A0A087Y1T5_POEFO Loading...

ATP-binding cassette sub-family G member 5

ABCG5 and ABCG8 form an obligate heterodimer that mediates Mg(2+)- and ATP-dependent sterol transport across the cell membrane. Plays an essential role in the selective transport of dietary plant sterols and cholesterol in and out of the enterocytes and in the selective sterol excretion by the liver into bile. Required for normal sterol homeostasis. The heterodimer with ABCG8 has ATPase activity.

AlphaFold DB , UniProt , Accession A0A087Y1T5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 662 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	37.3	Very low	27.7	Very low	245 Å²	245	170.5 Å²	170.5	100%	1.207	88%	0.875	S	S	*	*				0	69.6	0	-140.6	162.1	178	0	0	105.8
2	N	28.2	Very low	27.8	Very low	160 Å²	160	166.8 Å²	166.8	86%	0.856	87%	0.871	S	S	*	*				56.4	124.3	70	-104.5	13.4	0	0	0	115.8
3	R	25.8	Very low	27.6	Very low	235 Å²	235	173 Å²	173	89%	0.887	88%	0.876	S	S	*	*			trans	98.5	110.7	169.7	-65	-178.1	174.1	178.8	-2.8	115.2
4	F	27.4	Very low	27.5	Very low	173 Å²	173	172.1 Å²	172.1	76%	0.759	87%	0.874	S	S	*	*				68.7	121.7	52.6	-92.3	-61.7	0	0	0	117
5	Y	29	Very low	27.5	Very low	196 Å²	196	173.6 Å²	173.6	77%	0.769	88%	0.877	S	S	*	*			trans	59.9	126.9	153.6	-69.2	-66.8	0	0	0	122.1
6	S	24.5	Very low	27.3	Very low	113 Å²	113	170.8 Å²	170.8	79%	0.79	87%	0.871	S	S	*	*				-173.2	131	101.4	56.4	0	0	0	0	113.2
7	L	28.5	Very low	27.3	Very low	170 Å²	170	171.9 Å²	171.9	89%	0.89	87%	0.872	S	S	*	*			trans	-80.2	136.6	160.4	-88.2	143.3	0	0	0	108.2
8	E	25.3	Very low	27.2	Very low	189 Å²	189	168.2 Å²	168.2	88%	0.883	87%	0.872	S	S	*	*			trans	-133.3	127.7	161	-112.7	176.3	176	0	0	109.5
9	A	26.8	Very low	27.1	Very low	107 Å²	107	170.2 Å²	170.2	88%	0.884	88%	0.877	S	S	*	*			trans	-75.9	139.7	177.4	0	0	0	0	0	110.2
10	A	24.5	Very low	26.9	Very low	101 Å²	101	165.1 Å²	165.1	84%	0.835	87%	0.868	S	S	*	*			trans	-121.8	116.8	167.9	0	0	0	0	0	109.2
11	E	27.7	Very low	26.8	Very low	186 Å²	186	162 Å²	162	87%	0.869	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-68.4	158.4	171.2	-83.4	-178.3	160.1	0	0	112.4
12	P	28.8	Very low	26.2	Very low	126 Å²	126	160 Å²	160	82%	0.818	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-85.7	142.3	-166.8	34.3	-32.4	0	0	0	112.3
13	R	24.6	Very low	26	Very low	248 Å²	248	161.3 Å²	161.3	94%	0.936	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-101.7	133.6	166.4	-83.1	-174.8	174.7	-179.8	-0.7	110.6
14	N	26.8	Very low	26	Very low	160 Å²	160	159.7 Å²	159.7	86%	0.856	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-46.5	129.1	171.9	-72.2	-24.7	0	0	0	113.5
15	E	26.6	Very low	26	Very low	195 Å²	195	157.6 Å²	157.6	91%	0.911	84%	0.844	S	S	*	*			trans	-136.5	112.8	146.8	-77	-171.7	165.1	0	0	109.6
16	T	25.3	Very low	25.7	Very low	129 Å²	129	152.3 Å²	152.3	79%	0.791	84%	0.836	S	S	*	*			trans	-78.8	151.4	164.6	29.8	0	0	0	0	110.6
17	E	26.9	Very low	26	Very low	190 Å²	190	154.7 Å²	154.7	89%	0.888	84%	0.835	S	S	*	*			trans	82.8	92	161.7	-66.1	179.9	175.4	0	0	119.5
18	A	25	Very low	25.8	Very low	105 Å²	105	150.6 Å²	150.6	87%	0.868	83%	0.825	S	S	*	*			trans	-154.8	80.8	136.1	0	0	0	0	0	109.4	G20	A18-G20 PolarHBondContact O-N 3.23Å
19	E	25.5	Very low	25.8	Very low	205 Å²	205	149.5 Å²	149.5	96%	0.958	82%	0.817	S	S	*	*			trans	-69.7	105.7	170.5	-79.9	-171.1	145.3	0	0	110.6
20	G	24.3	Very low	25.9	Very low	69 Å²	69	154.4 Å²	154.4	71%	0.711	81%	0.813	S	S	*	*			trans	-125.4	71.6	163.9	0	0	0	0	0	109.7	A18 F22	A18-G20 PolarHBondContact O-N 3.23Å; G20-F22 PolarHBondContact O-N 2.96Å; G20-F22 VanDerWaalsContact O-N 3.1Å
21	S	24	Very low	25.9	Very low	100 Å²	100	156.1 Å²	156.1	70%	0.699	81%	0.808	S	S	*	*			trans	-67.3	100.6	-179.2	-180	0	0	0	0	111.7	K23	S21-K23 PolarHBondContact O-N 2.97Å
22	F	24	Very low	25.8	Very low	202 Å²	202	152.4 Å²	152.4	89%	0.886	80%	0.798	S	S	*	*			trans	-81.2	99.6	156.3	-97.2	-90.4	0	0	0	108.1	G20 F24	G20-F22 PolarHBondContact O-N 2.96Å; G20-F22 VanDerWaalsContact O-N 3.1Å; F22-F24 PolarHBondContact O-N 3.04Å; F22-F24 VanDerWaalsContact O-N 3.12Å
23	K	23.8	Very low	25.8	Very low	188 Å²	188	158.2 Å²	158.2	82%	0.817	80%	0.804	S	S	*	*			trans	-59.7	112.6	176.4	-78.1	179.9	175.7	176	0	110.4	S21 V25	S21-K23 PolarHBondContact O-N 2.97Å; K23-V25 PolarHBondContact O-N 2.75Å
24	F	26.9	Very low	25.8	Very low	201 Å²	201	157.5 Å²	157.5	88%	0.882	80%	0.801	S	S	*	*			trans	-53.4	130.6	157.6	-93.2	-99.6	0	0	0	109.2	F22 S26	F22-F24 PolarHBondContact O-N 3.04Å; F22-F24 VanDerWaalsContact O-N 3.12Å; F24-S26 PolarHBondContact O-N 3.33Å; F24-S26 VanDerWaalsContact O-N 3.1Å
25	V	26.2	Very low	25.8	Very low	130 Å²	130	159.3 Å²	159.3	79%	0.788	80%	0.804	S	S	*	*			trans	-65.2	111.3	173.2	176.3	0	0	0	0	107.6	K23	K23-V25 PolarHBondContact O-N 2.75Å
26	S	24.1	Very low	25.7	Very low	85 Å²	85	153.5 Å²	153.5	59%	0.594	80%	0.796	S	S	*	*			trans	-68.3	148.9	177	58.2	0	0	0	0	111.7	F24 A28	F24-S26 PolarHBondContact O-N 3.33Å; F24-S26 VanDerWaalsContact O-N 3.1Å; S26-A28 PolarHBondContact O-N 3.19Å
27	E	30.1	Very low	25.9	Very low	163 Å²	163	151.8 Å²	151.8	76%	0.762	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-59.3	-4.5	178.8	-71.7	174.2	136	0	0	114.7	K29	E27-K29 VanDerWaalsContact C-N 3.32Å; E27-K29 PolarHBondContact O-N 3.25Å
28	A	24.9	Very low	25.8	Very low	83 Å²	83	145.8 Å²	145.8	69%	0.686	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-80.4	0.7	-177.2	0	0	0	0	0	115.2	S26	S26-A28 PolarHBondContact O-N 3.19Å
29	K	24.9	Very low	25.9	Very low	166 Å²	166	150.9 Å²	150.9	72%	0.722	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-99.9	18.5	178.5	-110.7	-177.8	-177.8	-179.2	0	114.7	E27	E27-K29 VanDerWaalsContact C-N 3.32Å; E27-K29 PolarHBondContact O-N 3.25Å
30	R	28.8	Very low	25.9	Very low	210 Å²	210	144.2 Å²	144.2	79%	0.792	79%	0.786	S	S	*	*	S	Bend	trans	-74	-17.8	175.6	-87.1	-177	-176.7	166.2	3.5	114.7
31	D	25.7	Very low	26.2	Very low	138 Å²	138	152.8 Å²	152.8	74%	0.738	80%	0.797	S	S	*	*	S	Bend	trans	-114.3	4.8	-167.1	-66.2	-36.7	0	0	0	117
32	V	25.1	Very low	26.9	Very low	107 Å²	107	153.5 Å²	153.5	65%	0.648	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	2.9	-171.6	-175.8	0	0	0	0	114.6
33	W	28.7	Very low	28	Very low	249 Å²	249	150.3 Å²	150.3	94%	0.943	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	19.8	177.7	-65.9	97.9	0	0	0	114.2
34	R	25.3	Very low	29.3	Very low	233 Å²	233	144 Å²	144	88%	0.879	77%	0.768	S	S	*	*	S	Bend	trans	-93.1	-6.6	174.4	-129	178.7	-169.6	-171.9	2.7	114.4
35	E	25.9	Very low	31.3	Very low	198 Å²	198	137.4 Å²	137.4	93%	0.925	75%	0.747	S	S	*	*			trans	-124.1	88	177.8	-70.2	-171.9	168.8	0	0	110.6
36	G	24.4	Very low	33.8	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	71%	0.71	S	S	*	*			trans	-165.5	61.5	175.9	0	0	0	0	0	108.9	G38	G36-G38 PolarHBondContact O-N 3.37Å
37	G	29.3	Very low	36.7	Very low	93 Å²	93	127.9 Å²	127.9	96%	0.959	69%	0.686	S	S	*	*			trans	-63.4	101.7	177.4	0	0	0	0	0	111.3
38	G	24	Very low	39.5	Very low	65 Å²	65	120.1 Å²	120.1	67%	0.67	65%	0.649	S	S	*	*			trans	-127.9	122.5	156.4	0	0	0	0	0	107.4	G36 G40	G36-G38 PolarHBondContact O-N 3.37Å; G38-G40 PolarHBondContact O-N 3.14Å
39	E	28	Very low	42.6	Very low	212 Å²	212	116.2 Å²	116.2	99%	0.991	62%	0.617	S	S	*	*			trans	-62.4	77.6	178.1	-69.8	176.5	144.2	0	0	111.3
40	G	26.6	Very low	45.7	Very low	65 Å²	65	108.3 Å²	108.3	67%	0.67	58%	0.583	S	S	*	*			trans	-90.1	117.9	163.8	0	0	0	0	0	108.5	G38 S42	G38-G40 PolarHBondContact O-N 3.14Å; G40-S42 PolarHBondContact O-N 3.2Å
41	R	29.9	Very low	48.6	Very low	248 Å²	248	102.8 Å²	102.8	94%	0.936	56%	0.562	S	S	*	*			trans	-43.4	112.3	168.1	-80.3	173.4	168.1	166.8	-4.3	109.3	E43	R41-E43 PolarHBondContact O-N 3.36Å; R41-E43 VanDerWaalsContact O-N 3.09Å
42	S	37.4	Very low	51.7	Low	116 Å²	116	99.4 Å²	99.4	81%	0.811	54%	0.544	S	S	*	.			trans	-61.9	111.3	174.3	39.1	0	0	0	0	108.7	G40	G40-S42 PolarHBondContact O-N 3.2Å
43	E	47.8	Very low	54.7	Low	135 Å²	135	94.5 Å²	94.5	63%	0.631	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-56.8	139.2	174.8	-75.3	-170.3	153.8	0	0	109.9	R41 S45	R41-E43 PolarHBondContact O-N 3.36Å; R41-E43 VanDerWaalsContact O-N 3.09Å; E43-S45 PolarHBondContact O-N 3.22Å; E43-S45 VanDerWaalsContact O-N 3.16Å
44	P	52.3	Low	57.7	Low	54 Å²	54	82.9 Å²	82.9	35%	0.351	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-62.7	122.7	-177.1	23.1	-31.6	0	0	0	110.3	C46 R223 K362	P44-C46 PolarHBondContact O-N 3.02Å; P44-R223 PolarHBondContact O-NH1 3.38Å; P44-K362 HydrophobicContact CB-CD 4.08Å; P44-K362 HydrophobicContact CB-CG 4.26Å
45	S	67.9	Low	60.8	Low	64 Å²	64	72.7 Å²	72.7	45%	0.448	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-58	129.5	174.2	54.2	0	0	0	0	110.4	E43 K362	E43-S45 PolarHBondContact O-N 3.22Å; E43-S45 VanDerWaalsContact O-N 3.16Å; S45-K362 PolarHBondContact O-NZ 3.16Å; S45-K362 PolarHBondContact OG-NZ 2.85Å
46	C	77.9	Confident	63.7	Low	1 Å²	1	64.7 Å²	64.7	1%	0.007	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-78.6	145.8	175.2	-167.1	0	0	0	0	110.3	P44 S88 N126 I255 I365	P44-C46 PolarHBondContact O-N 3.02Å; C46-S88 VanDerWaalsContact O-CB 3.22Å; C46-S88 WeakPolarHBondContact O-CB 3.32Å; C46-S88 PolarHBondContact O-N 3Å; C46-N126 WeakPolarHBondContact CA-OD1 3.41Å; C46-N126 PolarHBondContact SG-OD1 3.21Å; C46-I255 HydrophobicContact CB-CD1 4.17Å; C46-I365 WeakPolarHBondContact SG-CD1 3.31Å
47	C	85.9	Confident	66.6	Low	13 Å²	13	62.9 Å²	62.9	9%	0.088	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	147.2	168.3	63.4	0	0	0	0	111	I125 N126	C47-I125 WeakPolarHBondContact O-CA 3.42Å; C47-N126 PolarHBondContact N-OD1 2.65Å; C47-N126 PolarHBondContact O-N 2.97Å; C47-N126 VanDerWaalsContact SG-CA 3.59Å
48	L	88.9	Confident	68.8	Low	0 Å²	0	59 Å²	59	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.7	176.8	176.8	71.6	0	0	0	108.6	H85 V86 V123 F124 I125 F139 V224 I255 I257	L48-H85 CarbonylContact O-C 3.57Å; L48-H85 WeakPolarHBondContact O-CA 3.19Å; L48-V86 PolarHBondContact N-O 2.99Å; L48-V86 PolarHBondContact O-N 2.86Å; L48-V123 HydrophobicContact CD1-CG1 3.78Å; L48-F124 WeakPolarHBondContact CA-O 3Å; L48-I125 HydrophobicContact CD1-CG1 3.86Å; L48-F139 HydrophobicContact CD1-CE1 3.79Å; L48-F139 HydrophobicContact CD1-CZ 3.71Å; L48-F139 HydrophobicContact CD2-CE1 4.2Å; L48-V224 HydrophobicContact CD2-CG1 4.23Å; L48-I255 HydrophobicContact CB-CD1 3.92Å; L48-I257 HydrophobicContact CD2-CD1 3.63Å
49	G	89.2	Confident	70.8	Confident	1 Å²	1	62 Å²	62	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134	173.7	0	0	0	0	0	110.6	F124	G49-F124 PolarHBondContact N-O 2.93Å; G49-F124 PolarHBondContact O-N 3.47Å
50	V	90.6	Very high	72.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.8	176.7	174.1	0	0	0	0	107.9	I53 S83 F84 I109 V123	V50-I53 HydrophobicContact CG1-CB 4.28Å; V50-I53 HydrophobicContact CG1-CD1 3.28Å; V50-I53 HydrophobicContact CG1-CG1 3.55Å; V50-S83 CarbonylContact O-C 3.52Å; V50-S83 WeakPolarHBondContact O-CA 3.49Å; V50-F84 HydrophobicContact CB-CD1 3.97Å; V50-F84 HydrophobicContact CB-CE1 3.8Å; V50-F84 HydrophobicContact CB-CE2 4.38Å; V50-F84 HydrophobicContact CB-CG 4.34Å; V50-F84 HydrophobicContact CB-CZ 4.03Å; V50-F84 HydrophobicContact CG1-CD1 4.21Å; V50-F84 HydrophobicContact CG1-CE1 3.91Å; V50-F84 HydrophobicContact CG1-CZ 4.49Å; V50-F84 HydrophobicContact CG2-CD1 4.42Å; V50-F84 HydrophobicContact CG2-CD2 4.49Å; V50-F84 HydrophobicContact CG2-CE1 3.83Å; V50-F84 HydrophobicContact CG2-CE2 3.91Å; V50-F84 HydrophobicContact CG2-CZ 3.56Å; V50-F84 PolarHBondContact N-O 3.25Å; V50-F84 PolarHBondContact O-N 3.39Å; V50-I109 HydrophobicContact CG2-CD1 4.5Å; V50-I109 HydrophobicContact CG2-CG1 4.33Å; V50-V123 HydrophobicContact CG2-CG1 4.45Å; V50-V123 HydrophobicContact CG2-CG2 4.49Å
51	R	90.1	Very high	73.6	Confident	94 Å²	94	60.9 Å²	60.9	36%	0.355	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.3	-177.4	-163.7	172.6	179.7	159.4	5.5	111.9	I53 G121 E122 F124 M353	R51-I53 PolarHBondContact O-N 2.86Å; R51-I53 VanDerWaalsContact O-N 3.17Å; R51-G121 VanDerWaalsContact O-CA 3.29Å; R51-G121 WeakPolarHBondContact O-CA 3.25Å; R51-E122 PolarHBondContact N-O 2.62Å; R51-E122 PolarHBondContact O-N 3.25Å; R51-F124 HydrophobicContact CB-CE2 3.87Å; R51-M353 HydrophobicContact CB-CE 3.55Å; R51-M353 HydrophobicContact CB-SD 4.26Å; R51-M353 HydrophobicContact CG-CE 4.33Å
52	N	90.2	Very high	74.6	Confident	68 Å²	68	51.4 Å²	51.4	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.8	46	168.4	-60.5	-1.7	0	0	0	112.5	S54 V82 S83 G121	N52-S54 PolarHBondContact O-N 3.34Å; N52-V82 PolarHBondContact N-O 2.8Å; N52-S83 PolarHBondContact N-OG 2.61Å; N52-S83 PolarHBondContact OD1-OG 3.43Å; N52-G121 WeakPolarHBondContact O-CA 3.45Å
53	I	89.6	Confident	75.2	Confident	4 Å²	4	51 Å²	51	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	117.1	176.1	-71.8	-170.6	0	0	0	108.9	V50 R51 L79 D81 V82 L105 A108 I109 L119 L120 V123	V50-I53 HydrophobicContact CG1-CB 4.28Å; V50-I53 HydrophobicContact CG1-CD1 3.28Å; V50-I53 HydrophobicContact CG1-CG1 3.55Å; R51-I53 PolarHBondContact O-N 2.86Å; R51-I53 VanDerWaalsContact O-N 3.17Å; I53-L79 HydrophobicContact CG2-CD1 4Å; I53-D81 PolarHBondContact O-N 2.85Å; I53-V82 PolarHBondContact N-O 3.25Å; I53-V82 PolarHBondContact O-N 3.34Å; I53-L105 HydrophobicContact CG2-CD1 4.31Å; I53-A108 HydrophobicContact CG2-CB 4.29Å; I53-I109 HydrophobicContact CD1-CG1 4.25Å; I53-L119 HydrophobicContact CG2-CD1 3.92Å; I53-L120 WeakPolarHBondContact CA-O 3.49Å; I53-V123 HydrophobicContact CD1-CG2 3.81Å
54	S	91.1	Very high	75.5	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.035	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.4	175	-89.6	0	0	0	0	108.7	N52 L79 D81 L120	N52-S54 PolarHBondContact O-N 3.34Å; S54-L79 WeakPolarHBondContact CA-O 3.41Å; S54-D81 PolarHBondContact OG-N 2.93Å; S54-D81 PolarHBondContact OG-OD1 2.77Å; S54-L120 PolarHBondContact N-O 3.29Å; S54-L120 PolarHBondContact O-N 3.03Å
55	Y	89.8	Confident	75.7	Confident	18 Å²	18	59.8 Å²	59.8	7%	0.071	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.1	-178.1	-178.7	-121.5	0	0	0	111.1	V57 I78 L79 T104 I113 L119	Y55-V57 HydrophobicContact CD1-CG2 4.07Å; Y55-V57 HydrophobicContact CE1-CG2 3.22Å; Y55-V57 WeakPolarHBondContact OH-CG2 3.44Å; Y55-I78 HydrophobicContact CD1-CB 4.2Å; Y55-I78 HydrophobicContact CD1-CD1 4.43Å; Y55-I78 HydrophobicContact CE1-CD1 4.32Å; Y55-I78 PolarHBondContact O-N 3.09Å; Y55-L79 PolarHBondContact N-O 3.16Å; Y55-L79 PolarHBondContact O-N 2.84Å; Y55-T104 HydrophobicContact CD1-CG2 3.61Å; Y55-T104 HydrophobicContact CE1-CG2 3.97Å; Y55-I113 HydrophobicContact CD1-CD1 3.95Å; Y55-I113 HydrophobicContact CD2-CD1 3.96Å; Y55-I113 HydrophobicContact CD2-CG2 3.87Å; Y55-I113 HydrophobicContact CE1-CD1 4.08Å; Y55-I113 HydrophobicContact CE1-CG2 4.24Å; Y55-I113 HydrophobicContact CE2-CB 4.5Å; Y55-I113 HydrophobicContact CE2-CD1 4.15Å; Y55-I113 HydrophobicContact CE2-CG2 3.17Å; Y55-I113 HydrophobicContact CG-CD1 3.88Å; Y55-I113 WeakPolarHBondContact OH-CG2 3.29Å; Y55-L119 HydrophobicContact CD2-CB 4.31Å; Y55-L119 HydrophobicContact CD2-CD1 4.36Å
56	T	87.4	Confident	74.6	Confident	31 Å²	31	60.4 Å²	60.4	19%	0.19	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121	177.8	-44.6	0	0	0	0	109.6	R76 G117 T118	T56-R76 WeakPolarHBondContact CA-O 3.24Å; T56-G117 CarbonylContact O-C 3.59Å; T56-G117 WeakPolarHBondContact O-CA 3.47Å; T56-T118 PolarHBondContact N-O 3.31Å; T56-T118 VanDerWaalsContact N-O 3.1Å; T56-T118 PolarHBondContact O-N 3.3Å
57	V	84.6	Confident	73.3	Confident	33 Å²	33	67 Å²	67	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132.8	171.3	175.5	0	0	0	0	108.9	Y55 T75 R76 I78	Y55-V57 HydrophobicContact CD1-CG2 4.07Å; Y55-V57 HydrophobicContact CE1-CG2 3.22Å; Y55-V57 WeakPolarHBondContact OH-CG2 3.44Å; V57-T75 CarbonylContact O-C 3.15Å; V57-T75 WeakPolarHBondContact O-CA 3.33Å; V57-R76 PolarHBondContact N-O 3.03Å; V57-R76 PolarHBondContact O-N 3.23Å; V57-I78 HydrophobicContact CB-CD1 4.03Å; V57-I78 HydrophobicContact CG2-CD1 3.28Å; V57-I78 HydrophobicContact CG2-CG1 4.06Å
58	S	75.3	Confident	71.7	Confident	13 Å²	13	71.4 Å²	71.4	9%	0.091	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.4	167.5	70.6	0	0	0	0	109.5	R73 W74 S116	S58-R73 PolarHBondContact OG-NE 2.83Å; S58-R73 PolarHBondContact OG-NH2 3.11Å; S58-W74 WeakPolarHBondContact CA-O 3.46Å; S58-S116 PolarHBondContact N-O 3.08Å; S58-S116 VanDerWaalsContact N-O 3.12Å; S58-S116 PolarHBondContact O-OG 3.45Å; S58-S116 VanDerWaalsContact O-OG 3.07Å; S58-S116 PolarHBondContact OG-O 3.35Å
59	E	67.1	Low	69.8	Low	128 Å²	128	76.9 Å²	76.9	60%	0.598	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.9	178.9	-161.8	171.8	-170.6	0	0	109.7	V61 W74	E59-V61 HydrophobicContact CB-CG2 4.49Å; E59-V61 HydrophobicContact CG-CG2 4.23Å; E59-W74 PolarHBondContact N-O 3.46Å; E59-W74 PolarHBondContact O-N 2.97Å; E59-W74 VanDerWaalsContact O-N 3.08Å
60	R	61.5	Low	67.8	Low	164 Å²	164	82.4 Å²	82.4	62%	0.619	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	88.9	175.6	-66.3	-172.8	-169.6	-174.2	3	108.3
61	V	51.2	Low	66.1	Low	89 Å²	89	86.7 Å²	86.7	54%	0.539	44%	0.441	S	S	.	.			trans	-81.8	122.9	176.9	-170.3	0	0	0	0	109	E59	E59-V61 HydrophobicContact CB-CG2 4.49Å; E59-V61 HydrophobicContact CG-CG2 4.23Å
62	G	51.6	Low	64.4	Low	48 Å²	48	90.3 Å²	90.3	50%	0.495	46%	0.459	S	S	.	.	S	Bend	trans	172.1	157.3	178.1	0	0	0	0	0	112.3
63	Q	50.4	Low	63.1	Low	107 Å²	107	94.8 Å²	94.8	50%	0.5	47%	0.471	S	S	.	.			trans	-65.6	148.9	176.1	-74.9	165.2	-17	0	0	110.5	W65 D66	Q63-W65 HydrophobicContact CB-CD2 3.82Å; Q63-W65 HydrophobicContact CB-CE3 4.14Å; Q63-W65 HydrophobicContact CB-CG 4.42Å; Q63-W65 HydrophobicContact CB-CH2 4.01Å; Q63-W65 HydrophobicContact CB-CZ2 3.7Å; Q63-W65 HydrophobicContact CB-CZ3 4.21Å; Q63-W65 HydrophobicContact CG-CH2 3.85Å; Q63-W65 HydrophobicContact CG-CZ2 3.65Å; Q63-W65 HydrophobicContact CG-CZ3 4.44Å; Q63-W65 PolarHBondContact O-N 2.9Å; Q63-W65 VanDerWaalsContact OE1-NE1 3.17Å; Q63-D66 PolarHBondContact O-N 3.23Å; Q63-D66 VanDerWaalsContact O-N 3.11Å
64	W	53	Low	62.2	Low	224 Å²	224	103 Å²	103	85%	0.848	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.6	-173.4	63.4	-74.2	0	0	0	114.2
65	W	56.9	Low	61.5	Low	150 Å²	150	107.3 Å²	107.3	57%	0.568	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-4.7	178.5	57.1	79.5	0	0	0	115.3	Q63 L67	Q63-W65 HydrophobicContact CB-CD2 3.82Å; Q63-W65 HydrophobicContact CB-CE3 4.14Å; Q63-W65 HydrophobicContact CB-CG 4.42Å; Q63-W65 HydrophobicContact CB-CH2 4.01Å; Q63-W65 HydrophobicContact CB-CZ2 3.7Å; Q63-W65 HydrophobicContact CB-CZ3 4.21Å; Q63-W65 HydrophobicContact CG-CH2 3.85Å; Q63-W65 HydrophobicContact CG-CZ2 3.65Å; Q63-W65 HydrophobicContact CG-CZ3 4.44Å; Q63-W65 PolarHBondContact O-N 2.9Å; Q63-W65 VanDerWaalsContact OE1-NE1 3.17Å; W65-L67 PolarHBondContact O-N 2.94Å
66	D	45.1	Very low	61.2	Low	78 Å²	78	114.6 Å²	114.6	42%	0.417	56%	0.555	S	S	.	*	S	Bend	trans	-82.4	121.6	-179.9	-74.8	-32.2	0	0	0	111.9	Q63	Q63-D66 PolarHBondContact O-N 3.23Å; Q63-D66 VanDerWaalsContact O-N 3.11Å
67	L	50.6	Low	61.1	Low	139 Å²	139	118 Å²	118	73%	0.728	57%	0.569	S	S	*	*			trans	-47.8	146	-179.4	-74	159.7	0	0	0	112.7	W65 S69 C70	W65-L67 PolarHBondContact O-N 2.94Å; L67-S69 PolarHBondContact O-N 3.24Å; L67-C70 PolarHBondContact O-N 2.66Å
68	P	52.4	Low	61.3	Low	106 Å²	106	118.7 Å²	118.7	69%	0.688	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-60.7	-18.2	-171.6	20.2	-30.9	0	0	0	115.4
69	S	49.2	Very low	62	Low	115 Å²	115	118.1 Å²	118.1	80%	0.804	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-82.1	-11.8	-175.5	-51.5	0	0	0	0	115.1	L67	L67-S69 PolarHBondContact O-N 3.24Å
70	C	47	Very low	63.1	Low	116 Å²	116	114 Å²	114	78%	0.784	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-121	19.4	-176.8	-77.9	0	0	0	0	114.4	L67 K72	L67-C70 PolarHBondContact O-N 2.66Å; C70-K72 PolarHBondContact O-N 3.07Å
71	R	53.7	Low	64.5	Low	91 Å²	91	111 Å²	111	34%	0.343	55%	0.545	S	S	.	.			trans	-80.9	115	174.6	-71.5	-168.2	-173.1	-171.1	2.2	110.7	R73	R71-R73 PolarHBondContact O-N 2.99Å; R71-R73 VanDerWaalsContact O-N 3.11Å
72	K	55.8	Low	66.4	Low	169 Å²	169	106.7 Å²	106.7	74%	0.735	52%	0.519	S	S	*	.			trans	-64	111.1	165.7	-75.6	-175	178.9	179.6	0	108.4	C70 W74	C70-K72 PolarHBondContact O-N 3.07Å; K72-W74 PolarHBondContact O-N 3.3Å
73	R	61.9	Low	68.3	Low	162 Å²	162	104.5 Å²	104.5	61%	0.611	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	110.7	174.4	-168.1	176	-173	179.4	-3.6	107.7	S58 R71	S58-R73 PolarHBondContact OG-NE 2.83Å; S58-R73 PolarHBondContact OG-NH2 3.11Å; R71-R73 PolarHBondContact O-N 2.99Å; R71-R73 VanDerWaalsContact O-N 3.11Å
74	W	69.6	Low	70.3	Confident	178 Å²	178	99.5 Å²	99.5	67%	0.674	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.7	172.4	-88.7	73.9	0	0	0	108.4	S58 E59 K72	S58-W74 WeakPolarHBondContact CA-O 3.46Å; E59-W74 PolarHBondContact N-O 3.46Å; E59-W74 PolarHBondContact O-N 2.97Å; E59-W74 VanDerWaalsContact O-N 3.08Å; K72-W74 PolarHBondContact O-N 3.3Å
75	T	77.6	Confident	72.2	Confident	94 Å²	94	89 Å²	89	58%	0.577	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.6	174.1	50.2	0	0	0	0	108.9	V57	V57-T75 CarbonylContact O-C 3.15Å; V57-T75 WeakPolarHBondContact O-CA 3.33Å
76	R	82.9	Confident	73.9	Confident	172 Å²	172	81.9 Å²	81.9	65%	0.649	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.4	175.5	-177.4	176.2	176.9	178.6	-0.8	108.9	T56 V57	T56-R76 WeakPolarHBondContact CA-O 3.24Å; V57-R76 PolarHBondContact N-O 3.03Å; V57-R76 PolarHBondContact O-N 3.23Å
77	Q	85.7	Confident	76	Confident	103 Å²	103	80.7 Å²	80.7	48%	0.481	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	127.2	170.7	-159.5	172.5	-14.5	0	0	108.8	L79 N80	Q77-L79 WeakPolarHBondContact CG-O 3.47Å; Q77-L79 PolarHBondContact NE2-O 2.91Å; Q77-N80 WeakPolarHBondContact CG-OD1 3.49Å; Q77-N80 PolarHBondContact NE2-OD1 2.71Å
78	I	87.9	Confident	77.9	Confident	47 Å²	47	75 Å²	75	24%	0.241	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-35.2	-178.7	-56.9	-171.4	0	0	0	111	Y55 V57 T104 G280	Y55-I78 HydrophobicContact CD1-CB 4.2Å; Y55-I78 HydrophobicContact CD1-CD1 4.43Å; Y55-I78 HydrophobicContact CE1-CD1 4.32Å; Y55-I78 PolarHBondContact O-N 3.09Å; V57-I78 HydrophobicContact CB-CD1 4.03Å; V57-I78 HydrophobicContact CG2-CD1 3.28Å; V57-I78 HydrophobicContact CG2-CG1 4.06Å; I78-T104 HydrophobicContact CG2-CG2 3.87Å; I78-G280 WeakPolarHBondContact O-CA 3.47Å
79	L	90.6	Very high	79.6	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.5	176.1	-60.7	174	0	0	0	110	I53 S54 Y55 Q77 T104 L105 A108 M277 G280	I53-L79 HydrophobicContact CG2-CD1 4Å; S54-L79 WeakPolarHBondContact CA-O 3.41Å; Y55-L79 PolarHBondContact N-O 3.16Å; Y55-L79 PolarHBondContact O-N 2.84Å; Q77-L79 WeakPolarHBondContact CG-O 3.47Å; Q77-L79 PolarHBondContact NE2-O 2.91Å; L79-T104 HydrophobicContact CD1-CG2 4.22Å; L79-T104 HydrophobicContact CG-CG2 4.4Å; L79-L105 HydrophobicContact CD1-CB 4.21Å; L79-L105 HydrophobicContact CD1-CD1 4.25Å; L79-L105 HydrophobicContact CD2-CB 4.18Å; L79-A108 HydrophobicContact CD1-CB 4.36Å; L79-M277 HydrophobicContact CD2-CE 3.73Å; L79-G280 WeakPolarHBondContact CA-O 3.25Å
80	N	91.1	Very high	81.7	Confident	42 Å²	42	68.2 Å²	68.2	23%	0.225	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	102.2	-176.2	-64.4	-3.1	0	0	0	109.4	Q77 V82 G280 E281	Q77-N80 WeakPolarHBondContact CG-OD1 3.49Å; Q77-N80 PolarHBondContact NE2-OD1 2.71Å; N80-V82 PolarHBondContact O-N 3.43Å; N80-V82 VanDerWaalsContact O-N 3.16Å; N80-G280 PolarHBondContact N-O 3.44Å; N80-E281 HydrophobicContact CB-CG 3.53Å; N80-E281 PolarHBondContact ND2-OE1 2.92Å
81	D	89.6	Confident	83.9	Confident	100 Å²	100	62.9 Å²	62.9	54%	0.535	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	42	52.6	169.6	-63.4	-28.8	0	0	0	115.2	I53 S54	I53-D81 PolarHBondContact O-N 2.85Å; S54-D81 PolarHBondContact OG-N 2.93Å; S54-D81 PolarHBondContact OG-OD1 2.77Å
82	V	91.8	Very high	85.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.6	-179.9	178.6	0	0	0	0	110.5	N52 I53 N80 F84 L105 M277 L282	N52-V82 PolarHBondContact N-O 2.8Å; I53-V82 PolarHBondContact N-O 3.25Å; I53-V82 PolarHBondContact O-N 3.34Å; N80-V82 PolarHBondContact O-N 3.43Å; N80-V82 VanDerWaalsContact O-N 3.16Å; V82-F84 HydrophobicContact CG1-CD1 4.09Å; V82-F84 HydrophobicContact CG1-CE1 4.4Å; V82-L105 HydrophobicContact CB-CD1 4.3Å; V82-L105 HydrophobicContact CG1-CD1 3.98Å; V82-L105 HydrophobicContact CG1-CD2 4Å; V82-M277 HydrophobicContact CG2-CE 4.32Å; V82-L282 HydrophobicContact CG1-CB 4.21Å; V82-L282 HydrophobicContact CG1-CD2 4.45Å; V82-L282 HydrophobicContact CG2-CB 4.46Å
83	S	92.3	Very high	87.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.5	177.3	-65.3	0	0	0	0	111.7	V50 N52 L282 M349	V50-S83 CarbonylContact O-C 3.52Å; V50-S83 WeakPolarHBondContact O-CA 3.49Å; N52-S83 PolarHBondContact N-OG 2.61Å; N52-S83 PolarHBondContact OD1-OG 3.43Å; S83-L282 WeakPolarHBondContact O-CD2 3.33Å; S83-M349 WeakPolarHBondContact O-CE 3.3Å
84	F	92.4	Very high	89.3	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	164.2	174.4	66.3	-92.9	0	0	0	112.3	V50 V82 V86 M92 L105 I109 I257	V50-F84 HydrophobicContact CB-CD1 3.97Å; V50-F84 HydrophobicContact CB-CE1 3.8Å; V50-F84 HydrophobicContact CB-CE2 4.38Å; V50-F84 HydrophobicContact CB-CG 4.34Å; V50-F84 HydrophobicContact CB-CZ 4.03Å; V50-F84 HydrophobicContact CG1-CD1 4.21Å; V50-F84 HydrophobicContact CG1-CE1 3.91Å; V50-F84 HydrophobicContact CG1-CZ 4.49Å; V50-F84 HydrophobicContact CG2-CD1 4.42Å; V50-F84 HydrophobicContact CG2-CD2 4.49Å; V50-F84 HydrophobicContact CG2-CE1 3.83Å; V50-F84 HydrophobicContact CG2-CE2 3.91Å; V50-F84 HydrophobicContact CG2-CZ 3.56Å; V50-F84 PolarHBondContact N-O 3.25Å; V50-F84 PolarHBondContact O-N 3.39Å; V82-F84 HydrophobicContact CG1-CD1 4.09Å; V82-F84 HydrophobicContact CG1-CE1 4.4Å; F84-V86 HydrophobicContact CD2-CG2 3.87Å; F84-V86 HydrophobicContact CE2-CG2 3.97Å; F84-M92 HydrophobicContact CB-CE 4.08Å; F84-M92 HydrophobicContact CD2-CE 3.72Å; F84-M92 HydrophobicContact CD2-SD 3.7Å; F84-M92 HydrophobicContact CE2-CE 4.28Å; F84-M92 HydrophobicContact CE2-SD 3.81Å; F84-M92 HydrophobicContact CG-CE 3.9Å; F84-M92 HydrophobicContact CG-SD 4.45Å; F84-L105 HydrophobicContact CE1-CD2 4.14Å; F84-I109 HydrophobicContact CE1-CD1 3.96Å; F84-I109 HydrophobicContact CZ-CD1 3.57Å; F84-I257 HydrophobicContact CE2-CD1 4.02Å; F84-I257 HydrophobicContact CZ-CD1 4.36Å
85	H	91.8	Very high	90.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.019	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.8	-179.4	-178.6	116.2	0	0	0	111	L48 D87 R273 M349	L48-H85 CarbonylContact O-C 3.57Å; L48-H85 WeakPolarHBondContact O-CA 3.19Å; H85-D87 IonicContact CD2-OD1 3.2Å; H85-D87 IonicContact CD2-OD2 3.8Å; H85-D87 IonicContact CE1-OD1 2.66Å; H85-D87 IonicContact NE2-OD1 3.31Å; H85-D87 PolarHBondContact NE2-OD1 2.62Å; H85-D87 IonicContact NE2-OD2 2.77Å; H85-R273 PolarHBondContact O-NH1 3.47Å; H85-M349 HydrophobicContact CB-CG 4.26Å
86	V	91.9	Very high	91	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.3	175.1	-167.3	0	0	0	0	110.9	L48 F84 Q90 M92 I255 I257	L48-V86 PolarHBondContact N-O 2.99Å; L48-V86 PolarHBondContact O-N 2.86Å; F84-V86 HydrophobicContact CD2-CG2 3.87Å; F84-V86 HydrophobicContact CE2-CG2 3.97Å; V86-Q90 HydrophobicContact CG1-CB 3.97Å; V86-M92 HydrophobicContact CG2-CB 4.26Å; V86-M92 HydrophobicContact CG2-CG 4.43Å; V86-M92 HydrophobicContact CG2-SD 3.34Å; V86-M92 WeakPolarHBondContact CG2-SD 3.22Å; V86-I255 HydrophobicContact CB-CG2 4.14Å; V86-I255 HydrophobicContact CG1-CG2 3.76Å; V86-I257 HydrophobicContact CG2-CD1 4.42Å
87	D	90.4	Very high	91.1	Very high	53 Å²	53	25.3 Å²	25.3	28%	0.283	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.7	175.6	-62.5	-54.4	0	0	0	111.8	H85 Q90	H85-D87 IonicContact CD2-OD1 3.2Å; H85-D87 IonicContact CD2-OD2 3.8Å; H85-D87 IonicContact CE1-OD1 2.66Å; H85-D87 IonicContact NE2-OD1 3.31Å; H85-D87 PolarHBondContact NE2-OD1 2.62Å; H85-D87 IonicContact NE2-OD2 2.77Å; D87-Q90 HydrophobicContact CB-CG 4.42Å; D87-Q90 VanDerWaalsContact O-CB 3.25Å; D87-Q90 WeakPolarHBondContact O-CB 3.49Å; D87-Q90 WeakPolarHBondContact O-CG 3.44Å; D87-Q90 PolarHBondContact O-N 3.35Å; D87-Q90 VanDerWaalsContact O-N 3.15Å
88	S	89.4	Confident	91.1	Very high	19 Å²	19	25 Å²	25	13%	0.133	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	140.1	172.5	-165.7	0	0	0	0	111.4	C46 Q90 N253 R254	C46-S88 VanDerWaalsContact O-CB 3.22Å; C46-S88 WeakPolarHBondContact O-CB 3.32Å; C46-S88 PolarHBondContact O-N 3Å; S88-Q90 VanDerWaalsContact C-N 3.33Å; S88-N253 VanDerWaalsContact CB-OD1 3.3Å; S88-N253 WeakPolarHBondContact CB-OD1 3.44Å; S88-N253 WeakPolarHBondContact OG-CA 3.28Å; S88-N253 PolarHBondContact OG-O 3.37Å; S88-N253 PolarHBondContact OG-OD1 3.19Å; S88-R254 PolarHBondContact OG-N 2.88Å
89	G	89.6	Confident	90.9	Very high	31 Å²	31	26.3 Å²	26.3	32%	0.32	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-16	-171.1	0	0	0	0	0	113.6	A250 R254	G89-A250 WeakPolarHBondContact CA-O 3.33Å; G89-R254 PolarHBondContact N-O 3.25Å
90	Q	92.1	Very high	90.7	Very high	49 Å²	49	26.5 Å²	26.5	23%	0.229	18%	0.176	C	C	.	.			trans	-98	143.7	-177	-60.4	178.9	-18.8	0	0	112.2	V86 D87 S88 V256	V86-Q90 HydrophobicContact CG1-CB 3.97Å; D87-Q90 HydrophobicContact CB-CG 4.42Å; D87-Q90 VanDerWaalsContact O-CB 3.25Å; D87-Q90 WeakPolarHBondContact O-CB 3.49Å; D87-Q90 WeakPolarHBondContact O-CG 3.44Å; D87-Q90 PolarHBondContact O-N 3.35Å; D87-Q90 VanDerWaalsContact O-N 3.15Å; S88-Q90 VanDerWaalsContact C-N 3.33Å; Q90-V256 PolarHBondContact O-N 3.11Å
91	I	94.4	Very high	90.5	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.2	167.1	-179.8	173.5	0	0	0	109.2	L246 A247 A250 V256 V258 V270 F271 S272 R273	I91-L246 HydrophobicContact CD1-CB 4.01Å; I91-A247 HydrophobicContact CD1-CB 4.37Å; I91-A247 HydrophobicContact CG2-CB 4.32Å; I91-A250 HydrophobicContact CB-CB 4.19Å; I91-V256 CarbonylContact C-O 3.6Å; I91-V256 WeakPolarHBondContact CA-O 3.46Å; I91-V256 HydrophobicContact CG1-CB 4.34Å; I91-V256 HydrophobicContact CG1-CG1 4.32Å; I91-V258 HydrophobicContact CD1-CG2 4.43Å; I91-V270 VanDerWaalsContact CG2-O 3.27Å; I91-V270 WeakPolarHBondContact CG2-O 3.49Å; I91-F271 HydrophobicContact CD1-CD1 4.25Å; I91-F271 HydrophobicContact CD1-CE1 4.02Å; I91-F271 HydrophobicContact CG1-CD1 4.04Å; I91-F271 HydrophobicContact CG1-CE1 4.18Å; I91-S272 PolarHBondContact N-OG 3.11Å; I91-S272 WeakPolarHBondContact O-CB 3.21Å; I91-S272 PolarHBondContact O-N 3.41Å; I91-R273 PolarHBondContact O-N 2.9Å; I91-R273 VanDerWaalsContact O-N 3.11Å
92	M	94.8	Very high	90.6	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123	178.9	-174.6	176.5	-164.7	0	0	110.5	F84 V86 V256 I257 V258 R273 A275 C285	F84-M92 HydrophobicContact CB-CE 4.08Å; F84-M92 HydrophobicContact CD2-CE 3.72Å; F84-M92 HydrophobicContact CD2-SD 3.7Å; F84-M92 HydrophobicContact CE2-CE 4.28Å; F84-M92 HydrophobicContact CE2-SD 3.81Å; F84-M92 HydrophobicContact CG-CE 3.9Å; F84-M92 HydrophobicContact CG-SD 4.45Å; V86-M92 HydrophobicContact CG2-CB 4.26Å; V86-M92 HydrophobicContact CG2-CG 4.43Å; V86-M92 HydrophobicContact CG2-SD 3.34Å; V86-M92 WeakPolarHBondContact CG2-SD 3.22Å; M92-V256 PolarHBondContact N-O 2.8Å; M92-I257 HydrophobicContact CB-CG1 4.31Å; M92-I257 WeakPolarHBondContact O-CA 3.48Å; M92-V258 PolarHBondContact O-N 3.28Å; M92-R273 CarbonylContact C-O 3.53Å; M92-R273 VanDerWaalsContact CA-O 3.3Å; M92-R273 WeakPolarHBondContact CA-O 3.37Å; M92-R273 HydrophobicContact CB-CB 4.49Å; M92-R273 HydrophobicContact CG-CB 4.26Å; M92-A275 HydrophobicContact CE-CB 3.48Å; M92-A275 VanDerWaalsContact CE-CB 3.48Å; M92-C285 VanDerWaalsContact CE-SG 3.59Å
93	G	94.6	Very high	90.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.5	172.3	0	0	0	0	0	111.3	V258 R273 I274 A275	G93-V258 CarbonylContact C-O 3.43Å; G93-V258 WeakPolarHBondContact CA-O 3.12Å; G93-R273 PolarHBondContact N-O 3.36Å; G93-I274 CarbonylContact O-C 3.42Å; G93-I274 WeakPolarHBondContact O-CA 3.29Å; G93-A275 PolarHBondContact O-N 3.42Å
94	I	94.5	Very high	90.4	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.3	173.7	-55.5	176	0	0	0	108.5	K102 L105 L106 I257 V258 T259 I260 A275 M277	I94-K102 HydrophobicContact CG2-CB 4.46Å; I94-K102 HydrophobicContact CG2-CD 4.42Å; I94-K102 HydrophobicContact CG2-CG 4Å; I94-L105 HydrophobicContact CD1-CD2 4.25Å; I94-L106 HydrophobicContact CD1-CD2 4.21Å; I94-I257 HydrophobicContact CD1-CG2 3.54Å; I94-I257 HydrophobicContact CG1-CG2 4.03Å; I94-V258 PolarHBondContact N-O 3.01Å; I94-T259 HydrophobicContact CB-CG2 3.97Å; I94-T259 HydrophobicContact CD1-CG2 4.34Å; I94-T259 HydrophobicContact CG2-CG2 4.29Å; I94-T259 WeakPolarHBondContact O-CA 3.39Å; I94-I260 PolarHBondContact O-N 3.31Å; I94-A275 CarbonylContact C-O 3.52Å; I94-A275 WeakPolarHBondContact CA-O 3.3Å; I94-M277 HydrophobicContact CG2-CG 3.98Å; I94-M277 HydrophobicContact CG2-SD 3.71Å
95	L	92.7	Very high	90.3	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	160.1	179.7	-66.1	100.4	0	0	0	111.6	P263 I274 A275 M277 F309 V313	L95-P263 HydrophobicContact CD2-CG 3.43Å; L95-P263 VanDerWaalsContact CD2-CG 3.43Å; L95-P263 HydrophobicContact CG-CG 4.38Å; L95-I274 HydrophobicContact CD1-CG2 3.48Å; L95-I274 VanDerWaalsContact CD1-CG2 3.48Å; L95-A275 PolarHBondContact N-O 3Å; L95-M277 PolarHBondContact O-N 2.93Å; L95-F309 HydrophobicContact CD1-CD1 4.08Å; L95-F309 HydrophobicContact CD1-CE1 3.99Å; L95-F309 HydrophobicContact CD2-CB 3.9Å; L95-F309 HydrophobicContact CD2-CD1 3.35Å; L95-F309 HydrophobicContact CD2-CE1 3.98Å; L95-F309 HydrophobicContact CD2-CG 3.91Å; L95-F309 HydrophobicContact CG-CD1 4.39Å; L95-V313 HydrophobicContact CB-CG2 3.99Å; L95-V313 HydrophobicContact CD2-CG2 4.3Å
96	G	90	Very high	90.3	Very high	7 Å²	7	24.1 Å²	24.1	7%	0.072	17%	0.168	C	C	.	.			trans	154.2	163.6	174.1	0	0	0	0	0	112	K102 M277	G96-K102 WeakPolarHBondContact O-CE 3.17Å; G96-K102 PolarHBondContact O-NZ 3.1Å; G96-M277 WeakPolarHBondContact CA-O 3.42Å
97	N	86.3	Confident	90.1	Very high	63 Å²	63	26 Å²	26	34%	0.337	18%	0.178	S	C	.	.			trans	-65.5	165.3	-179.9	-82.7	9.5	0	0	0	113.5	G99 S100 K102 V313 S317	N97-G99 PolarHBondContact O-N 3.23Å; N97-S100 VanDerWaalsContact O-CB 3.26Å; N97-S100 WeakPolarHBondContact O-CB 3.39Å; N97-S100 PolarHBondContact O-N 2.64Å; N97-S100 VanDerWaalsContact O-N 3.1Å; N97-S100 PolarHBondContact O-OG 2.98Å; N97-K102 PolarHBondContact O-NZ 3.27Å; N97-V313 WeakPolarHBondContact OD1-CG1 3.49Å; N97-S317 WeakPolarHBondContact ND2-CB 3.35Å
98	S	85.7	Confident	90	Very high	97 Å²	97	23.6 Å²	23.6	68%	0.678	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	130.9	171.4	-58.2	0	0	0	0	110.1	H261	S98-H261 PolarHBondContact OG-NE2 3.1Å
99	G	82.8	Confident	90	Very high	74 Å²	74	22.7 Å²	22.7	76%	0.763	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	10.2	-176.7	0	0	0	0	0	115.7	N97 G101	N97-G99 PolarHBondContact O-N 3.23Å; G99-G101 VanDerWaalsContact C-N 3.26Å; G99-G101 PolarHBondContact O-N 3.23Å
100	S	86	Confident	89.7	Confident	4 Å²	4	21.4 Å²	21.4	3%	0.028	15%	0.145	C	C	.	.	S	Bend	trans	-76	-6.4	176.1	67	0	0	0	0	115.4	N97 K102 M277 G280	N97-S100 VanDerWaalsContact O-CB 3.26Å; N97-S100 WeakPolarHBondContact O-CB 3.39Å; N97-S100 PolarHBondContact O-N 2.64Å; N97-S100 VanDerWaalsContact O-N 3.1Å; N97-S100 PolarHBondContact O-OG 2.98Å; S100-K102 WeakPolarHBondContact OG-CG 3.38Å; S100-K102 PolarHBondContact OG-NZ 3.01Å; S100-M277 WeakPolarHBondContact CB-O 3.2Å; S100-M277 PolarHBondContact OG-O 3.17Å; S100-G280 WeakPolarHBondContact O-CA 3.33Å; S100-G280 PolarHBondContact O-N 3.12Å
101	G	87.6	Confident	89.2	Confident	8 Å²	8	20 Å²	20	8%	0.082	14%	0.144	C	C	.	.	S	Bend	trans	96.3	6.8	179	0	0	0	0	0	115.6	G99 T104 L105	G99-G101 VanDerWaalsContact C-N 3.26Å; G99-G101 PolarHBondContact O-N 3.23Å; G101-T104 PolarHBondContact O-N 2.86Å; G101-L105 WeakPolarHBondContact O-CB 3.41Å; G101-L105 PolarHBondContact O-N 2.82Å
102	K	91.1	Very high	88.4	Confident	9 Å²	9	22.1 Å²	22.1	4%	0.039	15%	0.152	C	C	.	.	H	α-helix	trans	-51.1	-60	179.7	-64.6	-174.8	-57.4	-69.9	0	114	I94 G96 N97 S100 T104 L105 L106 T259 M277	I94-K102 HydrophobicContact CG2-CB 4.46Å; I94-K102 HydrophobicContact CG2-CD 4.42Å; I94-K102 HydrophobicContact CG2-CG 4Å; G96-K102 WeakPolarHBondContact O-CE 3.17Å; G96-K102 PolarHBondContact O-NZ 3.1Å; N97-K102 PolarHBondContact O-NZ 3.27Å; S100-K102 WeakPolarHBondContact OG-CG 3.38Å; S100-K102 PolarHBondContact OG-NZ 3.01Å; K102-T104 VanDerWaalsContact C-N 3.29Å; K102-T104 PolarHBondContact O-N 2.76Å; K102-L105 WeakPolarHBondContact O-CB 3.48Å; K102-L105 PolarHBondContact O-N 2.98Å; K102-L106 PolarHBondContact O-N 3.11Å; K102-T259 HydrophobicContact CB-CG2 3.77Å; K102-M277 HydrophobicContact CG-SD 4.4Å
103	T	89.7	Confident	87.5	Confident	45 Å²	45	22.9 Å²	22.9	28%	0.276	16%	0.156	S	C	.	.	H	α-helix	trans	-61.5	-40.7	179.4	-54.3	0	0	0	0	110.8	L105 L106 D107 D228	T103-L105 VanDerWaalsContact C-N 3.33Å; T103-L105 PolarHBondContact O-N 3.38Å; T103-L106 PolarHBondContact O-N 3.41Å; T103-D107 WeakPolarHBondContact O-CB 3.18Å; T103-D107 PolarHBondContact O-N 3.04Å; T103-D228 WeakPolarHBondContact CG2-OD2 3.4Å; T103-D228 PolarHBondContact OG1-OD1 2.98Å; T103-D228 PolarHBondContact OG1-OD2 3.34Å
104	T	90.1	Very high	86.1	Confident	35 Å²	35	23.6 Å²	23.6	22%	0.215	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-37.5	176.7	-48.1	0	0	0	0	112.5	Y55 I78 L79 G101 K102 A108 I113	Y55-T104 HydrophobicContact CD1-CG2 3.61Å; Y55-T104 HydrophobicContact CE1-CG2 3.97Å; I78-T104 HydrophobicContact CG2-CG2 3.87Å; L79-T104 HydrophobicContact CD1-CG2 4.22Å; L79-T104 HydrophobicContact CG-CG2 4.4Å; G101-T104 PolarHBondContact O-N 2.86Å; K102-T104 VanDerWaalsContact C-N 3.29Å; K102-T104 PolarHBondContact O-N 2.76Å; T104-A108 WeakPolarHBondContact O-CB 3.28Å; T104-A108 PolarHBondContact O-N 2.71Å; T104-I113 HydrophobicContact CG2-CD1 4.26Å
105	L	91.6	Very high	84.6	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-46.2	174.5	177	65.5	0	0	0	111	I53 L79 V82 F84 I94 G101 K102 T103 D107 A108 I109 M277	I53-L105 HydrophobicContact CG2-CD1 4.31Å; L79-L105 HydrophobicContact CD1-CB 4.21Å; L79-L105 HydrophobicContact CD1-CD1 4.25Å; L79-L105 HydrophobicContact CD2-CB 4.18Å; V82-L105 HydrophobicContact CB-CD1 4.3Å; V82-L105 HydrophobicContact CG1-CD1 3.98Å; V82-L105 HydrophobicContact CG1-CD2 4Å; F84-L105 HydrophobicContact CE1-CD2 4.14Å; I94-L105 HydrophobicContact CD1-CD2 4.25Å; G101-L105 WeakPolarHBondContact O-CB 3.41Å; G101-L105 PolarHBondContact O-N 2.82Å; K102-L105 WeakPolarHBondContact O-CB 3.48Å; K102-L105 PolarHBondContact O-N 2.98Å; T103-L105 VanDerWaalsContact C-N 3.33Å; T103-L105 PolarHBondContact O-N 3.38Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 3.48Å; L105-A108 WeakPolarHBondContact O-CB 3.44Å; L105-A108 PolarHBondContact O-N 2.84Å; L105-I109 HydrophobicContact CD1-CD1 4Å; L105-I109 HydrophobicContact CD1-CG1 4.36Å; L105-I109 HydrophobicContact CG-CD1 3.82Å; L105-I109 WeakPolarHBondContact O-CD1 3.47Å; L105-I109 VanDerWaalsContact O-CG1 3.25Å; L105-I109 WeakPolarHBondContact O-CG1 3.16Å; L105-I109 PolarHBondContact O-N 2.97Å; L105-M277 HydrophobicContact CB-CE 4.02Å; L105-M277 HydrophobicContact CB-SD 4.16Å; L105-M277 HydrophobicContact CD2-CE 3.77Å; L105-M277 HydrophobicContact CD2-SD 3.4Å; L105-M277 WeakPolarHBondContact CD2-SD 3.32Å; L105-M277 HydrophobicContact CG-CE 4.44Å; L105-M277 HydrophobicContact CG-SD 4.42Å
106	L	91.4	Very high	83.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-44.5	175.1	-80.6	-168.2	0	0	0	111.9	I94 K102 T103 A108 I109 A110 Y141 L226 D228 I257 T259	I94-L106 HydrophobicContact CD1-CD2 4.21Å; K102-L106 PolarHBondContact O-N 3.11Å; T103-L106 PolarHBondContact O-N 3.41Å; L106-A108 VanDerWaalsContact C-N 3.29Å; L106-A108 PolarHBondContact O-N 2.63Å; L106-I109 PolarHBondContact O-N 3.26Å; L106-A110 VanDerWaalsContact O-CB 3.29Å; L106-A110 WeakPolarHBondContact O-CB 3.42Å; L106-A110 PolarHBondContact O-N 2.81Å; L106-Y141 HydrophobicContact CB-CE2 3.89Å; L106-L226 HydrophobicContact CD2-CB 4.35Å; L106-L226 HydrophobicContact CD2-CD2 4.23Å; L106-D228 HydrophobicContact CD1-CB 4.02Å; L106-I257 HydrophobicContact CD2-CB 4.48Å; L106-I257 HydrophobicContact CD2-CG2 3.83Å; L106-T259 HydrophobicContact CD1-CG2 3.32Å; L106-T259 HydrophobicContact CG-CG2 3.64Å
107	D	88.4	Confident	82.5	Confident	40 Å²	40	30.1 Å²	30.1	21%	0.214	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-35.3	175.5	-74.6	-32.9	0	0	0	112	T103 L105 A110 G111 R112 I113 Y141	T103-D107 WeakPolarHBondContact O-CB 3.18Å; T103-D107 PolarHBondContact O-N 3.04Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 3.48Å; D107-A110 PolarHBondContact O-N 3.15Å; D107-G111 PolarHBondContact O-N 3.08Å; D107-G111 VanDerWaalsContact O-N 3.14Å; D107-R112 HydrophobicContact CB-CB 4.19Å; D107-R112 PolarHBondContact O-N 2.85Å; D107-I113 HydrophobicContact CB-CG1 4.16Å; D107-I113 PolarHBondContact O-N 2.83Å; D107-Y141 PolarHBondContact OD1-OH 3.46Å
108	A	88	Confident	82.3	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-49.2	174.7	0	0	0	0	0	111.1	I53 L79 T104 L105 L106 A110 G111 I113 L119	I53-A108 HydrophobicContact CG2-CB 4.29Å; L79-A108 HydrophobicContact CD1-CB 4.36Å; T104-A108 WeakPolarHBondContact O-CB 3.28Å; T104-A108 PolarHBondContact O-N 2.71Å; L105-A108 WeakPolarHBondContact O-CB 3.44Å; L105-A108 PolarHBondContact O-N 2.84Å; L106-A108 VanDerWaalsContact C-N 3.29Å; L106-A108 PolarHBondContact O-N 2.63Å; A108-A110 VanDerWaalsContact C-N 3.28Å; A108-A110 PolarHBondContact O-N 3.33Å; A108-G111 PolarHBondContact O-N 3.03Å; A108-G111 VanDerWaalsContact O-N 3.12Å; A108-I113 VanDerWaalsContact CA-CD1 3.4Å; A108-I113 HydrophobicContact CB-CD1 3.35Å; A108-I113 HydrophobicContact CB-CG1 4.23Å; A108-L119 HydrophobicContact CB-CD1 4.07Å
109	I	87.9	Confident	82.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-33.1	-179.2	-61.7	157	0	0	0	110.6	V50 I53 F84 L105 L106 G111 Y135 F139 L226	V50-I109 HydrophobicContact CG2-CD1 4.5Å; V50-I109 HydrophobicContact CG2-CG1 4.33Å; I53-I109 HydrophobicContact CD1-CG1 4.25Å; F84-I109 HydrophobicContact CE1-CD1 3.96Å; F84-I109 HydrophobicContact CZ-CD1 3.57Å; L105-I109 HydrophobicContact CD1-CD1 4Å; L105-I109 HydrophobicContact CD1-CG1 4.36Å; L105-I109 HydrophobicContact CG-CD1 3.82Å; L105-I109 WeakPolarHBondContact O-CD1 3.47Å; L105-I109 VanDerWaalsContact O-CG1 3.25Å; L105-I109 WeakPolarHBondContact O-CG1 3.16Å; L105-I109 PolarHBondContact O-N 2.97Å; L106-I109 PolarHBondContact O-N 3.26Å; I109-G111 VanDerWaalsContact C-N 3.27Å; I109-G111 PolarHBondContact O-N 3.12Å; I109-Y135 WeakPolarHBondContact O-CD1 3.38Å; I109-Y135 WeakPolarHBondContact O-CE1 3.43Å; I109-F139 HydrophobicContact CG2-CD1 4.42Å; I109-F139 HydrophobicContact CG2-CE1 3.82Å; I109-F139 HydrophobicContact CG2-CE2 4.29Å; I109-F139 HydrophobicContact CG2-CZ 3.76Å; I109-F139 VanDerWaalsContact O-CD2 3.22Å; I109-F139 WeakPolarHBondContact O-CD2 3.5Å; I109-F139 WeakPolarHBondContact O-CE2 3.49Å; I109-L226 HydrophobicContact CB-CD1 4.37Å; I109-L226 HydrophobicContact CG2-CD1 4.05Å
110	A	84.3	Confident	82.4	Confident	4 Å²	4	31.4 Å²	31.4	3%	0.033	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.7	176.1	0	0	0	0	0	113.8	L106 D107 A108 R112 Y141 L226	L106-A110 VanDerWaalsContact O-CB 3.29Å; L106-A110 WeakPolarHBondContact O-CB 3.42Å; L106-A110 PolarHBondContact O-N 2.81Å; D107-A110 PolarHBondContact O-N 3.15Å; A108-A110 VanDerWaalsContact C-N 3.28Å; A108-A110 PolarHBondContact O-N 3.33Å; A110-R112 VanDerWaalsContact C-N 3.28Å; A110-R112 HydrophobicContact CB-CG 3.96Å; A110-R112 PolarHBondContact O-N 3.37Å; A110-Y141 HydrophobicContact CB-CD2 3.49Å; A110-Y141 VanDerWaalsContact CB-CD2 3.49Å; A110-Y141 HydrophobicContact CB-CE2 3.86Å; A110-Y141 HydrophobicContact CB-CG 4.4Å; A110-L226 HydrophobicContact CB-CD1 3.85Å
111	G	80.9	Confident	82.3	Confident	21 Å²	21	33.1 Å²	33.1	22%	0.216	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	24.1	-175.8	0	0	0	0	0	113.9	D107 A108 I109	D107-G111 PolarHBondContact O-N 3.08Å; D107-G111 VanDerWaalsContact O-N 3.14Å; A108-G111 PolarHBondContact O-N 3.03Å; A108-G111 VanDerWaalsContact O-N 3.12Å; I109-G111 VanDerWaalsContact C-N 3.27Å; I109-G111 PolarHBondContact O-N 3.12Å
112	R	78.8	Confident	82.4	Confident	47 Å²	47	36.1 Å²	36.1	18%	0.177	23%	0.225	C	C	.	.			trans	-90	-9	-179.9	-68	-177.6	173.8	-153.9	-11.2	113.7	D107 A110 G114 Y141 D469	D107-R112 HydrophobicContact CB-CB 4.19Å; D107-R112 PolarHBondContact O-N 2.85Å; A110-R112 VanDerWaalsContact C-N 3.28Å; A110-R112 HydrophobicContact CB-CG 3.96Å; A110-R112 PolarHBondContact O-N 3.37Å; R112-G114 PolarHBondContact O-N 3.26Å; R112-Y141 VanDerWaalsContact CZ-CB 3.49Å; R112-D469 IonicContact CZ-OD1 2.63Å; R112-D469 IonicContact NH2-OD1 2.63Å; R112-D469 PolarHBondContact NH2-OD1 3.04Å
113	I	75.6	Confident	82.2	Confident	16 Å²	16	35.8 Å²	35.8	8%	0.082	22%	0.224	C	C	.	.			trans	-62.9	125.7	175.9	-74.2	-174	0	0	0	110.9	Y55 T104 D107 A108 L119 R132	Y55-I113 HydrophobicContact CD1-CD1 3.95Å; Y55-I113 HydrophobicContact CD2-CD1 3.96Å; Y55-I113 HydrophobicContact CD2-CG2 3.87Å; Y55-I113 HydrophobicContact CE1-CD1 4.08Å; Y55-I113 HydrophobicContact CE1-CG2 4.24Å; Y55-I113 HydrophobicContact CE2-CB 4.5Å; Y55-I113 HydrophobicContact CE2-CD1 4.15Å; Y55-I113 HydrophobicContact CE2-CG2 3.17Å; Y55-I113 HydrophobicContact CG-CD1 3.88Å; Y55-I113 WeakPolarHBondContact OH-CG2 3.29Å; T104-I113 HydrophobicContact CG2-CD1 4.26Å; D107-I113 HydrophobicContact CB-CG1 4.16Å; D107-I113 PolarHBondContact O-N 2.83Å; A108-I113 VanDerWaalsContact CA-CD1 3.4Å; A108-I113 HydrophobicContact CB-CD1 3.35Å; A108-I113 HydrophobicContact CB-CG1 4.23Å; I113-L119 HydrophobicContact CD1-CD1 4.36Å; I113-R132 PolarHBondContact O-NH2 3.23Å
114	G	65.8	Low	82.1	Confident	15 Å²	15	34.4 Å²	34.4	16%	0.155	21%	0.214	C	C	.	.			trans	-63.3	175.8	177.7	0	0	0	0	0	114.3	R112 S116 H662	R112-G114 PolarHBondContact O-N 3.26Å; G114-S116 VanDerWaalsContact C-N 3.31Å; G114-H662 CarbonylContact C-O 3.59Å; G114-H662 WeakPolarHBondContact CA-O 3.42Å
115	S	63.1	Low	81.8	Confident	69 Å²	69	33.2 Å²	33.2	48%	0.483	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.3	-180	55.5	0	0	0	0	113.8	G117 H662	S115-G117 PolarHBondContact O-N 3.02Å; S115-H662 WeakPolarHBondContact CB-ND1 3.46Å; S115-H662 PolarHBondContact N-O 2.63Å; S115-H662 WeakPolarHBondContact OG-CB 3.41Å; S115-H662 VanDerWaalsContact OG-CG 3.29Å; S115-H662 PolarHBondContact OG-ND1 3.27Å
116	S	65.5	Low	81.3	Confident	64 Å²	64	33.7 Å²	33.7	45%	0.448	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.9	-178.9	-160.1	0	0	0	0	113.9	S58 G114	S58-S116 PolarHBondContact N-O 3.08Å; S58-S116 VanDerWaalsContact N-O 3.12Å; S58-S116 PolarHBondContact O-OG 3.45Å; S58-S116 VanDerWaalsContact O-OG 3.07Å; S58-S116 PolarHBondContact OG-O 3.35Å; G114-S116 VanDerWaalsContact C-N 3.31Å
117	G	72.3	Confident	80.5	Confident	17 Å²	17	34.1 Å²	34.1	18%	0.175	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	166.5	179.7	0	0	0	0	0	113.9	T56 S115	T56-G117 CarbonylContact O-C 3.59Å; T56-G117 WeakPolarHBondContact O-CA 3.47Å; S115-G117 PolarHBondContact O-N 3.02Å
118	T	81.8	Confident	80.2	Confident	85 Å²	85	38.7 Å²	38.7	52%	0.521	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.2	173.5	47.3	0	0	0	0	109.2	T56	T56-T118 PolarHBondContact N-O 3.31Å; T56-T118 VanDerWaalsContact N-O 3.1Å; T56-T118 PolarHBondContact O-N 3.3Å
119	L	84.4	Confident	80	Confident	70 Å²	70	43.8 Å²	43.8	37%	0.366	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.2	170.1	-177.7	68.2	0	0	0	108.4	I53 Y55 A108 I113	I53-L119 HydrophobicContact CG2-CD1 3.92Å; Y55-L119 HydrophobicContact CD2-CB 4.31Å; Y55-L119 HydrophobicContact CD2-CD1 4.36Å; A108-L119 HydrophobicContact CB-CD1 4.07Å; I113-L119 HydrophobicContact CD1-CD1 4.36Å
120	L	86.3	Confident	79.7	Confident	107 Å²	107	44.4 Å²	44.4	56%	0.56	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	156.9	170.3	-61.8	173.2	0	0	0	108.6	I53 S54	I53-L120 WeakPolarHBondContact CA-O 3.49Å; S54-L120 PolarHBondContact N-O 3.29Å; S54-L120 PolarHBondContact O-N 3.03Å
