O-N 3.21Å; A375-L379 WeakPolarHBondContact O-CB 3.38Å; A375-L379 PolarHBondContact O-N 2.86Å; A375-F387 HydrophobicContact CB-CE1 4.34Å; A375-F387 HydrophobicContact CB-CZ 4.26Å
376	K	94.3	Very high	90	Very high	126 Å²	126	68.8 Å²	68.8	55%	0.548	39%	0.391	S	S	.	.	H	α-helix	trans	-59.1	-43.7	176.1	-175.7	178.2	178.6	-179.8	0	111.2	L372 D373 L379 Q380	L372-K376 WeakPolarHBondContact O-CB 3.24Å; L372-K376 PolarHBondContact O-N 3.34Å; D373-K376 PolarHBondContact O-N 3.36Å; K376-L379 PolarHBondContact O-N 2.97Å; K376-Q380 VanDerWaalsContact CE-NE2 3.32Å; K376-Q380 HydrophobicContact CG-CG 4.42Å; K376-Q380 WeakPolarHBondContact O-CB 3.38Å; K376-Q380 VanDerWaalsContact O-CG 3.26Å; K376-Q380 WeakPolarHBondContact O-CG 3.35Å; K376-Q380 PolarHBondContact O-N 2.89Å
377	H	91.1	Very high	90.6	Very high	48 Å²	48	66.3 Å²	66.3	22%	0.222	36%	0.358	C	S	.	.	H	α-helix	trans	-65.4	-42.8	179.7	-162.1	-98.1	0	0	0	112.7	Y368 D373 C374 A375 Q380 R381	Y368-H377 HydrophobicContact CD1-CB 4.4Å; Y368-H377 HydrophobicContact CE1-CB 3.81Å; Y368-H377 AromaticContact CE1-CG 3.8Å; Y368-H377 AromaticContact CE1-ND1 3.72Å; D373-H377 WeakPolarHBondContact O-CB 3.14Å; D373-H377 PolarHBondContact O-N 2.82Å; C374-H377 PolarHBondContact O-N 3.07Å; A375-H377 VanDerWaalsContact C-N 3.31Å; A375-H377 PolarHBondContact O-N 2.79Å; H377-Q380 PolarHBondContact O-N 3.31Å; H377-R381 WeakPolarHBondContact CE1-CD 3.33Å; H377-R381 PolarHBondContact CE1-NE 2.74Å; H377-R381 PolarHBondContact CE1-NH1 2.85Å; H377-R381 PolarHBondContact NE2-NE 2.96Å; H377-R381 VanDerWaalsContact NE2-NE 3.18Å; H377-R381 PolarHBondContact NE2-NH2 3.5Å; H377-R381 WeakPolarHBondContact O-CB 3.35Å; H377-R381 PolarHBondContact O-N 3.28Å
378	I	91.1	Very high	91	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-48	174.5	-67.7	165.5	0	0	0	110.1	L356 R359 C374 A375 Q380 R381 E382 G383 A386 F387	L356-I378 HydrophobicContact CD2-CD1 3.8Å; R359-I378 HydrophobicContact CB-CD1 4.29Å; R359-I378 HydrophobicContact CG-CD1 3.83Å; C374-I378 VanDerWaalsContact O-CG1 3.28Å; C374-I378 WeakPolarHBondContact O-CG1 3.18Å; C374-I378 PolarHBondContact O-N 3.33Å; A375-I378 PolarHBondContact O-N 3.21Å; I378-Q380 PolarHBondContact O-N 3.46Å; I378-R381 PolarHBondContact O-N 3.32Å; I378-E382 WeakPolarHBondContact O-CA 3.44Å; I378-E382 WeakPolarHBondContact O-CB 3.24Å; I378-E382 PolarHBondContact O-N 3.17Å; I378-G383 PolarHBondContact O-N 3.49Å; I378-A386 HydrophobicContact CG2-CB 3.63Å; I378-F387 HydrophobicContact CB-CE2 4.33Å; I378-F387 HydrophobicContact CB-CZ 4Å; I378-F387 HydrophobicContact CG2-CD2 4.17Å; I378-F387 HydrophobicContact CG2-CE1 4.25Å; I378-F387 HydrophobicContact CG2-CE2 3.76Å; I378-F387 HydrophobicContact CG2-CZ 3.81Å
379	L	93.2	Very high	91.1	Very high	88 Å²	88	68.8 Å²	68.8	46%	0.461	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-43.7	-179.1	-177	61.4	0	0	0	111.9	A375 K376 G383 V384 F387	A375-L379 WeakPolarHBondContact O-CB 3.38Å; A375-L379 PolarHBondContact O-N 2.86Å; K376-L379 PolarHBondContact O-N 2.97Å; L379-G383 VanDerWaalsContact O-CA 3.32Å; L379-G383 WeakPolarHBondContact O-CA 3.45Å; L379-G383 PolarHBondContact O-N 3.49Å; L379-V384 HydrophobicContact CD1-CG2 3.58Å; L379-F387 HydrophobicContact CB-CE2 4.13Å; L379-F387 HydrophobicContact CB-CZ 4.5Å; L379-F387 HydrophobicContact CD1-CE2 4.39Å
380	Q	91.6	Very high	91.5	Very high	138 Å²	138	63.8 Å²	63.8	65%	0.645	33%	0.331	S	S	*	.	H	α-helix	trans	-72.2	-33.6	-178.3	-73	179.6	-21.6	0	0	113.6	K376 H377 I378	K376-Q380 VanDerWaalsContact CE-NE2 3.32Å; K376-Q380 HydrophobicContact CG-CG 4.42Å; K376-Q380 WeakPolarHBondContact O-CB 3.38Å; K376-Q380 VanDerWaalsContact O-CG 3.26Å; K376-Q380 WeakPolarHBondContact O-CG 3.35Å; K376-Q380 PolarHBondContact O-N 2.89Å; H377-Q380 PolarHBondContact O-N 3.31Å; I378-Q380 PolarHBondContact O-N 3.46Å
381	R	88.6	Confident	91.7	Very high	194 Å²	194	65.8 Å²	65.8	73%	0.732	33%	0.332	S	S	*	.	H	α-helix	trans	-96.9	-35.6	-175.2	-68.2	-164.9	176.4	-170.5	0.2	114.6	H377 I378	H377-R381 WeakPolarHBondContact CE1-CD 3.33Å; H377-R381 PolarHBondContact CE1-NE 2.74Å; H377-R381 PolarHBondContact CE1-NH1 2.85Å; H377-R381 PolarHBondContact NE2-NE 2.96Å; H377-R381 VanDerWaalsContact NE2-NE 3.18Å; H377-R381 PolarHBondContact NE2-NH2 3.5Å; H377-R381 WeakPolarHBondContact O-CB 3.35Å; H377-R381 PolarHBondContact O-N 3.28Å; I378-R381 PolarHBondContact O-N 3.32Å
382	E	87.8	Confident	91.7	Very high	53 Å²	53	67 Å²	67	25%	0.248	34%	0.341	C	S	.	.	H	α-helix	trans	-116.2	-13.6	-172.9	-56.2	-176.9	-120.9	0	0	113.3	R359 I378 A386 K389 A461	R359-E382 IonicContact CZ-OE1 2.87Å; R359-E382 IonicContact NE-OE1 2.76Å; R359-E382 IonicContact NH2-OE1 3.74Å; R359-E382 PolarHBondContact NH2-OE1 3.33Å; R359-E382 IonicContact NH2-OE2 2.69Å; R359-E382 PolarHBondContact NH2-OE2 3.02Å; I378-E382 WeakPolarHBondContact O-CA 3.44Å; I378-E382 WeakPolarHBondContact O-CB 3.24Å; I378-E382 PolarHBondContact O-N 3.17Å; E382-A386 HydrophobicContact CB-CB 3.39Å; E382-A386 HydrophobicContact CG-CB 4.29Å; E382-K389 IonicContact OE2-NZ 3.09Å; E382-K389 PolarHBondContact OE2-NZ 3.09Å; E382-A461 HydrophobicContact CG-CB 3.92Å; E382-A461 WeakPolarHBondContact OE1-CB 3.32Å; E382-A461 WeakPolarHBondContact OE2-CB 3.19Å
383	G	89.9	Confident	91.6	Very high	26 Å²	26	59.9 Å²	59.9	27%	0.268	30%	0.304	S	S	.	.			trans	77.6	-179.2	-177.3	0	0	0	0	0	114.3	I378 L379 A385 A386	I378-G383 PolarHBondContact O-N 3.49Å; L379-G383 VanDerWaalsContact O-CA 3.32Å; L379-G383 WeakPolarHBondContact O-CA 3.45Å; L379-G383 PolarHBondContact O-N 3.49Å; G383-A385 VanDerWaalsContact C-N 3.33Å; G383-A385 PolarHBondContact O-N 2.8Å; G383-A386 VanDerWaalsContact O-CB 3.27Å; G383-A386 WeakPolarHBondContact O-CB 3.41Å; G383-A386 PolarHBondContact O-N 3.36Å
384	V	91.4	Very high	91.4	Very high	99 Å²	99	57.5 Å²	57.5	60%	0.6	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-64.2	-35.7	-174.2	-179.8	0	0	0	0	112.4	L379 A386 F387	L379-V384 HydrophobicContact CD1-CG2 3.58Å; V384-A386 PolarHBondContact O-N 3.41Å; V384-A386 VanDerWaalsContact O-N 3.08Å; V384-F387 PolarHBondContact O-N 3.42Å; V384-F387 VanDerWaalsContact O-N 3.12Å
385	A	90.8	Very high	91.2	Very high	79 Å²	79	59.3 Å²	59.3	65%	0.653	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.2	-179.9	0	0	0	0	0	113.2	G383 F387 Y388	G383-A385 VanDerWaalsContact C-N 3.33Å; G383-A385 PolarHBondContact O-N 2.8Å; A385-F387 VanDerWaalsContact C-N 3.26Å; A385-F387 PolarHBondContact O-N 3.25Å; A385-Y388 PolarHBondContact O-N 2.81Å; A385-Y388 VanDerWaalsContact O-N 3.12Å
386	A	90.8	Very high	90.9	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.008	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-62.5	-32.9	177.8	0	0	0	0	0	113.1	I378 E382 G383 V384 Y388 K389	I378-A386 HydrophobicContact CG2-CB 3.63Å; E382-A386 HydrophobicContact CB-CB 3.39Å; E382-A386 HydrophobicContact CG-CB 4.29Å; G383-A386 VanDerWaalsContact O-CB 3.27Å; G383-A386 WeakPolarHBondContact O-CB 3.41Å; G383-A386 PolarHBondContact O-N 3.36Å; V384-A386 PolarHBondContact O-N 3.41Å; V384-A386 VanDerWaalsContact O-N 3.08Å; A386-Y388 PolarHBondContact O-N 3.12Å; A386-K389 WeakPolarHBondContact O-CB 3.46Å; A386-K389 PolarHBondContact O-N 3.29Å
387	F	93.3	Very high	90.4	Very high	25 Å²	25	56.8 Å²	56.8	11%	0.11	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-68.4	-11	177.4	-69.8	-83.7	0	0	0	113.6	Y351 P352 V355 L356 A375 I378 L379 V384 A385	Y351-F387 VanDerWaalsContact CD1-O 3.31Å; Y351-F387 WeakPolarHBondContact CD1-O 3.49Å; P352-F387 HydrophobicContact CB-CB 3.98Å; P352-F387 HydrophobicContact CB-CD1 3.95Å; P352-F387 HydrophobicContact CB-CG 4.32Å; P352-F387 HydrophobicContact CG-CB 4.27Å; V355-F387 WeakPolarHBondContact CG2-O 3.45Å; L356-F387 HydrophobicContact CD1-CE1 4.11Å; L356-F387 HydrophobicContact CD2-CE1 4.12Å; L356-F387 HydrophobicContact CG-CD1 4.41Å; L356-F387 HydrophobicContact CG-CE1 4Å; A375-F387 HydrophobicContact CB-CE1 4.34Å; A375-F387 HydrophobicContact CB-CZ 4.26Å; I378-F387 HydrophobicContact CB-CE2 4.33Å; I378-F387 HydrophobicContact CB-CZ 4Å; I378-F387 HydrophobicContact CG2-CD2 4.17Å; I378-F387 HydrophobicContact CG2-CE1 4.25Å; I378-F387 HydrophobicContact CG2-CE2 3.76Å; I378-F387 HydrophobicContact CG2-CZ 3.81Å; L379-F387 HydrophobicContact CB-CE2 4.13Å; L379-F387 HydrophobicContact CB-CZ 4.5Å; L379-F387 HydrophobicContact CD1-CE2 4.39Å; V384-F387 PolarHBondContact O-N 3.42Å; V384-F387 VanDerWaalsContact O-N 3.12Å; A385-F387 VanDerWaalsContact C-N 3.26Å; A385-F387 PolarHBondContact O-N 3.25Å
388	Y	93.9	Very high	89.8	Confident	103 Å²	103	57.8 Å²	57.8	40%	0.404	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-114.3	11.7	177.4	-70.9	-90.9	0	0	0	113.3	S348 Y351 P352 A385 A386 G390 Y391	S348-Y388 WeakPolarHBondContact O-CE1 3.45Å; S348-Y388 PolarHBondContact O-OH 3.06Å; Y351-Y388 HydrophobicContact CD1-CD1 4Å; Y351-Y388 HydrophobicContact CD1-CG 4.43Å; Y351-Y388 HydrophobicContact CG-CD1 4.36Å; P352-Y388 HydrophobicContact CG-CE2 3.92Å; A385-Y388 PolarHBondContact O-N 2.81Å; A385-Y388 VanDerWaalsContact O-N 3.12Å; A386-Y388 PolarHBondContact O-N 3.12Å; Y388-G390 PolarHBondContact O-N 3.16Å; Y388-Y391 HydrophobicContact CD1-CD2 4.41Å; Y388-Y391 WeakPolarHBondContact O-CB 3.28Å; Y388-Y391 PolarHBondContact O-N 2.67Å; Y388-Y391 VanDerWaalsContact O-N 3.11Å
389	K	91.3	Very high	89.1	Confident	39 Å²	39	63.8 Å²	63.8	17%	0.17	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	128.5	175.5	-80.7	-178	-178.1	171.4	0	111.4	Y351 E382 A386 Q458 Q468	Y351-K389 WeakPolarHBondContact CE1-O 3.34Å; Y351-K389 PolarHBondContact OH-O 3.47Å; E382-K389 IonicContact OE2-NZ 3.09Å; E382-K389 PolarHBondContact OE2-NZ 3.09Å; A386-K389 WeakPolarHBondContact O-CB 3.46Å; A386-K389 PolarHBondContact O-N 3.29Å; K389-Q458 WeakPolarHBondContact O-CG 3.49Å; K389-Q468 VanDerWaalsContact NZ-CD 3.28Å
390	G	90.6	Very high	88.5	Confident	3 Å²	3	62 Å²	62	3%	0.031	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	5.7	-176.8	0	0	0	0	0	114.2	Y351 Y388 V392 P393 N394	Y351-G390 WeakPolarHBondContact OH-CA 3.41Å; Y351-G390 PolarHBondContact OH-O 3.08Å; Y388-G390 PolarHBondContact O-N 3.16Å; G390-V392 PolarHBondContact O-N 2.68Å; G390-P393 VanDerWaalsContact O-CD 3.27Å; G390-P393 WeakPolarHBondContact O-CD 3.42Å; G390-P393 VanDerWaalsContact O-CG 3.27Å; G390-P393 WeakPolarHBondContact O-CG 3.3Å; G390-N394 WeakPolarHBondContact O-CB 3.35Å; G390-N394 PolarHBondContact O-N 3.48Å
391	Y	91.7	Very high	87.9	Confident	67 Å²	67	58.4 Å²	58.4	26%	0.263	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-43.3	-178.7	178	-98.4	0	0	0	112.4	S348 Y351 Y388 N394 M395	S348-Y391 PolarHBondContact OG-OH 2.92Å; Y351-Y391 HydrophobicContact CD1-CD2 4.27Å; Y351-Y391 AromaticContact CD2-CD2 3.7Å; Y351-Y391 HydrophobicContact CD2-CD2 3.7Å; Y351-Y391 HydrophobicContact CD2-CE2 4.45Å; Y351-Y391 HydrophobicContact CE2-CD2 4.04Å; Y351-Y391 AromaticContact CG-CD2 3.83Å; Y351-Y391 HydrophobicContact CG-CD2 3.83Å; Y351-Y391 VanDerWaalsContact CZ-CA 3.46Å; Y351-Y391 PolarHBondContact OH-N 3.22Å; Y388-Y391 HydrophobicContact CD1-CD2 4.41Å; Y388-Y391 WeakPolarHBondContact O-CB 3.28Å; Y388-Y391 PolarHBondContact O-N 2.67Å; Y388-Y391 VanDerWaalsContact O-N 3.11Å; Y391-N394 VanDerWaalsContact O-CB 3.25Å; Y391-N394 WeakPolarHBondContact O-CB 3.36Å; Y391-N394 PolarHBondContact O-N 2.88Å; Y391-M395 HydrophobicContact CD1-CG 4.17Å; Y391-M395 HydrophobicContact CD2-CE 4.44Å; Y391-M395 HydrophobicContact CD2-CG 4.45Å; Y391-M395 HydrophobicContact CE1-CG 3.66Å; Y391-M395 HydrophobicContact CE2-CE 3.72Å; Y391-M395 HydrophobicContact CE2-CG 3.97Å; Y391-M395 HydrophobicContact CE2-SD 4.21Å; Y391-M395 WeakPolarHBondContact O-CG 3.39Å; Y391-M395 PolarHBondContact O-N 3.47Å
392	V	92.5	Very high	87.1	Confident	85 Å²	85	50.3 Å²	50.3	52%	0.515	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-55.6	177.8	177.5	0	0	0	0	112.5	G390 N394 M395 L396 M471	G390-V392 PolarHBondContact O-N 2.68Å; V392-N394 PolarHBondContact O-N 3.41Å; V392-M395 PolarHBondContact O-N 3.24Å; V392-L396 HydrophobicContact CG1-CD1 3.9Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CG 3.41Å; V392-L396 PolarHBondContact O-N 2.86Å; V392-M471 HydrophobicContact CG1-SD 4.12Å
393	P	91.5	Very high	86.4	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-25	176.6	22.6	-32	0	0	0	112.9	G390 G397 L450 V453 R454 M457 M471	G390-P393 VanDerWaalsContact O-CD 3.27Å; G390-P393 WeakPolarHBondContact O-CD 3.42Å; G390-P393 VanDerWaalsContact O-CG 3.27Å; G390-P393 WeakPolarHBondContact O-CG 3.3Å; P393-G397 PolarHBondContact O-N 3.32Å; P393-L450 HydrophobicContact CB-CD2 4.28Å; P393-V453 HydrophobicContact CB-CG1 4.25Å; P393-V453 HydrophobicContact CG-CG1 4.27Å; P393-R454 HydrophobicContact CB-CB 4.38Å; P393-R454 HydrophobicContact CG-CB 4.2Å; P393-M457 HydrophobicContact CG-SD 3.9Å; P393-M471 HydrophobicContact CB-CG 4.14Å; P393-M471 HydrophobicContact CB-SD 3.84Å; P393-M471 HydrophobicContact CG-CG 4.11Å; P393-M471 HydrophobicContact CG-SD 4.18Å
394	N	88.9	Confident	86	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-53.9	171.3	-173.3	71.1	0	0	0	111.9	Q347 Y351 G390 Y391 V392 L396 G397 I398 R454	Q347-N394 WeakPolarHBondContact CG-ND2 3.14Å; Y351-N394 HydrophobicContact CE2-CB 3.78Å; G390-N394 WeakPolarHBondContact O-CB 3.35Å; G390-N394 PolarHBondContact O-N 3.48Å; Y391-N394 VanDerWaalsContact O-CB 3.25Å; Y391-N394 WeakPolarHBondContact O-CB 3.36Å; Y391-N394 PolarHBondContact O-N 2.88Å; V392-N394 PolarHBondContact O-N 3.41Å; N394-L396 PolarHBondContact O-N 2.84Å; N394-G397 PolarHBondContact O-N 3.15Å; N394-G397 VanDerWaalsContact O-N 3.16Å; N394-I398 WeakPolarHBondContact O-CG1 3.3Å; N394-I398 PolarHBondContact O-N 2.93Å; N394-R454 HydrophobicContact CB-CG 4.23Å; N394-R454 WeakPolarHBondContact OD1-CD 3.41Å; N394-R454 PolarHBondContact OD1-NH1 3.26Å
395	M	86.9	Confident	85.2	Confident	39 Å²	39	47.5 Å²	47.5	19%	0.192	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-46.2	179.7	-70.4	-67.7	117.9	0	0	111.8	Q347 Y391 V392 G397 I398	Q347-M395 HydrophobicContact CB-CE 3.87Å; Q347-M395 HydrophobicContact CG-CE 3.26Å; Y391-M395 HydrophobicContact CD1-CG 4.17Å; Y391-M395 HydrophobicContact CD2-CE 4.44Å; Y391-M395 HydrophobicContact CD2-CG 4.45Å; Y391-M395 HydrophobicContact CE1-CG 3.66Å; Y391-M395 HydrophobicContact CE2-CE 3.72Å; Y391-M395 HydrophobicContact CE2-CG 3.97Å; Y391-M395 HydrophobicContact CE2-SD 4.21Å; Y391-M395 WeakPolarHBondContact O-CG 3.39Å; Y391-M395 PolarHBondContact O-N 3.47Å; V392-M395 PolarHBondContact O-N 3.24Å; M395-G397 PolarHBondContact O-N 3.1Å; M395-I398 HydrophobicContact CE-CD1 3.84Å; M395-I398 PolarHBondContact O-N 3.29Å
396	L	88.8	Confident	84.4	Confident	85 Å²	85	46.4 Å²	46.4	45%	0.445	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-27.2	177.2	-68.2	177.3	0	0	0	112.9	V392 N394 P400 L450 M471	V392-L396 HydrophobicContact CG1-CD1 3.9Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CG 3.41Å; V392-L396 PolarHBondContact O-N 2.86Å; N394-L396 PolarHBondContact O-N 2.84Å; L396-P400 WeakPolarHBondContact O-CD 2.85Å; L396-P400 WeakPolarHBondContact O-CG 3.36Å; L396-L450 HydrophobicContact CB-CD1 3.94Å; L396-M471 HydrophobicContact CD1-CE 4.38Å; L396-M471 HydrophobicContact CD1-SD 4.28Å
397	G	81.7	Confident	83.6	Confident	10 Å²	10	48.7 Å²	48.7	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-80	-28	178.8	0	0	0	0	0	113.9	P393 N394 M395 Y401 S447	P393-G397 PolarHBondContact O-N 3.32Å; N394-G397 PolarHBondContact O-N 3.15Å; N394-G397 VanDerWaalsContact O-N 3.16Å; M395-G397 PolarHBondContact O-N 3.1Å; G397-Y401 VanDerWaalsContact O-CB 3.29Å; G397-Y401 WeakPolarHBondContact O-CB 3.23Å; G397-Y401 PolarHBondContact O-N 3.44Å; G397-S447 WeakPolarHBondContact O-CB 3.23Å
398	I	78.9	Confident	83	Confident	68 Å²	68	49.4 Å²	49.4	35%	0.349	27%	0.273	S	S	.	.	H	α-helix	trans	-67	-41.7	-179	-70.1	163.8	0	0	0	111.1	Q347 N394 M395 Y401 A402	Q347-I398 HydrophobicContact CG-CD1 4.19Å; N394-I398 WeakPolarHBondContact O-CG1 3.3Å; N394-I398 PolarHBondContact O-N 2.93Å; M395-I398 HydrophobicContact CE-CD1 3.84Å; M395-I398 PolarHBondContact O-N 3.29Å; I398-Y401 WeakPolarHBondContact O-CB 3.13Å; I398-Y401 PolarHBondContact O-N 3.34Å; I398-A402 WeakPolarHBondContact O-CB 3.35Å; I398-A402 PolarHBondContact O-N 2.93Å
399	I	77.4	Confident	82.2	Confident	127 Å²	127	45.4 Å²	45.4	65%	0.651	26%	0.257	S	S	*	.	H	α-helix	trans	-63.2	-53.3	-174.6	-59.3	168	0	0	0	111.8	Y401 A402 G403	I399-Y401 VanDerWaalsContact C-N 3.31Å; I399-Y401 PolarHBondContact O-N 3.29Å; I399-A402 PolarHBondContact O-N 2.81Å; I399-G403 PolarHBondContact O-N 3.1Å
400	P	79.7	Confident	81.3	Confident	50 Å²	50	46.9 Å²	46.9	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-65.9	-34.5	177.4	-19.6	32.8	0	0	0	112.5	L396 I404	L396-P400 WeakPolarHBondContact O-CD 2.85Å; L396-P400 WeakPolarHBondContact O-CG 3.36Å; P400-I404 WeakPolarHBondContact O-CB 3.31Å; P400-I404 WeakPolarHBondContact O-CD1 3.37Å; P400-I404 VanDerWaalsContact O-CG1 3.27Å; P400-I404 WeakPolarHBondContact O-CG1 3.48Å; P400-I404 PolarHBondContact O-N 3.36Å
401	Y	78.6	Confident	80.7	Confident	63 Å²	63	50.9 Å²	50.9	25%	0.247	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-56.4	175.1	172.6	-94.1	0	0	0	110.4	G397 I398 I399 I404 D405 S440 G443 Q444	G397-Y401 VanDerWaalsContact O-CB 3.29Å; G397-Y401 WeakPolarHBondContact O-CB 3.23Å; G397-Y401 PolarHBondContact O-N 3.44Å; I398-Y401 WeakPolarHBondContact O-CB 3.13Å; I398-Y401 PolarHBondContact O-N 3.34Å; I399-Y401 VanDerWaalsContact C-N 3.31Å; I399-Y401 PolarHBondContact O-N 3.29Å; Y401-I404 PolarHBondContact O-N 3.01Å; Y401-D405 WeakPolarHBondContact O-CB 3.24Å; Y401-D405 PolarHBondContact O-N 2.92Å; Y401-D405 PolarHBondContact OH-OD2 3.35Å; Y401-S440 PolarHBondContact OH-OG 3.21Å; Y401-G443 VanDerWaalsContact CD2-C 3.41Å; Y401-Q444 HydrophobicContact CD2-CG 4.24Å; Y401-Q444 HydrophobicContact CE2-CG 3.8Å
402	A	72.1	Confident	80	Confident	24 Å²	24	50.8 Å²	50.8	20%	0.198	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-43.5	-176.6	0	0	0	0	0	112.1	I223 I398 I399 L406	I223-A402 HydrophobicContact CD1-CB 3.8Å; I398-A402 WeakPolarHBondContact O-CB 3.35Å; I398-A402 PolarHBondContact O-N 2.93Å; I399-A402 PolarHBondContact O-N 2.81Å; A402-L406 WeakPolarHBondContact O-CB 3.34Å; A402-L406 PolarHBondContact O-N 3.36Å
403	G	74.1	Confident	79	Confident	44 Å²	44	47.1 Å²	47.1	45%	0.454	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-42.9	179.9	0	0	0	0	0	113	I399 A407	I399-G403 PolarHBondContact O-N 3.1Å; G403-A407 VanDerWaalsContact O-CB 3.26Å; G403-A407 WeakPolarHBondContact O-CB 3.26Å; G403-A407 PolarHBondContact O-N 3.47Å
404	I	80.5	Confident	78	Confident	57 Å²	57	50.4 Å²	50.4	29%	0.292	29%	0.287	S	S	.	.	H	α-helix	trans	-73.8	-41.1	179.1	-66.8	167.9	0	0	0	111.1	P400 Y401 L406 A407 V408 C442 A446	P400-I404 WeakPolarHBondContact O-CB 3.31Å; P400-I404 WeakPolarHBondContact O-CD1 3.37Å; P400-I404 VanDerWaalsContact O-CG1 3.27Å; P400-I404 WeakPolarHBondContact O-CG1 3.48Å; P400-I404 PolarHBondContact O-N 3.36Å; Y401-I404 PolarHBondContact O-N 3.01Å; I404-L406 VanDerWaalsContact C-N 3.35Å; I404-A407 PolarHBondContact O-N 3.41Å; I404-V408 HydrophobicContact CG2-CG2 3.99Å; I404-V408 VanDerWaalsContact O-CB 3.28Å; I404-V408 WeakPolarHBondContact O-CB 3.47Å; I404-V408 WeakPolarHBondContact O-CG2 3.43Å; I404-V408 PolarHBondContact O-N 3.49Å; I404-C442 HydrophobicContact CG2-CB 4.03Å; I404-A446 HydrophobicContact CD1-CB 3.23Å
405	D	75.7	Confident	77.3	Confident	19 Å²	19	52.1 Å²	52.1	10%	0.102	30%	0.3	C	S	.	.	H	α-helix	trans	-58.2	-49.1	176.3	-171.3	27.4	0	0	0	110.3	Y401 Y409 S439 S440	Y401-D405 WeakPolarHBondContact O-CB 3.24Å; Y401-D405 PolarHBondContact O-N 2.92Å; Y401-D405 PolarHBondContact OH-OD2 3.35Å; D405-Y409 WeakPolarHBondContact O-CB 3.42Å; D405-Y409 PolarHBondContact O-N 3.23Å; D405-S439 VanDerWaalsContact O-CB 3.24Å; D405-S439 WeakPolarHBondContact O-CB 3.31Å; D405-S439 VanDerWaalsContact OD1-CB 3.26Å; D405-S439 WeakPolarHBondContact OD1-CB 3.05Å; D405-S439 PolarHBondContact OD1-OG 2.83Å; D405-S440 VanDerWaalsContact OD1-CA 3.22Å; D405-S440 WeakPolarHBondContact OD1-CA 3.1Å; D405-S440 PolarHBondContact OD1-N 3.19Å; D405-S440 PolarHBondContact OD1-OG 3.07Å; D405-S440 VanDerWaalsContact OD1-OG 3.13Å; D405-S440 PolarHBondContact OD2-OG 2.84Å
406	L	73.4	Confident	76.9	Confident	55 Å²	55	53.6 Å²	53.6	29%	0.288	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-52.5	177.7	-174.3	65.4	0	0	0	112.2	A402 I404 V408 Y409 E410	A402-L406 WeakPolarHBondContact O-CB 3.34Å; A402-L406 PolarHBondContact O-N 3.36Å; I404-L406 VanDerWaalsContact C-N 3.35Å; L406-V408 VanDerWaalsContact C-N 3.35Å; L406-V408 PolarHBondContact O-N 3.5Å; L406-Y409 PolarHBondContact O-N 2.92Å; L406-E410 HydrophobicContact CD1-CG 4.16Å; L406-E410 WeakPolarHBondContact CD1-OE1 3.47Å; L406-E410 HydrophobicContact CG-CG 4.47Å; L406-E410 WeakPolarHBondContact O-CB 3.44Å; L406-E410 WeakPolarHBondContact O-CG 3.44Å; L406-E410 PolarHBondContact O-N 3.3Å
407	A	74.8	Confident	76	Confident	50 Å²	50	50.9 Å²	50.9	41%	0.413	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-42.6	-176.5	0	0	0	0	0	112.4	G403 I404 T411	G403-A407 VanDerWaalsContact O-CB 3.26Å; G403-A407 WeakPolarHBondContact O-CB 3.26Å; G403-A407 PolarHBondContact O-N 3.47Å; I404-A407 PolarHBondContact O-N 3.41Å; A407-T411 VanDerWaalsContact O-CB 3.27Å; A407-T411 WeakPolarHBondContact O-CB 3.47Å; A407-T411 PolarHBondContact O-N 2.68Å; A407-T411 PolarHBondContact O-OG1 3.03Å
408	V	80.3	Confident	75.5	Confident	39 Å²	39	57.7 Å²	57.7	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-70.3	-41.1	178.4	175	0	0	0	0	110.7	I404 L406 T411 L412 C442	I404-V408 HydrophobicContact CG2-CG2 3.99Å; I404-V408 VanDerWaalsContact O-CB 3.28Å; I404-V408 WeakPolarHBondContact O-CB 3.47Å; I404-V408 WeakPolarHBondContact O-CG2 3.43Å; I404-V408 PolarHBondContact O-N 3.49Å; L406-V408 VanDerWaalsContact C-N 3.35Å; L406-V408 PolarHBondContact O-N 3.5Å; V408-T411 PolarHBondContact O-N 3.09Å; V408-L412 HydrophobicContact CG1-CD1 3.67Å; V408-L412 HydrophobicContact CG1-CG 4.15Å; V408-L412 WeakPolarHBondContact O-CB 3.5Å; V408-L412 WeakPolarHBondContact O-CG 3.21Å; V408-L412 PolarHBondContact O-N 2.81Å; V408-C442 HydrophobicContact CG2-CB 4.23Å
409	Y	76	Confident	75.2	Confident	20 Å²	20	63.6 Å²	63.6	8%	0.078	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-52.9	177.6	176.8	-103.2	0	0	0	111.4	D405 L406 T411 L412 K413 C435	D405-Y409 WeakPolarHBondContact O-CB 3.42Å; D405-Y409 PolarHBondContact O-N 3.23Å; L406-Y409 PolarHBondContact O-N 2.92Å; Y409-T411 PolarHBondContact O-N 3.29Å; Y409-L412 PolarHBondContact O-N 3.12Å; Y409-K413 HydrophobicContact CE1-CD 4.02Å; Y409-K413 VanDerWaalsContact O-CB 3.23Å; Y409-K413 WeakPolarHBondContact O-CB 3.17Å; Y409-K413 PolarHBondContact O-N 3.19Å; Y409-C435 HydrophobicContact CD2-CB 3.88Å; Y409-C435 HydrophobicContact CE2-CB 3.95Å
410	E	74	Confident	74.8	Confident	70 Å²	70	63.7 Å²	63.7	33%	0.327	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-44.9	179.9	-71.5	-179.1	169.8	0	0	111.3	L406 L412 K413 N414	L406-E410 HydrophobicContact CD1-CG 4.16Å; L406-E410 WeakPolarHBondContact CD1-OE1 3.47Å; L406-E410 HydrophobicContact CG-CG 4.47Å; L406-E410 WeakPolarHBondContact O-CB 3.44Å; L406-E410 WeakPolarHBondContact O-CG 3.44Å; L406-E410 PolarHBondContact O-N 3.3Å; E410-L412 PolarHBondContact O-N 3.41Å; E410-K413 PolarHBondContact O-N 3.06Å; E410-N414 VanDerWaalsContact O-CB 3.23Å; E410-N414 WeakPolarHBondContact O-CB 3.27Å; E410-N414 PolarHBondContact O-N 2.69Å; E410-N414 PolarHBondContact O-ND2 3.11Å