121	G	84.5	Confident	79.5	Confident	39 Å²	39	50.7 Å²	50.7	40%	0.402	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.9	174.8	-177.4	0	0	0	0	0	113.8	R51 N52	R51-G121 VanDerWaalsContact O-CA 3.29Å; R51-G121 WeakPolarHBondContact O-CA 3.25Å; N52-G121 WeakPolarHBondContact O-CA 3.45Å
122	E	88.1	Confident	79.1	Confident	72 Å²	72	57.6 Å²	57.6	34%	0.336	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.4	-171.5	-56.4	-171.3	170.5	0	0	110.9	R51 F124 K129	R51-E122 PolarHBondContact N-O 2.62Å; R51-E122 PolarHBondContact O-N 3.25Å; E122-F124 HydrophobicContact CB-CD2 4.44Å; E122-F124 HydrophobicContact CB-CE2 3.61Å; E122-F124 HydrophobicContact CB-CZ 3.7Å; E122-F124 WeakPolarHBondContact OE2-CZ 3.44Å; E122-K129 HydrophobicContact CG-CD 4.37Å; E122-K129 WeakPolarHBondContact OE1-CE 3.13Å; E122-K129 IonicContact OE1-NZ 3.55Å; E122-K129 PolarHBondContact OE1-NZ 2.95Å; E122-K129 WeakPolarHBondContact OE2-CD 3.2Å; E122-K129 IonicContact OE2-NZ 3.64Å
123	V	88.5	Confident	78.7	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.4	173.2	-178	0	0	0	0	108.4	L48 V50 I53 L130 Y135 F139	L48-V123 HydrophobicContact CD1-CG1 3.78Å; V50-V123 HydrophobicContact CG2-CG1 4.45Å; V50-V123 HydrophobicContact CG2-CG2 4.49Å; I53-V123 HydrophobicContact CD1-CG2 3.81Å; V123-L130 WeakPolarHBondContact O-CB 3.29Å; V123-L130 PolarHBondContact O-N 3.17Å; V123-Y135 HydrophobicContact CB-CE1 4.2Å; V123-Y135 HydrophobicContact CG2-CE1 3.98Å; V123-F139 HydrophobicContact CG1-CZ 4.01Å
124	F	87.1	Confident	78.6	Confident	15 Å²	15	62.5 Å²	62.5	7%	0.066	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.3	-178.5	-58.2	-88.4	0	0	0	109.8	L48 G49 R51 E122 R128 K129 M353 L357	L48-F124 WeakPolarHBondContact CA-O 3Å; G49-F124 PolarHBondContact N-O 2.93Å; G49-F124 PolarHBondContact O-N 3.47Å; R51-F124 HydrophobicContact CB-CE2 3.87Å; E122-F124 HydrophobicContact CB-CD2 4.44Å; E122-F124 HydrophobicContact CB-CE2 3.61Å; E122-F124 HydrophobicContact CB-CZ 3.7Å; E122-F124 WeakPolarHBondContact OE2-CZ 3.44Å; F124-R128 WeakPolarHBondContact CA-O 3.03Å; F124-K129 HydrophobicContact CD1-CB 4.04Å; F124-K129 HydrophobicContact CE1-CB 3.91Å; F124-K129 HydrophobicContact CE1-CG 4.41Å; F124-M353 HydrophobicContact CD2-CE 3.34Å; F124-M353 HydrophobicContact CE2-CE 3.71Å; F124-M353 HydrophobicContact CG-CE 4.34Å; F124-L357 HydrophobicContact CB-CD2 4.24Å; F124-L357 HydrophobicContact CD1-CD2 3.24Å; F124-L357 HydrophobicContact CD2-CD2 4.32Å; F124-L357 HydrophobicContact CE1-CD2 3.5Å; F124-L357 VanDerWaalsContact CE1-CD2 3.5Å; F124-L357 HydrophobicContact CG-CD2 3.68Å; F124-L357 HydrophobicContact CZ-CD2 4.14Å
125	I	84.3	Confident	79.1	Confident	11 Å²	11	62.9 Å²	62.9	6%	0.056	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	121.6	174.2	-64.9	-176.7	0	0	0	107.2	C47 L48 G127 R128 L130 C138 F139 I365	C47-I125 WeakPolarHBondContact O-CA 3.42Å; L48-I125 HydrophobicContact CD1-CG1 3.86Å; I125-G127 PolarHBondContact O-N 3.18Å; I125-R128 PolarHBondContact N-O 3.01Å; I125-R128 WeakPolarHBondContact O-CB 3.43Å; I125-R128 PolarHBondContact O-N 2.72Å; I125-L130 HydrophobicContact CD1-CD1 4.16Å; I125-L130 HydrophobicContact CD1-CD2 3.91Å; I125-C138 HydrophobicContact CD1-CB 3.55Å; I125-F139 HydrophobicContact CD1-CE1 4.34Å; I125-F139 HydrophobicContact CD1-CE2 4.08Å; I125-F139 HydrophobicContact CD1-CZ 3.75Å; I125-F139 HydrophobicContact CG1-CZ 4.36Å; I125-I365 HydrophobicContact CG2-CD1 3.26Å; I125-I365 HydrophobicContact CG2-CG1 3.89Å
126	N	80.7	Confident	79.4	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.064	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	42.3	-175.9	-61.2	-21.1	0	0	0	112.6	C46 C47 R128 K362	C46-N126 WeakPolarHBondContact CA-OD1 3.41Å; C46-N126 PolarHBondContact SG-OD1 3.21Å; C47-N126 PolarHBondContact N-OD1 2.65Å; C47-N126 PolarHBondContact O-N 2.97Å; C47-N126 VanDerWaalsContact SG-CA 3.59Å; N126-R128 PolarHBondContact O-N 3.3Å; N126-K362 HydrophobicContact CB-CB 4.46Å
127	G	74.8	Confident	79.6	Confident	10 Å²	10	61.4 Å²	61.4	10%	0.103	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-4.7	-178.3	0	0	0	0	0	115.5	I125 S356	I125-G127 PolarHBondContact O-N 3.18Å; G127-S356 WeakPolarHBondContact CA-O 3.5Å
128	R	81.8	Confident	79.7	Confident	135 Å²	135	61 Å²	61	51%	0.509	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.1	-179.6	-156.4	-179.8	-167	-135.6	8.7	111.3	F124 I125 N126 L130	F124-R128 WeakPolarHBondContact CA-O 3.03Å; I125-R128 PolarHBondContact N-O 3.01Å; I125-R128 WeakPolarHBondContact O-CB 3.43Å; I125-R128 PolarHBondContact O-N 2.72Å; N126-R128 PolarHBondContact O-N 3.3Å; R128-L130 PolarHBondContact O-N 2.92Å
129	K	83.9	Confident	79.7	Confident	109 Å²	109	57.6 Å²	57.6	47%	0.474	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	128.1	173.5	-176.6	179.7	179.8	172.4	0	110.5	E122 F124	E122-K129 HydrophobicContact CG-CD 4.37Å; E122-K129 WeakPolarHBondContact OE1-CE 3.13Å; E122-K129 IonicContact OE1-NZ 3.55Å; E122-K129 PolarHBondContact OE1-NZ 2.95Å; E122-K129 WeakPolarHBondContact OE2-CD 3.2Å; E122-K129 IonicContact OE2-NZ 3.64Å; F124-K129 HydrophobicContact CD1-CB 4.04Å; F124-K129 HydrophobicContact CE1-CB 3.91Å; F124-K129 HydrophobicContact CE1-CG 4.41Å
130	L	81.3	Confident	79.7	Confident	12 Å²	12	54.3 Å²	54.3	6%	0.063	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-80.4	130.8	179.4	-161.7	63.2	0	0	0	110.9	V123 I125 R128 E134 Y135 C138 F139	V123-L130 WeakPolarHBondContact O-CB 3.29Å; V123-L130 PolarHBondContact O-N 3.17Å; I125-L130 HydrophobicContact CD1-CD1 4.16Å; I125-L130 HydrophobicContact CD1-CD2 3.91Å; R128-L130 PolarHBondContact O-N 2.92Å; L130-E134 HydrophobicContact CD1-CB 3.47Å; L130-E134 VanDerWaalsContact CD1-CB 3.47Å; L130-E134 HydrophobicContact CG-CB 4.12Å; L130-Y135 HydrophobicContact CB-CD2 4.44Å; L130-Y135 HydrophobicContact CB-CE2 3.96Å; L130-Y135 HydrophobicContact CD2-CD1 3.78Å; L130-Y135 HydrophobicContact CD2-CD2 3.69Å; L130-Y135 HydrophobicContact CD2-CE1 3.96Å; L130-Y135 HydrophobicContact CD2-CE2 3.88Å; L130-Y135 HydrophobicContact CD2-CG 3.65Å; L130-Y135 HydrophobicContact CG-CD2 3.79Å; L130-Y135 HydrophobicContact CG-CE2 3.83Å; L130-Y135 HydrophobicContact CG-CG 4.25Å; L130-C138 HydrophobicContact CD1-CB 4.46Å; L130-F139 HydrophobicContact CD2-CD2 4.26Å; L130-F139 HydrophobicContact CD2-CE2 3.45Å; L130-F139 VanDerWaalsContact CD2-CE2 3.45Å; L130-F139 HydrophobicContact CD2-CZ 4.25Å
131	K	79.4	Confident	79.7	Confident	137 Å²	137	49.4 Å²	49.4	60%	0.596	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-83.4	150.7	170.8	-64.6	-179.6	-180	-178.5	0	109.7	E133 E134 Y135	K131-E133 PolarHBondContact O-N 3.01Å; K131-E134 HydrophobicContact CB-CG 4.28Å; K131-E134 PolarHBondContact N-OE2 2.86Å; K131-E134 WeakPolarHBondContact O-CB 3.35Å; K131-E134 PolarHBondContact O-N 3.25Å; K131-Y135 WeakPolarHBondContact O-CD2 3.16Å
132	R	72.5	Confident	79.7	Confident	166 Å²	166	47.7 Å²	47.7	63%	0.626	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-49.9	-35.8	-178.8	-166.6	171.8	-173.2	158.5	5.5	114	I113 E134 Y135	I113-R132 PolarHBondContact O-NH2 3.23Å; R132-E134 VanDerWaalsContact C-N 3.29Å; R132-E134 PolarHBondContact O-N 3.44Å; R132-Y135 VanDerWaalsContact CA-CD2 3.47Å
133	E	70.9	Confident	79.3	Confident	157 Å²	157	46 Å²	46	73%	0.734	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-69.5	-25.8	179.1	-61	174.1	-172.3	0	0	113.4	K131	K131-E133 PolarHBondContact O-N 3.01Å
134	E	73.8	Confident	78.3	Confident	9 Å²	9	49.5 Å²	49.5	4%	0.042	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-92.8	-8.7	-172.9	-62.1	173.4	161.2	0	0	112.4	L130 K131 R132 Q136 D137 C138 F367 K370	L130-E134 HydrophobicContact CD1-CB 3.47Å; L130-E134 VanDerWaalsContact CD1-CB 3.47Å; L130-E134 HydrophobicContact CG-CB 4.12Å; K131-E134 HydrophobicContact CB-CG 4.28Å; K131-E134 PolarHBondContact N-OE2 2.86Å; K131-E134 WeakPolarHBondContact O-CB 3.35Å; K131-E134 PolarHBondContact O-N 3.25Å; R132-E134 VanDerWaalsContact C-N 3.29Å; R132-E134 PolarHBondContact O-N 3.44Å; E134-Q136 PolarHBondContact O-N 2.94Å; E134-D137 PolarHBondContact O-N 3.17Å; E134-C138 PolarHBondContact O-N 2.92Å; E134-C138 PolarHBondContact O-SG 3.23Å; E134-F367 HydrophobicContact CB-CD1 4.29Å; E134-F367 HydrophobicContact CB-CE1 3.91Å; E134-F367 HydrophobicContact CG-CD1 4.31Å; E134-F367 HydrophobicContact CG-CE1 3.91Å; E134-K370 IonicContact OE1-NZ 3.82Å; E134-K370 PolarHBondContact OE1-NZ 3.02Å; E134-K370 VanDerWaalsContact OE1-NZ 3.1Å
135	Y	76.3	Confident	77.2	Confident	22 Å²	22	56.1 Å²	56.1	9%	0.086	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-48.3	179.5	-82.3	-104.1	0	0	0	112.6	I109 V123 L130 K131 R132 D137 C138 F139	I109-Y135 WeakPolarHBondContact O-CD1 3.38Å; I109-Y135 WeakPolarHBondContact O-CE1 3.43Å; V123-Y135 HydrophobicContact CB-CE1 4.2Å; V123-Y135 HydrophobicContact CG2-CE1 3.98Å; L130-Y135 HydrophobicContact CB-CD2 4.44Å; L130-Y135 HydrophobicContact CB-CE2 3.96Å; L130-Y135 HydrophobicContact CD2-CD1 3.78Å; L130-Y135 HydrophobicContact CD2-CD2 3.69Å; L130-Y135 HydrophobicContact CD2-CE1 3.96Å; L130-Y135 HydrophobicContact CD2-CE2 3.88Å; L130-Y135 HydrophobicContact CD2-CG 3.65Å; L130-Y135 HydrophobicContact CG-CD2 3.79Å; L130-Y135 HydrophobicContact CG-CE2 3.83Å; L130-Y135 HydrophobicContact CG-CG 4.25Å; K131-Y135 WeakPolarHBondContact O-CD2 3.16Å; R132-Y135 VanDerWaalsContact CA-CD2 3.47Å; Y135-D137 PolarHBondContact O-N 3.48Å; Y135-C138 PolarHBondContact O-N 3.2Å; Y135-F139 HydrophobicContact CD1-CD2 4.36Å; Y135-F139 HydrophobicContact CD1-CE2 4.04Å; Y135-F139 VanDerWaalsContact O-CD2 3.29Å; Y135-F139 WeakPolarHBondContact O-CD2 3.13Å; Y135-F139 PolarHBondContact O-N 3.45Å
136	Q	69.3	Low	76	Confident	58 Å²	58	55.6 Å²	55.6	27%	0.271	25%	0.249	S	C	.	.	H	α-helix	trans	-69.4	-18.4	-178.4	-64.7	-175.1	-6.1	0	0	113.3	E134	E134-Q136 PolarHBondContact O-N 2.94Å
137	D	70.2	Confident	75.1	Confident	45 Å²	45	57 Å²	57	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-89.1	-26.4	-178.2	-64.8	-21.3	0	0	0	112.1	E134 Y135 F367 K368	E134-D137 PolarHBondContact O-N 3.17Å; Y135-D137 PolarHBondContact O-N 3.48Å; D137-F367 HydrophobicContact CB-CB 4.41Å; D137-F367 HydrophobicContact CB-CD1 4.37Å; D137-K368 HydrophobicContact CB-CB 3.71Å
138	C	73.6	Confident	75.1	Confident	7 Å²	7	60 Å²	60	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-96.1	-29.3	-177	-67.1	0	0	0	0	113.9	I125 L130 E134 Y135	I125-C138 HydrophobicContact CD1-CB 3.55Å; L130-C138 HydrophobicContact CD1-CB 4.46Å; E134-C138 PolarHBondContact O-N 2.92Å; E134-C138 PolarHBondContact O-SG 3.23Å; Y135-C138 PolarHBondContact O-N 3.2Å
139	F	82.2	Confident	75.3	Confident	14 Å²	14	54.3 Å²	54.3	6%	0.061	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.8	-175.9	-61.7	-73.7	0	0	0	112.2	L48 I109 V123 I125 L130 Y135 V224 L226	L48-F139 HydrophobicContact CD1-CE1 3.79Å; L48-F139 HydrophobicContact CD1-CZ 3.71Å; L48-F139 HydrophobicContact CD2-CE1 4.2Å; I109-F139 HydrophobicContact CG2-CD1 4.42Å; I109-F139 HydrophobicContact CG2-CE1 3.82Å; I109-F139 HydrophobicContact CG2-CE2 4.29Å; I109-F139 HydrophobicContact CG2-CZ 3.76Å; I109-F139 VanDerWaalsContact O-CD2 3.22Å; I109-F139 WeakPolarHBondContact O-CD2 3.5Å; I109-F139 WeakPolarHBondContact O-CE2 3.49Å; V123-F139 HydrophobicContact CG1-CZ 4.01Å; I125-F139 HydrophobicContact CD1-CE1 4.34Å; I125-F139 HydrophobicContact CD1-CE2 4.08Å; I125-F139 HydrophobicContact CD1-CZ 3.75Å; I125-F139 HydrophobicContact CG1-CZ 4.36Å; L130-F139 HydrophobicContact CD2-CD2 4.26Å; L130-F139 HydrophobicContact CD2-CE2 3.45Å; L130-F139 VanDerWaalsContact CD2-CE2 3.45Å; L130-F139 HydrophobicContact CD2-CZ 4.25Å; Y135-F139 HydrophobicContact CD1-CD2 4.36Å; Y135-F139 HydrophobicContact CD1-CE2 4.04Å; Y135-F139 VanDerWaalsContact O-CD2 3.29Å; Y135-F139 WeakPolarHBondContact O-CD2 3.13Å; Y135-F139 PolarHBondContact O-N 3.45Å; F139-V224 HydrophobicContact CD1-CB 3.77Å; F139-V224 HydrophobicContact CD1-CG1 3.55Å; F139-V224 HydrophobicContact CD1-CG2 4.48Å; F139-V224 HydrophobicContact CE1-CB 4.06Å; F139-V224 HydrophobicContact CE1-CG1 3.67Å; F139-V224 HydrophobicContact CE1-CG2 4.36Å; F139-L226 HydrophobicContact CB-CD1 4.06Å; F139-L226 HydrophobicContact CD1-CD1 3.85Å; F139-L226 HydrophobicContact CD1-CD2 4.43Å; F139-L226 HydrophobicContact CD1-CG 4.16Å; F139-L226 HydrophobicContact CG-CD1 4.05Å
140	S	85.1	Confident	75.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.4	163.5	150.1	0	0	0	0	108.8	Q217 P222 V224 L226	S140-Q217 VanDerWaalsContact OG-CB 3.28Å; S140-Q217 WeakPolarHBondContact OG-CB 3.35Å; S140-P222 VanDerWaalsContact CB-CG 3.43Å; S140-V224 PolarHBondContact N-O 3.16Å; S140-L226 PolarHBondContact O-N 3.02Å
141	Y	86.4	Confident	75.8	Confident	5 Å²	5	50.8 Å²	50.8	2%	0.02	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127	-176.3	-162.5	-82.9	0	0	0	112.1	L106 D107 A110 R112 L143 L226 D228	L106-Y141 HydrophobicContact CB-CE2 3.89Å; D107-Y141 PolarHBondContact OD1-OH 3.46Å; A110-Y141 HydrophobicContact CB-CD2 3.49Å; A110-Y141 VanDerWaalsContact CB-CD2 3.49Å; A110-Y141 HydrophobicContact CB-CE2 3.86Å; A110-Y141 HydrophobicContact CB-CG 4.4Å; R112-Y141 VanDerWaalsContact CZ-CB 3.49Å; Y141-L143 HydrophobicContact CD1-CD2 4.09Å; Y141-L143 HydrophobicContact CD1-CG 3.89Å; Y141-L143 HydrophobicContact CE1-CB 4.45Å; Y141-L143 HydrophobicContact CE1-CD2 3.67Å; Y141-L143 HydrophobicContact CE1-CG 3.9Å; Y141-L226 CarbonylContact C-O 3.59Å; Y141-L226 WeakPolarHBondContact CA-O 3.14Å; Y141-L226 HydrophobicContact CD2-CB 3.65Å; Y141-L226 HydrophobicContact CD2-CD1 4Å; Y141-L226 HydrophobicContact CD2-CG 4.45Å; Y141-L226 HydrophobicContact CE2-CB 4.1Å; Y141-L226 HydrophobicContact CE2-CD1 4.44Å; Y141-L226 HydrophobicContact CG-CB 4.46Å; Y141-D228 HydrophobicContact CE1-CB 4.23Å
142	V	84.3	Confident	76.3	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	108.6	173.2	-174.6	0	0	0	0	108	S146 I214 Q217 L226 L227 D228	V142-S146 WeakPolarHBondContact CG1-OG 3.13Å; V142-I214 HydrophobicContact CG1-CG1 4.34Å; V142-I214 HydrophobicContact CG2-CG1 4.31Å; V142-Q217 HydrophobicContact CG2-CB 4.46Å; V142-Q217 HydrophobicContact CG2-CG 3.98Å; V142-L226 PolarHBondContact N-O 3.28Å; V142-L227 HydrophobicContact CB-CB 4.37Å; V142-L227 HydrophobicContact CB-CD2 4.02Å; V142-L227 HydrophobicContact CB-CG 3.98Å; V142-L227 HydrophobicContact CG1-CD2 4.35Å; V142-L227 HydrophobicContact CG2-CD2 3.93Å; V142-L227 HydrophobicContact CG2-CG 3.99Å; V142-D228 PolarHBondContact O-N 2.82Å
143	L	79.8	Confident	77.2	Confident	37 Å²	37	38.3 Å²	38.3	19%	0.194	19%	0.188	C	C	.	.			trans	-67.3	154.3	179.6	-68.8	148.7	0	0	0	111.8	Y141 Q145 S146 R210 Q465	Y141-L143 HydrophobicContact CD1-CD2 4.09Å; Y141-L143 HydrophobicContact CD1-CG 3.89Å; Y141-L143 HydrophobicContact CE1-CB 4.45Å; Y141-L143 HydrophobicContact CE1-CD2 3.67Å; Y141-L143 HydrophobicContact CE1-CG 3.9Å; L143-Q145 PolarHBondContact O-N 3.36Å; L143-S146 VanDerWaalsContact O-CB 3.3Å; L143-S146 WeakPolarHBondContact O-CB 3.47Å; L143-S146 PolarHBondContact O-N 3.3Å; L143-S146 VanDerWaalsContact O-N 3.16Å; L143-S146 PolarHBondContact O-OG 3.25Å; L143-R210 PolarHBondContact O-NH1 2.82Å; L143-R210 PolarHBondContact O-NH2 3.22Å; L143-R210 VanDerWaalsContact O-NH2 3.16Å; L143-Q465 HydrophobicContact CD1-CG 3.75Å
144	Q	67.6	Low	78.3	Confident	76 Å²	76	31.5 Å²	31.5	36%	0.355	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-38.2	172.2	-176.7	175	12.5	0	0	112.3	R210 D228 E229	Q144-R210 PolarHBondContact O-NH1 3.15Å; Q144-D228 VanDerWaalsContact CA-O 3.3Å; Q144-D228 WeakPolarHBondContact CA-O 3.06Å; Q144-D228 HydrophobicContact CB-CB 4.4Å; Q144-D228 PolarHBondContact N-O 3.08Å; Q144-E229 HydrophobicContact CG-CB 3.99Å; Q144-E229 PolarHBondContact NE2-OE2 2.87Å
145	Q	63	Low	79.2	Confident	153 Å²	153	31 Å²	31	72%	0.715	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	22.2	179.7	-62	-178.2	-9.4	0	0	113.6	L143 D147	L143-Q145 PolarHBondContact O-N 3.36Å; Q145-D147 PolarHBondContact O-N 3.42Å
146	S	58.6	Low	80.1	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.007	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	13.8	-175.6	65.5	0	0	0	0	115.7	V142 L143 N148 R210 S213	V142-S146 WeakPolarHBondContact CG1-OG 3.13Å; L143-S146 VanDerWaalsContact O-CB 3.3Å; L143-S146 WeakPolarHBondContact O-CB 3.47Å; L143-S146 PolarHBondContact O-N 3.3Å; L143-S146 VanDerWaalsContact O-N 3.16Å; L143-S146 PolarHBondContact O-OG 3.25Å; S146-N148 PolarHBondContact O-N 3.09Å; S146-R210 PolarHBondContact OG-NH1 2.83Å; S146-S213 WeakPolarHBondContact CB-OG 3.5Å; S146-S213 PolarHBondContact O-OG 3.33Å; S146-S213 PolarHBondContact OG-OG 3.45Å
147	D	61.8	Low	81.2	Confident	40 Å²	40	30.2 Å²	30.2	21%	0.214	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.7	175.9	-80.1	14	0	0	0	112.8	Q145 L149 R209 R210	Q145-D147 PolarHBondContact O-N 3.42Å; D147-L149 PolarHBondContact O-N 3.23Å; D147-R209 HydrophobicContact CB-CG 4.42Å; D147-R209 VanDerWaalsContact CG-NE 3.3Å; D147-R209 IonicContact OD2-CZ 2.81Å; D147-R209 IonicContact OD2-NE 2.72Å; D147-R209 PolarHBondContact OD2-NE 3.3Å; D147-R209 IonicContact OD2-NH2 3.24Å; D147-R209 PolarHBondContact OD2-NH2 2.97Å; D147-R210 IonicContact OD1-NH1 3.76Å
148	N	75.3	Confident	82.3	Confident	73 Å²	73	28.2 Å²	28.2	39%	0.39	14%	0.141	S	C	.	.			trans	-73	79.6	173.1	-71.6	-15.9	0	0	0	110.1	S146 I462	S146-N148 PolarHBondContact O-N 3.09Å; N148-I462 HydrophobicContact CB-CG1 4.19Å; N148-I462 WeakPolarHBondContact O-CG1 3.34Å
149	L	86.6	Confident	83.2	Confident	17 Å²	17	27.9 Å²	27.9	9%	0.089	14%	0.139	C	C	.	.			trans	-103.7	160.6	170.6	-60.3	173.2	0	0	0	109.6	D147 S151 T158 I196 R209 V212	D147-L149 PolarHBondContact O-N 3.23Å; L149-S151 PolarHBondContact O-N 3.03Å; L149-S151 VanDerWaalsContact O-N 3.12Å; L149-T158 HydrophobicContact CD2-CG2 4.36Å; L149-I196 HydrophobicContact CB-CD1 4.03Å; L149-I196 HydrophobicContact CB-CG2 4.16Å; L149-I196 HydrophobicContact CD1-CD1 4.09Å; L149-I196 HydrophobicContact CD1-CG2 4.27Å; L149-R209 HydrophobicContact CD1-CG 4.19Å; L149-V212 HydrophobicContact CD1-CB 4.07Å; L149-V212 HydrophobicContact CD1-CG1 3.62Å
150	L	87.4	Confident	83.7	Confident	13 Å²	13	28.6 Å²	28.6	7%	0.068	14%	0.144	C	C	.	.			trans	-68.7	111.9	174	-72.6	177.3	0	0	0	110	Y152 L153 R388 N392 I462	L150-Y152 VanDerWaalsContact C-N 3.31Å; L150-Y152 PolarHBondContact O-N 3.21Å; L150-L153 HydrophobicContact CB-CD1 3.95Å; L150-L153 HydrophobicContact CB-CG 4.07Å; L150-L153 HydrophobicContact CD1-CD1 3.64Å; L150-L153 HydrophobicContact CD1-CG 4.4Å; L150-L153 HydrophobicContact CG-CD1 4.47Å; L150-L153 PolarHBondContact O-N 3.35Å; L150-R388 HydrophobicContact CD1-CG 3.79Å; L150-N392 HydrophobicContact CD1-CB 4.37Å; L150-I462 HydrophobicContact CD2-CD1 3.5Å; L150-I462 VanDerWaalsContact CD2-CD1 3.5Å; L150-I462 HydrophobicContact CG-CD1 3.97Å
151	S	87.4	Confident	84	Confident	33 Å²	33	29.1 Å²	29.1	23%	0.231	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-31.3	-170.1	-60	0	0	0	0	114.8	L149 V195 G197 G198 F201	L149-S151 PolarHBondContact O-N 3.03Å; L149-S151 VanDerWaalsContact O-N 3.12Å; S151-V195 WeakPolarHBondContact O-CG1 3.33Å; S151-G197 WeakPolarHBondContact CA-O 3.35Å; S151-G197 VanDerWaalsContact CB-O 3.23Å; S151-G197 WeakPolarHBondContact CB-O 3.36Å; S151-G197 PolarHBondContact O-N 3.04Å; S151-G197 PolarHBondContact OG-O 2.76Å; S151-G197 VanDerWaalsContact OG-O 3.07Å; S151-G198 WeakPolarHBondContact OG-CA 3.37Å; S151-F201 VanDerWaalsContact O-CZ 3.29Å; S151-F201 WeakPolarHBondContact O-CZ 3.45Å
152	Y	89.4	Confident	84.1	Confident	42 Å²	42	29.2 Å²	29.2	17%	0.165	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-1.6	-174.3	-59.3	-77	0	0	0	114.4	L150 F201 N392 R395 D396	L150-Y152 VanDerWaalsContact C-N 3.31Å; L150-Y152 PolarHBondContact O-N 3.21Å; Y152-F201 AromaticContact CD1-CE1 3.65Å; Y152-F201 HydrophobicContact CD1-CE1 3.65Å; Y152-F201 HydrophobicContact CD1-CE2 4.34Å; Y152-F201 AromaticContact CD1-CZ 3.42Å; Y152-F201 HydrophobicContact CD1-CZ 3.42Å; Y152-F201 VanDerWaalsContact CD1-CZ 3.42Å; Y152-F201 AromaticContact CE1-CD1 3.98Å; Y152-F201 HydrophobicContact CE1-CD1 3.98Å; Y152-F201 AromaticContact CE1-CE1 3.22Å; Y152-F201 HydrophobicContact CE1-CE1 3.22Å; Y152-F201 AromaticContact CE1-CZ 3.54Å; Y152-F201 HydrophobicContact CE1-CZ 3.54Å; Y152-F201 HydrophobicContact CE2-CE1 4.29Å; Y152-F201 HydrophobicContact CG-CE1 4.32Å; Y152-F201 HydrophobicContact CG-CZ 4.04Å; Y152-F201 AromaticContact CZ-CE1 3.6Å; Y152-N392 WeakPolarHBondContact CB-OD1 3.43Å; Y152-R395 WeakPolarHBondContact O-CD 3.25Å; Y152-R395 PolarHBondContact O-NH1 3.48Å; Y152-D396 HydrophobicContact CD1-CB 4.48Å; Y152-D396 HydrophobicContact CD2-CB 3.85Å; Y152-D396 HydrophobicContact CE1-CB 4.19Å; Y152-D396 HydrophobicContact CE2-CB 3.48Å; Y152-D396 VanDerWaalsContact CE2-CB 3.48Å; Y152-D396 HydrophobicContact CG-CB 4.32Å; Y152-D396 VanDerWaalsContact CZ-CG 3.4Å; Y152-D396 VanDerWaalsContact OH-CG 3.26Å; Y152-D396 PolarHBondContact OH-OD1 2.87Å
153	L	91.8	Very high	84.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-91.5	156	176.3	-62	-174.6	0	0	0	111	L150 E157 T158 Y161 I196 R388 R391 N392	L150-L153 HydrophobicContact CB-CD1 3.95Å; L150-L153 HydrophobicContact CB-CG 4.07Å; L150-L153 HydrophobicContact CD1-CD1 3.64Å; L150-L153 HydrophobicContact CD1-CG 4.4Å; L150-L153 HydrophobicContact CG-CD1 4.47Å; L150-L153 PolarHBondContact O-N 3.35Å; L153-E157 HydrophobicContact CB-CB 4.49Å; L153-T158 WeakPolarHBondContact CB-OG1 3.45Å; L153-Y161 HydrophobicContact CD1-CD2 4.06Å; L153-Y161 HydrophobicContact CD1-CE2 4.29Å; L153-I196 PolarHBondContact O-N 3.45Å; L153-R388 HydrophobicContact CD1-CG 3.89Å; L153-R391 HydrophobicContact CD2-CB 4.33Å; L153-R391 HydrophobicContact CD2-CG 4.15Å; L153-N392 HydrophobicContact CD2-CB 4.33Å; L153-N392 HydrophobicContact CG-CB 4.48Å
154	T	93.8	Very high	84.7	Confident	13 Å²	13	28.4 Å²	28.4	8%	0.08	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-79.5	165.8	170.5	68	0	0	0	0	110.8	E157 T158 H193 S194 V195	T154-E157 PolarHBondContact N-OE2 3.44Å; T154-E157 PolarHBondContact O-N 3.37Å; T154-E157 WeakPolarHBondContact OG1-CB 3.27Å; T154-E157 WeakPolarHBondContact OG1-CG 3.45Å; T154-E157 PolarHBondContact OG1-N 3.03Å; T154-T158 WeakPolarHBondContact O-CB 3.39Å; T154-T158 PolarHBondContact O-N 3Å; T154-T158 PolarHBondContact O-OG1 3.29Å; T154-H193 WeakPolarHBondContact CG2-O 3.34Å; T154-S194 VanDerWaalsContact CA-O 3.25Å; T154-S194 WeakPolarHBondContact CA-O 3.29Å; T154-S194 WeakPolarHBondContact CB-O 3.38Å; T154-V195 HydrophobicContact CG2-CG2 4.46Å
155	V	94.3	Very high	85.4	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.1	-50.7	175	176.2	0	0	0	0	110.9	E157 T158 L159 V191 S194 I196 I204 V212	V155-E157 PolarHBondContact O-N 3Å; V155-T158 PolarHBondContact O-N 3Å; V155-L159 HydrophobicContact CG1-CD1 4Å; V155-L159 WeakPolarHBondContact O-CG 3.45Å; V155-L159 PolarHBondContact O-N 2.98Å; V155-V191 WeakPolarHBondContact CG2-O 3.32Å; V155-S194 PolarHBondContact N-O 3.33Å; V155-I196 HydrophobicContact CG2-CG1 4.26Å; V155-I204 HydrophobicContact CG2-CD1 4.13Å; V155-I204 HydrophobicContact CG2-CG2 4.31Å; V155-V212 HydrophobicContact CB-CG2 4.4Å; V155-V212 HydrophobicContact CG1-CG1 4.37Å; V155-V212 HydrophobicContact CG1-CG2 3.64Å; V155-V212 HydrophobicContact CG2-CG2 3.93Å
156	E	94.5	Very high	86.2	Confident	33 Å²	33	19.3 Å²	19.3	15%	0.154	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-43.5	178.9	-175.6	-171.8	-177.4	0	0	111.8	T160 M183 A192 H193	E156-T160 VanDerWaalsContact O-CB 3.22Å; E156-T160 WeakPolarHBondContact O-CB 3.3Å; E156-T160 PolarHBondContact O-N 2.82Å; E156-T160 PolarHBondContact O-OG1 3.34Å; E156-M183 HydrophobicContact CB-SD 4.3Å; E156-M183 HydrophobicContact CG-SD 4.45Å; E156-A192 WeakPolarHBondContact CB-O 3.26Å; E156-A192 PolarHBondContact N-O 3.49Å; E156-H193 IonicContact OE2-CE1 2.8Å; E156-H193 PolarHBondContact OE2-CE1 3.17Å; E156-H193 IonicContact OE2-ND1 3.87Å; E156-H193 PolarHBondContact OE2-ND1 3.46Å
157	E	93.3	Very high	87.3	Confident	30 Å²	30	20.5 Å²	20.5	14%	0.14	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-44.8	179.8	-75.2	172.8	170.6	0	0	111.7	L153 T154 V155 T160 Y161 R391 R395	L153-E157 HydrophobicContact CB-CB 4.49Å; T154-E157 PolarHBondContact N-OE2 3.44Å; T154-E157 PolarHBondContact O-N 3.37Å; T154-E157 WeakPolarHBondContact OG1-CB 3.27Å; T154-E157 WeakPolarHBondContact OG1-CG 3.45Å; T154-E157 PolarHBondContact OG1-N 3.03Å; V155-E157 PolarHBondContact O-N 3Å; E157-T160 PolarHBondContact O-N 2.9Å; E157-Y161 HydrophobicContact CB-CD2 4.47Å; E157-Y161 HydrophobicContact CB-CE2 4.28Å; E157-Y161 WeakPolarHBondContact O-CD2 3.5Å; E157-Y161 PolarHBondContact O-N 3.26Å; E157-R391 IonicContact OE1-CZ 3.82Å; E157-R391 IonicContact OE1-NE 3.73Å; E157-R391 PolarHBondContact OE1-NE 2.71Å; E157-R391 IonicContact OE1-NH2 2.66Å; E157-R391 PolarHBondContact OE1-NH2 3.35Å; E157-R391 IonicContact OE2-NE 2.75Å; E157-R395 IonicContact OE1-CZ 3.19Å; E157-R395 IonicContact OE1-NH1 2.83Å; E157-R395 IonicContact OE1-NH2 2.75Å; E157-R395 PolarHBondContact OE1-NH2 2.96Å; E157-R395 IonicContact OE2-CZ 3.82Å; E157-R395 IonicContact OE2-NH1 2.69Å; E157-R395 PolarHBondContact OE2-NH1 3.05Å; E157-R395 IonicContact OE2-NH2 3.71Å; E157-R395 PolarHBondContact OE2-NH2 2.83Å
158	T	92.8	Very high	87.7	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-50.9	178.9	-59.6	0	0	0	0	110	L149 L153 T154 V155 T160 Y161 T162 I196	L149-T158 HydrophobicContact CD2-CG2 4.36Å; L153-T158 WeakPolarHBondContact CB-OG1 3.45Å; T154-T158 WeakPolarHBondContact O-CB 3.39Å; T154-T158 PolarHBondContact O-N 3Å; T154-T158 PolarHBondContact O-OG1 3.29Å; V155-T158 PolarHBondContact O-N 3Å; T158-T160 VanDerWaalsContact C-N 3.34Å; T158-T160 PolarHBondContact O-N 2.89Å; T158-Y161 PolarHBondContact O-N 3.14Å; T158-T162 PolarHBondContact O-N 3.43Å; T158-T162 PolarHBondContact O-OG1 2.85Å; T158-I196 HydrophobicContact CG2-CD1 4.02Å; T158-I196 WeakPolarHBondContact OG1-CD1 3.38Å
159	L	93	Very high	87.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62	-40.9	178.2	-67.2	177.1	0	0	0	112.2	V155 T162 A163 V179 M183 V212 A215 L219	V155-L159 HydrophobicContact CG1-CD1 4Å; V155-L159 WeakPolarHBondContact O-CG 3.45Å; V155-L159 PolarHBondContact O-N 2.98Å; L159-T162 VanDerWaalsContact CA-OG1 3.3Å; L159-T162 WeakPolarHBondContact CA-OG1 3.27Å; L159-T162 PolarHBondContact O-N 3.01Å; L159-T162 PolarHBondContact O-OG1 3.11Å; L159-A163 VanDerWaalsContact O-CB 3.25Å; L159-A163 WeakPolarHBondContact O-CB 3.41Å; L159-A163 PolarHBondContact O-N 2.79Å; L159-V179 HydrophobicContact CB-CG1 3.78Å; L159-M183 HydrophobicContact CD1-CG 3.47Å; L159-M183 VanDerWaalsContact CD1-CG 3.47Å; L159-M183 HydrophobicContact CD1-SD 4.02Å; L159-V212 HydrophobicContact CD2-CG1 4.42Å; L159-A215 HydrophobicContact CD1-CB 4.03Å; L159-A215 HydrophobicContact CD2-CB 3.61Å; L159-A215 HydrophobicContact CG-CB 4.49Å; L159-L219 HydrophobicContact CB-CD1 4.19Å; L159-L219 HydrophobicContact CD2-CD1 3.96Å; L159-L219 VanDerWaalsContact O-CD1 3.28Å; L159-L219 WeakPolarHBondContact O-CD1 3.38Å
160	T	92.6	Very high	87.2	Confident	29 Å²	29	29.4 Å²	29.4	18%	0.178	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-44.1	176.6	-59.4	0	0	0	0	111.7	E156 E157 T158 A163 Q164	E156-T160 VanDerWaalsContact O-CB 3.22Å; E156-T160 WeakPolarHBondContact O-CB 3.3Å; E156-T160 PolarHBondContact O-N 2.82Å; E156-T160 PolarHBondContact O-OG1 3.34Å; E157-T160 PolarHBondContact O-N 2.9Å; T158-T160 VanDerWaalsContact C-N 3.34Å; T158-T160 PolarHBondContact O-N 2.89Å; T160-A163 PolarHBondContact O-N 2.91Å; T160-Q164 HydrophobicContact CG2-CG 4.48Å; T160-Q164 WeakPolarHBondContact O-CB 3.35Å; T160-Q164 VanDerWaalsContact O-CG 3.27Å; T160-Q164 WeakPolarHBondContact O-CG 3.3Å; T160-Q164 PolarHBondContact O-N 3.06Å
161	Y	90.4	Very high	87	Confident	13 Å²	13	31.8 Å²	31.8	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-66.8	-43.3	177	-72.8	-58.3	0	0	0	112.1	L153 E157 T158 A163 Q164 L165 R387 R388 R391	L153-Y161 HydrophobicContact CD1-CD2 4.06Å; L153-Y161 HydrophobicContact CD1-CE2 4.29Å; E157-Y161 HydrophobicContact CB-CD2 4.47Å; E157-Y161 HydrophobicContact CB-CE2 4.28Å; E157-Y161 WeakPolarHBondContact O-CD2 3.5Å; E157-Y161 PolarHBondContact O-N 3.26Å; T158-Y161 PolarHBondContact O-N 3.14Å; Y161-A163 VanDerWaalsContact C-N 3.3Å; Y161-A163 PolarHBondContact O-N 3.22Å; Y161-Q164 PolarHBondContact O-N 2.89Å; Y161-L165 VanDerWaalsContact O-CG 3.25Å; Y161-L165 WeakPolarHBondContact O-CG 3.47Å; Y161-L165 PolarHBondContact O-N 3.5Å; Y161-R387 HydrophobicContact CE1-CG 4.29Å; Y161-R388 HydrophobicContact CD1-CB 3.97Å; Y161-R388 HydrophobicContact CD1-CG 4.47Å; Y161-R388 HydrophobicContact CD2-CB 4.09Å; Y161-R388 HydrophobicContact CD2-CG 3.81Å; Y161-R388 HydrophobicContact CE1-CB 4.14Å; Y161-R388 HydrophobicContact CE2-CB 4.26Å; Y161-R388 HydrophobicContact CE2-CG 4.27Å; Y161-R388 HydrophobicContact CG-CB 3.96Å; Y161-R388 HydrophobicContact CG-CG 3.94Å; Y161-R391 WeakPolarHBondContact OH-CD 3.42Å
162	T	88.9	Confident	86.9	Confident	6 Å²	6	34.5 Å²	34.5	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-39.9	173.2	24.5	0	0	0	0	111.9	T158 L159 L165 A166 L471	T158-T162 PolarHBondContact O-N 3.43Å; T158-T162 PolarHBondContact O-OG1 2.85Å; L159-T162 VanDerWaalsContact CA-OG1 3.3Å; L159-T162 WeakPolarHBondContact CA-OG1 3.27Å; L159-T162 PolarHBondContact O-N 3.01Å; L159-T162 PolarHBondContact O-OG1 3.11Å; T162-L165 PolarHBondContact O-N 3.13Å; T162-A166 VanDerWaalsContact O-CB 3.31Å; T162-A166 WeakPolarHBondContact O-CB 3.38Å; T162-A166 PolarHBondContact O-N 3.49Å; T162-L471 HydrophobicContact CG2-CD1 4.36Å
163	A	88.3	Confident	86.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-40.6	177.7	0	0	0	0	0	111.8	L159 T160 Y161 L165 A166 L167 I175 V179 L219	L159-A163 VanDerWaalsContact O-CB 3.25Å; L159-A163 WeakPolarHBondContact O-CB 3.41Å; L159-A163 PolarHBondContact O-N 2.79Å; T160-A163 PolarHBondContact O-N 2.91Å; Y161-A163 VanDerWaalsContact C-N 3.3Å; Y161-A163 PolarHBondContact O-N 3.22Å; A163-L165 VanDerWaalsContact C-N 3.32Å; A163-L165 PolarHBondContact O-N 2.74Å; A163-A166 PolarHBondContact O-N 2.98Å; A163-L167 WeakPolarHBondContact O-CA 3.47Å; A163-L167 VanDerWaalsContact O-CB 3.23Å; A163-L167 WeakPolarHBondContact O-CB 3.27Å; A163-L167 PolarHBondContact O-N 3.31Å; A163-I175 HydrophobicContact CB-CG2 3.56Å; A163-V179 HydrophobicContact CB-CG2 3.72Å; A163-L219 HydrophobicContact CB-CD1 4Å; A163-L219 HydrophobicContact CB-CD2 4.11Å; A163-L219 HydrophobicContact CB-CG 4.49Å
164	Q	87.6	Confident	86.7	Confident	22 Å²	22	41.2 Å²	41.2	10%	0.103	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-37.1	174.5	-75.4	173.9	-9.4	0	0	112.4	T160 Y161 I175 F384	T160-Q164 HydrophobicContact CG2-CG 4.48Å; T160-Q164 WeakPolarHBondContact O-CB 3.35Å; T160-Q164 VanDerWaalsContact O-CG 3.27Å; T160-Q164 WeakPolarHBondContact O-CG 3.3Å; T160-Q164 PolarHBondContact O-N 3.06Å; Y161-Q164 PolarHBondContact O-N 2.89Å; Q164-I175 HydrophobicContact CG-CD1 4.18Å; Q164-I175 HydrophobicContact CG-CG2 4.25Å; Q164-F384 HydrophobicContact CB-CD1 4.28Å; Q164-F384 HydrophobicContact CB-CD2 4.37Å; Q164-F384 HydrophobicContact CB-CE1 4.39Å; Q164-F384 HydrophobicContact CB-CE2 4.48Å; Q164-F384 HydrophobicContact CB-CG 4.29Å; Q164-F384 HydrophobicContact CB-CZ 4.49Å; Q164-F384 HydrophobicContact CG-CE1 4.37Å
165	L	83.5	Confident	86.5	Confident	2 Å²	2	41 Å²	41	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-71.5	-39.2	176.6	-68.7	169.8	0	0	0	112.1	Y161 T162 A163 Q168 V381 F384 M385 L471 Y472	Y161-L165 VanDerWaalsContact O-CG 3.25Å; Y161-L165 WeakPolarHBondContact O-CG 3.47Å; Y161-L165 PolarHBondContact O-N 3.5Å; T162-L165 PolarHBondContact O-N 3.13Å; A163-L165 VanDerWaalsContact C-N 3.32Å; A163-L165 PolarHBondContact O-N 2.74Å; L165-Q168 WeakPolarHBondContact O-CG 3.23Å; L165-Q168 PolarHBondContact O-NE2 3.36Å; L165-Q168 VanDerWaalsContact O-NE2 3.07Å; L165-V381 HydrophobicContact CD2-CB 4.45Å; L165-V381 HydrophobicContact CD2-CG1 3.9Å; L165-F384 HydrophobicContact CD2-CB 4.13Å; L165-M385 HydrophobicContact CD1-CE 4.1Å; L165-M385 HydrophobicContact CD2-CG 4.09Å; L165-L471 HydrophobicContact CB-CD2 4.01Å; L165-Y472 HydrophobicContact CD1-CD1 4.29Å; L165-Y472 HydrophobicContact CD1-CE1 4.35Å
166	A	80.1	Confident	86.3	Confident	37 Å²	37	46.1 Å²	46.1	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-78	-38.3	-180	0	0	0	0	0	113.5	T162 A163 Q220 L471	T162-A166 VanDerWaalsContact O-CB 3.31Å; T162-A166 WeakPolarHBondContact O-CB 3.38Å; T162-A166 PolarHBondContact O-N 3.49Å; A163-A166 PolarHBondContact O-N 2.98Å; A166-Q220 HydrophobicContact CB-CG 4.2Å; A166-L471 HydrophobicContact CB-CD2 3.88Å
167	L	80.9	Confident	86.2	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	27%	0.268	C	S	.	.			trans	-111.6	54.9	-169.2	-57.1	173.3	0	0	0	112	A163 K169 H170 I175 K178	A163-L167 WeakPolarHBondContact O-CA 3.47Å; A163-L167 VanDerWaalsContact O-CB 3.23Å; A163-L167 WeakPolarHBondContact O-CB 3.27Å; A163-L167 PolarHBondContact O-N 3.31Å; L167-K169 PolarHBondContact O-N 2.94Å; L167-H170 HydrophobicContact CB-CB 4.36Å; L167-H170 PolarHBondContact O-N 3.25Å; L167-H170 VanDerWaalsContact O-N 3.13Å; L167-I175 HydrophobicContact CB-CG1 4.32Å; L167-K178 HydrophobicContact CD1-CD 3.59Å
168	Q	70.4	Confident	86.1	Confident	77 Å²	77	53 Å²	53	36%	0.36	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.9	-170.3	-62.8	171.5	16.6	0	0	115.3	L165 V381	L165-Q168 WeakPolarHBondContact O-CG 3.23Å; L165-Q168 PolarHBondContact O-NE2 3.36Å; L165-Q168 VanDerWaalsContact O-NE2 3.07Å; Q168-V381 HydrophobicContact CG-CG2 4.27Å
169	K	72.6	Confident	86.1	Confident	131 Å²	131	52.9 Å²	52.9	57%	0.57	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-9.6	-177.6	-64.4	-177.5	177.6	-179.7	0	114.2	L167 E371	L167-K169 PolarHBondContact O-N 2.94Å; K169-E371 IonicContact NZ-OE1 2.71Å; K169-E371 IonicContact NZ-OE2 3.57Å; K169-E371 PolarHBondContact NZ-OE2 3.28Å
170	H	78.8	Confident	86.2	Confident	110 Å²	110	56.9 Å²	56.9	51%	0.509	29%	0.29	S	S	.	.	S	Bend	trans	-88.2	153.2	-175.3	-72.1	-93.9	0	0	0	111.9	L167 A174 I175	L167-H170 HydrophobicContact CB-CB 4.36Å; L167-H170 PolarHBondContact O-N 3.25Å; L167-H170 VanDerWaalsContact O-N 3.13Å; H170-A174 HydrophobicContact CB-CB 4.46Å; H170-I175 HydrophobicContact CB-CD1 4.38Å; H170-I175 HydrophobicContact CB-CG1 4.02Å
171	S	83.8	Confident	86.2	Confident	62 Å²	62	58.2 Å²	58.2	43%	0.434	30%	0.304	S	S	.	.			trans	-66.3	155.2	173	107.6	0	0	0	0	110.9	E173 A174 I175	S171-E173 WeakPolarHBondContact CB-OE2 3.43Å; S171-E173 PolarHBondContact O-N 2.95Å; S171-E173 PolarHBondContact OG-N 3.15Å; S171-E173 PolarHBondContact OG-OE2 2.94Å; S171-A174 PolarHBondContact O-N 3.43Å; S171-A174 PolarHBondContact OG-N 3.49Å; S171-I175 WeakPolarHBondContact O-CG1 3.15Å; S171-I175 PolarHBondContact O-N 2.91Å
172	V	84.9	Confident	86.3	Confident	90 Å²	90	57.8 Å²	57.8	55%	0.545	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-37.1	179	-179.8	0	0	0	0	111.2	I175 K176	V172-I175 PolarHBondContact O-N 3.17Å; V172-K176 PolarHBondContact O-N 3.31Å
173	E	88	Confident	86.5	Confident	139 Å²	139	57.7 Å²	57.7	65%	0.65	30%	0.302	S	S	*	.	H	α-helix	trans	-66.9	-42.5	177.4	-59.4	70.8	-151.2	0	0	111.5	S171 I175 K176 K177	S171-E173 WeakPolarHBondContact CB-OE2 3.43Å; S171-E173 PolarHBondContact O-N 2.95Å; S171-E173 PolarHBondContact OG-N 3.15Å; S171-E173 PolarHBondContact OG-OE2 2.94Å; E173-I175 VanDerWaalsContact C-N 3.34Å; E173-K176 PolarHBondContact O-N 3.42Å; E173-K177 WeakPolarHBondContact O-CB 3.43Å; E173-K177 PolarHBondContact O-N 3Å
174	A	88.8	Confident	86.7	Confident	44 Å²	44	60.4 Å²	60.4	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-42	176.4	0	0	0	0	0	111.4	H170 S171 K177 K178	H170-A174 HydrophobicContact CB-CB 4.46Å; S171-A174 PolarHBondContact O-N 3.43Å; S171-A174 PolarHBondContact OG-N 3.49Å; A174-K177 PolarHBondContact O-N 2.99Å; A174-K178 WeakPolarHBondContact O-CB 3.39Å; A174-K178 PolarHBondContact O-N 3.35Å
175	I	88.7	Confident	86.8	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-49	175.1	-69.8	165.1	0	0	0	110.4	A163 Q164 L167 H170 S171 V172 E173 K177 K178 V179	A163-I175 HydrophobicContact CB-CG2 3.56Å; Q164-I175 HydrophobicContact CG-CD1 4.18Å; Q164-I175 HydrophobicContact CG-CG2 4.25Å; L167-I175 HydrophobicContact CB-CG1 4.32Å; H170-I175 HydrophobicContact CB-CD1 4.38Å; H170-I175 HydrophobicContact CB-CG1 4.02Å; S171-I175 WeakPolarHBondContact O-CG1 3.15Å; S171-I175 PolarHBondContact O-N 2.91Å; V172-I175 PolarHBondContact O-N 3.17Å; E173-I175 VanDerWaalsContact C-N 3.34Å; I175-K177 PolarHBondContact O-N 3.43Å; I175-K178 PolarHBondContact O-N 2.92Å; I175-V179 HydrophobicContact CG2-CG2 4.41Å; I175-V179 WeakPolarHBondContact O-CG2 3.23Å; I175-V179 PolarHBondContact O-N 3.19Å
176	K	90.9	Very high	87.2	Confident	109 Å²	109	60.8 Å²	60.8	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-43.3	179.6	-170.1	174.7	-176.5	178.9	0	111.9	V172 E173 K178 V179 L180	V172-K176 PolarHBondContact O-N 3.31Å; E173-K176 PolarHBondContact O-N 3.42Å; K176-K178 VanDerWaalsContact C-N 3.31Å; K176-K178 PolarHBondContact O-N 3.31Å; K176-V179 PolarHBondContact O-N 3.42Å; K176-L180 HydrophobicContact CG-CD1 4.42Å; K176-L180 WeakPolarHBondContact O-CG 3.47Å; K176-L180 PolarHBondContact O-N 2.91Å
177	K	92.4	Very high	87.7	Confident	164 Å²	164	62.3 Å²	62.3	71%	0.713	34%	0.335	S	S	*	.	H	α-helix	trans	-60.5	-41.1	176.5	-172.1	177.4	-179.7	-179.8	0	111.6	E173 A174 I175 L180 A181	E173-K177 WeakPolarHBondContact O-CB 3.43Å; E173-K177 PolarHBondContact O-N 3Å; A174-K177 PolarHBondContact O-N 2.99Å; I175-K177 PolarHBondContact O-N 3.43Å; K177-L180 PolarHBondContact O-N 2.75Å; K177-A181 PolarHBondContact O-N 3.33Å
178	K	90.8	Very high	88.3	Confident	42 Å²	42	61.1 Å²	61.1	18%	0.183	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-43.3	176.8	-170.4	175.8	-174.5	179.1	0	112.4	L167 A174 I175 K176 L180 A181 V182 L219 D221	L167-K178 HydrophobicContact CD1-CD 3.59Å; A174-K178 WeakPolarHBondContact O-CB 3.39Å; A174-K178 PolarHBondContact O-N 3.35Å; I175-K178 PolarHBondContact O-N 2.92Å; K176-K178 VanDerWaalsContact C-N 3.31Å; K176-K178 PolarHBondContact O-N 3.31Å; K178-L180 VanDerWaalsContact C-N 3.33Å; K178-L180 PolarHBondContact O-N 3.46Å; K178-A181 WeakPolarHBondContact O-CB 3.34Å; K178-A181 PolarHBondContact O-N 3.19Å; K178-V182 WeakPolarHBondContact O-CG2 3.49Å; K178-V182 PolarHBondContact O-N 2.96Å; K178-L219 WeakPolarHBondContact CE-O 3.28Å; K178-L219 PolarHBondContact NZ-O 2.77Å; K178-D221 WeakPolarHBondContact CE-OD2 3.48Å; K178-D221 VanDerWaalsContact NZ-CG 3.28Å; K178-D221 IonicContact NZ-OD1 2.62Å; K178-D221 IonicContact NZ-OD2 2.72Å; K178-D221 PolarHBondContact NZ-OD2 3.33Å
179	V	93.8	Very high	89.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-46.2	175.9	170.6	0	0	0	0	110.8	L159 A163 I175 K176 A181 V182 M183 L219	L159-V179 HydrophobicContact CB-CG1 3.78Å; A163-V179 HydrophobicContact CB-CG2 3.72Å; I175-V179 HydrophobicContact CG2-CG2 4.41Å; I175-V179 WeakPolarHBondContact O-CG2 3.23Å; I175-V179 PolarHBondContact O-N 3.19Å; K176-V179 PolarHBondContact O-N 3.42Å; V179-A181 VanDerWaalsContact C-N 3.32Å; V179-A181 PolarHBondContact O-N 3.33Å; V179-V182 PolarHBondContact O-N 3.45Å; V179-M183 HydrophobicContact CG1-CG 4.43Å; V179-M183 HydrophobicContact CG1-SD 3.76Å; V179-M183 WeakPolarHBondContact O-CB 3.37Å; V179-M183 WeakPolarHBondContact O-CG 3.45Å; V179-M183 PolarHBondContact O-N 3.31Å; V179-L219 HydrophobicContact CG2-CD2 3.87Å
180	L	93.9	Very high	90.4	Very high	83 Å²	83	60.6 Å²	60.6	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-38.6	176.7	-69.2	173.4	0	0	0	112.4	K176 K177 K178 A184	K176-L180 HydrophobicContact CG-CD1 4.42Å; K176-L180 WeakPolarHBondContact O-CG 3.47Å; K176-L180 PolarHBondContact O-N 2.91Å; K177-L180 PolarHBondContact O-N 2.75Å; K178-L180 VanDerWaalsContact C-N 3.33Å; K178-L180 PolarHBondContact O-N 3.46Å; L180-A184 WeakPolarHBondContact O-CB 3.41Å; L180-A184 PolarHBondContact O-N 2.84Å
181	A	92.4	Very high	91.1	Very high	57 Å²	57	56 Å²	56	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-45.8	176.1	0	0	0	0	0	112.2	K177 K178 V179 A184 E185	K177-A181 PolarHBondContact O-N 3.33Å; K178-A181 WeakPolarHBondContact O-CB 3.34Å; K178-A181 PolarHBondContact O-N 3.19Å; V179-A181 VanDerWaalsContact C-N 3.32Å; V179-A181 PolarHBondContact O-N 3.33Å; A181-A184 PolarHBondContact O-N 2.93Å; A181-E185 WeakPolarHBondContact O-CB 3.48Å; A181-E185 PolarHBondContact O-N 3.03Å
182	V	92.4	Very high	91.5	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.03	30%	0.298	C	S	.	.	H	α-helix	trans	-66.1	-39.1	177.9	172.7	0	0	0	0	111.4	K178 V179 E185 L186 A215 L218 L219	K178-V182 WeakPolarHBondContact O-CG2 3.49Å; K178-V182 PolarHBondContact O-N 2.96Å; V179-V182 PolarHBondContact O-N 3.45Å; V182-E185 PolarHBondContact O-N 3.19Å; V182-L186 HydrophobicContact CG1-CD1 4.2Å; V182-L186 PolarHBondContact O-N 3.1Å; V182-A215 HydrophobicContact CG1-CB 3.91Å; V182-L218 HydrophobicContact CG1-CB 4.02Å; V182-L218 HydrophobicContact CG1-CD1 4.49Å; V182-L219 HydrophobicContact CB-CD2 4.3Å; V182-L219 HydrophobicContact CG2-CD2 4.08Å
183	M	93.8	Very high	91.9	Very high	3 Å²	3	56 Å²	56	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-40.3	175	-76.2	171.8	43	0	0	112.4	E156 L159 V179 S187 L188 A192	E156-M183 HydrophobicContact CB-SD 4.3Å; E156-M183 HydrophobicContact CG-SD 4.45Å; L159-M183 HydrophobicContact CD1-CG 3.47Å; L159-M183 VanDerWaalsContact CD1-CG 3.47Å; L159-M183 HydrophobicContact CD1-SD 4.02Å; V179-M183 HydrophobicContact CG1-CG 4.43Å; V179-M183 HydrophobicContact CG1-SD 3.76Å; V179-M183 WeakPolarHBondContact O-CB 3.37Å; V179-M183 WeakPolarHBondContact O-CG 3.45Å; V179-M183 PolarHBondContact O-N 3.31Å; M183-S187 PolarHBondContact O-N 2.8Å; M183-L188 HydrophobicContact CB-CB 4.42Å; M183-L188 PolarHBondContact O-N 3.03Å; M183-A192 HydrophobicContact CE-CB 3.25Å
184	A	92.3	Very high	92.2	Very high	57 Å²	57	51.9 Å²	51.9	47%	0.471	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-41.1	175	0	0	0	0	0	111.4	L180 A181 L186 S187	L180-A184 WeakPolarHBondContact O-CB 3.41Å; L180-A184 PolarHBondContact O-N 2.84Å; A181-A184 PolarHBondContact O-N 2.93Å; A184-L186 VanDerWaalsContact C-N 3.32Å; A184-L186 PolarHBondContact O-N 2.92Å; A184-S187 PolarHBondContact O-N 3.33Å
185	E	90.3	Very high	92.4	Very high	32 Å²	32	52.5 Å²	52.5	15%	0.15	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-38.4	177.5	-179.7	167.9	-150	0	0	112.6	A181 V182 L249 R252	A181-E185 WeakPolarHBondContact O-CB 3.48Å; A181-E185 PolarHBondContact O-N 3.03Å; V182-E185 PolarHBondContact O-N 3.19Å; E185-L249 HydrophobicContact CG-CD2 4.02Å; E185-L249 WeakPolarHBondContact OE1-CD2 3.49Å; E185-R252 WeakPolarHBondContact OE1-CD 3.43Å; E185-R252 IonicContact OE1-CZ 3.87Å; E185-R252 IonicContact OE1-NE 3.56Å; E185-R252 PolarHBondContact OE1-NE 3.24Å; E185-R252 IonicContact OE1-NH1 3.1Å; E185-R252 PolarHBondContact OE1-NH1 3.03Å; E185-R252 IonicContact OE2-NH1 3.62Å
186	L	90.9	Very high	92.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	9.6	178.9	-66.4	172.6	0	0	0	114.3	V182 A184 L188 R211 I214 A215 L218 L245 L249	V182-L186 HydrophobicContact CG1-CD1 4.2Å; V182-L186 PolarHBondContact O-N 3.1Å; A184-L186 VanDerWaalsContact C-N 3.32Å; A184-L186 PolarHBondContact O-N 2.92Å; L186-L188 VanDerWaalsContact C-N 3.32Å; L186-L188 HydrophobicContact CB-CD1 3.97Å; L186-L188 HydrophobicContact CB-CG 4.15Å; L186-L188 HydrophobicContact CD1-CD1 4.4Å; L186-L188 PolarHBondContact O-N 2.92Å; L186-R211 WeakPolarHBondContact CD1-O 3.43Å; L186-R211 WeakPolarHBondContact O-CD 3.47Å; L186-I214 HydrophobicContact CD1-CG2 4.48Å; L186-I214 HydrophobicContact CD2-CG2 4.28Å; L186-A215 HydrophobicContact CD1-CB 3.26Å; L186-L218 HydrophobicContact CD1-CD1 3.83Å; L186-L218 HydrophobicContact CD2-CD1 3.94Å; L186-L218 HydrophobicContact CG-CD1 4.02Å; L186-L245 HydrophobicContact CB-CD2 4.47Å; L186-L245 HydrophobicContact CD2-CD1 4.05Å; L186-L245 HydrophobicContact CD2-CD2 3.43Å; L186-L245 VanDerWaalsContact CD2-CD2 3.43Å; L186-L245 HydrophobicContact CD2-CG 3.81Å; L186-L249 HydrophobicContact CD2-CD1 4.16Å
187	S	91.7	Very high	92.3	Very high	70 Å²	70	47.3 Å²	47.3	49%	0.49	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	48.9	-176.8	-60	0	0	0	0	112.9	M183 A184 H190	M183-S187 PolarHBondContact O-N 2.8Å; A184-S187 PolarHBondContact O-N 3.33Å; S187-H190 PolarHBondContact O-CE1 3.35Å; S187-H190 VanDerWaalsContact O-CE1 3.31Å; S187-H190 PolarHBondContact O-ND1 3.29Å
188	L	93.3	Very high	91.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	25%	0.245	C	C	.	.			trans	-108.1	1.5	178.7	-71.8	171.7	0	0	0	113.2	M183 L186 H190 V191 A192 E208 R211 V212 A215	M183-L188 HydrophobicContact CB-CB 4.42Å; M183-L188 PolarHBondContact O-N 3.03Å; L186-L188 VanDerWaalsContact C-N 3.32Å; L186-L188 HydrophobicContact CB-CD1 3.97Å; L186-L188 HydrophobicContact CB-CG 4.15Å; L186-L188 HydrophobicContact CD1-CD1 4.4Å; L186-L188 PolarHBondContact O-N 2.92Å; L188-H190 VanDerWaalsContact C-N 3.26Å; L188-H190 PolarHBondContact O-N 2.96Å; L188-V191 HydrophobicContact CB-CG2 4.36Å; L188-V191 HydrophobicContact CD2-CG2 3.85Å; L188-V191 WeakPolarHBondContact O-CG2 3.37Å; L188-V191 PolarHBondContact O-N 2.86Å; L188-V191 VanDerWaalsContact O-N 3.13Å; L188-A192 PolarHBondContact O-N 3.16Å; L188-E208 HydrophobicContact CD2-CB 4.33Å; L188-R211 HydrophobicContact CD1-CB 4.03Å; L188-R211 HydrophobicContact CD2-CB 3.94Å; L188-R211 HydrophobicContact CG-CB 4.17Å; L188-V212 HydrophobicContact CD1-CG2 3.86Å; L188-V212 HydrophobicContact CD2-CG2 4.11Å; L188-A215 HydrophobicContact CD1-CB 4.2Å
189	S	92.8	Very high	91	Very high	70 Å²	70	50.5 Å²	50.5	49%	0.49	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60.5	-31.9	-175.4	-56.7	0	0	0	0	113.5	V191 A192	S189-V191 VanDerWaalsContact C-N 3.32Å; S189-V191 PolarHBondContact O-N 3.19Å; S189-A192 WeakPolarHBondContact O-CB 3.33Å
190	H	93.1	Very high	90.1	Very high	127 Å²	127	57.4 Å²	57.4	59%	0.588	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-71.6	-24.9	178.9	66	-64.3	0	0	0	113.2	S187 L188 E208	S187-H190 PolarHBondContact O-CE1 3.35Å; S187-H190 VanDerWaalsContact O-CE1 3.31Å; S187-H190 PolarHBondContact O-ND1 3.29Å; L188-H190 VanDerWaalsContact C-N 3.26Å; L188-H190 PolarHBondContact O-N 2.96Å; H190-E208 IonicContact CD2-OE1 3.2Å; H190-E208 IonicContact CE1-OE1 3.38Å; H190-E208 IonicContact NE2-OE1 3.07Å; H190-E208 PolarHBondContact NE2-OE1 3.5Å
191	V	93.5	Very high	89.6	Confident	12 Å²	12	56 Å²	56	7%	0.073	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-106.7	12.2	178.5	-74.3	0	0	0	0	113.5	V155 L188 S189 H193 S194 I204 E208	V155-V191 WeakPolarHBondContact CG2-O 3.32Å; L188-V191 HydrophobicContact CB-CG2 4.36Å; L188-V191 HydrophobicContact CD2-CG2 3.85Å; L188-V191 WeakPolarHBondContact O-CG2 3.37Å; L188-V191 PolarHBondContact O-N 2.86Å; L188-V191 VanDerWaalsContact O-N 3.13Å; S189-V191 VanDerWaalsContact C-N 3.32Å; S189-V191 PolarHBondContact O-N 3.19Å; V191-H193 VanDerWaalsContact C-N 3.28Å; V191-H193 PolarHBondContact O-N 2.94Å; V191-S194 WeakPolarHBondContact O-CB 3.29Å; V191-S194 PolarHBondContact O-N 3.03Å; V191-I204 HydrophobicContact CB-CG2 4.39Å; V191-E208 WeakPolarHBondContact CG1-OE1 3.39Å
192	A	92.9	Very high	89.2	Confident	8 Å²	8	59.2 Å²	59.2	7%	0.066	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-47.6	-178.4	0	0	0	0	0	114	E156 M183 L188 S189	E156-A192 WeakPolarHBondContact CB-O 3.26Å; E156-A192 PolarHBondContact N-O 3.49Å; M183-A192 HydrophobicContact CE-CB 3.25Å; L188-A192 PolarHBondContact O-N 3.16Å; S189-A192 WeakPolarHBondContact O-CB 3.33Å
193	H	94.1	Very high	89	Confident	145 Å²	145	61.1 Å²	61.1	67%	0.671	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	1.5	-175.8	-53.2	-54.7	0	0	0	113.2	T154 E156 V191	T154-H193 WeakPolarHBondContact CG2-O 3.34Å; E156-H193 IonicContact OE2-CE1 2.8Å; E156-H193 PolarHBondContact OE2-CE1 3.17Å; E156-H193 IonicContact OE2-ND1 3.87Å; E156-H193 PolarHBondContact OE2-ND1 3.46Å; V191-H193 VanDerWaalsContact C-N 3.28Å; V191-H193 PolarHBondContact O-N 2.94Å