411	T	76.5	Confident	74	Confident	86 Å²	86	63.1 Å²	63.1	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-46.4	178	-57.9	0	0	0	0	111.4	A407 V408 Y409 S415	A407-T411 VanDerWaalsContact O-CB 3.27Å; A407-T411 WeakPolarHBondContact O-CB 3.47Å; A407-T411 PolarHBondContact O-N 2.68Å; A407-T411 PolarHBondContact O-OG1 3.03Å; V408-T411 PolarHBondContact O-N 3.09Å; Y409-T411 PolarHBondContact O-N 3.29Å; T411-S415 WeakPolarHBondContact O-CB 3.41Å; T411-S415 PolarHBondContact O-N 2.95Å; T411-S415 PolarHBondContact O-OG 3.44Å
412	L	77.1	Confident	72.4	Confident	66 Å²	66	65.9 Å²	65.9	35%	0.346	36%	0.355	S	S	.	.	H	α-helix	trans	-67.5	-43.5	-179.7	-71.6	175.1	0	0	0	111.9	V408 Y409 E410 W416 C435 T438	V408-L412 HydrophobicContact CG1-CD1 3.67Å; V408-L412 HydrophobicContact CG1-CG 4.15Å; V408-L412 WeakPolarHBondContact O-CB 3.5Å; V408-L412 WeakPolarHBondContact O-CG 3.21Å; V408-L412 PolarHBondContact O-N 2.81Å; Y409-L412 PolarHBondContact O-N 3.12Å; E410-L412 PolarHBondContact O-N 3.41Å; L412-W416 WeakPolarHBondContact O-CB 3Å; L412-W416 PolarHBondContact O-N 3.34Å; L412-C435 HydrophobicContact CB-CB 4.36Å; L412-T438 HydrophobicContact CD1-CG2 3.79Å
413	K	72.3	Confident	70.8	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.035	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-50.9	179.1	-177.5	-178.9	174.9	-178.7	0	111	D217 Y409 E410 S415 W416 L417 L432	D217-K413 IonicContact OD1-NZ 2.74Å; D217-K413 PolarHBondContact OD1-NZ 2.9Å; D217-K413 WeakPolarHBondContact OD2-CE 3.28Å; D217-K413 IonicContact OD2-NZ 3.59Å; D217-K413 PolarHBondContact OD2-NZ 2.99Å; Y409-K413 HydrophobicContact CE1-CD 4.02Å; Y409-K413 VanDerWaalsContact O-CB 3.23Å; Y409-K413 WeakPolarHBondContact O-CB 3.17Å; Y409-K413 PolarHBondContact O-N 3.19Å; E410-K413 PolarHBondContact O-N 3.06Å; K413-S415 VanDerWaalsContact C-N 3.35Å; K413-S415 PolarHBondContact O-N 2.9Å; K413-W416 WeakPolarHBondContact O-CB 3.5Å; K413-W416 PolarHBondContact O-N 3.17Å; K413-W416 VanDerWaalsContact O-N 3.14Å; K413-L417 HydrophobicContact CG-CD1 4.2Å; K413-L417 WeakPolarHBondContact O-CG 3.46Å; K413-L417 PolarHBondContact O-N 3.41Å; K413-L432 HydrophobicContact CD-CD2 4.22Å
414	N	71.3	Confident	69.3	Low	69 Å²	69	74 Å²	74	37%	0.369	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-40.2	-180	-66.1	-11.3	0	0	0	111.4	E410 W416 L417 Q418	E410-N414 VanDerWaalsContact O-CB 3.23Å; E410-N414 WeakPolarHBondContact O-CB 3.27Å; E410-N414 PolarHBondContact O-N 2.69Å; E410-N414 PolarHBondContact O-ND2 3.11Å; N414-W416 VanDerWaalsContact C-N 3.27Å; N414-W416 PolarHBondContact O-N 2.67Å; N414-L417 PolarHBondContact O-N 3.29Å; N414-Q418 WeakPolarHBondContact O-CB 3.47Å; N414-Q418 VanDerWaalsContact O-CG 3.3Å; N414-Q418 WeakPolarHBondContact O-CG 3.09Å; N414-Q418 PolarHBondContact O-N 3.47Å
415	S	73.1	Confident	67.8	Low	46 Å²	46	72.8 Å²	72.8	32%	0.322	39%	0.389	S	S	.	.	H	α-helix	trans	-63.2	-33.7	175.3	-62.6	0	0	0	0	112.7	T411 K413 R419	T411-S415 WeakPolarHBondContact O-CB 3.41Å; T411-S415 PolarHBondContact O-N 2.95Å; T411-S415 PolarHBondContact O-OG 3.44Å; K413-S415 VanDerWaalsContact C-N 3.35Å; K413-S415 PolarHBondContact O-N 2.9Å; S415-R419 WeakPolarHBondContact O-CG 3.44Å
416	W	78.3	Confident	66.6	Low	69 Å²	69	77 Å²	77	26%	0.261	41%	0.412	S	S	.	.	H	α-helix	trans	-71.8	-48.3	176	-174	95.3	0	0	0	110.9	L412 K413 N414 Q418 R419 F420 P427 V431	L412-W416 WeakPolarHBondContact O-CB 3Å; L412-W416 PolarHBondContact O-N 3.34Å; K413-W416 WeakPolarHBondContact O-CB 3.5Å; K413-W416 PolarHBondContact O-N 3.17Å; K413-W416 VanDerWaalsContact O-N 3.14Å; N414-W416 VanDerWaalsContact C-N 3.27Å; N414-W416 PolarHBondContact O-N 2.67Å; W416-Q418 PolarHBondContact O-N 2.81Å; W416-R419 PolarHBondContact O-N 3.08Å; W416-R419 VanDerWaalsContact O-N 3.08Å; W416-F420 AromaticContact CD1-CD2 3.76Å; W416-F420 HydrophobicContact CD2-CB 4.23Å; W416-F420 HydrophobicContact CD2-CD2 4.32Å; W416-F420 HydrophobicContact CE3-CB 4.48Å; W416-F420 HydrophobicContact CG-CD2 4.12Å; W416-F420 HydrophobicContact CH2-CB 4.14Å; W416-F420 HydrophobicContact CZ2-CB 3.89Å; W416-F420 HydrophobicContact CZ3-CB 4.4Å; W416-F420 AromaticContact NE1-CD2 3.74Å; W416-F420 PolarHBondContact O-N 3.03Å; W416-P427 HydrophobicContact CE3-CB 3.86Å; W416-P427 HydrophobicContact CE3-CG 4.26Å; W416-P427 HydrophobicContact CH2-CB 4.41Å; W416-P427 VanDerWaalsContact CZ3-CA 3.41Å; W416-P427 HydrophobicContact CZ3-CB 3.85Å; W416-P427 HydrophobicContact CZ3-CG 4.29Å; W416-V431 HydrophobicContact CB-CG1 4.42Å; W416-V431 HydrophobicContact CD2-CG1 3.82Å; W416-V431 HydrophobicContact CE3-CG1 4.46Å; W416-V431 HydrophobicContact CG-CG1 3.76Å; W416-V431 HydrophobicContact CZ2-CG2 3.91Å
417	L	70.4	Confident	65.9	Low	28 Å²	28	74.8 Å²	74.8	15%	0.147	40%	0.401	C	S	.	.	H	α-helix	trans	-56.1	-49.2	178.4	-75.1	169.9	0	0	0	111.1	K413 N414 R419 F420 A421 P427	K413-L417 HydrophobicContact CG-CD1 4.2Å; K413-L417 WeakPolarHBondContact O-CG 3.46Å; K413-L417 PolarHBondContact O-N 3.41Å; N414-L417 PolarHBondContact O-N 3.29Å; L417-R419 PolarHBondContact O-N 3.11Å; L417-R419 VanDerWaalsContact O-N 3.11Å; L417-F420 PolarHBondContact O-N 3.2Å; L417-A421 HydrophobicContact CD2-CB 4.07Å; L417-A421 WeakPolarHBondContact O-CB 3.42Å; L417-A421 PolarHBondContact O-N 3.03Å; L417-P427 HydrophobicContact CD2-CG 3.84Å; L417-P427 HydrophobicContact CG-CG 4.25Å
418	Q	71.1	Confident	65.1	Low	154 Å²	154	73.6 Å²	73.6	72%	0.72	39%	0.394	S	S	*	.	H	α-helix	trans	-59.6	-25.8	178.7	-74.6	176.9	-10.6	0	0	114.3	N414 W416	N414-Q418 WeakPolarHBondContact O-CB 3.47Å; N414-Q418 VanDerWaalsContact O-CG 3.3Å; N414-Q418 WeakPolarHBondContact O-CG 3.09Å; N414-Q418 PolarHBondContact O-N 3.47Å; W416-Q418 PolarHBondContact O-N 2.81Å
419	R	72.7	Confident	64.4	Low	192 Å²	192	75.5 Å²	75.5	73%	0.725	41%	0.405	S	S	*	.	H	α-helix	trans	-98.6	-28.1	-176.2	-71	-177	-175.8	178.2	3.5	114	S415 W416 L417	S415-R419 WeakPolarHBondContact O-CG 3.44Å; W416-R419 PolarHBondContact O-N 3.08Å; W416-R419 VanDerWaalsContact O-N 3.08Å; L417-R419 PolarHBondContact O-N 3.11Å; L417-R419 VanDerWaalsContact O-N 3.11Å
420	F	69.6	Low	64.1	Low	129 Å²	129	83.1 Å²	83.1	57%	0.566	44%	0.439	S	S	*	.	H	α-helix	trans	-127.8	-9.5	-167.5	-63.9	-74.6	0	0	0	114.6	W416 L417 T422	W416-F420 AromaticContact CD1-CD2 3.76Å; W416-F420 HydrophobicContact CD2-CB 4.23Å; W416-F420 HydrophobicContact CD2-CD2 4.32Å; W416-F420 HydrophobicContact CE3-CB 4.48Å; W416-F420 HydrophobicContact CG-CD2 4.12Å; W416-F420 HydrophobicContact CH2-CB 4.14Å; W416-F420 HydrophobicContact CZ2-CB 3.89Å; W416-F420 HydrophobicContact CZ3-CB 4.4Å; W416-F420 AromaticContact NE1-CD2 3.74Å; W416-F420 PolarHBondContact O-N 3.03Å; L417-F420 PolarHBondContact O-N 3.2Å; F420-T422 PolarHBondContact O-N 3.42Å
421	A	61.6	Low	64.2	Low	38 Å²	38	81.3 Å²	81.3	31%	0.314	43%	0.432	S	S	.	.			trans	-82.9	57	179.7	0	0	0	0	0	112.5	L417	L417-A421 HydrophobicContact CD2-CB 4.07Å; L417-A421 WeakPolarHBondContact O-CB 3.42Å; L417-A421 PolarHBondContact O-N 3.03Å
422	T	45.9	Very low	63.8	Low	121 Å²	121	79.4 Å²	79.4	74%	0.742	42%	0.419	S	S	*	.	S	Bend	trans	-83.1	-25.6	179	-31.9	0	0	0	0	112.8	F420	F420-T422 PolarHBondContact O-N 3.42Å
423	D	38.8	Very low	63.4	Low	163 Å²	163	79.8 Å²	79.8	87%	0.872	42%	0.421	S	S	*	.	S	Bend	trans	-133.4	-3.8	-177.6	-71.3	-49	0	0	0	114.2
424	S	41.5	Very low	63.5	Low	75 Å²	75	81.8 Å²	81.8	52%	0.524	44%	0.439	S	S	.	.			trans	-160.9	124.6	178.6	54.8	0	0	0	0	111.3	D426	S424-D426 VanDerWaalsContact C-N 3.26Å; S424-D426 PolarHBondContact O-N 3.39Å
425	A	48.9	Very low	63.7	Low	32 Å²	32	79 Å²	79	26%	0.264	43%	0.425	S	S	.	.	S	Bend	trans	-83.9	10.1	179.1	0	0	0	0	0	114.4	T214 P427	T214-A425 HydrophobicContact CG2-CB 3.74Å; A425-P427 WeakPolarHBondContact O-CD 3.49Å
426	D	51.4	Low	63.7	Low	106 Å²	106	77.4 Å²	77.4	57%	0.567	42%	0.416	S	S	*	.			trans	-95.9	114.9	172.4	-172.9	-4.5	0	0	0	109.7	S424 G428	S424-D426 VanDerWaalsContact C-N 3.26Å; S424-D426 PolarHBondContact O-N 3.39Å; D426-G428 PolarHBondContact O-N 3.2Å; D426-G428 VanDerWaalsContact O-N 3.09Å; D426-G428 PolarHBondContact OD1-N 3.4Å
427	P	57.9	Low	63.6	Low	10 Å²	10	76.4 Å²	76.4	7%	0.065	42%	0.417	C	S	.	.			trans	-60.3	-17.3	174.6	-18.1	30	0	0	0	113.6	W416 L417 A425 V431 L432	W416-P427 HydrophobicContact CE3-CB 3.86Å; W416-P427 HydrophobicContact CE3-CG 4.26Å; W416-P427 HydrophobicContact CH2-CB 4.41Å; W416-P427 VanDerWaalsContact CZ3-CA 3.41Å; W416-P427 HydrophobicContact CZ3-CB 3.85Å; W416-P427 HydrophobicContact CZ3-CG 4.29Å; L417-P427 HydrophobicContact CD2-CG 3.84Å; L417-P427 HydrophobicContact CG-CG 4.25Å; A425-P427 WeakPolarHBondContact O-CD 3.49Å; P427-V431 HydrophobicContact CB-CB 3.83Å; P427-V431 HydrophobicContact CB-CG1 3.81Å; P427-V431 WeakPolarHBondContact O-CB 3.39Å; P427-V431 WeakPolarHBondContact O-CG2 3.44Å; P427-L432 HydrophobicContact CB-CD2 4.16Å; P427-L432 HydrophobicContact CB-CG 4.22Å; P427-L432 HydrophobicContact CG-CD2 4Å; P427-L432 HydrophobicContact CG-CG 4.48Å
428	G	59.1	Low	64.2	Low	25 Å²	25	78.3 Å²	78.3	26%	0.258	43%	0.43	S	S	.	.	H	α-helix	trans	73.7	154.5	-173.7	0	0	0	0	0	111.8	D426 F430 V431 L432	D426-G428 PolarHBondContact O-N 3.2Å; D426-G428 VanDerWaalsContact O-N 3.09Å; D426-G428 PolarHBondContact OD1-N 3.4Å; G428-F430 PolarHBondContact O-N 3.08Å; G428-F430 VanDerWaalsContact O-N 3.11Å; G428-V431 PolarHBondContact O-N 2.83Å; G428-V431 VanDerWaalsContact O-N 3.11Å; G428-L432 PolarHBondContact O-N 3.45Å; G428-L432 VanDerWaalsContact O-N 3.15Å
429	V	65.3	Low	64.7	Low	78 Å²	78	71 Å²	71	47%	0.473	40%	0.396	S	S	.	.	H	α-helix	trans	-55	-37.3	-172.3	179.5	0	0	0	0	112.7	L433	V429-L433 HydrophobicContact CG1-CD1 3.83Å; V429-L433 HydrophobicContact CG1-CG 4.22Å; V429-L433 VanDerWaalsContact O-CB 3.3Å; V429-L433 WeakPolarHBondContact O-CB 3.34Å; V429-L433 WeakPolarHBondContact O-CG 3.43Å; V429-L433 PolarHBondContact O-N 2.87Å
430	F	70.3	Confident	64.9	Low	181 Å²	181	63.1 Å²	63.1	79%	0.794	37%	0.37	S	S	*	.	H	α-helix	trans	-68.7	-38	-178.7	-68.8	-73.2	0	0	0	113.5	G428 A434	G428-F430 PolarHBondContact O-N 3.08Å; G428-F430 VanDerWaalsContact O-N 3.11Å; F430-A434 WeakPolarHBondContact O-CB 3.49Å; F430-A434 PolarHBondContact O-N 3.22Å
431	V	74.6	Confident	65.6	Low	31 Å²	31	58.9 Å²	58.9	19%	0.188	36%	0.355	C	S	.	.	H	α-helix	trans	-71.4	-44.6	177.5	178.2	0	0	0	0	109.6	W416 P427 G428 L433 A434 C435	W416-V431 HydrophobicContact CB-CG1 4.42Å; W416-V431 HydrophobicContact CD2-CG1 3.82Å; W416-V431 HydrophobicContact CE3-CG1 4.46Å; W416-V431 HydrophobicContact CG-CG1 3.76Å; W416-V431 HydrophobicContact CZ2-CG2 3.91Å; P427-V431 HydrophobicContact CB-CB 3.83Å; P427-V431 HydrophobicContact CB-CG1 3.81Å; P427-V431 WeakPolarHBondContact O-CB 3.39Å; P427-V431 WeakPolarHBondContact O-CG2 3.44Å; G428-V431 PolarHBondContact O-N 2.83Å; G428-V431 VanDerWaalsContact O-N 3.11Å; V431-L433 VanDerWaalsContact C-N 3.29Å; V431-L433 PolarHBondContact O-N 3.24Å; V431-A434 PolarHBondContact O-N 3.46Å; V431-A434 VanDerWaalsContact O-N 3.07Å; V431-C435 WeakPolarHBondContact O-CB 3.46Å; V431-C435 PolarHBondContact O-N 3.09Å; V431-C435 PolarHBondContact O-SG 2.87Å; V431-C435 VanDerWaalsContact O-SG 3.34Å
432	L	68.2	Low	66.8	Low	47 Å²	47	59.3 Å²	59.3	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-58.2	-42.6	175.4	-65.3	174.1	0	0	0	111.6	K413 P427 G428 G436	K413-L432 HydrophobicContact CD-CD2 4.22Å; P427-L432 HydrophobicContact CB-CD2 4.16Å; P427-L432 HydrophobicContact CB-CG 4.22Å; P427-L432 HydrophobicContact CG-CD2 4Å; P427-L432 HydrophobicContact CG-CG 4.48Å; G428-L432 PolarHBondContact O-N 3.45Å; G428-L432 VanDerWaalsContact O-N 3.15Å; L432-G436 PolarHBondContact O-N 2.93Å
433	L	68.8	Low	68.6	Low	74 Å²	74	53.6 Å²	53.6	39%	0.387	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-41.1	173.8	-74.9	173.6	0	0	0	112.3	V429 V431 T437 V502	V429-L433 HydrophobicContact CG1-CD1 3.83Å; V429-L433 HydrophobicContact CG1-CG 4.22Å; V429-L433 VanDerWaalsContact O-CB 3.3Å; V429-L433 WeakPolarHBondContact O-CB 3.34Å; V429-L433 WeakPolarHBondContact O-CG 3.43Å; V429-L433 PolarHBondContact O-N 2.87Å; V431-L433 VanDerWaalsContact C-N 3.29Å; V431-L433 PolarHBondContact O-N 3.24Å; L433-T437 VanDerWaalsContact O-CB 3.31Å; L433-T437 WeakPolarHBondContact O-CB 3.33Å; L433-T437 VanDerWaalsContact O-CG2 3.24Å; L433-T437 WeakPolarHBondContact O-CG2 3.49Å; L433-T437 PolarHBondContact O-N 3.07Å; L433-T437 PolarHBondContact O-OG1 3.35Å; L433-V502 HydrophobicContact CD2-CG1 3.9Å
434	A	76	Confident	70.7	Confident	50 Å²	50	47.6 Å²	47.6	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-45.2	177.8	0	0	0	0	0	111.9	F430 V431 T437 T438	F430-A434 WeakPolarHBondContact O-CB 3.49Å; F430-A434 PolarHBondContact O-N 3.22Å; V431-A434 PolarHBondContact O-N 3.46Å; V431-A434 VanDerWaalsContact O-N 3.07Å; A434-T437 PolarHBondContact O-OG1 2.61Å; A434-T437 VanDerWaalsContact O-OG1 3.14Å; A434-T438 VanDerWaalsContact O-CB 3.3Å; A434-T438 WeakPolarHBondContact O-CB 3.44Å; A434-T438 PolarHBondContact O-N 2.85Å; A434-T438 PolarHBondContact O-OG1 3.47Å
435	C	75	Confident	73	Confident	10 Å²	10	47.1 Å²	47.1	7%	0.068	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-51.3	174.2	-69	0	0	0	0	110.7	Y409 L412 V431 T438 S439	Y409-C435 HydrophobicContact CD2-CB 3.88Å; Y409-C435 HydrophobicContact CE2-CB 3.95Å; L412-C435 HydrophobicContact CB-CB 4.36Å; V431-C435 WeakPolarHBondContact O-CB 3.46Å; V431-C435 PolarHBondContact O-N 3.09Å; V431-C435 PolarHBondContact O-SG 2.87Å; V431-C435 VanDerWaalsContact O-SG 3.34Å; C435-T438 PolarHBondContact O-N 2.77Å; C435-S439 WeakPolarHBondContact O-CB 3.16Å; C435-S439 PolarHBondContact O-N 3.37Å; C435-S439 PolarHBondContact O-OG 2.78Å
436	G	72.1	Confident	75	Confident	13 Å²	13	48 Å²	48	13%	0.134	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-40.7	-179	0	0	0	0	0	113.6	L432 S439 S440	L432-G436 PolarHBondContact O-N 2.93Å; G436-S439 WeakPolarHBondContact CA-OG 3.44Å; G436-S439 PolarHBondContact O-OG 2.9Å; G436-S440 WeakPolarHBondContact O-CB 3.46Å; G436-S440 PolarHBondContact O-N 3.2Å; G436-S440 PolarHBondContact O-OG 2.86Å; G436-S440 VanDerWaalsContact O-OG 3.11Å
437	T	76	Confident	76.8	Confident	47 Å²	47	43.5 Å²	43.5	29%	0.288	26%	0.262	S	S	.	.	H	α-helix	trans	-68.4	-37.3	176.9	50.6	0	0	0	0	112.2	L433 A434 T441	L433-T437 VanDerWaalsContact O-CB 3.31Å; L433-T437 WeakPolarHBondContact O-CB 3.33Å; L433-T437 VanDerWaalsContact O-CG2 3.24Å; L433-T437 WeakPolarHBondContact O-CG2 3.49Å; L433-T437 PolarHBondContact O-N 3.07Å; L433-T437 PolarHBondContact O-OG1 3.35Å; A434-T437 PolarHBondContact O-OG1 2.61Å; A434-T437 VanDerWaalsContact O-OG1 3.14Å; T437-T441 VanDerWaalsContact O-CB 3.27Å; T437-T441 WeakPolarHBondContact O-CB 3.43Å; T437-T441 PolarHBondContact O-N 3.21Å; T437-T441 VanDerWaalsContact O-N 3.09Å; T437-T441 PolarHBondContact O-OG1 3.02Å
438	T	84.1	Confident	78.3	Confident	68 Å²	68	43.2 Å²	43.2	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-68.6	-47.5	176.9	-56.6	0	0	0	0	111	L412 A434 C435 T441 C442	L412-T438 HydrophobicContact CD1-CG2 3.79Å; A434-T438 VanDerWaalsContact O-CB 3.3Å; A434-T438 WeakPolarHBondContact O-CB 3.44Å; A434-T438 PolarHBondContact O-N 2.85Å; A434-T438 PolarHBondContact O-OG1 3.47Å; C435-T438 PolarHBondContact O-N 2.77Å; T438-T441 WeakPolarHBondContact O-CB 3.47Å; T438-T441 PolarHBondContact O-N 3.14Å; T438-C442 PolarHBondContact O-N 3.03Å; T438-C442 PolarHBondContact O-SG 3Å; T438-C442 VanDerWaalsContact O-SG 3.41Å
439	S	80.3	Confident	80	Confident	1 Å²	1	43 Å²	43	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-46.3	178.8	69	0	0	0	0	112.2	D405 C435 G436 T441 C442 G443	D405-S439 VanDerWaalsContact O-CB 3.24Å; D405-S439 WeakPolarHBondContact O-CB 3.31Å; D405-S439 VanDerWaalsContact OD1-CB 3.26Å; D405-S439 WeakPolarHBondContact OD1-CB 3.05Å; D405-S439 PolarHBondContact OD1-OG 2.83Å; C435-S439 WeakPolarHBondContact O-CB 3.16Å; C435-S439 PolarHBondContact O-N 3.37Å; C435-S439 PolarHBondContact O-OG 2.78Å; G436-S439 WeakPolarHBondContact CA-OG 3.44Å; G436-S439 PolarHBondContact O-OG 2.9Å; S439-T441 PolarHBondContact O-N 3.45Å; S439-C442 WeakPolarHBondContact O-CB 3.41Å; S439-C442 PolarHBondContact O-N 3.43Å; S439-C442 VanDerWaalsContact O-N 3.13Å; S439-G443 PolarHBondContact O-N 3.47Å
440	S	78.4	Confident	81.3	Confident	27 Å²	27	41.2 Å²	41.2	19%	0.189	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-30.9	178.7	-75.6	0	0	0	0	111.8	Y401 D405 G436 Q444	Y401-S440 PolarHBondContact OH-OG 3.21Å; D405-S440 VanDerWaalsContact OD1-CA 3.22Å; D405-S440 WeakPolarHBondContact OD1-CA 3.1Å; D405-S440 PolarHBondContact OD1-N 3.19Å; D405-S440 PolarHBondContact OD1-OG 3.07Å; D405-S440 VanDerWaalsContact OD1-OG 3.13Å; D405-S440 PolarHBondContact OD2-OG 2.84Å; G436-S440 WeakPolarHBondContact O-CB 3.46Å; G436-S440 PolarHBondContact O-N 3.2Å; G436-S440 PolarHBondContact O-OG 2.86Å; G436-S440 VanDerWaalsContact O-OG 3.11Å; S440-Q444 VanDerWaalsContact O-CB 3.26Å; S440-Q444 WeakPolarHBondContact O-CB 3.37Å; S440-Q444 VanDerWaalsContact O-CG 3.3Å; S440-Q444 WeakPolarHBondContact O-CG 3.46Å; S440-Q444 PolarHBondContact O-N 3.06Å; S440-Q444 PolarHBondContact O-NE2 2.87Å; S440-Q444 VanDerWaalsContact O-NE2 3.14Å
441	T	84.1	Confident	82.2	Confident	40 Å²	40	33.6 Å²	33.6	25%	0.245	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-46.3	173.9	-67	0	0	0	0	111.2	T437 T438 S439 Q444 L445 F495	T437-T441 VanDerWaalsContact O-CB 3.27Å; T437-T441 WeakPolarHBondContact O-CB 3.43Å; T437-T441 PolarHBondContact O-N 3.21Å; T437-T441 VanDerWaalsContact O-N 3.09Å; T437-T441 PolarHBondContact O-OG1 3.02Å; T438-T441 WeakPolarHBondContact O-CB 3.47Å; T438-T441 PolarHBondContact O-N 3.14Å; S439-T441 PolarHBondContact O-N 3.45Å; T441-Q444 PolarHBondContact O-N 2.96Å; T441-L445 HydrophobicContact CG2-CD1 4.28Å; T441-L445 WeakPolarHBondContact O-CG 3.49Å; T441-L445 PolarHBondContact O-N 3.4Å; T441-F495 HydrophobicContact CG2-CD1 4.4Å; T441-F495 HydrophobicContact CG2-CE1 3.59Å; T441-F495 HydrophobicContact CG2-CZ 3.73Å
442	C	86.2	Confident	83.1	Confident	47 Å²	47	32.1 Å²	32.1	32%	0.318	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-46.8	175.4	-69	0	0	0	0	111.9	I404 V408 T438 S439 Q444 L445 A446	I404-C442 HydrophobicContact CG2-CB 4.03Å; V408-C442 HydrophobicContact CG2-CB 4.23Å; T438-C442 PolarHBondContact O-N 3.03Å; T438-C442 PolarHBondContact O-SG 3Å; T438-C442 VanDerWaalsContact O-SG 3.41Å; S439-C442 WeakPolarHBondContact O-CB 3.41Å; S439-C442 PolarHBondContact O-N 3.43Å; S439-C442 VanDerWaalsContact O-N 3.13Å; C442-Q444 VanDerWaalsContact C-N 3.31Å; C442-Q444 PolarHBondContact O-N 3.37Å; C442-L445 PolarHBondContact O-N 2.95Å; C442-A446 PolarHBondContact O-N 2.87Å; C442-A446 VanDerWaalsContact O-N 3.08Å
443	G	83.4	Confident	84.3	Confident	0 Å²	0	30 Å²	30	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-40.1	175.6	0	0	0	0	0	112.3	Y401 S439 S447	Y401-G443 VanDerWaalsContact CD2-C 3.41Å; S439-G443 PolarHBondContact O-N 3.47Å; G443-S447 WeakPolarHBondContact O-CB 3.47Å; G443-S447 PolarHBondContact O-N 3.28Å; G443-S447 VanDerWaalsContact O-N 3.1Å; G443-S447 PolarHBondContact O-OG 3.33Å
444	Q	83.9	Confident	85.4	Confident	37 Å²	37	29 Å²	29	17%	0.173	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-43.2	174.8	-87.5	166.7	70.5	0	0	112	Y401 S440 T441 C442 S447 Y448 N494	Y401-Q444 HydrophobicContact CD2-CG 4.24Å; Y401-Q444 HydrophobicContact CE2-CG 3.8Å; S440-Q444 VanDerWaalsContact O-CB 3.26Å; S440-Q444 WeakPolarHBondContact O-CB 3.37Å; S440-Q444 VanDerWaalsContact O-CG 3.3Å; S440-Q444 WeakPolarHBondContact O-CG 3.46Å; S440-Q444 PolarHBondContact O-N 3.06Å; S440-Q444 PolarHBondContact O-NE2 2.87Å; S440-Q444 VanDerWaalsContact O-NE2 3.14Å; T441-Q444 PolarHBondContact O-N 2.96Å; C442-Q444 VanDerWaalsContact C-N 3.31Å; C442-Q444 PolarHBondContact O-N 3.37Å; Q444-S447 PolarHBondContact O-N 3.09Å; Q444-Y448 WeakPolarHBondContact O-CA 3.47Å; Q444-Y448 WeakPolarHBondContact O-CB 3.28Å; Q444-Y448 PolarHBondContact O-N 3.15Å; Q444-N494 PolarHBondContact OE1-ND2 2.61Å
445	L	90.1	Very high	86.1	Confident	65 Å²	65	26.8 Å²	26.8	34%	0.34	16%	0.164	S	C	.	.	H	α-helix	trans	-60.5	-46.8	178.5	-74	170.2	0	0	0	111.2	T441 C442 S447 Y448 Y488 L491 F495	T441-L445 HydrophobicContact CG2-CD1 4.28Å; T441-L445 WeakPolarHBondContact O-CG 3.49Å; T441-L445 PolarHBondContact O-N 3.4Å; C442-L445 PolarHBondContact O-N 2.95Å; L445-S447 PolarHBondContact O-N 3Å; L445-Y448 PolarHBondContact O-N 3.3Å; L445-Y488 WeakPolarHBondContact O-CE1 3.3Å; L445-L491 HydrophobicContact CD2-CD1 4.16Å; L445-L491 HydrophobicContact CD2-CD2 3.72Å; L445-F495 HydrophobicContact CD2-CE2 4.13Å; L445-F495 HydrophobicContact CD2-CZ 3.8Å; L445-F495 HydrophobicContact CG-CZ 4.01Å
446	A	89.9	Confident	86.9	Confident	50 Å²	50	27.7 Å²	27.7	41%	0.413	17%	0.166	S	C	.	.	H	α-helix	trans	-65.1	-40.8	-179.4	0	0	0	0	0	113.2	I404 C442	I404-A446 HydrophobicContact CD1-CB 3.23Å; C442-A446 PolarHBondContact O-N 2.87Å; C442-A446 VanDerWaalsContact O-N 3.08Å
447	S	89.4	Confident	87.9	Confident	13 Å²	13	28.2 Å²	28.2	9%	0.091	17%	0.166	C	C	.	.	H	α-helix	trans	-88.5	-6.9	-179	61.4	0	0	0	0	114.1	G397 G443 Q444 L445 P449 L450 A451	G397-S447 WeakPolarHBondContact O-CB 3.23Å; G443-S447 WeakPolarHBondContact O-CB 3.47Å; G443-S447 PolarHBondContact O-N 3.28Å; G443-S447 VanDerWaalsContact O-N 3.1Å; G443-S447 PolarHBondContact O-OG 3.33Å; Q444-S447 PolarHBondContact O-N 3.09Å; L445-S447 PolarHBondContact O-N 3Å; S447-P449 VanDerWaalsContact C-CD 3.48Å; S447-L450 PolarHBondContact O-N 3.15Å; S447-L450 VanDerWaalsContact O-N 3.14Å; S447-A451 PolarHBondContact O-N 3.11Å; S447-A451 VanDerWaalsContact O-N 3.11Å
448	Y	90.4	Very high	88.6	Confident	4 Å²	4	26 Å²	26	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-56.8	-41.3	-174.1	-155.6	-90.2	0	0	0	114.5	Q267 Q444 L445 L450 A451 L452 L487 Y488 R489 G490 L491 N494	Q267-Y448 PolarHBondContact NE2-OH 3.42Å; Q444-Y448 WeakPolarHBondContact O-CA 3.47Å; Q444-Y448 WeakPolarHBondContact O-CB 3.28Å; Q444-Y448 PolarHBondContact O-N 3.15Å; L445-Y448 PolarHBondContact O-N 3.3Å; Y448-L450 VanDerWaalsContact C-N 3.28Å; Y448-L450 PolarHBondContact O-N 3.36Å; Y448-A451 CarbonylContact O-C 3.44Å; Y448-A451 WeakPolarHBondContact O-CA 3.49Å; Y448-A451 WeakPolarHBondContact O-CB 3.21Å; Y448-A451 PolarHBondContact O-N 2.94Å; Y448-L452 PolarHBondContact O-N 3.27Å; Y448-L487 VanDerWaalsContact CD1-O 3.24Å; Y448-L487 WeakPolarHBondContact CD1-O 3.34Å; Y448-Y488 HydrophobicContact CD1-CD1 4.01Å; Y448-Y488 HydrophobicContact CD1-CG 4.44Å; Y448-Y488 HydrophobicContact CG-CD1 4.22Å; Y448-R489 VanDerWaalsContact CE1-O 3.27Å; Y448-R489 WeakPolarHBondContact CE1-O 3.36Å; Y448-R489 PolarHBondContact OH-O 2.86Å; Y448-G490 WeakPolarHBondContact OH-CA 3.48Å; Y448-G490 PolarHBondContact OH-O 2.78Å; Y448-L491 HydrophobicContact CD2-CD1 3.46Å; Y448-L491 VanDerWaalsContact CD2-CD1 3.46Å; Y448-L491 HydrophobicContact CE1-CB 4.4Å; Y448-L491 HydrophobicContact CE2-CB 4.28Å; Y448-L491 HydrophobicContact CE2-CD1 3.55Å; Y448-L491 HydrophobicContact CG-CD1 3.99Å; Y448-L491 PolarHBondContact OH-N 3.26Å; Y448-L491 VanDerWaalsContact OH-N 3.1Å; Y448-N494 HydrophobicContact CE2-CB 4.45Å