194	S	93.1	Very high	89	Confident	52 Å²	52	61.9 Å²	61.9	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-75.9	143.6	175.6	-61.2	0	0	0	0	110.4	T154 V155 V191	T154-S194 VanDerWaalsContact CA-O 3.25Å; T154-S194 WeakPolarHBondContact CA-O 3.29Å; T154-S194 WeakPolarHBondContact CB-O 3.38Å; V155-S194 PolarHBondContact N-O 3.33Å; V191-S194 WeakPolarHBondContact O-CB 3.29Å; V191-S194 PolarHBondContact O-N 3.03Å
195	V	92.6	Very high	88.8	Confident	57 Å²	57	62 Å²	62	35%	0.345	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-73.9	137.4	176.3	-178.8	0	0	0	0	109.3	S151 T154 G197 F201 I204	S151-V195 WeakPolarHBondContact O-CG1 3.33Å; T154-V195 HydrophobicContact CG2-CG2 4.46Å; V195-G197 VanDerWaalsContact C-N 3.31Å; V195-G197 PolarHBondContact O-N 3.24Å; V195-F201 HydrophobicContact CG1-CE2 3.87Å; V195-F201 HydrophobicContact CG1-CZ 4.43Å; V195-I204 PolarHBondContact O-N 3.44Å
196	I	91.3	Very high	88.7	Confident	4 Å²	4	62 Å²	62	2%	0.021	35%	0.353	C	S	.	.			trans	-61.2	-41.2	-177.1	-66.4	170.8	0	0	0	111.2	L149 L153 V155 T158 I204	L149-I196 HydrophobicContact CB-CD1 4.03Å; L149-I196 HydrophobicContact CB-CG2 4.16Å; L149-I196 HydrophobicContact CD1-CD1 4.09Å; L149-I196 HydrophobicContact CD1-CG2 4.27Å; L153-I196 PolarHBondContact O-N 3.45Å; V155-I196 HydrophobicContact CG2-CG1 4.26Å; T158-I196 HydrophobicContact CG2-CD1 4.02Å; T158-I196 WeakPolarHBondContact OG1-CD1 3.38Å; I196-I204 HydrophobicContact CB-CD1 4.47Å; I196-I204 HydrophobicContact CG1-CD1 4.34Å; I196-I204 HydrophobicContact CG2-CD1 4.19Å; I196-I204 HydrophobicContact CG2-CG1 4.44Å; I196-I204 WeakPolarHBondContact O-CG1 3.46Å; I196-I204 PolarHBondContact O-N 3.41Å
197	G	87.4	Confident	88.6	Confident	5 Å²	5	62.2 Å²	62.2	5%	0.052	36%	0.356	C	S	.	.			trans	82.9	170.5	-177.4	0	0	0	0	0	113.1	S151 V195 F201	S151-G197 WeakPolarHBondContact CA-O 3.35Å; S151-G197 VanDerWaalsContact CB-O 3.23Å; S151-G197 WeakPolarHBondContact CB-O 3.36Å; S151-G197 PolarHBondContact O-N 3.04Å; S151-G197 PolarHBondContact OG-O 2.76Å; S151-G197 VanDerWaalsContact OG-O 3.07Å; V195-G197 VanDerWaalsContact C-N 3.31Å; V195-G197 PolarHBondContact O-N 3.24Å; G197-F201 VanDerWaalsContact CA-CE2 3.48Å
198	G	81.9	Confident	88.5	Confident	23 Å²	23	60.3 Å²	60.3	24%	0.237	34%	0.339	C	S	.	.			trans	-141.7	-162	-179	0	0	0	0	0	111.2	S151 I200 F201	S151-G198 WeakPolarHBondContact OG-CA 3.37Å; G198-I200 VanDerWaalsContact C-N 3.31Å; G198-F201 PolarHBondContact N-O 2.96Å
199	R	74	Confident	88.4	Confident	250 Å²	250	63.9 Å²	63.9	94%	0.943	35%	0.353	S	S	*	.	S	Bend	trans	-74.3	-26.8	172.7	-62.3	-176.6	-176.9	-171.5	0.3	112.5
200	I	74.6	Confident	88.2	Confident	146 Å²	146	61 Å²	61	75%	0.749	33%	0.331	S	S	*	.	S	Bend	trans	-84.3	-34.9	-174	-58.2	170.8	0	0	0	111.2	G198	G198-I200 VanDerWaalsContact C-N 3.31Å
201	F	82.8	Confident	88.2	Confident	52 Å²	52	56.7 Å²	56.7	23%	0.228	31%	0.31	C	S	.	.	S	Bend	trans	-137.1	143.3	-179	66.5	-86	0	0	0	111.1	S151 Y152 V195 G197 G198	S151-F201 VanDerWaalsContact O-CZ 3.29Å; S151-F201 WeakPolarHBondContact O-CZ 3.45Å; Y152-F201 AromaticContact CD1-CE1 3.65Å; Y152-F201 HydrophobicContact CD1-CE1 3.65Å; Y152-F201 HydrophobicContact CD1-CE2 4.34Å; Y152-F201 AromaticContact CD1-CZ 3.42Å; Y152-F201 HydrophobicContact CD1-CZ 3.42Å; Y152-F201 VanDerWaalsContact CD1-CZ 3.42Å; Y152-F201 AromaticContact CE1-CD1 3.98Å; Y152-F201 HydrophobicContact CE1-CD1 3.98Å; Y152-F201 AromaticContact CE1-CE1 3.22Å; Y152-F201 HydrophobicContact CE1-CE1 3.22Å; Y152-F201 AromaticContact CE1-CZ 3.54Å; Y152-F201 HydrophobicContact CE1-CZ 3.54Å; Y152-F201 HydrophobicContact CE2-CE1 4.29Å; Y152-F201 HydrophobicContact CG-CE1 4.32Å; Y152-F201 HydrophobicContact CG-CZ 4.04Å; Y152-F201 AromaticContact CZ-CE1 3.6Å; V195-F201 HydrophobicContact CG1-CE2 3.87Å; V195-F201 HydrophobicContact CG1-CZ 4.43Å; G197-F201 VanDerWaalsContact CA-CE2 3.48Å; G198-F201 PolarHBondContact N-O 2.96Å
202	P	84.8	Confident	88.1	Confident	125 Å²	125	56.2 Å²	56.2	81%	0.812	31%	0.307	S	S	*	.			trans	-67.6	149.4	-178.2	29	-34.8	0	0	0	111.5
203	G	88.6	Confident	88	Confident	45 Å²	45	55.9 Å²	55.9	46%	0.464	30%	0.304	S	S	.	.			trans	-150.3	-133.4	174.8	0	0	0	0	0	110.9
204	I	92.2	Very high	87.9	Confident	20 Å²	20	49 Å²	49	10%	0.103	27%	0.272	C	S	.	.	S	Bend	trans	-69.1	160.3	179.1	67.2	-178	0	0	0	112.1	V155 V191 V195 I196 E208 R209 V212	V155-I204 HydrophobicContact CG2-CD1 4.13Å; V155-I204 HydrophobicContact CG2-CG2 4.31Å; V191-I204 HydrophobicContact CB-CG2 4.39Å; V195-I204 PolarHBondContact O-N 3.44Å; I196-I204 HydrophobicContact CB-CD1 4.47Å; I196-I204 HydrophobicContact CG1-CD1 4.34Å; I196-I204 HydrophobicContact CG2-CD1 4.19Å; I196-I204 HydrophobicContact CG2-CG1 4.44Å; I196-I204 WeakPolarHBondContact O-CG1 3.46Å; I196-I204 PolarHBondContact O-N 3.41Å; I204-E208 HydrophobicContact CB-CB 4.21Å; I204-E208 HydrophobicContact CD1-CB 4.31Å; I204-E208 HydrophobicContact CG1-CB 4.44Å; I204-R209 HydrophobicContact CD1-CB 3.98Å; I204-R209 HydrophobicContact CG1-CB 4.1Å; I204-V212 HydrophobicContact CD1-CG2 4Å
205	S	89.9	Confident	87.8	Confident	60 Å²	60	46.6 Å²	46.6	42%	0.42	26%	0.255	S	S	.	.			trans	-65.1	157.9	176.9	67.6	0	0	0	0	112.1	G207 E208 R209	S205-G207 VanDerWaalsContact C-N 3.29Å; S205-G207 PolarHBondContact O-N 3.14Å; S205-E208 WeakPolarHBondContact CB-OE2 3.4Å; S205-E208 PolarHBondContact N-OE2 3.06Å; S205-E208 PolarHBondContact O-N 3.44Å; S205-E208 WeakPolarHBondContact OG-CB 3.35Å; S205-E208 WeakPolarHBondContact OG-CG 3.03Å; S205-E208 PolarHBondContact OG-N 3.44Å; S205-E208 PolarHBondContact OG-OE2 3.45Å; S205-R209 WeakPolarHBondContact O-CB 3.22Å; S205-R209 PolarHBondContact O-N 2.89Å
206	G	87.1	Confident	87.6	Confident	30 Å²	30	44.5 Å²	44.5	31%	0.309	24%	0.243	S	C	.	.	H	α-helix	trans	-59.1	-39.2	177.7	0	0	0	0	0	113	R209 R210	G206-R209 PolarHBondContact O-N 3.12Å; G206-R210 PolarHBondContact O-N 3.42Å
207	G	88.3	Confident	87.4	Confident	5 Å²	5	44.6 Å²	44.6	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-44.9	175	0	0	0	0	0	113.3	S205 R210 R211 T238	S205-G207 VanDerWaalsContact C-N 3.29Å; S205-G207 PolarHBondContact O-N 3.14Å; G207-R210 WeakPolarHBondContact O-CB 3.37Å; G207-R210 PolarHBondContact O-N 2.89Å; G207-R211 WeakPolarHBondContact O-CG 3.48Å; G207-R211 PolarHBondContact O-N 3.48Å; G207-T238 VanDerWaalsContact CA-CG2 3.46Å
208	E	91	Very high	87.5	Confident	30 Å²	30	44.4 Å²	44.4	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-41.6	175.4	-71.6	163.3	151.4	0	0	111	L188 H190 V191 I204 S205 R210 R211 V212	L188-E208 HydrophobicContact CD2-CB 4.33Å; H190-E208 IonicContact CD2-OE1 3.2Å; H190-E208 IonicContact CE1-OE1 3.38Å; H190-E208 IonicContact NE2-OE1 3.07Å; H190-E208 PolarHBondContact NE2-OE1 3.5Å; V191-E208 WeakPolarHBondContact CG1-OE1 3.39Å; I204-E208 HydrophobicContact CB-CB 4.21Å; I204-E208 HydrophobicContact CD1-CB 4.31Å; I204-E208 HydrophobicContact CG1-CB 4.44Å; S205-E208 WeakPolarHBondContact CB-OE2 3.4Å; S205-E208 PolarHBondContact N-OE2 3.06Å; S205-E208 PolarHBondContact O-N 3.44Å; S205-E208 WeakPolarHBondContact OG-CB 3.35Å; S205-E208 WeakPolarHBondContact OG-CG 3.03Å; S205-E208 PolarHBondContact OG-N 3.44Å; S205-E208 PolarHBondContact OG-OE2 3.45Å; E208-R210 VanDerWaalsContact C-N 3.29Å; E208-R210 PolarHBondContact O-N 3.17Å; E208-R211 CarbonylContact O-C 3.56Å; E208-R211 WeakPolarHBondContact O-CB 3.25Å; E208-R211 PolarHBondContact O-N 2.88Å; E208-R211 VanDerWaalsContact O-N 3.1Å; E208-V212 WeakPolarHBondContact O-CG2 3.4Å; E208-V212 PolarHBondContact O-N 2.87Å
209	R	90.6	Very high	87.7	Confident	75 Å²	75	43.4 Å²	43.4	28%	0.283	23%	0.23	S	C	.	.	H	α-helix	trans	-58.7	-41.2	174.9	-170.7	175	63.4	-163	2.1	111.8	D147 L149 I204 S205 G206 V212 S213	D147-R209 HydrophobicContact CB-CG 4.42Å; D147-R209 VanDerWaalsContact CG-NE 3.3Å; D147-R209 IonicContact OD2-CZ 2.81Å; D147-R209 IonicContact OD2-NE 2.72Å; D147-R209 PolarHBondContact OD2-NE 3.3Å; D147-R209 IonicContact OD2-NH2 3.24Å; D147-R209 PolarHBondContact OD2-NH2 2.97Å; L149-R209 HydrophobicContact CD1-CG 4.19Å; I204-R209 HydrophobicContact CD1-CB 3.98Å; I204-R209 HydrophobicContact CG1-CB 4.1Å; S205-R209 WeakPolarHBondContact O-CB 3.22Å; S205-R209 PolarHBondContact O-N 2.89Å; G206-R209 PolarHBondContact O-N 3.12Å; R209-V212 PolarHBondContact O-N 2.92Å; R209-S213 PolarHBondContact O-N 2.99Å
210	R	89.4	Confident	88	Confident	10 Å²	10	33.3 Å²	33.3	4%	0.038	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-43.5	174.4	-167.5	66.4	177.3	168.9	2.3	111.6	L143 Q144 S146 D147 G206 G207 E208 V212 S213 I214 D228 P230	L143-R210 PolarHBondContact O-NH1 2.82Å; L143-R210 PolarHBondContact O-NH2 3.22Å; L143-R210 VanDerWaalsContact O-NH2 3.16Å; Q144-R210 PolarHBondContact O-NH1 3.15Å; S146-R210 PolarHBondContact OG-NH1 2.83Å; D147-R210 IonicContact OD1-NH1 3.76Å; G206-R210 PolarHBondContact O-N 3.42Å; G207-R210 WeakPolarHBondContact O-CB 3.37Å; G207-R210 PolarHBondContact O-N 2.89Å; E208-R210 VanDerWaalsContact C-N 3.29Å; E208-R210 PolarHBondContact O-N 3.17Å; R210-V212 VanDerWaalsContact C-N 3.34Å; R210-V212 PolarHBondContact O-N 3.29Å; R210-S213 WeakPolarHBondContact O-CB 3.21Å; R210-S213 PolarHBondContact O-N 2.8Å; R210-I214 HydrophobicContact CG-CD1 4.49Å; R210-I214 WeakPolarHBondContact O-CG1 3.29Å; R210-I214 PolarHBondContact O-N 3.04Å; R210-D228 PolarHBondContact NH2-O 3.11Å; R210-P230 PolarHBondContact NE-O 3.49Å; R210-P230 VanDerWaalsContact NH2-CA 3.26Å
211	R	91.4	Very high	88.3	Confident	37 Å²	37	30.6 Å²	30.6	14%	0.14	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-40	173.8	-65.6	-179.1	-138.1	-179.6	0.6	111.9	L186 L188 G207 E208 S213 I214 A215 I242 L245	L186-R211 WeakPolarHBondContact CD1-O 3.43Å; L186-R211 WeakPolarHBondContact O-CD 3.47Å; L188-R211 HydrophobicContact CD1-CB 4.03Å; L188-R211 HydrophobicContact CD2-CB 3.94Å; L188-R211 HydrophobicContact CG-CB 4.17Å; G207-R211 WeakPolarHBondContact O-CG 3.48Å; G207-R211 PolarHBondContact O-N 3.48Å; E208-R211 CarbonylContact O-C 3.56Å; E208-R211 WeakPolarHBondContact O-CB 3.25Å; E208-R211 PolarHBondContact O-N 2.88Å; E208-R211 VanDerWaalsContact O-N 3.1Å; R211-S213 VanDerWaalsContact C-N 3.31Å; R211-S213 PolarHBondContact O-N 2.84Å; R211-I214 PolarHBondContact O-N 3.3Å; R211-A215 WeakPolarHBondContact O-CB 3.43Å; R211-A215 PolarHBondContact O-N 2.93Å; R211-I242 HydrophobicContact CG-CD1 3.42Å; R211-I242 VanDerWaalsContact CG-CD1 3.42Å; R211-L245 HydrophobicContact CG-CD2 4.04Å
212	V	92.6	Very high	88.3	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-38.3	175.9	177.6	0	0	0	0	111.1	L149 V155 L159 L188 I204 E208 R209 R210 A215 S216	L149-V212 HydrophobicContact CD1-CB 4.07Å; L149-V212 HydrophobicContact CD1-CG1 3.62Å; V155-V212 HydrophobicContact CB-CG2 4.4Å; V155-V212 HydrophobicContact CG1-CG1 4.37Å; V155-V212 HydrophobicContact CG1-CG2 3.64Å; V155-V212 HydrophobicContact CG2-CG2 3.93Å; L159-V212 HydrophobicContact CD2-CG1 4.42Å; L188-V212 HydrophobicContact CD1-CG2 3.86Å; L188-V212 HydrophobicContact CD2-CG2 4.11Å; I204-V212 HydrophobicContact CD1-CG2 4Å; E208-V212 WeakPolarHBondContact O-CG2 3.4Å; E208-V212 PolarHBondContact O-N 2.87Å; R209-V212 PolarHBondContact O-N 2.92Å; R210-V212 VanDerWaalsContact C-N 3.34Å; R210-V212 PolarHBondContact O-N 3.29Å; V212-A215 WeakPolarHBondContact O-CB 3.35Å; V212-A215 PolarHBondContact O-N 3.25Å; V212-S216 PolarHBondContact O-N 2.82Å
213	S	90.7	Very high	88.3	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-61.6	-45.2	174.2	-162.2	0	0	0	0	111.5	S146 R209 R210 R211 S216	S146-S213 WeakPolarHBondContact CB-OG 3.5Å; S146-S213 PolarHBondContact O-OG 3.33Å; S146-S213 PolarHBondContact OG-OG 3.45Å; R209-S213 PolarHBondContact O-N 2.99Å; R210-S213 WeakPolarHBondContact O-CB 3.21Å; R210-S213 PolarHBondContact O-N 2.8Å; R211-S213 VanDerWaalsContact C-N 3.31Å; R211-S213 PolarHBondContact O-N 2.84Å; S213-S216 WeakPolarHBondContact O-CB 3.42Å; S213-S216 PolarHBondContact O-N 2.94Å; S213-S216 PolarHBondContact O-OG 3.07Å
214	I	90.8	Very high	88.3	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-42.5	174.2	-62	164.9	0	0	0	110.5	V142 L186 R210 R211 S216 Q217 L218 L227 I242 L246 L249	V142-I214 HydrophobicContact CG1-CG1 4.34Å; V142-I214 HydrophobicContact CG2-CG1 4.31Å; L186-I214 HydrophobicContact CD1-CG2 4.48Å; L186-I214 HydrophobicContact CD2-CG2 4.28Å; R210-I214 HydrophobicContact CG-CD1 4.49Å; R210-I214 WeakPolarHBondContact O-CG1 3.29Å; R210-I214 PolarHBondContact O-N 3.04Å; R211-I214 PolarHBondContact O-N 3.3Å; I214-S216 VanDerWaalsContact C-N 3.29Å; I214-S216 PolarHBondContact O-N 3Å; I214-Q217 PolarHBondContact O-N 2.69Å; I214-Q217 VanDerWaalsContact O-N 3.11Å; I214-L218 HydrophobicContact CG2-CD1 4.18Å; I214-L218 HydrophobicContact CG2-CG 4.27Å; I214-L218 WeakPolarHBondContact O-CG 3.36Å; I214-L218 PolarHBondContact O-N 2.8Å; I214-L227 HydrophobicContact CD1-CD2 3.97Å; I214-L227 HydrophobicContact CG1-CD2 3.9Å; I214-I242 HydrophobicContact CD1-CG2 4.39Å; I214-L246 HydrophobicContact CD1-CD2 4.26Å; I214-L249 HydrophobicContact CG2-CD1 4.26Å
215	A	91.7	Very high	88.3	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-56.4	-44	177.2	0	0	0	0	0	111.6	L159 V182 L186 L188 R211 V212 Q217 L218 L219	L159-A215 HydrophobicContact CD1-CB 4.03Å; L159-A215 HydrophobicContact CD2-CB 3.61Å; L159-A215 HydrophobicContact CG-CB 4.49Å; V182-A215 HydrophobicContact CG1-CB 3.91Å; L186-A215 HydrophobicContact CD1-CB 3.26Å; L188-A215 HydrophobicContact CD1-CB 4.2Å; R211-A215 WeakPolarHBondContact O-CB 3.43Å; R211-A215 PolarHBondContact O-N 2.93Å; V212-A215 WeakPolarHBondContact O-CB 3.35Å; V212-A215 PolarHBondContact O-N 3.25Å; A215-Q217 PolarHBondContact O-N 3.45Å; A215-L218 PolarHBondContact O-N 2.86Å; A215-L218 VanDerWaalsContact O-N 3.16Å; A215-L219 WeakPolarHBondContact O-CG 3.5Å; A215-L219 PolarHBondContact O-N 2.83Å; A215-L219 VanDerWaalsContact O-N 3.17Å
216	S	89.1	Confident	88.4	Confident	14 Å²	14	19.7 Å²	19.7	10%	0.098	10%	0.1	C	C	.	.	H	α-helix	trans	-56	-35.8	179.5	79.2	0	0	0	0	112.6	V212 S213 I214	V212-S216 PolarHBondContact O-N 2.82Å; S213-S216 WeakPolarHBondContact O-CB 3.42Å; S213-S216 PolarHBondContact O-N 2.94Å; S213-S216 PolarHBondContact O-OG 3.07Å; I214-S216 VanDerWaalsContact C-N 3.29Å; I214-S216 PolarHBondContact O-N 3Å
217	Q	86.8	Confident	88.6	Confident	6 Å²	6	18.2 Å²	18.2	3%	0.028	9%	0.085	C	C	.	.	H	α-helix	trans	-83.3	-34.9	179.9	-58.3	-59	-42.3	0	0	112.3	S140 V142 I214 A215 L219 Q220 P222 D469	S140-Q217 VanDerWaalsContact OG-CB 3.28Å; S140-Q217 WeakPolarHBondContact OG-CB 3.35Å; V142-Q217 HydrophobicContact CG2-CB 4.46Å; V142-Q217 HydrophobicContact CG2-CG 3.98Å; I214-Q217 PolarHBondContact O-N 2.69Å; I214-Q217 VanDerWaalsContact O-N 3.11Å; A215-Q217 PolarHBondContact O-N 3.45Å; Q217-L219 PolarHBondContact O-N 2.82Å; Q217-Q220 PolarHBondContact O-N 2.86Å; Q217-P222 WeakPolarHBondContact O-CD 3.45Å; Q217-D469 PolarHBondContact NE2-OD2 3.05Å
218	L	88.4	Confident	88.8	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-63	-26.1	175	-71.6	-178.1	0	0	0	113.4	V182 L186 I214 A215 Q220 D221 I225 L249	V182-L218 HydrophobicContact CG1-CB 4.02Å; V182-L218 HydrophobicContact CG1-CD1 4.49Å; L186-L218 HydrophobicContact CD1-CD1 3.83Å; L186-L218 HydrophobicContact CD2-CD1 3.94Å; L186-L218 HydrophobicContact CG-CD1 4.02Å; I214-L218 HydrophobicContact CG2-CD1 4.18Å; I214-L218 HydrophobicContact CG2-CG 4.27Å; I214-L218 WeakPolarHBondContact O-CG 3.36Å; I214-L218 PolarHBondContact O-N 2.8Å; A215-L218 PolarHBondContact O-N 2.86Å; A215-L218 VanDerWaalsContact O-N 3.16Å; L218-Q220 PolarHBondContact O-N 3Å; L218-D221 PolarHBondContact O-N 3.47Å; L218-I225 HydrophobicContact CD2-CD1 3.44Å; L218-I225 VanDerWaalsContact CD2-CD1 3.44Å; L218-L249 HydrophobicContact CD1-CD1 3.96Å; L218-L249 HydrophobicContact CD1-CD2 3.7Å; L218-L249 HydrophobicContact CD2-CD1 4.46Å; L218-L249 HydrophobicContact CD2-CD2 4.28Å
219	L	86.9	Confident	88.7	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.005	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.2	176	-70.4	168.1	0	0	0	113.5	L159 A163 K178 V179 V182 A215 Q217 D221	L159-L219 HydrophobicContact CB-CD1 4.19Å; L159-L219 HydrophobicContact CD2-CD1 3.96Å; L159-L219 VanDerWaalsContact O-CD1 3.28Å; L159-L219 WeakPolarHBondContact O-CD1 3.38Å; A163-L219 HydrophobicContact CB-CD1 4Å; A163-L219 HydrophobicContact CB-CD2 4.11Å; A163-L219 HydrophobicContact CB-CG 4.49Å; K178-L219 WeakPolarHBondContact CE-O 3.28Å; K178-L219 PolarHBondContact NZ-O 2.77Å; V179-L219 HydrophobicContact CG2-CD2 3.87Å; V182-L219 HydrophobicContact CB-CD2 4.3Å; V182-L219 HydrophobicContact CG2-CD2 4.08Å; A215-L219 WeakPolarHBondContact O-CG 3.5Å; A215-L219 PolarHBondContact O-N 2.83Å; A215-L219 VanDerWaalsContact O-N 3.17Å; Q217-L219 PolarHBondContact O-N 2.82Å; L219-D221 VanDerWaalsContact C-N 3.29Å
220	Q	80.1	Confident	88.7	Confident	39 Å²	39	14.2 Å²	14.2	18%	0.182	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2	176.8	-57.3	179.1	16.1	0	0	113.1	A166 Q217 L218	A166-Q220 HydrophobicContact CB-CG 4.2Å; Q217-Q220 PolarHBondContact O-N 2.86Å; L218-Q220 PolarHBondContact O-N 3Å
221	D	81.8	Confident	88.6	Confident	89 Å²	89	14.6 Å²	14.6	48%	0.476	7%	0.071	S	C	.	.			trans	48.3	53.8	-169.4	-66.2	-35.5	0	0	0	114.4	K178 L218 L219	K178-D221 WeakPolarHBondContact CE-OD2 3.48Å; K178-D221 VanDerWaalsContact NZ-CG 3.28Å; K178-D221 IonicContact NZ-OD1 2.62Å; K178-D221 IonicContact NZ-OD2 2.72Å; K178-D221 PolarHBondContact NZ-OD2 3.33Å; L218-D221 PolarHBondContact O-N 3.47Å; L219-D221 VanDerWaalsContact C-N 3.29Å
222	P	83.3	Confident	88.4	Confident	14 Å²	14	15.2 Å²	15.2	9%	0.091	8%	0.08	C	C	.	.			trans	-69.3	139.5	177.7	30.9	-36.3	0	0	0	111.3	S140 Q217 I225 R254	S140-P222 VanDerWaalsContact CB-CG 3.43Å; Q217-P222 WeakPolarHBondContact O-CD 3.45Å; P222-I225 HydrophobicContact CB-CG1 4.44Å; P222-I225 HydrophobicContact CG-CD1 4.41Å; P222-I225 HydrophobicContact CG-CG1 3.99Å; P222-R254 PolarHBondContact O-NH1 3.44Å
223	R	83.2	Confident	87.9	Confident	57 Å²	57	19.4 Å²	19.4	22%	0.215	12%	0.123	C	C	.	.	S	Bend	trans	-82.8	-26.4	169.1	-67	-161.8	179.7	-155.1	-6.7	112.8	P44 R254 I255 I365	P44-R223 PolarHBondContact O-NH1 3.38Å; R223-R254 WeakPolarHBondContact O-CA 2.93Å; R223-I255 PolarHBondContact O-N 2.9Å; R223-I365 HydrophobicContact CB-CD1 4.27Å; R223-I365 HydrophobicContact CB-CG2 4.33Å; R223-I365 HydrophobicContact CG-CG2 4.03Å
224	V	89.3	Confident	87.6	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.9	176.7	-168.6	0	0	0	0	110	L48 F139 S140 L226 I255	L48-V224 HydrophobicContact CD2-CG1 4.23Å; F139-V224 HydrophobicContact CD1-CB 3.77Å; F139-V224 HydrophobicContact CD1-CG1 3.55Å; F139-V224 HydrophobicContact CD1-CG2 4.48Å; F139-V224 HydrophobicContact CE1-CB 4.06Å; F139-V224 HydrophobicContact CE1-CG1 3.67Å; F139-V224 HydrophobicContact CE1-CG2 4.36Å; S140-V224 PolarHBondContact N-O 3.16Å; V224-L226 HydrophobicContact CG1-CD2 4.2Å; V224-I255 WeakPolarHBondContact CA-O 3.49Å; V224-I255 HydrophobicContact CB-CB 4.44Å; V224-I255 HydrophobicContact CG1-CB 4.12Å; V224-I255 HydrophobicContact CG1-CG2 3.99Å; V224-I255 HydrophobicContact CG2-CB 4.22Å; V224-I255 HydrophobicContact CG2-CD1 4.21Å
225	I	91.1	Very high	87.4	Confident	1 Å²	1	25 Å²	25	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.2	-179.4	-48.8	175.8	0	0	0	108.5	L218 P222 L227 I255 V256 I257	L218-I225 HydrophobicContact CD2-CD1 3.44Å; L218-I225 VanDerWaalsContact CD2-CD1 3.44Å; P222-I225 HydrophobicContact CB-CG1 4.44Å; P222-I225 HydrophobicContact CG-CD1 4.41Å; P222-I225 HydrophobicContact CG-CG1 3.99Å; I225-L227 HydrophobicContact CB-CD1 4.3Å; I225-L227 HydrophobicContact CG2-CD1 3.54Å; I225-L227 HydrophobicContact CG2-CG 4.11Å; I225-I255 PolarHBondContact N-O 2.84Å; I225-V256 WeakPolarHBondContact O-CA 3.12Å; I225-I257 PolarHBondContact O-N 3.43Å
226	L	92.6	Very high	87.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.5	175.6	-54.3	179.6	0	0	0	107.8	L106 I109 A110 F139 S140 Y141 V142 V224 I257	L106-L226 HydrophobicContact CD2-CB 4.35Å; L106-L226 HydrophobicContact CD2-CD2 4.23Å; I109-L226 HydrophobicContact CB-CD1 4.37Å; I109-L226 HydrophobicContact CG2-CD1 4.05Å; A110-L226 HydrophobicContact CB-CD1 3.85Å; F139-L226 HydrophobicContact CB-CD1 4.06Å; F139-L226 HydrophobicContact CD1-CD1 3.85Å; F139-L226 HydrophobicContact CD1-CD2 4.43Å; F139-L226 HydrophobicContact CD1-CG 4.16Å; F139-L226 HydrophobicContact CG-CD1 4.05Å; S140-L226 PolarHBondContact O-N 3.02Å; Y141-L226 CarbonylContact C-O 3.59Å; Y141-L226 WeakPolarHBondContact CA-O 3.14Å; Y141-L226 HydrophobicContact CD2-CB 3.65Å; Y141-L226 HydrophobicContact CD2-CD1 4Å; Y141-L226 HydrophobicContact CD2-CG 4.45Å; Y141-L226 HydrophobicContact CE2-CB 4.1Å; Y141-L226 HydrophobicContact CE2-CD1 4.44Å; Y141-L226 HydrophobicContact CG-CB 4.46Å; V142-L226 PolarHBondContact N-O 3.28Å; V224-L226 HydrophobicContact CG1-CD2 4.2Å; L226-I257 WeakPolarHBondContact CA-O 3.05Å; L226-I257 HydrophobicContact CD2-CB 3.79Å; L226-I257 HydrophobicContact CD2-CD1 3.82Å; L226-I257 HydrophobicContact CD2-CG1 4.03Å
227	L	92.6	Very high	87	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.5	178.7	-61.8	101.1	0	0	0	110.2	V142 I214 I225 P230 L246 V256 I257 V258 T259	V142-L227 HydrophobicContact CB-CB 4.37Å; V142-L227 HydrophobicContact CB-CD2 4.02Å; V142-L227 HydrophobicContact CB-CG 3.98Å; V142-L227 HydrophobicContact CG1-CD2 4.35Å; V142-L227 HydrophobicContact CG2-CD2 3.93Å; V142-L227 HydrophobicContact CG2-CG 3.99Å; I214-L227 HydrophobicContact CD1-CD2 3.97Å; I214-L227 HydrophobicContact CG1-CD2 3.9Å; I225-L227 HydrophobicContact CB-CD1 4.3Å; I225-L227 HydrophobicContact CG2-CD1 3.54Å; I225-L227 HydrophobicContact CG2-CG 4.11Å; L227-P230 HydrophobicContact CB-CB 4.3Å; L227-P230 HydrophobicContact CB-CG 3.98Å; L227-P230 HydrophobicContact CD2-CB 4.16Å; L227-P230 HydrophobicContact CD2-CG 4.4Å; L227-L246 HydrophobicContact CD1-CD1 4.43Å; L227-L246 HydrophobicContact CD1-CD2 3.79Å; L227-L246 HydrophobicContact CD2-CD1 4.06Å; L227-L246 HydrophobicContact CD2-CD2 3.58Å; L227-L246 HydrophobicContact CD2-CG 4.48Å; L227-L246 HydrophobicContact CG-CD2 4.37Å; L227-V256 HydrophobicContact CD1-CG1 3.65Å; L227-I257 PolarHBondContact N-O 3.13Å; L227-V258 HydrophobicContact CB-CG1 4.43Å; L227-V258 HydrophobicContact CB-CG2 4.39Å; L227-V258 HydrophobicContact CD1-CG2 4.1Å; L227-V258 WeakPolarHBondContact O-CA 3.39Å; L227-T259 PolarHBondContact O-N 3.2Å
228	D	91.6	Very high	87	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	20%	0.197	C	C	.	.	S	Bend	trans	-92.4	115.9	176.1	-165	28	0	0	0	110.4	T103 L106 Y141 V142 Q144 R210 T259	T103-D228 WeakPolarHBondContact CG2-OD2 3.4Å; T103-D228 PolarHBondContact OG1-OD1 2.98Å; T103-D228 PolarHBondContact OG1-OD2 3.34Å; L106-D228 HydrophobicContact CD1-CB 4.02Å; Y141-D228 HydrophobicContact CE1-CB 4.23Å; V142-D228 PolarHBondContact O-N 2.82Å; Q144-D228 VanDerWaalsContact CA-O 3.3Å; Q144-D228 WeakPolarHBondContact CA-O 3.06Å; Q144-D228 HydrophobicContact CB-CB 4.4Å; Q144-D228 PolarHBondContact N-O 3.08Å; R210-D228 PolarHBondContact NH2-O 3.11Å; D228-T259 VanDerWaalsContact CA-OG1 3.25Å; D228-T259 WeakPolarHBondContact CA-OG1 3.02Å; D228-T259 PolarHBondContact OD1-OG1 3.22Å
229	E	89.5	Confident	87	Confident	20 Å²	20	33.7 Å²	33.7	9%	0.093	20%	0.201	C	C	.	.	S	Bend	trans	44.3	53	174.9	-71.2	-166.9	179.8	0	0	115.1	Q144 T231 T232 T259	Q144-E229 HydrophobicContact CG-CB 3.99Å; Q144-E229 PolarHBondContact NE2-OE2 2.87Å; E229-T231 PolarHBondContact O-N 3.43Å; E229-T232 HydrophobicContact CB-CG2 3.7Å; E229-T232 HydrophobicContact CG-CG2 4.33Å; E229-T232 PolarHBondContact O-N 3.33Å; E229-T232 PolarHBondContact O-OG1 3.17Å; E229-T259 WeakPolarHBondContact CA-O 3.47Å; E229-T259 PolarHBondContact N-O 3.06Å; E229-T259 PolarHBondContact N-OG1 2.76Å
230	P	89.2	Confident	87.1	Confident	1 Å²	1	35 Å²	35	1%	0.006	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.6	-171.4	33.3	-38.1	0	0	0	116.1	R210 L227 L246 V258 T259	R210-P230 PolarHBondContact NE-O 3.49Å; R210-P230 VanDerWaalsContact NH2-CA 3.26Å; L227-P230 HydrophobicContact CB-CB 4.3Å; L227-P230 HydrophobicContact CB-CG 3.98Å; L227-P230 HydrophobicContact CD2-CB 4.16Å; L227-P230 HydrophobicContact CD2-CG 4.4Å; P230-L246 HydrophobicContact CG-CD1 4.19Å; P230-V258 HydrophobicContact CG-CG1 3.33Å; P230-T259 WeakPolarHBondContact CD-O 3.49Å
231	T	88.3	Confident	87.6	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.11	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-5.6	176.6	53	0	0	0	0	112.8	E229 L234 A239 V243	E229-T231 PolarHBondContact O-N 3.43Å; T231-L234 PolarHBondContact O-N 3.35Å; T231-A239 HydrophobicContact CG2-CB 3.96Å; T231-V243 HydrophobicContact CG2-CG2 3.66Å
232	T	86.1	Confident	88	Confident	51 Å²	51	33 Å²	33	31%	0.313	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	138.5	-176.2	56	0	0	0	0	112.3	E229 L234	E229-T232 HydrophobicContact CB-CG2 3.7Å; E229-T232 HydrophobicContact CG-CG2 4.33Å; E229-T232 PolarHBondContact O-N 3.33Å; E229-T232 PolarHBondContact O-OG1 3.17Å; T232-L234 PolarHBondContact O-N 2.82Å
233	G	81.9	Confident	88.4	Confident	89 Å²	89	32.4 Å²	32.4	92%	0.918	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.6	8.3	-178.7	0	0	0	0	0	115.1
234	L	85.7	Confident	88.8	Confident	34 Å²	34	32.6 Å²	32.6	18%	0.178	20%	0.2	C	C	.	.	S	Bend	trans	-101.5	151.9	173.7	-59.9	179.3	0	0	0	110.7	T231 T232 T238 A239 I242	T231-L234 PolarHBondContact O-N 3.35Å; T232-L234 PolarHBondContact O-N 2.82Å; L234-T238 HydrophobicContact CB-CG2 4.46Å; L234-T238 HydrophobicContact CD1-CG2 4.16Å; L234-T238 HydrophobicContact CD2-CG2 4.3Å; L234-A239 HydrophobicContact CB-CB 4.45Å; L234-I242 HydrophobicContact CD1-CG1 4.03Å
235	D	86.5	Confident	88.9	Confident	87 Å²	87	33.3 Å²	33.3	47%	0.465	20%	0.204	S	C	.	.			trans	-66.6	157.7	165.8	69.1	-79.3	0	0	0	110.1	M237 T238 A239	D235-M237 VanDerWaalsContact C-N 3.31Å; D235-M237 PolarHBondContact O-N 3.35Å; D235-M237 WeakPolarHBondContact OD2-CB 3.31Å; D235-M237 PolarHBondContact OD2-N 3.43Å; D235-T238 VanDerWaalsContact CG-OG1 3.23Å; D235-T238 PolarHBondContact O-N 2.94Å; D235-T238 WeakPolarHBondContact OD1-CB 3.28Å; D235-T238 PolarHBondContact OD1-OG1 3.28Å; D235-T238 PolarHBondContact OD2-N 3.26Å; D235-T238 PolarHBondContact OD2-OG1 3.01Å; D235-A239 WeakPolarHBondContact O-CB 3.48Å; D235-A239 PolarHBondContact O-N 2.96Å
236	S	84.3	Confident	89	Confident	44 Å²	44	33.3 Å²	33.3	31%	0.308	20%	0.203	S	C	.	.	H	α-helix	trans	-67.8	-29.2	-170.9	-53.6	0	0	0	0	114.7	N240 R264	S236-N240 PolarHBondContact O-N 3.49Å; S236-N240 VanDerWaalsContact O-N 3.11Å; S236-R264 PolarHBondContact OG-NE 3.38Å; S236-R264 PolarHBondContact OG-NH2 3.27Å
237	M	86.9	Confident	89	Confident	126 Å²	126	33.5 Å²	33.5	62%	0.621	21%	0.205	S	C	*	.	H	α-helix	trans	-68	-48.6	176.1	-175.2	-133.2	-63.1	0	0	109.6	D235 A239 N240 Q241	D235-M237 VanDerWaalsContact C-N 3.31Å; D235-M237 PolarHBondContact O-N 3.35Å; D235-M237 WeakPolarHBondContact OD2-CB 3.31Å; D235-M237 PolarHBondContact OD2-N 3.43Å; M237-A239 VanDerWaalsContact C-N 3.34Å; M237-A239 PolarHBondContact O-N 3.49Å; M237-N240 PolarHBondContact O-N 3Å; M237-Q241 WeakPolarHBondContact O-CG 3.09Å; M237-Q241 PolarHBondContact O-N 3.04Å; M237-Q241 PolarHBondContact SD-NE2 2.98Å; M237-Q241 VanDerWaalsContact SD-NE2 3.43Å
238	T	87.6	Confident	89	Confident	21 Å²	21	37.8 Å²	37.8	13%	0.129	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-41.5	176.3	-58.9	0	0	0	0	111.7	G207 L234 D235 N240 Q241 I242	G207-T238 VanDerWaalsContact CA-CG2 3.46Å; L234-T238 HydrophobicContact CB-CG2 4.46Å; L234-T238 HydrophobicContact CD1-CG2 4.16Å; L234-T238 HydrophobicContact CD2-CG2 4.3Å; D235-T238 VanDerWaalsContact CG-OG1 3.23Å; D235-T238 PolarHBondContact O-N 2.94Å; D235-T238 WeakPolarHBondContact OD1-CB 3.28Å; D235-T238 PolarHBondContact OD1-OG1 3.28Å; D235-T238 PolarHBondContact OD2-N 3.26Å; D235-T238 PolarHBondContact OD2-OG1 3.01Å; T238-N240 VanDerWaalsContact C-N 3.34Å; T238-N240 PolarHBondContact O-N 3.42Å; T238-Q241 WeakPolarHBondContact O-CB 3.45Å; T238-Q241 PolarHBondContact O-N 3.41Å; T238-I242 HydrophobicContact CG2-CG1 4.5Å; T238-I242 WeakPolarHBondContact O-CG1 3.44Å; T238-I242 PolarHBondContact O-N 2.84Å
239	A	88.5	Confident	88.9	Confident	11 Å²	11	37.6 Å²	37.6	9%	0.091	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-45.6	176.4	0	0	0	0	0	111.8	T231 L234 D235 M237 Q241 I242 V243	T231-A239 HydrophobicContact CG2-CB 3.96Å; L234-A239 HydrophobicContact CB-CB 4.45Å; D235-A239 WeakPolarHBondContact O-CB 3.48Å; D235-A239 PolarHBondContact O-N 2.96Å; M237-A239 VanDerWaalsContact C-N 3.34Å; M237-A239 PolarHBondContact O-N 3.49Å; A239-Q241 PolarHBondContact O-N 3.21Å; A239-I242 PolarHBondContact O-N 3.21Å; A239-V243 WeakPolarHBondContact O-CG2 3.25Å; A239-V243 PolarHBondContact O-N 3.12Å; A239-V243 VanDerWaalsContact O-N 3.07Å
240	N	90	Very high	89	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.15	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-44.8	175.4	-77.6	-8.1	0	0	0	112	S236 M237 T238 I242 V243 V244 E266 L267	S236-N240 PolarHBondContact O-N 3.49Å; S236-N240 VanDerWaalsContact O-N 3.11Å; M237-N240 PolarHBondContact O-N 3Å; T238-N240 VanDerWaalsContact C-N 3.34Å; T238-N240 PolarHBondContact O-N 3.42Å; N240-I242 VanDerWaalsContact C-N 3.31Å; N240-I242 PolarHBondContact O-N 3.2Å; N240-V243 PolarHBondContact O-N 3.38Å; N240-V244 WeakPolarHBondContact O-CG2 3.17Å; N240-V244 PolarHBondContact O-N 3.1Å; N240-E266 PolarHBondContact ND2-OE2 2.91Å; N240-L267 HydrophobicContact CB-CD2 4.48Å; N240-L267 VanDerWaalsContact OD1-CD2 3.29Å; N240-L267 WeakPolarHBondContact OD1-CD2 3.44Å
241	Q	89.6	Confident	89.1	Confident	88 Å²	88	45 Å²	45	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-41	176.9	-70.1	175.6	2.8	0	0	112.2	M237 T238 A239 V244 L245	M237-Q241 WeakPolarHBondContact O-CG 3.09Å; M237-Q241 PolarHBondContact O-N 3.04Å; M237-Q241 PolarHBondContact SD-NE2 2.98Å; M237-Q241 VanDerWaalsContact SD-NE2 3.43Å; T238-Q241 WeakPolarHBondContact O-CB 3.45Å; T238-Q241 PolarHBondContact O-N 3.41Å; A239-Q241 PolarHBondContact O-N 3.21Å; Q241-V244 PolarHBondContact O-N 2.91Å; Q241-L245 WeakPolarHBondContact O-CB 3.42Å; Q241-L245 PolarHBondContact O-N 3.19Å
242	I	90.9	Very high	89.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-44.8	176.4	-66.2	-65.6	0	0	0	110.8	R211 I214 L234 T238 A239 N240 L245 L246	R211-I242 HydrophobicContact CG-CD1 3.42Å; R211-I242 VanDerWaalsContact CG-CD1 3.42Å; I214-I242 HydrophobicContact CD1-CG2 4.39Å; L234-I242 HydrophobicContact CD1-CG1 4.03Å; T238-I242 HydrophobicContact CG2-CG1 4.5Å; T238-I242 WeakPolarHBondContact O-CG1 3.44Å; T238-I242 PolarHBondContact O-N 2.84Å; A239-I242 PolarHBondContact O-N 3.21Å; N240-I242 VanDerWaalsContact C-N 3.31Å; N240-I242 PolarHBondContact O-N 3.2Å; I242-L245 WeakPolarHBondContact O-CB 3.27Å; I242-L245 PolarHBondContact O-N 3.04Å; I242-L246 HydrophobicContact CG2-CD1 4.1Å; I242-L246 HydrophobicContact CG2-CG 4.44Å; I242-L246 VanDerWaalsContact O-CG 3.28Å; I242-L246 WeakPolarHBondContact O-CG 3.46Å; I242-L246 PolarHBondContact O-N 3.1Å
243	V	91.9	Very high	89.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-67.3	-38.3	-179.3	178.1	0	0	0	0	111.8	T231 A239 N240 L245 L246 A247 L267 V270 F271	T231-V243 HydrophobicContact CG2-CG2 3.66Å; A239-V243 WeakPolarHBondContact O-CG2 3.25Å; A239-V243 PolarHBondContact O-N 3.12Å; A239-V243 VanDerWaalsContact O-N 3.07Å; N240-V243 PolarHBondContact O-N 3.38Å; V243-L245 VanDerWaalsContact C-N 3.34Å; V243-L246 PolarHBondContact O-N 2.97Å; V243-A247 PolarHBondContact O-N 2.81Å; V243-L267 HydrophobicContact CB-CD2 3.83Å; V243-L267 HydrophobicContact CG1-CD2 3.84Å; V243-L267 HydrophobicContact CG2-CD1 4.07Å; V243-L267 HydrophobicContact CG2-CD2 4.26Å; V243-V270 HydrophobicContact CG1-CB 4.47Å; V243-V270 HydrophobicContact CG1-CG1 3.99Å; V243-F271 HydrophobicContact CG1-CE1 4.29Å; V243-F271 HydrophobicContact CG1-CZ 3.88Å
244	V	90.9	Very high	89.5	Confident	61 Å²	61	48.2 Å²	48.2	37%	0.37	23%	0.232	S	C	.	.	H	α-helix	trans	-61.9	-43.7	173.5	172.5	0	0	0	0	111	N240 Q241 L246 A247 E248	N240-V244 WeakPolarHBondContact O-CG2 3.17Å; N240-V244 PolarHBondContact O-N 3.1Å; Q241-V244 PolarHBondContact O-N 2.91Å; V244-L246 VanDerWaalsContact C-N 3.32Å; V244-L246 PolarHBondContact O-N 3.2Å; V244-A247 WeakPolarHBondContact O-CB 3.49Å; V244-A247 PolarHBondContact O-N 2.98Å; V244-A247 VanDerWaalsContact O-N 3.15Å; V244-E248 WeakPolarHBondContact O-CG 3.28Å; V244-E248 PolarHBondContact O-N 3.05Å
245	L	91.6	Very high	89.8	Confident	15 Å²	15	46.6 Å²	46.6	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-41.2	175.5	-176.3	65.7	0	0	0	111.9	L186 R211 Q241 I242 V243 A247 E248 L249	L186-L245 HydrophobicContact CB-CD2 4.47Å; L186-L245 HydrophobicContact CD2-CD1 4.05Å; L186-L245 HydrophobicContact CD2-CD2 3.43Å; L186-L245 VanDerWaalsContact CD2-CD2 3.43Å; L186-L245 HydrophobicContact CD2-CG 3.81Å; R211-L245 HydrophobicContact CG-CD2 4.04Å; Q241-L245 WeakPolarHBondContact O-CB 3.42Å; Q241-L245 PolarHBondContact O-N 3.19Å; I242-L245 WeakPolarHBondContact O-CB 3.27Å; I242-L245 PolarHBondContact O-N 3.04Å; V243-L245 VanDerWaalsContact C-N 3.34Å; L245-A247 VanDerWaalsContact C-N 3.34Å; L245-A247 PolarHBondContact O-N 3.44Å; L245-E248 WeakPolarHBondContact O-CB 3.48Å; L245-E248 PolarHBondContact O-N 3.49Å; L245-L249 WeakPolarHBondContact O-CG 3.42Å; L245-L249 PolarHBondContact O-N 3.33Å
246	L	92.8	Very high	90.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-38.2	174.7	-69	173.6	0	0	0	112.2	I91 I214 L227 P230 I242 V243 V244 L249 A250 V256 V258	I91-L246 HydrophobicContact CD1-CB 4.01Å; I214-L246 HydrophobicContact CD1-CD2 4.26Å; L227-L246 HydrophobicContact CD1-CD1 4.43Å; L227-L246 HydrophobicContact CD1-CD2 3.79Å; L227-L246 HydrophobicContact CD2-CD1 4.06Å; L227-L246 HydrophobicContact CD2-CD2 3.58Å; L227-L246 HydrophobicContact CD2-CG 4.48Å; L227-L246 HydrophobicContact CG-CD2 4.37Å; P230-L246 HydrophobicContact CG-CD1 4.19Å; I242-L246 HydrophobicContact CG2-CD1 4.1Å; I242-L246 HydrophobicContact CG2-CG 4.44Å; I242-L246 VanDerWaalsContact O-CG 3.28Å; I242-L246 WeakPolarHBondContact O-CG 3.46Å; I242-L246 PolarHBondContact O-N 3.1Å; V243-L246 PolarHBondContact O-N 2.97Å; V244-L246 VanDerWaalsContact C-N 3.32Å; V244-L246 PolarHBondContact O-N 3.2Å; L246-L249 HydrophobicContact CD2-CD1 4.2Å; L246-L249 PolarHBondContact O-N 2.92Å; L246-A250 PolarHBondContact O-N 3.25Å; L246-V256 HydrophobicContact CB-CG1 4.28Å; L246-V256 HydrophobicContact CD2-CG1 4.33Å; L246-V258 HydrophobicContact CD1-CG2 3.93Å
247	A	92.8	Very high	90.7	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-36.8	174	0	0	0	0	0	112	I91 V243 V244 L245 A250 R251 V270	I91-A247 HydrophobicContact CD1-CB 4.37Å; I91-A247 HydrophobicContact CG2-CB 4.32Å; V243-A247 PolarHBondContact O-N 2.81Å; V244-A247 WeakPolarHBondContact O-CB 3.49Å; V244-A247 PolarHBondContact O-N 2.98Å; V244-A247 VanDerWaalsContact O-N 3.15Å; L245-A247 VanDerWaalsContact C-N 3.34Å; L245-A247 PolarHBondContact O-N 3.44Å; A247-A250 WeakPolarHBondContact O-CB 3.44Å; A247-A250 PolarHBondContact O-N 3.31Å; A247-R251 WeakPolarHBondContact O-CG 3.37Å; A247-R251 PolarHBondContact O-N 2.69Å; A247-V270 HydrophobicContact CB-CG1 3.58Å
248	E	91.8	Very high	91	Very high	89 Å²	89	34.4 Å²	34.4	42%	0.416	16%	0.157	S	C	.	.	H	α-helix	trans	-64.9	-39.9	172.6	-73.2	176.8	-178.3	0	0	112.5	V244 L245 A250 R251 R252	V244-E248 WeakPolarHBondContact O-CG 3.28Å; V244-E248 PolarHBondContact O-N 3.05Å; L245-E248 WeakPolarHBondContact O-CB 3.48Å; L245-E248 PolarHBondContact O-N 3.49Å; E248-A250 VanDerWaalsContact C-N 3.32Å; E248-A250 PolarHBondContact O-N 2.91Å; E248-R251 PolarHBondContact O-N 3.44Å; E248-R252 PolarHBondContact O-N 2.98Å
249	L	90.6	Very high	91.3	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-40	173	-70.8	171.1	0	0	0	111.6	E185 L186 I214 L218 L245 L246 R252 R254	E185-L249 HydrophobicContact CG-CD2 4.02Å; E185-L249 WeakPolarHBondContact OE1-CD2 3.49Å; L186-L249 HydrophobicContact CD2-CD1 4.16Å; I214-L249 HydrophobicContact CG2-CD1 4.26Å; L218-L249 HydrophobicContact CD1-CD1 3.96Å; L218-L249 HydrophobicContact CD1-CD2 3.7Å; L218-L249 HydrophobicContact CD2-CD1 4.46Å; L218-L249 HydrophobicContact CD2-CD2 4.28Å; L245-L249 WeakPolarHBondContact O-CG 3.42Å; L245-L249 PolarHBondContact O-N 3.33Å; L246-L249 HydrophobicContact CD2-CD1 4.2Å; L246-L249 PolarHBondContact O-N 2.92Å; L249-R252 PolarHBondContact O-N 2.82Å; L249-R254 WeakPolarHBondContact O-CB 3.39Å
250	A	91.8	Very high	91.3	Very high	1 Å²	1	33 Å²	33	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-48.3	174.7	0	0	0	0	0	111	G89 I91 L246 A247 E248 R252 N253 R254 V256	G89-A250 WeakPolarHBondContact CA-O 3.33Å; I91-A250 HydrophobicContact CB-CB 4.19Å; L246-A250 PolarHBondContact O-N 3.25Å; A247-A250 WeakPolarHBondContact O-CB 3.44Å; A247-A250 PolarHBondContact O-N 3.31Å; E248-A250 VanDerWaalsContact C-N 3.32Å; E248-A250 PolarHBondContact O-N 2.91Å; A250-R252 PolarHBondContact O-N 2.97Å; A250-N253 PolarHBondContact O-N 2.96Å; A250-N253 VanDerWaalsContact O-N 3.12Å; A250-R254 WeakPolarHBondContact CA-O 2.91Å; A250-R254 PolarHBondContact O-N 2.82Å; A250-R254 VanDerWaalsContact O-N 3.08Å; A250-V256 HydrophobicContact CB-CB 4.29Å; A250-V256 HydrophobicContact CB-CG2 3.85Å
251	R	90.5	Very high	90.8	Very high	175 Å²	175	34.7 Å²	34.7	66%	0.66	15%	0.154	S	C	*	.	H	α-helix	trans	-55.5	-26.8	177.9	-70.5	179.4	-160.7	134.1	3.9	113.5	A247 E248 N253	A247-R251 WeakPolarHBondContact O-CG 3.37Å; A247-R251 PolarHBondContact O-N 2.69Å; E248-R251 PolarHBondContact O-N 3.44Å; R251-N253 PolarHBondContact O-N 3.39Å
252	R	88	Confident	90.2	Very high	149 Å²	149	37.1 Å²	37.1	56%	0.562	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	41.1	173.5	-65.3	179.2	176.4	-151.1	-0.4	112.8	E185 E248 L249 A250 R254	E185-R252 WeakPolarHBondContact OE1-CD 3.43Å; E185-R252 IonicContact OE1-CZ 3.87Å; E185-R252 IonicContact OE1-NE 3.56Å; E185-R252 PolarHBondContact OE1-NE 3.24Å; E185-R252 IonicContact OE1-NH1 3.1Å; E185-R252 PolarHBondContact OE1-NH1 3.03Å; E185-R252 IonicContact OE2-NH1 3.62Å; E248-R252 PolarHBondContact O-N 2.98Å; L249-R252 PolarHBondContact O-N 2.82Å; A250-R252 PolarHBondContact O-N 2.97Å; R252-R254 VanDerWaalsContact C-N 3.33Å; R252-R254 PolarHBondContact O-N 3.42Å
253	N	87.3	Confident	89.8	Confident	48 Å²	48	37.4 Å²	37.4	26%	0.257	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	43.6	177.6	-161.2	26.8	0	0	0	113.3	S88 A250 R251	S88-N253 VanDerWaalsContact CB-OD1 3.3Å; S88-N253 WeakPolarHBondContact CB-OD1 3.44Å; S88-N253 WeakPolarHBondContact OG-CA 3.28Å; S88-N253 PolarHBondContact OG-O 3.37Å; S88-N253 PolarHBondContact OG-OD1 3.19Å; A250-N253 PolarHBondContact O-N 2.96Å; A250-N253 VanDerWaalsContact O-N 3.12Å; R251-N253 PolarHBondContact O-N 3.39Å
254	R	89.1	Confident	89.5	Confident	28 Å²	28	43.2 Å²	43.2	11%	0.106	19%	0.189	C	C	.	.			trans	-119.5	154	172.1	-53.7	-175.5	-170.8	-121.5	9.6	110.4	S88 G89 P222 R223 L249 A250 R252	S88-R254 PolarHBondContact OG-N 2.88Å; G89-R254 PolarHBondContact N-O 3.25Å; P222-R254 PolarHBondContact O-NH1 3.44Å; R223-R254 WeakPolarHBondContact O-CA 2.93Å; L249-R254 WeakPolarHBondContact O-CB 3.39Å; A250-R254 WeakPolarHBondContact CA-O 2.91Å; A250-R254 PolarHBondContact O-N 2.82Å; A250-R254 VanDerWaalsContact O-N 3.08Å; R252-R254 VanDerWaalsContact C-N 3.33Å; R252-R254 PolarHBondContact O-N 3.42Å
255	I	91.9	Very high	89.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.5	169.7	-63	175.1	0	0	0	107.3	C46 L48 V86 R223 V224 I225 I257	C46-I255 HydrophobicContact CB-CD1 4.17Å; L48-I255 HydrophobicContact CB-CD1 3.92Å; V86-I255 HydrophobicContact CB-CG2 4.14Å; V86-I255 HydrophobicContact CG1-CG2 3.76Å; R223-I255 PolarHBondContact O-N 2.9Å; V224-I255 WeakPolarHBondContact CA-O 3.49Å; V224-I255 HydrophobicContact CB-CB 4.44Å; V224-I255 HydrophobicContact CG1-CB 4.12Å; V224-I255 HydrophobicContact CG1-CG2 3.99Å; V224-I255 HydrophobicContact CG2-CB 4.22Å; V224-I255 HydrophobicContact CG2-CD1 4.21Å; I225-I255 PolarHBondContact N-O 2.84Å; I255-I257 HydrophobicContact CG2-CG1 4.31Å
256	V	94.6	Very high	88.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.1	179.3	-175.9	0	0	0	0	109.5	Q90 I91 M92 I225 L227 L246 A250 V258	Q90-V256 PolarHBondContact O-N 3.11Å; I91-V256 CarbonylContact C-O 3.6Å; I91-V256 WeakPolarHBondContact CA-O 3.46Å; I91-V256 HydrophobicContact CG1-CB 4.34Å; I91-V256 HydrophobicContact CG1-CG1 4.32Å; M92-V256 PolarHBondContact N-O 2.8Å; I225-V256 WeakPolarHBondContact O-CA 3.12Å; L227-V256 HydrophobicContact CD1-CG1 3.65Å; L246-V256 HydrophobicContact CB-CG1 4.28Å; L246-V256 HydrophobicContact CD2-CG1 4.33Å; A250-V256 HydrophobicContact CB-CB 4.29Å; A250-V256 HydrophobicContact CB-CG2 3.85Å; V256-V258 HydrophobicContact CG1-CG2 3.86Å
257	I	95.1	Very high	88.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.8	175.2	-53.5	-176.9	0	0	0	108.4	L48 F84 V86 M92 I94 L106 I225 L226 L227 I255	L48-I257 HydrophobicContact CD2-CD1 3.63Å; F84-I257 HydrophobicContact CE2-CD1 4.02Å; F84-I257 HydrophobicContact CZ-CD1 4.36Å; V86-I257 HydrophobicContact CG2-CD1 4.42Å; M92-I257 HydrophobicContact CB-CG1 4.31Å; M92-I257 WeakPolarHBondContact O-CA 3.48Å; I94-I257 HydrophobicContact CD1-CG2 3.54Å; I94-I257 HydrophobicContact CG1-CG2 4.03Å; L106-I257 HydrophobicContact CD2-CB 4.48Å; L106-I257 HydrophobicContact CD2-CG2 3.83Å; I225-I257 PolarHBondContact O-N 3.43Å; L226-I257 WeakPolarHBondContact CA-O 3.05Å; L226-I257 HydrophobicContact CD2-CB 3.79Å; L226-I257 HydrophobicContact CD2-CD1 3.82Å; L226-I257 HydrophobicContact CD2-CG1 4.03Å; L227-I257 PolarHBondContact N-O 3.13Å; I255-I257 HydrophobicContact CG2-CG1 4.31Å
258	V	93.9	Very high	88.2	Confident	1 Å²	1	50 Å²	50	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.8	-175.6	-171.4	0	0	0	0	109.8	I91 M92 G93 I94 L227 P230 L246 V256 I260	I91-V258 HydrophobicContact CD1-CG2 4.43Å; M92-V258 PolarHBondContact O-N 3.28Å; G93-V258 CarbonylContact C-O 3.43Å; G93-V258 WeakPolarHBondContact CA-O 3.12Å; I94-V258 PolarHBondContact N-O 3.01Å; L227-V258 HydrophobicContact CB-CG1 4.43Å; L227-V258 HydrophobicContact CB-CG2 4.39Å; L227-V258 HydrophobicContact CD1-CG2 4.1Å; L227-V258 WeakPolarHBondContact O-CA 3.39Å; P230-V258 HydrophobicContact CG-CG1 3.33Å; L246-V258 HydrophobicContact CD1-CG2 3.93Å; V256-V258 HydrophobicContact CG1-CG2 3.86Å; V258-I260 HydrophobicContact CB-CG1 4.42Å; V258-I260 HydrophobicContact CG1-CD1 4.04Å; V258-I260 HydrophobicContact CG1-CG1 3.65Å
259	T	93	Very high	88	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.8	163.5	53.3	0	0	0	0	109.4	I94 K102 L106 L227 D228 E229 P230	I94-T259 HydrophobicContact CB-CG2 3.97Å; I94-T259 HydrophobicContact CD1-CG2 4.34Å; I94-T259 HydrophobicContact CG2-CG2 4.29Å; I94-T259 WeakPolarHBondContact O-CA 3.39Å; K102-T259 HydrophobicContact CB-CG2 3.77Å; L106-T259 HydrophobicContact CD1-CG2 3.32Å; L106-T259 HydrophobicContact CG-CG2 3.64Å; L227-T259 PolarHBondContact O-N 3.2Å; D228-T259 VanDerWaalsContact CA-OG1 3.25Å; D228-T259 WeakPolarHBondContact CA-OG1 3.02Å; D228-T259 PolarHBondContact OD1-OG1 3.22Å; E229-T259 WeakPolarHBondContact CA-O 3.47Å; E229-T259 PolarHBondContact N-O 3.06Å; E229-T259 PolarHBondContact N-OG1 2.76Å; P230-T259 WeakPolarHBondContact CD-O 3.49Å
260	I	88.4	Confident	87.9	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	26%	0.255	C	S	.	.			trans	-131.6	131.3	179.5	-54	179.5	0	0	0	110.1	I94 V258 P263 F271	I94-I260 PolarHBondContact O-N 3.31Å; V258-I260 HydrophobicContact CB-CG1 4.42Å; V258-I260 HydrophobicContact CG1-CD1 4.04Å; V258-I260 HydrophobicContact CG1-CG1 3.65Å; I260-P263 HydrophobicContact CG2-CB 3.8Å; I260-P263 HydrophobicContact CG2-CG 4.04Å; I260-F271 HydrophobicContact CD1-CE1 3.89Å; I260-F271 HydrophobicContact CD1-CE2 4.04Å; I260-F271 HydrophobicContact CD1-CZ 3.21Å
261	H	80.4	Confident	88	Confident	64 Å²	64	58.7 Å²	58.7	30%	0.296	26%	0.255	S	S	.	.	S	Bend	trans	-94	113.6	168.1	-166.1	-78.1	0	0	0	107.9	S98	S98-H261 PolarHBondContact OG-NE2 3.1Å
262	Q	77.8	Confident	88.1	Confident	140 Å²	140	52.5 Å²	52.5	65%	0.654	24%	0.239	S	C	*	.	S	Bend	trans	49.9	73.6	177.5	-66.9	179.2	-23.9	0	0	115.6
263	P	82.3	Confident	88.3	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.032	22%	0.216	C	C	.	.			trans	-72.1	150.3	173.6	24.1	-23.5	0	0	0	112.5	L95 I260 L267 N307 F309	L95-P263 HydrophobicContact CD2-CG 3.43Å; L95-P263 VanDerWaalsContact CD2-CG 3.43Å; L95-P263 HydrophobicContact CG-CG 4.38Å; I260-P263 HydrophobicContact CG2-CB 3.8Å; I260-P263 HydrophobicContact CG2-CG 4.04Å; P263-L267 HydrophobicContact CB-CB 4.49Å; P263-L267 HydrophobicContact CB-CD1 3.91Å; P263-N307 PolarHBondContact O-ND2 3.36Å; P263-F309 HydrophobicContact CB-CD2 4.15Å; P263-F309 HydrophobicContact CB-CE2 4.22Å; P263-F309 HydrophobicContact CG-CB 3.94Å; P263-F309 HydrophobicContact CG-CD1 4.05Å; P263-F309 HydrophobicContact CG-CD2 3.73Å; P263-F309 HydrophobicContact CG-CE1 4.34Å; P263-F309 HydrophobicContact CG-CE2 4.05Å; P263-F309 HydrophobicContact CG-CG 3.68Å; P263-F309 HydrophobicContact CG-CZ 4.31Å
264	R	84.1	Confident	88.6	Confident	123 Å²	123	44.1 Å²	44.1	46%	0.464	20%	0.203	S	C	.	.			trans	-67.4	151.1	168.3	-70.2	-166.5	168.6	-160.3	1	111.6	S236 E266 L267	S236-R264 PolarHBondContact OG-NE 3.38Å; S236-R264 PolarHBondContact OG-NH2 3.27Å; R264-E266 PolarHBondContact O-N 3.32Å; R264-L267 WeakPolarHBondContact O-CB 3.46Å; R264-L267 PolarHBondContact O-N 3.11Å
265	S	86.6	Confident	88.9	Confident	66 Å²	66	42.9 Å²	42.9	46%	0.462	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-56.6	-31	177.2	54.5	0	0	0	0	113.5	L267 F268 N307	S265-L267 PolarHBondContact O-N 3.04Å; S265-F268 WeakPolarHBondContact O-CB 3.42Å; S265-F268 PolarHBondContact O-N 3.17Å; S265-N307 WeakPolarHBondContact CA-OD1 3.25Å
266	E	84.7	Confident	89	Confident	121 Å²	121	43 Å²	43	57%	0.565	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-58.3	-30.8	176.3	-67	171	-165.8	0	0	113	N240 R264 F268	N240-E266 PolarHBondContact ND2-OE2 2.91Å; R264-E266 PolarHBondContact O-N 3.32Å; E266-F268 PolarHBondContact O-N 2.74Å
267	L	85.9	Confident	88.9	Confident	6 Å²	6	43 Å²	43	3%	0.031	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-75.5	-11.9	-179.3	-60.3	179.2	0	0	0	112.9	N240 V243 P263 R264 S265 R269 V270 F271 F309	N240-L267 HydrophobicContact CB-CD2 4.48Å; N240-L267 VanDerWaalsContact OD1-CD2 3.29Å; N240-L267 WeakPolarHBondContact OD1-CD2 3.44Å; V243-L267 HydrophobicContact CB-CD2 3.83Å; V243-L267 HydrophobicContact CG1-CD2 3.84Å; V243-L267 HydrophobicContact CG2-CD1 4.07Å; V243-L267 HydrophobicContact CG2-CD2 4.26Å; P263-L267 HydrophobicContact CB-CB 4.49Å; P263-L267 HydrophobicContact CB-CD1 3.91Å; R264-L267 WeakPolarHBondContact O-CB 3.46Å; R264-L267 PolarHBondContact O-N 3.11Å; S265-L267 PolarHBondContact O-N 3.04Å; L267-R269 PolarHBondContact O-N 2.66Å; L267-V270 WeakPolarHBondContact O-CB 3.48Å; L267-V270 PolarHBondContact O-N 3.18Å; L267-F271 HydrophobicContact CB-CE2 3.81Å; L267-F271 WeakPolarHBondContact O-CD2 3.41Å; L267-F271 WeakPolarHBondContact O-CE2 3.15Å; L267-F309 HydrophobicContact CB-CE2 4.46Å