449	P	94.4	Very high	88.7	Confident	20 Å²	20	22.8 Å²	22.8	13%	0.13	13%	0.132	C	C	.	.	H	α-helix	trans	-55.7	-41.7	177.2	-29.3	38.2	0	0	0	113.3	S447 L452 V453 F475 L487 Y488	S447-P449 VanDerWaalsContact C-CD 3.48Å; P449-L452 PolarHBondContact O-N 3.1Å; P449-V453 WeakPolarHBondContact O-CG2 3.39Å; P449-V453 PolarHBondContact O-N 2.89Å; P449-V453 VanDerWaalsContact O-N 3.07Å; P449-F475 HydrophobicContact CB-CE2 4.32Å; P449-L487 HydrophobicContact CB-CB 4.04Å; P449-L487 HydrophobicContact CB-CD1 4.18Å; P449-L487 HydrophobicContact CB-CD2 4.3Å; P449-L487 HydrophobicContact CB-CG 4.4Å; P449-L487 HydrophobicContact CG-CB 4.25Å; P449-Y488 HydrophobicContact CG-CE1 4.41Å; P449-Y488 HydrophobicContact CG-CE2 4.26Å
450	L	92.3	Very high	88.3	Confident	40 Å²	40	24 Å²	24	21%	0.209	14%	0.138	C	C	.	.	H	α-helix	trans	-70.8	-37.2	176.7	-67.9	173.1	0	0	0	111.2	P393 L396 S447 Y448 L452 V453 R454	P393-L450 HydrophobicContact CB-CD2 4.28Å; L396-L450 HydrophobicContact CB-CD1 3.94Å; S447-L450 PolarHBondContact O-N 3.15Å; S447-L450 VanDerWaalsContact O-N 3.14Å; Y448-L450 VanDerWaalsContact C-N 3.28Å; Y448-L450 PolarHBondContact O-N 3.36Å; L450-L452 VanDerWaalsContact C-N 3.33Å; L450-L452 PolarHBondContact O-N 3.47Å; L450-V453 PolarHBondContact O-N 3.3Å; L450-R454 VanDerWaalsContact O-CB 3.32Å; L450-R454 WeakPolarHBondContact O-CB 3.23Å; L450-R454 PolarHBondContact O-N 2.87Å
451	A	89.5	Confident	87.6	Confident	22 Å²	22	24.3 Å²	24.3	18%	0.182	14%	0.142	C	C	.	.	H	α-helix	trans	-61.8	-39.5	173.8	0	0	0	0	0	112.3	S447 Y448 T455	S447-A451 PolarHBondContact O-N 3.11Å; S447-A451 VanDerWaalsContact O-N 3.11Å; Y448-A451 CarbonylContact O-C 3.44Å; Y448-A451 WeakPolarHBondContact O-CA 3.49Å; Y448-A451 WeakPolarHBondContact O-CB 3.21Å; Y448-A451 PolarHBondContact O-N 2.94Å; A451-T455 PolarHBondContact O-N 3.42Å; A451-T455 VanDerWaalsContact O-N 3.12Å; A451-T455 PolarHBondContact O-OG1 3.32Å; A451-T455 VanDerWaalsContact O-OG1 3.09Å
452	L	92.3	Very high	86.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-49.8	174.7	-176.2	79.9	0	0	0	111.4	Q267 Y448 P449 L450 R454 T455 R456 I478 G486 L487 R489	Q267-L452 HydrophobicContact CB-CD1 3.57Å; Q267-L452 HydrophobicContact CG-CD1 3.54Å; Q267-L452 WeakPolarHBondContact O-CD1 3.23Å; Y448-L452 PolarHBondContact O-N 3.27Å; P449-L452 PolarHBondContact O-N 3.1Å; L450-L452 VanDerWaalsContact C-N 3.33Å; L450-L452 PolarHBondContact O-N 3.47Å; L452-R454 VanDerWaalsContact C-N 3.27Å; L452-R454 PolarHBondContact O-N 2.73Å; L452-T455 PolarHBondContact O-N 3.05Å; L452-T455 VanDerWaalsContact O-N 3.17Å; L452-R456 PolarHBondContact O-N 3.43Å; L452-I478 HydrophobicContact CD2-CD1 4.32Å; L452-G486 WeakPolarHBondContact CD2-O 3.34Å; L452-L487 WeakPolarHBondContact CB-O 3.18Å; L452-L487 VanDerWaalsContact CD2-CA 3.46Å; L452-L487 HydrophobicContact CD2-CD2 4.42Å; L452-L487 WeakPolarHBondContact CD2-O 3.22Å; L452-R489 HydrophobicContact CD1-CB 4.38Å
453	V	93.6	Very high	85	Confident	1 Å²	1	26 Å²	26	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-57.8	-44.1	179.3	171.1	0	0	0	0	110.3	P393 P449 L450 T455 R456 M457 M471 L474 F475 I478 L487	P393-V453 HydrophobicContact CB-CG1 4.25Å; P393-V453 HydrophobicContact CG-CG1 4.27Å; P449-V453 WeakPolarHBondContact O-CG2 3.39Å; P449-V453 PolarHBondContact O-N 2.89Å; P449-V453 VanDerWaalsContact O-N 3.07Å; L450-V453 PolarHBondContact O-N 3.3Å; V453-T455 PolarHBondContact O-N 3.42Å; V453-R456 PolarHBondContact O-N 3.3Å; V453-M457 HydrophobicContact CG1-CG 4.33Å; V453-M457 HydrophobicContact CG1-SD 4.05Å; V453-M457 VanDerWaalsContact O-CG 3.31Å; V453-M457 WeakPolarHBondContact O-CG 3.45Å; V453-M457 PolarHBondContact O-N 3.5Å; V453-M471 HydrophobicContact CG1-CG 3.72Å; V453-L474 HydrophobicContact CG1-CD2 4.3Å; V453-F475 HydrophobicContact CG2-CB 4.27Å; V453-F475 HydrophobicContact CG2-CD2 3.97Å; V453-I478 HydrophobicContact CG2-CD1 4.22Å; V453-L487 HydrophobicContact CG2-CD2 4.46Å
454	R	92.6	Very high	83.5	Confident	54 Å²	54	32.3 Å²	32.3	20%	0.204	18%	0.179	C	C	.	.	H	α-helix	trans	-52.8	-56.1	172.8	178.1	-171.7	73.5	159.6	4.8	111.4	P393 N394 L450 L452 R456 M457 Q458	P393-R454 HydrophobicContact CB-CB 4.38Å; P393-R454 HydrophobicContact CG-CB 4.2Å; N394-R454 HydrophobicContact CB-CG 4.23Å; N394-R454 WeakPolarHBondContact OD1-CD 3.41Å; N394-R454 PolarHBondContact OD1-NH1 3.26Å; L450-R454 VanDerWaalsContact O-CB 3.32Å; L450-R454 WeakPolarHBondContact O-CB 3.23Å; L450-R454 PolarHBondContact O-N 2.87Å; L452-R454 VanDerWaalsContact C-N 3.27Å; L452-R454 PolarHBondContact O-N 2.73Å; R454-R456 VanDerWaalsContact C-N 3.32Å; R454-R456 PolarHBondContact O-N 2.94Å; R454-M457 PolarHBondContact O-N 3.06Å; R454-Q458 WeakPolarHBondContact O-CG 3.49Å; R454-Q458 PolarHBondContact O-N 2.96Å
455	T	91.3	Very high	81.9	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-40.2	-177.5	-54.8	0	0	0	0	111.9	V264 Q267 V268 T358 A451 L452 V453 Q458 A459	V264-T455 HydrophobicContact CG1-CG2 4.08Å; Q267-T455 HydrophobicContact CB-CG2 4.16Å; Q267-T455 VanDerWaalsContact OE1-CB 3.26Å; Q267-T455 VanDerWaalsContact OE1-CG2 3.31Å; Q267-T455 PolarHBondContact OE1-OG1 2.61Å; V268-T455 HydrophobicContact CG2-CG2 3.87Å; T358-T455 HydrophobicContact CG2-CG2 4.08Å; A451-T455 PolarHBondContact O-N 3.42Å; A451-T455 VanDerWaalsContact O-N 3.12Å; A451-T455 PolarHBondContact O-OG1 3.32Å; A451-T455 VanDerWaalsContact O-OG1 3.09Å; L452-T455 PolarHBondContact O-N 3.05Å; L452-T455 VanDerWaalsContact O-N 3.17Å; V453-T455 PolarHBondContact O-N 3.42Å; T455-Q458 PolarHBondContact O-N 2.96Å; T455-A459 WeakPolarHBondContact O-CB 3.46Å; T455-A459 PolarHBondContact O-N 3.41Å; T455-A459 VanDerWaalsContact O-N 3.07Å
456	R	91.8	Very high	80.4	Confident	29 Å²	29	34.8 Å²	34.8	11%	0.109	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-40.7	177.3	-74.2	-168.3	178.1	-165	10.3	112.6	Q267 V268 L452 V453 R454 Q458 A459 Q460 L474 E482	Q267-R456 PolarHBondContact O-NE 3.19Å; V268-R456 HydrophobicContact CG2-CG 4.49Å; L452-R456 PolarHBondContact O-N 3.43Å; V453-R456 PolarHBondContact O-N 3.3Å; R454-R456 VanDerWaalsContact C-N 3.32Å; R454-R456 PolarHBondContact O-N 2.94Å; R456-Q458 VanDerWaalsContact C-N 3.33Å; R456-Q458 PolarHBondContact O-N 3.43Å; R456-A459 CarbonylContact O-C 3.58Å; R456-A459 PolarHBondContact O-N 3.11Å; R456-A459 VanDerWaalsContact O-N 3.08Å; R456-Q460 WeakPolarHBondContact O-CG 3.43Å; R456-Q460 PolarHBondContact O-N 2.93Å; R456-L474 HydrophobicContact CB-CD2 3.85Å; R456-E482 IonicContact CZ-OE1 2.55Å; R456-E482 IonicContact CZ-OE2 3.48Å; R456-E482 IonicContact NH1-OE1 3.06Å; R456-E482 PolarHBondContact NH1-OE1 3.25Å; R456-E482 IonicContact NH1-OE2 2.78Å; R456-E482 VanDerWaalsContact NH2-CD 3.35Å; R456-E482 IonicContact NH2-OE1 3.42Å; R456-E482 PolarHBondContact NH2-OE1 2.99Å; R456-E482 IonicContact NH2-OE2 3.44Å; R456-E482 PolarHBondContact NH2-OE2 3.15Å
457	M	91.3	Very high	79.2	Confident	24 Å²	24	38 Å²	38	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-41.4	174.2	-71.2	-175.9	76.5	0	0	111.8	P393 V453 R454 A459 Q460 M471 L474	P393-M457 HydrophobicContact CG-SD 3.9Å; V453-M457 HydrophobicContact CG1-CG 4.33Å; V453-M457 HydrophobicContact CG1-SD 4.05Å; V453-M457 VanDerWaalsContact O-CG 3.31Å; V453-M457 WeakPolarHBondContact O-CG 3.45Å; V453-M457 PolarHBondContact O-N 3.5Å; R454-M457 PolarHBondContact O-N 3.06Å; M457-A459 PolarHBondContact O-N 3.08Å; M457-Q460 PolarHBondContact O-N 3.12Å; M457-M471 HydrophobicContact CE-CB 4.37Å; M457-M471 HydrophobicContact SD-CB 3.9Å; M457-M471 HydrophobicContact SD-CG 4.23Å; M457-L474 HydrophobicContact CG-CD2 3.54Å
458	Q	90.6	Very high	78.5	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-63.9	-25.2	174.3	-69.6	179.1	-12.3	0	0	112.7	Y351 V355 T358 R359 K389 R454 T455 R456	Y351-Q458 PolarHBondContact OH-NE2 3.25Å; V355-Q458 HydrophobicContact CG2-CG 4.15Å; T358-Q458 HydrophobicContact CG2-CB 3.77Å; T358-Q458 PolarHBondContact OG1-OE1 2.96Å; R359-Q458 PolarHBondContact NE-O 3.42Å; R359-Q458 PolarHBondContact NH1-O 3.03Å; R359-Q458 VanDerWaalsContact NH1-O 3.08Å; R359-Q458 PolarHBondContact NH2-O 3.46Å; K389-Q458 WeakPolarHBondContact O-CG 3.49Å; R454-Q458 WeakPolarHBondContact O-CG 3.49Å; R454-Q458 PolarHBondContact O-N 2.96Å; T455-Q458 PolarHBondContact O-N 2.96Å; R456-Q458 VanDerWaalsContact C-N 3.33Å; R456-Q458 PolarHBondContact O-N 3.43Å
459	A	86.4	Confident	78.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-91.9	-17.5	179.8	0	0	0	0	0	114.7	V268 R359 L362 T455 R456 M457 A461 S462 L463	V268-A459 HydrophobicContact CB-CB 4.48Å; V268-A459 HydrophobicContact CG1-CB 3.8Å; V268-A459 HydrophobicContact CG2-CB 3.76Å; R359-A459 PolarHBondContact NH1-O 2.95Å; L362-A459 HydrophobicContact CD1-CB 3.4Å; T455-A459 WeakPolarHBondContact O-CB 3.46Å; T455-A459 PolarHBondContact O-N 3.41Å; T455-A459 VanDerWaalsContact O-N 3.07Å; R456-A459 CarbonylContact O-C 3.58Å; R456-A459 PolarHBondContact O-N 3.11Å; R456-A459 VanDerWaalsContact O-N 3.08Å; M457-A459 PolarHBondContact O-N 3.08Å; A459-A461 PolarHBondContact O-N 3.41Å; A459-A461 VanDerWaalsContact O-N 3.16Å; A459-S462 WeakPolarHBondContact O-CB 3.29Å; A459-S462 PolarHBondContact O-N 3.26Å; A459-L463 HydrophobicContact CB-CD1 4.21Å
460	Q	73.6	Confident	77.8	Confident	26 Å²	26	46.3 Å²	46.3	12%	0.121	28%	0.278	C	S	.	.	H	α-helix	trans	-50.6	-47.3	-165.5	-94.5	171.7	-31	0	0	115	R456 M457 S462 L463 Q464	R456-Q460 WeakPolarHBondContact O-CG 3.43Å; R456-Q460 PolarHBondContact O-N 2.93Å; M457-Q460 PolarHBondContact O-N 3.12Å; Q460-S462 VanDerWaalsContact C-N 3.27Å; Q460-S462 PolarHBondContact O-N 3.26Å; Q460-L463 PolarHBondContact O-N 2.67Å; Q460-Q464 PolarHBondContact O-N 2.96Å
461	A	63	Low	77.7	Confident	34 Å²	34	47 Å²	47	28%	0.281	28%	0.281	S	S	.	.	H	α-helix	trans	-74.9	-8.8	-178.3	0	0	0	0	0	115.8	R359 E382 A459 L463	R359-A461 VanDerWaalsContact NH2-CB 3.26Å; E382-A461 HydrophobicContact CG-CB 3.92Å; E382-A461 WeakPolarHBondContact OE1-CB 3.32Å; E382-A461 WeakPolarHBondContact OE2-CB 3.19Å; A459-A461 PolarHBondContact O-N 3.41Å; A459-A461 VanDerWaalsContact O-N 3.16Å; A461-L463 VanDerWaalsContact C-N 3.34Å
462	S	58.3	Low	77.9	Confident	39 Å²	39	48.6 Å²	48.6	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-83.7	-14.9	174.9	-59.9	0	0	0	0	111.9	R359 A459 Q460	R359-S462 VanDerWaalsContact CD-OG 3.23Å; R359-S462 WeakPolarHBondContact CD-OG 3.19Å; R359-S462 PolarHBondContact NH1-OG 3.08Å; A459-S462 WeakPolarHBondContact O-CB 3.29Å; A459-S462 PolarHBondContact O-N 3.26Å; Q460-S462 VanDerWaalsContact C-N 3.27Å; Q460-S462 PolarHBondContact O-N 3.26Å
463	L	57.4	Low	77.8	Confident	82 Å²	82	50 Å²	50	43%	0.429	30%	0.303	S	S	.	.	H	α-helix	trans	-120.2	-29.1	-166.6	-64.3	165.5	0	0	0	114.4	V268 H269 A459 Q460 A461	V268-L463 HydrophobicContact CG1-CD1 3.17Å; V268-L463 HydrophobicContact CG1-CG 4.46Å; H269-L463 VanDerWaalsContact NE2-CD2 3.31Å; H269-L463 WeakPolarHBondContact NE2-CD2 3.47Å; A459-L463 HydrophobicContact CB-CD1 4.21Å; Q460-L463 PolarHBondContact O-N 2.67Å; A461-L463 VanDerWaalsContact C-N 3.34Å
464	Q	51.1	Low	77.7	Confident	134 Å²	134	50.5 Å²	50.5	63%	0.626	31%	0.305	S	S	*	.			trans	-137	129.7	-175	-69.6	-176.8	-10.1	0	0	111.6	Q460 G466	Q460-Q464 PolarHBondContact O-N 2.96Å; Q464-G466 PolarHBondContact O-N 3.35Å; Q464-G466 VanDerWaalsContact O-N 3.14Å
465	A	51.9	Low	77.8	Confident	122 Å²	122	51.7 Å²	51.7	100%	1.008	31%	0.312	S	S	*	.	S	Bend	trans	-74.8	20.3	164.8	0	0	0	0	0	112.5
466	G	58.3	Low	77.9	Confident	31 Å²	31	58.2 Å²	58.2	32%	0.32	34%	0.336	S	S	.	.	S	Bend	trans	-100	175.3	-176.1	0	0	0	0	0	113.6	Q464 Q468	Q464-G466 PolarHBondContact O-N 3.35Å; Q464-G466 VanDerWaalsContact O-N 3.14Å; G466-Q468 PolarHBondContact O-N 2.68Å
467	P	64.8	Low	77.9	Confident	118 Å²	118	60.7 Å²	60.7	77%	0.766	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-58.4	135.2	179.7	-19.8	30.6	0	0	0	111.7	L469	P467-L469 PolarHBondContact O-N 3.37Å