268	F	85.5	Confident	88.7	Confident	30 Å²	30	43.4 Å²	43.4	13%	0.132	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-56.1	-39.7	-176.5	-168.4	-97.3	0	0	0	112.8	S265 E266 V270 I274 P288 M291 V292 P308 F309	S265-F268 WeakPolarHBondContact O-CB 3.42Å; S265-F268 PolarHBondContact O-N 3.17Å; E266-F268 PolarHBondContact O-N 2.74Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3Å; F268-I274 HydrophobicContact CD2-CD1 4.25Å; F268-I274 HydrophobicContact CE2-CD1 4.18Å; F268-P288 HydrophobicContact CD1-CB 3.82Å; F268-P288 HydrophobicContact CE1-CB 3.35Å; F268-P288 HydrophobicContact CE2-CB 4.19Å; F268-P288 HydrophobicContact CG-CB 4.4Å; F268-P288 HydrophobicContact CZ-CB 3.57Å; F268-P288 VanDerWaalsContact CZ-O 3.3Å; F268-P288 WeakPolarHBondContact CZ-O 3.41Å; F268-P288 WeakPolarHBondContact O-CG 3.15Å; F268-M291 HydrophobicContact CD2-CE 4.35Å; F268-M291 HydrophobicContact CE2-CE 3.28Å; F268-M291 HydrophobicContact CZ-CE 3.81Å; F268-V292 HydrophobicContact CE1-CG2 4.48Å; F268-V292 HydrophobicContact CZ-CG2 3.89Å; F268-P308 HydrophobicContact CD2-CB 4.31Å; F268-P308 HydrophobicContact CD2-CG 3.68Å; F268-P308 HydrophobicContact CE2-CB 3.94Å; F268-P308 HydrophobicContact CE2-CG 3.79Å; F268-P308 HydrophobicContact CG-CG 4.25Å; F268-P308 HydrophobicContact CZ-CG 4.48Å; F268-F309 VanDerWaalsContact CA-CE2 3.45Å; F268-F309 VanDerWaalsContact CA-CZ 3.44Å; F268-F309 HydrophobicContact CB-CD2 4.48Å; F268-F309 HydrophobicContact CB-CE2 3.64Å; F268-F309 HydrophobicContact CB-CZ 3.93Å; F268-F309 HydrophobicContact CD2-CD1 4.22Å; F268-F309 HydrophobicContact CD2-CD2 4.15Å; F268-F309 AromaticContact CD2-CE1 3.83Å; F268-F309 HydrophobicContact CD2-CE1 3.83Å; F268-F309 AromaticContact CD2-CE2 3.74Å; F268-F309 HydrophobicContact CD2-CE2 3.74Å; F268-F309 HydrophobicContact CD2-CG 4.41Å; F268-F309 AromaticContact CD2-CZ 3.59Å; F268-F309 HydrophobicContact CD2-CZ 3.59Å; F268-F309 HydrophobicContact CE2-CE1 4.43Å; F268-F309 HydrophobicContact CG-CE2 4.2Å; F268-F309 HydrophobicContact CG-CZ 4.18Å
269	R	85.6	Confident	88.5	Confident	233 Å²	233	47.8 Å²	47.8	88%	0.879	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-81.4	-11	-179.3	-60.2	-178.7	179.5	-176.9	-0.4	113.7	L267	L267-R269 PolarHBondContact O-N 2.66Å
270	V	90.4	Very high	88.3	Confident	37 Å²	37	47.9 Å²	47.9	22%	0.224	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-32	-177.9	-175.2	0	0	0	0	110.8	I91 V243 A247 L267 F268	I91-V270 VanDerWaalsContact CG2-O 3.27Å; I91-V270 WeakPolarHBondContact CG2-O 3.49Å; V243-V270 HydrophobicContact CG1-CB 4.47Å; V243-V270 HydrophobicContact CG1-CG1 3.99Å; A247-V270 HydrophobicContact CB-CG1 3.58Å; L267-V270 WeakPolarHBondContact O-CB 3.48Å; L267-V270 PolarHBondContact O-N 3.18Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3Å
271	F	92	Very high	88.4	Confident	5 Å²	5	49.5 Å²	49.5	2%	0.022	23%	0.227	C	C	.	.			trans	-74.1	129.3	179.4	-65.2	-67.9	0	0	0	112	I91 V243 I260 L267 I274 P288 F309	I91-F271 HydrophobicContact CD1-CD1 4.25Å; I91-F271 HydrophobicContact CD1-CE1 4.02Å; I91-F271 HydrophobicContact CG1-CD1 4.04Å; I91-F271 HydrophobicContact CG1-CE1 4.18Å; V243-F271 HydrophobicContact CG1-CE1 4.29Å; V243-F271 HydrophobicContact CG1-CZ 3.88Å; I260-F271 HydrophobicContact CD1-CE1 3.89Å; I260-F271 HydrophobicContact CD1-CE2 4.04Å; I260-F271 HydrophobicContact CD1-CZ 3.21Å; L267-F271 HydrophobicContact CB-CE2 3.81Å; L267-F271 WeakPolarHBondContact O-CD2 3.41Å; L267-F271 WeakPolarHBondContact O-CE2 3.15Å; F271-I274 HydrophobicContact CB-CD1 4.33Å; F271-I274 HydrophobicContact CB-CG1 3.83Å; F271-I274 HydrophobicContact CG-CG1 4.34Å; F271-P288 VanDerWaalsContact O-CG 3.23Å; F271-P288 WeakPolarHBondContact O-CG 3.37Å; F271-F309 AromaticContact CD2-CZ 3.87Å; F271-F309 HydrophobicContact CD2-CZ 3.87Å; F271-F309 HydrophobicContact CE2-CZ 4.13Å
272	S	92.9	Very high	89	Confident	44 Å²	44	47.2 Å²	47.2	31%	0.308	22%	0.217	S	C	.	.	S	Bend	trans	-76.2	-36.6	171.3	-45.9	0	0	0	0	110.8	I91	I91-S272 PolarHBondContact N-OG 3.11Å; I91-S272 WeakPolarHBondContact O-CB 3.21Å; I91-S272 PolarHBondContact O-N 3.41Å
273	R	93	Very high	89.7	Confident	21 Å²	21	40.5 Å²	40.5	8%	0.079	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.9	175.3	-58.3	-164.6	79.3	156.9	8.2	110.7	H85 I91 M92 G93 G286	H85-R273 PolarHBondContact O-NH1 3.47Å; I91-R273 PolarHBondContact O-N 2.9Å; I91-R273 VanDerWaalsContact O-N 3.11Å; M92-R273 CarbonylContact C-O 3.53Å; M92-R273 VanDerWaalsContact CA-O 3.3Å; M92-R273 WeakPolarHBondContact CA-O 3.37Å; M92-R273 HydrophobicContact CB-CB 4.49Å; M92-R273 HydrophobicContact CG-CB 4.26Å; G93-R273 PolarHBondContact N-O 3.36Å; R273-G286 CarbonylContact C-O 3.6Å; R273-G286 VanDerWaalsContact CA-O 3.27Å; R273-G286 WeakPolarHBondContact CA-O 3.39Å
274	I	94.1	Very high	90.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.2	175.3	-69.4	163	0	0	0	108.1	G93 L95 F268 F271 I276 C285 G286 P288 M291 F309	G93-I274 CarbonylContact O-C 3.42Å; G93-I274 WeakPolarHBondContact O-CA 3.29Å; L95-I274 HydrophobicContact CD1-CG2 3.48Å; L95-I274 VanDerWaalsContact CD1-CG2 3.48Å; F268-I274 HydrophobicContact CD2-CD1 4.25Å; F268-I274 HydrophobicContact CE2-CD1 4.18Å; F271-I274 HydrophobicContact CB-CD1 4.33Å; F271-I274 HydrophobicContact CB-CG1 3.83Å; F271-I274 HydrophobicContact CG-CG1 4.34Å; I274-I276 HydrophobicContact CG2-CG1 4.43Å; I274-C285 VanDerWaalsContact O-CA 3.32Å; I274-C285 WeakPolarHBondContact O-CA 3.29Å; I274-G286 PolarHBondContact N-O 3.21Å; I274-G286 PolarHBondContact O-N 3.01Å; I274-P288 HydrophobicContact CD1-CB 3.78Å; I274-P288 HydrophobicContact CD1-CG 3.74Å; I274-P288 HydrophobicContact CG1-CG 4.44Å; I274-M291 HydrophobicContact CB-SD 4.36Å; I274-M291 HydrophobicContact CD1-CE 3.91Å; I274-M291 HydrophobicContact CG2-CE 4.27Å; I274-M291 HydrophobicContact CG2-SD 3.7Å; I274-F309 HydrophobicContact CD1-CE1 3.52Å; I274-F309 HydrophobicContact CD1-CZ 4.02Å; I274-F309 HydrophobicContact CG1-CE1 4.13Å
275	A	94.1	Very high	90.7	Very high	2 Å²	2	34.4 Å²	34.4	2%	0.017	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.1	170.4	0	0	0	0	0	110.8	M92 G93 I94 L95 L282 F284 C285	M92-A275 HydrophobicContact CE-CB 3.48Å; M92-A275 VanDerWaalsContact CE-CB 3.48Å; G93-A275 PolarHBondContact O-N 3.42Å; I94-A275 CarbonylContact C-O 3.52Å; I94-A275 WeakPolarHBondContact CA-O 3.3Å; L95-A275 PolarHBondContact N-O 3Å; A275-L282 HydrophobicContact CB-CD1 3.91Å; A275-F284 CarbonylContact C-O 3.58Å; A275-F284 WeakPolarHBondContact CA-O 3.35Å; A275-C285 HydrophobicContact CB-CB 4.17Å
276	I	93.9	Very high	91	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.015	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.8	176.7	-60.3	178.9	0	0	0	108.9	I274 V283 F284 M291 F295 T316	I274-I276 HydrophobicContact CG2-CG1 4.43Å; I276-V283 HydrophobicContact CG2-CB 4.37Å; I276-V283 PolarHBondContact O-N 2.89Å; I276-F284 PolarHBondContact N-O 3.19Å; I276-M291 HydrophobicContact CD1-SD 3.82Å; I276-M291 HydrophobicContact CG1-SD 4.43Å; I276-F295 HydrophobicContact CD1-CE2 3.88Å; I276-F295 HydrophobicContact CD1-CZ 3.95Å; I276-T316 HydrophobicContact CG2-CG2 4.13Å; I276-T316 WeakPolarHBondContact CG2-OG1 3.34Å
277	M	92.6	Very high	91.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.2	176.2	-66.1	-173.4	76	0	0	111.4	L79 V82 I94 L95 G96 S100 K102 L105 E281 L282	L79-M277 HydrophobicContact CD2-CE 3.73Å; V82-M277 HydrophobicContact CG2-CE 4.32Å; I94-M277 HydrophobicContact CG2-CG 3.98Å; I94-M277 HydrophobicContact CG2-SD 3.71Å; L95-M277 PolarHBondContact O-N 2.93Å; G96-M277 WeakPolarHBondContact CA-O 3.42Å; S100-M277 WeakPolarHBondContact CB-O 3.2Å; S100-M277 PolarHBondContact OG-O 3.17Å; K102-M277 HydrophobicContact CG-SD 4.4Å; L105-M277 HydrophobicContact CB-CE 4.02Å; L105-M277 HydrophobicContact CB-SD 4.16Å; L105-M277 HydrophobicContact CD2-CE 3.77Å; L105-M277 HydrophobicContact CD2-SD 3.4Å; L105-M277 WeakPolarHBondContact CD2-SD 3.32Å; L105-M277 HydrophobicContact CG-CE 4.44Å; L105-M277 HydrophobicContact CG-SD 4.42Å; M277-E281 WeakPolarHBondContact CA-O 3.2Å; M277-L282 HydrophobicContact CG-CD1 4.43Å
278	S	91.8	Very high	91.5	Very high	7 Å²	7	30.3 Å²	30.3	5%	0.049	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	132.1	172.2	-168	0	0	0	0	110.1	G280 E281 T316 M333	S278-G280 PolarHBondContact O-N 2.91Å; S278-E281 PolarHBondContact N-O 2.79Å; S278-E281 PolarHBondContact O-N 3.23Å; S278-T316 WeakPolarHBondContact CB-O 3.33Å; S278-T316 PolarHBondContact OG-O 3.18Å; S278-M333 WeakPolarHBondContact O-CE 3.33Å
279	R	88.9	Confident	91.8	Very high	94 Å²	94	35.8 Å²	35.8	36%	0.355	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	31.4	179.7	-67.1	-67.2	-169	134.4	14.1	115.5	V318 E326	R279-V318 HydrophobicContact CG-CB 4.37Å; R279-V318 HydrophobicContact CG-CG2 4Å; R279-E326 IonicContact CZ-OE1 2.71Å; R279-E326 IonicContact NH2-OE1 2.77Å; R279-E326 PolarHBondContact NH2-OE1 2.73Å
280	G	88.4	Confident	92	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.01	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	-5.6	179.5	0	0	0	0	0	115.7	I78 L79 N80 S100 S278	I78-G280 WeakPolarHBondContact O-CA 3.47Å; L79-G280 WeakPolarHBondContact CA-O 3.25Å; N80-G280 PolarHBondContact N-O 3.44Å; S100-G280 WeakPolarHBondContact O-CA 3.33Å; S100-G280 PolarHBondContact O-N 3.12Å; S278-G280 PolarHBondContact O-N 2.91Å
281	E	91.5	Very high	92.1	Very high	37 Å²	37	25.7 Å²	25.7	17%	0.173	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	148.3	177.5	-72	173.7	-166.1	0	0	110.9	N80 M277 S278 M333	N80-E281 HydrophobicContact CB-CG 3.53Å; N80-E281 PolarHBondContact ND2-OE1 2.92Å; M277-E281 WeakPolarHBondContact CA-O 3.2Å; S278-E281 PolarHBondContact N-O 2.79Å; S278-E281 PolarHBondContact O-N 3.23Å; E281-M333 HydrophobicContact CB-CE 3.54Å; E281-M333 HydrophobicContact CG-CE 4.3Å; E281-M333 VanDerWaalsContact OE2-CE 3.29Å; E281-M333 WeakPolarHBondContact OE2-CE 3.46Å
282	L	92.4	Very high	92	Very high	15 Å²	15	27.8 Å²	27.8	8%	0.079	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	110.4	172.6	-176.7	70.8	0	0	0	109.2	V82 S83 A275 M277 C285 Y340	V82-L282 HydrophobicContact CG1-CB 4.21Å; V82-L282 HydrophobicContact CG1-CD2 4.45Å; V82-L282 HydrophobicContact CG2-CB 4.46Å; S83-L282 WeakPolarHBondContact O-CD2 3.33Å; A275-L282 HydrophobicContact CB-CD1 3.91Å; M277-L282 HydrophobicContact CG-CD1 4.43Å; L282-C285 HydrophobicContact CD1-CB 4.25Å; L282-C285 HydrophobicContact CD2-CB 3.95Å; L282-C285 HydrophobicContact CG-CB 4.41Å; L282-Y340 HydrophobicContact CD2-CE1 4.42Å
283	V	93.2	Very high	91.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-39.7	-177.3	-175.3	0	0	0	0	111.4	I276 T316 M333 I336 Y340	I276-V283 HydrophobicContact CG2-CB 4.37Å; I276-V283 PolarHBondContact O-N 2.89Å; V283-T316 HydrophobicContact CB-CG2 4.25Å; V283-T316 HydrophobicContact CG1-CG2 3.58Å; V283-T316 HydrophobicContact CG2-CG2 4.46Å; V283-M333 HydrophobicContact CG2-CE 3.81Å; V283-M333 HydrophobicContact CG2-CG 4.34Å; V283-I336 HydrophobicContact CG1-CB 4.27Å; V283-I336 HydrophobicContact CG1-CG2 3.55Å; V283-Y340 WeakPolarHBondContact O-CB 3.32Å; V283-Y340 WeakPolarHBondContact O-CD1 3.42Å; V283-Y340 VanDerWaalsContact O-CG 3.22Å
284	F	93.4	Very high	91.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	146.1	179.8	178.1	-95.5	0	0	0	110.2	A275 I276 E290 M291 F294 Y340 I345	A275-F284 CarbonylContact C-O 3.58Å; A275-F284 WeakPolarHBondContact CA-O 3.35Å; I276-F284 PolarHBondContact N-O 3.19Å; F284-E290 HydrophobicContact CZ-CB 4.33Å; F284-M291 HydrophobicContact CD1-CB 4.14Å; F284-M291 HydrophobicContact CD1-CG 3.77Å; F284-M291 HydrophobicContact CD1-SD 4.1Å; F284-M291 HydrophobicContact CE1-CB 3.43Å; F284-M291 VanDerWaalsContact CE1-CB 3.43Å; F284-M291 HydrophobicContact CE1-CG 3.61Å; F284-M291 HydrophobicContact CE1-SD 4.21Å; F284-M291 HydrophobicContact CG-CG 4.46Å; F284-M291 HydrophobicContact CZ-CB 3.72Å; F284-M291 HydrophobicContact CZ-CG 4.17Å; F284-F294 HydrophobicContact CD2-CB 4.26Å; F284-F294 AromaticContact CD2-CD1 3.53Å; F284-F294 HydrophobicContact CD2-CD1 3.53Å; F284-F294 HydrophobicContact CD2-CE1 4.03Å; F284-F294 AromaticContact CD2-CG 3.89Å; F284-F294 HydrophobicContact CD2-CG 3.89Å; F284-F294 HydrophobicContact CE2-CB 3.8Å; F284-F294 AromaticContact CE2-CD1 3.98Å; F284-F294 HydrophobicContact CE2-CD1 3.98Å; F284-F294 AromaticContact CE2-CG 3.89Å; F284-F294 HydrophobicContact CE2-CG 3.89Å; F284-F294 HydrophobicContact CG-CD1 4.43Å; F284-Y340 AromaticContact CD2-CD2 3.69Å; F284-Y340 HydrophobicContact CD2-CD2 3.69Å; F284-Y340 AromaticContact CD2-CE2 3.8Å; F284-Y340 HydrophobicContact CD2-CE2 3.8Å; F284-Y340 HydrophobicContact CE2-CD2 4.34Å; F284-Y340 HydrophobicContact CE2-CE2 4.21Å; F284-Y340 HydrophobicContact CG-CD2 4.47Å; F284-Y340 HydrophobicContact CG-CE2 4.43Å; F284-I345 HydrophobicContact CE2-CD1 3.93Å
285	C	93.9	Very high	91.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	117.4	168	171.5	0	0	0	0	110.2	M92 I274 A275 L282 Y340	M92-C285 VanDerWaalsContact CE-SG 3.59Å; I274-C285 VanDerWaalsContact O-CA 3.32Å; I274-C285 WeakPolarHBondContact O-CA 3.29Å; A275-C285 HydrophobicContact CB-CB 4.17Å; L282-C285 HydrophobicContact CD1-CB 4.25Å; L282-C285 HydrophobicContact CD2-CB 3.95Å; L282-C285 HydrophobicContact CG-CB 4.41Å; C285-Y340 WeakPolarHBondContact CB-OH 3.01Å; C285-Y340 VanDerWaalsContact N-CZ 3.3Å; C285-Y340 PolarHBondContact N-OH 2.83Å; C285-Y340 PolarHBondContact O-OH 3.04Å
286	G	92.3	Very high	91.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-171.3	-173.1	0	0	0	0	0	112.8	R273 I274 E290	R273-G286 CarbonylContact C-O 3.6Å; R273-G286 VanDerWaalsContact CA-O 3.27Å; R273-G286 WeakPolarHBondContact CA-O 3.39Å; I274-G286 PolarHBondContact N-O 3.21Å; I274-G286 PolarHBondContact O-N 3.01Å; G286-E290 WeakPolarHBondContact CA-OE2 3.3Å
287	Q	92.1	Very high	91.4	Very high	90 Å²	90	38.9 Å²	38.9	42%	0.421	19%	0.192	S	C	.	.			trans	-73.8	159	170.2	-61.1	-175.3	6	0	0	110.9	E289 E290 M291	Q287-E289 VanDerWaalsContact C-N 3.28Å; Q287-E289 PolarHBondContact O-N 3.28Å; Q287-E290 HydrophobicContact CB-CB 4.31Å; Q287-E290 HydrophobicContact CB-CG 3.99Å; Q287-E290 PolarHBondContact N-OE2 3.12Å; Q287-E290 PolarHBondContact O-N 3.24Å; Q287-M291 PolarHBondContact O-N 2.94Å
288	P	90.3	Very high	91.1	Very high	16 Å²	16	40.5 Å²	40.5	10%	0.104	20%	0.203	C	C	.	.	H	α-helix	trans	-58.7	-38.7	178.2	-20.6	30.2	0	0	0	113.2	F268 F271 I274 M291 V292	F268-P288 HydrophobicContact CD1-CB 3.82Å; F268-P288 HydrophobicContact CE1-CB 3.35Å; F268-P288 HydrophobicContact CE2-CB 4.19Å; F268-P288 HydrophobicContact CG-CB 4.4Å; F268-P288 HydrophobicContact CZ-CB 3.57Å; F268-P288 VanDerWaalsContact CZ-O 3.3Å; F268-P288 WeakPolarHBondContact CZ-O 3.41Å; F268-P288 WeakPolarHBondContact O-CG 3.15Å; F271-P288 VanDerWaalsContact O-CG 3.23Å; F271-P288 WeakPolarHBondContact O-CG 3.37Å; I274-P288 HydrophobicContact CD1-CB 3.78Å; I274-P288 HydrophobicContact CD1-CG 3.74Å; I274-P288 HydrophobicContact CG1-CG 4.44Å; P288-M291 WeakPolarHBondContact O-CB 3.38Å; P288-M291 PolarHBondContact O-N 3.15Å; P288-V292 PolarHBondContact O-N 2.89Å
289	E	90.1	Very high	90.9	Very high	145 Å²	145	43.1 Å²	43.1	68%	0.678	23%	0.231	S	C	*	.	H	α-helix	trans	-67	-47.9	178.1	-66	163.3	-164.4	0	0	111	Q287 M291 V292 D293	Q287-E289 VanDerWaalsContact C-N 3.28Å; Q287-E289 PolarHBondContact O-N 3.28Å; E289-M291 PolarHBondContact O-N 3.44Å; E289-M291 VanDerWaalsContact O-N 3.17Å; E289-V292 PolarHBondContact O-N 3.47Å; E289-V292 VanDerWaalsContact O-N 3.14Å; E289-D293 PolarHBondContact O-N 3.15Å
290	E	91.4	Very high	90.8	Very high	58 Å²	58	41.7 Å²	41.7	27%	0.271	23%	0.226	S	C	.	.	H	α-helix	trans	-58	-30.2	175.2	-65.9	173.6	165.9	0	0	112.7	F284 G286 Q287 F294 I345	F284-E290 HydrophobicContact CZ-CB 4.33Å; G286-E290 WeakPolarHBondContact CA-OE2 3.3Å; Q287-E290 HydrophobicContact CB-CB 4.31Å; Q287-E290 HydrophobicContact CB-CG 3.99Å; Q287-E290 PolarHBondContact N-OE2 3.12Å; Q287-E290 PolarHBondContact O-N 3.24Å; E290-F294 VanDerWaalsContact O-CB 3.26Å; E290-F294 WeakPolarHBondContact O-CB 3.5Å; E290-F294 PolarHBondContact O-N 3.4Å; E290-I345 HydrophobicContact CB-CD1 4.27Å
291	M	90.8	Very high	90.7	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-46.9	177.8	-170.3	172.4	60.7	0	0	111.4	F268 I274 I276 F284 Q287 P288 E289 D293 F294 F295 Y312	F268-M291 HydrophobicContact CD2-CE 4.35Å; F268-M291 HydrophobicContact CE2-CE 3.28Å; F268-M291 HydrophobicContact CZ-CE 3.81Å; I274-M291 HydrophobicContact CB-SD 4.36Å; I274-M291 HydrophobicContact CD1-CE 3.91Å; I274-M291 HydrophobicContact CG2-CE 4.27Å; I274-M291 HydrophobicContact CG2-SD 3.7Å; I276-M291 HydrophobicContact CD1-SD 3.82Å; I276-M291 HydrophobicContact CG1-SD 4.43Å; F284-M291 HydrophobicContact CD1-CB 4.14Å; F284-M291 HydrophobicContact CD1-CG 3.77Å; F284-M291 HydrophobicContact CD1-SD 4.1Å; F284-M291 HydrophobicContact CE1-CB 3.43Å; F284-M291 VanDerWaalsContact CE1-CB 3.43Å; F284-M291 HydrophobicContact CE1-CG 3.61Å; F284-M291 HydrophobicContact CE1-SD 4.21Å; F284-M291 HydrophobicContact CG-CG 4.46Å; F284-M291 HydrophobicContact CZ-CB 3.72Å; F284-M291 HydrophobicContact CZ-CG 4.17Å; Q287-M291 PolarHBondContact O-N 2.94Å; P288-M291 WeakPolarHBondContact O-CB 3.38Å; P288-M291 PolarHBondContact O-N 3.15Å; E289-M291 PolarHBondContact O-N 3.44Å; E289-M291 VanDerWaalsContact O-N 3.17Å; M291-D293 VanDerWaalsContact C-N 3.31Å; M291-D293 PolarHBondContact O-N 3.38Å; M291-F294 PolarHBondContact O-N 2.91Å; M291-F295 HydrophobicContact CG-CD2 3.74Å; M291-F295 HydrophobicContact CG-CE2 3.71Å; M291-F295 VanDerWaalsContact O-CD2 3.27Å; M291-F295 WeakPolarHBondContact O-CD2 3.45Å; M291-F295 PolarHBondContact O-N 3.18Å; M291-F295 HydrophobicContact SD-CE2 4.4Å; M291-Y312 HydrophobicContact CE-CD2 3.68Å; M291-Y312 HydrophobicContact CE-CE2 3.94Å; M291-Y312 HydrophobicContact CG-CD2 4.25Å; M291-Y312 HydrophobicContact CG-CE2 4.4Å; M291-Y312 HydrophobicContact SD-CD2 4.08Å
292	V	90.5	Very high	90.3	Very high	49 Å²	49	48.8 Å²	48.8	30%	0.297	26%	0.262	S	S	.	.	H	α-helix	trans	-61.9	-44.8	-179.9	179.5	0	0	0	0	110	F268 P288 E289 F294 F295 S296 Y312	F268-V292 HydrophobicContact CE1-CG2 4.48Å; F268-V292 HydrophobicContact CZ-CG2 3.89Å; P288-V292 PolarHBondContact O-N 2.89Å; E289-V292 PolarHBondContact O-N 3.47Å; E289-V292 VanDerWaalsContact O-N 3.14Å; V292-F294 PolarHBondContact O-N 2.64Å; V292-F295 PolarHBondContact O-N 3.03Å; V292-S296 WeakPolarHBondContact O-CB 3.45Å; V292-S296 PolarHBondContact O-N 2.85Å; V292-S296 PolarHBondContact O-OG 3.2Å; V292-Y312 HydrophobicContact CG2-CE2 4.34Å
293	D	91.4	Very high	90.1	Very high	98 Å²	98	51.5 Å²	51.5	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-43	178.5	-68	-19.2	0	0	0	112.1	E289 M291 S296 Q297	E289-D293 PolarHBondContact O-N 3.15Å; M291-D293 VanDerWaalsContact C-N 3.31Å; M291-D293 PolarHBondContact O-N 3.38Å; D293-S296 PolarHBondContact O-N 3.42Å; D293-Q297 VanDerWaalsContact O-CG 3.29Å; D293-Q297 WeakPolarHBondContact O-CG 3.4Å; D293-Q297 PolarHBondContact O-N 3.25Å
294	F	92	Very high	89.5	Confident	3 Å²	3	59.9 Å²	59.9	1%	0.013	32%	0.32	C	S	.	.	H	α-helix	trans	-63.5	-45.5	179.1	174.2	-100.1	0	0	0	112.5	F284 E290 M291 V292 Q297 C298 I336 Y340 I345	F284-F294 HydrophobicContact CD2-CB 4.26Å; F284-F294 AromaticContact CD2-CD1 3.53Å; F284-F294 HydrophobicContact CD2-CD1 3.53Å; F284-F294 HydrophobicContact CD2-CE1 4.03Å; F284-F294 AromaticContact CD2-CG 3.89Å; F284-F294 HydrophobicContact CD2-CG 3.89Å; F284-F294 HydrophobicContact CE2-CB 3.8Å; F284-F294 AromaticContact CE2-CD1 3.98Å; F284-F294 HydrophobicContact CE2-CD1 3.98Å; F284-F294 AromaticContact CE2-CG 3.89Å; F284-F294 HydrophobicContact CE2-CG 3.89Å; F284-F294 HydrophobicContact CG-CD1 4.43Å; E290-F294 VanDerWaalsContact O-CB 3.26Å; E290-F294 WeakPolarHBondContact O-CB 3.5Å; E290-F294 PolarHBondContact O-N 3.4Å; M291-F294 PolarHBondContact O-N 2.91Å; V292-F294 PolarHBondContact O-N 2.64Å; F294-Q297 PolarHBondContact O-N 3.32Å; F294-C298 PolarHBondContact O-N 2.98Å; F294-C298 VanDerWaalsContact O-N 3.08Å; F294-C298 PolarHBondContact O-SG 3.03Å; F294-I336 HydrophobicContact CE1-CG2 4.01Å; F294-I336 HydrophobicContact CZ-CG2 4.43Å; F294-Y340 HydrophobicContact CE2-CD2 4.45Å; F294-Y340 HydrophobicContact CZ-CD2 4.38Å; F294-I345 HydrophobicContact CB-CD1 4.24Å; F294-I345 HydrophobicContact CD2-CD1 4.49Å
295	F	91.6	Very high	89.1	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-68.8	-35.5	179	-82.4	-76.8	0	0	0	112.3	I276 M291 V292 C298 G299 Y300 Y312 T316 I336	I276-F295 HydrophobicContact CD1-CE2 3.88Å; I276-F295 HydrophobicContact CD1-CZ 3.95Å; M291-F295 HydrophobicContact CG-CD2 3.74Å; M291-F295 HydrophobicContact CG-CE2 3.71Å; M291-F295 VanDerWaalsContact O-CD2 3.27Å; M291-F295 WeakPolarHBondContact O-CD2 3.45Å; M291-F295 PolarHBondContact O-N 3.18Å; M291-F295 HydrophobicContact SD-CE2 4.4Å; V292-F295 PolarHBondContact O-N 3.03Å; F295-C298 CarbonylContact O-C 3.45Å; F295-C298 WeakPolarHBondContact O-CB 3.46Å; F295-C298 PolarHBondContact O-N 3.25Å; F295-C298 VanDerWaalsContact O-N 3.15Å; F295-G299 PolarHBondContact O-N 3.42Å; F295-Y300 CarbonylContact C-O 3.58Å; F295-Y300 CarbonylContact O-C 3.59Å; F295-Y300 PolarHBondContact O-N 3.01Å; F295-Y312 HydrophobicContact CB-CD1 3.85Å; F295-Y312 HydrophobicContact CB-CE1 3.4Å; F295-Y312 VanDerWaalsContact CB-CE1 3.4Å; F295-Y312 AromaticContact CD1-CD1 3.86Å; F295-Y312 HydrophobicContact CD1-CD1 3.86Å; F295-Y312 HydrophobicContact CD1-CE1 4.3Å; F295-Y312 AromaticContact CD2-CD1 3.53Å; F295-Y312 HydrophobicContact CD2-CD1 3.53Å; F295-Y312 HydrophobicContact CD2-CD2 4.26Å; F295-Y312 AromaticContact CD2-CE1 3.79Å; F295-Y312 HydrophobicContact CD2-CE1 3.79Å; F295-Y312 HydrophobicContact CD2-CE2 4.47Å; F295-Y312 AromaticContact CD2-CG 3.81Å; F295-Y312 HydrophobicContact CD2-CG 3.81Å; F295-Y312 HydrophobicContact CE1-CD1 4.29Å; F295-Y312 HydrophobicContact CE2-CD1 4.02Å; F295-Y312 AromaticContact CE2-CG 3.94Å; F295-Y312 HydrophobicContact CE2-CG 3.94Å; F295-Y312 AromaticContact CG-CD1 3.46Å; F295-Y312 HydrophobicContact CG-CD1 3.46Å; F295-Y312 VanDerWaalsContact CG-CD1 3.46Å; F295-Y312 AromaticContact CG-CE1 3.58Å; F295-Y312 HydrophobicContact CG-CE1 3.58Å; F295-Y312 HydrophobicContact CG-CG 4.22Å; F295-Y312 HydrophobicContact CZ-CD1 4.38Å; F295-Y312 HydrophobicContact CZ-CG 4.42Å; F295-T316 HydrophobicContact CE1-CG2 3.9Å; F295-T316 HydrophobicContact CZ-CG2 3.84Å; F295-I336 HydrophobicContact CE1-CG2 4.1Å
296	S	90.8	Very high	88.8	Confident	46 Å²	46	72.9 Å²	72.9	32%	0.322	38%	0.379	S	S	.	.	H	α-helix	trans	-62.4	-41	172	-62	0	0	0	0	111.9	V292 D293 C298 G299	V292-S296 WeakPolarHBondContact O-CB 3.45Å; V292-S296 PolarHBondContact O-N 2.85Å; V292-S296 PolarHBondContact O-OG 3.2Å; D293-S296 PolarHBondContact O-N 3.42Å; S296-C298 VanDerWaalsContact C-N 3.26Å; S296-C298 PolarHBondContact O-N 2.89Å; S296-G299 PolarHBondContact O-N 2.83Å
297	Q	89.6	Confident	88.6	Confident	156 Å²	156	74.3 Å²	74.3	73%	0.729	39%	0.386	S	S	*	.	H	α-helix	trans	-64.2	-30	173.8	-72.2	170.8	19	0	0	113.1	D293 F294 G299	D293-Q297 VanDerWaalsContact O-CG 3.29Å; D293-Q297 WeakPolarHBondContact O-CG 3.4Å; D293-Q297 PolarHBondContact O-N 3.25Å; F294-Q297 PolarHBondContact O-N 3.32Å; Q297-G299 PolarHBondContact O-N 3.39Å
298	C	87.3	Confident	88.4	Confident	34 Å²	34	71 Å²	71	23%	0.23	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-1.2	173.5	-62.3	0	0	0	0	113.2	F294 F295 S296 Y300	F294-C298 PolarHBondContact O-N 2.98Å; F294-C298 VanDerWaalsContact O-N 3.08Å; F294-C298 PolarHBondContact O-SG 3.03Å; F295-C298 CarbonylContact O-C 3.45Å; F295-C298 WeakPolarHBondContact O-CB 3.46Å; F295-C298 PolarHBondContact O-N 3.25Å; F295-C298 VanDerWaalsContact O-N 3.15Å; S296-C298 VanDerWaalsContact C-N 3.26Å; S296-C298 PolarHBondContact O-N 2.89Å; C298-Y300 HydrophobicContact CB-CD2 3.99Å
299	G	87.6	Confident	88.2	Confident	62 Å²	62	70.5 Å²	70.5	64%	0.639	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	15.2	-179	0	0	0	0	0	114.6	F295 S296 Q297	F295-G299 PolarHBondContact O-N 3.42Å; S296-G299 PolarHBondContact O-N 2.83Å; Q297-G299 PolarHBondContact O-N 3.39Å
300	Y	87	Confident	88.1	Confident	65 Å²	65	66.2 Å²	66.2	26%	0.255	35%	0.351	S	S	.	.			trans	-114.7	84.4	-179.9	-64.1	-65.9	0	0	0	111	F295 C298 F315 R332 I336	F295-Y300 CarbonylContact C-O 3.58Å; F295-Y300 CarbonylContact O-C 3.59Å; F295-Y300 PolarHBondContact O-N 3.01Å; C298-Y300 HydrophobicContact CB-CD2 3.99Å; Y300-F315 HydrophobicContact CD1-CD1 4.44Å; Y300-F315 HydrophobicContact CD1-CD2 4.37Å; Y300-F315 HydrophobicContact CD1-CE2 4.4Å; Y300-F315 HydrophobicContact CD1-CG 4.39Å; Y300-F315 HydrophobicContact CD1-CZ 4.48Å; Y300-F315 HydrophobicContact CG-CD2 4.24Å; Y300-F315 HydrophobicContact CG-CE2 4.45Å; Y300-R332 WeakPolarHBondContact OH-CD 3.49Å; Y300-R332 WeakPolarHBondContact OH-CG 3.38Å; Y300-I336 HydrophobicContact CD2-CD1 4.12Å; Y300-I336 HydrophobicContact CD2-CG1 4.44Å; Y300-I336 HydrophobicContact CE2-CD1 3.77Å; Y300-I336 HydrophobicContact CE2-CG1 3.98Å
301	E	85.9	Confident	88	Confident	150 Å²	150	64.7 Å²	64.7	70%	0.701	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-79.4	144.2	176.7	-67.9	-176.4	171.7	0	0	112.1
302	C	83.3	Confident	88	Confident	36 Å²	36	64.7 Å²	64.7	24%	0.243	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-94.9	122.9	174.8	-176.8	0	0	0	0	109.8	Y312	C302-Y312 HydrophobicContact CB-CE1 4.28Å
303	P	87.2	Confident	88	Confident	73 Å²	73	63.1 Å²	63.1	47%	0.474	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-60.2	148.1	170.7	-21.6	32.7	0	0	0	112.3	Y305 C306 I311	P303-Y305 VanDerWaalsContact C-N 3.3Å; P303-Y305 PolarHBondContact O-N 2.95Å; P303-C306 HydrophobicContact CB-CB 4.47Å; P303-C306 PolarHBondContact O-N 3.28Å; P303-I311 HydrophobicContact CG-CD1 4.45Å
304	E	81.9	Confident	87.9	Confident	175 Å²	175	62.8 Å²	62.8	82%	0.818	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.6	-175.6	-69.1	-173	158.8	0	0	114.2	C306	E304-C306 VanDerWaalsContact C-N 3.27Å; E304-C306 PolarHBondContact O-N 2.78Å
305	Y	85.1	Confident	87.7	Confident	219 Å²	219	65 Å²	65	86%	0.859	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	10.4	-176.3	-57.8	-74.6	0	0	0	113.7	P303	P303-Y305 VanDerWaalsContact C-N 3.3Å; P303-Y305 PolarHBondContact O-N 2.95Å
306	C	86	Confident	87.5	Confident	55 Å²	55	65 Å²	65	37%	0.372	34%	0.343	S	S	.	.	S	Bend	trans	-110.1	152.2	-178.6	-66.1	0	0	0	0	111.7	P303 E304 P308 I311	P303-C306 HydrophobicContact CB-CB 4.47Å; P303-C306 PolarHBondContact O-N 3.28Å; E304-C306 VanDerWaalsContact C-N 3.27Å; E304-C306 PolarHBondContact O-N 2.78Å; C306-P308 WeakPolarHBondContact O-CD 3.2Å; C306-I311 HydrophobicContact CB-CD1 3.16Å; C306-I311 HydrophobicContact CB-CG1 3.98Å
307	N	88.7	Confident	87.4	Confident	29 Å²	29	63.8 Å²	63.8	16%	0.155	33%	0.334	C	S	.	.			trans	-73.8	117.6	173.6	-176.3	5.4	0	0	0	109	P263 S265 F309 D310 I311	P263-N307 PolarHBondContact O-ND2 3.36Å; S265-N307 WeakPolarHBondContact CA-OD1 3.25Å; N307-F309 PolarHBondContact O-N 3.25Å; N307-F309 PolarHBondContact OD1-N 3.04Å; N307-D310 HydrophobicContact CB-CB 4.16Å; N307-D310 WeakPolarHBondContact CB-OD2 3.38Å; N307-D310 VanDerWaalsContact ND2-CG 3.25Å; N307-D310 PolarHBondContact ND2-OD2 3.45Å; N307-D310 PolarHBondContact O-N 2.98Å; N307-I311 PolarHBondContact O-N 3.2Å; N307-I311 VanDerWaalsContact O-N 3.12Å
308	P	87.3	Confident	87.3	Confident	22 Å²	22	57.3 Å²	57.3	14%	0.143	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-35.6	-179.2	22.6	-33.8	0	0	0	111.8	F268 C306 Y312	F268-P308 HydrophobicContact CD2-CB 4.31Å; F268-P308 HydrophobicContact CD2-CG 3.68Å; F268-P308 HydrophobicContact CE2-CB 3.94Å; F268-P308 HydrophobicContact CE2-CG 3.79Å; F268-P308 HydrophobicContact CG-CG 4.25Å; F268-P308 HydrophobicContact CZ-CG 4.48Å; C306-P308 WeakPolarHBondContact O-CD 3.2Å; P308-Y312 HydrophobicContact CB-CD2 4.14Å; P308-Y312 HydrophobicContact CB-CE2 3.73Å; P308-Y312 WeakPolarHBondContact O-CB 3.39Å; P308-Y312 WeakPolarHBondContact O-CD2 3.46Å; P308-Y312 VanDerWaalsContact O-CG 3.27Å; P308-Y312 PolarHBondContact O-N 3.46Å
309	F	86.6	Confident	87.2	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-46.5	178.5	-69.5	-62.5	0	0	0	113	L95 P263 L267 F268 F271 I274 N307 V313	L95-F309 HydrophobicContact CD1-CD1 4.08Å; L95-F309 HydrophobicContact CD1-CE1 3.99Å; L95-F309 HydrophobicContact CD2-CB 3.9Å; L95-F309 HydrophobicContact CD2-CD1 3.35Å; L95-F309 HydrophobicContact CD2-CE1 3.98Å; L95-F309 HydrophobicContact CD2-CG 3.91Å; L95-F309 HydrophobicContact CG-CD1 4.39Å; P263-F309 HydrophobicContact CB-CD2 4.15Å; P263-F309 HydrophobicContact CB-CE2 4.22Å; P263-F309 HydrophobicContact CG-CB 3.94Å; P263-F309 HydrophobicContact CG-CD1 4.05Å; P263-F309 HydrophobicContact CG-CD2 3.73Å; P263-F309 HydrophobicContact CG-CE1 4.34Å; P263-F309 HydrophobicContact CG-CE2 4.05Å; P263-F309 HydrophobicContact CG-CG 3.68Å; P263-F309 HydrophobicContact CG-CZ 4.31Å; L267-F309 HydrophobicContact CB-CE2 4.46Å; F268-F309 VanDerWaalsContact CA-CE2 3.45Å; F268-F309 VanDerWaalsContact CA-CZ 3.44Å; F268-F309 HydrophobicContact CB-CD2 4.48Å; F268-F309 HydrophobicContact CB-CE2 3.64Å; F268-F309 HydrophobicContact CB-CZ 3.93Å; F268-F309 HydrophobicContact CD2-CD1 4.22Å; F268-F309 HydrophobicContact CD2-CD2 4.15Å; F268-F309 AromaticContact CD2-CE1 3.83Å; F268-F309 HydrophobicContact CD2-CE1 3.83Å; F268-F309 AromaticContact CD2-CE2 3.74Å; F268-F309 HydrophobicContact CD2-CE2 3.74Å; F268-F309 HydrophobicContact CD2-CG 4.41Å; F268-F309 AromaticContact CD2-CZ 3.59Å; F268-F309 HydrophobicContact CD2-CZ 3.59Å; F268-F309 HydrophobicContact CE2-CE1 4.43Å; F268-F309 HydrophobicContact CG-CE2 4.2Å; F268-F309 HydrophobicContact CG-CZ 4.18Å; F271-F309 AromaticContact CD2-CZ 3.87Å; F271-F309 HydrophobicContact CD2-CZ 3.87Å; F271-F309 HydrophobicContact CE2-CZ 4.13Å; I274-F309 HydrophobicContact CD1-CE1 3.52Å; I274-F309 HydrophobicContact CD1-CZ 4.02Å; I274-F309 HydrophobicContact CG1-CE1 4.13Å; N307-F309 PolarHBondContact O-N 3.25Å; N307-F309 PolarHBondContact OD1-N 3.04Å; F309-V313 VanDerWaalsContact O-CB 3.3Å; F309-V313 WeakPolarHBondContact O-CB 3.25Å; F309-V313 WeakPolarHBondContact O-CG2 3.41Å; F309-V313 PolarHBondContact O-N 3.1Å; F309-V313 VanDerWaalsContact O-N 3.11Å
310	D	88.3	Confident	87.1	Confident	56 Å²	56	59.2 Å²	59.2	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-68.4	-44	-177.1	-63.4	-26.3	0	0	0	110	N307 V313 D314	N307-D310 HydrophobicContact CB-CB 4.16Å; N307-D310 WeakPolarHBondContact CB-OD2 3.38Å; N307-D310 VanDerWaalsContact ND2-CG 3.25Å; N307-D310 PolarHBondContact ND2-OD2 3.45Å; N307-D310 PolarHBondContact O-N 2.98Å; D310-V313 PolarHBondContact O-N 3.04Å; D310-D314 WeakPolarHBondContact O-CB 3.36Å; D310-D314 VanDerWaalsContact O-CG 3.24Å; D310-D314 PolarHBondContact O-N 3.07Å
311	I	89.9	Confident	87.1	Confident	26 Å²	26	66.4 Å²	66.4	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-62.6	-48.7	179.4	-75.8	-165.3	0	0	0	112.5	P303 C306 N307 V313 D314 F315	P303-I311 HydrophobicContact CG-CD1 4.45Å; C306-I311 HydrophobicContact CB-CD1 3.16Å; C306-I311 HydrophobicContact CB-CG1 3.98Å; N307-I311 PolarHBondContact O-N 3.2Å; N307-I311 VanDerWaalsContact O-N 3.12Å; I311-V313 VanDerWaalsContact C-N 3.29Å; I311-V313 PolarHBondContact O-N 3.21Å; I311-D314 WeakPolarHBondContact O-CB 3.36Å; I311-D314 PolarHBondContact O-N 3.21Å; I311-D314 VanDerWaalsContact O-N 3.17Å; I311-F315 HydrophobicContact CG2-CD2 3.7Å; I311-F315 HydrophobicContact CG2-CE1 4.43Å; I311-F315 HydrophobicContact CG2-CE2 3.16Å; I311-F315 HydrophobicContact CG2-CZ 3.59Å; I311-F315 WeakPolarHBondContact O-CD2 3.33Å; I311-F315 WeakPolarHBondContact O-CG 3.42Å; I311-F315 PolarHBondContact O-N 2.86Å
312	Y	90.1	Very high	87.3	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-33.3	-178.8	-62.8	-43.8	0	0	0	111.8	M291 V292 F295 C302 P308 F315 T316	M291-Y312 HydrophobicContact CE-CD2 3.68Å; M291-Y312 HydrophobicContact CE-CE2 3.94Å; M291-Y312 HydrophobicContact CG-CD2 4.25Å; M291-Y312 HydrophobicContact CG-CE2 4.4Å; M291-Y312 HydrophobicContact SD-CD2 4.08Å; V292-Y312 HydrophobicContact CG2-CE2 4.34Å; F295-Y312 HydrophobicContact CB-CD1 3.85Å; F295-Y312 HydrophobicContact CB-CE1 3.4Å; F295-Y312 VanDerWaalsContact CB-CE1 3.4Å; F295-Y312 AromaticContact CD1-CD1 3.86Å; F295-Y312 HydrophobicContact CD1-CD1 3.86Å; F295-Y312 HydrophobicContact CD1-CE1 4.3Å; F295-Y312 AromaticContact CD2-CD1 3.53Å; F295-Y312 HydrophobicContact CD2-CD1 3.53Å; F295-Y312 HydrophobicContact CD2-CD2 4.26Å; F295-Y312 AromaticContact CD2-CE1 3.79Å; F295-Y312 HydrophobicContact CD2-CE1 3.79Å; F295-Y312 HydrophobicContact CD2-CE2 4.47Å; F295-Y312 AromaticContact CD2-CG 3.81Å; F295-Y312 HydrophobicContact CD2-CG 3.81Å; F295-Y312 HydrophobicContact CE1-CD1 4.29Å; F295-Y312 HydrophobicContact CE2-CD1 4.02Å; F295-Y312 AromaticContact CE2-CG 3.94Å; F295-Y312 HydrophobicContact CE2-CG 3.94Å; F295-Y312 AromaticContact CG-CD1 3.46Å; F295-Y312 HydrophobicContact CG-CD1 3.46Å; F295-Y312 VanDerWaalsContact CG-CD1 3.46Å; F295-Y312 AromaticContact CG-CE1 3.58Å; F295-Y312 HydrophobicContact CG-CE1 3.58Å; F295-Y312 HydrophobicContact CG-CG 4.22Å; F295-Y312 HydrophobicContact CZ-CD1 4.38Å; F295-Y312 HydrophobicContact CZ-CG 4.42Å; C302-Y312 HydrophobicContact CB-CE1 4.28Å; P308-Y312 HydrophobicContact CB-CD2 4.14Å; P308-Y312 HydrophobicContact CB-CE2 3.73Å; P308-Y312 WeakPolarHBondContact O-CB 3.39Å; P308-Y312 WeakPolarHBondContact O-CD2 3.46Å; P308-Y312 VanDerWaalsContact O-CG 3.27Å; P308-Y312 PolarHBondContact O-N 3.46Å; Y312-F315 HydrophobicContact CD1-CD2 4.27Å; Y312-T316 WeakPolarHBondContact O-CB 3.43Å; Y312-T316 VanDerWaalsContact O-CG2 3.25Å; Y312-T316 WeakPolarHBondContact O-CG2 3.3Å; Y312-T316 PolarHBondContact O-N 3.28Å; Y312-T316 VanDerWaalsContact O-N 3.13Å; Y312-T316 PolarHBondContact O-OG1 3.42Å
313	V	90.1	Very high	87.6	Confident	15 Å²	15	64.4 Å²	64.4	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-40.8	171.8	170.6	0	0	0	0	110.9	L95 N97 F309 D310 I311 T316 S317	L95-V313 HydrophobicContact CB-CG2 3.99Å; L95-V313 HydrophobicContact CD2-CG2 4.3Å; N97-V313 WeakPolarHBondContact OD1-CG1 3.49Å; F309-V313 VanDerWaalsContact O-CB 3.3Å; F309-V313 WeakPolarHBondContact O-CB 3.25Å; F309-V313 WeakPolarHBondContact O-CG2 3.41Å; F309-V313 PolarHBondContact O-N 3.1Å; F309-V313 VanDerWaalsContact O-N 3.11Å; D310-V313 PolarHBondContact O-N 3.04Å; I311-V313 VanDerWaalsContact C-N 3.29Å; I311-V313 PolarHBondContact O-N 3.21Å; V313-T316 WeakPolarHBondContact CA-OG1 3.37Å; V313-T316 PolarHBondContact O-N 2.96Å; V313-T316 PolarHBondContact O-OG1 3.11Å; V313-T316 VanDerWaalsContact O-OG1 3.11Å; V313-S317 VanDerWaalsContact O-CB 3.32Å; V313-S317 WeakPolarHBondContact O-CB 3.44Å; V313-S317 PolarHBondContact O-N 3.49Å
314	D	88.9	Confident	87.8	Confident	91 Å²	91	69 Å²	69	49%	0.487	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-42.5	177.1	-76.4	-16.9	0	0	0	112.2	D310 I311 T316 S317 R332	D310-D314 WeakPolarHBondContact O-CB 3.36Å; D310-D314 VanDerWaalsContact O-CG 3.24Å; D310-D314 PolarHBondContact O-N 3.07Å; I311-D314 WeakPolarHBondContact O-CB 3.36Å; I311-D314 PolarHBondContact O-N 3.21Å; I311-D314 VanDerWaalsContact O-N 3.17Å; D314-T316 VanDerWaalsContact C-N 3.31Å; D314-T316 PolarHBondContact O-N 3.3Å; D314-S317 PolarHBondContact O-N 2.68Å; D314-S317 PolarHBondContact O-OG 3.31Å; D314-R332 PolarHBondContact O-NH2 3Å
315	F	88.4	Confident	88.1	Confident	49 Å²	49	67.7 Å²	67.7	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-34.7	175.9	-66.6	-30.1	0	0	0	113.1	Y300 I311 Y312 R332	Y300-F315 HydrophobicContact CD1-CD1 4.44Å; Y300-F315 HydrophobicContact CD1-CD2 4.37Å; Y300-F315 HydrophobicContact CD1-CE2 4.4Å; Y300-F315 HydrophobicContact CD1-CG 4.39Å; Y300-F315 HydrophobicContact CD1-CZ 4.48Å; Y300-F315 HydrophobicContact CG-CD2 4.24Å; Y300-F315 HydrophobicContact CG-CE2 4.45Å; I311-F315 HydrophobicContact CG2-CD2 3.7Å; I311-F315 HydrophobicContact CG2-CE1 4.43Å; I311-F315 HydrophobicContact CG2-CE2 3.16Å; I311-F315 HydrophobicContact CG2-CZ 3.59Å; I311-F315 WeakPolarHBondContact O-CD2 3.33Å; I311-F315 WeakPolarHBondContact O-CG 3.42Å; I311-F315 PolarHBondContact O-N 2.86Å; Y312-F315 HydrophobicContact CD1-CD2 4.27Å; F315-R332 PolarHBondContact O-NE 3.4Å; F315-R332 PolarHBondContact O-NH2 3.38Å
316	T	88.4	Confident	88.4	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-88.2	-8.4	-179.3	57.2	0	0	0	0	113.3	I276 S278 V283 F295 Y312 V313 D314	I276-T316 HydrophobicContact CG2-CG2 4.13Å; I276-T316 WeakPolarHBondContact CG2-OG1 3.34Å; S278-T316 WeakPolarHBondContact CB-O 3.33Å; S278-T316 PolarHBondContact OG-O 3.18Å; V283-T316 HydrophobicContact CB-CG2 4.25Å; V283-T316 HydrophobicContact CG1-CG2 3.58Å; V283-T316 HydrophobicContact CG2-CG2 4.46Å; F295-T316 HydrophobicContact CE1-CG2 3.9Å; F295-T316 HydrophobicContact CZ-CG2 3.84Å; Y312-T316 WeakPolarHBondContact O-CB 3.43Å; Y312-T316 VanDerWaalsContact O-CG2 3.25Å; Y312-T316 WeakPolarHBondContact O-CG2 3.3Å; Y312-T316 PolarHBondContact O-N 3.28Å; Y312-T316 VanDerWaalsContact O-N 3.13Å; Y312-T316 PolarHBondContact O-OG1 3.42Å; V313-T316 WeakPolarHBondContact CA-OG1 3.37Å; V313-T316 PolarHBondContact O-N 2.96Å; V313-T316 PolarHBondContact O-OG1 3.11Å; V313-T316 VanDerWaalsContact O-OG1 3.11Å; D314-T316 VanDerWaalsContact C-N 3.31Å; D314-T316 PolarHBondContact O-N 3.3Å
317	S	88.3	Confident	88.6	Confident	20 Å²	20	60.5 Å²	60.5	14%	0.14	31%	0.312	C	S	.	.			trans	-78.6	150.2	178.6	75.4	0	0	0	0	113.7	N97 V313 D314 R332	N97-S317 WeakPolarHBondContact ND2-CB 3.35Å; V313-S317 VanDerWaalsContact O-CB 3.32Å; V313-S317 WeakPolarHBondContact O-CB 3.44Å; V313-S317 PolarHBondContact O-N 3.49Å; D314-S317 PolarHBondContact O-N 2.68Å; D314-S317 PolarHBondContact O-OG 3.31Å; S317-R332 PolarHBondContact O-NH2 2.84Å
318	V	87.2	Confident	88.7	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.115	33%	0.33	C	S	.	.			trans	-106.7	119.3	176.2	-179.2	0	0	0	0	109	R279 E326 F330 M333	R279-V318 HydrophobicContact CG-CB 4.37Å; R279-V318 HydrophobicContact CG-CG2 4Å; V318-E326 HydrophobicContact CG1-CG 3.84Å; V318-F330 HydrophobicContact CG1-CB 4.21Å; V318-F330 HydrophobicContact CG2-CB 4.43Å; V318-F330 HydrophobicContact CG2-CD2 4.22Å; V318-M333 HydrophobicContact CG2-CB 4.4Å
319	D	86	Confident	88.8	Confident	46 Å²	46	62.1 Å²	62.1	25%	0.246	33%	0.329	C	S	.	.			trans	-87.1	116.3	-179.5	-177.1	2.5	0	0	0	110.5	R321 R325 E326 T329	D319-R321 VanDerWaalsContact OD1-CB 3.26Å; D319-R321 WeakPolarHBondContact OD1-CB 3.22Å; D319-R321 WeakPolarHBondContact OD1-CD 3.29Å; D319-R321 WeakPolarHBondContact OD1-CG 3.36Å; D319-R321 PolarHBondContact OD1-N 3.18Å; D319-R325 IonicContact OD2-NH1 3.58Å; D319-E326 WeakPolarHBondContact O-CA 3.46Å; D319-E326 WeakPolarHBondContact O-CB 3.42Å; D319-E326 PolarHBondContact O-N 3.36Å; D319-T329 HydrophobicContact CB-CG2 4.39Å; D319-T329 PolarHBondContact N-OG1 3.31Å; D319-T329 VanDerWaalsContact N-OG1 3.11Å
320	T	84.9	Confident	89	Confident	90 Å²	90	66.3 Å²	66.3	55%	0.552	35%	0.348	S	S	*	.			trans	-92	6	-178.8	59.9	0	0	0	0	114.1	S322	T320-S322 VanDerWaalsContact C-N 3.3Å; T320-S322 PolarHBondContact O-N 2.85Å
321	R	87.7	Confident	89.1	Confident	217 Å²	217	67.2 Å²	67.2	82%	0.819	36%	0.358	S	S	*	.	S	Bend	trans	-68.6	-28.6	-175.6	-69.3	174.6	73.7	131.9	5.5	113.2	D319	D319-R321 VanDerWaalsContact OD1-CB 3.26Å; D319-R321 WeakPolarHBondContact OD1-CB 3.22Å; D319-R321 WeakPolarHBondContact OD1-CD 3.29Å; D319-R321 WeakPolarHBondContact OD1-CG 3.36Å; D319-R321 PolarHBondContact OD1-N 3.18Å
322	S	90.1	Very high	89.2	Confident	45 Å²	45	69 Å²	69	32%	0.315	36%	0.363	S	S	.	.	S	Bend	trans	-141.5	146.1	172.1	71.2	0	0	0	0	111	T320 E324 R325 E326	T320-S322 VanDerWaalsContact C-N 3.3Å; T320-S322 PolarHBondContact O-N 2.85Å; S322-E324 PolarHBondContact O-N 3.4Å; S322-R325 PolarHBondContact O-N 3.43Å; S322-R325 VanDerWaalsContact OG-CB 3.29Å; S322-R325 WeakPolarHBondContact OG-CB 3.36Å; S322-R325 VanDerWaalsContact OG-CG 3.23Å; S322-R325 WeakPolarHBondContact OG-CG 3.39Å; S322-R325 PolarHBondContact OG-N 2.92Å; S322-E326 WeakPolarHBondContact O-CB 3.43Å; S322-E326 PolarHBondContact O-N 3.38Å
323	S	89.1	Confident	89.2	Confident	99 Å²	99	69 Å²	69	69%	0.692	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-34.8	-178.4	-173.3	0	0	0	0	112.7	A327	S323-A327 PolarHBondContact O-N 2.94Å; S323-A327 VanDerWaalsContact O-N 3.08Å
324	E	90.3	Very high	89.3	Confident	170 Å²	170	73.1 Å²	73.1	79%	0.794	38%	0.382	S	S	*	.	H	α-helix	trans	-69.2	-42.5	177.7	-66.9	175	-178.8	0	0	111.8	S322 A327 A328	S322-E324 PolarHBondContact O-N 3.4Å; E324-A327 PolarHBondContact O-N 3.01Å; E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 3.2Å
325	R	89.4	Confident	89.4	Confident	147 Å²	147	74.9 Å²	74.9	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-69.3	-37.1	176.2	-73.3	-179.2	178.2	-167.4	-0.1	111.6	D319 S322 A328 T329	D319-R325 IonicContact OD2-NH1 3.58Å; S322-R325 PolarHBondContact O-N 3.43Å; S322-R325 VanDerWaalsContact OG-CB 3.29Å; S322-R325 WeakPolarHBondContact OG-CB 3.36Å; S322-R325 VanDerWaalsContact OG-CG 3.23Å; S322-R325 WeakPolarHBondContact OG-CG 3.39Å; S322-R325 PolarHBondContact OG-N 2.92Å; R325-A328 PolarHBondContact O-N 3.13Å; R325-T329 VanDerWaalsContact O-CB 3.32Å; R325-T329 WeakPolarHBondContact O-CB 3.4Å; R325-T329 VanDerWaalsContact O-CG2 3.31Å; R325-T329 WeakPolarHBondContact O-CG2 3.34Å; R325-T329 PolarHBondContact O-N 3.25Å; R325-T329 PolarHBondContact O-OG1 3.46Å
326	E	90.8	Very high	89.6	Confident	68 Å²	68	72.8 Å²	72.8	32%	0.318	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-49.4	175.3	-177	164.7	-152.7	0	0	110.1	R279 V318 D319 S322 A328 T329 F330	R279-E326 IonicContact CZ-OE1 2.71Å; R279-E326 IonicContact NH2-OE1 2.77Å; R279-E326 PolarHBondContact NH2-OE1 2.73Å; V318-E326 HydrophobicContact CG1-CG 3.84Å; D319-E326 WeakPolarHBondContact O-CA 3.46Å; D319-E326 WeakPolarHBondContact O-CB 3.42Å; D319-E326 PolarHBondContact O-N 3.36Å; S322-E326 WeakPolarHBondContact O-CB 3.43Å; S322-E326 PolarHBondContact O-N 3.38Å; E326-A328 PolarHBondContact O-N 3.48Å; E326-T329 PolarHBondContact O-N 3.2Å; E326-T329 PolarHBondContact O-OG1 3.07Å; E326-F330 WeakPolarHBondContact O-CB 3.34Å; E326-F330 PolarHBondContact O-N 3.43Å
327	A	89.9	Confident	89.8	Confident	55 Å²	55	72.8 Å²	72.8	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-44.2	177.7	0	0	0	0	0	112.5	S323 E324 S331	S323-A327 PolarHBondContact O-N 2.94Å; S323-A327 VanDerWaalsContact O-N 3.08Å; E324-A327 PolarHBondContact O-N 3.01Å; A327-S331 WeakPolarHBondContact O-CB 3.41Å; A327-S331 PolarHBondContact O-N 2.89Å; A327-S331 PolarHBondContact O-OG 3.12Å
328	A	90.3	Very high	90	Very high	64 Å²	64	73.3 Å²	73.3	53%	0.529	38%	0.382	S	S	.	.	H	α-helix	trans	-65.9	-46.9	179.3	0	0	0	0	0	112.5	E324 R325 E326 S331 R332	E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 3.2Å; R325-A328 PolarHBondContact O-N 3.13Å; E326-A328 PolarHBondContact O-N 3.48Å; A328-S331 PolarHBondContact O-N 2.83Å; A328-R332 PolarHBondContact O-N 2.85Å
329	T	90.4	Very high	90.2	Very high	21 Å²	21	74.2 Å²	74.2	13%	0.129	39%	0.389	C	S	.	.	H	α-helix	trans	-71.7	-33.6	-179.5	54.9	0	0	0	0	112.4	D319 R325 E326 R332 M333	D319-T329 HydrophobicContact CB-CG2 4.39Å; D319-T329 PolarHBondContact N-OG1 3.31Å; D319-T329 VanDerWaalsContact N-OG1 3.11Å; R325-T329 VanDerWaalsContact O-CB 3.32Å; R325-T329 WeakPolarHBondContact O-CB 3.4Å; R325-T329 VanDerWaalsContact O-CG2 3.31Å; R325-T329 WeakPolarHBondContact O-CG2 3.34Å; R325-T329 PolarHBondContact O-N 3.25Å; R325-T329 PolarHBondContact O-OG1 3.46Å; E326-T329 PolarHBondContact O-N 3.2Å; E326-T329 PolarHBondContact O-OG1 3.07Å; T329-R332 PolarHBondContact O-N 2.85Å; T329-M333 WeakPolarHBondContact O-CB 3.06Å; T329-M333 PolarHBondContact O-N 3.45Å
330	F	90.3	Very high	90.5	Very high	92 Å²	92	72.1 Å²	72.1	40%	0.404	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-44.7	171.7	-173.9	-94.3	0	0	0	111.6	V318 E326 R332 M333 H334	V318-F330 HydrophobicContact CG1-CB 4.21Å; V318-F330 HydrophobicContact CG2-CB 4.43Å; V318-F330 HydrophobicContact CG2-CD2 4.22Å; E326-F330 WeakPolarHBondContact O-CB 3.34Å; E326-F330 PolarHBondContact O-N 3.43Å; F330-R332 VanDerWaalsContact C-N 3.34Å; F330-R332 PolarHBondContact O-N 2.74Å; F330-M333 PolarHBondContact O-N 3.19Å; F330-H334 WeakPolarHBondContact O-CB 3.42Å; F330-H334 PolarHBondContact O-N 3.27Å
331	S	91.4	Very high	90.7	Very high	75 Å²	75	72.8 Å²	72.8	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-44	176.7	-57.6	0	0	0	0	111.5	A327 A328 H334 E335	A327-S331 WeakPolarHBondContact O-CB 3.41Å; A327-S331 PolarHBondContact O-N 2.89Å; A327-S331 PolarHBondContact O-OG 3.12Å; A328-S331 PolarHBondContact O-N 2.83Å; S331-H334 PolarHBondContact O-N 3.07Å; S331-E335 PolarHBondContact O-N 3.23Å
332	R	91.4	Very high	90.9	Very high	63 Å²	63	71.6 Å²	71.6	24%	0.238	37%	0.37	C	S	.	.	H	α-helix	trans	-57.7	-49.3	173.8	178	-178.6	68.4	-177.3	1.8	112.1	Y300 D314 F315 S317 A328 T329 F330 H334 E335 I336	Y300-R332 WeakPolarHBondContact OH-CD 3.49Å; Y300-R332 WeakPolarHBondContact OH-CG 3.38Å; D314-R332 PolarHBondContact O-NH2 3Å; F315-R332 PolarHBondContact O-NE 3.4Å; F315-R332 PolarHBondContact O-NH2 3.38Å; S317-R332 PolarHBondContact O-NH2 2.84Å; A328-R332 PolarHBondContact O-N 2.85Å; T329-R332 PolarHBondContact O-N 2.85Å; F330-R332 VanDerWaalsContact C-N 3.34Å; F330-R332 PolarHBondContact O-N 2.74Å; R332-H334 VanDerWaalsContact C-N 3.31Å; R332-H334 PolarHBondContact O-N 3.3Å; R332-E335 PolarHBondContact O-N 3.47Å; R332-I336 HydrophobicContact CG-CD1 4.08Å; R332-I336 WeakPolarHBondContact O-CG1 3.48Å; R332-I336 PolarHBondContact O-N 2.85Å
333	M	90.6	Very high	91	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-62.3	-40.2	179.9	171	-87.4	171.3	0	0	111.6	S278 E281 V283 V318 T329 F330 I336 T337	S278-M333 WeakPolarHBondContact O-CE 3.33Å; E281-M333 HydrophobicContact CB-CE 3.54Å; E281-M333 HydrophobicContact CG-CE 4.3Å; E281-M333 VanDerWaalsContact OE2-CE 3.29Å; E281-M333 WeakPolarHBondContact OE2-CE 3.46Å; V283-M333 HydrophobicContact CG2-CE 3.81Å; V283-M333 HydrophobicContact CG2-CG 4.34Å; V318-M333 HydrophobicContact CG2-CB 4.4Å; T329-M333 WeakPolarHBondContact O-CB 3.06Å; T329-M333 PolarHBondContact O-N 3.45Å; F330-M333 PolarHBondContact O-N 3.19Å; M333-I336 PolarHBondContact O-N 3.4Å; M333-T337 WeakPolarHBondContact CE-OG1 3.47Å; M333-T337 WeakPolarHBondContact O-CB 3.42Å; M333-T337 PolarHBondContact O-N 3.02Å; M333-T337 PolarHBondContact O-OG1 3.4Å
334	H	90.9	Very high	91.1	Very high	103 Å²	103	69.5 Å²	69.5	48%	0.477	36%	0.36	S	S	.	.	H	α-helix	trans	-66.1	-39.3	177	-169.4	66.4	0	0	0	112.1	F330 S331 R332 T337 S338	F330-H334 WeakPolarHBondContact O-CB 3.42Å; F330-H334 PolarHBondContact O-N 3.27Å; S331-H334 PolarHBondContact O-N 3.07Å; R332-H334 VanDerWaalsContact C-N 3.31Å; R332-H334 PolarHBondContact O-N 3.3Å; H334-T337 PolarHBondContact O-N 3.47Å; H334-S338 WeakPolarHBondContact O-CB 3.27Å; H334-S338 PolarHBondContact O-N 2.86Å
335	E	92.4	Very high	91.1	Very high	127 Å²	127	63.1 Å²	63.1	59%	0.593	33%	0.331	S	S	*	.	H	α-helix	trans	-60.8	-49.1	174.8	-174.6	174	-168.9	0	0	111.6	S331 R332 T337 S338 S339	S331-E335 PolarHBondContact O-N 3.23Å; R332-E335 PolarHBondContact O-N 3.47Å; E335-T337 VanDerWaalsContact C-N 3.32Å; E335-T337 PolarHBondContact O-N 3.2Å; E335-S338 PolarHBondContact O-N 2.95Å; E335-S338 PolarHBondContact O-OG 2.92Å; E335-S339 PolarHBondContact O-N 3.23Å
336	I	92.4	Very high	91.1	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-44.8	176.8	-62.8	167.1	0	0	0	110.5	V283 F294 F295 Y300 R332 M333 S338 S339 Y340	V283-I336 HydrophobicContact CG1-CB 4.27Å; V283-I336 HydrophobicContact CG1-CG2 3.55Å; F294-I336 HydrophobicContact CE1-CG2 4.01Å; F294-I336 HydrophobicContact CZ-CG2 4.43Å; F295-I336 HydrophobicContact CE1-CG2 4.1Å; Y300-I336 HydrophobicContact CD2-CD1 4.12Å; Y300-I336 HydrophobicContact CD2-CG1 4.44Å; Y300-I336 HydrophobicContact CE2-CD1 3.77Å; Y300-I336 HydrophobicContact CE2-CG1 3.98Å; R332-I336 HydrophobicContact CG-CD1 4.08Å; R332-I336 WeakPolarHBondContact O-CG1 3.48Å; R332-I336 PolarHBondContact O-N 2.85Å; M333-I336 PolarHBondContact O-N 3.4Å; I336-S338 PolarHBondContact O-N 3.05Å; I336-S339 WeakPolarHBondContact O-CB 3.31Å; I336-S339 PolarHBondContact O-N 3.4Å; I336-S339 VanDerWaalsContact O-N 3.17Å; I336-Y340 PolarHBondContact O-N 2.94Å