468	Q	73.8	Confident	77.8	Confident	92 Å²	92	59.6 Å²	59.6	43%	0.43	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-67.1	116.1	175.7	-61.1	-67.4	-51.9	0	0	109.2	K389 G466	K389-Q468 VanDerWaalsContact NZ-CD 3.28Å; G466-Q468 PolarHBondContact O-N 2.68Å
469	L	82.3	Confident	77.9	Confident	55 Å²	55	62 Å²	62	29%	0.288	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-79.5	139.5	-179.7	-58.8	169.6	0	0	0	110.6	P467 A473 L474 L477	P467-L469 PolarHBondContact O-N 3.37Å; L469-A473 HydrophobicContact CB-CB 4.23Å; L469-A473 HydrophobicContact CD2-CB 4.39Å; L469-L474 HydrophobicContact CB-CB 4.37Å; L469-L474 HydrophobicContact CD1-CD1 4.31Å; L469-L477 HydrophobicContact CD1-CD2 3.57Å
470	S	88.5	Confident	78.2	Confident	64 Å²	64	72 Å²	72	45%	0.448	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-64.4	162.1	168.8	70.5	0	0	0	0	111.6	S472 A473 L474	S470-S472 VanDerWaalsContact C-N 3.31Å; S470-S472 PolarHBondContact O-N 2.98Å; S470-S472 PolarHBondContact OG-OG 3.16Å; S470-A473 PolarHBondContact O-N 2.74Å; S470-A473 WeakPolarHBondContact OG-CB 3.34Å; S470-A473 PolarHBondContact OG-N 3.34Å; S470-L474 WeakPolarHBondContact O-CB 3.17Å; S470-L474 PolarHBondContact O-N 2.86Å
471	M	90.5	Very high	78.9	Confident	55 Å²	55	74.1 Å²	74.1	27%	0.271	41%	0.413	S	S	.	.	H	α-helix	trans	-52.8	-47.6	178.4	-175.5	-162.2	80.9	0	0	112.2	V392 P393 L396 V453 M457 L474 F475	V392-M471 HydrophobicContact CG1-SD 4.12Å; P393-M471 HydrophobicContact CB-CG 4.14Å; P393-M471 HydrophobicContact CB-SD 3.84Å; P393-M471 HydrophobicContact CG-CG 4.11Å; P393-M471 HydrophobicContact CG-SD 4.18Å; L396-M471 HydrophobicContact CD1-CE 4.38Å; L396-M471 HydrophobicContact CD1-SD 4.28Å; V453-M471 HydrophobicContact CG1-CG 3.72Å; M457-M471 HydrophobicContact CE-CB 4.37Å; M457-M471 HydrophobicContact SD-CB 3.9Å; M457-M471 HydrophobicContact SD-CG 4.23Å; M471-L474 PolarHBondContact O-N 2.96Å; M471-F475 WeakPolarHBondContact O-CB 3.19Å; M471-F475 PolarHBondContact O-N 3.35Å
472	S	92	Very high	80.1	Confident	56 Å²	56	73.4 Å²	73.4	39%	0.392	40%	0.404	S	S	.	.	H	α-helix	trans	-71	-34.6	-178.4	60.5	0	0	0	0	112.6	S470 R476	S470-S472 VanDerWaalsContact C-N 3.31Å; S470-S472 PolarHBondContact O-N 2.98Å; S470-S472 PolarHBondContact OG-OG 3.16Å; S472-R476 WeakPolarHBondContact O-CB 3.38Å; S472-R476 VanDerWaalsContact O-CG 3.31Å; S472-R476 WeakPolarHBondContact O-CG 3.38Å; S472-R476 PolarHBondContact O-N 3.09Å; S472-R476 VanDerWaalsContact O-N 3.09Å; S472-R476 PolarHBondContact O-NE 2.74Å
473	A	91.9	Very high	81.6	Confident	29 Å²	29	72.2 Å²	72.2	24%	0.24	40%	0.398	C	S	.	.	H	α-helix	trans	-65.9	-45.1	173.1	0	0	0	0	0	111	L469 S470 R476 L477	L469-A473 HydrophobicContact CB-CB 4.23Å; L469-A473 HydrophobicContact CD2-CB 4.39Å; S470-A473 PolarHBondContact O-N 2.74Å; S470-A473 WeakPolarHBondContact OG-CB 3.34Å; S470-A473 PolarHBondContact OG-N 3.34Å; A473-R476 PolarHBondContact O-N 3.36Å; A473-L477 VanDerWaalsContact O-CB 3.29Å; A473-L477 WeakPolarHBondContact O-CB 3.49Å; A473-L477 PolarHBondContact O-N 3.15Å
474	L	91.3	Very high	83.1	Confident	11 Å²	11	72.5 Å²	72.5	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-64.9	-44.9	178.2	-176.8	60.8	0	0	0	112	V453 R456 M457 L469 S470 M471 R476 L477 I478	V453-L474 HydrophobicContact CG1-CD2 4.3Å; R456-L474 HydrophobicContact CB-CD2 3.85Å; M457-L474 HydrophobicContact CG-CD2 3.54Å; L469-L474 HydrophobicContact CB-CB 4.37Å; L469-L474 HydrophobicContact CD1-CD1 4.31Å; S470-L474 WeakPolarHBondContact O-CB 3.17Å; S470-L474 PolarHBondContact O-N 2.86Å; M471-L474 PolarHBondContact O-N 2.96Å; L474-R476 PolarHBondContact O-N 3.14Å; L474-L477 PolarHBondContact O-N 3.41Å; L474-I478 HydrophobicContact CD1-CD1 4.31Å; L474-I478 HydrophobicContact CD1-CG1 4.43Å; L474-I478 HydrophobicContact CG-CD1 4.07Å; L474-I478 VanDerWaalsContact O-CG1 3.24Å; L474-I478 WeakPolarHBondContact O-CG1 3.25Å; L474-I478 PolarHBondContact O-N 2.89Å
475	F	93.5	Very high	85	Confident	79 Å²	79	73 Å²	73	35%	0.346	41%	0.411	S	S	.	.	H	α-helix	trans	-57.7	-49.6	175.8	-177.8	-87.9	0	0	0	111.4	P449 V453 M471 L477 I478 V479 L487	P449-F475 HydrophobicContact CB-CE2 4.32Å; V453-F475 HydrophobicContact CG2-CB 4.27Å; V453-F475 HydrophobicContact CG2-CD2 3.97Å; M471-F475 WeakPolarHBondContact O-CB 3.19Å; M471-F475 PolarHBondContact O-N 3.35Å; F475-L477 VanDerWaalsContact C-N 3.33Å; F475-L477 PolarHBondContact O-N 2.93Å; F475-I478 PolarHBondContact O-N 2.83Å; F475-V479 HydrophobicContact CD1-CG2 4.28Å; F475-V479 HydrophobicContact CE1-CG2 3.94Å; F475-V479 HydrophobicContact CZ-CG2 4.24Å; F475-V479 WeakPolarHBondContact O-CG2 3.45Å; F475-V479 PolarHBondContact O-N 3.47Å; F475-L487 HydrophobicContact CD2-CD1 4.46Å; F475-L487 HydrophobicContact CD2-CD2 3.88Å; F475-L487 HydrophobicContact CE2-CD1 3.63Å; F475-L487 HydrophobicContact CE2-CD2 3.82Å; F475-L487 HydrophobicContact CE2-CG 4.4Å; F475-L487 HydrophobicContact CZ-CD1 3.79Å
476	R	93.6	Very high	86.7	Confident	142 Å²	142	67.3 Å²	67.3	54%	0.536	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-38.9	177.4	-74	-177.3	-68.9	-158.9	3.1	112.3	S472 A473 L474 V479 R480	S472-R476 WeakPolarHBondContact O-CB 3.38Å; S472-R476 VanDerWaalsContact O-CG 3.31Å; S472-R476 WeakPolarHBondContact O-CG 3.38Å; S472-R476 PolarHBondContact O-N 3.09Å; S472-R476 VanDerWaalsContact O-N 3.09Å; S472-R476 PolarHBondContact O-NE 2.74Å; A473-R476 PolarHBondContact O-N 3.36Å; L474-R476 PolarHBondContact O-N 3.14Å; R476-V479 PolarHBondContact O-N 2.83Å; R476-R480 WeakPolarHBondContact O-CB 3.43Å; R476-R480 VanDerWaalsContact O-CG 3.31Å; R476-R480 WeakPolarHBondContact O-CG 3.35Å; R476-R480 PolarHBondContact O-N 3.4Å
477	L	91	Very high	88.3	Confident	80 Å²	80	66.3 Å²	66.3	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-45.5	176.9	-179.5	65.3	0	0	0	111.1	L469 A473 L474 F475 R480 T481	L469-L477 HydrophobicContact CD1-CD2 3.57Å; A473-L477 VanDerWaalsContact O-CB 3.29Å; A473-L477 WeakPolarHBondContact O-CB 3.49Å; A473-L477 PolarHBondContact O-N 3.15Å; L474-L477 PolarHBondContact O-N 3.41Å; F475-L477 VanDerWaalsContact C-N 3.33Å; F475-L477 PolarHBondContact O-N 2.93Å; L477-R480 PolarHBondContact O-N 2.9Å; L477-T481 HydrophobicContact CD1-CG2 3.78Å; L477-T481 HydrophobicContact CG-CG2 4.41Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 WeakPolarHBondContact O-CG2 3.42Å; L477-T481 PolarHBondContact O-N 3.47Å; L477-T481 PolarHBondContact O-OG1 3.1Å
478	I	90.6	Very high	89.6	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-50.7	177.7	-65.4	164	0	0	0	110.1	L452 V453 L474 F475 R480 T481 E482 G483 L487	L452-I478 HydrophobicContact CD2-CD1 4.32Å; V453-I478 HydrophobicContact CG2-CD1 4.22Å; L474-I478 HydrophobicContact CD1-CD1 4.31Å; L474-I478 HydrophobicContact CD1-CG1 4.43Å; L474-I478 HydrophobicContact CG-CD1 4.07Å; L474-I478 VanDerWaalsContact O-CG1 3.24Å; L474-I478 WeakPolarHBondContact O-CG1 3.25Å; L474-I478 PolarHBondContact O-N 2.89Å; F475-I478 PolarHBondContact O-N 2.83Å; I478-R480 VanDerWaalsContact C-N 3.31Å; I478-R480 PolarHBondContact O-N 2.85Å; I478-T481 PolarHBondContact O-N 3.03Å; I478-E482 HydrophobicContact CG2-CB 4.41Å; I478-E482 WeakPolarHBondContact O-CA 3.09Å; I478-E482 WeakPolarHBondContact O-CB 3.35Å; I478-E482 PolarHBondContact O-N 3.14Å; I478-G483 PolarHBondContact O-N 3.04Å; I478-L487 HydrophobicContact CB-CD2 4.36Å; I478-L487 HydrophobicContact CD1-CD2 4.43Å; I478-L487 HydrophobicContact CG2-CD2 3.87Å; I478-L487 HydrophobicContact CG2-CG 4.18Å
479	V	92.9	Very high	90.4	Very high	53 Å²	53	62.5 Å²	62.5	32%	0.321	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-41.3	-179	174.6	0	0	0	0	111.4	F475 R476 G483 L487	F475-V479 HydrophobicContact CD1-CG2 4.28Å; F475-V479 HydrophobicContact CE1-CG2 3.94Å; F475-V479 HydrophobicContact CZ-CG2 4.24Å; F475-V479 WeakPolarHBondContact O-CG2 3.45Å; F475-V479 PolarHBondContact O-N 3.47Å; R476-V479 PolarHBondContact O-N 2.83Å; V479-G483 WeakPolarHBondContact O-CA 3.3Å; V479-G483 PolarHBondContact O-N 3.2Å; V479-L487 HydrophobicContact CG2-CD1 3.83Å; V479-L487 HydrophobicContact CG2-CG 4.39Å
480	R	91.9	Very high	90.5	Very high	208 Å²	208	60 Å²	60	79%	0.785	31%	0.306	S	S	*	.	H	α-helix	trans	-69.2	-45.1	178.8	-74.5	-179.6	175.9	-179.2	-1.8	113.1	R476 L477 I478	R476-R480 WeakPolarHBondContact O-CB 3.43Å; R476-R480 VanDerWaalsContact O-CG 3.31Å; R476-R480 WeakPolarHBondContact O-CG 3.35Å; R476-R480 PolarHBondContact O-N 3.4Å; L477-R480 PolarHBondContact O-N 2.9Å; I478-R480 VanDerWaalsContact C-N 3.31Å; I478-R480 PolarHBondContact O-N 2.85Å
481	T	88.6	Confident	90.5	Very high	71 Å²	71	58.5 Å²	58.5	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-82.9	-45.3	-174.1	54.6	0	0	0	0	111.9	K272 L477 I478	K272-T481 VanDerWaalsContact CD-O 3.28Å; K272-T481 WeakPolarHBondContact CD-O 3.39Å; K272-T481 WeakPolarHBondContact CE-O 3.48Å; K272-T481 PolarHBondContact NZ-O 3.48Å; L477-T481 HydrophobicContact CD1-CG2 3.78Å; L477-T481 HydrophobicContact CG-CG2 4.41Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 WeakPolarHBondContact O-CG2 3.42Å; L477-T481 PolarHBondContact O-N 3.47Å; L477-T481 PolarHBondContact O-OG1 3.1Å; I478-T481 PolarHBondContact O-N 3.03Å
482	E	87.4	Confident	90.3	Very high	20 Å²	20	58.2 Å²	58.2	9%	0.093	30%	0.299	C	S	.	.	H	α-helix	trans	-105.8	-10.2	-170.3	-60.7	169	-166.6	0	0	113.5	K272 R456 I478 R489	K272-E482 WeakPolarHBondContact CE-O 3.21Å; R456-E482 IonicContact CZ-OE1 2.55Å; R456-E482 IonicContact CZ-OE2 3.48Å; R456-E482 IonicContact NH1-OE1 3.06Å; R456-E482 PolarHBondContact NH1-OE1 3.25Å; R456-E482 IonicContact NH1-OE2 2.78Å; R456-E482 VanDerWaalsContact NH2-CD 3.35Å; R456-E482 IonicContact NH2-OE1 3.42Å; R456-E482 PolarHBondContact NH2-OE1 2.99Å; R456-E482 IonicContact NH2-OE2 3.44Å; R456-E482 PolarHBondContact NH2-OE2 3.15Å; I478-E482 HydrophobicContact CG2-CB 4.41Å; I478-E482 WeakPolarHBondContact O-CA 3.09Å; I478-E482 WeakPolarHBondContact O-CB 3.35Å; I478-E482 PolarHBondContact O-N 3.14Å; E482-R489 IonicContact OE1-NH1 2.76Å; E482-R489 IonicContact OE2-CZ 2.68Å; E482-R489 IonicContact OE2-NH1 2.67Å; E482-R489 PolarHBondContact OE2-NH1 3.41Å
483	G	89.7	Confident	90.1	Very high	13 Å²	13	55.5 Å²	55.5	13%	0.134	28%	0.28	C	S	.	.			trans	79.2	172.3	-173.9	0	0	0	0	0	112.8	I478 V479 L485 G486	I478-G483 PolarHBondContact O-N 3.04Å; V479-G483 WeakPolarHBondContact O-CA 3.3Å; V479-G483 PolarHBondContact O-N 3.2Å; G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.23Å; G483-G486 PolarHBondContact O-N 3.24Å
484	P	89.7	Confident	89.7	Confident	89 Å²	89	54.4 Å²	54.4	58%	0.578	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-63	-34.3	-178.7	24.2	-33.3	0	0	0	112.9	G486 L487	P484-G486 PolarHBondContact O-N 3.39Å; P484-L487 WeakPolarHBondContact O-CB 3.44Å; P484-L487 PolarHBondContact O-N 3.34Å; P484-L487 VanDerWaalsContact O-N 3.11Å
485	L	90	Very high	89.3	Confident	145 Å²	145	56.9 Å²	56.9	76%	0.759	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-65.3	-20.3	174.7	-65.9	175.5	0	0	0	113	G483 L487 Y488	G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.23Å; L485-L487 PolarHBondContact O-N 2.94Å; L485-Y488 PolarHBondContact O-N 2.96Å; L485-Y488 VanDerWaalsContact O-N 3.1Å
486	G	88.1	Confident	88.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.01	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59	-28.8	172.4	0	0	0	0	0	112.8	L452 G483 P484 Y488 R489	L452-G486 WeakPolarHBondContact CD2-O 3.34Å; G483-G486 PolarHBondContact O-N 3.24Å; P484-G486 PolarHBondContact O-N 3.39Å; G486-Y488 PolarHBondContact O-N 3.11Å; G486-R489 PolarHBondContact O-N 3.15Å
487	L	92	Very high	88.3	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.052	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-65.6	-16.6	177.4	-66.8	166.1	0	0	0	113.5	Y448 P449 L452 V453 F475 I478 V479 P484 L485	Y448-L487 VanDerWaalsContact CD1-O 3.24Å; Y448-L487 WeakPolarHBondContact CD1-O 3.34Å; P449-L487 HydrophobicContact CB-CB 4.04Å; P449-L487 HydrophobicContact CB-CD1 4.18Å; P449-L487 HydrophobicContact CB-CD2 4.3Å; P449-L487 HydrophobicContact CB-CG 4.4Å; P449-L487 HydrophobicContact CG-CB 4.25Å; L452-L487 WeakPolarHBondContact CB-O 3.18Å; L452-L487 VanDerWaalsContact CD2-CA 3.46Å; L452-L487 HydrophobicContact CD2-CD2 4.42Å; L452-L487 WeakPolarHBondContact CD2-O 3.22Å; V453-L487 HydrophobicContact CG2-CD2 4.46Å; F475-L487 HydrophobicContact CD2-CD1 4.46Å; F475-L487 HydrophobicContact CD2-CD2 3.88Å; F475-L487 HydrophobicContact CE2-CD1 3.63Å; F475-L487 HydrophobicContact CE2-CD2 3.82Å; F475-L487 HydrophobicContact CE2-CG 4.4Å; F475-L487 HydrophobicContact CZ-CD1 3.79Å; I478-L487 HydrophobicContact CB-CD2 4.36Å; I478-L487 HydrophobicContact CD1-CD2 4.43Å; I478-L487 HydrophobicContact CG2-CD2 3.87Å; I478-L487 HydrophobicContact CG2-CG 4.18Å; V479-L487 HydrophobicContact CG2-CD1 3.83Å; V479-L487 HydrophobicContact CG2-CG 4.39Å; P484-L487 WeakPolarHBondContact O-CB 3.44Å; P484-L487 PolarHBondContact O-N 3.34Å; P484-L487 VanDerWaalsContact O-N 3.11Å; L485-L487 PolarHBondContact O-N 2.94Å
488	Y	92	Very high	87.5	Confident	85 Å²	85	49.7 Å²	49.7	33%	0.333	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-105	14.5	-175.9	-65.7	-89.7	0	0	0	114.1	L445 Y448 P449 L485 G486 L491	L445-Y488 WeakPolarHBondContact O-CE1 3.3Å; Y448-Y488 HydrophobicContact CD1-CD1 4.01Å; Y448-Y488 HydrophobicContact CD1-CG 4.44Å; Y448-Y488 HydrophobicContact CG-CD1 4.22Å; P449-Y488 HydrophobicContact CG-CE1 4.41Å; P449-Y488 HydrophobicContact CG-CE2 4.26Å; L485-Y488 PolarHBondContact O-N 2.96Å; L485-Y488 VanDerWaalsContact O-N 3.1Å; G486-Y488 PolarHBondContact O-N 3.11Å; Y488-L491 HydrophobicContact CD1-CD2 4.26Å; Y488-L491 WeakPolarHBondContact O-CB 3.27Å; Y488-L491 PolarHBondContact O-N 2.92Å
489	R	89.9	Confident	86.7	Confident	45 Å²	45	54.3 Å²	54.3	17%	0.17	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	139.7	178.5	-74.2	-161.4	176.3	115.7	16.5	112.6	Q267 A270 Y448 L452 E482 G486 L491	Q267-R489 VanDerWaalsContact CG-O 3.24Å; Q267-R489 WeakPolarHBondContact CG-O 3.48Å; A270-R489 WeakPolarHBondContact O-CD 3.38Å; A270-R489 PolarHBondContact O-NH1 3.38Å; Y448-R489 VanDerWaalsContact CE1-O 3.27Å; Y448-R489 WeakPolarHBondContact CE1-O 3.36Å; Y448-R489 PolarHBondContact OH-O 2.86Å; L452-R489 HydrophobicContact CD1-CB 4.38Å; E482-R489 IonicContact OE1-NH1 2.76Å; E482-R489 IonicContact OE2-CZ 2.68Å; E482-R489 IonicContact OE2-NH1 2.67Å; E482-R489 PolarHBondContact OE2-NH1 3.41Å; G486-R489 PolarHBondContact O-N 3.15Å; R489-L491 VanDerWaalsContact C-N 3.31Å
490	G	86.3	Confident	86	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.031	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	5.5	-175.5	0	0	0	0	0	114.7	Y448 P493 N494	Y448-G490 WeakPolarHBondContact OH-CA 3.48Å; Y448-G490 PolarHBondContact OH-O 2.78Å; G490-P493 VanDerWaalsContact O-CD 3.29Å; G490-P493 WeakPolarHBondContact O-CD 3.26Å; G490-P493 VanDerWaalsContact O-CG 3.27Å; G490-P493 WeakPolarHBondContact O-CG 3.49Å; G490-N494 WeakPolarHBondContact O-CB 3.11Å; G490-N494 PolarHBondContact O-N 3.08Å
491	L	87.1	Confident	85.2	Confident	32 Å²	32	46.2 Å²	46.2	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-39.7	179.5	-174.1	69.9	0	0	0	112.1	L445 Y448 Y488 R489 N494 F495	L445-L491 HydrophobicContact CD2-CD1 4.16Å; L445-L491 HydrophobicContact CD2-CD2 3.72Å; Y448-L491 HydrophobicContact CD2-CD1 3.46Å; Y448-L491 VanDerWaalsContact CD2-CD1 3.46Å; Y448-L491 HydrophobicContact CE1-CB 4.4Å; Y448-L491 HydrophobicContact CE2-CB 4.28Å; Y448-L491 HydrophobicContact CE2-CD1 3.55Å; Y448-L491 HydrophobicContact CG-CD1 3.99Å; Y448-L491 PolarHBondContact OH-N 3.26Å; Y448-L491 VanDerWaalsContact OH-N 3.1Å; Y488-L491 HydrophobicContact CD1-CD2 4.26Å; Y488-L491 WeakPolarHBondContact O-CB 3.27Å; Y488-L491 PolarHBondContact O-N 2.92Å; R489-L491 VanDerWaalsContact C-N 3.31Å; L491-N494 CarbonylContact O-C 3.58Å; L491-N494 WeakPolarHBondContact O-CA 3.5Å; L491-N494 VanDerWaalsContact O-CB 3.27Å; L491-N494 WeakPolarHBondContact O-CB 3.39Å; L491-N494 PolarHBondContact O-N 3.09Å; L491-N494 VanDerWaalsContact O-N 3.1Å; L491-F495 HydrophobicContact CD1-CD2 4.25Å; L491-F495 HydrophobicContact CD1-CE1 4.32Å; L491-F495 HydrophobicContact CD1-CE2 3.57Å; L491-F495 HydrophobicContact CD1-CZ 3.59Å; L491-F495 HydrophobicContact CD2-CD2 4.49Å; L491-F495 HydrophobicContact CD2-CE2 3.71Å; L491-F495 HydrophobicContact CD2-CZ 4.36Å; L491-F495 HydrophobicContact CG-CD2 3.87Å; L491-F495 HydrophobicContact CG-CE2 3.39Å; L491-F495 HydrophobicContact CG-CZ 3.99Å; L491-F495 PolarHBondContact O-N 2.92Å
492	A	87.8	Confident	84.2	Confident	49 Å²	49	45.5 Å²	45.5	41%	0.405	25%	0.254	S	S	.	.	H	α-helix	trans	-58.4	-54.6	178.4	0	0	0	0	0	113.7	I278 N494 F495 M496	I278-A492 HydrophobicContact CD1-CB 4.09Å; A492-N494 PolarHBondContact O-N 3.23Å; A492-F495 PolarHBondContact O-N 3.41Å; A492-F495 VanDerWaalsContact O-N 3.14Å; A492-M496 WeakPolarHBondContact O-CG 3.38Å; A492-M496 PolarHBondContact O-N 3.32Å
493	P	86.1	Confident	83.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-25.2	174.4	24.8	-33.9	0	0	0	113.3	L259 L262 K263 M266 G490 M496 K497	L259-P493 HydrophobicContact CD2-CB 4.38Å; L262-P493 HydrophobicContact CD2-CB 4.18Å; L262-P493 HydrophobicContact CG-CB 4.33Å; L262-P493 HydrophobicContact CG-CG 4.46Å; K263-P493 HydrophobicContact CB-CB 4.31Å; K263-P493 HydrophobicContact CB-CG 4.03Å; M266-P493 HydrophobicContact SD-CG 3.84Å; G490-P493 VanDerWaalsContact O-CD 3.29Å; G490-P493 WeakPolarHBondContact O-CD 3.26Å; G490-P493 VanDerWaalsContact O-CG 3.27Å; G490-P493 WeakPolarHBondContact O-CG 3.49Å; P493-M496 VanDerWaalsContact CA-CE 3.48Å; P493-M496 HydrophobicContact CB-CE 4.05Å; P493-K497 PolarHBondContact O-N 2.87Å
494	N	83.6	Confident	82.7	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-35.7	173.6	-172.8	73.3	0	0	0	113.2	K263 Q444 Y448 G490 L491 A492 K497 V498	K263-N494 HydrophobicContact CD-CB 3.92Å; K263-N494 WeakPolarHBondContact CE-OD1 3.27Å; K263-N494 HydrophobicContact CG-CB 4.47Å; K263-N494 PolarHBondContact NZ-OD1 3.39Å; Q444-N494 PolarHBondContact OE1-ND2 2.61Å; Y448-N494 HydrophobicContact CE2-CB 4.45Å; G490-N494 WeakPolarHBondContact O-CB 3.11Å; G490-N494 PolarHBondContact O-N 3.08Å; L491-N494 CarbonylContact O-C 3.58Å; L491-N494 WeakPolarHBondContact O-CA 3.5Å; L491-N494 VanDerWaalsContact O-CB 3.27Å; L491-N494 WeakPolarHBondContact O-CB 3.39Å; L491-N494 PolarHBondContact O-N 3.09Å; L491-N494 VanDerWaalsContact O-N 3.1Å; A492-N494 PolarHBondContact O-N 3.23Å; N494-K497 WeakPolarHBondContact O-CG 3.45Å; N494-K497 WeakPolarHBondContact OD1-CE 3.21Å; N494-K497 PolarHBondContact OD1-NZ 3.31Å; N494-V498 WeakPolarHBondContact O-CG2 3.37Å
495	F	83.3	Confident	81.9	Confident	63 Å²	63	46.9 Å²	46.9	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-80.1	-39.5	175	-70.1	-41.2	0	0	0	113	T441 L445 L491 A492 K497 V498	T441-F495 HydrophobicContact CG2-CD1 4.4Å; T441-F495 HydrophobicContact CG2-CE1 3.59Å; T441-F495 HydrophobicContact CG2-CZ 3.73Å; L445-F495 HydrophobicContact CD2-CE2 4.13Å; L445-F495 HydrophobicContact CD2-CZ 3.8Å; L445-F495 HydrophobicContact CG-CZ 4.01Å; L491-F495 HydrophobicContact CD1-CD2 4.25Å; L491-F495 HydrophobicContact CD1-CE1 4.32Å; L491-F495 HydrophobicContact CD1-CE2 3.57Å; L491-F495 HydrophobicContact CD1-CZ 3.59Å; L491-F495 HydrophobicContact CD2-CD2 4.49Å; L491-F495 HydrophobicContact CD2-CE2 3.71Å; L491-F495 HydrophobicContact CD2-CZ 4.36Å; L491-F495 HydrophobicContact CG-CD2 3.87Å; L491-F495 HydrophobicContact CG-CE2 3.39Å; L491-F495 HydrophobicContact CG-CZ 3.99Å; L491-F495 PolarHBondContact O-N 2.92Å; A492-F495 PolarHBondContact O-N 3.41Å; A492-F495 VanDerWaalsContact O-N 3.14Å; F495-K497 PolarHBondContact O-N 2.88Å; F495-K497 VanDerWaalsContact O-N 3.08Å; F495-V498 PolarHBondContact O-N 3.06Å
496	M	84.9	Confident	81	Confident	84 Å²	84	46.1 Å²	46.1	41%	0.414	25%	0.249	S	C	.	.	H	α-helix	trans	-57.1	-28	177.6	-72.6	-173.4	-63.9	0	0	113	L259 I278 A492 P493 P500	L259-M496 HydrophobicContact CD1-CB 4.38Å; L259-M496 HydrophobicContact CD2-CB 4.33Å; L259-M496 HydrophobicContact CD2-CE 4.02Å; I278-M496 HydrophobicContact CD1-CE 3.37Å; I278-M496 HydrophobicContact CD1-SD 4.1Å; I278-M496 HydrophobicContact CG1-CE 3.84Å; I278-M496 HydrophobicContact CG2-CE 3.99Å; A492-M496 WeakPolarHBondContact O-CG 3.38Å; A492-M496 PolarHBondContact O-N 3.32Å; P493-M496 VanDerWaalsContact CA-CE 3.48Å; P493-M496 HydrophobicContact CB-CE 4.05Å; M496-P500 WeakPolarHBondContact O-CD 3.44Å; M496-P500 WeakPolarHBondContact O-CG 3.47Å
497	K	82.6	Confident	80.4	Confident	40 Å²	40	50.6 Å²	50.6	17%	0.174	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.3	178.2	68.6	171.7	-162.2	-178.6	0	114.6	T256 L259 D260 P493 N494 F495 S501	T256-K497 HydrophobicContact CG2-CB 4.33Å; L259-K497 HydrophobicContact CB-CB 4.04Å; L259-K497 HydrophobicContact CD1-CB 3.81Å; D260-K497 VanDerWaalsContact OD1-CD 3.24Å; D260-K497 WeakPolarHBondContact OD1-CD 3.24Å; D260-K497 IonicContact OD1-NZ 3.97Å; D260-K497 PolarHBondContact OD1-NZ 3.25Å; P493-K497 PolarHBondContact O-N 2.87Å; N494-K497 WeakPolarHBondContact O-CG 3.45Å; N494-K497 WeakPolarHBondContact OD1-CE 3.21Å; N494-K497 PolarHBondContact OD1-NZ 3.31Å; F495-K497 PolarHBondContact O-N 2.88Å; F495-K497 VanDerWaalsContact O-N 3.08Å; K497-S501 WeakPolarHBondContact O-CB 3.21Å; K497-S501 PolarHBondContact O-N 3.03Å
498	V	73.6	Confident	79.6	Confident	26 Å²	26	51.6 Å²	51.6	16%	0.158	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-55.7	-170	175.4	0	0	0	0	110.7	N494 F495 S501 V502	N494-V498 WeakPolarHBondContact O-CG2 3.37Å; F495-V498 PolarHBondContact O-N 3.06Å; V498-S501 WeakPolarHBondContact O-CB 3.35Å; V498-S501 PolarHBondContact O-N 3.44Å; V498-V502 WeakPolarHBondContact O-CG2 3.15Å; V498-V502 PolarHBondContact O-N 3.35Å
499	V	74.2	Confident	78.8	Confident	98 Å²	98	50.6 Å²	50.6	59%	0.594	28%	0.279	S	S	*	.	H	α-helix	trans	-60.9	-48.9	-177.5	174.7	0	0	0	0	111.9	S501 V502 S503	V499-S501 VanDerWaalsContact C-N 3.33Å; V499-S501 PolarHBondContact O-N 3.27Å; V499-V502 PolarHBondContact O-N 3.09Å; V499-S503 WeakPolarHBondContact O-CB 3.29Å; V499-S503 PolarHBondContact O-N 2.96Å; V499-S503 PolarHBondContact O-OG 2.87Å
500	P	77.6	Confident	78	Confident	51 Å²	51	49.6 Å²	49.6	33%	0.331	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-41.1	173.9	-25.7	34.6	0	0	0	113.3	T256 M496 V502 I504	T256-P500 HydrophobicContact CG2-CB 4.32Å; M496-P500 WeakPolarHBondContact O-CD 3.44Å; M496-P500 WeakPolarHBondContact O-CG 3.47Å; P500-V502 PolarHBondContact O-N 3.49Å; P500-I504 HydrophobicContact CB-CD1 4.45Å; P500-I504 VanDerWaalsContact O-CB 3.3Å; P500-I504 WeakPolarHBondContact O-CB 3.48Å; P500-I504 WeakPolarHBondContact O-CD1 3.29Å; P500-I504 WeakPolarHBondContact O-CG1 3.37Å; P500-I504 PolarHBondContact O-N 3.32Å
501	S	74.8	Confident	77.7	Confident	40 Å²	40	55.4 Å²	55.4	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-48.9	-179.1	-174.2	0	0	0	0	111.6	S252 K497 V498 V499 S505	S252-S501 VanDerWaalsContact OG-CA 3.29Å; S252-S501 WeakPolarHBondContact OG-CA 3.37Å; S252-S501 PolarHBondContact OG-O 3.2Å; S252-S501 PolarHBondContact OG-OG 3.41Å; K497-S501 WeakPolarHBondContact O-CB 3.21Å; K497-S501 PolarHBondContact O-N 3.03Å; V498-S501 WeakPolarHBondContact O-CB 3.35Å; V498-S501 PolarHBondContact O-N 3.44Å; V499-S501 VanDerWaalsContact C-N 3.33Å; V499-S501 PolarHBondContact O-N 3.27Å; S501-S505 VanDerWaalsContact O-CB 3.27Å; S501-S505 WeakPolarHBondContact O-CB 3.5Å; S501-S505 PolarHBondContact O-N 2.88Å; S501-S505 VanDerWaalsContact O-N 3.09Å