337	T	91.4	Very high	91.1	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.012	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-42.3	179	-56	0	0	0	0	111.4	M333 H334 E335 S339 Y340 Q341	M333-T337 WeakPolarHBondContact CE-OG1 3.47Å; M333-T337 WeakPolarHBondContact O-CB 3.42Å; M333-T337 PolarHBondContact O-N 3.02Å; M333-T337 PolarHBondContact O-OG1 3.4Å; H334-T337 PolarHBondContact O-N 3.47Å; E335-T337 VanDerWaalsContact C-N 3.32Å; E335-T337 PolarHBondContact O-N 3.2Å; T337-S339 VanDerWaalsContact C-N 3.31Å; T337-S339 PolarHBondContact O-N 3.03Å; T337-Y340 PolarHBondContact O-N 3.35Å; T337-Q341 WeakPolarHBondContact O-CG 2.92Å; T337-Q341 PolarHBondContact O-N 3.25Å
338	S	92.1	Very high	91.2	Very high	32 Å²	32	60 Å²	60	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-66.8	-31.7	175.9	80.1	0	0	0	0	112.9	H334 E335 I336 R342	H334-S338 WeakPolarHBondContact O-CB 3.27Å; H334-S338 PolarHBondContact O-N 2.86Å; E335-S338 PolarHBondContact O-N 2.95Å; E335-S338 PolarHBondContact O-OG 2.92Å; I336-S338 PolarHBondContact O-N 3.05Å; S338-R342 WeakPolarHBondContact O-CG 2.94Å; S338-R342 PolarHBondContact O-N 3.38Å; S338-R342 PolarHBondContact O-NE 3.29Å
339	S	92.6	Very high	91.1	Very high	38 Å²	38	57.1 Å²	57.1	27%	0.266	29%	0.29	S	S	.	.	H	α-helix	trans	-67	-43.7	173.1	-171	0	0	0	0	110.4	E335 I336 T337 R342 S343	E335-S339 PolarHBondContact O-N 3.23Å; I336-S339 WeakPolarHBondContact O-CB 3.31Å; I336-S339 PolarHBondContact O-N 3.4Å; I336-S339 VanDerWaalsContact O-N 3.17Å; T337-S339 VanDerWaalsContact C-N 3.31Å; T337-S339 PolarHBondContact O-N 3.03Å; S339-R342 PolarHBondContact O-N 3.44Å; S339-S343 PolarHBondContact O-N 2.73Å
340	Y	91.9	Very high	91	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-46.5	176.5	177.8	-111.8	0	0	0	112.1	L282 V283 F284 C285 F294 I336 T337 R342 S343 I345 Y346	L282-Y340 HydrophobicContact CD2-CE1 4.42Å; V283-Y340 WeakPolarHBondContact O-CB 3.32Å; V283-Y340 WeakPolarHBondContact O-CD1 3.42Å; V283-Y340 VanDerWaalsContact O-CG 3.22Å; F284-Y340 AromaticContact CD2-CD2 3.69Å; F284-Y340 HydrophobicContact CD2-CD2 3.69Å; F284-Y340 AromaticContact CD2-CE2 3.8Å; F284-Y340 HydrophobicContact CD2-CE2 3.8Å; F284-Y340 HydrophobicContact CE2-CD2 4.34Å; F284-Y340 HydrophobicContact CE2-CE2 4.21Å; F284-Y340 HydrophobicContact CG-CD2 4.47Å; F284-Y340 HydrophobicContact CG-CE2 4.43Å; C285-Y340 WeakPolarHBondContact CB-OH 3.01Å; C285-Y340 VanDerWaalsContact N-CZ 3.3Å; C285-Y340 PolarHBondContact N-OH 2.83Å; C285-Y340 PolarHBondContact O-OH 3.04Å; F294-Y340 HydrophobicContact CE2-CD2 4.45Å; F294-Y340 HydrophobicContact CZ-CD2 4.38Å; I336-Y340 PolarHBondContact O-N 2.94Å; T337-Y340 PolarHBondContact O-N 3.35Å; Y340-R342 PolarHBondContact O-N 2.96Å; Y340-S343 VanDerWaalsContact O-CB 3.28Å; Y340-S343 WeakPolarHBondContact O-CB 3.42Å; Y340-S343 PolarHBondContact O-N 2.68Å; Y340-S343 PolarHBondContact O-OG 3.11Å; Y340-I345 HydrophobicContact CE2-CB 4.38Å; Y340-I345 HydrophobicContact CE2-CG2 4.14Å; Y340-Y346 HydrophobicContact CD1-CD2 4.14Å; Y340-Y346 AromaticContact CE1-CD2 3.49Å; Y340-Y346 HydrophobicContact CE1-CD2 3.49Å; Y340-Y346 VanDerWaalsContact CE1-CD2 3.49Å; Y340-Y346 HydrophobicContact CE1-CE2 4.23Å; Y340-Y346 HydrophobicContact CE1-CG 4.29Å; Y340-Y346 AromaticContact CZ-CD2 3.92Å; Y340-Y346 WeakPolarHBondContact O-CB 3.31Å
341	Q	89.6	Confident	90.9	Very high	103 Å²	103	57.3 Å²	57.3	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-29.3	177.9	-70.7	175.9	-0.1	0	0	113.4	T337 Y346	T337-Q341 WeakPolarHBondContact O-CG 2.92Å; T337-Q341 PolarHBondContact O-N 3.25Å; Q341-Y346 WeakPolarHBondContact O-CD1 3.4Å
342	R	92.1	Very high	90.6	Very high	192 Å²	192	57.7 Å²	57.7	73%	0.725	29%	0.287	S	S	*	.	H	α-helix	trans	-85.4	-14.9	174.9	-71.1	-176.8	-70.8	161.6	-3.7	113.6	S338 S339 Y340	S338-R342 WeakPolarHBondContact O-CG 2.94Å; S338-R342 PolarHBondContact O-N 3.38Å; S338-R342 PolarHBondContact O-NE 3.29Å; S339-R342 PolarHBondContact O-N 3.44Å; Y340-R342 PolarHBondContact O-N 2.96Å
343	S	92.2	Very high	90.2	Very high	19 Å²	19	54.9 Å²	54.9	13%	0.133	28%	0.276	C	S	.	.	S	Bend	trans	-69.7	154.2	-175.3	76.9	0	0	0	0	112.6	S339 Y340 I345 Y346 Q347	S339-S343 PolarHBondContact O-N 2.73Å; Y340-S343 VanDerWaalsContact O-CB 3.28Å; Y340-S343 WeakPolarHBondContact O-CB 3.42Å; Y340-S343 PolarHBondContact O-N 2.68Å; Y340-S343 PolarHBondContact O-OG 3.11Å; S343-I345 PolarHBondContact O-N 3.1Å; S343-I345 PolarHBondContact OG-N 2.94Å; S343-Y346 PolarHBondContact O-N 3.33Å; S343-Y346 PolarHBondContact OG-N 3.49Å; S343-Q347 PolarHBondContact O-N 2.91Å
344	A	91.4	Very high	89.9	Confident	82 Å²	82	59.2 Å²	59.2	68%	0.678	30%	0.296	S	S	*	.	H	α-helix	trans	-62.6	-25.7	173.1	0	0	0	0	0	112.7	Q347 N348	A344-Q347 PolarHBondContact O-N 2.8Å; A344-N348 VanDerWaalsContact O-CB 3.28Å; A344-N348 WeakPolarHBondContact O-CB 3.26Å; A344-N348 PolarHBondContact O-N 2.93Å
345	I	90.5	Very high	89.6	Confident	36 Å²	36	59.8 Å²	59.8	19%	0.185	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-45.3	178.9	-55.7	170.2	0	0	0	110	F284 E290 F294 Y340 S343 M349	F284-I345 HydrophobicContact CE2-CD1 3.93Å; E290-I345 HydrophobicContact CB-CD1 4.27Å; F294-I345 HydrophobicContact CB-CD1 4.24Å; F294-I345 HydrophobicContact CD2-CD1 4.49Å; Y340-I345 HydrophobicContact CE2-CB 4.38Å; Y340-I345 HydrophobicContact CE2-CG2 4.14Å; S343-I345 PolarHBondContact O-N 3.1Å; S343-I345 PolarHBondContact OG-N 2.94Å; I345-M349 WeakPolarHBondContact O-CB 3.33Å; I345-M349 PolarHBondContact O-N 3.34Å
346	Y	89.3	Confident	88.8	Confident	36 Å²	36	54.2 Å²	54.2	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-42.8	178.3	-175	-105.2	0	0	0	111.8	Y340 Q341 S343 M349 L350	Y340-Y346 HydrophobicContact CD1-CD2 4.14Å; Y340-Y346 AromaticContact CE1-CD2 3.49Å; Y340-Y346 HydrophobicContact CE1-CD2 3.49Å; Y340-Y346 VanDerWaalsContact CE1-CD2 3.49Å; Y340-Y346 HydrophobicContact CE1-CE2 4.23Å; Y340-Y346 HydrophobicContact CE1-CG 4.29Å; Y340-Y346 AromaticContact CZ-CD2 3.92Å; Y340-Y346 WeakPolarHBondContact O-CB 3.31Å; Q341-Y346 WeakPolarHBondContact O-CD1 3.4Å; S343-Y346 PolarHBondContact O-N 3.33Å; S343-Y346 PolarHBondContact OG-N 3.49Å; Y346-M349 HydrophobicContact CD2-CE 3.54Å; Y346-M349 HydrophobicContact CE2-CE 3.69Å; Y346-M349 WeakPolarHBondContact O-CB 3.21Å; Y346-M349 PolarHBondContact O-N 3.34Å; Y346-L350 HydrophobicContact CD1-CD1 3.87Å; Y346-L350 HydrophobicContact CD1-CG 4.4Å; Y346-L350 HydrophobicContact CE1-CD1 3.43Å; Y346-L350 VanDerWaalsContact CE1-CD1 3.43Å; Y346-L350 HydrophobicContact CE1-CG 4.09Å; Y346-L350 WeakPolarHBondContact O-CG 3.47Å; Y346-L350 PolarHBondContact O-N 3.03Å
347	Q	90.7	Very high	87.9	Confident	95 Å²	95	56.1 Å²	56.1	44%	0.444	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-46.8	176.1	-64.2	-62.6	-31.9	0	0	111.9	S343 A344 M349 L350 D351	S343-Q347 PolarHBondContact O-N 2.91Å; A344-Q347 PolarHBondContact O-N 2.8Å; Q347-M349 VanDerWaalsContact C-N 3.27Å; Q347-M349 PolarHBondContact O-N 3.33Å; Q347-L350 WeakPolarHBondContact O-CB 3.04Å; Q347-L350 PolarHBondContact O-N 3.39Å; Q347-L350 VanDerWaalsContact O-N 3.11Å; Q347-D351 VanDerWaalsContact O-CG 3.3Å; Q347-D351 PolarHBondContact O-N 3.18Å
348	N	90.9	Very high	86.7	Confident	74 Å²	74	63.5 Å²	63.5	40%	0.396	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-35.8	176	-173.1	2	0	0	0	112.1	A344 K352	A344-N348 VanDerWaalsContact O-CB 3.28Å; A344-N348 WeakPolarHBondContact O-CB 3.26Å; A344-N348 PolarHBondContact O-N 2.93Å; N348-K352 WeakPolarHBondContact O-CB 3.07Å; N348-K352 WeakPolarHBondContact O-CG 3.32Å; N348-K352 PolarHBondContact O-N 3.42Å; N348-K352 WeakPolarHBondContact OD1-CE 2.94Å
349	M	88.6	Confident	85.4	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-65.6	-42.6	174.4	179.6	-101.8	-74.6	0	0	112	S83 H85 I345 Y346 Q347 M353	S83-M349 WeakPolarHBondContact O-CE 3.3Å; H85-M349 HydrophobicContact CB-CG 4.26Å; I345-M349 WeakPolarHBondContact O-CB 3.33Å; I345-M349 PolarHBondContact O-N 3.34Å; Y346-M349 HydrophobicContact CD2-CE 3.54Å; Y346-M349 HydrophobicContact CE2-CE 3.69Å; Y346-M349 WeakPolarHBondContact O-CB 3.21Å; Y346-M349 PolarHBondContact O-N 3.34Å; Q347-M349 VanDerWaalsContact C-N 3.27Å; Q347-M349 PolarHBondContact O-N 3.33Å; M349-M353 WeakPolarHBondContact O-CB 3.4Å; M349-M353 PolarHBondContact O-N 3.43Å
350	L	87.4	Confident	83.6	Confident	38 Å²	38	69.1 Å²	69.1	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-43.9	174	-70.3	176.9	0	0	0	111.9	Y346 Q347 K352 M353 E354	Y346-L350 HydrophobicContact CD1-CD1 3.87Å; Y346-L350 HydrophobicContact CD1-CG 4.4Å; Y346-L350 HydrophobicContact CE1-CD1 3.43Å; Y346-L350 VanDerWaalsContact CE1-CD1 3.43Å; Y346-L350 HydrophobicContact CE1-CG 4.09Å; Y346-L350 WeakPolarHBondContact O-CG 3.47Å; Y346-L350 PolarHBondContact O-N 3.03Å; Q347-L350 WeakPolarHBondContact O-CB 3.04Å; Q347-L350 PolarHBondContact O-N 3.39Å; Q347-L350 VanDerWaalsContact O-N 3.11Å; L350-K352 PolarHBondContact O-N 3.32Å; L350-M353 CarbonylContact O-C 3.58Å; L350-M353 WeakPolarHBondContact O-CA 3.31Å; L350-M353 WeakPolarHBondContact O-CB 3.11Å; L350-M353 PolarHBondContact O-N 2.93Å; L350-M353 VanDerWaalsContact O-N 3.08Å; L350-E354 PolarHBondContact O-N 3.13Å
351	D	88.4	Confident	81.5	Confident	80 Å²	80	76.6 Å²	76.6	43%	0.428	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-45.6	178.1	-70.1	-23.2	0	0	0	111.4	Q347 M353 E354 Q355	Q347-D351 VanDerWaalsContact O-CG 3.3Å; Q347-D351 PolarHBondContact O-N 3.18Å; D351-M353 VanDerWaalsContact C-N 3.26Å; D351-M353 PolarHBondContact O-N 3.28Å; D351-E354 PolarHBondContact O-N 2.85Å; D351-Q355 WeakPolarHBondContact O-CB 3.39Å; D351-Q355 VanDerWaalsContact O-CG 3.24Å; D351-Q355 WeakPolarHBondContact O-CG 3.31Å; D351-Q355 PolarHBondContact O-N 2.75Å
352	K	85.1	Confident	79.7	Confident	82 Å²	82	74.9 Å²	74.9	36%	0.357	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-38.7	174.5	-77.4	178.2	179.6	179.1	0	111.9	N348 L350 S356	N348-K352 WeakPolarHBondContact O-CB 3.07Å; N348-K352 WeakPolarHBondContact O-CG 3.32Å; N348-K352 PolarHBondContact O-N 3.42Å; N348-K352 WeakPolarHBondContact OD1-CE 2.94Å; L350-K352 PolarHBondContact O-N 3.32Å; K352-S356 WeakPolarHBondContact O-CB 3.46Å; K352-S356 PolarHBondContact O-N 2.85Å
353	M	83.9	Confident	77.6	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.02	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-44.8	176.9	-171.4	173.8	179.8	0	0	111.1	R51 F124 M349 L350 D351 S356 L357	R51-M353 HydrophobicContact CB-CE 3.55Å; R51-M353 HydrophobicContact CB-SD 4.26Å; R51-M353 HydrophobicContact CG-CE 4.33Å; F124-M353 HydrophobicContact CD2-CE 3.34Å; F124-M353 HydrophobicContact CE2-CE 3.71Å; F124-M353 HydrophobicContact CG-CE 4.34Å; M349-M353 WeakPolarHBondContact O-CB 3.4Å; M349-M353 PolarHBondContact O-N 3.43Å; L350-M353 CarbonylContact O-C 3.58Å; L350-M353 WeakPolarHBondContact O-CA 3.31Å; L350-M353 WeakPolarHBondContact O-CB 3.11Å; L350-M353 PolarHBondContact O-N 2.93Å; L350-M353 VanDerWaalsContact O-N 3.08Å; D351-M353 VanDerWaalsContact C-N 3.26Å; D351-M353 PolarHBondContact O-N 3.28Å; M353-S356 PolarHBondContact O-N 2.97Å; M353-S356 PolarHBondContact O-OG 2.56Å; M353-L357 WeakPolarHBondContact O-CG 3.49Å; M353-L357 PolarHBondContact O-N 3.22Å
354	E	84.6	Confident	75.7	Confident	91 Å²	91	71.9 Å²	71.9	43%	0.425	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-41	176.6	-71.2	-167.7	169.9	0	0	112.6	L350 D351 S356 L357 Q358	L350-E354 PolarHBondContact O-N 3.13Å; D351-E354 PolarHBondContact O-N 2.85Å; E354-S356 VanDerWaalsContact C-N 3.27Å; E354-S356 PolarHBondContact O-N 3.43Å; E354-L357 WeakPolarHBondContact O-CB 3.04Å; E354-L357 PolarHBondContact O-N 3.4Å; E354-L357 VanDerWaalsContact O-N 3.14Å; E354-Q358 PolarHBondContact O-N 3.28Å
355	Q	83.2	Confident	73.8	Confident	116 Å²	116	68.5 Å²	68.5	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-40.7	172.6	-73.1	172.3	12.4	0	0	111.5	D351 L357 Q358 I359	D351-Q355 WeakPolarHBondContact O-CB 3.39Å; D351-Q355 VanDerWaalsContact O-CG 3.24Å; D351-Q355 WeakPolarHBondContact O-CG 3.31Å; D351-Q355 PolarHBondContact O-N 2.75Å; Q355-L357 VanDerWaalsContact C-N 3.28Å; Q355-L357 PolarHBondContact O-N 2.86Å; Q355-Q358 PolarHBondContact O-N 3.23Å; Q355-I359 WeakPolarHBondContact O-CG1 3.41Å; Q355-I359 PolarHBondContact O-N 3.16Å
356	S	75.7	Confident	71.9	Confident	10 Å²	10	71.7 Å²	71.7	7%	0.07	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-28.9	178.3	81	0	0	0	0	113.6	G127 K352 M353 E354	G127-S356 WeakPolarHBondContact CA-O 3.5Å; K352-S356 WeakPolarHBondContact O-CB 3.46Å; K352-S356 PolarHBondContact O-N 2.85Å; M353-S356 PolarHBondContact O-N 2.97Å; M353-S356 PolarHBondContact O-OG 2.56Å; E354-S356 VanDerWaalsContact C-N 3.27Å; E354-S356 PolarHBondContact O-N 3.43Å
357	L	73.9	Confident	70.1	Confident	45 Å²	45	72.4 Å²	72.4	24%	0.236	39%	0.387	C	S	.	.	H	α-helix	trans	-70.9	-32.6	174.6	-66.7	169	0	0	0	112	F124 M353 E354 Q355	F124-L357 HydrophobicContact CB-CD2 4.24Å; F124-L357 HydrophobicContact CD1-CD2 3.24Å; F124-L357 HydrophobicContact CD2-CD2 4.32Å; F124-L357 HydrophobicContact CE1-CD2 3.5Å; F124-L357 VanDerWaalsContact CE1-CD2 3.5Å; F124-L357 HydrophobicContact CG-CD2 3.68Å; F124-L357 HydrophobicContact CZ-CD2 4.14Å; M353-L357 WeakPolarHBondContact O-CG 3.49Å; M353-L357 PolarHBondContact O-N 3.22Å; E354-L357 WeakPolarHBondContact O-CB 3.04Å; E354-L357 PolarHBondContact O-N 3.4Å; E354-L357 VanDerWaalsContact O-N 3.14Å; Q355-L357 VanDerWaalsContact C-N 3.28Å; Q355-L357 PolarHBondContact O-N 2.86Å
358	Q	67.1	Low	68.4	Low	157 Å²	157	70.5 Å²	70.5	73%	0.734	38%	0.377	S	S	*	.	H	α-helix	trans	-75.3	-26.5	-179.8	-67.4	178.7	2.2	0	0	112.6	E354 Q355 S360	E354-Q358 PolarHBondContact O-N 3.28Å; Q355-Q358 PolarHBondContact O-N 3.23Å; Q358-S360 PolarHBondContact O-N 3.26Å
359	I	64.8	Low	66.4	Low	98 Å²	98	72.3 Å²	72.3	50%	0.503	39%	0.387	S	S	.	.			trans	-82.1	65.6	177	-54.8	161.6	0	0	0	109.3	Q355 D361	Q355-I359 WeakPolarHBondContact O-CG1 3.41Å; Q355-I359 PolarHBondContact O-N 3.16Å; I359-D361 PolarHBondContact O-N 3.46Å
360	S	54.2	Low	64.2	Low	89 Å²	89	78.2 Å²	78.2	62%	0.622	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	29.4	-177.5	-147.5	0	0	0	0	114	Q358	Q358-S360 PolarHBondContact O-N 3.26Å
361	D	47.4	Very low	62.1	Low	159 Å²	159	82.5 Å²	82.5	85%	0.85	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-1.2	-176	-90.2	-21.5	0	0	0	114.4	I359	I359-D361 PolarHBondContact O-N 3.46Å
362	K	51.9	Low	59.9	Low	67 Å²	67	83.4 Å²	83.4	29%	0.291	44%	0.444	S	S	.	.	S	Bend	trans	-85.9	131.5	179.5	-71	177.8	177.3	178.6	0	110.5	P44 S45 N126 A364	P44-K362 HydrophobicContact CB-CD 4.08Å; P44-K362 HydrophobicContact CB-CG 4.26Å; S45-K362 PolarHBondContact O-NZ 3.16Å; S45-K362 PolarHBondContact OG-NZ 2.85Å; N126-K362 HydrophobicContact CB-CB 4.46Å; K362-A364 PolarHBondContact O-N 3.49Å
363	P	48.7	Very low	58.5	Low	101 Å²	101	82.1 Å²	82.1	66%	0.656	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-58.2	140.7	176.7	24.1	-32.1	0	0	0	109.7	I365	P363-I365 PolarHBondContact O-N 2.9Å
364	A	51.1	Low	57.3	Low	47 Å²	47	87.8 Å²	87.8	39%	0.388	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-51.9	134.9	174	0	0	0	0	0	108.9	K362 F367	K362-A364 PolarHBondContact O-N 3.49Å; A364-F367 HydrophobicContact CB-CD2 4.27Å; A364-F367 HydrophobicContact CB-CE2 3.34Å; A364-F367 HydrophobicContact CB-CZ 3.72Å
365	I	53.2	Low	56.1	Low	12 Å²	12	88.7 Å²	88.7	6%	0.062	49%	0.489	C	S	.	.			trans	-45.1	133.4	172	-56.1	-179.5	0	0	0	106.8	C46 I125 R223 P363 F367	C46-I365 WeakPolarHBondContact SG-CD1 3.31Å; I125-I365 HydrophobicContact CG2-CD1 3.26Å; I125-I365 HydrophobicContact CG2-CG1 3.89Å; R223-I365 HydrophobicContact CB-CD1 4.27Å; R223-I365 HydrophobicContact CB-CG2 4.33Å; R223-I365 HydrophobicContact CG-CG2 4.03Å; P363-I365 PolarHBondContact O-N 2.9Å; I365-F367 VanDerWaalsContact C-N 3.32Å; I365-F367 PolarHBondContact O-N 3.06Å
366	P	50.3	Low	55.2	Low	102 Å²	102	88.9 Å²	88.9	66%	0.662	50%	0.498	S	S	*	.			trans	-53	103.7	-179.6	21	-32.6	0	0	0	108	K368	P366-K368 PolarHBondContact O-N 2.71Å
367	F	50.9	Low	54.9	Low	51 Å²	51	89.8 Å²	89.8	22%	0.224	51%	0.506	C	S	.	.			trans	-56	130.1	176.9	-65.5	-80.4	0	0	0	105.9	E134 D137 A364 I365 N369	E134-F367 HydrophobicContact CB-CD1 4.29Å; E134-F367 HydrophobicContact CB-CE1 3.91Å; E134-F367 HydrophobicContact CG-CD1 4.31Å; E134-F367 HydrophobicContact CG-CE1 3.91Å; D137-F367 HydrophobicContact CB-CB 4.41Å; D137-F367 HydrophobicContact CB-CD1 4.37Å; A364-F367 HydrophobicContact CB-CD2 4.27Å; A364-F367 HydrophobicContact CB-CE2 3.34Å; A364-F367 HydrophobicContact CB-CZ 3.72Å; I365-F367 VanDerWaalsContact C-N 3.32Å; I365-F367 PolarHBondContact O-N 3.06Å; F367-N369 PolarHBondContact O-N 2.84Å
368	K	55.3	Low	54.8	Low	56 Å²	56	92.2 Å²	92.2	24%	0.243	52%	0.515	C	S	.	.	S	Bend	trans	-40.3	117	166.2	-161.2	169	174.2	174.3	0	107.3	D137 P366 K370 D469	D137-K368 HydrophobicContact CB-CB 3.71Å; P366-K368 PolarHBondContact O-N 2.71Å; K368-K370 PolarHBondContact O-N 3.38Å; K368-D469 PolarHBondContact NZ-O 3.34Å
369	N	48.4	Very low	55.2	Low	112 Å²	112	89.8 Å²	89.8	60%	0.599	51%	0.506	S	S	*	.			trans	-32.6	108.6	-159.3	-104.4	-36.8	0	0	0	113.7	F367 E371	F367-N369 PolarHBondContact O-N 2.84Å; N369-E371 PolarHBondContact O-N 2.91Å; N369-E371 VanDerWaalsContact O-N 3.11Å
370	K	41.7	Very low	55.8	Low	125 Å²	125	86.3 Å²	86.3	54%	0.543	49%	0.494	S	S	.	.			trans	-72.5	1.4	-177.8	-148	169.1	-170.5	165.7	0	113.9	E134 K368 S372	E134-K370 IonicContact OE1-NZ 3.82Å; E134-K370 PolarHBondContact OE1-NZ 3.02Å; E134-K370 VanDerWaalsContact OE1-NZ 3.1Å; K368-K370 PolarHBondContact O-N 3.38Å; K370-S372 PolarHBondContact O-N 3.45Å
371	E	43.4	Very low	57	Low	129 Å²	129	82.2 Å²	82.2	60%	0.603	47%	0.466	S	S	*	.	S	Bend	trans	-81.1	116.4	178.6	-71.7	-177.2	-163.7	0	0	109.8	K169 N369 P373	K169-E371 IonicContact NZ-OE1 2.71Å; K169-E371 IonicContact NZ-OE2 3.57Å; K169-E371 PolarHBondContact NZ-OE2 3.28Å; N369-E371 PolarHBondContact O-N 2.91Å; N369-E371 VanDerWaalsContact O-N 3.11Å; E371-P373 VanDerWaalsContact O-N 3.13Å
372	S	43.7	Very low	58.6	Low	98 Å²	98	76.2 Å²	76.2	69%	0.685	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-47.3	122.1	171	56.5	0	0	0	0	109.2	K370 N374	K370-S372 PolarHBondContact O-N 3.45Å; S372-N374 PolarHBondContact O-N 3.48Å; S372-N374 VanDerWaalsContact O-N 3.09Å
373	P	54.3	Low	60.1	Low	56 Å²	56	77 Å²	77	36%	0.364	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-59.6	124	-177.6	18.7	-28.6	0	0	0	108.7	E371 A377 K378	E371-P373 VanDerWaalsContact O-N 3.13Å; P373-A377 HydrophobicContact CB-CB 3.78Å; P373-K378 HydrophobicContact CB-CG 4.09Å; P373-K378 HydrophobicContact CG-CG 3.99Å; P373-K378 WeakPolarHBondContact O-CE 3.08Å
374	N	58.8	Low	61.7	Low	123 Å²	123	75.3 Å²	75.3	66%	0.658	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-47.9	153.3	170.9	-76.6	-13.2	0	0	0	109.6	S372 V376 A377 K378	S372-N374 PolarHBondContact O-N 3.48Å; S372-N374 VanDerWaalsContact O-N 3.09Å; N374-V376 PolarHBondContact O-N 2.72Å; N374-A377 WeakPolarHBondContact O-CA 3.41Å; N374-A377 WeakPolarHBondContact O-CB 3.3Å; N374-A377 PolarHBondContact O-N 2.83Å; N374-K378 PolarHBondContact O-N 2.97Å
375	C	60.1	Low	63.3	Low	110 Å²	110	73.3 Å²	73.3	74%	0.743	41%	0.409	S	S	*	.	H	α-helix	trans	-50.6	-37.2	178.4	-168.5	0	0	0	0	112	K378 L379	C375-K378 PolarHBondContact O-N 2.81Å; C375-L379 PolarHBondContact O-N 2.75Å
376	V	65.3	Low	64.8	Low	120 Å²	120	76.2 Å²	76.2	73%	0.727	42%	0.421	S	S	*	.	H	α-helix	trans	-62.9	-41.3	174.4	-177	0	0	0	0	112.7	N374 L379 G380	N374-V376 PolarHBondContact O-N 2.72Å; V376-L379 PolarHBondContact O-N 3.18Å; V376-G380 PolarHBondContact O-N 2.84Å
377	A	68.3	Low	66.5	Low	29 Å²	29	79 Å²	79	24%	0.24	42%	0.419	C	S	.	.	H	α-helix	trans	-68	-38.9	176.3	0	0	0	0	0	111.3	P373 N374 L379 G380 V381	P373-A377 HydrophobicContact CB-CB 3.78Å; N374-A377 WeakPolarHBondContact O-CA 3.41Å; N374-A377 WeakPolarHBondContact O-CB 3.3Å; N374-A377 PolarHBondContact O-N 2.83Å; A377-L379 VanDerWaalsContact C-N 3.33Å; A377-L379 PolarHBondContact O-N 3.2Å; A377-G380 PolarHBondContact O-N 2.71Å; A377-V381 WeakPolarHBondContact O-CG2 3.3Å; A377-V381 PolarHBondContact O-N 3.41Å
378	K	72.4	Confident	68.3	Low	96 Å²	96	76.8 Å²	76.8	42%	0.417	41%	0.409	S	S	.	.	H	α-helix	trans	-63.2	-37.6	172.9	-68.1	-178.5	-179.2	173.3	0	112.5	P373 N374 C375 L382	P373-K378 HydrophobicContact CB-CG 4.09Å; P373-K378 HydrophobicContact CG-CG 3.99Å; P373-K378 WeakPolarHBondContact O-CE 3.08Å; N374-K378 PolarHBondContact O-N 2.97Å; C375-K378 PolarHBondContact O-N 2.81Å; K378-L382 PolarHBondContact O-N 3.49Å
379	L	75.4	Confident	69.7	Low	106 Å²	106	74.8 Å²	74.8	56%	0.555	40%	0.401	S	S	*	.	H	α-helix	trans	-68.9	-41.4	174	-172.2	66.3	0	0	0	111.2	C375 V376 A377 V381 L382 V383	C375-L379 PolarHBondContact O-N 2.75Å; V376-L379 PolarHBondContact O-N 3.18Å; A377-L379 VanDerWaalsContact C-N 3.33Å; A377-L379 PolarHBondContact O-N 3.2Å; L379-V381 VanDerWaalsContact C-N 3.35Å; L379-V381 PolarHBondContact O-N 3.47Å; L379-L382 HydrophobicContact CD1-CD2 4.4Å; L379-L382 WeakPolarHBondContact O-CB 3.36Å; L379-L382 PolarHBondContact O-N 2.8Å; L379-L382 VanDerWaalsContact O-N 3.15Å; L379-V383 WeakPolarHBondContact O-CG2 3.39Å; L379-V383 PolarHBondContact O-N 2.92Å
380	G	77.9	Confident	71.5	Confident	24 Å²	24	71.9 Å²	71.9	25%	0.247	39%	0.387	C	S	.	.	H	α-helix	trans	-57	-45.8	173.4	0	0	0	0	0	112.4	V376 A377 L382 V383 F384	V376-G380 PolarHBondContact O-N 2.84Å; A377-G380 PolarHBondContact O-N 2.71Å; G380-L382 VanDerWaalsContact C-N 3.32Å; G380-L382 PolarHBondContact O-N 2.87Å; G380-V383 PolarHBondContact O-N 3.38Å; G380-V383 VanDerWaalsContact O-N 3.15Å; G380-F384 WeakPolarHBondContact O-CD2 3.43Å; G380-F384 WeakPolarHBondContact O-CG 3.29Å; G380-F384 PolarHBondContact O-N 3Å
381	V	78.6	Confident	73.8	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.024	38%	0.379	C	S	.	.	H	α-helix	trans	-56.6	-45.3	173.8	168.6	0	0	0	0	111.6	L165 Q168 A377 L379 V383 F384 M385	L165-V381 HydrophobicContact CD2-CB 4.45Å; L165-V381 HydrophobicContact CD2-CG1 3.9Å; Q168-V381 HydrophobicContact CG-CG2 4.27Å; A377-V381 WeakPolarHBondContact O-CG2 3.3Å; A377-V381 PolarHBondContact O-N 3.41Å; L379-V381 VanDerWaalsContact C-N 3.35Å; L379-V381 PolarHBondContact O-N 3.47Å; V381-V383 VanDerWaalsContact C-N 3.34Å; V381-V383 PolarHBondContact O-N 2.93Å; V381-F384 PolarHBondContact O-N 2.84Å; V381-M385 HydrophobicContact CG1-CG 4.48Å; V381-M385 WeakPolarHBondContact O-CB 3.48Å; V381-M385 WeakPolarHBondContact O-CG 3.16Å; V381-M385 PolarHBondContact O-N 3.37Å
382	L	80.8	Confident	75.8	Confident	32 Å²	32	65 Å²	65	17%	0.168	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-42	177.2	-171.8	75.7	0	0	0	111.6	K378 L379 G380 M385 F386 Q476 L479 A480	K378-L382 PolarHBondContact O-N 3.49Å; L379-L382 HydrophobicContact CD1-CD2 4.4Å; L379-L382 WeakPolarHBondContact O-CB 3.36Å; L379-L382 PolarHBondContact O-N 2.8Å; L379-L382 VanDerWaalsContact O-N 3.15Å; G380-L382 VanDerWaalsContact C-N 3.32Å; G380-L382 PolarHBondContact O-N 2.87Å; L382-M385 PolarHBondContact O-N 3.25Å; L382-F386 VanDerWaalsContact O-CB 3.29Å; L382-F386 WeakPolarHBondContact O-CB 3.44Å; L382-F386 PolarHBondContact O-N 2.87Å; L382-Q476 WeakPolarHBondContact CD1-O 3.38Å; L382-L479 HydrophobicContact CD1-CB 3.91Å; L382-L479 HydrophobicContact CD1-CD2 3.92Å; L382-L479 HydrophobicContact CD1-CG 4.04Å; L382-L479 HydrophobicContact CD2-CD2 3.74Å; L382-L479 HydrophobicContact CD2-CG 4.31Å; L382-A480 HydrophobicContact CD1-CB 4.14Å
383	V	83.8	Confident	77.7	Confident	85 Å²	85	60.4 Å²	60.4	52%	0.515	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-43.7	178.1	172.7	0	0	0	0	111.3	L379 G380 V381 F386 R387	L379-V383 WeakPolarHBondContact O-CG2 3.39Å; L379-V383 PolarHBondContact O-N 2.92Å; G380-V383 PolarHBondContact O-N 3.38Å; G380-V383 VanDerWaalsContact O-N 3.15Å; V381-V383 VanDerWaalsContact C-N 3.34Å; V381-V383 PolarHBondContact O-N 2.93Å; V383-F386 PolarHBondContact O-N 3.47Å; V383-R387 WeakPolarHBondContact O-CB 3.01Å; V383-R387 PolarHBondContact O-N 3.17Å
384	F	83.3	Confident	79.2	Confident	64 Å²	64	61.2 Å²	61.2	28%	0.281	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-44.2	175.8	-68	-54.1	0	0	0	111.8	Q164 L165 G380 V381 R387 R388	Q164-F384 HydrophobicContact CB-CD1 4.28Å; Q164-F384 HydrophobicContact CB-CD2 4.37Å; Q164-F384 HydrophobicContact CB-CE1 4.39Å; Q164-F384 HydrophobicContact CB-CE2 4.48Å; Q164-F384 HydrophobicContact CB-CG 4.29Å; Q164-F384 HydrophobicContact CB-CZ 4.49Å; Q164-F384 HydrophobicContact CG-CE1 4.37Å; L165-F384 HydrophobicContact CD2-CB 4.13Å; G380-F384 WeakPolarHBondContact O-CD2 3.43Å; G380-F384 WeakPolarHBondContact O-CG 3.29Å; G380-F384 PolarHBondContact O-N 3Å; V381-F384 PolarHBondContact O-N 2.84Å; F384-R387 PolarHBondContact O-N 2.84Å; F384-R388 WeakPolarHBondContact O-CB 3.33Å; F384-R388 PolarHBondContact O-N 3.35Å
385	M	82.6	Confident	80.6	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-47.7	173.7	-78.8	-115.6	102.3	0	0	111.6	L165 V381 L382 R387 R388 T389 Y472 M477 A480	L165-M385 HydrophobicContact CD1-CE 4.1Å; L165-M385 HydrophobicContact CD2-CG 4.09Å; V381-M385 HydrophobicContact CG1-CG 4.48Å; V381-M385 WeakPolarHBondContact O-CB 3.48Å; V381-M385 WeakPolarHBondContact O-CG 3.16Å; V381-M385 PolarHBondContact O-N 3.37Å; L382-M385 PolarHBondContact O-N 3.25Å; M385-R387 PolarHBondContact O-N 2.97Å; M385-R388 WeakPolarHBondContact O-CB 3.26Å; M385-R388 PolarHBondContact O-N 3.37Å; M385-T389 PolarHBondContact O-N 3.29Å; M385-T389 PolarHBondContact O-OG1 3.38Å; M385-Y472 HydrophobicContact CE-CD1 3.86Å; M385-Y472 HydrophobicContact CE-CD2 4.49Å; M385-Y472 HydrophobicContact CE-CE1 3.27Å; M385-Y472 HydrophobicContact CE-CE2 3.98Å; M385-Y472 HydrophobicContact CE-CG 4.43Å; M385-Y472 WeakPolarHBondContact CE-OH 3.25Å; M385-Y472 HydrophobicContact SD-CD1 4.03Å; M385-Y472 HydrophobicContact SD-CD2 3.9Å; M385-Y472 HydrophobicContact SD-CE1 3.91Å; M385-Y472 HydrophobicContact SD-CE2 3.77Å; M385-Y472 HydrophobicContact SD-CG 4.02Å; M385-M477 HydrophobicContact SD-CB 4.4Å; M385-A480 HydrophobicContact CB-CB 3.98Å
386	F	84.9	Confident	81.8	Confident	72 Å²	72	54.8 Å²	54.8	32%	0.316	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-49.2	177.8	172.9	-104.7	0	0	0	111.3	L382 V383 R388 T389 V390 V483 H484	L382-F386 VanDerWaalsContact O-CB 3.29Å; L382-F386 WeakPolarHBondContact O-CB 3.44Å; L382-F386 PolarHBondContact O-N 2.87Å; V383-F386 PolarHBondContact O-N 3.47Å; F386-R388 VanDerWaalsContact C-N 3.32Å; F386-R388 PolarHBondContact O-N 3.29Å; F386-T389 PolarHBondContact O-N 3.31Å; F386-V390 HydrophobicContact CD1-CG2 4.29Å; F386-V390 HydrophobicContact CD2-CG2 3.96Å; F386-V390 HydrophobicContact CE1-CG2 3.91Å; F386-V390 HydrophobicContact CE2-CG2 3.54Å; F386-V390 HydrophobicContact CG-CG2 4.32Å; F386-V390 HydrophobicContact CZ-CG2 3.53Å; F386-V390 WeakPolarHBondContact O-CB 3.35Å; F386-V390 VanDerWaalsContact O-CG2 3.26Å; F386-V390 WeakPolarHBondContact O-CG2 3.34Å; F386-V390 PolarHBondContact O-N 2.81Å; F386-V483 HydrophobicContact CD2-CB 4.11Å; F386-V483 HydrophobicContact CD2-CG1 3.85Å; F386-V483 HydrophobicContact CE2-CB 4.14Å; F386-V483 HydrophobicContact CE2-CG1 3.57Å; F386-V483 HydrophobicContact CZ-CG1 4.19Å; F386-H484 HydrophobicContact CD2-CB 4.28Å; F386-H484 HydrophobicContact CE2-CB 4.12Å
387	R	86.9	Confident	82.8	Confident	161 Å²	161	58.6 Å²	58.6	61%	0.608	28%	0.281	S	S	*	.	H	α-helix	trans	-60	-41.5	178	-175.5	176.9	172.7	159.5	0.1	112.1	Y161 V383 F384 M385 R391	Y161-R387 HydrophobicContact CE1-CG 4.29Å; V383-R387 WeakPolarHBondContact O-CB 3.01Å; V383-R387 PolarHBondContact O-N 3.17Å; F384-R387 PolarHBondContact O-N 2.84Å; M385-R387 PolarHBondContact O-N 2.97Å; R387-R391 WeakPolarHBondContact O-CB 3.15Å; R387-R391 PolarHBondContact O-N 2.93Å
388	R	88.6	Confident	83.6	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.015	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-49.5	175.6	-178.6	-175.5	177	-168.7	-8.7	111.2	L150 L153 Y161 F384 M385 F386 R391 N392 E466	L150-R388 HydrophobicContact CD1-CG 3.79Å; L153-R388 HydrophobicContact CD1-CG 3.89Å; Y161-R388 HydrophobicContact CD1-CB 3.97Å; Y161-R388 HydrophobicContact CD1-CG 4.47Å; Y161-R388 HydrophobicContact CD2-CB 4.09Å; Y161-R388 HydrophobicContact CD2-CG 3.81Å; Y161-R388 HydrophobicContact CE1-CB 4.14Å; Y161-R388 HydrophobicContact CE2-CB 4.26Å; Y161-R388 HydrophobicContact CE2-CG 4.27Å; Y161-R388 HydrophobicContact CG-CB 3.96Å; Y161-R388 HydrophobicContact CG-CG 3.94Å; F384-R388 WeakPolarHBondContact O-CB 3.33Å; F384-R388 PolarHBondContact O-N 3.35Å; M385-R388 WeakPolarHBondContact O-CB 3.26Å; M385-R388 PolarHBondContact O-N 3.37Å; F386-R388 VanDerWaalsContact C-N 3.32Å; F386-R388 PolarHBondContact O-N 3.29Å; R388-R391 PolarHBondContact O-N 3.22Å; R388-N392 WeakPolarHBondContact O-CB 3.37Å; R388-N392 PolarHBondContact O-N 3.18Å; R388-E466 IonicContact CZ-OE1 3.51Å; R388-E466 VanDerWaalsContact CZ-OE1 3.24Å; R388-E466 IonicContact CZ-OE2 3.88Å; R388-E466 IonicContact NH1-OE1 3.52Å; R388-E466 PolarHBondContact NH1-OE1 3.46Å; R388-E466 IonicContact NH1-OE2 3.81Å; R388-E466 PolarHBondContact NH1-OE2 3.41Å; R388-E466 IonicContact NH2-OE1 3.03Å; R388-E466 PolarHBondContact NH2-OE1 3.29Å; R388-E466 IonicContact NH2-OE2 2.91Å
389	T	84.9	Confident	84.1	Confident	15 Å²	15	59 Å²	59	9%	0.092	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-44.5	-179.2	-57.4	0	0	0	0	112	M385 F386 R391 N392 L393 L459 H484	M385-T389 PolarHBondContact O-N 3.29Å; M385-T389 PolarHBondContact O-OG1 3.38Å; F386-T389 PolarHBondContact O-N 3.31Å; T389-R391 VanDerWaalsContact C-N 3.32Å; T389-R391 PolarHBondContact O-N 2.88Å; T389-N392 PolarHBondContact O-N 2.59Å; T389-L393 PolarHBondContact O-N 3.31Å; T389-L459 HydrophobicContact CG2-CD2 3.98Å; T389-H484 HydrophobicContact CG2-CB 4.38Å
390	V	87.1	Confident	84.8	Confident	50 Å²	50	55.3 Å²	55.3	30%	0.303	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-44.1	175.4	170.4	0	0	0	0	110.9	F386 L393 S394 H484	F386-V390 HydrophobicContact CD1-CG2 4.29Å; F386-V390 HydrophobicContact CD2-CG2 3.96Å; F386-V390 HydrophobicContact CE1-CG2 3.91Å; F386-V390 HydrophobicContact CE2-CG2 3.54Å; F386-V390 HydrophobicContact CG-CG2 4.32Å; F386-V390 HydrophobicContact CZ-CG2 3.53Å; F386-V390 WeakPolarHBondContact O-CB 3.35Å; F386-V390 VanDerWaalsContact O-CG2 3.26Å; F386-V390 WeakPolarHBondContact O-CG2 3.34Å; F386-V390 PolarHBondContact O-N 2.81Å; V390-L393 PolarHBondContact O-N 2.96Å; V390-S394 WeakPolarHBondContact O-CB 3.49Å; V390-S394 PolarHBondContact O-N 2.66Å; V390-S394 PolarHBondContact O-OG 2.71Å; V390-H484 WeakPolarHBondContact CG2-ND1 3.47Å
391	R	88.3	Confident	85.3	Confident	100 Å²	100	59.5 Å²	59.5	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-40.4	179.3	-168.2	164	-177	99.4	-10.5	111.9	L153 E157 Y161 R387 R388 T389 S394 R395	L153-R391 HydrophobicContact CD2-CB 4.33Å; L153-R391 HydrophobicContact CD2-CG 4.15Å; E157-R391 IonicContact OE1-CZ 3.82Å; E157-R391 IonicContact OE1-NE 3.73Å; E157-R391 PolarHBondContact OE1-NE 2.71Å; E157-R391 IonicContact OE1-NH2 2.66Å; E157-R391 PolarHBondContact OE1-NH2 3.35Å; E157-R391 IonicContact OE2-NE 2.75Å; Y161-R391 WeakPolarHBondContact OH-CD 3.42Å; R387-R391 WeakPolarHBondContact O-CB 3.15Å; R387-R391 PolarHBondContact O-N 2.93Å; R388-R391 PolarHBondContact O-N 3.22Å; T389-R391 VanDerWaalsContact C-N 3.32Å; T389-R391 PolarHBondContact O-N 2.88Å; R391-S394 PolarHBondContact O-N 3.25Å; R391-S394 PolarHBondContact O-OG 2.72Å; R391-R395 PolarHBondContact O-N 3.24Å
392	N	87.1	Confident	85.7	Confident	9 Å²	9	62.7 Å²	62.7	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-50.7	174.8	-174	70.6	0	0	0	111.4	L150 Y152 L153 R388 T389 S394 R395 D396	L150-N392 HydrophobicContact CD1-CB 4.37Å; Y152-N392 WeakPolarHBondContact CB-OD1 3.43Å; L153-N392 HydrophobicContact CD2-CB 4.33Å; L153-N392 HydrophobicContact CG-CB 4.48Å; R388-N392 WeakPolarHBondContact O-CB 3.37Å; R388-N392 PolarHBondContact O-N 3.18Å; T389-N392 PolarHBondContact O-N 2.59Å; N392-S394 PolarHBondContact O-N 3.18Å; N392-R395 PolarHBondContact O-N 3.05Å; N392-D396 PolarHBondContact O-N 3.33Å
393	L	83	Confident	86	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-37.6	179.1	-168.4	75.5	0	0	0	112.2	T389 V390 R395 D396 V400 L455 H484 F488	T389-L393 PolarHBondContact O-N 3.31Å; V390-L393 PolarHBondContact O-N 2.96Å; L393-R395 PolarHBondContact O-N 3.17Å; L393-D396 HydrophobicContact CD1-CB 4.38Å; L393-D396 WeakPolarHBondContact O-CA 3.18Å; L393-D396 WeakPolarHBondContact O-CB 3.35Å; L393-D396 PolarHBondContact O-N 3.08Å; L393-V400 HydrophobicContact CD1-CG2 4.37Å; L393-V400 HydrophobicContact CD2-CG2 4.09Å; L393-V400 HydrophobicContact CG-CG2 3.79Å; L393-V400 WeakPolarHBondContact O-CG2 3.35Å; L393-L455 HydrophobicContact CD1-CD1 4.21Å; L393-L455 HydrophobicContact CD1-CD2 3.86Å; L393-H484 VanDerWaalsContact CB-CE1 3.48Å; L393-H484 WeakPolarHBondContact CB-CE1 3.48Å; L393-H484 WeakPolarHBondContact CB-NE2 3.32Å; L393-H484 WeakPolarHBondContact CD2-CE1 3.17Å; L393-H484 WeakPolarHBondContact CD2-NE2 3.31Å; L393-F488 HydrophobicContact CD2-CD2 4.03Å; L393-F488 HydrophobicContact CD2-CE1 4.36Å; L393-F488 HydrophobicContact CD2-CE2 3.74Å; L393-F488 HydrophobicContact CD2-CG 4.48Å; L393-F488 HydrophobicContact CD2-CZ 3.91Å
394	S	84.9	Confident	86.2	Confident	74 Å²	74	59.6 Å²	59.6	52%	0.517	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-25.7	179.7	73	0	0	0	0	113.6	V390 R391 N392	V390-S394 WeakPolarHBondContact O-CB 3.49Å; V390-S394 PolarHBondContact O-N 2.66Å; V390-S394 PolarHBondContact O-OG 2.71Å; R391-S394 PolarHBondContact O-N 3.25Å; R391-S394 PolarHBondContact O-OG 2.72Å; N392-S394 PolarHBondContact O-N 3.18Å
395	R	87.6	Confident	86.5	Confident	81 Å²	81	58.2 Å²	58.2	31%	0.306	28%	0.277	S	S	.	.	H	α-helix	trans	-93.4	-19.5	176.1	-70.8	-178.1	175.5	161.9	5.2	113.2	Y152 E157 R391 N392 L393 R397	Y152-R395 WeakPolarHBondContact O-CD 3.25Å; Y152-R395 PolarHBondContact O-NH1 3.48Å; E157-R395 IonicContact OE1-CZ 3.19Å; E157-R395 IonicContact OE1-NH1 2.83Å; E157-R395 IonicContact OE1-NH2 2.75Å; E157-R395 PolarHBondContact OE1-NH2 2.96Å; E157-R395 IonicContact OE2-CZ 3.82Å; E157-R395 IonicContact OE2-NH1 2.69Å; E157-R395 PolarHBondContact OE2-NH1 3.05Å; E157-R395 IonicContact OE2-NH2 3.71Å; E157-R395 PolarHBondContact OE2-NH2 2.83Å; R391-R395 PolarHBondContact O-N 3.24Å; N392-R395 PolarHBondContact O-N 3.05Å; L393-R395 PolarHBondContact O-N 3.17Å; R395-R397 VanDerWaalsContact C-N 3.26Å; R395-R397 PolarHBondContact O-N 2.8Å
396	D	85.9	Confident	86.8	Confident	16 Å²	16	59.1 Å²	59.1	9%	0.086	28%	0.282	C	S	.	.			trans	-77	74.8	171.3	-171.3	3.9	0	0	0	110.9	Y152 N392 L393 I398 G399 V400	Y152-D396 HydrophobicContact CD1-CB 4.48Å; Y152-D396 HydrophobicContact CD2-CB 3.85Å; Y152-D396 HydrophobicContact CE1-CB 4.19Å; Y152-D396 HydrophobicContact CE2-CB 3.48Å; Y152-D396 VanDerWaalsContact CE2-CB 3.48Å; Y152-D396 HydrophobicContact CG-CB 4.32Å; Y152-D396 VanDerWaalsContact CZ-CG 3.4Å; Y152-D396 VanDerWaalsContact OH-CG 3.26Å; Y152-D396 PolarHBondContact OH-OD1 2.87Å; N392-D396 PolarHBondContact O-N 3.33Å; L393-D396 HydrophobicContact CD1-CB 4.38Å; L393-D396 WeakPolarHBondContact O-CA 3.18Å; L393-D396 WeakPolarHBondContact O-CB 3.35Å; L393-D396 PolarHBondContact O-N 3.08Å; D396-I398 PolarHBondContact O-N 3.11Å; D396-G399 PolarHBondContact O-N 3.48Å; D396-G399 PolarHBondContact OD1-N 2.88Å; D396-V400 WeakPolarHBondContact O-CG2 3.1Å; D396-V400 PolarHBondContact O-N 3.19Å
397	R	86	Confident	87	Confident	200 Å²	200	55.9 Å²	55.9	76%	0.755	27%	0.268	S	S	*	.	H	α-helix	trans	-56.9	-37.9	179.1	-66.1	-177.4	-177.8	171.6	0.7	111.9	R395 I401	R395-R397 VanDerWaalsContact C-N 3.26Å; R395-R397 PolarHBondContact O-N 2.8Å; R397-I401 WeakPolarHBondContact O-CB 3.45Å; R397-I401 WeakPolarHBondContact O-CD1 3.36Å; R397-I401 WeakPolarHBondContact O-CG1 3.15Å; R397-I401 PolarHBondContact O-N 2.91Å
398	I	85.2	Confident	87.2	Confident	119 Å²	119	50.4 Å²	50.4	61%	0.61	25%	0.25	S	S	*	.	H	α-helix	trans	-65.9	-49	-179.4	-61.8	171.4	0	0	0	109.5	D396 V400 I401 M402	D396-I398 PolarHBondContact O-N 3.11Å; I398-V400 PolarHBondContact O-N 3.44Å; I398-I401 PolarHBondContact O-N 3.08Å; I398-M402 VanDerWaalsContact O-CB 3.26Å; I398-M402 WeakPolarHBondContact O-CB 3.33Å; I398-M402 PolarHBondContact O-N 3.5Å
399	G	84	Confident	87.3	Confident	14 Å²	14	55.3 Å²	55.3	14%	0.144	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-45.3	177.1	0	0	0	0	0	113.1	D396 M402 R403	D396-G399 PolarHBondContact O-N 3.48Å; D396-G399 PolarHBondContact OD1-N 2.88Å; G399-M402 PolarHBondContact O-N 3.19Å; G399-R403 VanDerWaalsContact O-CG 3.31Å; G399-R403 WeakPolarHBondContact O-CG 3.46Å; G399-R403 PolarHBondContact O-N 3.33Å
400	V	88.5	Confident	87.6	Confident	29 Å²	29	56.6 Å²	56.6	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-46.1	178.6	175.5	0	0	0	0	111.6	L393 D396 I398 M402 R403 L404 F488	L393-V400 HydrophobicContact CD1-CG2 4.37Å; L393-V400 HydrophobicContact CD2-CG2 4.09Å; L393-V400 HydrophobicContact CG-CG2 3.79Å; L393-V400 WeakPolarHBondContact O-CG2 3.35Å; D396-V400 WeakPolarHBondContact O-CG2 3.1Å; D396-V400 PolarHBondContact O-N 3.19Å; I398-V400 PolarHBondContact O-N 3.44Å; V400-M402 VanDerWaalsContact C-N 3.34Å; V400-M402 PolarHBondContact O-N 3.19Å; V400-R403 PolarHBondContact O-N 2.84Å; V400-L404 HydrophobicContact CG1-CD1 3.93Å; V400-L404 HydrophobicContact CG1-CG 4.48Å; V400-L404 WeakPolarHBondContact O-CG 3.44Å; V400-L404 PolarHBondContact O-N 3.45Å; V400-L404 VanDerWaalsContact O-N 3.1Å; V400-F488 HydrophobicContact CG1-CE1 4.21Å; V400-F488 HydrophobicContact CG2-CE1 4.39Å
401	I	89.3	Confident	87.7	Confident	112 Å²	112	54.2 Å²	54.2	57%	0.574	26%	0.264	S	S	*	.	H	α-helix	trans	-60.8	-45.8	178	-71.2	167.2	0	0	0	110.1	R397 I398 R403 L404 S405	R397-I401 WeakPolarHBondContact O-CB 3.45Å; R397-I401 WeakPolarHBondContact O-CD1 3.36Å; R397-I401 WeakPolarHBondContact O-CG1 3.15Å; R397-I401 PolarHBondContact O-N 2.91Å; I398-I401 PolarHBondContact O-N 3.08Å; I401-R403 VanDerWaalsContact C-N 3.33Å; I401-R403 PolarHBondContact O-N 3.48Å; I401-L404 PolarHBondContact O-N 2.9Å; I401-S405 WeakPolarHBondContact O-CB 3.42Å; I401-S405 PolarHBondContact O-N 3.02Å; I401-S405 PolarHBondContact O-OG 3.31Å
402	M	86.6	Confident	87.8	Confident	72 Å²	72	54.6 Å²	54.6	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-57.1	-44.8	177.5	-165.1	-131.9	-179.6	0	0	111.2	I398 G399 V400 Q406	I398-M402 VanDerWaalsContact O-CB 3.26Å; I398-M402 WeakPolarHBondContact O-CB 3.33Å; I398-M402 PolarHBondContact O-N 3.5Å; G399-M402 PolarHBondContact O-N 3.19Å; V400-M402 VanDerWaalsContact C-N 3.34Å; V400-M402 PolarHBondContact O-N 3.19Å; M402-Q406 WeakPolarHBondContact O-CG 3.36Å; M402-Q406 PolarHBondContact O-N 2.97Å; M402-Q406 PolarHBondContact O-NE2 3.32Å; M402-Q406 VanDerWaalsContact O-NE2 3.12Å; M402-Q406 PolarHBondContact SD-NE2 3.13Å
403	R	87.9	Confident	88	Confident	8 Å²	8	60 Å²	60	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-38.2	-179.9	-70.2	178.8	73.4	92.4	9.8	114.1	G399 V400 I401 N451 S489 S492 E528	G399-R403 VanDerWaalsContact O-CG 3.31Å; G399-R403 WeakPolarHBondContact O-CG 3.46Å; G399-R403 PolarHBondContact O-N 3.33Å; V400-R403 PolarHBondContact O-N 2.84Å; I401-R403 VanDerWaalsContact C-N 3.33Å; I401-R403 PolarHBondContact O-N 3.48Å; R403-N451 HydrophobicContact CG-CB 4.44Å; R403-S489 PolarHBondContact NH2-OG 3.05Å; R403-S492 PolarHBondContact O-OG 3.27Å; R403-E528 IonicContact CZ-OE1 3.79Å; R403-E528 IonicContact NH1-OE1 2.96Å; R403-E528 PolarHBondContact NH1-OE1 3.49Å; R403-E528 VanDerWaalsContact NH2-CD 3.3Å; R403-E528 IonicContact NH2-OE1 2.86Å; R403-E528 PolarHBondContact NH2-OE1 3.07Å; R403-E528 IonicContact NH2-OE2 3.69Å; R403-E528 PolarHBondContact NH2-OE2 3.37Å
404	L	88.6	Confident	88.2	Confident	44 Å²	44	60.4 Å²	60.4	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-82.6	-32.8	-178.2	-65.3	177.3	0	0	0	112.3	V400 I401 L491	V400-L404 HydrophobicContact CG1-CD1 3.93Å; V400-L404 HydrophobicContact CG1-CG 4.48Å; V400-L404 WeakPolarHBondContact O-CG 3.44Å; V400-L404 PolarHBondContact O-N 3.45Å; V400-L404 VanDerWaalsContact O-N 3.1Å; I401-L404 PolarHBondContact O-N 2.9Å; L404-L491 HydrophobicContact CD2-CB 4.37Å; L404-L491 HydrophobicContact CD2-CD2 4.03Å; L404-L491 HydrophobicContact CD2-CG 4.16Å
405	S	88.8	Confident	88.4	Confident	35 Å²	35	57.3 Å²	57.3	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-82.6	-32.8	-175.5	58.7	0	0	0	0	114	I401 N407 L408 I409	I401-S405 WeakPolarHBondContact O-CB 3.42Å; I401-S405 PolarHBondContact O-N 3.02Å; I401-S405 PolarHBondContact O-OG 3.31Å; S405-N407 PolarHBondContact O-N 2.85Å; S405-L408 PolarHBondContact O-N 2.83Å; S405-L408 VanDerWaalsContact O-N 3.11Å; S405-I409 VanDerWaalsContact O-CG1 3.29Å; S405-I409 WeakPolarHBondContact O-CG1 3.46Å; S405-I409 PolarHBondContact O-N 3.25Å
406	Q	89.4	Confident	88.4	Confident	25 Å²	25	60.9 Å²	60.9	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-55.6	-50.5	-173.5	-82.3	169.6	44.3	0	0	113.9	M402 L408 I409 Y410 N451	M402-Q406 WeakPolarHBondContact O-CG 3.36Å; M402-Q406 PolarHBondContact O-N 2.97Å; M402-Q406 PolarHBondContact O-NE2 3.32Å; M402-Q406 VanDerWaalsContact O-NE2 3.12Å; M402-Q406 PolarHBondContact SD-NE2 3.13Å; Q406-L408 VanDerWaalsContact C-N 3.28Å; Q406-L408 PolarHBondContact O-N 3.4Å; Q406-I409 PolarHBondContact O-N 3.35Å; Q406-Y410 WeakPolarHBondContact O-CB 3.5Å; Q406-Y410 PolarHBondContact O-N 2.93Å; Q406-N451 PolarHBondContact NE2-OD1 3.03Å; Q406-N451 PolarHBondContact OE1-OD1 3.03Å
407	N	89.1	Confident	88.4	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-41	178.9	-76.2	-25.9	0	0	0	110.7	S405 Y410 G411 T447 S492 F496 H524	S405-N407 PolarHBondContact O-N 2.85Å; N407-Y410 PolarHBondContact O-N 3.3Å; N407-G411 PolarHBondContact O-N 3.34Å; N407-T447 WeakPolarHBondContact OD1-CB 3.39Å; N407-T447 VanDerWaalsContact OD1-CG2 3.27Å; N407-T447 WeakPolarHBondContact OD1-CG2 3.35Å; N407-T447 PolarHBondContact OD1-OG1 2.96Å; N407-S492 PolarHBondContact ND2-OG 2.89Å; N407-F496 HydrophobicContact CB-CB 3.84Å; N407-F496 HydrophobicContact CB-CG 4.21Å; N407-F496 WeakPolarHBondContact O-CD2 3.14Å; N407-H524 PolarHBondContact ND2-CE1 2.98Å
408	L	90.1	Very high	88.2	Confident	46 Å²	46	59.1 Å²	59.1	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-43.9	179.1	-178.2	62.7	0	0	0	112.5	S405 Q406 Y410 G411 F412 I495 F499	S405-L408 PolarHBondContact O-N 2.83Å; S405-L408 VanDerWaalsContact O-N 3.11Å; Q406-L408 VanDerWaalsContact C-N 3.28Å; Q406-L408 PolarHBondContact O-N 3.4Å; L408-Y410 PolarHBondContact O-N 2.69Å; L408-G411 CarbonylContact O-C 3.28Å; L408-G411 WeakPolarHBondContact O-CA 3.4Å; L408-G411 PolarHBondContact O-N 3.25Å; L408-G411 VanDerWaalsContact O-N 3.07Å; L408-F412 HydrophobicContact CD1-CD2 4.09Å; L408-F412 HydrophobicContact CD1-CE2 3.72Å; L408-F412 HydrophobicContact CD1-CZ 4.42Å; L408-F412 HydrophobicContact CD2-CE2 3.93Å; L408-F412 HydrophobicContact CG-CD2 3.84Å; L408-F412 HydrophobicContact CG-CE2 3.55Å; L408-F412 VanDerWaalsContact O-CD2 3.25Å; L408-F412 WeakPolarHBondContact O-CD2 3.31Å; L408-F412 PolarHBondContact O-N 3.37Å; L408-I495 HydrophobicContact CD1-CG2 4.25Å; L408-I495 HydrophobicContact CD2-CG2 4.26Å; L408-F499 HydrophobicContact CD1-CB 3.95Å; L408-F499 HydrophobicContact CD1-CD1 4.14Å; L408-F499 HydrophobicContact CD1-CD2 4.42Å; L408-F499 HydrophobicContact CD1-CG 3.89Å
409	I	91.8	Very high	87.8	Confident	107 Å²	107	59.3 Å²	59.3	55%	0.549	29%	0.293	S	S	.	.	H	α-helix	trans	-57.8	-43.4	175.3	-69.6	163.8	0	0	0	109.8	S405 Q406 F412 F413	S405-I409 VanDerWaalsContact O-CG1 3.29Å; S405-I409 WeakPolarHBondContact O-CG1 3.46Å; S405-I409 PolarHBondContact O-N 3.25Å; Q406-I409 PolarHBondContact O-N 3.35Å; I409-F412 PolarHBondContact O-N 3.28Å; I409-F413 PolarHBondContact O-N 3.03Å
410	Y	89.6	Confident	87.7	Confident	41 Å²	41	64.5 Å²	64.5	16%	0.161	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-40.3	175.4	178.3	-99.5	0	0	0	112.2	Q406 N407 L408 F413 V414 Q439 A443 F496	Q406-Y410 WeakPolarHBondContact O-CB 3.5Å; Q406-Y410 PolarHBondContact O-N 2.93Å; N407-Y410 PolarHBondContact O-N 3.3Å; L408-Y410 PolarHBondContact O-N 2.69Å; Y410-F413 WeakPolarHBondContact O-CB 3.37Å; Y410-F413 PolarHBondContact O-N 3.29Å; Y410-V414 HydrophobicContact CD1-CG2 4.47Å; Y410-V414 HydrophobicContact CE1-CG2 3.75Å; Y410-V414 HydrophobicContact CE2-CG2 3.97Å; Y410-V414 VanDerWaalsContact CZ-CG2 3.43Å; Y410-V414 WeakPolarHBondContact O-CG2 3.49Å; Y410-V414 PolarHBondContact O-N 3.46Å; Y410-V414 VanDerWaalsContact OH-CG2 3.28Å; Y410-V414 WeakPolarHBondContact OH-CG2 3.41Å; Y410-Q439 WeakPolarHBondContact OH-CB 3.26Å; Y410-Q439 WeakPolarHBondContact OH-CG 3.43Å; Y410-Q439 PolarHBondContact OH-NE2 3.14Å; Y410-Q439 PolarHBondContact OH-O 2.99Å; Y410-A443 HydrophobicContact CD1-CB 3.7Å; Y410-A443 HydrophobicContact CD2-CB 4.21Å; Y410-A443 HydrophobicContact CE1-CB 3.16Å; Y410-A443 HydrophobicContact CE2-CB 3.75Å; Y410-A443 HydrophobicContact CG-CB 4.2Å; Y410-F496 HydrophobicContact CD1-CE2 4.06Å; Y410-F496 HydrophobicContact CD1-CZ 4.37Å
411	G	89.4	Confident	87.1	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-43.7	172.1	0	0	0	0	0	113.4	N407 L408 F413 V414 A415	N407-G411 PolarHBondContact O-N 3.34Å; L408-G411 CarbonylContact O-C 3.28Å; L408-G411 WeakPolarHBondContact O-CA 3.4Å; L408-G411 PolarHBondContact O-N 3.25Å; L408-G411 VanDerWaalsContact O-N 3.07Å; G411-F413 VanDerWaalsContact C-N 3.31Å; G411-F413 PolarHBondContact O-N 3.06Å; G411-V414 PolarHBondContact O-N 3.39Å; G411-A415 VanDerWaalsContact O-CB 3.23Å; G411-A415 WeakPolarHBondContact O-CB 3.32Å; G411-A415 PolarHBondContact O-N 3.49Å
412	F	91.4	Very high	86.3	Confident	108 Å²	108	59.5 Å²	59.5	47%	0.474	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-42.7	172.7	-82.2	-66.7	0	0	0	111.9	L408 I409 A415 F416 F499	L408-F412 HydrophobicContact CD1-CD2 4.09Å; L408-F412 HydrophobicContact CD1-CE2 3.72Å; L408-F412 HydrophobicContact CD1-CZ 4.42Å; L408-F412 HydrophobicContact CD2-CE2 3.93Å; L408-F412 HydrophobicContact CG-CD2 3.84Å; L408-F412 HydrophobicContact CG-CE2 3.55Å; L408-F412 VanDerWaalsContact O-CD2 3.25Å; L408-F412 WeakPolarHBondContact O-CD2 3.31Å; L408-F412 PolarHBondContact O-N 3.37Å; I409-F412 PolarHBondContact O-N 3.28Å; F412-A415 PolarHBondContact O-N 3.4Å; F412-F416 VanDerWaalsContact O-CB 3.3Å; F412-F416 WeakPolarHBondContact O-CB 3.39Å; F412-F416 PolarHBondContact O-N 2.89Å; F412-F499 AromaticContact CD1-CE1 3.73Å; F412-F499 HydrophobicContact CD1-CE1 3.73Å; F412-F499 AromaticContact CD1-CE2 3.98Å; F412-F499 HydrophobicContact CD1-CE2 3.98Å; F412-F499 AromaticContact CD1-CZ 3.24Å; F412-F499 HydrophobicContact CD1-CZ 3.24Å; F412-F499 HydrophobicContact CE1-CD2 4.38Å; F412-F499 HydrophobicContact CE1-CE1 4.01Å; F412-F499 AromaticContact CE1-CE2 3.39Å; F412-F499 HydrophobicContact CE1-CE2 3.39Å; F412-F499 AromaticContact CE1-CZ 3.17Å; F412-F499 HydrophobicContact CE1-CZ 3.17Å; F412-F499 HydrophobicContact CG-CE1 4.04Å; F412-F499 HydrophobicContact CG-CZ 4.01Å; F412-F499 HydrophobicContact CZ-CD2 4.38Å; F412-F499 AromaticContact CZ-CE2 3.79Å; F412-F499 HydrophobicContact CZ-CE2 3.79Å; F412-F499 AromaticContact CZ-CZ 3.9Å; F412-F499 HydrophobicContact CZ-CZ 3.9Å
413	F	90.7	Very high	85.3	Confident	123 Å²	123	59.3 Å²	59.3	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-49.8	177.2	-178.6	-96.7	0	0	0	111.1	I409 Y410 G411 F416 F417	I409-F413 PolarHBondContact O-N 3.03Å; Y410-F413 WeakPolarHBondContact O-CB 3.37Å; Y410-F413 PolarHBondContact O-N 3.29Å; G411-F413 VanDerWaalsContact C-N 3.31Å; G411-F413 PolarHBondContact O-N 3.06Å; F413-F416 PolarHBondContact O-N 3.23Å; F413-F417 HydrophobicContact CD1-CD2 4.49Å; F413-F417 HydrophobicContact CD1-CE2 4.42Å; F413-F417 HydrophobicContact CD2-CE2 4.01Å; F413-F417 HydrophobicContact CE1-CD2 4.26Å; F413-F417 AromaticContact CE1-CE2 3.98Å; F413-F417 HydrophobicContact CE1-CE2 3.98Å; F413-F417 HydrophobicContact CE2-CD2 4.46Å; F413-F417 AromaticContact CE2-CE2 3.54Å; F413-F417 HydrophobicContact CE2-CE2 3.54Å; F413-F417 HydrophobicContact CE2-CZ 4.32Å; F413-F417 HydrophobicContact CG-CE2 4.44Å; F413-F417 HydrophobicContact CZ-CD2 4.24Å; F413-F417 AromaticContact CZ-CE2 3.51Å; F413-F417 HydrophobicContact CZ-CE2 3.51Å; F413-F417 HydrophobicContact CZ-CZ 4.29Å; F413-F417 VanDerWaalsContact O-CD2 3.22Å; F413-F417 WeakPolarHBondContact O-CD2 3.38Å