502	V	67.3	Low	77.2	Confident	57 Å²	57	56.2 Å²	56.2	35%	0.345	31%	0.306	S	S	.	.	H	α-helix	trans	-67.2	-48	-178.9	175.5	0	0	0	0	110.3	L433 V498 V499 P500 I504 S505 Y506	L433-V502 HydrophobicContact CD2-CG1 3.9Å; V498-V502 WeakPolarHBondContact O-CG2 3.15Å; V498-V502 PolarHBondContact O-N 3.35Å; V499-V502 PolarHBondContact O-N 3.09Å; P500-V502 PolarHBondContact O-N 3.49Å; V502-I504 PolarHBondContact O-N 3.04Å; V502-S505 PolarHBondContact O-N 2.93Å; V502-Y506 PolarHBondContact O-N 3.11Å
503	S	70.8	Confident	76.6	Confident	61 Å²	61	55.3 Å²	55.3	43%	0.427	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-47.6	-177.7	-52.7	0	0	0	0	112.1	V499 Y506 V507	V499-S503 WeakPolarHBondContact O-CB 3.29Å; V499-S503 PolarHBondContact O-N 2.96Å; V499-S503 PolarHBondContact O-OG 2.87Å; S503-Y506 PolarHBondContact O-N 2.84Å; S503-V507 WeakPolarHBondContact O-CG2 3.5Å; S503-V507 PolarHBondContact O-N 2.52Å; S503-V507 VanDerWaalsContact O-N 3.09Å
504	I	76.1	Confident	76.2	Confident	48 Å²	48	63 Å²	63	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-43.1	178.9	-65.9	167.1	0	0	0	110.3	V251 C255 P500 V502 Y506 V507 V508	V251-I504 HydrophobicContact CG1-CG2 3.98Å; C255-I504 HydrophobicContact CB-CD1 3.62Å; P500-I504 HydrophobicContact CB-CD1 4.45Å; P500-I504 VanDerWaalsContact O-CB 3.3Å; P500-I504 WeakPolarHBondContact O-CB 3.48Å; P500-I504 WeakPolarHBondContact O-CD1 3.29Å; P500-I504 WeakPolarHBondContact O-CG1 3.37Å; P500-I504 PolarHBondContact O-N 3.32Å; V502-I504 PolarHBondContact O-N 3.04Å; I504-Y506 VanDerWaalsContact C-N 3.32Å; I504-Y506 PolarHBondContact O-N 3.22Å; I504-V507 PolarHBondContact O-N 2.96Å; I504-V508 HydrophobicContact CG2-CG2 4Å; I504-V508 VanDerWaalsContact O-CB 3.3Å; I504-V508 WeakPolarHBondContact O-CB 3.19Å; I504-V508 WeakPolarHBondContact O-CG2 3.49Å; I504-V508 PolarHBondContact O-N 3.36Å
505	S	72.2	Confident	76.3	Confident	41 Å²	41	66.7 Å²	66.7	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-44.1	179.3	-166.5	0	0	0	0	111.2	A248 S501 V502 Y509	A248-S505 WeakPolarHBondContact CB-O 3.38Å; S501-S505 VanDerWaalsContact O-CB 3.27Å; S501-S505 WeakPolarHBondContact O-CB 3.5Å; S501-S505 PolarHBondContact O-N 2.88Å; S501-S505 VanDerWaalsContact O-N 3.09Å; V502-S505 PolarHBondContact O-N 2.93Å; S505-Y509 WeakPolarHBondContact O-CB 3.3Å; S505-Y509 PolarHBondContact O-N 3.15Å
506	Y	70.9	Confident	76.2	Confident	129 Å²	129	65.8 Å²	65.8	51%	0.506	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-52.7	178.8	-179.2	-96.8	0	0	0	112	V502 S503 I504 V508 Y509 E510	V502-Y506 PolarHBondContact O-N 3.11Å; S503-Y506 PolarHBondContact O-N 2.84Å; I504-Y506 VanDerWaalsContact C-N 3.32Å; I504-Y506 PolarHBondContact O-N 3.22Å; Y506-V508 VanDerWaalsContact C-N 3.34Å; Y506-V508 PolarHBondContact O-N 3.13Å; Y506-Y509 PolarHBondContact O-N 3.39Å; Y506-E510 HydrophobicContact CE1-CG 4.07Å; Y506-E510 HydrophobicContact CE2-CG 4.32Å; Y506-E510 PolarHBondContact O-N 3.13Å
507	V	74.7	Confident	75.7	Confident	95 Å²	95	64 Å²	64	58%	0.576	35%	0.35	S	S	*	.	H	α-helix	trans	-60.8	-43.8	-178.7	172.7	0	0	0	0	111.5	S503 I504 H511	S503-V507 WeakPolarHBondContact O-CG2 3.5Å; S503-V507 PolarHBondContact O-N 2.52Å; S503-V507 VanDerWaalsContact O-N 3.09Å; I504-V507 PolarHBondContact O-N 2.96Å; V507-H511 WeakPolarHBondContact O-CB 3.39Å; V507-H511 PolarHBondContact O-N 2.87Å
508	V	76.4	Confident	75	Confident	31 Å²	31	62.8 Å²	62.8	19%	0.188	35%	0.345	C	S	.	.	H	α-helix	trans	-69.3	-39	179.4	177.5	0	0	0	0	110.9	A248 V251 I504 Y506 H511 L512	A248-V508 HydrophobicContact CB-CB 4.13Å; A248-V508 HydrophobicContact CB-CG1 4.04Å; V251-V508 HydrophobicContact CB-CG1 4.29Å; V251-V508 HydrophobicContact CB-CG2 4.26Å; V251-V508 HydrophobicContact CG1-CG2 3.91Å; V251-V508 HydrophobicContact CG2-CG1 4.18Å; I504-V508 HydrophobicContact CG2-CG2 4Å; I504-V508 VanDerWaalsContact O-CB 3.3Å; I504-V508 WeakPolarHBondContact O-CB 3.19Å; I504-V508 WeakPolarHBondContact O-CG2 3.49Å; I504-V508 PolarHBondContact O-N 3.36Å; Y506-V508 VanDerWaalsContact C-N 3.34Å; Y506-V508 PolarHBondContact O-N 3.13Å; V508-H511 PolarHBondContact O-N 3.29Å; V508-L512 HydrophobicContact CG1-CD1 3.68Å; V508-L512 HydrophobicContact CG1-CG 4.06Å; V508-L512 VanDerWaalsContact O-CB 3.32Å; V508-L512 WeakPolarHBondContact O-CB 3.37Å; V508-L512 VanDerWaalsContact O-CG 3.27Å; V508-L512 WeakPolarHBondContact O-CG 3.39Å; V508-L512 PolarHBondContact O-N 3.1Å
509	Y	74.4	Confident	73.8	Confident	64 Å²	64	70.4 Å²	70.4	25%	0.251	38%	0.379	S	S	.	.	H	α-helix	trans	-60.4	-50.6	176	177.9	-103.4	0	0	0	110.9	H241 A244 S505 Y506 H511 L512 K513	H241-Y509 PolarHBondContact ND1-OH 3.23Å; A244-Y509 HydrophobicContact CB-CD2 3.83Å; A244-Y509 HydrophobicContact CB-CE2 3.85Å; S505-Y509 WeakPolarHBondContact O-CB 3.3Å; S505-Y509 PolarHBondContact O-N 3.15Å; Y506-Y509 PolarHBondContact O-N 3.39Å; Y509-H511 VanDerWaalsContact C-N 3.33Å; Y509-H511 PolarHBondContact O-N 3.21Å; Y509-L512 PolarHBondContact O-N 3.43Å; Y509-K513 HydrophobicContact CE1-CD 3.98Å; Y509-K513 WeakPolarHBondContact O-CB 3.48Å; Y509-K513 PolarHBondContact O-N 2.75Å
510	E	73.4	Confident	72.1	Confident	24 Å²	24	67.8 Å²	67.8	11%	0.112	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-43.5	177.4	-81.1	-64	114.4	0	0	112.1	Y506 R514	Y506-E510 HydrophobicContact CE1-CG 4.07Å; Y506-E510 HydrophobicContact CE2-CG 4.32Å; Y506-E510 PolarHBondContact O-N 3.13Å; E510-R514 WeakPolarHBondContact O-CB 3.48Å; E510-R514 VanDerWaalsContact O-CG 3.24Å; E510-R514 WeakPolarHBondContact O-CG 3.44Å; E510-R514 PolarHBondContact O-N 3.02Å; E510-R514 IonicContact OE2-CZ 2.86Å; E510-R514 IonicContact OE2-NE 3.35Å; E510-R514 IonicContact OE2-NH2 3.57Å; E510-R514 PolarHBondContact OE2-NH2 2.83Å; E510-R514 VanDerWaalsContact OE2-NH2 3.15Å
511	H	80.4	Confident	70.1	Confident	125 Å²	125	78 Å²	78	58%	0.579	40%	0.397	S	S	*	.	H	α-helix	trans	-66.7	-43.7	179	-171.6	74.3	0	0	0	112.6	V507 V508 Y509 S515	V507-H511 WeakPolarHBondContact O-CB 3.39Å; V507-H511 PolarHBondContact O-N 2.87Å; V508-H511 PolarHBondContact O-N 3.29Å; Y509-H511 VanDerWaalsContact C-N 3.33Å; Y509-H511 PolarHBondContact O-N 3.21Å; H511-S515 WeakPolarHBondContact O-CB 3.44Å; H511-S515 PolarHBondContact O-N 2.69Å; H511-S515 PolarHBondContact O-OG 2.99Å
512	L	76.6	Confident	69.8	Low	49 Å²	49	79.9 Å²	79.9	26%	0.257	40%	0.403	S	S	.	.	H	α-helix	trans	-67.8	-41.3	177.5	-72.6	176.6	0	0	0	111.5	A244 V508 Y509 S515 L516	A244-L512 HydrophobicContact CB-CB 3.89Å; V508-L512 HydrophobicContact CG1-CD1 3.68Å; V508-L512 HydrophobicContact CG1-CG 4.06Å; V508-L512 VanDerWaalsContact O-CB 3.32Å; V508-L512 WeakPolarHBondContact O-CB 3.37Å; V508-L512 VanDerWaalsContact O-CG 3.27Å; V508-L512 WeakPolarHBondContact O-CG 3.39Å; V508-L512 PolarHBondContact O-N 3.1Å; Y509-L512 PolarHBondContact O-N 3.43Å; L512-S515 PolarHBondContact O-N 2.95Å; L512-L516 WeakPolarHBondContact O-CB 2.97Å; L512-L516 WeakPolarHBondContact O-CG 3.22Å; L512-L516 PolarHBondContact O-N 3.04Å
513	K	74.6	Confident	70	Confident	31 Å²	31	81.1 Å²	81.1	14%	0.135	41%	0.406	C	S	.	.	H	α-helix	trans	-57.9	-49.3	176.1	-174.4	-176.8	174.1	-167	0	110.6	A244 Y509 L516 G517 V518 S520	A244-K513 HydrophobicContact CB-CB 4.45Å; Y509-K513 HydrophobicContact CE1-CD 3.98Å; Y509-K513 WeakPolarHBondContact O-CB 3.48Å; Y509-K513 PolarHBondContact O-N 2.75Å; K513-L516 PolarHBondContact O-N 3.23Å; K513-G517 PolarHBondContact O-N 3.23Å; K513-V518 HydrophobicContact CD-CG1 4.14Å; K513-V518 HydrophobicContact CG-CB 3.56Å; K513-V518 HydrophobicContact CG-CG1 3.64Å; K513-V518 HydrophobicContact CG-CG2 4.48Å; K513-V518 WeakPolarHBondContact O-CB 3.4Å; K513-V518 PolarHBondContact O-N 3Å; K513-S520 PolarHBondContact NZ-OG 3.36Å
514	R	78.8	Confident	69.9	Low	162 Å²	162	82.2 Å²	82.2	61%	0.611	41%	0.405	S	S	*	.	H	α-helix	trans	-61.3	-44.9	175.1	-70.5	173.9	-161.8	-172.9	3.8	112.3	E510 L516 G517	E510-R514 WeakPolarHBondContact O-CB 3.48Å; E510-R514 VanDerWaalsContact O-CG 3.24Å; E510-R514 WeakPolarHBondContact O-CG 3.44Å; E510-R514 PolarHBondContact O-N 3.02Å; E510-R514 IonicContact OE2-CZ 2.86Å; E510-R514 IonicContact OE2-NE 3.35Å; E510-R514 IonicContact OE2-NH2 3.57Å; E510-R514 PolarHBondContact OE2-NH2 2.83Å; E510-R514 VanDerWaalsContact OE2-NH2 3.15Å; R514-L516 VanDerWaalsContact C-N 3.29Å; R514-L516 PolarHBondContact O-N 3.19Å; R514-G517 PolarHBondContact O-N 2.75Å
515	S	84.7	Confident	69.6	Low	81 Å²	81	84.2 Å²	84.2	57%	0.566	42%	0.415	S	S	*	.	H	α-helix	trans	-65.7	-31.7	-179.9	-59.1	0	0	0	0	112.9	H511 L512 G517	H511-S515 WeakPolarHBondContact O-CB 3.44Å; H511-S515 PolarHBondContact O-N 2.69Å; H511-S515 PolarHBondContact O-OG 2.99Å; L512-S515 PolarHBondContact O-N 2.95Å; S515-G517 PolarHBondContact O-N 3.09Å
516	L	81.8	Confident	69.4	Low	44 Å²	44	86.9 Å²	86.9	23%	0.23	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	5.1	175.2	-68.1	168.9	0	0	0	112.9	W239 R240 V243 A244 L512 K513 R514 V518	W239-L516 HydrophobicContact CZ3-CD2 4.34Å; R240-L516 HydrophobicContact CB-CB 4.16Å; R240-L516 HydrophobicContact CB-CD1 4.28Å; R240-L516 VanDerWaalsContact CD-O 3.26Å; R240-L516 WeakPolarHBondContact CD-O 3.17Å; R240-L516 HydrophobicContact CG-CB 4.31Å; R240-L516 VanDerWaalsContact CZ-O 3.27Å; R240-L516 PolarHBondContact NE-O 3.43Å; R240-L516 PolarHBondContact NH1-O 3.01Å; R240-L516 VanDerWaalsContact NH1-O 3.12Å; R240-L516 WeakPolarHBondContact O-CD1 3.39Å; V243-L516 HydrophobicContact CB-CD1 4.21Å; V243-L516 HydrophobicContact CG1-CD1 4.05Å; A244-L516 HydrophobicContact CB-CD1 4.22Å; L512-L516 WeakPolarHBondContact O-CB 2.97Å; L512-L516 WeakPolarHBondContact O-CG 3.22Å; L512-L516 PolarHBondContact O-N 3.04Å; K513-L516 PolarHBondContact O-N 3.23Å; R514-L516 VanDerWaalsContact C-N 3.29Å; R514-L516 PolarHBondContact O-N 3.19Å; L516-V518 VanDerWaalsContact C-N 3.3Å; L516-V518 PolarHBondContact O-N 3.38Å
517	G	74.2	Confident	69.3	Low	48 Å²	48	84.1 Å²	84.1	50%	0.495	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	23.4	178.1	0	0	0	0	0	113.6	K513 R514 S515	K513-G517 PolarHBondContact O-N 3.23Å; R514-G517 PolarHBondContact O-N 2.75Å; S515-G517 PolarHBondContact O-N 3.09Å
518	V	66.9	Low	68.9	Low	13 Å²	13	83.4 Å²	83.4	8%	0.079	41%	0.406	C	S	.	.			trans	-91.1	102	168.3	-177.7	0	0	0	0	106.5	R240 H241 K513 L516 S520	R240-V518 HydrophobicContact CB-CG2 3.57Å; R240-V518 HydrophobicContact CG-CG2 4.28Å; H241-V518 VanDerWaalsContact NE2-CG1 3.35Å; H241-V518 WeakPolarHBondContact NE2-CG1 3.41Å; K513-V518 HydrophobicContact CD-CG1 4.14Å; K513-V518 HydrophobicContact CG-CB 3.56Å; K513-V518 HydrophobicContact CG-CG1 3.64Å; K513-V518 HydrophobicContact CG-CG2 4.48Å; K513-V518 WeakPolarHBondContact O-CB 3.4Å; K513-V518 PolarHBondContact O-N 3Å; L516-V518 VanDerWaalsContact C-N 3.3Å; L516-V518 PolarHBondContact O-N 3.38Å; V518-S520 PolarHBondContact O-N 3.37Å
519	Q	49.7	Very low	68.4	Low	186 Å²	186	87.4 Å²	87.4	87%	0.869	42%	0.422	S	S	*	.			trans	-67.8	121.4	176.7	-71.8	-177.6	-11.1	0	0	109
520	S	39	Very low	67.9	Low	44 Å²	44	89.3 Å²	89.3	31%	0.308	44%	0.437	S	S	.	.			trans	-68.4	126.8	158.5	-88.2	0	0	0	0	106.9	K513 V518	K513-S520 PolarHBondContact NZ-OG 3.36Å; V518-S520 PolarHBondContact O-N 3.37Å
521	R	34.3	Very low	67.4	Low	265 Å²	265	95.3 Å²	95.3	100%	1	47%	0.466	S	S	*	.			trans	-53.1	0	163.4	-84.3	-176.3	177.7	174.1	1.4	110.4	T100	T100-R521 VanDerWaalsContact CB-NH2 3.33Å; T100-R521 PolarHBondContact OG1-NH2 3.44Å

Retrieved 521 of 521 residues in 454.3 ms (Link to these results)

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