414	V	88.4	Confident	84.1	Confident	10 Å²	10	60.8 Å²	60.8	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-45.2	178.2	176.8	0	0	0	0	111.8	Y410 G411 F416 F417 V418 Q439 I500	Y410-V414 HydrophobicContact CD1-CG2 4.47Å; Y410-V414 HydrophobicContact CE1-CG2 3.75Å; Y410-V414 HydrophobicContact CE2-CG2 3.97Å; Y410-V414 VanDerWaalsContact CZ-CG2 3.43Å; Y410-V414 WeakPolarHBondContact O-CG2 3.49Å; Y410-V414 PolarHBondContact O-N 3.46Å; Y410-V414 VanDerWaalsContact OH-CG2 3.28Å; Y410-V414 WeakPolarHBondContact OH-CG2 3.41Å; G411-V414 PolarHBondContact O-N 3.39Å; V414-F416 VanDerWaalsContact C-N 3.26Å; V414-F416 PolarHBondContact O-N 3.27Å; V414-F417 PolarHBondContact O-N 2.94Å; V414-V418 HydrophobicContact CG1-CG2 4.22Å; V414-V418 PolarHBondContact O-N 2.86Å; V414-Q439 HydrophobicContact CG2-CG 4.36Å; V414-I500 HydrophobicContact CB-CD1 4.18Å; V414-I500 HydrophobicContact CG1-CD1 4.14Å
415	A	87.8	Confident	83	Confident	9 Å²	9	60.2 Å²	60.2	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-34.6	179.5	0	0	0	0	0	112.3	G411 F412 F417 I419 F499 I500 T503	G411-A415 VanDerWaalsContact O-CB 3.23Å; G411-A415 WeakPolarHBondContact O-CB 3.32Å; G411-A415 PolarHBondContact O-N 3.49Å; F412-A415 PolarHBondContact O-N 3.4Å; A415-F417 VanDerWaalsContact C-N 3.34Å; A415-F417 PolarHBondContact O-N 3.42Å; A415-I419 VanDerWaalsContact O-CA 3.31Å; A415-I419 WeakPolarHBondContact O-CA 3.42Å; A415-I419 PolarHBondContact O-N 3.32Å; A415-F499 HydrophobicContact CB-CE1 3.87Å; A415-F499 HydrophobicContact CB-CZ 4.3Å; A415-I500 HydrophobicContact CB-CD1 4.07Å; A415-T503 HydrophobicContact CB-CG2 4Å
416	F	88.6	Confident	81.7	Confident	156 Å²	156	63.3 Å²	63.3	68%	0.684	32%	0.315	S	S	*	.	H	α-helix	trans	-62.7	-38.3	177	178.4	-98.5	0	0	0	112.7	F412 F413 V414 I419	F412-F416 VanDerWaalsContact O-CB 3.3Å; F412-F416 WeakPolarHBondContact O-CB 3.39Å; F412-F416 PolarHBondContact O-N 2.89Å; F413-F416 PolarHBondContact O-N 3.23Å; V414-F416 VanDerWaalsContact C-N 3.26Å; V414-F416 PolarHBondContact O-N 3.27Å; F416-I419 WeakPolarHBondContact O-CG1 3.45Å
417	F	85.3	Confident	80.5	Confident	139 Å²	139	68.9 Å²	68.9	61%	0.61	34%	0.339	S	S	*	.	H	α-helix	trans	-80.4	-38.2	178.9	-75.1	-78.8	0	0	0	113.1	F413 V414 A415	F413-F417 HydrophobicContact CD1-CD2 4.49Å; F413-F417 HydrophobicContact CD1-CE2 4.42Å; F413-F417 HydrophobicContact CD2-CE2 4.01Å; F413-F417 HydrophobicContact CE1-CD2 4.26Å; F413-F417 AromaticContact CE1-CE2 3.98Å; F413-F417 HydrophobicContact CE1-CE2 3.98Å; F413-F417 HydrophobicContact CE2-CD2 4.46Å; F413-F417 AromaticContact CE2-CE2 3.54Å; F413-F417 HydrophobicContact CE2-CE2 3.54Å; F413-F417 HydrophobicContact CE2-CZ 4.32Å; F413-F417 HydrophobicContact CG-CE2 4.44Å; F413-F417 HydrophobicContact CZ-CD2 4.24Å; F413-F417 AromaticContact CZ-CE2 3.51Å; F413-F417 HydrophobicContact CZ-CE2 3.51Å; F413-F417 HydrophobicContact CZ-CZ 4.29Å; F413-F417 VanDerWaalsContact O-CD2 3.22Å; F413-F417 WeakPolarHBondContact O-CD2 3.38Å; V414-F417 PolarHBondContact O-N 2.94Å; A415-F417 VanDerWaalsContact C-N 3.34Å; A415-F417 PolarHBondContact O-N 3.42Å
418	V	81.1	Confident	79.7	Confident	40 Å²	40	69.8 Å²	69.8	24%	0.242	35%	0.349	C	S	.	.	H	α-helix	trans	-86.8	-30.1	-173.5	179.9	0	0	0	0	112.1	V414 H420 L421 V504	V414-V418 HydrophobicContact CG1-CG2 4.22Å; V414-V418 PolarHBondContact O-N 2.86Å; V418-H420 PolarHBondContact O-N 3.19Å; V418-L421 HydrophobicContact CG1-CD1 3.23Å; V418-V504 HydrophobicContact CG1-CG1 3.83Å
419	I	78.4	Confident	79.1	Confident	123 Å²	123	67.6 Å²	67.6	63%	0.631	34%	0.338	S	S	*	.			trans	56	-71.8	-178.6	-57.6	177.4	0	0	0	113.2	A415 F416	A415-I419 VanDerWaalsContact O-CA 3.31Å; A415-I419 WeakPolarHBondContact O-CA 3.42Å; A415-I419 PolarHBondContact O-N 3.32Å; F416-I419 WeakPolarHBondContact O-CG1 3.45Å
420	H	80.3	Confident	78.5	Confident	123 Å²	123	63.9 Å²	63.9	57%	0.569	32%	0.32	S	S	*	.	S	Bend	trans	-152.3	137.8	177.5	-165.2	-64.8	0	0	0	110.4	V418 A422	V418-H420 PolarHBondContact O-N 3.19Å; H420-A422 PolarHBondContact O-N 3.03Å
421	L	77	Confident	78.2	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	34%	0.344	C	S	.	.			trans	-71.5	118.4	177.4	-90.3	40.3	0	0	0	109.6	V418 R433 M436 V504	V418-L421 HydrophobicContact CG1-CD1 3.23Å; L421-R433 HydrophobicContact CD2-CB 4.43Å; L421-R433 HydrophobicContact CD2-CG 3.29Å; L421-R433 HydrophobicContact CG-CG 3.85Å; L421-M436 HydrophobicContact CD2-CE 3.83Å; L421-M436 HydrophobicContact CD2-SD 4.44Å; L421-V504 HydrophobicContact CD1-CB 4.5Å; L421-V504 HydrophobicContact CD1-CG1 3.09Å; L421-V504 HydrophobicContact CD2-CG1 3.92Å; L421-V504 HydrophobicContact CG-CG1 4.08Å; L421-V504 PolarHBondContact N-O 3.24Å
422	A	72.6	Confident	78	Confident	33 Å²	33	71.9 Å²	71.9	27%	0.273	36%	0.361	S	S	.	.			trans	-71.8	155	167.5	0	0	0	0	0	110.1	H420 A429	H420-A422 PolarHBondContact O-N 3.03Å; A422-A429 WeakPolarHBondContact O-CB 3.43Å
423	M	65.3	Low	77.8	Confident	68 Å²	68	66.9 Å²	66.9	34%	0.335	34%	0.339	S	S	.	.			trans	-96.5	-5.6	172.8	-64.1	-62.8	-65.7	0	0	112.7	R433 L597 E598 N600	M423-R433 PolarHBondContact SD-NH2 3.07Å; M423-L597 HydrophobicContact CE-CD2 4.33Å; M423-E598 WeakPolarHBondContact CE-O 3.13Å; M423-N600 PolarHBondContact O-N 3.39Å; M423-N600 VanDerWaalsContact O-N 3.15Å
424	D	63.3	Low	77.6	Confident	38 Å²	38	62.1 Å²	62.1	20%	0.203	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-79.7	117.6	-179.8	-72.8	-32.8	0	0	0	110.8	T426 K427 A429	D424-T426 PolarHBondContact O-N 2.87Å; D424-K427 HydrophobicContact CB-CB 4.17Å; D424-K427 HydrophobicContact CB-CD 3.99Å; D424-K427 HydrophobicContact CB-CG 4Å; D424-K427 PolarHBondContact O-N 3.18Å; D424-K427 VanDerWaalsContact O-N 3.12Å; D424-K427 WeakPolarHBondContact OD2-CE 3.4Å; D424-K427 IonicContact OD2-NZ 3.35Å; D424-K427 PolarHBondContact OD2-NZ 3.28Å; D424-A429 VanDerWaalsContact O-CB 3.3Å; D424-A429 WeakPolarHBondContact O-CB 3.34Å
425	V	64.9	Low	77.6	Confident	33 Å²	33	63 Å²	63	20%	0.2	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-60.2	-36.3	178.2	-175.4	0	0	0	0	111.6	K427 G428 F599 N600	V425-K427 PolarHBondContact O-N 2.87Å; V425-G428 PolarHBondContact O-N 3.27Å; V425-G428 VanDerWaalsContact O-N 3.14Å; V425-F599 HydrophobicContact CG2-CB 3.31Å; V425-F599 HydrophobicContact CG2-CG 4.06Å; V425-N600 PolarHBondContact N-O 3.21Å
426	T	60.9	Low	77.6	Confident	99 Å²	99	62.8 Å²	62.8	61%	0.607	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-67.6	-16.8	-179.1	54.4	0	0	0	0	113.6	D424	D424-T426 PolarHBondContact O-N 2.87Å
427	K	63.7	Low	77.6	Confident	142 Å²	142	55.5 Å²	55.5	62%	0.617	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-96.7	2.6	176.6	-66.3	-178.6	-176.4	149.8	0	113.6	D424 V425	D424-K427 HydrophobicContact CB-CB 4.17Å; D424-K427 HydrophobicContact CB-CD 3.99Å; D424-K427 HydrophobicContact CB-CG 4Å; D424-K427 PolarHBondContact O-N 3.18Å; D424-K427 VanDerWaalsContact O-N 3.12Å; D424-K427 WeakPolarHBondContact OD2-CE 3.4Å; D424-K427 IonicContact OD2-NZ 3.35Å; D424-K427 PolarHBondContact OD2-NZ 3.28Å; V425-K427 PolarHBondContact O-N 2.87Å
428	G	72.6	Confident	77.8	Confident	23 Å²	23	51.2 Å²	51.2	24%	0.237	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	16	179.1	0	0	0	0	0	115.3	V425 V430 Q431 D432	V425-G428 PolarHBondContact O-N 3.27Å; V425-G428 VanDerWaalsContact O-N 3.14Å; G428-V430 PolarHBondContact O-N 2.98Å; G428-Q431 WeakPolarHBondContact O-CB 3.45Å; G428-Q431 PolarHBondContact O-N 3.36Å; G428-D432 PolarHBondContact O-N 2.95Å
429	A	77.7	Confident	78.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-47.2	-40.4	-176.8	0	0	0	0	0	115.3	A422 D424 R433 F599	A422-A429 WeakPolarHBondContact O-CB 3.43Å; D424-A429 VanDerWaalsContact O-CB 3.3Å; D424-A429 WeakPolarHBondContact O-CB 3.34Å; A429-R433 WeakPolarHBondContact O-CG 3.31Å; A429-R433 PolarHBondContact O-N 3.12Å; A429-F599 HydrophobicContact CB-CD1 4.4Å; A429-F599 HydrophobicContact CB-CE1 4.48Å
430	V	79.5	Confident	78.8	Confident	30 Å²	30	47 Å²	47	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-71.9	-42.5	179	175.8	0	0	0	0	111.1	G428 R433 I434 F594 F599 I619	G428-V430 PolarHBondContact O-N 2.98Å; V430-R433 PolarHBondContact O-N 3.43Å; V430-I434 HydrophobicContact CG1-CD1 3.67Å; V430-I434 HydrophobicContact CG1-CG1 4.42Å; V430-I434 VanDerWaalsContact O-CG1 3.25Å; V430-I434 WeakPolarHBondContact O-CG1 3.45Å; V430-I434 PolarHBondContact O-N 2.75Å; V430-F594 HydrophobicContact CG1-CE1 4.24Å; V430-F594 HydrophobicContact CG1-CZ 4.38Å; V430-F599 HydrophobicContact CG2-CD1 4.48Å; V430-F599 HydrophobicContact CG2-CD2 4.48Å; V430-F599 HydrophobicContact CG2-CE1 4.16Å; V430-F599 HydrophobicContact CG2-CE2 4.17Å; V430-F599 HydrophobicContact CG2-CZ 4.01Å; V430-I619 HydrophobicContact CB-CD1 4.45Å; V430-I619 HydrophobicContact CG1-CD1 3.83Å; V430-I619 HydrophobicContact CG2-CD1 3.71Å
431	Q	83.3	Confident	79.3	Confident	140 Å²	140	41.3 Å²	41.3	65%	0.654	23%	0.225	S	C	*	.	H	α-helix	trans	-66.2	-39.6	180	-177.3	175.7	-22.1	0	0	111.4	G428 I434 G435	G428-Q431 WeakPolarHBondContact O-CB 3.45Å; G428-Q431 PolarHBondContact O-N 3.36Å; Q431-I434 PolarHBondContact O-N 2.83Å; Q431-G435 PolarHBondContact O-N 3.45Å
432	D	85.9	Confident	79.9	Confident	68 Å²	68	41.9 Å²	41.9	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-43.1	177.7	-63.9	-24.6	0	0	0	111.6	G428 G435 M436	G428-D432 PolarHBondContact O-N 2.95Å; D432-G435 PolarHBondContact O-N 3.45Å; D432-M436 WeakPolarHBondContact O-CB 3.48Å; D432-M436 PolarHBondContact O-N 2.87Å
433	R	86.6	Confident	80.7	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-47.4	174.5	-82.3	176.4	-159.9	-88.2	-3	112	L421 M423 A429 V430 M436 I437 E593 F594	L421-R433 HydrophobicContact CD2-CB 4.43Å; L421-R433 HydrophobicContact CD2-CG 3.29Å; L421-R433 HydrophobicContact CG-CG 3.85Å; M423-R433 PolarHBondContact SD-NH2 3.07Å; A429-R433 WeakPolarHBondContact O-CG 3.31Å; A429-R433 PolarHBondContact O-N 3.12Å; V430-R433 PolarHBondContact O-N 3.43Å; R433-M436 PolarHBondContact O-N 3.23Å; R433-I437 WeakPolarHBondContact O-CG1 3.49Å; R433-I437 PolarHBondContact O-N 3.32Å; R433-E593 IonicContact CZ-OE1 2.61Å; R433-E593 IonicContact NH1-OE1 2.76Å; R433-E593 PolarHBondContact NH1-OE1 3Å; R433-F594 HydrophobicContact CB-CE1 4.5Å; R433-F594 HydrophobicContact CB-CE2 4.41Å; R433-F594 HydrophobicContact CB-CZ 3.77Å
434	I	86.2	Confident	82	Confident	23 Å²	23	37.8 Å²	37.8	12%	0.118	21%	0.207	C	C	.	.	H	α-helix	trans	-69.4	-40.9	-179.7	-59.9	164.9	0	0	0	111	V430 Q431 M436 I437 Y438 F562 F594	V430-I434 HydrophobicContact CG1-CD1 3.67Å; V430-I434 HydrophobicContact CG1-CG1 4.42Å; V430-I434 VanDerWaalsContact O-CG1 3.25Å; V430-I434 WeakPolarHBondContact O-CG1 3.45Å; V430-I434 PolarHBondContact O-N 2.75Å; Q431-I434 PolarHBondContact O-N 2.83Å; I434-M436 VanDerWaalsContact C-N 3.3Å; I434-M436 PolarHBondContact O-N 2.75Å; I434-I437 PolarHBondContact O-N 3.46Å; I434-Y438 VanDerWaalsContact O-CB 3.3Å; I434-Y438 WeakPolarHBondContact O-CB 3.42Å; I434-Y438 PolarHBondContact O-N 2.99Å; I434-F562 HydrophobicContact CB-CD2 4.24Å; I434-F562 HydrophobicContact CB-CE2 3.93Å; I434-F562 HydrophobicContact CD1-CD2 4.49Å; I434-F562 HydrophobicContact CD1-CE2 4.21Å; I434-F562 HydrophobicContact CG2-CB 4.36Å; I434-F562 HydrophobicContact CG2-CD1 4.36Å; I434-F562 HydrophobicContact CG2-CD2 3.14Å; I434-F562 HydrophobicContact CG2-CE1 4.49Å; I434-F562 HydrophobicContact CG2-CE2 3.29Å; I434-F562 HydrophobicContact CG2-CG 3.7Å; I434-F562 HydrophobicContact CG2-CZ 3.99Å; I434-F594 HydrophobicContact CD1-CZ 4.48Å; I434-F594 HydrophobicContact CG1-CE2 4.08Å; I434-F594 HydrophobicContact CG1-CZ 3.85Å
435	G	88	Confident	83.3	Confident	29 Å²	29	36.2 Å²	36.2	30%	0.299	20%	0.198	S	C	.	.	H	α-helix	trans	-60.6	-38.4	175.7	0	0	0	0	0	112.6	Q431 D432 Y438 Q439	Q431-G435 PolarHBondContact O-N 3.45Å; D432-G435 PolarHBondContact O-N 3.45Å; G435-Y438 PolarHBondContact O-N 3.07Å; G435-Q439 PolarHBondContact O-N 3.38Å
436	M	88.4	Confident	84.6	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-47.5	173.5	176.5	-170.6	58.7	0	0	112.1	L421 D432 R433 I434 Y438 Q439 C440 V504 M506	L421-M436 HydrophobicContact CD2-CE 3.83Å; L421-M436 HydrophobicContact CD2-SD 4.44Å; D432-M436 WeakPolarHBondContact O-CB 3.48Å; D432-M436 PolarHBondContact O-N 2.87Å; R433-M436 PolarHBondContact O-N 3.23Å; I434-M436 VanDerWaalsContact C-N 3.3Å; I434-M436 PolarHBondContact O-N 2.75Å; M436-Y438 VanDerWaalsContact C-N 3.3Å; M436-Y438 PolarHBondContact O-N 3.46Å; M436-Q439 PolarHBondContact O-N 2.97Å; M436-C440 PolarHBondContact O-N 3.33Å; M436-C440 PolarHBondContact O-SG 3.41Å; M436-V504 HydrophobicContact SD-CB 4.09Å; M436-V504 HydrophobicContact SD-CG1 3.44Å; M436-V504 WeakPolarHBondContact SD-CG1 3.5Å; M436-V504 HydrophobicContact SD-CG2 4.45Å; M436-M506 HydrophobicContact CE-CE 3.48Å; M436-M506 VanDerWaalsContact CE-CE 3.48Å; M436-M506 HydrophobicContact CE-CG 3.69Å; M436-M506 HydrophobicContact CE-SD 3.42Å; M436-M506 WeakPolarHBondContact CE-SD 3.47Å; M436-M506 HydrophobicContact SD-CG 4.23Å; M436-M506 HydrophobicContact SD-SD 3.9Å
437	I	89.3	Confident	86	Confident	3 Å²	3	35 Å²	35	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-45.5	176.3	-70.4	169.1	0	0	0	110	R433 I434 Q439 C440 V441 L589 I590 E593 F594	R433-I437 WeakPolarHBondContact O-CG1 3.49Å; R433-I437 PolarHBondContact O-N 3.32Å; I434-I437 PolarHBondContact O-N 3.46Å; I437-Q439 PolarHBondContact O-N 3.06Å; I437-C440 PolarHBondContact O-N 3.03Å; I437-V441 WeakPolarHBondContact O-CG2 3.38Å; I437-V441 PolarHBondContact O-N 3.27Å; I437-L589 HydrophobicContact CD1-CB 4.35Å; I437-L589 HydrophobicContact CG1-CB 4.32Å; I437-L589 HydrophobicContact CG2-CB 3.68Å; I437-L589 HydrophobicContact CG2-CD1 3.89Å; I437-L589 HydrophobicContact CG2-CG 4.44Å; I437-I590 HydrophobicContact CD1-CG1 4.01Å; I437-I590 HydrophobicContact CG2-CG1 4.46Å; I437-E593 HydrophobicContact CD1-CB 4.23Å; I437-F594 HydrophobicContact CD1-CE2 4.26Å
438	Y	89.6	Confident	87.3	Confident	49 Å²	49	28.2 Å²	28.2	19%	0.192	15%	0.151	C	C	.	.	H	α-helix	trans	-57	-47.3	176.7	-177.7	-87.9	0	0	0	111.5	I434 G435 M436 V441 A442 I556 F562 L563	I434-Y438 VanDerWaalsContact O-CB 3.3Å; I434-Y438 WeakPolarHBondContact O-CB 3.42Å; I434-Y438 PolarHBondContact O-N 2.99Å; G435-Y438 PolarHBondContact O-N 3.07Å; M436-Y438 VanDerWaalsContact C-N 3.3Å; M436-Y438 PolarHBondContact O-N 3.46Å; Y438-V441 PolarHBondContact O-N 2.95Å; Y438-A442 VanDerWaalsContact O-CB 3.26Å; Y438-A442 WeakPolarHBondContact O-CB 3.23Å; Y438-A442 PolarHBondContact O-N 3.44Å; Y438-I556 HydrophobicContact CD2-CD1 4.17Å; Y438-I556 HydrophobicContact CD2-CG1 3.87Å; Y438-I556 HydrophobicContact CE1-CG1 4.26Å; Y438-I556 HydrophobicContact CE2-CD1 4.09Å; Y438-I556 HydrophobicContact CE2-CG1 3.29Å; Y438-I556 WeakPolarHBondContact OH-CG2 3.35Å; Y438-F562 HydrophobicContact CD2-CD1 4.08Å; Y438-L563 HydrophobicContact CE2-CD1 3.93Å
439	Q	90	Very high	88.2	Confident	75 Å²	75	27.2 Å²	27.2	35%	0.35	14%	0.141	S	C	.	.	H	α-helix	trans	-63.7	-41.8	176.8	-107	-21	116.8	0	0	112.8	Y410 V414 G435 M436 I437 V441 A442 A443	Y410-Q439 WeakPolarHBondContact OH-CB 3.26Å; Y410-Q439 WeakPolarHBondContact OH-CG 3.43Å; Y410-Q439 PolarHBondContact OH-NE2 3.14Å; Y410-Q439 PolarHBondContact OH-O 2.99Å; V414-Q439 HydrophobicContact CG2-CG 4.36Å; G435-Q439 PolarHBondContact O-N 3.38Å; M436-Q439 PolarHBondContact O-N 2.97Å; I437-Q439 PolarHBondContact O-N 3.06Å; Q439-V441 PolarHBondContact O-N 3.42Å; Q439-A442 PolarHBondContact O-N 3.44Å; Q439-A443 WeakPolarHBondContact O-CB 3.32Å; Q439-A443 PolarHBondContact O-N 3.41Å
440	C	89.8	Confident	88.8	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-63.2	-42.7	179.5	-68.1	0	0	0	0	111.4	M436 I437 S444	M436-C440 PolarHBondContact O-N 3.33Å; M436-C440 PolarHBondContact O-SG 3.41Å; I437-C440 PolarHBondContact O-N 3.03Å; C440-S444 VanDerWaalsContact O-CB 3.31Å; C440-S444 WeakPolarHBondContact O-CB 3.13Å; C440-S444 PolarHBondContact O-N 3.07Å; C440-S444 PolarHBondContact O-OG 3.2Å
441	V	90.4	Very high	89.2	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.018	15%	0.145	C	C	.	.	H	α-helix	trans	-71.7	-36.6	178.2	178.4	0	0	0	0	111.9	I437 Y438 Q439 P445 I556 Q582 L589	I437-V441 WeakPolarHBondContact O-CG2 3.38Å; I437-V441 PolarHBondContact O-N 3.27Å; Y438-V441 PolarHBondContact O-N 2.95Å; Q439-V441 PolarHBondContact O-N 3.42Å; V441-P445 WeakPolarHBondContact O-CD 3.46Å; V441-P445 WeakPolarHBondContact O-CG 3.12Å; V441-I556 HydrophobicContact CB-CD1 4.21Å; V441-I556 HydrophobicContact CG1-CD1 3.89Å; V441-Q582 HydrophobicContact CG1-CB 4.05Å; V441-Q582 HydrophobicContact CG1-CG 3.96Å; V441-L589 HydrophobicContact CG2-CD1 3.5Å; V441-L589 VanDerWaalsContact CG2-CD1 3.5Å
442	A	89.9	Confident	89.5	Confident	16 Å²	16	21.7 Å²	21.7	13%	0.132	11%	0.114	C	C	.	.	H	α-helix	trans	-75.1	-39.7	-179.8	0	0	0	0	0	113.3	Y438 Q439 N552 I556	Y438-A442 VanDerWaalsContact O-CB 3.26Å; Y438-A442 WeakPolarHBondContact O-CB 3.23Å; Y438-A442 PolarHBondContact O-N 3.44Å; Q439-A442 PolarHBondContact O-N 3.44Å; A442-N552 PolarHBondContact O-ND2 3.36Å; A442-I556 HydrophobicContact CB-CD1 4.35Å; A442-I556 HydrophobicContact CB-CG1 4.16Å
443	A	90.2	Very high	89.7	Confident	10 Å²	10	19.6 Å²	19.6	8%	0.083	10%	0.104	C	C	.	.	H	α-helix	trans	-81.1	-35.6	-173.9	0	0	0	0	0	113.4	Y410 Q439 Y446 T447	Y410-A443 HydrophobicContact CD1-CB 3.7Å; Y410-A443 HydrophobicContact CD2-CB 4.21Å; Y410-A443 HydrophobicContact CE1-CB 3.16Å; Y410-A443 HydrophobicContact CE2-CB 3.75Å; Y410-A443 HydrophobicContact CG-CB 4.2Å; Q439-A443 WeakPolarHBondContact O-CB 3.32Å; Q439-A443 PolarHBondContact O-N 3.41Å; A443-Y446 WeakPolarHBondContact O-CA 3.39Å; A443-Y446 VanDerWaalsContact O-CB 3.31Å; A443-Y446 WeakPolarHBondContact O-CB 3.29Å; A443-Y446 PolarHBondContact O-N 3.2Å; A443-T447 PolarHBondContact O-N 2.8Å
444	S	90.9	Very high	89.6	Confident	4 Å²	4	22.4 Å²	22.4	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-53.9	-48.4	-179.8	-61.8	0	0	0	0	114.4	C440 Y446 T447 G448 V520 H524	C440-S444 VanDerWaalsContact O-CB 3.31Å; C440-S444 WeakPolarHBondContact O-CB 3.13Å; C440-S444 PolarHBondContact O-N 3.07Å; C440-S444 PolarHBondContact O-OG 3.2Å; S444-Y446 VanDerWaalsContact C-N 3.29Å; S444-Y446 PolarHBondContact O-N 3.49Å; S444-T447 PolarHBondContact O-N 3.28Å; S444-T447 PolarHBondContact O-OG1 2.96Å; S444-G448 PolarHBondContact O-N 2.79Å; S444-V520 WeakPolarHBondContact OG-CG1 3.33Å; S444-H524 WeakPolarHBondContact O-CA 3.43Å; S444-H524 PolarHBondContact O-ND1 3.39Å
445	P	91.9	Very high	89.6	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.032	12%	0.123	C	C	.	.	H	α-helix	trans	-68	-28.3	175.2	21	-27.1	0	0	0	113	V441 G448 M449 P523 N552 F581	V441-P445 WeakPolarHBondContact O-CD 3.46Å; V441-P445 WeakPolarHBondContact O-CG 3.12Å; P445-G448 PolarHBondContact O-N 3.16Å; P445-M449 PolarHBondContact O-N 2.97Å; P445-P523 WeakPolarHBondContact CA-O 3.42Å; P445-P523 WeakPolarHBondContact CB-O 3.4Å; P445-P523 HydrophobicContact CG-CB 4.36Å; P445-N552 WeakPolarHBondContact CG-ND2 3.29Å; P445-F581 HydrophobicContact CB-CE2 4.22Å; P445-F581 HydrophobicContact CB-CZ 3.93Å; P445-F581 HydrophobicContact CG-CE2 4.07Å; P445-F581 HydrophobicContact CG-CZ 4.09Å
446	Y	91.2	Very high	89.5	Confident	99 Å²	99	20.8 Å²	20.8	39%	0.388	11%	0.109	S	C	.	.	H	α-helix	trans	-68.1	-41.6	177.3	-171.4	-95.3	0	0	0	111.8	A443 S444 G448 M449 L450 A549 N552	A443-Y446 WeakPolarHBondContact O-CA 3.39Å; A443-Y446 VanDerWaalsContact O-CB 3.31Å; A443-Y446 WeakPolarHBondContact O-CB 3.29Å; A443-Y446 PolarHBondContact O-N 3.2Å; S444-Y446 VanDerWaalsContact C-N 3.29Å; S444-Y446 PolarHBondContact O-N 3.49Å; Y446-G448 VanDerWaalsContact C-N 3.35Å; Y446-M449 HydrophobicContact CD2-CE 3.38Å; Y446-M449 HydrophobicContact CE1-CE 4.48Å; Y446-M449 HydrophobicContact CE2-CE 3.27Å; Y446-M449 HydrophobicContact CG-CE 4.05Å; Y446-M449 WeakPolarHBondContact O-CB 3.26Å; Y446-M449 PolarHBondContact O-N 3.34Å; Y446-L450 HydrophobicContact CD1-CD1 3.92Å; Y446-L450 HydrophobicContact CD1-CG 4.23Å; Y446-L450 HydrophobicContact CE1-CD1 3.59Å; Y446-L450 HydrophobicContact CE1-CD2 4.32Å; Y446-L450 HydrophobicContact CE1-CG 3.96Å; Y446-L450 WeakPolarHBondContact O-CG 3.23Å; Y446-L450 PolarHBondContact O-N 3.25Å; Y446-A549 HydrophobicContact CE2-CB 4.09Å; Y446-N552 PolarHBondContact N-ND2 2.94Å
447	T	91.1	Very high	89.5	Confident	8 Å²	8	22 Å²	22	5%	0.049	12%	0.116	C	C	.	.	H	α-helix	trans	-67.8	-35.9	174.8	58.4	0	0	0	0	112	N407 A443 S444 M449 L450 N451 H524	N407-T447 WeakPolarHBondContact OD1-CB 3.39Å; N407-T447 VanDerWaalsContact OD1-CG2 3.27Å; N407-T447 WeakPolarHBondContact OD1-CG2 3.35Å; N407-T447 PolarHBondContact OD1-OG1 2.96Å; A443-T447 PolarHBondContact O-N 2.8Å; S444-T447 PolarHBondContact O-N 3.28Å; S444-T447 PolarHBondContact O-OG1 2.96Å; T447-M449 VanDerWaalsContact C-N 3.34Å; T447-M449 PolarHBondContact O-N 3.17Å; T447-L450 PolarHBondContact O-N 3.02Å; T447-N451 WeakPolarHBondContact O-CB 3.32Å; T447-N451 VanDerWaalsContact O-CG 3.27Å; T447-N451 PolarHBondContact O-N 3.1Å; T447-N451 VanDerWaalsContact O-N 3.09Å; T447-N451 PolarHBondContact O-ND2 2.76Å; T447-H524 PolarHBondContact OG1-CE1 2.93Å; T447-H524 VanDerWaalsContact OG1-CE1 3.26Å; T447-H524 PolarHBondContact OG1-ND1 2.94Å
448	G	90.8	Very high	89.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-43.3	171	0	0	0	0	0	112.4	S444 P445 Y446 N451 A452 H524 E528	S444-G448 PolarHBondContact O-N 2.79Å; P445-G448 PolarHBondContact O-N 3.16Å; Y446-G448 VanDerWaalsContact C-N 3.35Å; G448-N451 PolarHBondContact O-N 2.81Å; G448-A452 PolarHBondContact O-N 3.02Å; G448-A452 VanDerWaalsContact O-N 3.11Å; G448-H524 PolarHBondContact N-CE1 3.42Å; G448-H524 PolarHBondContact N-ND1 3.44Å; G448-E528 WeakPolarHBondContact O-CA 3.32Å; G448-E528 WeakPolarHBondContact O-CB 3.36Å; G448-E528 WeakPolarHBondContact O-CG 3.37Å
449	M	91.4	Very high	89.1	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-49.1	174.7	174.8	-164.4	72.1	0	0	112.5	P445 Y446 T447 N451 A452 V453 T531 N545 M548 A549	P445-M449 PolarHBondContact O-N 2.97Å; Y446-M449 HydrophobicContact CD2-CE 3.38Å; Y446-M449 HydrophobicContact CE1-CE 4.48Å; Y446-M449 HydrophobicContact CE2-CE 3.27Å; Y446-M449 HydrophobicContact CG-CE 4.05Å; Y446-M449 WeakPolarHBondContact O-CB 3.26Å; Y446-M449 PolarHBondContact O-N 3.34Å; T447-M449 VanDerWaalsContact C-N 3.34Å; T447-M449 PolarHBondContact O-N 3.17Å; M449-N451 PolarHBondContact O-N 3.3Å; M449-A452 PolarHBondContact O-N 3.08Å; M449-A452 VanDerWaalsContact O-N 3.1Å; M449-V453 HydrophobicContact CG-CG2 4.2Å; M449-V453 WeakPolarHBondContact O-CG2 3.28Å; M449-V453 PolarHBondContact O-N 3.07Å; M449-T531 WeakPolarHBondContact CA-OG1 3.49Å; M449-T531 WeakPolarHBondContact CB-OG1 3.26Å; M449-T531 HydrophobicContact CG-CG2 4.13Å; M449-T531 WeakPolarHBondContact CG-OG1 3.49Å; M449-N545 WeakPolarHBondContact CE-OD1 3.49Å; M449-M548 HydrophobicContact CG-CB 3.85Å; M449-M548 HydrophobicContact CG-CG 4.44Å; M449-M548 HydrophobicContact SD-CB 3.23Å; M449-M548 WeakPolarHBondContact SD-CB 3.42Å; M449-M548 HydrophobicContact SD-CG 4.37Å; M449-A549 HydrophobicContact CE-CB 4.45Å; M449-A549 HydrophobicContact SD-CB 4.49Å
450	L	89.5	Confident	88.9	Confident	51 Å²	51	20.9 Å²	20.9	27%	0.267	12%	0.12	S	C	.	.	H	α-helix	trans	-58	-37.8	178.5	-72.6	178.4	0	0	0	112.3	Y446 T447 S454	Y446-L450 HydrophobicContact CD1-CD1 3.92Å; Y446-L450 HydrophobicContact CD1-CG 4.23Å; Y446-L450 HydrophobicContact CE1-CD1 3.59Å; Y446-L450 HydrophobicContact CE1-CD2 4.32Å; Y446-L450 HydrophobicContact CE1-CG 3.96Å; Y446-L450 WeakPolarHBondContact O-CG 3.23Å; Y446-L450 PolarHBondContact O-N 3.25Å; T447-L450 PolarHBondContact O-N 3.02Å; L450-S454 WeakPolarHBondContact O-CB 3.13Å; L450-S454 PolarHBondContact O-N 3.32Å; L450-S454 PolarHBondContact O-OG 3.38Å
451	N	89.1	Confident	88.7	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.011	13%	0.133	C	C	.	.	H	α-helix	trans	-65.5	-41.3	175.7	-74.8	-20.5	0	0	0	112.5	R403 Q406 T447 G448 M449 S454 L455	R403-N451 HydrophobicContact CG-CB 4.44Å; Q406-N451 PolarHBondContact NE2-OD1 3.03Å; Q406-N451 PolarHBondContact OE1-OD1 3.03Å; T447-N451 WeakPolarHBondContact O-CB 3.32Å; T447-N451 VanDerWaalsContact O-CG 3.27Å; T447-N451 PolarHBondContact O-N 3.1Å; T447-N451 VanDerWaalsContact O-N 3.09Å; T447-N451 PolarHBondContact O-ND2 2.76Å; G448-N451 PolarHBondContact O-N 2.81Å; M449-N451 PolarHBondContact O-N 3.3Å; N451-S454 PolarHBondContact O-OG 3.28Å; N451-L455 PolarHBondContact O-N 3.46Å
452	A	89.8	Confident	88.5	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69.6	-48.4	177	0	0	0	0	0	112.8	G448 M449 S454 L455 F456 E528 T531 V532	G448-A452 PolarHBondContact O-N 3.02Å; G448-A452 VanDerWaalsContact O-N 3.11Å; M449-A452 PolarHBondContact O-N 3.08Å; M449-A452 VanDerWaalsContact O-N 3.1Å; A452-S454 VanDerWaalsContact C-N 3.29Å; A452-S454 PolarHBondContact O-N 3.43Å; A452-L455 PolarHBondContact O-N 2.95Å; A452-F456 WeakPolarHBondContact O-CB 3.13Å; A452-F456 PolarHBondContact O-N 3.21Å; A452-E528 HydrophobicContact CB-CG 3.89Å; A452-T531 HydrophobicContact CB-CG2 3.56Å; A452-V532 HydrophobicContact CB-CG2 3.78Å
453	V	89.6	Confident	88.3	Confident	24 Å²	24	22.3 Å²	22.3	15%	0.145	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-35.3	-175.8	174.1	0	0	0	0	112	M449 P457 T531 P541 N545	M449-V453 HydrophobicContact CG-CG2 4.2Å; M449-V453 WeakPolarHBondContact O-CG2 3.28Å; M449-V453 PolarHBondContact O-N 3.07Å; V453-P457 WeakPolarHBondContact O-CD 3.46Å; V453-P457 WeakPolarHBondContact O-CG 3.36Å; V453-T531 HydrophobicContact CG2-CG2 3.55Å; V453-P541 HydrophobicContact CG1-CB 4.1Å; V453-N545 HydrophobicContact CG1-CB 4.32Å; V453-N545 HydrophobicContact CG2-CB 4.22Å
454	S	85	Confident	88.1	Confident	64 Å²	64	22.8 Å²	22.8	45%	0.448	13%	0.131	S	C	.	.	H	α-helix	trans	-75.4	-39.6	-178.6	57	0	0	0	0	113.4	L450 N451 A452	L450-S454 WeakPolarHBondContact O-CB 3.13Å; L450-S454 PolarHBondContact O-N 3.32Å; L450-S454 PolarHBondContact O-OG 3.38Å; N451-S454 PolarHBondContact O-OG 3.28Å; A452-S454 VanDerWaalsContact C-N 3.29Å; A452-S454 PolarHBondContact O-N 3.43Å
455	L	84.8	Confident	87.6	Confident	18 Å²	18	23.6 Å²	23.6	9%	0.094	13%	0.134	C	C	.	.	H	α-helix	trans	-96	-40.1	-172.5	-173.9	64.4	0	0	0	113.3	L393 N451 A452 S458 L459 Y481	L393-L455 HydrophobicContact CD1-CD1 4.21Å; L393-L455 HydrophobicContact CD1-CD2 3.86Å; N451-L455 PolarHBondContact O-N 3.46Å; A452-L455 PolarHBondContact O-N 2.95Å; L455-S458 PolarHBondContact O-OG 2.98Å; L455-S458 VanDerWaalsContact O-OG 3.08Å; L455-L459 HydrophobicContact CD1-CD1 4.27Å; L455-L459 HydrophobicContact CG-CD1 4.39Å; L455-L459 WeakPolarHBondContact O-CD1 3.46Å; L455-Y481 HydrophobicContact CD2-CE2 4.2Å
456	F	87.8	Confident	87.2	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.5	-36.2	-168.3	-168.6	-102.2	0	0	0	115.4	A452 S458 L459 R460 M477 Y481 V532 L535 F653	A452-F456 WeakPolarHBondContact O-CB 3.13Å; A452-F456 PolarHBondContact O-N 3.21Å; F456-S458 VanDerWaalsContact C-N 3.33Å; F456-S458 PolarHBondContact O-N 3.46Å; F456-L459 PolarHBondContact O-N 3.02Å; F456-R460 HydrophobicContact CD1-CB 4.14Å; F456-R460 HydrophobicContact CE1-CB 3.87Å; F456-R460 HydrophobicContact CE1-CG 4Å; F456-R460 HydrophobicContact CZ-CB 4.37Å; F456-R460 VanDerWaalsContact O-CB 3.27Å; F456-R460 WeakPolarHBondContact O-CB 3.37Å; F456-R460 PolarHBondContact O-N 3.11Å; F456-M477 HydrophobicContact CE2-CE 3.86Å; F456-M477 HydrophobicContact CZ-CE 3.55Å; F456-Y481 AromaticContact CD2-CD1 3.75Å; F456-Y481 HydrophobicContact CD2-CD1 3.75Å; F456-Y481 HydrophobicContact CD2-CD2 4.12Å; F456-Y481 AromaticContact CD2-CE1 3.67Å; F456-Y481 HydrophobicContact CD2-CE1 3.67Å; F456-Y481 HydrophobicContact CD2-CE2 4.07Å; F456-Y481 AromaticContact CD2-CG 3.98Å; F456-Y481 HydrophobicContact CD2-CG 3.98Å; F456-Y481 AromaticContact CD2-CZ 3.86Å; F456-Y481 AromaticContact CE2-CD1 3.89Å; F456-Y481 HydrophobicContact CE2-CD1 3.89Å; F456-Y481 HydrophobicContact CE2-CE1 4.24Å; F456-Y481 HydrophobicContact CE2-CG 4.1Å; F456-Y481 HydrophobicContact CG-CE1 4.5Å; F456-V532 HydrophobicContact CD1-CG1 4.26Å; F456-V532 HydrophobicContact CD2-CG1 3.98Å; F456-V532 HydrophobicContact CD2-CG2 4.33Å; F456-V532 HydrophobicContact CE1-CG1 3.93Å; F456-V532 HydrophobicContact CE2-CG1 3.63Å; F456-V532 HydrophobicContact CG-CG1 4.29Å; F456-V532 HydrophobicContact CG-CG2 4.32Å; F456-V532 HydrophobicContact CZ-CG1 3.61Å; F456-L535 HydrophobicContact CB-CD1 4.07Å; F456-L535 HydrophobicContact CD1-CB 3.83Å; F456-L535 HydrophobicContact CD1-CD1 3.83Å; F456-L535 HydrophobicContact CD1-CG 4.44Å; F456-L535 HydrophobicContact CE1-CB 4.1Å; F456-L535 HydrophobicContact CG-CD1 4.34Å; F456-F653 HydrophobicContact CE1-CE1 4.09Å; F456-F653 AromaticContact CE1-CZ 3.6Å; F456-F653 HydrophobicContact CE1-CZ 3.6Å; F456-F653 HydrophobicContact CE2-CZ 4.47Å; F456-F653 AromaticContact CZ-CE1 3.75Å; F456-F653 HydrophobicContact CZ-CE1 3.75Å; F456-F653 HydrophobicContact CZ-CE2 4.23Å; F456-F653 AromaticContact CZ-CZ 3.3Å; F456-F653 HydrophobicContact CZ-CZ 3.3Å
457	P	87.9	Confident	86.8	Confident	27 Å²	27	19.4 Å²	19.4	18%	0.175	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-37	-175.7	-28	36.6	0	0	0	114.8	V453 R460 A461 P541	V453-P457 WeakPolarHBondContact O-CD 3.46Å; V453-P457 WeakPolarHBondContact O-CG 3.36Å; P457-R460 PolarHBondContact O-N 3.03Å; P457-A461 PolarHBondContact O-N 2.86Å; P457-P541 HydrophobicContact CB-CG 3.95Å; P457-P541 HydrophobicContact CG-CB 3.99Å; P457-P541 HydrophobicContact CG-CG 3.69Å
458	S	83.4	Confident	86.1	Confident	63 Å²	63	21.6 Å²	21.6	44%	0.441	13%	0.127	S	C	.	.	H	α-helix	trans	-69	-47.1	178.6	61	0	0	0	0	111.2	L455 F456 R460 A461 I462	L455-S458 PolarHBondContact O-OG 2.98Å; L455-S458 VanDerWaalsContact O-OG 3.08Å; F456-S458 VanDerWaalsContact C-N 3.33Å; F456-S458 PolarHBondContact O-N 3.46Å; S458-R460 VanDerWaalsContact C-N 3.29Å; S458-R460 PolarHBondContact O-N 3.08Å; S458-A461 PolarHBondContact O-N 2.64Å; S458-I462 WeakPolarHBondContact O-CG1 3.36Å; S458-I462 PolarHBondContact O-N 3.16Å
459	L	85.8	Confident	85.4	Confident	16 Å²	16	22 Å²	22	8%	0.084	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-40.9	174.4	-85.1	72	0	0	0	111.4	T389 L455 F456 I462 S463 Y481	T389-L459 HydrophobicContact CG2-CD2 3.98Å; L455-L459 HydrophobicContact CD1-CD1 4.27Å; L455-L459 HydrophobicContact CG-CD1 4.39Å; L455-L459 WeakPolarHBondContact O-CD1 3.46Å; F456-L459 PolarHBondContact O-N 3.02Å; L459-I462 PolarHBondContact O-N 3.46Å; L459-S463 VanDerWaalsContact O-CB 3.31Å; L459-S463 WeakPolarHBondContact O-CB 3.18Å; L459-S463 PolarHBondContact O-N 2.95Å; L459-Y481 HydrophobicContact CD2-CD2 4.23Å
460	R	87.6	Confident	84.6	Confident	26 Å²	26	23.8 Å²	23.8	10%	0.098	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-45.6	178.3	-173.1	-168.7	78.5	155.9	-2.6	112	F456 P457 S458 S463 D464 L535 V538 Q539 R656	F456-R460 HydrophobicContact CD1-CB 4.14Å; F456-R460 HydrophobicContact CE1-CB 3.87Å; F456-R460 HydrophobicContact CE1-CG 4Å; F456-R460 HydrophobicContact CZ-CB 4.37Å; F456-R460 VanDerWaalsContact O-CB 3.27Å; F456-R460 WeakPolarHBondContact O-CB 3.37Å; F456-R460 PolarHBondContact O-N 3.11Å; P457-R460 PolarHBondContact O-N 3.03Å; S458-R460 VanDerWaalsContact C-N 3.29Å; S458-R460 PolarHBondContact O-N 3.08Å; R460-S463 PolarHBondContact O-N 3.4Å; R460-D464 PolarHBondContact O-N 3.44Å; R460-L535 WeakPolarHBondContact CD-O 3.42Å; R460-L535 PolarHBondContact NH1-O 3.04Å; R460-V538 PolarHBondContact NH1-O 3.38Å; R460-V538 VanDerWaalsContact NH1-O 3.1Å; R460-Q539 PolarHBondContact NH1-O 3.35Å; R460-Q539 PolarHBondContact NH2-O 3.42Å; R460-R656 VanDerWaalsContact CD-NH2 3.27Å; R460-R656 VanDerWaalsContact CZ-NH2 3.25Å; R460-R656 VanDerWaalsContact NE-NH2 3.15Å
461	A	84.8	Confident	84.1	Confident	35 Å²	35	22 Å²	22	29%	0.289	14%	0.139	S	C	.	.	H	α-helix	trans	-63.1	-42	179.3	0	0	0	0	0	112	P457 S458 S463 D464 Q465	P457-A461 PolarHBondContact O-N 2.86Å; S458-A461 PolarHBondContact O-N 2.64Å; A461-S463 VanDerWaalsContact C-N 3.33Å; A461-D464 PolarHBondContact O-N 3.46Å; A461-Q465 PolarHBondContact O-N 3.49Å
462	I	86.5	Confident	83.8	Confident	14 Å²	14	22.6 Å²	22.6	7%	0.072	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-42.5	175.7	-63.8	170.4	0	0	0	110.5	N148 L150 S458 L459 Q465 E466	N148-I462 HydrophobicContact CB-CG1 4.19Å; N148-I462 WeakPolarHBondContact O-CG1 3.34Å; L150-I462 HydrophobicContact CD2-CD1 3.5Å; L150-I462 VanDerWaalsContact CD2-CD1 3.5Å; L150-I462 HydrophobicContact CG-CD1 3.97Å; S458-I462 WeakPolarHBondContact O-CG1 3.36Å; S458-I462 PolarHBondContact O-N 3.16Å; L459-I462 PolarHBondContact O-N 3.46Å; I462-Q465 PolarHBondContact O-N 3.46Å; I462-E466 HydrophobicContact CG2-CG 4.2Å; I462-E466 WeakPolarHBondContact O-CB 3.47Å; I462-E466 WeakPolarHBondContact O-CG 3.48Å; I462-E466 PolarHBondContact O-N 3.25Å
463	S	86	Confident	83.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68	-36.9	178.3	172.6	0	0	0	0	113.8	L459 R460 A461 Q465 S467 Y472 M477	L459-S463 VanDerWaalsContact O-CB 3.31Å; L459-S463 WeakPolarHBondContact O-CB 3.18Å; L459-S463 PolarHBondContact O-N 2.95Å; R460-S463 PolarHBondContact O-N 3.4Å; A461-S463 VanDerWaalsContact C-N 3.33Å; S463-Q465 VanDerWaalsContact C-N 3.26Å; S463-Q465 PolarHBondContact O-N 2.86Å; S463-S467 WeakPolarHBondContact O-CB 3.4Å; S463-S467 PolarHBondContact O-N 3.33Å; S463-Y472 VanDerWaalsContact CA-OH 3.31Å; S463-Y472 WeakPolarHBondContact CA-OH 3.3Å; S463-Y472 WeakPolarHBondContact OG-CE2 3.08Å; S463-M477 WeakPolarHBondContact CB-SD 3.43Å; S463-M477 PolarHBondContact OG-SD 3.43Å
464	D	84.4	Confident	83.3	Confident	21 Å²	21	23.8 Å²	23.8	11%	0.112	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-41.7	173	-74.2	-39	0	0	0	110.9	R460 A461 Q468 K474 R656 I660	R460-D464 PolarHBondContact O-N 3.44Å; A461-D464 PolarHBondContact O-N 3.46Å; D464-Q468 VanDerWaalsContact O-CG 3.31Å; D464-Q468 WeakPolarHBondContact O-CG 3.27Å; D464-Q468 PolarHBondContact O-N 3.37Å; D464-K474 VanDerWaalsContact OD1-CD 3.3Å; D464-K474 WeakPolarHBondContact OD1-CD 3.48Å; D464-K474 WeakPolarHBondContact OD1-CE 3.38Å; D464-K474 IonicContact OD1-NZ 3.47Å; D464-K474 PolarHBondContact OD1-NZ 2.87Å; D464-R656 IonicContact OD1-CZ 2.94Å; D464-R656 IonicContact OD1-NE 3.59Å; D464-R656 PolarHBondContact OD1-NE 3.15Å; D464-R656 IonicContact OD1-NH2 3.71Å; D464-R656 IonicContact OD2-CZ 3.01Å; D464-R656 IonicContact OD2-NE 2.73Å; D464-R656 IonicContact OD2-NH2 3.77Å; D464-R656 PolarHBondContact OD2-NH2 3.29Å; D464-I660 VanDerWaalsContact OD1-CD1 3.32Å; D464-I660 WeakPolarHBondContact OD1-CD1 3.04Å
465	Q	81.4	Confident	83.3	Confident	21 Å²	21	23.3 Å²	23.3	10%	0.098	14%	0.138	C	C	.	.	H	α-helix	trans	-69.1	-54.6	176.3	177.3	177.3	-12.7	0	0	112.5	L143 A461 I462 S463 S467 Q468 D469	L143-Q465 HydrophobicContact CD1-CG 3.75Å; A461-Q465 PolarHBondContact O-N 3.49Å; I462-Q465 PolarHBondContact O-N 3.46Å; S463-Q465 VanDerWaalsContact C-N 3.26Å; S463-Q465 PolarHBondContact O-N 2.86Å; Q465-S467 PolarHBondContact O-N 3.04Å; Q465-Q468 WeakPolarHBondContact O-CB 3.08Å; Q465-Q468 PolarHBondContact O-N 3.34Å; Q465-D469 PolarHBondContact O-N 3.47Å; Q465-D469 VanDerWaalsContact O-N 3.11Å
466	E	83.3	Confident	83.4	Confident	14 Å²	14	23 Å²	23	7%	0.065	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-29.1	-177.1	-71.1	-180	168	0	0	112.2	R388 I462 D469 G470 L471 Y472	R388-E466 IonicContact CZ-OE1 3.51Å; R388-E466 VanDerWaalsContact CZ-OE1 3.24Å; R388-E466 IonicContact CZ-OE2 3.88Å; R388-E466 IonicContact NH1-OE1 3.52Å; R388-E466 PolarHBondContact NH1-OE1 3.46Å; R388-E466 IonicContact NH1-OE2 3.81Å; R388-E466 PolarHBondContact NH1-OE2 3.41Å; R388-E466 IonicContact NH2-OE1 3.03Å; R388-E466 PolarHBondContact NH2-OE1 3.29Å; R388-E466 IonicContact NH2-OE2 2.91Å; I462-E466 HydrophobicContact CG2-CG 4.2Å; I462-E466 WeakPolarHBondContact O-CB 3.47Å; I462-E466 WeakPolarHBondContact O-CG 3.48Å; I462-E466 PolarHBondContact O-N 3.25Å; E466-D469 PolarHBondContact O-N 3.44Å; E466-G470 PolarHBondContact O-N 2.73Å; E466-L471 HydrophobicContact CB-CD1 3.82Å; E466-L471 HydrophobicContact CG-CD1 4.01Å; E466-L471 WeakPolarHBondContact O-CB 3.47Å; E466-L471 PolarHBondContact O-N 3.45Å; E466-L471 VanDerWaalsContact O-N 3.12Å; E466-Y472 HydrophobicContact CB-CE1 3.58Å; E466-Y472 HydrophobicContact CG-CE1 4.39Å; E466-Y472 WeakPolarHBondContact OE2-CE1 3.48Å; E466-Y472 PolarHBondContact OE2-OH 3.4Å
467	S	82.1	Confident	83.3	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-73.9	-32.1	174.3	-166.8	0	0	0	0	113	S463 Q465 D469 G470 Y472	S463-S467 WeakPolarHBondContact O-CB 3.4Å; S463-S467 PolarHBondContact O-N 3.33Å; Q465-S467 PolarHBondContact O-N 3.04Å; S467-D469 VanDerWaalsContact C-N 3.27Å; S467-G470 PolarHBondContact O-N 2.85Å; S467-G470 VanDerWaalsContact O-N 3.1Å; S467-Y472 WeakPolarHBondContact CA-O 3.25Å; S467-Y472 VanDerWaalsContact CB-O 3.29Å; S467-Y472 WeakPolarHBondContact CB-O 3.36Å; S467-Y472 PolarHBondContact OG-O 3.45Å
468	Q	77.9	Confident	83.4	Confident	55 Å²	55	22.2 Å²	22.2	26%	0.257	13%	0.131	S	C	.	.	H	α-helix	trans	-66.8	-31.3	170	-75.6	175.5	-3.1	0	0	111.9	D464 Q465 G470	D464-Q468 VanDerWaalsContact O-CG 3.31Å; D464-Q468 WeakPolarHBondContact O-CG 3.27Å; D464-Q468 PolarHBondContact O-N 3.37Å; Q465-Q468 WeakPolarHBondContact O-CB 3.08Å; Q465-Q468 PolarHBondContact O-N 3.34Å; Q468-G470 PolarHBondContact O-N 2.89Å
469	D	75.1	Confident	83.6	Confident	9 Å²	9	21.3 Å²	21.3	5%	0.048	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-0.8	172.1	-60.5	-19.3	0	0	0	112.6	R112 Q217 K368 Q465 E466 S467 L471	R112-D469 IonicContact CZ-OD1 2.63Å; R112-D469 IonicContact NH2-OD1 2.63Å; R112-D469 PolarHBondContact NH2-OD1 3.04Å; Q217-D469 PolarHBondContact NE2-OD2 3.05Å; K368-D469 PolarHBondContact NZ-O 3.34Å; Q465-D469 PolarHBondContact O-N 3.47Å; Q465-D469 VanDerWaalsContact O-N 3.11Å; E466-D469 PolarHBondContact O-N 3.44Å; S467-D469 VanDerWaalsContact C-N 3.27Å; D469-L471 HydrophobicContact CB-CD1 4.24Å; D469-L471 PolarHBondContact O-N 3.34Å
470	G	75	Confident	83.6	Confident	39 Å²	39	20.6 Å²	20.6	40%	0.402	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	18.1	175.1	0	0	0	0	0	115.1	E466 S467 Q468	E466-G470 PolarHBondContact O-N 2.73Å; S467-G470 PolarHBondContact O-N 2.85Å; S467-G470 VanDerWaalsContact O-N 3.1Å; Q468-G470 PolarHBondContact O-N 2.89Å
471	L	78.4	Confident	83.7	Confident	14 Å²	14	19.5 Å²	19.5	7%	0.073	11%	0.113	C	C	.	.	S	Bend	trans	-70.8	-41.7	179.2	-73.7	150.2	0	0	0	112.4	T162 L165 A166 E466 D469	T162-L471 HydrophobicContact CG2-CD1 4.36Å; L165-L471 HydrophobicContact CB-CD2 4.01Å; A166-L471 HydrophobicContact CB-CD2 3.88Å; E466-L471 HydrophobicContact CB-CD1 3.82Å; E466-L471 HydrophobicContact CG-CD1 4.01Å; E466-L471 WeakPolarHBondContact O-CB 3.47Å; E466-L471 PolarHBondContact O-N 3.45Å; E466-L471 VanDerWaalsContact O-N 3.12Å; D469-L471 HydrophobicContact CB-CD1 4.24Å; D469-L471 PolarHBondContact O-N 3.34Å
472	Y	83.1	Confident	83.8	Confident	14 Å²	14	18.6 Å²	18.6	6%	0.055	10%	0.103	C	C	.	.			trans	-159.2	166.9	179.2	56.2	-91.6	0	0	0	111.6	L165 M385 S463 E466 S467 Q476 M477	L165-Y472 HydrophobicContact CD1-CD1 4.29Å; L165-Y472 HydrophobicContact CD1-CE1 4.35Å; M385-Y472 HydrophobicContact CE-CD1 3.86Å; M385-Y472 HydrophobicContact CE-CD2 4.49Å; M385-Y472 HydrophobicContact CE-CE1 3.27Å; M385-Y472 HydrophobicContact CE-CE2 3.98Å; M385-Y472 HydrophobicContact CE-CG 4.43Å; M385-Y472 WeakPolarHBondContact CE-OH 3.25Å; M385-Y472 HydrophobicContact SD-CD1 4.03Å; M385-Y472 HydrophobicContact SD-CD2 3.9Å; M385-Y472 HydrophobicContact SD-CE1 3.91Å; M385-Y472 HydrophobicContact SD-CE2 3.77Å; M385-Y472 HydrophobicContact SD-CG 4.02Å; S463-Y472 VanDerWaalsContact CA-OH 3.31Å; S463-Y472 WeakPolarHBondContact CA-OH 3.3Å; S463-Y472 WeakPolarHBondContact OG-CE2 3.08Å; E466-Y472 HydrophobicContact CB-CE1 3.58Å; E466-Y472 HydrophobicContact CG-CE1 4.39Å; E466-Y472 WeakPolarHBondContact OE2-CE1 3.48Å; E466-Y472 PolarHBondContact OE2-OH 3.4Å; S467-Y472 WeakPolarHBondContact CA-O 3.25Å; S467-Y472 VanDerWaalsContact CB-O 3.29Å; S467-Y472 WeakPolarHBondContact CB-O 3.36Å; S467-Y472 PolarHBondContact OG-O 3.45Å; Y472-Q476 VanDerWaalsContact CB-OE1 3.27Å; Y472-M477 HydrophobicContact CE2-CB 4.02Å
473	S	83.4	Confident	83.8	Confident	44 Å²	44	21.1 Å²	21.1	31%	0.308	12%	0.119	S	C	.	.			trans	-88.1	146.6	174.1	-53.7	0	0	0	0	111.4	W475 Q476	S473-W475 VanDerWaalsContact CB-NE1 3.32Å; S473-W475 PolarHBondContact O-N 3.27Å; S473-W475 VanDerWaalsContact O-N 3.13Å; S473-Q476 WeakPolarHBondContact O-CB 3.48Å; S473-Q476 PolarHBondContact O-N 3.17Å
474	K	86.2	Confident	83.8	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.017	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-29.6	-174.7	-70	174.5	-156.2	-167	0	114.3	D464 Q476 M477 F478 F653 R656 D657 I660	D464-K474 VanDerWaalsContact OD1-CD 3.3Å; D464-K474 WeakPolarHBondContact OD1-CD 3.48Å; D464-K474 WeakPolarHBondContact OD1-CE 3.38Å; D464-K474 IonicContact OD1-NZ 3.47Å; D464-K474 PolarHBondContact OD1-NZ 2.87Å; K474-Q476 PolarHBondContact O-N 3.07Å; K474-M477 PolarHBondContact O-N 3.49Å; K474-F478 PolarHBondContact O-N 2.82Å; K474-F653 HydrophobicContact CB-CB 4.33Å; K474-F653 HydrophobicContact CB-CD1 4.17Å; K474-R656 HydrophobicContact CD-CG 4.37Å; K474-D657 VanDerWaalsContact CB-OD1 3.31Å; K474-D657 WeakPolarHBondContact CB-OD1 3.18Å; K474-D657 WeakPolarHBondContact CD-OD1 3.47Å; K474-D657 WeakPolarHBondContact CE-OD1 3.31Å; K474-D657 WeakPolarHBondContact CG-OD1 3.45Å; K474-D657 PolarHBondContact N-OD2 2.94Å; K474-I660 VanDerWaalsContact NZ-CD1 3.32Å
475	W	85	Confident	83.8	Confident	55 Å²	55	20.6 Å²	20.6	21%	0.208	12%	0.116	C	C	.	.	H	α-helix	trans	-64	-27.2	175.4	73.3	-93.5	0	0	0	113	S473 F478 L479 F653 R654	S473-W475 VanDerWaalsContact CB-NE1 3.32Å; S473-W475 PolarHBondContact O-N 3.27Å; S473-W475 VanDerWaalsContact O-N 3.13Å; W475-F478 PolarHBondContact O-N 3.38Å; W475-L479 HydrophobicContact CZ3-CD2 4.23Å; W475-L479 PolarHBondContact O-N 3.39Å; W475-F653 HydrophobicContact CB-CB 4.38Å; W475-R654 HydrophobicContact CB-CG 4.38Å; W475-R654 HydrophobicContact CG-CG 4.45Å
476	Q	86.1	Confident	84.2	Confident	12 Å²	12	22.9 Å²	22.9	6%	0.056	13%	0.128	C	C	.	.	H	α-helix	trans	-70.2	-39.4	177.6	-63.1	175.4	-59.3	0	0	110.8	L382 Y472 S473 K474 L479 A480	L382-Q476 WeakPolarHBondContact CD1-O 3.38Å; Y472-Q476 VanDerWaalsContact CB-OE1 3.27Å; S473-Q476 WeakPolarHBondContact O-CB 3.48Å; S473-Q476 PolarHBondContact O-N 3.17Å; K474-Q476 PolarHBondContact O-N 3.07Å; Q476-L479 PolarHBondContact O-N 3.12Å; Q476-A480 WeakPolarHBondContact O-CB 3.48Å; Q476-A480 PolarHBondContact O-N 3.24Å
477	M	86	Confident	84.5	Confident	10 Å²	10	26.1 Å²	26.1	5%	0.049	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-45.8	171.5	177.6	-144.1	54.7	0	0	110.9	M385 F456 S463 Y472 K474 L479 A480 Y481 F653	M385-M477 HydrophobicContact SD-CB 4.4Å; F456-M477 HydrophobicContact CE2-CE 3.86Å; F456-M477 HydrophobicContact CZ-CE 3.55Å; S463-M477 WeakPolarHBondContact CB-SD 3.43Å; S463-M477 PolarHBondContact OG-SD 3.43Å; Y472-M477 HydrophobicContact CE2-CB 4.02Å; K474-M477 PolarHBondContact O-N 3.49Å; M477-L479 VanDerWaalsContact C-N 3.32Å; M477-L479 PolarHBondContact O-N 3.36Å; M477-A480 PolarHBondContact O-N 3.07Å; M477-Y481 WeakPolarHBondContact O-CB 3.42Å; M477-Y481 PolarHBondContact O-N 3.05Å; M477-F653 HydrophobicContact CE-CD1 4.27Å; M477-F653 HydrophobicContact CE-CE1 3.88Å; M477-F653 HydrophobicContact CE-CZ 4.49Å
478	F	89.2	Confident	84.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.8	-46.1	177.8	171.4	-108.4	0	0	0	111.9	K474 W475 Y481 I482 V532 V646 M650 F653	K474-F478 PolarHBondContact O-N 2.82Å; W475-F478 PolarHBondContact O-N 3.38Å; F478-Y481 WeakPolarHBondContact O-CB 3.49Å; F478-Y481 PolarHBondContact O-N 2.71Å; F478-I482 HydrophobicContact CD1-CD1 3.86Å; F478-I482 HydrophobicContact CD2-CD1 4.37Å; F478-I482 HydrophobicContact CE1-CD1 3.3Å; F478-I482 HydrophobicContact CE1-CG1 4.42Å; F478-I482 HydrophobicContact CE2-CD1 3.89Å; F478-I482 HydrophobicContact CE2-CG1 4.23Å; F478-I482 HydrophobicContact CG-CD1 4.37Å; F478-I482 HydrophobicContact CZ-CD1 3.33Å; F478-I482 HydrophobicContact CZ-CG1 4.14Å; F478-I482 WeakPolarHBondContact O-CG1 3.5Å; F478-I482 PolarHBondContact O-N 3.46Å; F478-V532 HydrophobicContact CD2-CG1 3.58Å; F478-V532 HydrophobicContact CE2-CB 4.3Å; F478-V532 HydrophobicContact CE2-CG1 3.55Å; F478-V646 HydrophobicContact CE1-CG1 4.5Å; F478-V646 WeakPolarHBondContact CE1-O 3.34Å; F478-M650 HydrophobicContact CD1-CG 4.22Å; F478-M650 HydrophobicContact CE1-CG 4.26Å; F478-F653 HydrophobicContact CB-CD2 3.66Å; F478-F653 HydrophobicContact CB-CE2 4.03Å; F478-F653 HydrophobicContact CB-CG 4.05Å; F478-F653 HydrophobicContact CD1-CD2 4.31Å; F478-F653 AromaticContact CD2-CD2 3.71Å; F478-F653 HydrophobicContact CD2-CD2 3.71Å; F478-F653 AromaticContact CD2-CE2 3.43Å; F478-F653 HydrophobicContact CD2-CE2 3.43Å; F478-F653 VanDerWaalsContact CD2-CE2 3.43Å; F478-F653 HydrophobicContact CD2-CZ 4.35Å; F478-F653 HydrophobicContact CE2-CD2 4.43Å; F478-F653 HydrophobicContact CE2-CE2 4.07Å; F478-F653 AromaticContact CG-CD2 3.63Å; F478-F653 HydrophobicContact CG-CD2 3.63Å; F478-F653 AromaticContact CG-CE2 3.86Å; F478-F653 HydrophobicContact CG-CE2 3.86Å; F478-F653 HydrophobicContact CG-CG 4.48Å
479	L	87.8	Confident	85.5	Confident	44 Å²	44	25.9 Å²	25.9	23%	0.23	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-42.7	177.8	-170.6	62.3	0	0	0	112.1	L382 W475 Q476 M477 Y481 I482 V483	L382-L479 HydrophobicContact CD1-CB 3.91Å; L382-L479 HydrophobicContact CD1-CD2 3.92Å; L382-L479 HydrophobicContact CD1-CG 4.04Å; L382-L479 HydrophobicContact CD2-CD2 3.74Å; L382-L479 HydrophobicContact CD2-CG 4.31Å; W475-L479 HydrophobicContact CZ3-CD2 4.23Å; W475-L479 PolarHBondContact O-N 3.39Å; Q476-L479 PolarHBondContact O-N 3.12Å; M477-L479 VanDerWaalsContact C-N 3.32Å; M477-L479 PolarHBondContact O-N 3.36Å; L479-Y481 VanDerWaalsContact C-N 3.25Å; L479-Y481 PolarHBondContact O-N 2.77Å; L479-I482 PolarHBondContact O-N 2.92Å; L479-V483 WeakPolarHBondContact O-CG2 3.43Å; L479-V483 PolarHBondContact O-N 3.27Å; L479-V483 VanDerWaalsContact O-N 3.14Å
480	A	87	Confident	86.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-36.9	176.1	0	0	0	0	0	112	L382 M385 Q476 M477 H484	L382-A480 HydrophobicContact CD1-CB 4.14Å; M385-A480 HydrophobicContact CB-CB 3.98Å; Q476-A480 WeakPolarHBondContact O-CB 3.48Å; Q476-A480 PolarHBondContact O-N 3.24Å; M477-A480 PolarHBondContact O-N 3.07Å; A480-H484 VanDerWaalsContact O-CB 3.31Å; A480-H484 WeakPolarHBondContact O-CB 3.38Å; A480-H484 PolarHBondContact O-N 3.24Å
481	Y	87.9	Confident	87.2	Confident	3 Å²	3	30.4 Å²	30.4	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-45	175.4	178.5	-107.9	0	0	0	111.8	L455 F456 L459 M477 F478 L479 V483 H484 I485 E528 V532	L455-Y481 HydrophobicContact CD2-CE2 4.2Å; F456-Y481 AromaticContact CD2-CD1 3.75Å; F456-Y481 HydrophobicContact CD2-CD1 3.75Å; F456-Y481 HydrophobicContact CD2-CD2 4.12Å; F456-Y481 AromaticContact CD2-CE1 3.67Å; F456-Y481 HydrophobicContact CD2-CE1 3.67Å; F456-Y481 HydrophobicContact CD2-CE2 4.07Å; F456-Y481 AromaticContact CD2-CG 3.98Å; F456-Y481 HydrophobicContact CD2-CG 3.98Å; F456-Y481 AromaticContact CD2-CZ 3.86Å; F456-Y481 AromaticContact CE2-CD1 3.89Å; F456-Y481 HydrophobicContact CE2-CD1 3.89Å; F456-Y481 HydrophobicContact CE2-CE1 4.24Å; F456-Y481 HydrophobicContact CE2-CG 4.1Å; F456-Y481 HydrophobicContact CG-CE1 4.5Å; L459-Y481 HydrophobicContact CD2-CD2 4.23Å; M477-Y481 WeakPolarHBondContact O-CB 3.42Å; M477-Y481 PolarHBondContact O-N 3.05Å; F478-Y481 WeakPolarHBondContact O-CB 3.49Å; F478-Y481 PolarHBondContact O-N 2.71Å; L479-Y481 VanDerWaalsContact C-N 3.25Å; L479-Y481 PolarHBondContact O-N 2.77Å; Y481-V483 PolarHBondContact O-N 2.94Å; Y481-H484 WeakPolarHBondContact O-CB 3.21Å; Y481-H484 PolarHBondContact O-N 3.43Å; Y481-I485 HydrophobicContact CD1-CD1 3.36Å; Y481-I485 HydrophobicContact CD1-CG1 4.39Å; Y481-I485 HydrophobicContact CD2-CD1 4.14Å; Y481-I485 HydrophobicContact CD2-CG1 4.36Å; Y481-I485 HydrophobicContact CE1-CD1 2.98Å; Y481-I485 HydrophobicContact CE1-CG1 4.05Å; Y481-I485 HydrophobicContact CE2-CD1 3.84Å; Y481-I485 HydrophobicContact CE2-CG1 4.02Å; Y481-I485 HydrophobicContact CG-CD1 3.92Å; Y481-I485 WeakPolarHBondContact O-CD1 3.36Å; Y481-I485 VanDerWaalsContact O-CG1 3.25Å; Y481-I485 WeakPolarHBondContact O-CG1 3.46Å; Y481-I485 PolarHBondContact O-N 3.38Å; Y481-E528 PolarHBondContact OH-OE1 2.91Å; Y481-V532 HydrophobicContact CD1-CG1 4.23Å; Y481-V532 HydrophobicContact CD1-CG2 4.2Å; Y481-V532 HydrophobicContact CE1-CB 4.4Å; Y481-V532 HydrophobicContact CE1-CG1 4.22Å; Y481-V532 HydrophobicContact CE1-CG2 3.39Å
482	I	88.1	Confident	87.9	Confident	16 Å²	16	29.8 Å²	29.8	8%	0.082	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-49.8	177	-65.8	165	0	0	0	111.7	F478 L479 H484 I485 L486 L529 V646	F478-I482 HydrophobicContact CD1-CD1 3.86Å; F478-I482 HydrophobicContact CD2-CD1 4.37Å; F478-I482 HydrophobicContact CE1-CD1 3.3Å; F478-I482 HydrophobicContact CE1-CG1 4.42Å; F478-I482 HydrophobicContact CE2-CD1 3.89Å; F478-I482 HydrophobicContact CE2-CG1 4.23Å; F478-I482 HydrophobicContact CG-CD1 4.37Å; F478-I482 HydrophobicContact CZ-CD1 3.33Å; F478-I482 HydrophobicContact CZ-CG1 4.14Å; F478-I482 WeakPolarHBondContact O-CG1 3.5Å; F478-I482 PolarHBondContact O-N 3.46Å; L479-I482 PolarHBondContact O-N 2.92Å; I482-H484 PolarHBondContact O-N 3.34Å; I482-I485 PolarHBondContact O-N 3.1Å; I482-L486 HydrophobicContact CG2-CD1 4.4Å; I482-L486 WeakPolarHBondContact O-CG 3.36Å; I482-L486 PolarHBondContact O-N 3.11Å; I482-L529 HydrophobicContact CD1-CD2 4.06Å; I482-L529 HydrophobicContact CG1-CD2 3.69Å; I482-L529 HydrophobicContact CG2-CD2 4.4Å; I482-V646 HydrophobicContact CD1-CB 4.45Å; I482-V646 HydrophobicContact CD1-CG1 4.03Å; I482-V646 HydrophobicContact CD1-CG2 3.9Å
483	V	87.1	Confident	88.3	Confident	66 Å²	66	29.2 Å²	29.2	40%	0.4	16%	0.16	S	C	.	.	H	α-helix	trans	-61.4	-34.3	-178.4	179	0	0	0	0	110.8	F386 L479 Y481 P487	F386-V483 HydrophobicContact CD2-CB 4.11Å; F386-V483 HydrophobicContact CD2-CG1 3.85Å; F386-V483 HydrophobicContact CE2-CB 4.14Å; F386-V483 HydrophobicContact CE2-CG1 3.57Å; F386-V483 HydrophobicContact CZ-CG1 4.19Å; L479-V483 WeakPolarHBondContact O-CG2 3.43Å; L479-V483 PolarHBondContact O-N 3.27Å; L479-V483 VanDerWaalsContact O-N 3.14Å; Y481-V483 PolarHBondContact O-N 2.94Å; V483-P487 WeakPolarHBondContact O-CD 3.48Å
484	H	84.4	Confident	88.8	Confident	5 Å²	5	30.1 Å²	30.1	2%	0.023	16%	0.164	C	C	.	.	H	α-helix	trans	-71.9	-35.4	177.8	173.4	52.5	0	0	0	114	F386 T389 V390 L393 A480 Y481 I482 P487 F488	F386-H484 HydrophobicContact CD2-CB 4.28Å; F386-H484 HydrophobicContact CE2-CB 4.12Å; T389-H484 HydrophobicContact CG2-CB 4.38Å; V390-H484 WeakPolarHBondContact CG2-ND1 3.47Å; L393-H484 VanDerWaalsContact CB-CE1 3.48Å; L393-H484 WeakPolarHBondContact CB-CE1 3.48Å; L393-H484 WeakPolarHBondContact CB-NE2 3.32Å; L393-H484 WeakPolarHBondContact CD2-CE1 3.17Å; L393-H484 WeakPolarHBondContact CD2-NE2 3.31Å; A480-H484 VanDerWaalsContact O-CB 3.31Å; A480-H484 WeakPolarHBondContact O-CB 3.38Å; A480-H484 PolarHBondContact O-N 3.24Å; Y481-H484 WeakPolarHBondContact O-CB 3.21Å; Y481-H484 PolarHBondContact O-N 3.43Å; I482-H484 PolarHBondContact O-N 3.34Å; H484-P487 WeakPolarHBondContact O-CD 3.4Å; H484-F488 AromaticContact CE1-CE2 3.59Å; H484-F488 AromaticContact ND1-CE2 3.93Å; H484-F488 WeakPolarHBondContact O-CD2 3.3Å
485	I	85.6	Confident	89.2	Confident	6 Å²	6	33 Å²	33	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-69.3	-44.1	-178.2	-74.5	160.8	0	0	0	112.7	Y481 I482 P487 F488 S489 E528	Y481-I485 HydrophobicContact CD1-CD1 3.36Å; Y481-I485 HydrophobicContact CD1-CG1 4.39Å; Y481-I485 HydrophobicContact CD2-CD1 4.14Å; Y481-I485 HydrophobicContact CD2-CG1 4.36Å; Y481-I485 HydrophobicContact CE1-CD1 2.98Å; Y481-I485 HydrophobicContact CE1-CG1 4.05Å; Y481-I485 HydrophobicContact CE2-CD1 3.84Å; Y481-I485 HydrophobicContact CE2-CG1 4.02Å; Y481-I485 HydrophobicContact CG-CD1 3.92Å; Y481-I485 WeakPolarHBondContact O-CD1 3.36Å; Y481-I485 VanDerWaalsContact O-CG1 3.25Å; Y481-I485 WeakPolarHBondContact O-CG1 3.46Å; Y481-I485 PolarHBondContact O-N 3.38Å; I482-I485 PolarHBondContact O-N 3.1Å; I485-P487 VanDerWaalsContact C-CD 3.49Å; I485-F488 PolarHBondContact O-N 3.23Å; I485-S489 VanDerWaalsContact CG2-OG 3.25Å; I485-S489 WeakPolarHBondContact CG2-OG 3.15Å; I485-S489 PolarHBondContact O-N 3.5Å; I485-S489 PolarHBondContact O-OG 3.45Å; I485-E528 HydrophobicContact CD1-CG 4.24Å; I485-E528 WeakPolarHBondContact CG2-OE2 3.5Å
486	L	89.1	Confident	89.6	Confident	69 Å²	69	30.6 Å²	30.6	36%	0.361	17%	0.169	S	C	.	.	H	α-helix	trans	-51	-46.6	-166.6	-71.9	169.9	0	0	0	113.6	I482 F488 S489 V490 I525	I482-L486 HydrophobicContact CG2-CD1 4.4Å; I482-L486 WeakPolarHBondContact O-CG 3.36Å; I482-L486 PolarHBondContact O-N 3.11Å; L486-F488 PolarHBondContact O-N 3.06Å; L486-S489 PolarHBondContact O-N 3.49Å; L486-V490 WeakPolarHBondContact O-CB 3.43Å; L486-V490 WeakPolarHBondContact O-CG2 3.44Å; L486-V490 PolarHBondContact O-N 3.44Å; L486-I525 HydrophobicContact CD2-CD1 3.78Å; L486-I525 HydrophobicContact CD2-CG1 4.44Å; L486-I525 HydrophobicContact CD2-CG2 4.29Å
487	P	90.4	Very high	89.9	Confident	82 Å²	82	30 Å²	30	53%	0.532	17%	0.167	S	C	.	.	H	α-helix	trans	-61.3	-40.3	179.6	-23.3	34.7	0	0	0	113.6	V483 H484 I485 L491	V483-P487 WeakPolarHBondContact O-CD 3.48Å; H484-P487 WeakPolarHBondContact O-CD 3.4Å; I485-P487 VanDerWaalsContact C-CD 3.49Å; P487-L491 VanDerWaalsContact O-CB 3.31Å; P487-L491 WeakPolarHBondContact O-CB 3.44Å; P487-L491 PolarHBondContact O-N 2.92Å
488	F	89.8	Confident	90.2	Very high	49 Å²	49	32.3 Å²	32.3	22%	0.215	18%	0.184	C	C	.	.	H	α-helix	trans	-73.8	-39.8	-178.4	-66.7	-82.1	0	0	0	111.8	L393 V400 H484 I485 L486 L491 S492	L393-F488 HydrophobicContact CD2-CD2 4.03Å; L393-F488 HydrophobicContact CD2-CE1 4.36Å; L393-F488 HydrophobicContact CD2-CE2 3.74Å; L393-F488 HydrophobicContact CD2-CG 4.48Å; L393-F488 HydrophobicContact CD2-CZ 3.91Å; V400-F488 HydrophobicContact CG1-CE1 4.21Å; V400-F488 HydrophobicContact CG2-CE1 4.39Å; H484-F488 AromaticContact CE1-CE2 3.59Å; H484-F488 AromaticContact ND1-CE2 3.93Å; H484-F488 WeakPolarHBondContact O-CD2 3.3Å; I485-F488 PolarHBondContact O-N 3.23Å; L486-F488 PolarHBondContact O-N 3.06Å; F488-L491 PolarHBondContact O-N 2.81Å; F488-S492 VanDerWaalsContact O-CB 3.27Å; F488-S492 WeakPolarHBondContact O-CB 3.44Å; F488-S492 PolarHBondContact O-N 2.9Å
489	S	90.8	Very high	90.3	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-69.9	-39.6	179.1	-63.9	0	0	0	0	111.3	R403 I485 L486 S492 V493 E528	R403-S489 PolarHBondContact NH2-OG 3.05Å; I485-S489 VanDerWaalsContact CG2-OG 3.25Å; I485-S489 WeakPolarHBondContact CG2-OG 3.15Å; I485-S489 PolarHBondContact O-N 3.5Å; I485-S489 PolarHBondContact O-OG 3.45Å; L486-S489 PolarHBondContact O-N 3.49Å; S489-S492 PolarHBondContact O-N 2.99Å; S489-V493 VanDerWaalsContact O-CG2 3.31Å; S489-V493 WeakPolarHBondContact O-CG2 3.39Å; S489-V493 PolarHBondContact O-N 3.1Å; S489-E528 PolarHBondContact OG-OE2 3.4Å; S489-E528 VanDerWaalsContact OG-OE2 3.05Å
490	V	93.1	Very high	90.4	Very high	58 Å²	58	32.5 Å²	32.5	35%	0.352	18%	0.183	S	C	.	.	H	α-helix	trans	-61.3	-48.7	171.6	172	0	0	0	0	110.9	L486 S492 V493 V494 L521	L486-V490 WeakPolarHBondContact O-CB 3.43Å; L486-V490 WeakPolarHBondContact O-CG2 3.44Å; L486-V490 PolarHBondContact O-N 3.44Å; V490-S492 PolarHBondContact O-N 3.25Å; V490-V493 PolarHBondContact O-N 3.39Å; V490-V494 HydrophobicContact CG1-CG2 4.3Å; V490-V494 VanDerWaalsContact O-CG2 3.26Å; V490-V494 WeakPolarHBondContact O-CG2 3.31Å; V490-V494 PolarHBondContact O-N 3.39Å; V490-L521 HydrophobicContact CB-CD1 4.4Å; V490-L521 HydrophobicContact CG2-CD1 3.87Å; V490-L521 HydrophobicContact CG2-CD2 4Å
491	L	93.4	Very high	90.6	Very high	86 Å²	86	32.6 Å²	32.6	45%	0.45	18%	0.183	S	C	.	.	H	α-helix	trans	-60.7	-44.3	179.3	-178	61.6	0	0	0	112	L404 P487 F488 V493 V494 I495	L404-L491 HydrophobicContact CD2-CB 4.37Å; L404-L491 HydrophobicContact CD2-CD2 4.03Å; L404-L491 HydrophobicContact CD2-CG 4.16Å; P487-L491 VanDerWaalsContact O-CB 3.31Å; P487-L491 WeakPolarHBondContact O-CB 3.44Å; P487-L491 PolarHBondContact O-N 2.92Å; F488-L491 PolarHBondContact O-N 2.81Å; L491-V493 PolarHBondContact O-N 3.25Å; L491-V494 PolarHBondContact O-N 2.87Å; L491-I495 HydrophobicContact CD1-CD1 4.1Å; L491-I495 HydrophobicContact CD1-CG1 4.42Å; L491-I495 HydrophobicContact CG-CD1 3.96Å; L491-I495 WeakPolarHBondContact O-CD1 3.15Å; L491-I495 VanDerWaalsContact O-CG1 3.26Å; L491-I495 WeakPolarHBondContact O-CG1 3.06Å; L491-I495 PolarHBondContact O-N 3.09Å
492	S	91.8	Very high	90.7	Very high	1 Å²	1	39 Å²	39	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-43.4	178.6	-170.9	0	0	0	0	112.1	R403 N407 F488 S489 V490 F496	R403-S492 PolarHBondContact O-OG 3.27Å; N407-S492 PolarHBondContact ND2-OG 2.89Å; F488-S492 VanDerWaalsContact O-CB 3.27Å; F488-S492 WeakPolarHBondContact O-CB 3.44Å; F488-S492 PolarHBondContact O-N 2.9Å; S489-S492 PolarHBondContact O-N 2.99Å; V490-S492 PolarHBondContact O-N 3.25Å; S492-F496 WeakPolarHBondContact O-CB 3.19Å; S492-F496 PolarHBondContact O-N 2.98Å
493	V	93.2	Very high	90.7	Very high	2 Å²	2	41 Å²	41	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-68.7	-40.8	177.9	172	0	0	0	0	111.6	S489 V490 L491 I495 F496 S497 T517 V520 L521 H524	S489-V493 VanDerWaalsContact O-CG2 3.31Å; S489-V493 WeakPolarHBondContact O-CG2 3.39Å; S489-V493 PolarHBondContact O-N 3.1Å; V490-V493 PolarHBondContact O-N 3.39Å; L491-V493 PolarHBondContact O-N 3.25Å; V493-I495 PolarHBondContact O-N 3.4Å; V493-F496 PolarHBondContact O-N 3.01Å; V493-S497 WeakPolarHBondContact O-CB 3.31Å; V493-S497 PolarHBondContact O-N 3.48Å; V493-S497 PolarHBondContact O-OG 3.37Å; V493-S497 VanDerWaalsContact O-OG 3.07Å; V493-T517 HydrophobicContact CG1-CG2 4.37Å; V493-V520 HydrophobicContact CG1-CB 4.34Å; V493-V520 HydrophobicContact CG1-CG1 3.96Å; V493-L521 HydrophobicContact CB-CD1 4.06Å; V493-L521 HydrophobicContact CG1-CB 4.16Å; V493-L521 HydrophobicContact CG1-CD1 4.37Å; V493-L521 HydrophobicContact CG2-CD1 4Å; V493-H524 HydrophobicContact CG2-CB 3.88Å
494	V	93.9	Very high	90.6	Very high	63 Å²	63	37.8 Å²	37.8	38%	0.382	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-43.7	177.3	169.9	0	0	0	0	111.2	V490 L491 S497 S498 T517	V490-V494 HydrophobicContact CG1-CG2 4.3Å; V490-V494 VanDerWaalsContact O-CG2 3.26Å; V490-V494 WeakPolarHBondContact O-CG2 3.31Å; V490-V494 PolarHBondContact O-N 3.39Å; L491-V494 PolarHBondContact O-N 2.87Å; V494-S497 WeakPolarHBondContact CA-OG 3.25Å; V494-S497 PolarHBondContact O-OG 3.44Å; V494-S497 VanDerWaalsContact O-OG 3.12Å; V494-S498 WeakPolarHBondContact O-CB 3.39Å; V494-S498 PolarHBondContact O-N 3.34Å; V494-T517 HydrophobicContact CG2-CG2 3.98Å
495	I	93.3	Very high	90.6	Very high	64 Å²	64	38.6 Å²	38.6	33%	0.328	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-47	175.9	-68.6	165.7	0	0	0	110.3	L408 L491 V493 F499	L408-I495 HydrophobicContact CD1-CG2 4.25Å; L408-I495 HydrophobicContact CD2-CG2 4.26Å; L491-I495 HydrophobicContact CD1-CD1 4.1Å; L491-I495 HydrophobicContact CD1-CG1 4.42Å; L491-I495 HydrophobicContact CG-CD1 3.96Å; L491-I495 WeakPolarHBondContact O-CD1 3.15Å; L491-I495 VanDerWaalsContact O-CG1 3.26Å; L491-I495 WeakPolarHBondContact O-CG1 3.06Å; L491-I495 PolarHBondContact O-N 3.09Å; V493-I495 PolarHBondContact O-N 3.4Å; I495-F499 WeakPolarHBondContact O-CB 3.27Å; I495-F499 PolarHBondContact O-N 2.84Å; I495-F499 VanDerWaalsContact O-N 3.08Å
496	F	93.1	Very high	90.4	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-48.7	178.2	165.1	-105	0	0	0	112.8	N407 Y410 S492 V493 S498 F499 I500 V520	N407-F496 HydrophobicContact CB-CB 3.84Å; N407-F496 HydrophobicContact CB-CG 4.21Å; N407-F496 WeakPolarHBondContact O-CD2 3.14Å; Y410-F496 HydrophobicContact CD1-CE2 4.06Å; Y410-F496 HydrophobicContact CD1-CZ 4.37Å; S492-F496 WeakPolarHBondContact O-CB 3.19Å; S492-F496 PolarHBondContact O-N 2.98Å; V493-F496 PolarHBondContact O-N 3.01Å; F496-S498 VanDerWaalsContact C-N 3.34Å; F496-S498 PolarHBondContact O-N 2.97Å; F496-F499 PolarHBondContact O-N 3.32Å; F496-F499 VanDerWaalsContact O-N 3.15Å; F496-I500 HydrophobicContact CE1-CG2 4.28Å; F496-I500 HydrophobicContact CE2-CB 4.34Å; F496-I500 HydrophobicContact CE2-CG2 4.38Å; F496-I500 HydrophobicContact CZ-CG2 4.14Å; F496-I500 WeakPolarHBondContact O-CG2 3.32Å; F496-I500 PolarHBondContact O-N 2.83Å; F496-V520 HydrophobicContact CD1-CG1 4.22Å; F496-V520 HydrophobicContact CE1-CG1 4.02Å
497	S	92.2	Very high	90.2	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-40.7	-179.8	60.5	0	0	0	0	111.4	V493 V494 F499 Y501 T517	V493-S497 WeakPolarHBondContact O-CB 3.31Å; V493-S497 PolarHBondContact O-N 3.48Å; V493-S497 PolarHBondContact O-OG 3.37Å; V493-S497 VanDerWaalsContact O-OG 3.07Å; V494-S497 WeakPolarHBondContact CA-OG 3.25Å; V494-S497 PolarHBondContact O-OG 3.44Å; V494-S497 VanDerWaalsContact O-OG 3.12Å; S497-F499 PolarHBondContact O-N 3.47Å; S497-Y501 WeakPolarHBondContact O-CB 3.45Å; S497-Y501 PolarHBondContact O-N 3.34Å; S497-T517 VanDerWaalsContact CB-OG1 3.27Å; S497-T517 WeakPolarHBondContact CB-OG1 2.83Å; S497-T517 WeakPolarHBondContact OG-CG2 3.44Å; S497-T517 PolarHBondContact OG-OG1 3Å
498	S	92.4	Very high	89.7	Confident	59 Å²	59	37.9 Å²	37.9	41%	0.413	21%	0.207	S	C	.	.	H	α-helix	trans	-67.4	-23.7	176.8	-173.3	0	0	0	0	112.7	V494 F496	V494-S498 WeakPolarHBondContact O-CB 3.39Å; V494-S498 PolarHBondContact O-N 3.34Å; F496-S498 VanDerWaalsContact C-N 3.34Å; F496-S498 PolarHBondContact O-N 2.97Å
499	F	91.8	Very high	89.7	Confident	47 Å²	47	38.7 Å²	38.7	21%	0.206	21%	0.214	C	C	.	.	H	α-helix	trans	-81.3	-59	173.2	178	-101	0	0	0	110.2	L408 F412 A415 I495 F496 S497 Y501 T503	L408-F499 HydrophobicContact CD1-CB 3.95Å; L408-F499 HydrophobicContact CD1-CD1 4.14Å; L408-F499 HydrophobicContact CD1-CD2 4.42Å; L408-F499 HydrophobicContact CD1-CG 3.89Å; F412-F499 AromaticContact CD1-CE1 3.73Å; F412-F499 HydrophobicContact CD1-CE1 3.73Å; F412-F499 AromaticContact CD1-CE2 3.98Å; F412-F499 HydrophobicContact CD1-CE2 3.98Å; F412-F499 AromaticContact CD1-CZ 3.24Å; F412-F499 HydrophobicContact CD1-CZ 3.24Å; F412-F499 HydrophobicContact CE1-CD2 4.38Å; F412-F499 HydrophobicContact CE1-CE1 4.01Å; F412-F499 AromaticContact CE1-CE2 3.39Å; F412-F499 HydrophobicContact CE1-CE2 3.39Å; F412-F499 AromaticContact CE1-CZ 3.17Å; F412-F499 HydrophobicContact CE1-CZ 3.17Å; F412-F499 HydrophobicContact CG-CE1 4.04Å; F412-F499 HydrophobicContact CG-CZ 4.01Å; F412-F499 HydrophobicContact CZ-CD2 4.38Å; F412-F499 AromaticContact CZ-CE2 3.79Å; F412-F499 HydrophobicContact CZ-CE2 3.79Å; F412-F499 AromaticContact CZ-CZ 3.9Å; F412-F499 HydrophobicContact CZ-CZ 3.9Å; A415-F499 HydrophobicContact CB-CE1 3.87Å; A415-F499 HydrophobicContact CB-CZ 4.3Å; I495-F499 WeakPolarHBondContact O-CB 3.27Å; I495-F499 PolarHBondContact O-N 2.84Å; I495-F499 VanDerWaalsContact O-N 3.08Å; F496-F499 PolarHBondContact O-N 3.32Å; F496-F499 VanDerWaalsContact O-N 3.15Å; S497-F499 PolarHBondContact O-N 3.47Å; F499-Y501 PolarHBondContact O-N 2.89Å; F499-T503 HydrophobicContact CZ-CG2 4.48Å; F499-T503 WeakPolarHBondContact O-CB 3.16Å; F499-T503 PolarHBondContact O-N 3.35Å; F499-T503 VanDerWaalsContact O-N 3.07Å; F499-T503 PolarHBondContact O-OG1 3.35Å
500	I	90.4	Very high	89.5	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-41.8	-170.3	-162	69.2	0	0	0	112.9	V414 A415 F496 W502 V504 F516	V414-I500 HydrophobicContact CB-CD1 4.18Å; V414-I500 HydrophobicContact CG1-CD1 4.14Å; A415-I500 HydrophobicContact CB-CD1 4.07Å; F496-I500 HydrophobicContact CE1-CG2 4.28Å; F496-I500 HydrophobicContact CE2-CB 4.34Å; F496-I500 HydrophobicContact CE2-CG2 4.38Å; F496-I500 HydrophobicContact CZ-CG2 4.14Å; F496-I500 WeakPolarHBondContact O-CG2 3.32Å; F496-I500 PolarHBondContact O-N 2.83Å; I500-W502 PolarHBondContact O-N 2.66Å; I500-V504 HydrophobicContact CD1-CG2 3.62Å; I500-V504 HydrophobicContact CG1-CG2 3.97Å; I500-V504 WeakPolarHBondContact O-CB 3.39Å; I500-V504 WeakPolarHBondContact O-CG2 3.32Å; I500-V504 PolarHBondContact O-N 2.98Å; I500-F516 HydrophobicContact CG2-CE1 4.11Å; I500-F516 HydrophobicContact CG2-CZ 4.23Å
501	Y	90.1	Very high	89.3	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-43.5	-173.7	-170.9	-95.8	0	0	0	112.3	S497 F499 G505 M506 H507 R512 F513 F516	S497-Y501 WeakPolarHBondContact O-CB 3.45Å; S497-Y501 PolarHBondContact O-N 3.34Å; F499-Y501 PolarHBondContact O-N 2.89Å; Y501-G505 PolarHBondContact O-N 3.48Å; Y501-M506 HydrophobicContact CD1-CB 4.38Å; Y501-M506 HydrophobicContact CD2-CB 3.62Å; Y501-M506 HydrophobicContact CD2-CE 4.31Å; Y501-M506 HydrophobicContact CD2-CG 4.02Å; Y501-M506 HydrophobicContact CD2-SD 3.47Å; Y501-M506 WeakPolarHBondContact CD2-SD 3.41Å; Y501-M506 HydrophobicContact CE1-CB 4.33Å; Y501-M506 HydrophobicContact CE2-CB 3.53Å; Y501-M506 HydrophobicContact CE2-CE 4.28Å; Y501-M506 HydrophobicContact CE2-CG 4.31Å; Y501-M506 HydrophobicContact CE2-SD 3.97Å; Y501-M506 HydrophobicContact CG-CB 4.06Å; Y501-M506 HydrophobicContact CG-SD 4.31Å; Y501-M506 PolarHBondContact O-N 2.95Å; Y501-H507 VanDerWaalsContact CZ-O 3.31Å; Y501-H507 PolarHBondContact OH-O 2.94Å; Y501-R512 WeakPolarHBondContact OH-CB 3.39Å; Y501-F513 HydrophobicContact CD1-CB 4.19Å; Y501-F513 AromaticContact CD1-CD2 3.65Å; Y501-F513 HydrophobicContact CD1-CD2 3.65Å; Y501-F513 HydrophobicContact CD1-CG 4.34Å; Y501-F513 HydrophobicContact CD2-CD2 4.26Å; Y501-F513 HydrophobicContact CE1-CB 3.75Å; Y501-F513 HydrophobicContact CE1-CD2 4.11Å; Y501-F513 HydrophobicContact CE1-CG 4.38Å; Y501-F513 AromaticContact CG-CD2 3.71Å; Y501-F513 HydrophobicContact CG-CD2 3.71Å; Y501-F513 HydrophobicContact CG-CE2 4.43Å; Y501-F513 PolarHBondContact OH-N 2.96Å; Y501-F516 HydrophobicContact CD2-CB 4.33Å; Y501-F516 HydrophobicContact CD2-CD1 4.09Å; Y501-F516 HydrophobicContact CD2-CD2 4.35Å; Y501-F516 HydrophobicContact CD2-CG 4.01Å; Y501-F516 HydrophobicContact CE2-CB 4.2Å; Y501-F516 HydrophobicContact CE2-CG 4.29Å
502	W	89.9	Confident	89.1	Confident	137 Å²	137	46.8 Å²	46.8	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-83.4	-37.2	-177.1	-63.3	98	0	0	0	112.6	I500 V504 F513	I500-W502 PolarHBondContact O-N 2.66Å; W502-V504 VanDerWaalsContact C-N 3.32Å; W502-V504 PolarHBondContact O-N 3.43Å; W502-F513 AromaticContact NE1-CE2 3.96Å
503	T	88.3	Confident	89.1	Confident	57 Å²	57	48 Å²	48	35%	0.35	25%	0.248	S	C	.	.	H	α-helix	trans	-65.1	-38.7	177.2	-61.5	0	0	0	0	111.7	A415 F499	A415-T503 HydrophobicContact CB-CG2 4Å; F499-T503 HydrophobicContact CZ-CG2 4.48Å; F499-T503 WeakPolarHBondContact O-CB 3.16Å; F499-T503 PolarHBondContact O-N 3.35Å; F499-T503 VanDerWaalsContact O-N 3.07Å; F499-T503 PolarHBondContact O-OG1 3.35Å
504	V	85.9	Confident	89	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-86.6	-16.2	-172.8	-177.4	0	0	0	0	112.4	V418 L421 M436 I500 W502	V418-V504 HydrophobicContact CG1-CG1 3.83Å; L421-V504 HydrophobicContact CD1-CB 4.5Å; L421-V504 HydrophobicContact CD1-CG1 3.09Å; L421-V504 HydrophobicContact CD2-CG1 3.92Å; L421-V504 HydrophobicContact CG-CG1 4.08Å; L421-V504 PolarHBondContact N-O 3.24Å; M436-V504 HydrophobicContact SD-CB 4.09Å; M436-V504 HydrophobicContact SD-CG1 3.44Å; M436-V504 WeakPolarHBondContact SD-CG1 3.5Å; M436-V504 HydrophobicContact SD-CG2 4.45Å; I500-V504 HydrophobicContact CD1-CG2 3.62Å; I500-V504 HydrophobicContact CG1-CG2 3.97Å; I500-V504 WeakPolarHBondContact O-CB 3.39Å; I500-V504 WeakPolarHBondContact O-CG2 3.32Å; I500-V504 PolarHBondContact O-N 2.98Å; W502-V504 VanDerWaalsContact C-N 3.32Å; W502-V504 PolarHBondContact O-N 3.43Å
505	G	83.6	Confident	88.9	Confident	22 Å²	22	50.6 Å²	50.6	23%	0.227	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	45.6	176.4	0	0	0	0	0	113.4	Y501	Y501-G505 PolarHBondContact O-N 3.48Å
506	M	82.9	Confident	88.9	Confident	11 Å²	11	47.7 Å²	47.7	5%	0.054	24%	0.243	C	C	.	.			trans	-67.6	170.9	170.8	-64.1	-171	75	0	0	111.3	M436 Y501 F516 E593	M436-M506 HydrophobicContact CE-CE 3.48Å; M436-M506 VanDerWaalsContact CE-CE 3.48Å; M436-M506 HydrophobicContact CE-CG 3.69Å; M436-M506 HydrophobicContact CE-SD 3.42Å; M436-M506 WeakPolarHBondContact CE-SD 3.47Å; M436-M506 HydrophobicContact SD-CG 4.23Å; M436-M506 HydrophobicContact SD-SD 3.9Å; Y501-M506 HydrophobicContact CD1-CB 4.38Å; Y501-M506 HydrophobicContact CD2-CB 3.62Å; Y501-M506 HydrophobicContact CD2-CE 4.31Å; Y501-M506 HydrophobicContact CD2-CG 4.02Å; Y501-M506 HydrophobicContact CD2-SD 3.47Å; Y501-M506 WeakPolarHBondContact CD2-SD 3.41Å; Y501-M506 HydrophobicContact CE1-CB 4.33Å; Y501-M506 HydrophobicContact CE2-CB 3.53Å; Y501-M506 HydrophobicContact CE2-CE 4.28Å; Y501-M506 HydrophobicContact CE2-CG 4.31Å; Y501-M506 HydrophobicContact CE2-SD 3.97Å; Y501-M506 HydrophobicContact CG-CB 4.06Å; Y501-M506 HydrophobicContact CG-SD 4.31Å; Y501-M506 PolarHBondContact O-N 2.95Å; M506-F516 HydrophobicContact CE-CD2 3.91Å; M506-F516 HydrophobicContact CE-CE2 3.81Å; M506-F516 HydrophobicContact SD-CD2 4.25Å; M506-F516 HydrophobicContact SD-CE2 3.88Å; M506-F516 HydrophobicContact SD-CZ 4.27Å; M506-E593 HydrophobicContact CE-CB 4.43Å; M506-E593 VanDerWaalsContact CE-CD 3.45Å; M506-E593 HydrophobicContact CE-CG 4.13Å; M506-E593 VanDerWaalsContact CE-OE2 3.25Å; M506-E593 WeakPolarHBondContact CE-OE2 3.46Å
507	H	83.3	Confident	88.9	Confident	29 Å²	29	48.3 Å²	48.3	13%	0.134	25%	0.247	C	C	.	.			trans	-52.6	126	-174.6	-169.7	-65.2	0	0	0	112	Y501 D509 R512 E593	Y501-H507 VanDerWaalsContact CZ-O 3.31Å; Y501-H507 PolarHBondContact OH-O 2.94Å; H507-D509 VanDerWaalsContact CE1-CG 3.41Å; H507-D509 IonicContact CE1-OD1 3.87Å; H507-D509 IonicContact CE1-OD2 3.19Å; H507-D509 PolarHBondContact CE1-OD2 3.47Å; H507-D509 IonicContact ND1-OD1 3.75Å; H507-D509 IonicContact ND1-OD2 3.71Å; H507-D509 PolarHBondContact ND1-OD2 2.92Å; H507-D509 PolarHBondContact O-N 3.45Å; H507-R512 PolarHBondContact CD2-NH1 3.32Å; H507-R512 PolarHBondContact NE2-NH2 3.03Å; H507-E593 PolarHBondContact N-OE2 3.5Å
508	P	81.8	Confident	88.9	Confident	102 Å²	102	49.5 Å²	49.5	66%	0.662	26%	0.257	S	S	*	.			trans	-75.9	31.3	-164.6	29.3	-36.2	0	0	0	116.9
509	D	87.8	Confident	89	Confident	66 Å²	66	46.7 Å²	46.7	35%	0.353	24%	0.237	S	C	.	.			trans	-97.7	131.1	-178.9	-72.5	-23.4	0	0	0	112.9	H507 W511 R512 F513	H507-D509 VanDerWaalsContact CE1-CG 3.41Å; H507-D509 IonicContact CE1-OD1 3.87Å; H507-D509 IonicContact CE1-OD2 3.19Å; H507-D509 PolarHBondContact CE1-OD2 3.47Å; H507-D509 IonicContact ND1-OD1 3.75Å; H507-D509 IonicContact ND1-OD2 3.71Å; H507-D509 PolarHBondContact ND1-OD2 2.92Å; H507-D509 PolarHBondContact O-N 3.45Å; D509-W511 VanDerWaalsContact C-N 3.32Å; D509-W511 PolarHBondContact O-N 3.43Å; D509-R512 HydrophobicContact CB-CB 4.02Å; D509-R512 HydrophobicContact CB-CG 3.78Å; D509-R512 PolarHBondContact O-N 3.47Å; D509-R512 WeakPolarHBondContact OD2-CD 3.36Å; D509-R512 IonicContact OD2-CZ 3.99Å; D509-R512 IonicContact OD2-NE 3.6Å; D509-R512 PolarHBondContact OD2-NE 3.07Å; D509-R512 IonicContact OD2-NH2 2.84Å; D509-F513 PolarHBondContact O-N 3.29Å
510	T	88.3	Confident	89	Confident	96 Å²	96	44.6 Å²	44.6	59%	0.589	23%	0.228	S	C	*	.	H	α-helix	trans	-62.6	-35.9	177.6	-47.7	0	0	0	0	113.2	F513 M514	T510-F513 WeakPolarHBondContact O-CB 3.39Å; T510-F513 PolarHBondContact O-N 3.39Å; T510-M514 WeakPolarHBondContact O-CG 3.23Å; T510-M514 PolarHBondContact O-N 3.41Å; T510-M514 VanDerWaalsContact O-N 3.13Å
511	W	89.1	Confident	89.2	Confident	196 Å²	196	45.9 Å²	45.9	74%	0.742	24%	0.235	S	C	*	.	H	α-helix	trans	-65.8	-43.8	177.6	179	-106	0	0	0	111.6	D509 F513 M514 C515	D509-W511 VanDerWaalsContact C-N 3.32Å; D509-W511 PolarHBondContact O-N 3.43Å; W511-F513 VanDerWaalsContact C-N 3.33Å; W511-F513 PolarHBondContact O-N 3.3Å; W511-M514 PolarHBondContact O-N 2.94Å; W511-C515 PolarHBondContact O-N 3.46Å; W511-C515 PolarHBondContact O-SG 3.39Å
512	R	88.1	Confident	89.3	Confident	23 Å²	23	45.8 Å²	45.8	9%	0.087	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-36.5	177.8	-63.7	-178.2	-169	-138.1	9.9	111.9	Y501 H507 D509 C515 F516 T592 L595	Y501-R512 WeakPolarHBondContact OH-CB 3.39Å; H507-R512 PolarHBondContact CD2-NH1 3.32Å; H507-R512 PolarHBondContact NE2-NH2 3.03Å; D509-R512 HydrophobicContact CB-CB 4.02Å; D509-R512 HydrophobicContact CB-CG 3.78Å; D509-R512 PolarHBondContact O-N 3.47Å; D509-R512 WeakPolarHBondContact OD2-CD 3.36Å; D509-R512 IonicContact OD2-CZ 3.99Å; D509-R512 IonicContact OD2-NE 3.6Å; D509-R512 PolarHBondContact OD2-NE 3.07Å; D509-R512 IonicContact OD2-NH2 2.84Å; R512-C515 PolarHBondContact O-N 3.36Å; R512-F516 WeakPolarHBondContact O-CB 3.23Å; R512-F516 PolarHBondContact O-N 3.29Å; R512-T592 HydrophobicContact CB-CG2 3.75Å; R512-T592 WeakPolarHBondContact CD-O 3.17Å; R512-T592 HydrophobicContact CG-CG2 4.1Å; R512-T592 PolarHBondContact NH1-O 2.96Å; R512-L595 VanDerWaalsContact CZ-O 3.3Å; R512-L595 PolarHBondContact NH1-O 3.46Å; R512-L595 PolarHBondContact NH2-O 3.01Å
513	F	92.1	Very high	89.5	Confident	25 Å²	25	39.3 Å²	39.3	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-47.9	170.8	170.3	-104.9	0	0	0	111.9	Y501 W502 D509 T510 W511 C515 F516 T517	Y501-F513 HydrophobicContact CD1-CB 4.19Å; Y501-F513 AromaticContact CD1-CD2 3.65Å; Y501-F513 HydrophobicContact CD1-CD2 3.65Å; Y501-F513 HydrophobicContact CD1-CG 4.34Å; Y501-F513 HydrophobicContact CD2-CD2 4.26Å; Y501-F513 HydrophobicContact CE1-CB 3.75Å; Y501-F513 HydrophobicContact CE1-CD2 4.11Å; Y501-F513 HydrophobicContact CE1-CG 4.38Å; Y501-F513 AromaticContact CG-CD2 3.71Å; Y501-F513 HydrophobicContact CG-CD2 3.71Å; Y501-F513 HydrophobicContact CG-CE2 4.43Å; Y501-F513 PolarHBondContact OH-N 2.96Å; W502-F513 AromaticContact NE1-CE2 3.96Å; D509-F513 PolarHBondContact O-N 3.29Å; T510-F513 WeakPolarHBondContact O-CB 3.39Å; T510-F513 PolarHBondContact O-N 3.39Å; W511-F513 VanDerWaalsContact C-N 3.33Å; W511-F513 PolarHBondContact O-N 3.3Å; F513-C515 VanDerWaalsContact C-N 3.35Å; F513-C515 PolarHBondContact O-N 3.09Å; F513-F516 WeakPolarHBondContact O-CB 3.25Å; F513-F516 PolarHBondContact O-N 2.87Å; F513-T517 PolarHBondContact O-N 3.48Å; F513-T517 PolarHBondContact O-OG1 3.28Å
514	M	91.8	Very high	89.7	Confident	110 Å²	110	36.6 Å²	36.6	54%	0.542	19%	0.194	S	C	.	.	H	α-helix	trans	-63.1	-41	178.1	-69.2	-65.1	-175.3	0	0	112.1	T510 W511 T517 A518	T510-M514 WeakPolarHBondContact O-CG 3.23Å; T510-M514 PolarHBondContact O-N 3.41Å; T510-M514 VanDerWaalsContact O-N 3.13Å; W511-M514 PolarHBondContact O-N 2.94Å; M514-T517 PolarHBondContact O-N 3.23Å; M514-A518 VanDerWaalsContact O-CB 3.32Å; M514-A518 WeakPolarHBondContact O-CB 3.39Å; M514-A518 PolarHBondContact O-N 3.45Å
515	C	91.5	Very high	90.1	Very high	10 Å²	10	37.1 Å²	37.1	7%	0.068	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-44.8	172.9	-69.7	0	0	0	0	111.7	W511 R512 F513 A518 V519 T592 F635	W511-C515 PolarHBondContact O-N 3.46Å; W511-C515 PolarHBondContact O-SG 3.39Å; R512-C515 PolarHBondContact O-N 3.36Å; F513-C515 VanDerWaalsContact C-N 3.35Å; F513-C515 PolarHBondContact O-N 3.09Å; C515-A518 PolarHBondContact O-N 3.37Å; C515-V519 VanDerWaalsContact O-CG2 3.25Å; C515-V519 WeakPolarHBondContact O-CG2 3.16Å; C515-V519 PolarHBondContact O-N 3.43Å; C515-T592 HydrophobicContact CB-CG2 4.08Å; C515-F635 HydrophobicContact CB-CZ 4.32Å
516	F	92.2	Very high	90.5	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-50.4	176.1	177.4	-88	0	0	0	111.4	I500 Y501 M506 R512 F513 A518 V519 V520 L589	I500-F516 HydrophobicContact CG2-CE1 4.11Å; I500-F516 HydrophobicContact CG2-CZ 4.23Å; Y501-F516 HydrophobicContact CD2-CB 4.33Å; Y501-F516 HydrophobicContact CD2-CD1 4.09Å; Y501-F516 HydrophobicContact CD2-CD2 4.35Å; Y501-F516 HydrophobicContact CD2-CG 4.01Å; Y501-F516 HydrophobicContact CE2-CB 4.2Å; Y501-F516 HydrophobicContact CE2-CG 4.29Å; M506-F516 HydrophobicContact CE-CD2 3.91Å; M506-F516 HydrophobicContact CE-CE2 3.81Å; M506-F516 HydrophobicContact SD-CD2 4.25Å; M506-F516 HydrophobicContact SD-CE2 3.88Å; M506-F516 HydrophobicContact SD-CZ 4.27Å; R512-F516 WeakPolarHBondContact O-CB 3.23Å; R512-F516 PolarHBondContact O-N 3.29Å; F513-F516 WeakPolarHBondContact O-CB 3.25Å; F513-F516 PolarHBondContact O-N 2.87Å; F516-A518 VanDerWaalsContact C-N 3.35Å; F516-A518 PolarHBondContact O-N 2.99Å; F516-V519 PolarHBondContact O-N 3.02Å; F516-V520 HydrophobicContact CD1-CG2 4.26Å; F516-V520 HydrophobicContact CE1-CG2 3.91Å; F516-V520 HydrophobicContact CE2-CG2 4.29Å; F516-V520 HydrophobicContact CZ-CG2 3.92Å; F516-V520 VanDerWaalsContact O-CG2 3.32Å; F516-V520 WeakPolarHBondContact O-CG2 3.32Å; F516-V520 PolarHBondContact O-N 3.5Å; F516-L589 HydrophobicContact CB-CD2 4.44Å; F516-L589 HydrophobicContact CD2-CD2 3.48Å; F516-L589 VanDerWaalsContact CD2-CD2 3.48Å; F516-L589 HydrophobicContact CE2-CD2 3.99Å; F516-L589 HydrophobicContact CG-CD2 4.2Å
517	T	93.1	Very high	91	Very high	16 Å²	16	35.7 Å²	35.7	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-43.1	177.5	-59.9	0	0	0	0	111.9	V493 V494 S497 F513 M514 V520 L521	V493-T517 HydrophobicContact CG1-CG2 4.37Å; V494-T517 HydrophobicContact CG2-CG2 3.98Å; S497-T517 VanDerWaalsContact CB-OG1 3.27Å; S497-T517 WeakPolarHBondContact CB-OG1 2.83Å; S497-T517 WeakPolarHBondContact OG-CG2 3.44Å; S497-T517 PolarHBondContact OG-OG1 3Å; F513-T517 PolarHBondContact O-N 3.48Å; F513-T517 PolarHBondContact O-OG1 3.28Å; M514-T517 PolarHBondContact O-N 3.23Å; T517-V520 PolarHBondContact O-N 3.34Å; T517-L521 WeakPolarHBondContact O-CB 3.4Å; T517-L521 PolarHBondContact O-N 3.46Å
518	A	93.4	Very high	91.5	Very high	25 Å²	25	34.4 Å²	34.4	21%	0.207	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-42.1	178.1	0	0	0	0	0	112.2	M514 C515 F516 L521 Y639	M514-A518 VanDerWaalsContact O-CB 3.32Å; M514-A518 WeakPolarHBondContact O-CB 3.39Å; M514-A518 PolarHBondContact O-N 3.45Å; C515-A518 PolarHBondContact O-N 3.37Å; F516-A518 VanDerWaalsContact C-N 3.35Å; F516-A518 PolarHBondContact O-N 2.99Å; A518-L521 PolarHBondContact O-N 3.46Å; A518-Y639 PolarHBondContact O-OH 3.01Å
519	V	93.3	Very high	92	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69	-40.8	178.7	176.3	0	0	0	0	111.4	C515 F516 L521 P523 L588 L589 F635 L638	C515-V519 VanDerWaalsContact O-CG2 3.25Å; C515-V519 WeakPolarHBondContact O-CG2 3.16Å; C515-V519 PolarHBondContact O-N 3.43Å; F516-V519 PolarHBondContact O-N 3.02Å; V519-L521 VanDerWaalsContact C-N 3.31Å; V519-L521 PolarHBondContact O-N 2.87Å; V519-P523 WeakPolarHBondContact O-CD 3.5Å; V519-L588 HydrophobicContact CG1-CB 4.27Å; V519-L588 HydrophobicContact CG2-CB 3.88Å; V519-L588 HydrophobicContact CG2-CD1 3.89Å; V519-L589 HydrophobicContact CB-CD2 3.94Å; V519-L589 HydrophobicContact CB-CG 4.3Å; V519-L589 HydrophobicContact CG1-CD1 4.19Å; V519-L589 HydrophobicContact CG1-CD2 3.91Å; V519-L589 HydrophobicContact CG1-CG 3.69Å; V519-F635 HydrophobicContact CG2-CE1 3.61Å; V519-F635 HydrophobicContact CG2-CZ 3.67Å; V519-L638 HydrophobicContact CG1-CD2 4Å
520	V	92.4	Very high	92.2	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.018	14%	0.14	C	C	.	.	H	α-helix	trans	-69.4	-29	178.5	172.6	0	0	0	0	112.4	S444 V493 F496 F516 T517 V522 P523	S444-V520 WeakPolarHBondContact OG-CG1 3.33Å; V493-V520 HydrophobicContact CG1-CB 4.34Å; V493-V520 HydrophobicContact CG1-CG1 3.96Å; F496-V520 HydrophobicContact CD1-CG1 4.22Å; F496-V520 HydrophobicContact CE1-CG1 4.02Å; F516-V520 HydrophobicContact CD1-CG2 4.26Å; F516-V520 HydrophobicContact CE1-CG2 3.91Å; F516-V520 HydrophobicContact CE2-CG2 4.29Å; F516-V520 HydrophobicContact CZ-CG2 3.92Å; F516-V520 VanDerWaalsContact O-CG2 3.32Å; F516-V520 WeakPolarHBondContact O-CG2 3.32Å; F516-V520 PolarHBondContact O-N 3.5Å; T517-V520 PolarHBondContact O-N 3.34Å; V520-V522 PolarHBondContact O-N 3.15Å; V520-P523 WeakPolarHBondContact O-CD 3.5Å
521	L	93.9	Very high	92.5	Very high	29 Å²	29	23.7 Å²	23.7	15%	0.152	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-40.6	178.6	-179.9	64.9	0	0	0	112.6	V490 V493 T517 A518 V519 H524 I525	V490-L521 HydrophobicContact CB-CD1 4.4Å; V490-L521 HydrophobicContact CG2-CD1 3.87Å; V490-L521 HydrophobicContact CG2-CD2 4Å; V493-L521 HydrophobicContact CB-CD1 4.06Å; V493-L521 HydrophobicContact CG1-CB 4.16Å; V493-L521 HydrophobicContact CG1-CD1 4.37Å; V493-L521 HydrophobicContact CG2-CD1 4Å; T517-L521 WeakPolarHBondContact O-CB 3.4Å; T517-L521 PolarHBondContact O-N 3.46Å; A518-L521 PolarHBondContact O-N 3.46Å; V519-L521 VanDerWaalsContact C-N 3.31Å; V519-L521 PolarHBondContact O-N 2.87Å; L521-H524 PolarHBondContact O-N 3.31Å; L521-I525 HydrophobicContact CD1-CD1 3.77Å; L521-I525 HydrophobicContact CD1-CG1 4.14Å; L521-I525 HydrophobicContact CD2-CD1 4.29Å; L521-I525 HydrophobicContact CG-CD1 3.73Å; L521-I525 HydrophobicContact CG-CG1 4.4Å; L521-I525 WeakPolarHBondContact O-CG1 3.48Å; L521-I525 PolarHBondContact O-N 2.93Å; L521-I525 VanDerWaalsContact O-N 3.07Å
522	V	93.8	Very high	92.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.3	-48.4	-174.1	179.9	0	0	0	0	112.5	V520 H524 I525 T526 L638 Y639 L642	V520-V522 PolarHBondContact O-N 3.15Å; V522-H524 VanDerWaalsContact C-N 3.29Å; V522-H524 PolarHBondContact O-N 3.12Å; V522-I525 PolarHBondContact O-N 3.04Å; V522-T526 WeakPolarHBondContact O-CB 3.43Å; V522-T526 PolarHBondContact O-N 3.35Å; V522-T526 PolarHBondContact O-OG1 3.25Å; V522-L638 HydrophobicContact CB-CD1 4.1Å; V522-L638 HydrophobicContact CB-CD2 4.17Å; V522-L638 HydrophobicContact CB-CG 3.88Å; V522-L638 HydrophobicContact CG1-CD1 3.69Å; V522-L638 HydrophobicContact CG1-CG 3.73Å; V522-L638 WeakPolarHBondContact CG1-O 3.5Å; V522-L638 HydrophobicContact CG2-CD2 4.38Å; V522-L638 HydrophobicContact CG2-CG 4.2Å; V522-Y639 HydrophobicContact CG2-CD1 4.05Å; V522-Y639 HydrophobicContact CG2-CD2 3.93Å; V522-Y639 HydrophobicContact CG2-CE1 3.75Å; V522-Y639 HydrophobicContact CG2-CE2 3.63Å; V522-Y639 HydrophobicContact CG2-CG 4.15Å; V522-L642 HydrophobicContact CG1-CD1 4.36Å; V522-L642 HydrophobicContact CG1-CD2 4.18Å; V522-L642 HydrophobicContact CG1-CG 4.14Å; V522-L642 HydrophobicContact CG2-CD1 4.44Å
523	P	92.8	Very high	92.8	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-54.9	-40.8	172.1	-30.2	37.4	0	0	0	113.5	P445 V519 V520 T526 G527 F581 S585	P445-P523 WeakPolarHBondContact CA-O 3.42Å; P445-P523 WeakPolarHBondContact CB-O 3.4Å; P445-P523 HydrophobicContact CG-CB 4.36Å; V519-P523 WeakPolarHBondContact O-CD 3.5Å; V520-P523 WeakPolarHBondContact O-CD 3.5Å; P523-T526 PolarHBondContact O-N 3.1Å; P523-G527 PolarHBondContact O-N 2.92Å; P523-F581 HydrophobicContact CB-CD2 4.16Å; P523-F581 HydrophobicContact CB-CE2 3.85Å; P523-F581 HydrophobicContact CG-CD2 4.2Å; P523-F581 HydrophobicContact CG-CE2 4.35Å; P523-S585 WeakPolarHBondContact CG-OG 3.43Å
524	H	93.1	Very high	92.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.1	-49.6	178.8	-174.3	66.6	0	0	0	112.2	N407 S444 T447 G448 V493 L521 V522 T526 G527 E528	N407-H524 PolarHBondContact ND2-CE1 2.98Å; S444-H524 WeakPolarHBondContact O-CA 3.43Å; S444-H524 PolarHBondContact O-ND1 3.39Å; T447-H524 PolarHBondContact OG1-CE1 2.93Å; T447-H524 VanDerWaalsContact OG1-CE1 3.26Å; T447-H524 PolarHBondContact OG1-ND1 2.94Å; G448-H524 PolarHBondContact N-CE1 3.42Å; G448-H524 PolarHBondContact N-ND1 3.44Å; V493-H524 HydrophobicContact CG2-CB 3.88Å; L521-H524 PolarHBondContact O-N 3.31Å; V522-H524 VanDerWaalsContact C-N 3.29Å; V522-H524 PolarHBondContact O-N 3.12Å; H524-T526 VanDerWaalsContact C-N 3.34Å; H524-T526 PolarHBondContact O-N 2.64Å; H524-G527 PolarHBondContact O-N 3.43Å; H524-E528 PolarHBondContact O-N 3.42Å
525	I	93.8	Very high	92.6	Very high	12 Å²	12	10 Å²	10	6%	0.062	6%	0.058	C	C	.	.	H	α-helix	trans	-65.7	-39.8	176.9	-62.1	172	0	0	0	110.6	L486 L521 V522 E528 L529 L642	L486-I525 HydrophobicContact CD2-CD1 3.78Å; L486-I525 HydrophobicContact CD2-CG1 4.44Å; L486-I525 HydrophobicContact CD2-CG2 4.29Å; L521-I525 HydrophobicContact CD1-CD1 3.77Å; L521-I525 HydrophobicContact CD1-CG1 4.14Å; L521-I525 HydrophobicContact CD2-CD1 4.29Å; L521-I525 HydrophobicContact CG-CD1 3.73Å; L521-I525 HydrophobicContact CG-CG1 4.4Å; L521-I525 WeakPolarHBondContact O-CG1 3.48Å; L521-I525 PolarHBondContact O-N 2.93Å; L521-I525 VanDerWaalsContact O-N 3.07Å; V522-I525 PolarHBondContact O-N 3.04Å; I525-E528 PolarHBondContact O-N 3.05Å; I525-L529 HydrophobicContact CG2-CD1 3.78Å; I525-L529 HydrophobicContact CG2-CG 4.03Å; I525-L529 WeakPolarHBondContact O-CB 3.45Å; I525-L529 WeakPolarHBondContact O-CG 3.46Å; I525-L529 PolarHBondContact O-N 2.87Å; I525-L642 HydrophobicContact CB-CD2 4.01Å; I525-L642 HydrophobicContact CG2-CD2 3.65Å
526	T	93.3	Very high	92.3	Very high	2 Å²	2	9.6 Å²	9.6	1%	0.012	6%	0.056	C	C	.	.	H	α-helix	trans	-61.6	-45.2	179.3	-64.7	0	0	0	0	111.6	V522 P523 H524 E528 L529 L530 F581 L645	V522-T526 WeakPolarHBondContact O-CB 3.43Å; V522-T526 PolarHBondContact O-N 3.35Å; V522-T526 PolarHBondContact O-OG1 3.25Å; P523-T526 PolarHBondContact O-N 3.1Å; H524-T526 VanDerWaalsContact C-N 3.34Å; H524-T526 PolarHBondContact O-N 2.64Å; T526-E528 VanDerWaalsContact C-N 3.33Å; T526-E528 PolarHBondContact O-N 3.4Å; T526-L529 PolarHBondContact O-N 3.27Å; T526-L530 WeakPolarHBondContact O-CB 3.42Å; T526-L530 PolarHBondContact O-N 3.47Å; T526-F581 HydrophobicContact CG2-CD1 3.49Å; T526-F581 VanDerWaalsContact CG2-CD1 3.49Å; T526-F581 HydrophobicContact CG2-CD2 4.46Å; T526-F581 HydrophobicContact CG2-CE1 3.53Å; T526-F581 HydrophobicContact CG2-CE2 4.5Å; T526-F581 HydrophobicContact CG2-CG 3.98Å; T526-F581 HydrophobicContact CG2-CZ 4.05Å; T526-L645 HydrophobicContact CG2-CD1 3.69Å
527	G	92.8	Very high	92	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-60.2	-41.6	175.5	0	0	0	0	0	112.5	P523 H524 T531	P523-G527 PolarHBondContact O-N 2.92Å; H524-G527 PolarHBondContact O-N 3.43Å; G527-T531 WeakPolarHBondContact O-CB 3.31Å; G527-T531 PolarHBondContact O-N 3.37Å; G527-T531 VanDerWaalsContact O-N 3.17Å; G527-T531 PolarHBondContact O-OG1 3.11Å
528	E	92.7	Very high	91.8	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-67.4	-49.2	177.3	-165.2	162.5	-170.7	0	0	112.1	R403 G448 A452 Y481 I485 S489 H524 I525 T526 T531 V532	R403-E528 IonicContact CZ-OE1 3.79Å; R403-E528 IonicContact NH1-OE1 2.96Å; R403-E528 PolarHBondContact NH1-OE1 3.49Å; R403-E528 VanDerWaalsContact NH2-CD 3.3Å; R403-E528 IonicContact NH2-OE1 2.86Å; R403-E528 PolarHBondContact NH2-OE1 3.07Å; R403-E528 IonicContact NH2-OE2 3.69Å; R403-E528 PolarHBondContact NH2-OE2 3.37Å; G448-E528 WeakPolarHBondContact O-CA 3.32Å; G448-E528 WeakPolarHBondContact O-CB 3.36Å; G448-E528 WeakPolarHBondContact O-CG 3.37Å; A452-E528 HydrophobicContact CB-CG 3.89Å; Y481-E528 PolarHBondContact OH-OE1 2.91Å; I485-E528 HydrophobicContact CD1-CG 4.24Å; I485-E528 WeakPolarHBondContact CG2-OE2 3.5Å; S489-E528 PolarHBondContact OG-OE2 3.4Å; S489-E528 VanDerWaalsContact OG-OE2 3.05Å; H524-E528 PolarHBondContact O-N 3.42Å; I525-E528 PolarHBondContact O-N 3.05Å; T526-E528 VanDerWaalsContact C-N 3.33Å; T526-E528 PolarHBondContact O-N 3.4Å; E528-T531 PolarHBondContact O-N 3.1Å; E528-V532 WeakPolarHBondContact O-CG2 3.44Å; E528-V532 PolarHBondContact O-N 3.29Å; E528-V532 VanDerWaalsContact O-N 3.12Å
529	L	93.3	Very high	91.2	Very high	8 Å²	8	20.2 Å²	20.2	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-60.9	-48.6	178.5	-71.6	178.2	0	0	0	111.9	I482 I525 T526 T531 V532 V533 L642 L645 V646	I482-L529 HydrophobicContact CD1-CD2 4.06Å; I482-L529 HydrophobicContact CG1-CD2 3.69Å; I482-L529 HydrophobicContact CG2-CD2 4.4Å; I525-L529 HydrophobicContact CG2-CD1 3.78Å; I525-L529 HydrophobicContact CG2-CG 4.03Å; I525-L529 WeakPolarHBondContact O-CB 3.45Å; I525-L529 WeakPolarHBondContact O-CG 3.46Å; I525-L529 PolarHBondContact O-N 2.87Å; T526-L529 PolarHBondContact O-N 3.27Å; L529-T531 VanDerWaalsContact C-N 3.3Å; L529-T531 PolarHBondContact O-N 3.24Å; L529-V532 PolarHBondContact O-N 2.64Å; L529-V532 VanDerWaalsContact O-N 3.07Å; L529-V533 WeakPolarHBondContact O-CG2 3.48Å; L529-V533 PolarHBondContact O-N 2.93Å; L529-L642 HydrophobicContact CD1-CD2 4.08Å; L529-L645 HydrophobicContact CB-CB 4.24Å; L529-L645 HydrophobicContact CB-CD1 4.38Å; L529-L645 HydrophobicContact CD1-CB 4.34Å; L529-V646 HydrophobicContact CD1-CG2 4.21Å
530	L	92.8	Very high	91	Very high	32 Å²	32	23.5 Å²	23.5	17%	0.168	13%	0.127	C	C	.	.	H	α-helix	trans	-61.2	-40.5	-178.6	-177.2	57.3	0	0	0	111.6	T526 V532 V533 L534 M548 L551 L645	T526-L530 WeakPolarHBondContact O-CB 3.42Å; T526-L530 PolarHBondContact O-N 3.47Å; L530-V532 VanDerWaalsContact C-N 3.3Å; L530-V532 PolarHBondContact O-N 3.16Å; L530-V533 PolarHBondContact O-N 2.86Å; L530-L534 PolarHBondContact O-N 3.41Å; L530-M548 HydrophobicContact CB-CE 4Å; L530-M548 HydrophobicContact CB-SD 4.39Å; L530-M548 HydrophobicContact CD2-CE 3.8Å; L530-M548 HydrophobicContact CD2-SD 3.96Å; L530-M548 HydrophobicContact CG-CE 3.81Å; L530-M548 HydrophobicContact CG-SD 3.69Å; L530-L551 HydrophobicContact CD2-CD2 3.68Å; L530-L645 HydrophobicContact CB-CD2 4.39Å; L530-L645 HydrophobicContact CD1-CD2 3.88Å
531	T	93.3	Very high	90.8	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.4	-42	173.9	-58.8	0	0	0	0	111.6	M449 A452 V453 G527 E528 L529 L534 L535 V544	M449-T531 WeakPolarHBondContact CA-OG1 3.49Å; M449-T531 WeakPolarHBondContact CB-OG1 3.26Å; M449-T531 HydrophobicContact CG-CG2 4.13Å; M449-T531 WeakPolarHBondContact CG-OG1 3.49Å; A452-T531 HydrophobicContact CB-CG2 3.56Å; V453-T531 HydrophobicContact CG2-CG2 3.55Å; G527-T531 WeakPolarHBondContact O-CB 3.31Å; G527-T531 PolarHBondContact O-N 3.37Å; G527-T531 VanDerWaalsContact O-N 3.17Å; G527-T531 PolarHBondContact O-OG1 3.11Å; E528-T531 PolarHBondContact O-N 3.1Å; L529-T531 VanDerWaalsContact C-N 3.3Å; L529-T531 PolarHBondContact O-N 3.24Å; T531-L534 PolarHBondContact O-N 2.95Å; T531-L535 HydrophobicContact CG2-CD1 3.98Å; T531-L535 HydrophobicContact CG2-CG 4.49Å; T531-L535 WeakPolarHBondContact O-CB 3.26Å; T531-L535 WeakPolarHBondContact O-CG 3.26Å; T531-L535 PolarHBondContact O-N 3.24Å; T531-V544 HydrophobicContact CG2-CG1 4.08Å
532	V	92.1	Very high	90.7	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-70.8	-37.8	-179.5	176.7	0	0	0	0	111.8	A452 F456 F478 Y481 E528 L529 L530 L534 L535 G536 F653	A452-V532 HydrophobicContact CB-CG2 3.78Å; F456-V532 HydrophobicContact CD1-CG1 4.26Å; F456-V532 HydrophobicContact CD2-CG1 3.98Å; F456-V532 HydrophobicContact CD2-CG2 4.33Å; F456-V532 HydrophobicContact CE1-CG1 3.93Å; F456-V532 HydrophobicContact CE2-CG1 3.63Å; F456-V532 HydrophobicContact CG-CG1 4.29Å; F456-V532 HydrophobicContact CG-CG2 4.32Å; F456-V532 HydrophobicContact CZ-CG1 3.61Å; F478-V532 HydrophobicContact CD2-CG1 3.58Å; F478-V532 HydrophobicContact CE2-CB 4.3Å; F478-V532 HydrophobicContact CE2-CG1 3.55Å; Y481-V532 HydrophobicContact CD1-CG1 4.23Å; Y481-V532 HydrophobicContact CD1-CG2 4.2Å; Y481-V532 HydrophobicContact CE1-CB 4.4Å; Y481-V532 HydrophobicContact CE1-CG1 4.22Å; Y481-V532 HydrophobicContact CE1-CG2 3.39Å; E528-V532 WeakPolarHBondContact O-CG2 3.44Å; E528-V532 PolarHBondContact O-N 3.29Å; E528-V532 VanDerWaalsContact O-N 3.12Å; L529-V532 PolarHBondContact O-N 2.64Å; L529-V532 VanDerWaalsContact O-N 3.07Å; L530-V532 VanDerWaalsContact C-N 3.3Å; L530-V532 PolarHBondContact O-N 3.16Å; V532-L534 VanDerWaalsContact C-N 3.3Å; V532-L534 PolarHBondContact O-N 2.78Å; V532-L535 PolarHBondContact O-N 2.83Å; V532-G536 PolarHBondContact O-N 3.27Å; V532-F653 HydrophobicContact CG1-CE2 4.08Å; V532-F653 HydrophobicContact CG1-CZ 4.22Å
533	V	92.1	Very high	90.6	Very high	8 Å²	8	34.9 Å²	34.9	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-45.7	172.3	176.4	0	0	0	0	110.4	L529 L530 G536 V537 M648 S652	L529-V533 WeakPolarHBondContact O-CG2 3.48Å; L529-V533 PolarHBondContact O-N 2.93Å; L530-V533 PolarHBondContact O-N 2.86Å; V533-G536 WeakPolarHBondContact O-CA 3.04Å; V533-G536 PolarHBondContact O-N 3.42Å; V533-G536 VanDerWaalsContact O-N 3.16Å; V533-V537 PolarHBondContact O-N 3.32Å; V533-M648 HydrophobicContact CG1-CG 4.01Å; V533-M648 HydrophobicContact CG1-SD 4.11Å; V533-S652 PolarHBondContact O-OG 2.99Å
534	L	90.6	Very high	90.6	Very high	57 Å²	57	35 Å²	35	30%	0.298	19%	0.188	S	C	.	.	H	α-helix	trans	-68.1	-40.7	177.6	-71.8	178.1	0	0	0	112.8	L530 T531 V532 G536 V537 V538 V544 M548	L530-L534 PolarHBondContact O-N 3.41Å; T531-L534 PolarHBondContact O-N 2.95Å; V532-L534 VanDerWaalsContact C-N 3.3Å; V532-L534 PolarHBondContact O-N 2.78Å; L534-G536 PolarHBondContact O-N 3.14Å; L534-V537 PolarHBondContact O-N 2.9Å; L534-V538 PolarHBondContact O-N 3.32Å; L534-V544 HydrophobicContact CB-CG1 3.79Å; L534-V544 HydrophobicContact CB-CG2 4.36Å; L534-V544 HydrophobicContact CD1-CG1 4.38Å; L534-M548 HydrophobicContact CD1-CG 3.66Å; L534-M548 HydrophobicContact CD1-SD 3.32Å; L534-M548 WeakPolarHBondContact CD1-SD 3.22Å; L534-M548 HydrophobicContact CG-SD 4.5Å
535	L	89.4	Confident	90.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-20.3	171.7	-75.2	166.8	0	0	0	112.7	F456 R460 T531 V532 P541 V544 R656	F456-L535 HydrophobicContact CB-CD1 4.07Å; F456-L535 HydrophobicContact CD1-CB 3.83Å; F456-L535 HydrophobicContact CD1-CD1 3.83Å; F456-L535 HydrophobicContact CD1-CG 4.44Å; F456-L535 HydrophobicContact CE1-CB 4.1Å; F456-L535 HydrophobicContact CG-CD1 4.34Å; R460-L535 WeakPolarHBondContact CD-O 3.42Å; R460-L535 PolarHBondContact NH1-O 3.04Å; T531-L535 HydrophobicContact CG2-CD1 3.98Å; T531-L535 HydrophobicContact CG2-CG 4.49Å; T531-L535 WeakPolarHBondContact O-CB 3.26Å; T531-L535 WeakPolarHBondContact O-CG 3.26Å; T531-L535 PolarHBondContact O-N 3.24Å; V532-L535 PolarHBondContact O-N 2.83Å; L535-P541 HydrophobicContact CD2-CB 4.16Å; L535-P541 HydrophobicContact CD2-CG 4.45Å; L535-V544 HydrophobicContact CD2-CB 4.11Å; L535-V544 HydrophobicContact CD2-CG1 4.39Å; L535-V544 HydrophobicContact CD2-CG2 3.92Å; L535-V544 HydrophobicContact CG-CB 4.38Å; L535-V544 HydrophobicContact CG-CG1 4.11Å; L535-V544 HydrophobicContact CG-CG2 4.28Å; L535-R656 PolarHBondContact O-NH1 3.49Å
536	G	84.9	Confident	90.4	Very high	2 Å²	2	41.2 Å²	41.2	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-67.9	-34.6	169.7	0	0	0	0	0	112.9	V532 V533 L534 R656	V532-G536 PolarHBondContact O-N 3.27Å; V533-G536 WeakPolarHBondContact O-CA 3.04Å; V533-G536 PolarHBondContact O-N 3.42Å; V533-G536 VanDerWaalsContact O-N 3.16Å; L534-G536 PolarHBondContact O-N 3.14Å; G536-R656 WeakPolarHBondContact O-CD 3.35Å; G536-R656 PolarHBondContact O-NH1 3.19Å
537	V	85.8	Confident	90.4	Very high	101 Å²	101	42.9 Å²	42.9	61%	0.612	24%	0.243	S	C	*	.	H	α-helix	trans	-96.2	-50.7	-178	-176.8	0	0	0	0	111.8	V533 L534 S652	V533-V537 PolarHBondContact O-N 3.32Å; L534-V537 PolarHBondContact O-N 2.9Å; V537-S652 VanDerWaalsContact CG2-OG 3.32Å; V537-S652 WeakPolarHBondContact CG2-OG 3.45Å
538	V	87.6	Confident	90.3	Very high	46 Å²	46	43.2 Å²	43.2	28%	0.279	24%	0.244	S	C	.	.			trans	-90.2	130.5	-176.9	-178.7	0	0	0	0	109.6	R460 L534 M543 V544	R460-V538 PolarHBondContact NH1-O 3.38Å; R460-V538 VanDerWaalsContact NH1-O 3.1Å; L534-V538 PolarHBondContact O-N 3.32Å; V538-M543 HydrophobicContact CG1-CB 4.29Å; V538-M543 HydrophobicContact CG1-CE 4.03Å; V538-V544 HydrophobicContact CB-CG2 3.61Å; V538-V544 HydrophobicContact CG1-CG2 3.75Å; V538-V544 HydrophobicContact CG2-CG2 4.4Å
539	Q	82.4	Confident	90.3	Very high	121 Å²	121	44.1 Å²	44.1	57%	0.565	25%	0.252	S	S	*	.	S	Bend	trans	-80.6	-35.7	-174.6	-69.2	-173.8	2.5	0	0	113.5	R460 P541	R460-Q539 PolarHBondContact NH1-O 3.35Å; R460-Q539 PolarHBondContact NH2-O 3.42Å; Q539-P541 WeakPolarHBondContact O-CD 3.44Å
540	D	87.9	Confident	90.3	Very high	68 Å²	68	49.4 Å²	49.4	36%	0.364	28%	0.279	S	S	.	.			trans	-84.1	116.3	-177.7	-173.8	-6.5	0	0	0	111.6	N542 M543 V544	D540-N542 VanDerWaalsContact C-N 3.26Å; D540-N542 PolarHBondContact O-N 3.06Å; D540-N542 WeakPolarHBondContact OD1-CB 3.46Å; D540-N542 PolarHBondContact OD1-N 2.94Å; D540-M543 HydrophobicContact CB-CB 4.31Å; D540-M543 HydrophobicContact CB-CE 4.16Å; D540-M543 HydrophobicContact CB-CG 4.15Å; D540-M543 PolarHBondContact O-N 3.13Å; D540-V544 PolarHBondContact O-N 3.46Å
541	P	89.4	Confident	90.2	Very high	34 Å²	34	52.2 Å²	52.2	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-31.5	177.7	-21.1	33.5	0	0	0	113.9	V453 P457 L535 Q539 V544 N545	V453-P541 HydrophobicContact CG1-CB 4.1Å; P457-P541 HydrophobicContact CB-CG 3.95Å; P457-P541 HydrophobicContact CG-CB 3.99Å; P457-P541 HydrophobicContact CG-CG 3.69Å; L535-P541 HydrophobicContact CD2-CB 4.16Å; L535-P541 HydrophobicContact CD2-CG 4.45Å; Q539-P541 WeakPolarHBondContact O-CD 3.44Å; P541-V544 PolarHBondContact O-N 3.35Å; P541-N545 WeakPolarHBondContact O-CB 3.42Å; P541-N545 PolarHBondContact O-N 3.43Å
542	N	90.6	Very high	90.1	Very high	115 Å²	115	53 Å²	53	62%	0.615	30%	0.298	S	S	*	.	H	α-helix	trans	-69.3	-42.4	-177.5	-68.9	-32.6	0	0	0	111.2	D540 V544 N545 T546	D540-N542 VanDerWaalsContact C-N 3.26Å; D540-N542 PolarHBondContact O-N 3.06Å; D540-N542 WeakPolarHBondContact OD1-CB 3.46Å; D540-N542 PolarHBondContact OD1-N 2.94Å; N542-V544 VanDerWaalsContact C-N 3.3Å; N542-V544 PolarHBondContact O-N 3.06Å; N542-N545 WeakPolarHBondContact O-CB 3.29Å; N542-N545 PolarHBondContact O-N 3.36Å; N542-T546 PolarHBondContact O-N 2.9Å; N542-T546 PolarHBondContact O-OG1 3.32Å
543	M	91.6	Very high	90	Very high	122 Å²	122	58.2 Å²	58.2	60%	0.601	33%	0.325	S	S	*	.	H	α-helix	trans	-61.8	-39.7	174.4	-69.2	-149.9	-64	0	0	111.9	V538 D540 G547	V538-M543 HydrophobicContact CG1-CB 4.29Å; V538-M543 HydrophobicContact CG1-CE 4.03Å; D540-M543 HydrophobicContact CB-CB 4.31Å; D540-M543 HydrophobicContact CB-CE 4.16Å; D540-M543 HydrophobicContact CB-CG 4.15Å; D540-M543 PolarHBondContact O-N 3.13Å; M543-G547 PolarHBondContact O-N 3.41Å
544	V	92.5	Very high	89.9	Confident	4 Å²	4	60 Å²	60	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-43.8	175.6	178.8	0	0	0	0	111	T531 L534 L535 V538 D540 P541 N542 G547 M548	T531-V544 HydrophobicContact CG2-CG1 4.08Å; L534-V544 HydrophobicContact CB-CG1 3.79Å; L534-V544 HydrophobicContact CB-CG2 4.36Å; L534-V544 HydrophobicContact CD1-CG1 4.38Å; L535-V544 HydrophobicContact CD2-CB 4.11Å; L535-V544 HydrophobicContact CD2-CG1 4.39Å; L535-V544 HydrophobicContact CD2-CG2 3.92Å; L535-V544 HydrophobicContact CG-CB 4.38Å; L535-V544 HydrophobicContact CG-CG1 4.11Å; L535-V544 HydrophobicContact CG-CG2 4.28Å; V538-V544 HydrophobicContact CB-CG2 3.61Å; V538-V544 HydrophobicContact CG1-CG2 3.75Å; V538-V544 HydrophobicContact CG2-CG2 4.4Å; D540-V544 PolarHBondContact O-N 3.46Å; P541-V544 PolarHBondContact O-N 3.35Å; N542-V544 VanDerWaalsContact C-N 3.3Å; N542-V544 PolarHBondContact O-N 3.06Å; V544-G547 PolarHBondContact O-N 2.91Å; V544-M548 HydrophobicContact CG1-CG 3.99Å; V544-M548 VanDerWaalsContact O-CB 3.25Å; V544-M548 WeakPolarHBondContact O-CB 3.48Å; V544-M548 WeakPolarHBondContact O-CG 3.24Å; V544-M548 PolarHBondContact O-N 3.34Å
545	N	91.6	Very high	89.8	Confident	42 Å²	42	57.7 Å²	57.7	23%	0.225	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-49.3	178.9	-173.2	56.7	0	0	0	112.1	M449 V453 P541 N542 M548 A549	M449-N545 WeakPolarHBondContact CE-OD1 3.49Å; V453-N545 HydrophobicContact CG1-CB 4.32Å; V453-N545 HydrophobicContact CG2-CB 4.22Å; P541-N545 WeakPolarHBondContact O-CB 3.42Å; P541-N545 PolarHBondContact O-N 3.43Å; N542-N545 WeakPolarHBondContact O-CB 3.29Å; N542-N545 PolarHBondContact O-N 3.36Å; N545-M548 PolarHBondContact O-N 2.91Å; N545-A549 WeakPolarHBondContact O-CB 3.31Å; N545-A549 PolarHBondContact O-N 3.49Å
546	T	92.3	Very high	89.8	Confident	100 Å²	100	57.9 Å²	57.9	61%	0.613	33%	0.331	S	S	*	.	H	α-helix	trans	-64.1	-43.2	177.6	-56.2	0	0	0	0	111.9	N542 A549 L550	N542-T546 PolarHBondContact O-N 2.9Å; N542-T546 PolarHBondContact O-OG1 3.32Å; T546-A549 PolarHBondContact O-N 3.43Å; T546-L550 WeakPolarHBondContact O-CB 3.3Å; T546-L550 PolarHBondContact O-N 3Å
547	G	92.2	Very high	89.8	Confident	37 Å²	37	62.1 Å²	62.1	38%	0.381	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-41.3	178.5	0	0	0	0	0	113	M543 V544 L550 L551	M543-G547 PolarHBondContact O-N 3.41Å; V544-G547 PolarHBondContact O-N 2.91Å; G547-L550 PolarHBondContact O-N 3.49Å; G547-L551 WeakPolarHBondContact O-CB 3.3Å; G547-L551 PolarHBondContact O-N 3.05Å
548	M	92.1	Very high	89.9	Confident	9 Å²	9	58 Å²	58	4%	0.044	33%	0.328	C	S	.	.	H	α-helix	trans	-69.8	-39.7	177.8	-81.2	-62.3	-58.3	0	0	112.8	M449 L530 L534 V544 N545 L550 L551 N552	M449-M548 HydrophobicContact CG-CB 3.85Å; M449-M548 HydrophobicContact CG-CG 4.44Å; M449-M548 HydrophobicContact SD-CB 3.23Å; M449-M548 WeakPolarHBondContact SD-CB 3.42Å; M449-M548 HydrophobicContact SD-CG 4.37Å; L530-M548 HydrophobicContact CB-CE 4Å; L530-M548 HydrophobicContact CB-SD 4.39Å; L530-M548 HydrophobicContact CD2-CE 3.8Å; L530-M548 HydrophobicContact CD2-SD 3.96Å; L530-M548 HydrophobicContact CG-CE 3.81Å; L530-M548 HydrophobicContact CG-SD 3.69Å; L534-M548 HydrophobicContact CD1-CG 3.66Å; L534-M548 HydrophobicContact CD1-SD 3.32Å; L534-M548 WeakPolarHBondContact CD1-SD 3.22Å; L534-M548 HydrophobicContact CG-SD 4.5Å; V544-M548 HydrophobicContact CG1-CG 3.99Å; V544-M548 VanDerWaalsContact O-CB 3.25Å; V544-M548 WeakPolarHBondContact O-CB 3.48Å; V544-M548 WeakPolarHBondContact O-CG 3.24Å; V544-M548 PolarHBondContact O-N 3.34Å; N545-M548 PolarHBondContact O-N 2.91Å; M548-L550 VanDerWaalsContact C-N 3.32Å; M548-L550 PolarHBondContact O-N 2.98Å; M548-L551 PolarHBondContact O-N 2.96Å; M548-L551 HydrophobicContact SD-CD2 4.23Å; M548-N552 WeakPolarHBondContact O-CB 3.26Å; M548-N552 PolarHBondContact O-N 2.68Å
549	A	91.7	Very high	89.5	Confident	19 Å²	19	55.9 Å²	55.9	16%	0.157	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-44.6	173.3	0	0	0	0	0	111.1	Y446 M449 N545 T546 N552 I553	Y446-A549 HydrophobicContact CE2-CB 4.09Å; M449-A549 HydrophobicContact CE-CB 4.45Å; M449-A549 HydrophobicContact SD-CB 4.49Å; N545-A549 WeakPolarHBondContact O-CB 3.31Å; N545-A549 PolarHBondContact O-N 3.49Å; T546-A549 PolarHBondContact O-N 3.43Å; A549-N552 PolarHBondContact O-N 3.43Å; A549-I553 VanDerWaalsContact O-CG1 3.3Å; A549-I553 WeakPolarHBondContact O-CG1 3.41Å; A549-I553 PolarHBondContact O-N 3.06Å
550	L	93.1	Very high	89.4	Confident	119 Å²	119	50.2 Å²	50.2	62%	0.623	29%	0.289	S	S	*	.	H	α-helix	trans	-63.6	-44.6	176.2	-176.7	66.7	0	0	0	111.9	T546 G547 M548 N552 I553 A554	T546-L550 WeakPolarHBondContact O-CB 3.3Å; T546-L550 PolarHBondContact O-N 3Å; G547-L550 PolarHBondContact O-N 3.49Å; M548-L550 VanDerWaalsContact C-N 3.32Å; M548-L550 PolarHBondContact O-N 2.98Å; L550-N552 VanDerWaalsContact C-N 3.3Å; L550-N552 PolarHBondContact O-N 3.05Å; L550-I553 PolarHBondContact O-N 3.31Å; L550-A554 VanDerWaalsContact O-CB 3.31Å; L550-A554 WeakPolarHBondContact O-CB 3.31Å; L550-A554 PolarHBondContact O-N 3.49Å
551	L	91.6	Very high	89	Confident	91 Å²	91	47.3 Å²	47.3	48%	0.476	28%	0.275	S	S	.	.	H	α-helix	trans	-61.9	-39	177.6	-176.2	66	0	0	0	111.7	L530 G547 M548 G555	L530-L551 HydrophobicContact CD2-CD2 3.68Å; G547-L551 WeakPolarHBondContact O-CB 3.3Å; G547-L551 PolarHBondContact O-N 3.05Å; M548-L551 PolarHBondContact O-N 2.96Å; M548-L551 HydrophobicContact SD-CD2 4.23Å; L551-G555 WeakPolarHBondContact O-CA 3.44Å; L551-G555 PolarHBondContact O-N 3.44Å
552	N	91.2	Very high	88.4	Confident	16 Å²	16	49.7 Å²	49.7	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-47.8	175.8	-173.6	4.4	0	0	0	111.5	A442 P445 Y446 M548 A549 L550 A554 G555 I556	A442-N552 PolarHBondContact O-ND2 3.36Å; P445-N552 WeakPolarHBondContact CG-ND2 3.29Å; Y446-N552 PolarHBondContact N-ND2 2.94Å; M548-N552 WeakPolarHBondContact O-CB 3.26Å; M548-N552 PolarHBondContact O-N 2.68Å; A549-N552 PolarHBondContact O-N 3.43Å; L550-N552 VanDerWaalsContact C-N 3.3Å; L550-N552 PolarHBondContact O-N 3.05Å; N552-A554 PolarHBondContact O-N 3.01Å; N552-G555 PolarHBondContact O-N 3.01Å; N552-I556 WeakPolarHBondContact O-CG2 3.47Å; N552-I556 PolarHBondContact O-N 3.34Å
553	I	90.4	Very high	87.9	Confident	112 Å²	112	48.9 Å²	48.9	57%	0.574	28%	0.277	S	S	*	.	H	α-helix	trans	-62.7	-43.4	178	-66.6	166.1	0	0	0	111.5	A549 L550 I556 L557	A549-I553 VanDerWaalsContact O-CG1 3.3Å; A549-I553 WeakPolarHBondContact O-CG1 3.41Å; A549-I553 PolarHBondContact O-N 3.06Å; L550-I553 PolarHBondContact O-N 3.31Å; I553-I556 WeakPolarHBondContact O-CG2 3.42Å; I553-L557 WeakPolarHBondContact O-CB 3.48Å; I553-L557 PolarHBondContact O-N 2.82Å; I553-L557 VanDerWaalsContact O-N 3.08Å
554	A	90.3	Very high	87.4	Confident	46 Å²	46	49.7 Å²	49.7	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-65.8	-40.8	175.6	0	0	0	0	0	111.5	L550 N552 L557 V558	L550-A554 VanDerWaalsContact O-CB 3.31Å; L550-A554 WeakPolarHBondContact O-CB 3.31Å; L550-A554 PolarHBondContact O-N 3.49Å; N552-A554 PolarHBondContact O-N 3.01Å; A554-L557 PolarHBondContact O-N 2.96Å; A554-V558 WeakPolarHBondContact O-CG2 3.37Å; A554-V558 PolarHBondContact O-N 3.45Å; A554-V558 VanDerWaalsContact O-N 3.07Å
555	G	87.9	Confident	86.8	Confident	7 Å²	7	51 Å²	51	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-42.6	178.5	0	0	0	0	0	112.7	L551 N552 G559	L551-G555 WeakPolarHBondContact O-CA 3.44Å; L551-G555 PolarHBondContact O-N 3.44Å; N552-G555 PolarHBondContact O-N 3.01Å; G555-G559 VanDerWaalsContact O-CA 3.26Å; G555-G559 WeakPolarHBondContact O-CA 3.16Å; G555-G559 PolarHBondContact O-N 3.21Å
556	I	88.3	Confident	86.1	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-71.2	-38.9	176.1	-167.8	75	0	0	0	111.8	Y438 V441 A442 N552 I553 V558 S560 Q582	Y438-I556 HydrophobicContact CD2-CD1 4.17Å; Y438-I556 HydrophobicContact CD2-CG1 3.87Å; Y438-I556 HydrophobicContact CE1-CG1 4.26Å; Y438-I556 HydrophobicContact CE2-CD1 4.09Å; Y438-I556 HydrophobicContact CE2-CG1 3.29Å; Y438-I556 WeakPolarHBondContact OH-CG2 3.35Å; V441-I556 HydrophobicContact CB-CD1 4.21Å; V441-I556 HydrophobicContact CG1-CD1 3.89Å; A442-I556 HydrophobicContact CB-CD1 4.35Å; A442-I556 HydrophobicContact CB-CG1 4.16Å; N552-I556 WeakPolarHBondContact O-CG2 3.47Å; N552-I556 PolarHBondContact O-N 3.34Å; I553-I556 WeakPolarHBondContact O-CG2 3.42Å; I556-V558 VanDerWaalsContact C-N 3.33Å; I556-V558 PolarHBondContact O-N 2.65Å; I556-S560 WeakPolarHBondContact O-CB 3.49Å; I556-S560 PolarHBondContact O-N 2.87Å; I556-S560 PolarHBondContact O-OG 2.62Å; I556-Q582 HydrophobicContact CB-CG 4.44Å; I556-Q582 HydrophobicContact CD1-CB 4.22Å; I556-Q582 HydrophobicContact CD1-CG 4.13Å
557	L	86.6	Confident	85.5	Confident	92 Å²	92	52 Å²	52	48%	0.482	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-42.3	179.1	179.2	63.7	0	0	0	112	I553 A554 L563	I553-L557 WeakPolarHBondContact O-CB 3.48Å; I553-L557 PolarHBondContact O-N 2.82Å; I553-L557 VanDerWaalsContact O-N 3.08Å; A554-L557 PolarHBondContact O-N 2.96Å; L557-L563 HydrophobicContact CD1-CB 4.19Å; L557-L563 HydrophobicContact CD1-CD1 3.49Å; L557-L563 VanDerWaalsContact CD1-CD1 3.49Å; L557-L563 HydrophobicContact CD1-CG 4.38Å
558	V	86.3	Confident	85.1	Confident	15 Å²	15	56.5 Å²	56.5	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-86.5	-37.8	-179.1	178.8	0	0	0	0	111.9	A554 I556 F573 L576 S577	A554-V558 WeakPolarHBondContact O-CG2 3.37Å; A554-V558 PolarHBondContact O-N 3.45Å; A554-V558 VanDerWaalsContact O-N 3.07Å; I556-V558 VanDerWaalsContact C-N 3.33Å; I556-V558 PolarHBondContact O-N 2.65Å; V558-F573 HydrophobicContact CG1-CB 4.35Å; V558-F573 HydrophobicContact CG1-CD1 4.4Å; V558-F573 WeakPolarHBondContact CG1-O 3.36Å; V558-F573 HydrophobicContact CG2-CD1 4.04Å; V558-L576 HydrophobicContact CG1-CB 4.1Å; V558-L576 HydrophobicContact CG1-CD2 4.18Å; V558-L576 HydrophobicContact CG1-CG 4.21Å; V558-L576 HydrophobicContact CG2-CD2 4.33Å; V558-S577 WeakPolarHBondContact O-CB 3.22Å
559	G	80.8	Confident	84.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-85.2	-32.4	-171.8	0	0	0	0	0	114.8	G555 G561 T580 K583	G555-G559 VanDerWaalsContact O-CA 3.26Å; G555-G559 WeakPolarHBondContact O-CA 3.16Å; G555-G559 PolarHBondContact O-N 3.21Å; G559-G561 PolarHBondContact O-N 3.26Å; G559-G561 VanDerWaalsContact O-N 3.15Å; G559-T580 VanDerWaalsContact CA-OG1 3.3Å; G559-T580 WeakPolarHBondContact CA-OG1 3.12Å; G559-K583 WeakPolarHBondContact O-CA 3.39Å; G559-K583 VanDerWaalsContact O-CB 3.3Å; G559-K583 WeakPolarHBondContact O-CB 3.31Å
560	S	80.1	Confident	84.5	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.014	31%	0.311	C	S	.	.	S	Bend	trans	-64.3	-24.1	-169.6	59.4	0	0	0	0	114.7	I556 F562 Y624	I556-S560 WeakPolarHBondContact O-CB 3.49Å; I556-S560 PolarHBondContact O-N 2.87Å; I556-S560 PolarHBondContact O-OG 2.62Å; S560-F562 PolarHBondContact O-N 3.49Å; S560-Y624 PolarHBondContact O-OH 3.29Å
561	G	78.4	Confident	84.2	Confident	7 Å²	7	60.4 Å²	60.4	7%	0.072	31%	0.312	C	S	.	.	S	Bend	trans	67	-2.1	-173.9	0	0	0	0	0	114.7	G559 R564	G559-G561 PolarHBondContact O-N 3.26Å; G559-G561 VanDerWaalsContact O-N 3.15Å; G561-R564 CarbonylContact C-O 3.56Å; G561-R564 VanDerWaalsContact C-O 3.28Å; G561-R564 WeakPolarHBondContact CA-O 3.3Å; G561-R564 CarbonylContact O-C 3.55Å; G561-R564 VanDerWaalsContact O-O 3.13Å
562	F	77.8	Confident	84.1	Confident	84 Å²	84	61.4 Å²	61.4	37%	0.368	32%	0.322	S	S	.	.	S	Bend	trans	-87.1	-52.7	-175.3	173.1	-115.3	0	0	0	113.1	I434 Y438 S560 R564	I434-F562 HydrophobicContact CB-CD2 4.24Å; I434-F562 HydrophobicContact CB-CE2 3.93Å; I434-F562 HydrophobicContact CD1-CD2 4.49Å; I434-F562 HydrophobicContact CD1-CE2 4.21Å; I434-F562 HydrophobicContact CG2-CB 4.36Å; I434-F562 HydrophobicContact CG2-CD1 4.36Å; I434-F562 HydrophobicContact CG2-CD2 3.14Å; I434-F562 HydrophobicContact CG2-CE1 4.49Å; I434-F562 HydrophobicContact CG2-CE2 3.29Å; I434-F562 HydrophobicContact CG2-CG 3.7Å; I434-F562 HydrophobicContact CG2-CZ 3.99Å; Y438-F562 HydrophobicContact CD2-CD1 4.08Å; S560-F562 PolarHBondContact O-N 3.49Å; F562-R564 PolarHBondContact O-N 3.01Å
563	L	79.5	Confident	83.9	Confident	97 Å²	97	65.4 Å²	65.4	51%	0.508	34%	0.339	S	S	.	.	S	Bend	trans	-65.6	-29.9	-179.4	-78.3	156.1	0	0	0	111.8	Y438 L557	Y438-L563 HydrophobicContact CE2-CD1 3.93Å; L557-L563 HydrophobicContact CD1-CB 4.19Å; L557-L563 HydrophobicContact CD1-CD1 3.49Å; L557-L563 VanDerWaalsContact CD1-CD1 3.49Å; L557-L563 HydrophobicContact CD1-CG 4.38Å
564	R	81.3	Confident	83.6	Confident	139 Å²	139	62.7 Å²	62.7	53%	0.525	32%	0.324	S	S	.	.	S	Bend	trans	-150.4	134.7	168.7	-172.4	155.6	-174.3	120.7	0.2	108.6	G561 F562 Q568 M569	G561-R564 CarbonylContact C-O 3.56Å; G561-R564 VanDerWaalsContact C-O 3.28Å; G561-R564 WeakPolarHBondContact CA-O 3.3Å; G561-R564 CarbonylContact O-C 3.55Å; G561-R564 VanDerWaalsContact O-O 3.13Å; F562-R564 PolarHBondContact O-N 3.01Å; R564-Q568 PolarHBondContact NE-O 3.33Å; R564-Q568 VanDerWaalsContact NE-O 3.15Å; R564-Q568 PolarHBondContact NH2-O 3.03Å; R564-M569 HydrophobicContact CB-CE 3.78Å; R564-M569 HydrophobicContact CB-CG 4.29Å; R564-M569 HydrophobicContact CG-CE 4.46Å; R564-M569 HydrophobicContact CG-CG 3.94Å; R564-M569 WeakPolarHBondContact O-CE 3.43Å
565	S	79.4	Confident	83.6	Confident	32 Å²	32	68.6 Å²	68.6	22%	0.224	34%	0.336	C	S	.	.			trans	-62.5	140.2	178.1	59	0	0	0	0	110.4	E567 Q568 M569	S565-E567 PolarHBondContact O-N 3.19Å; S565-Q568 PolarHBondContact O-N 3.46Å; S565-Q568 VanDerWaalsContact O-N 3.08Å; S565-Q568 WeakPolarHBondContact OG-CB 3.26Å; S565-Q568 WeakPolarHBondContact OG-CG 3.29Å; S565-Q568 PolarHBondContact OG-OE1 3.26Å; S565-M569 PolarHBondContact O-N 3.13Å
566	T	77.3	Confident	83.5	Confident	19 Å²	19	72.1 Å²	72.1	12%	0.117	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-59.6	-34	-174.7	-51.4	0	0	0	0	112	M569 Q574	T566-M569 PolarHBondContact O-N 3.18Å; T566-Q574 WeakPolarHBondContact O-CG 3.48Å; T566-Q574 PolarHBondContact O-NE2 3.48Å; T566-Q574 VanDerWaalsContact O-NE2 3.14Å
567	E	79.8	Confident	83.4	Confident	144 Å²	144	71.9 Å²	71.9	67%	0.673	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-70.1	-31.5	178.4	-60.8	-168.5	159.6	0	0	113.3	S565 M569 Q574 P625	S565-E567 PolarHBondContact O-N 3.19Å; E567-M569 VanDerWaalsContact C-N 3.33Å; E567-Q574 PolarHBondContact O-NE2 3.07Å; E567-Q574 VanDerWaalsContact O-NE2 3.09Å; E567-P625 WeakPolarHBondContact OE1-CG 3.26Å
568	Q	83.1	Confident	83.4	Confident	131 Å²	131	72.5 Å²	72.5	61%	0.612	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-89.1	1.7	-178.6	-63.8	178	3.6	0	0	113.6	R564 S565	R564-Q568 PolarHBondContact NE-O 3.33Å; R564-Q568 VanDerWaalsContact NE-O 3.15Å; R564-Q568 PolarHBondContact NH2-O 3.03Å; S565-Q568 PolarHBondContact O-N 3.46Å; S565-Q568 VanDerWaalsContact O-N 3.08Å; S565-Q568 WeakPolarHBondContact OG-CB 3.26Å; S565-Q568 WeakPolarHBondContact OG-CG 3.29Å; S565-Q568 PolarHBondContact OG-OE1 3.26Å
569	M	84.3	Confident	83.5	Confident	18 Å²	18	77.8 Å²	77.8	9%	0.089	38%	0.375	C	S	.	.	S	Bend	trans	-80.1	146.8	174.4	-74.5	-172.2	173.4	0	0	111.3	R564 S565 T566 E567 F573 Q574	R564-M569 HydrophobicContact CB-CE 3.78Å; R564-M569 HydrophobicContact CB-CG 4.29Å; R564-M569 HydrophobicContact CG-CE 4.46Å; R564-M569 HydrophobicContact CG-CG 3.94Å; R564-M569 WeakPolarHBondContact O-CE 3.43Å; S565-M569 PolarHBondContact O-N 3.13Å; T566-M569 PolarHBondContact O-N 3.18Å; E567-M569 VanDerWaalsContact C-N 3.33Å; M569-F573 HydrophobicContact CB-CB 4.3Å; M569-F573 HydrophobicContact SD-CB 4.18Å; M569-Q574 HydrophobicContact CB-CG 4.01Å; M569-Q574 WeakPolarHBondContact O-CG 3.38Å; M569-Q574 PolarHBondContact O-NE2 2.88Å
570	P	87.6	Confident	84	Confident	79 Å²	79	78.5 Å²	78.5	51%	0.513	38%	0.38	S	S	.	.			trans	-55.9	148.1	168.8	-22.9	32.4	0	0	0	112	V572 F573 Q574	P570-V572 PolarHBondContact O-N 2.81Å; P570-F573 HydrophobicContact CB-CD2 4.25Å; P570-F573 HydrophobicContact CG-CD2 4.16Å; P570-F573 PolarHBondContact O-N 2.91Å; P570-Q574 PolarHBondContact O-N 3.27Å; P570-Q574 VanDerWaalsContact O-N 3.12Å
571	M	87.1	Confident	84.5	Confident	133 Å²	133	79.4 Å²	79.4	66%	0.655	38%	0.383	S	S	*	.	H	α-helix	trans	-49.9	-38.9	-173.1	-169.7	179.3	-177.7	0	0	114	F573 Q574 W575	M571-F573 PolarHBondContact O-N 3.47Å; M571-Q574 WeakPolarHBondContact O-CB 2.97Å; M571-Q574 PolarHBondContact O-N 3.3Å; M571-W575 VanDerWaalsContact O-CD1 3.24Å; M571-W575 PolarHBondContact O-N 3.41Å; M571-W575 VanDerWaalsContact O-N 3.11Å
572	V	89.1	Confident	85.2	Confident	112 Å²	112	79.3 Å²	79.3	68%	0.679	38%	0.381	S	S	*	.	H	α-helix	trans	-62	-45.1	178.8	-179.2	0	0	0	0	112	P570 Q574 W575 L576	P570-V572 PolarHBondContact O-N 2.81Å; V572-Q574 VanDerWaalsContact C-N 3.33Å; V572-W575 PolarHBondContact O-N 3.37Å; V572-L576 PolarHBondContact O-N 2.78Å
573	F	86.4	Confident	85.7	Confident	99 Å²	99	75.5 Å²	75.5	43%	0.434	37%	0.365	S	S	.	.	H	α-helix	trans	-73.1	-28.2	179	-67.8	-65.1	0	0	0	112	V558 M569 P570 M571 L576 S577	V558-F573 HydrophobicContact CG1-CB 4.35Å; V558-F573 HydrophobicContact CG1-CD1 4.4Å; V558-F573 WeakPolarHBondContact CG1-O 3.36Å; V558-F573 HydrophobicContact CG2-CD1 4.04Å; M569-F573 HydrophobicContact CB-CB 4.3Å; M569-F573 HydrophobicContact SD-CB 4.18Å; P570-F573 HydrophobicContact CB-CD2 4.25Å; P570-F573 HydrophobicContact CG-CD2 4.16Å; P570-F573 PolarHBondContact O-N 2.91Å; M571-F573 PolarHBondContact O-N 3.47Å; F573-L576 HydrophobicContact CD1-CD2 4.4Å; F573-L576 PolarHBondContact O-N 3.42Å; F573-S577 WeakPolarHBondContact O-CB 3.25Å; F573-S577 PolarHBondContact O-N 3.05Å
574	Q	85.2	Confident	86.3	Confident	55 Å²	55	72 Å²	72	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-50.6	170.6	-66.4	-180	-22	0	0	111	T566 E567 M569 P570 M571 V572 L576 S577 Y578	T566-Q574 WeakPolarHBondContact O-CG 3.48Å; T566-Q574 PolarHBondContact O-NE2 3.48Å; T566-Q574 VanDerWaalsContact O-NE2 3.14Å; E567-Q574 PolarHBondContact O-NE2 3.07Å; E567-Q574 VanDerWaalsContact O-NE2 3.09Å; M569-Q574 HydrophobicContact CB-CG 4.01Å; M569-Q574 WeakPolarHBondContact O-CG 3.38Å; M569-Q574 PolarHBondContact O-NE2 2.88Å; P570-Q574 PolarHBondContact O-N 3.27Å; P570-Q574 VanDerWaalsContact O-N 3.12Å; M571-Q574 WeakPolarHBondContact O-CB 2.97Å; M571-Q574 PolarHBondContact O-N 3.3Å; V572-Q574 VanDerWaalsContact C-N 3.33Å; Q574-L576 VanDerWaalsContact C-N 3.32Å; Q574-L576 PolarHBondContact O-N 3.12Å; Q574-S577 WeakPolarHBondContact O-CB 3.32Å; Q574-S577 PolarHBondContact O-N 3.35Å; Q574-S577 VanDerWaalsContact O-N 3.16Å; Q574-S577 PolarHBondContact O-OG 3.46Å; Q574-Y578 WeakPolarHBondContact O-CD2 3.43Å; Q574-Y578 PolarHBondContact O-N 2.91Å
575	W	88.9	Confident	86.8	Confident	171 Å²	171	65.3 Å²	65.3	65%	0.648	32%	0.32	S	S	*	.	H	α-helix	trans	-58.8	-43.3	175.2	-80.9	100.1	0	0	0	112.3	M571 V572 S577 Y578	M571-W575 VanDerWaalsContact O-CD1 3.24Å; M571-W575 PolarHBondContact O-N 3.41Å; M571-W575 VanDerWaalsContact O-N 3.11Å; V572-W575 PolarHBondContact O-N 3.37Å; W575-S577 VanDerWaalsContact C-N 3.29Å; W575-S577 PolarHBondContact O-N 3.03Å; W575-Y578 PolarHBondContact O-N 3.41Å
576	L	86.9	Confident	87.2	Confident	80 Å²	80	64 Å²	64	42%	0.419	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-34.5	177.8	-168.8	66.4	0	0	0	112.2	V558 V572 F573 Q574 Y578 L579	V558-L576 HydrophobicContact CG1-CB 4.1Å; V558-L576 HydrophobicContact CG1-CD2 4.18Å; V558-L576 HydrophobicContact CG1-CG 4.21Å; V558-L576 HydrophobicContact CG2-CD2 4.33Å; V572-L576 PolarHBondContact O-N 2.78Å; F573-L576 HydrophobicContact CD1-CD2 4.4Å; F573-L576 PolarHBondContact O-N 3.42Å; Q574-L576 VanDerWaalsContact C-N 3.32Å; Q574-L576 PolarHBondContact O-N 3.12Å; L576-Y578 VanDerWaalsContact C-N 3.29Å; L576-Y578 PolarHBondContact O-N 2.91Å; L576-L579 HydrophobicContact CD1-CD1 4.45Å; L576-L579 PolarHBondContact O-N 3.15Å; L576-L579 VanDerWaalsContact O-N 3.1Å
577	S	86	Confident	87.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-32.7	177	79.9	0	0	0	0	112.9	V558 F573 Q574 W575 L579 T580 K583	V558-S577 WeakPolarHBondContact O-CB 3.22Å; F573-S577 WeakPolarHBondContact O-CB 3.25Å; F573-S577 PolarHBondContact O-N 3.05Å; Q574-S577 WeakPolarHBondContact O-CB 3.32Å; Q574-S577 PolarHBondContact O-N 3.35Å; Q574-S577 VanDerWaalsContact O-N 3.16Å; Q574-S577 PolarHBondContact O-OG 3.46Å; W575-S577 VanDerWaalsContact C-N 3.29Å; W575-S577 PolarHBondContact O-N 3.03Å; S577-L579 PolarHBondContact O-N 3.08Å; S577-T580 PolarHBondContact O-N 3.11Å; S577-T580 PolarHBondContact O-OG1 3.14Å; S577-K583 WeakPolarHBondContact O-CB 3.46Å; S577-K583 VanDerWaalsContact O-CD 3.31Å; S577-K583 WeakPolarHBondContact O-CD 3.49Å
578	Y	87.1	Confident	88.3	Confident	104 Å²	104	56.5 Å²	56.5	41%	0.408	27%	0.274	S	S	.	.	H	α-helix	trans	-73.3	-16.1	176.4	-68.1	-73.3	0	0	0	113	Q574 W575 L576 K583 Y584	Q574-Y578 WeakPolarHBondContact O-CD2 3.43Å; Q574-Y578 PolarHBondContact O-N 2.91Å; W575-Y578 PolarHBondContact O-N 3.41Å; L576-Y578 VanDerWaalsContact C-N 3.29Å; L576-Y578 PolarHBondContact O-N 2.91Å; Y578-K583 HydrophobicContact CD1-CD 4.29Å; Y578-K583 VanDerWaalsContact CD1-NZ 3.34Å; Y578-Y584 WeakPolarHBondContact O-CE2 3.27Å; Y578-Y584 PolarHBondContact O-OH 3.25Å
579	L	88.4	Confident	88.6	Confident	126 Å²	126	50.4 Å²	50.4	66%	0.66	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.1	176.8	-66.8	172.7	0	0	0	113	L576 S577 F641	L576-L579 HydrophobicContact CD1-CD1 4.45Å; L576-L579 PolarHBondContact O-N 3.15Å; L576-L579 VanDerWaalsContact O-N 3.1Å; S577-L579 PolarHBondContact O-N 3.08Å; L579-F641 WeakPolarHBondContact O-CE1 3.17Å
580	T	90.5	Very high	88.8	Confident	17 Å²	17	49.8 Å²	49.8	10%	0.104	24%	0.243	C	C	.	.			trans	-94.3	135.4	-176.2	61.7	0	0	0	0	111.3	G559 S577 Q582 K583 Y584	G559-T580 VanDerWaalsContact CA-OG1 3.3Å; G559-T580 WeakPolarHBondContact CA-OG1 3.12Å; S577-T580 PolarHBondContact O-N 3.11Å; S577-T580 PolarHBondContact O-OG1 3.14Å; T580-Q582 PolarHBondContact O-N 2.8Å; T580-K583 PolarHBondContact O-N 3.09Å; T580-Y584 WeakPolarHBondContact O-CD2 3.31Å
581	F	91.4	Very high	88.8	Confident	20 Å²	20	46.3 Å²	46.3	9%	0.088	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-24	173.3	62.9	-94.9	0	0	0	111.8	P445 P523 T526 K583 Y584 S585 L638 F641	P445-F581 HydrophobicContact CB-CE2 4.22Å; P445-F581 HydrophobicContact CB-CZ 3.93Å; P445-F581 HydrophobicContact CG-CE2 4.07Å; P445-F581 HydrophobicContact CG-CZ 4.09Å; P523-F581 HydrophobicContact CB-CD2 4.16Å; P523-F581 HydrophobicContact CB-CE2 3.85Å; P523-F581 HydrophobicContact CG-CD2 4.2Å; P523-F581 HydrophobicContact CG-CE2 4.35Å; T526-F581 HydrophobicContact CG2-CD1 3.49Å; T526-F581 VanDerWaalsContact CG2-CD1 3.49Å; T526-F581 HydrophobicContact CG2-CD2 4.46Å; T526-F581 HydrophobicContact CG2-CE1 3.53Å; T526-F581 HydrophobicContact CG2-CE2 4.5Å; T526-F581 HydrophobicContact CG2-CG 3.98Å; T526-F581 HydrophobicContact CG2-CZ 4.05Å; F581-K583 VanDerWaalsContact C-N 3.3Å; F581-K583 PolarHBondContact O-N 3.04Å; F581-Y584 PolarHBondContact O-N 3.48Å; F581-S585 PolarHBondContact O-N 3.15Å; F581-S585 PolarHBondContact O-OG 3.04Å; F581-S585 VanDerWaalsContact O-OG 3.06Å; F581-L638 HydrophobicContact CB-CD1 4.07Å; F581-F641 HydrophobicContact CB-CD2 4.09Å; F581-F641 HydrophobicContact CB-CE2 4.2Å; F581-F641 HydrophobicContact CB-CG 4.28Å; F581-F641 HydrophobicContact CB-CZ 4.46Å
582	Q	91.4	Very high	88.9	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-37.6	178.4	-70.1	87.3	-19.1	0	0	112.3	V441 I556 T580 S585 C586	V441-Q582 HydrophobicContact CG1-CB 4.05Å; V441-Q582 HydrophobicContact CG1-CG 3.96Å; I556-Q582 HydrophobicContact CB-CG 4.44Å; I556-Q582 HydrophobicContact CD1-CB 4.22Å; I556-Q582 HydrophobicContact CD1-CG 4.13Å; T580-Q582 PolarHBondContact O-N 2.8Å; Q582-S585 PolarHBondContact O-N 3.07Å; Q582-C586 WeakPolarHBondContact O-CB 3.49Å; Q582-C586 PolarHBondContact O-N 3.36Å; Q582-C586 PolarHBondContact O-SG 3.12Å; Q582-C586 VanDerWaalsContact O-SG 3.35Å
583	K	90	Very high	88.7	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-57.7	-57.5	177.3	175.8	176.6	179.5	156.6	0	111.8	G559 S577 Y578 T580 F581 S585 C586 E587	G559-K583 WeakPolarHBondContact O-CA 3.39Å; G559-K583 VanDerWaalsContact O-CB 3.3Å; G559-K583 WeakPolarHBondContact O-CB 3.31Å; S577-K583 WeakPolarHBondContact O-CB 3.46Å; S577-K583 VanDerWaalsContact O-CD 3.31Å; S577-K583 WeakPolarHBondContact O-CD 3.49Å; Y578-K583 HydrophobicContact CD1-CD 4.29Å; Y578-K583 VanDerWaalsContact CD1-NZ 3.34Å; T580-K583 PolarHBondContact O-N 3.09Å; F581-K583 VanDerWaalsContact C-N 3.3Å; F581-K583 PolarHBondContact O-N 3.04Å; K583-S585 VanDerWaalsContact C-N 3.26Å; K583-S585 PolarHBondContact O-N 3.4Å; K583-C586 PolarHBondContact O-N 3.08Å; K583-C586 VanDerWaalsContact O-N 3.14Å; K583-E587 VanDerWaalsContact CE-OE1 3.24Å; K583-E587 WeakPolarHBondContact CE-OE1 3.27Å; K583-E587 PolarHBondContact O-N 2.95Å
584	Y	90.7	Very high	88.6	Confident	22 Å²	22	30.5 Å²	30.5	9%	0.086	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-35.5	-178.9	-55.4	-70.9	0	0	0	111.6	Y578 T580 F581 L588 D634 L637 F641	Y578-Y584 WeakPolarHBondContact O-CE2 3.27Å; Y578-Y584 PolarHBondContact O-OH 3.25Å; T580-Y584 WeakPolarHBondContact O-CD2 3.31Å; F581-Y584 PolarHBondContact O-N 3.48Å; Y584-L588 WeakPolarHBondContact O-CB 3.42Å; Y584-L588 WeakPolarHBondContact O-CD1 3.49Å; Y584-L588 WeakPolarHBondContact O-CG 3.35Å; Y584-L588 PolarHBondContact O-N 3.07Å; Y584-L588 VanDerWaalsContact O-N 3.13Å; Y584-D634 HydrophobicContact CD1-CB 4.32Å; Y584-L637 HydrophobicContact CD1-CB 4.16Å; Y584-L637 HydrophobicContact CD1-CD1 4.06Å; Y584-L637 HydrophobicContact CE1-CB 4.12Å; Y584-L637 HydrophobicContact CE1-CD1 3.33Å; Y584-L637 HydrophobicContact CE1-CG 4.39Å; Y584-L637 HydrophobicContact CG-CB 4.4Å; Y584-F641 AromaticContact CD2-CE2 3.95Å; Y584-F641 HydrophobicContact CD2-CE2 3.95Å; Y584-F641 AromaticContact CE2-CE2 4Å; Y584-F641 HydrophobicContact CE2-CE2 4Å; Y584-F641 HydrophobicContact CE2-CZ 4.25Å
585	S	91.7	Very high	88.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-44	174	-62.3	0	0	0	0	112.7	P523 F581 Q582 K583 L589 L638	P523-S585 WeakPolarHBondContact CG-OG 3.43Å; F581-S585 PolarHBondContact O-N 3.15Å; F581-S585 PolarHBondContact O-OG 3.04Å; F581-S585 VanDerWaalsContact O-OG 3.06Å; Q582-S585 PolarHBondContact O-N 3.07Å; K583-S585 VanDerWaalsContact C-N 3.26Å; K583-S585 PolarHBondContact O-N 3.4Å; S585-L589 WeakPolarHBondContact O-CB 3.43Å; S585-L589 VanDerWaalsContact O-CG 3.26Å; S585-L589 WeakPolarHBondContact O-CG 3.13Å; S585-L589 PolarHBondContact O-N 3.03Å; S585-L638 VanDerWaalsContact OG-CD1 3.32Å; S585-L638 WeakPolarHBondContact OG-CD1 3.4Å
586	C	89.5	Confident	87.9	Confident	4 Å²	4	27.5 Å²	27.5	3%	0.027	14%	0.137	C	C	.	.	H	α-helix	trans	-66.4	-46.5	178.6	-74.2	0	0	0	0	112	Q582 K583 L588 L589 I590	Q582-C586 WeakPolarHBondContact O-CB 3.49Å; Q582-C586 PolarHBondContact O-N 3.36Å; Q582-C586 PolarHBondContact O-SG 3.12Å; Q582-C586 VanDerWaalsContact O-SG 3.35Å; K583-C586 PolarHBondContact O-N 3.08Å; K583-C586 VanDerWaalsContact O-N 3.14Å; C586-L588 VanDerWaalsContact C-N 3.35Å; C586-L588 PolarHBondContact O-N 2.85Å; C586-L589 PolarHBondContact O-N 2.86Å; C586-I590 WeakPolarHBondContact O-CB 3.18Å; C586-I590 VanDerWaalsContact O-CG1 3.26Å; C586-I590 WeakPolarHBondContact O-CG1 3.29Å; C586-I590 PolarHBondContact O-N 3.29Å
587	E	88.8	Confident	87.6	Confident	5 Å²	5	24.4 Å²	24.4	2%	0.023	12%	0.121	C	C	.	.	H	α-helix	trans	-58.3	-45.5	177.6	-74.2	175.3	159.2	0	0	111.1	K583 V591 Y624 A627 R630	K583-E587 VanDerWaalsContact CE-OE1 3.24Å; K583-E587 WeakPolarHBondContact CE-OE1 3.27Å; K583-E587 PolarHBondContact O-N 2.95Å; E587-V591 VanDerWaalsContact O-CG2 3.32Å; E587-V591 WeakPolarHBondContact O-CG2 3.36Å; E587-V591 PolarHBondContact O-N 3.49Å; E587-Y624 HydrophobicContact CG-CD1 3.63Å; E587-Y624 HydrophobicContact CG-CE1 4.19Å; E587-Y624 HydrophobicContact CG-CG 4.37Å; E587-A627 HydrophobicContact CB-CB 4.49Å; E587-R630 IonicContact OE1-NH2 2.84Å
588	L	90.6	Very high	87.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-43.4	177.9	-72.8	173.4	0	0	0	113.4	V519 Y584 C586 T592 Y631 D634 F635 L638	V519-L588 HydrophobicContact CG1-CB 4.27Å; V519-L588 HydrophobicContact CG2-CB 3.88Å; V519-L588 HydrophobicContact CG2-CD1 3.89Å; Y584-L588 WeakPolarHBondContact O-CB 3.42Å; Y584-L588 WeakPolarHBondContact O-CD1 3.49Å; Y584-L588 WeakPolarHBondContact O-CG 3.35Å; Y584-L588 PolarHBondContact O-N 3.07Å; Y584-L588 VanDerWaalsContact O-N 3.13Å; C586-L588 VanDerWaalsContact C-N 3.35Å; C586-L588 PolarHBondContact O-N 2.85Å; L588-T592 VanDerWaalsContact O-CB 3.29Å; L588-T592 WeakPolarHBondContact O-CB 3.06Å; L588-T592 PolarHBondContact O-N 3.04Å; L588-T592 PolarHBondContact O-OG1 2.7Å; L588-Y631 HydrophobicContact CD2-CD2 3.61Å; L588-Y631 HydrophobicContact CD2-CE2 3.76Å; L588-Y631 HydrophobicContact CD2-CG 4.21Å; L588-Y631 WeakPolarHBondContact CD2-O 3.39Å; L588-D634 HydrophobicContact CD1-CB 4.28Å; L588-D634 HydrophobicContact CD2-CB 3.82Å; L588-D634 HydrophobicContact CG-CB 3.91Å; L588-F635 HydrophobicContact CD1-CD1 4.11Å; L588-F635 HydrophobicContact CD1-CD2 4.13Å; L588-F635 HydrophobicContact CD1-CE1 4.28Å; L588-F635 HydrophobicContact CD1-CE2 4.29Å; L588-F635 HydrophobicContact CD1-CG 4.03Å; L588-F635 HydrophobicContact CD1-CZ 4.36Å; L588-F635 HydrophobicContact CD2-CD2 3.51Å; L588-F635 HydrophobicContact CD2-CE2 3.6Å; L588-F635 HydrophobicContact CD2-CG 4.2Å; L588-F635 HydrophobicContact CD2-CZ 4.36Å; L588-F635 HydrophobicContact CG-CD2 4.47Å; L588-F635 HydrophobicContact CG-CE2 4.48Å; L588-L638 HydrophobicContact CD1-CB 4.5Å; L588-L638 HydrophobicContact CD1-CD2 3.87Å
589	L	90.1	Very high	86.8	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-68.8	-38	-179.9	-72.3	177.2	0	0	0	111.9	I437 V441 F516 V519 S585 C586 T592 E593	I437-L589 HydrophobicContact CD1-CB 4.35Å; I437-L589 HydrophobicContact CG1-CB 4.32Å; I437-L589 HydrophobicContact CG2-CB 3.68Å; I437-L589 HydrophobicContact CG2-CD1 3.89Å; I437-L589 HydrophobicContact CG2-CG 4.44Å; V441-L589 HydrophobicContact CG2-CD1 3.5Å; V441-L589 VanDerWaalsContact CG2-CD1 3.5Å; F516-L589 HydrophobicContact CB-CD2 4.44Å; F516-L589 HydrophobicContact CD2-CD2 3.48Å; F516-L589 VanDerWaalsContact CD2-CD2 3.48Å; F516-L589 HydrophobicContact CE2-CD2 3.99Å; F516-L589 HydrophobicContact CG-CD2 4.2Å; V519-L589 HydrophobicContact CB-CD2 3.94Å; V519-L589 HydrophobicContact CB-CG 4.3Å; V519-L589 HydrophobicContact CG1-CD1 4.19Å; V519-L589 HydrophobicContact CG1-CD2 3.91Å; V519-L589 HydrophobicContact CG1-CG 3.69Å; S585-L589 WeakPolarHBondContact O-CB 3.43Å; S585-L589 VanDerWaalsContact O-CG 3.26Å; S585-L589 WeakPolarHBondContact O-CG 3.13Å; S585-L589 PolarHBondContact O-N 3.03Å; C586-L589 PolarHBondContact O-N 2.86Å; L589-T592 PolarHBondContact O-N 3.31Å; L589-E593 WeakPolarHBondContact O-CB 3.4Å; L589-E593 PolarHBondContact O-N 2.93Å
590	I	88.3	Confident	86.2	Confident	6 Å²	6	26 Å²	26	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-46.9	177.2	-72.1	174.2	0	0	0	110.4	I437 C586 T592 E593 F594 I620 Y624	I437-I590 HydrophobicContact CD1-CG1 4.01Å; I437-I590 HydrophobicContact CG2-CG1 4.46Å; C586-I590 WeakPolarHBondContact O-CB 3.18Å; C586-I590 VanDerWaalsContact O-CG1 3.26Å; C586-I590 WeakPolarHBondContact O-CG1 3.29Å; C586-I590 PolarHBondContact O-N 3.29Å; I590-T592 VanDerWaalsContact C-N 3.31Å; I590-T592 PolarHBondContact O-N 2.95Å; I590-E593 PolarHBondContact O-N 3.4Å; I590-F594 HydrophobicContact CB-CD2 4.36Å; I590-F594 HydrophobicContact CG2-CD2 3.82Å; I590-F594 HydrophobicContact CG2-CE2 4.39Å; I590-F594 WeakPolarHBondContact O-CB 3.09Å; I590-F594 WeakPolarHBondContact O-CD2 3.48Å; I590-F594 PolarHBondContact O-N 3.42Å; I590-I620 HydrophobicContact CG2-CG1 4.32Å; I590-Y624 HydrophobicContact CD1-CD2 3.97Å; I590-Y624 HydrophobicContact CD1-CE1 4.39Å; I590-Y624 HydrophobicContact CD1-CE2 3.2Å; I590-Y624 VanDerWaalsContact CD1-CZ 3.45Å; I590-Y624 WeakPolarHBondContact CD1-OH 3.45Å; I590-Y624 HydrophobicContact CG1-CE2 4.49Å; I590-Y624 HydrophobicContact CG2-CD2 4.12Å; I590-Y624 HydrophobicContact CG2-CE2 4.32Å
591	V	87.8	Confident	85	Confident	5 Å²	5	27.3 Å²	27.3	3%	0.03	14%	0.141	C	C	.	.	H	α-helix	trans	-61.5	-42.4	176	173.3	0	0	0	0	111	E587 E593 L595 I620 A627 L628 Y631	E587-V591 VanDerWaalsContact O-CG2 3.32Å; E587-V591 WeakPolarHBondContact O-CG2 3.36Å; E587-V591 PolarHBondContact O-N 3.49Å; V591-E593 VanDerWaalsContact C-N 3.31Å; V591-E593 PolarHBondContact O-N 3.42Å; V591-L595 WeakPolarHBondContact O-CB 3.34Å; V591-L595 PolarHBondContact O-N 2.87Å; V591-I620 HydrophobicContact CG2-CG2 4.25Å; V591-A627 HydrophobicContact CG2-CB 3.66Å; V591-L628 HydrophobicContact CG1-CD1 4.19Å; V591-Y631 HydrophobicContact CB-CD2 3.97Å; V591-Y631 HydrophobicContact CB-CE2 4.1Å; V591-Y631 HydrophobicContact CG1-CD2 3.58Å; V591-Y631 HydrophobicContact CG1-CE2 3.82Å; V591-Y631 HydrophobicContact CG1-CG 4.46Å
592	T	87.3	Confident	83.5	Confident	10 Å²	10	33.7 Å²	33.7	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-36.7	-179.4	-57.5	0	0	0	0	112	R512 C515 L588 L589 I590 Y631	R512-T592 HydrophobicContact CB-CG2 3.75Å; R512-T592 WeakPolarHBondContact CD-O 3.17Å; R512-T592 HydrophobicContact CG-CG2 4.1Å; R512-T592 PolarHBondContact NH1-O 2.96Å; C515-T592 HydrophobicContact CB-CG2 4.08Å; L588-T592 VanDerWaalsContact O-CB 3.29Å; L588-T592 WeakPolarHBondContact O-CB 3.06Å; L588-T592 PolarHBondContact O-N 3.04Å; L588-T592 PolarHBondContact O-OG1 2.7Å; L589-T592 PolarHBondContact O-N 3.31Å; I590-T592 VanDerWaalsContact C-N 3.31Å; I590-T592 PolarHBondContact O-N 2.95Å; T592-Y631 PolarHBondContact OG1-OH 3.22Å
593	E	85.8	Confident	81.7	Confident	3 Å²	3	35.9 Å²	35.9	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-83.8	-48.6	-177.7	-176	65.6	174.2	0	0	112.8	R433 I437 M506 H507 L589 I590 V591 L597	R433-E593 IonicContact CZ-OE1 2.61Å; R433-E593 IonicContact NH1-OE1 2.76Å; R433-E593 PolarHBondContact NH1-OE1 3Å; I437-E593 HydrophobicContact CD1-CB 4.23Å; M506-E593 HydrophobicContact CE-CB 4.43Å; M506-E593 VanDerWaalsContact CE-CD 3.45Å; M506-E593 HydrophobicContact CE-CG 4.13Å; M506-E593 VanDerWaalsContact CE-OE2 3.25Å; M506-E593 WeakPolarHBondContact CE-OE2 3.46Å; H507-E593 PolarHBondContact N-OE2 3.5Å; L589-E593 WeakPolarHBondContact O-CB 3.4Å; L589-E593 PolarHBondContact O-N 2.93Å; I590-E593 PolarHBondContact O-N 3.4Å; V591-E593 VanDerWaalsContact C-N 3.31Å; V591-E593 PolarHBondContact O-N 3.42Å; E593-L597 HydrophobicContact CG-CD1 4.48Å; E593-L597 WeakPolarHBondContact O-CD1 3.43Å; E593-L597 WeakPolarHBondContact O-CG 3.36Å
594	F	84.4	Confident	79.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-84.3	-17.2	-169.2	-73.1	-85.1	0	0	0	114.8	V430 R433 I434 I437 I590 N596 L597 F599 G616 I619 I620	V430-F594 HydrophobicContact CG1-CE1 4.24Å; V430-F594 HydrophobicContact CG1-CZ 4.38Å; R433-F594 HydrophobicContact CB-CE1 4.5Å; R433-F594 HydrophobicContact CB-CE2 4.41Å; R433-F594 HydrophobicContact CB-CZ 3.77Å; I434-F594 HydrophobicContact CD1-CZ 4.48Å; I434-F594 HydrophobicContact CG1-CE2 4.08Å; I434-F594 HydrophobicContact CG1-CZ 3.85Å; I437-F594 HydrophobicContact CD1-CE2 4.26Å; I590-F594 HydrophobicContact CB-CD2 4.36Å; I590-F594 HydrophobicContact CG2-CD2 3.82Å; I590-F594 HydrophobicContact CG2-CE2 4.39Å; I590-F594 WeakPolarHBondContact O-CB 3.09Å; I590-F594 WeakPolarHBondContact O-CD2 3.48Å; I590-F594 PolarHBondContact O-N 3.42Å; F594-N596 PolarHBondContact O-N 3.45Å; F594-L597 PolarHBondContact O-N 3.23Å; F594-F599 HydrophobicContact CD1-CE2 4.07Å; F594-F599 AromaticContact CD1-CZ 3.81Å; F594-F599 HydrophobicContact CD1-CZ 3.81Å; F594-F599 HydrophobicContact CE1-CE2 4.23Å; F594-F599 AromaticContact CE1-CZ 3.69Å; F594-F599 HydrophobicContact CE1-CZ 3.69Å; F594-G616 WeakPolarHBondContact O-CA 3.44Å; F594-I619 HydrophobicContact CD1-CB 4.46Å; F594-I619 HydrophobicContact CD1-CD1 3.66Å; F594-I619 HydrophobicContact CD1-CG2 4.43Å; F594-I619 HydrophobicContact CE1-CD1 3.62Å; F594-I619 HydrophobicContact CE1-CG2 4.44Å; F594-I620 HydrophobicContact CB-CD1 3.97Å; F594-I620 HydrophobicContact CB-CG1 4.01Å
595	L	81.7	Confident	77.8	Confident	53 Å²	53	50.1 Å²	50.1	28%	0.277	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	125.2	179.8	-175.2	68.3	0	0	0	111.1	R512 V591 L597 L628	R512-L595 VanDerWaalsContact CZ-O 3.3Å; R512-L595 PolarHBondContact NH1-O 3.46Å; R512-L595 PolarHBondContact NH2-O 3.01Å; V591-L595 WeakPolarHBondContact O-CB 3.34Å; V591-L595 PolarHBondContact O-N 2.87Å; L595-L597 VanDerWaalsContact C-N 3.27Å; L595-L597 PolarHBondContact O-N 3.44Å; L595-L628 HydrophobicContact CD1-CD1 3.65Å
596	N	78.5	Confident	75.6	Confident	110 Å²	110	55.6 Å²	55.6	59%	0.588	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	23.5	-178.1	-53	-41.3	0	0	0	115.4	F594	F594-N596 PolarHBondContact O-N 3.45Å
597	L	80	Confident	73.5	Confident	14 Å²	14	62 Å²	62	7%	0.073	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-88.9	127.1	169.8	-77.9	-177.5	0	0	0	111.3	M423 E593 F594 L595 F599 G616	M423-L597 HydrophobicContact CE-CD2 4.33Å; E593-L597 HydrophobicContact CG-CD1 4.48Å; E593-L597 WeakPolarHBondContact O-CD1 3.43Å; E593-L597 WeakPolarHBondContact O-CG 3.36Å; F594-L597 PolarHBondContact O-N 3.23Å; L595-L597 VanDerWaalsContact C-N 3.27Å; L595-L597 PolarHBondContact O-N 3.44Å; L597-F599 HydrophobicContact CB-CE2 4.4Å; L597-F599 HydrophobicContact CB-CZ 4.35Å; L597-F599 HydrophobicContact CD1-CZ 4.34Å; L597-G616 PolarHBondContact O-N 2.92Å
598	E	79.1	Confident	71.4	Confident	158 Å²	158	68.5 Å²	68.5	74%	0.738	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-100.6	131	168.8	-66	-171.1	170.4	0	0	110.1	M423	M423-E598 WeakPolarHBondContact CE-O 3.13Å
599	F	77.4	Confident	69.4	Low	11 Å²	11	72.3 Å²	72.3	5%	0.048	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-103.7	138.3	178	-63	-79.7	0	0	0	111.5	V425 A429 V430 F594 L597 C601 T614 I619	V425-F599 HydrophobicContact CG2-CB 3.31Å; V425-F599 HydrophobicContact CG2-CG 4.06Å; A429-F599 HydrophobicContact CB-CD1 4.4Å; A429-F599 HydrophobicContact CB-CE1 4.48Å; V430-F599 HydrophobicContact CG2-CD1 4.48Å; V430-F599 HydrophobicContact CG2-CD2 4.48Å; V430-F599 HydrophobicContact CG2-CE1 4.16Å; V430-F599 HydrophobicContact CG2-CE2 4.17Å; V430-F599 HydrophobicContact CG2-CZ 4.01Å; F594-F599 HydrophobicContact CD1-CE2 4.07Å; F594-F599 AromaticContact CD1-CZ 3.81Å; F594-F599 HydrophobicContact CD1-CZ 3.81Å; F594-F599 HydrophobicContact CE1-CE2 4.23Å; F594-F599 AromaticContact CE1-CZ 3.69Å; F594-F599 HydrophobicContact CE1-CZ 3.69Å; L597-F599 HydrophobicContact CB-CE2 4.4Å; L597-F599 HydrophobicContact CB-CZ 4.35Å; L597-F599 HydrophobicContact CD1-CZ 4.34Å; F599-C601 PolarHBondContact O-N 2.94Å; F599-T614 PolarHBondContact N-O 3.21Å; F599-I619 HydrophobicContact CD2-CD1 4.36Å; F599-I619 HydrophobicContact CE2-CD1 3.61Å; F599-I619 HydrophobicContact CZ-CD1 4.23Å
600	N	74.3	Confident	67.2	Low	94 Å²	94	74.2 Å²	74.2	50%	0.503	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-80.7	123.9	177.7	-69.9	-15.7	0	0	0	109.8	M423 V425	M423-N600 PolarHBondContact O-N 3.39Å; M423-N600 VanDerWaalsContact O-N 3.15Å; V425-N600 PolarHBondContact N-O 3.21Å
601	C	66.5	Low	65.6	Low	45 Å²	45	76 Å²	76	30%	0.304	46%	0.461	S	S	.	.			trans	-115.9	94.6	169.3	-177.3	0	0	0	0	109.9	F599 G603 C611	F599-C601 PolarHBondContact O-N 2.94Å; C601-G603 PolarHBondContact O-N 2.91Å; C601-G603 VanDerWaalsContact O-N 3.12Å; C601-C611 HydrophobicContact CB-CB 3.77Å; C601-C611 WeakPolarHBondContact CB-SG 3.32Å; C601-C611 WeakPolarHBondContact SG-CB 3.38Å; C601-C611 CovalentContact SG-SG 2.02Å; C601-C611 PolarHBondContact SG-SG 2.86Å
602	N	59	Low	64.2	Low	155 Å²	155	81.4 Å²	81.4	83%	0.829	49%	0.493	S	S	*	.			trans	-85.7	49.8	173.3	-96.6	-7.6	0	0	0	112.1
603	G	54.6	Low	63	Low	52 Å²	52	82.3 Å²	82.3	54%	0.536	50%	0.499	S	S	.	.			trans	-109.8	97.6	176.5	0	0	0	0	0	111.8	C601 K605	C601-G603 PolarHBondContact O-N 2.91Å; C601-G603 VanDerWaalsContact O-N 3.12Å; G603-K605 PolarHBondContact O-N 2.9Å
604	T	50.4	Low	62.2	Low	140 Å²	140	85.9 Å²	85.9	86%	0.859	52%	0.521	S	S	*	.			trans	-67	114.9	166.7	32.1	0	0	0	0	110.3
605	K	47.4	Very low	61.8	Low	184 Å²	184	87.4 Å²	87.4	80%	0.8	53%	0.531	S	S	*	.	S	Bend	trans	70.8	121.3	165.2	-62.4	-177.7	178.2	178.6	0	118.6	G603 L607	G603-K605 PolarHBondContact O-N 2.9Å; K605-L607 PolarHBondContact O-N 3.33Å; K605-L607 VanDerWaalsContact O-N 3.16Å
606	S	46.8	Very low	61.4	Low	116 Å²	116	84.9 Å²	84.9	81%	0.811	52%	0.518	S	S	*	.			trans	7.8	86	145.3	64.4	0	0	0	0	117.8
607	L	44.3	Very low	61.3	Low	139 Å²	139	82.4 Å²	82.4	73%	0.728	51%	0.505	S	S	*	.			trans	-109.4	153.8	144.5	-96.2	87.2	0	0	0	108.4	K605 G609 G610	K605-L607 PolarHBondContact O-N 3.33Å; K605-L607 VanDerWaalsContact O-N 3.16Å; L607-G609 PolarHBondContact O-N 2.77Å; L607-G610 PolarHBondContact O-N 3.48Å
608	P	45.8	Very low	61.2	Low	141 Å²	141	85.6 Å²	85.6	92%	0.916	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	99.2	174	28.5	-29.8	0	0	0	107.8
609	G	48.8	Very low	61	Low	80 Å²	80	79 Å²	79	83%	0.825	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.3	4.6	-163.6	0	0	0	0	0	114.4	L607	L607-G609 PolarHBondContact O-N 2.77Å
610	G	43.2	Very low	61.1	Low	42 Å²	42	78.7 Å²	78.7	43%	0.433	49%	0.488	S	S	.	.			trans	-63	156.5	175.8	0	0	0	0	0	114.1	L607 V612	L607-G610 PolarHBondContact O-N 3.48Å; G610-V612 VanDerWaalsContact O-CG2 3.26Å; G610-V612 WeakPolarHBondContact O-CG2 3.45Å; G610-V612 PolarHBondContact O-N 3.44Å
611	C	54.8	Low	61.2	Low	44 Å²	44	79.3 Å²	79.3	30%	0.297	49%	0.491	S	S	.	.			trans	-49.7	103.5	178.8	-68.5	0	0	0	0	112	C601 V613	C601-C611 HydrophobicContact CB-CB 3.77Å; C601-C611 WeakPolarHBondContact CB-SG 3.32Å; C601-C611 WeakPolarHBondContact SG-CB 3.38Å; C601-C611 CovalentContact SG-SG 2.02Å; C601-C611 PolarHBondContact SG-SG 2.86Å; C611-V613 VanDerWaalsContact C-N 3.28Å
612	V	57.6	Low	61.5	Low	118 Å²	118	83.4 Å²	83.4	72%	0.715	51%	0.507	S	S	*	.			trans	-78.4	-16	-178.6	-176.2	0	0	0	0	111.8	G610	G610-V612 VanDerWaalsContact O-CG2 3.26Å; G610-V612 WeakPolarHBondContact O-CG2 3.45Å; G610-V612 PolarHBondContact O-N 3.44Å
613	V	63.4	Low	62	Low	29 Å²	29	77.3 Å²	77.3	18%	0.176	48%	0.481	C	S	.	.			trans	-138.6	123.4	-171.1	-175.7	0	0	0	0	109.8	C611 S615 Q618 I619	C611-V613 VanDerWaalsContact C-N 3.28Å; V613-S615 WeakPolarHBondContact CG1-O 3.08Å; V613-Q618 HydrophobicContact CG1-CB 4.17Å; V613-I619 HydrophobicContact CB-CG1 4.44Å; V613-I619 HydrophobicContact CG1-CD1 3.84Å; V613-I619 HydrophobicContact CG1-CG1 3.29Å
614	T	68.1	Low	63	Low	79 Å²	79	75.7 Å²	75.7	49%	0.485	46%	0.459	S	S	.	.	S	Bend	trans	-113.8	-21.8	178.9	53.9	0	0	0	0	113.3	F599	F599-T614 PolarHBondContact N-O 3.21Å
615	S	75.6	Confident	63.9	Low	31 Å²	31	71.7 Å²	71.7	22%	0.217	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-120.7	142.7	177.4	174.3	0	0	0	0	111.2	V613 D617 Q618	V613-S615 WeakPolarHBondContact CG1-O 3.08Å; S615-D617 PolarHBondContact O-N 2.88Å; S615-D617 PolarHBondContact OG-N 3.43Å; S615-Q618 WeakPolarHBondContact O-CB 3.47Å; S615-Q618 PolarHBondContact O-N 2.96Å
616	G	73.5	Confident	65.1	Low	0 Å²	0	64.4 Å²	64.4	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-28.1	173.1	0	0	0	0	0	113.8	F594 L597 Q618 I619 I620	F594-G616 WeakPolarHBondContact O-CA 3.44Å; L597-G616 PolarHBondContact O-N 2.92Å; G616-Q618 VanDerWaalsContact C-N 3.3Å; G616-Q618 PolarHBondContact O-N 3.19Å; G616-I619 WeakPolarHBondContact O-CB 3.18Å; G616-I619 PolarHBondContact O-N 2.66Å; G616-I620 WeakPolarHBondContact O-CG1 3.15Å; G616-I620 PolarHBondContact O-N 2.79Å; G616-I620 VanDerWaalsContact O-N 3.15Å
617	D	76.9	Confident	66.4	Low	59 Å²	59	58.9 Å²	58.9	32%	0.316	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-34.6	178	-57.8	-31.1	0	0	0	111.7	S615 I619 I620 D621	S615-D617 PolarHBondContact O-N 2.88Å; S615-D617 PolarHBondContact OG-N 3.43Å; D617-I619 VanDerWaalsContact C-N 3.28Å; D617-I619 PolarHBondContact O-N 2.63Å; D617-I620 PolarHBondContact O-N 3.07Å; D617-D621 PolarHBondContact O-N 2.99Å
618	Q	76.9	Confident	67.8	Low	81 Å²	81	57 Å²	57	38%	0.379	36%	0.364	S	S	.	.	H	α-helix	trans	-66.2	-30.8	174.3	-67.3	176.1	-16.8	0	0	112	V613 S615 G616 M622	V613-Q618 HydrophobicContact CG1-CB 4.17Å; S615-Q618 WeakPolarHBondContact O-CB 3.47Å; S615-Q618 PolarHBondContact O-N 2.96Å; G616-Q618 VanDerWaalsContact C-N 3.3Å; G616-Q618 PolarHBondContact O-N 3.19Å; Q618-M622 VanDerWaalsContact O-CB 3.28Å; Q618-M622 WeakPolarHBondContact O-CB 3.36Å; Q618-M622 WeakPolarHBondContact O-CG 3.4Å; Q618-M622 PolarHBondContact O-N 3.23Å
619	I	76.6	Confident	69.4	Low	20 Å²	20	55 Å²	55	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-69.6	-41.3	175.9	-57.8	176.2	0	0	0	110.1	V430 F594 F599 V613 G616 D617 G623	V430-I619 HydrophobicContact CB-CD1 4.45Å; V430-I619 HydrophobicContact CG1-CD1 3.83Å; V430-I619 HydrophobicContact CG2-CD1 3.71Å; F594-I619 HydrophobicContact CD1-CB 4.46Å; F594-I619 HydrophobicContact CD1-CD1 3.66Å; F594-I619 HydrophobicContact CD1-CG2 4.43Å; F594-I619 HydrophobicContact CE1-CD1 3.62Å; F594-I619 HydrophobicContact CE1-CG2 4.44Å; F599-I619 HydrophobicContact CD2-CD1 4.36Å; F599-I619 HydrophobicContact CE2-CD1 3.61Å; F599-I619 HydrophobicContact CZ-CD1 4.23Å; V613-I619 HydrophobicContact CB-CG1 4.44Å; V613-I619 HydrophobicContact CG1-CD1 3.84Å; V613-I619 HydrophobicContact CG1-CG1 3.29Å; G616-I619 WeakPolarHBondContact O-CB 3.18Å; G616-I619 PolarHBondContact O-N 2.66Å; D617-I619 VanDerWaalsContact C-N 3.28Å; D617-I619 PolarHBondContact O-N 2.63Å; I619-G623 PolarHBondContact O-N 3.38Å
620	I	79.1	Confident	71	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-47.2	177.9	-62.2	168.2	0	0	0	109.5	I590 V591 F594 G616 D617 G623 Y624 A627	I590-I620 HydrophobicContact CG2-CG1 4.32Å; V591-I620 HydrophobicContact CG2-CG2 4.25Å; F594-I620 HydrophobicContact CB-CD1 3.97Å; F594-I620 HydrophobicContact CB-CG1 4.01Å; G616-I620 WeakPolarHBondContact O-CG1 3.15Å; G616-I620 PolarHBondContact O-N 2.79Å; G616-I620 VanDerWaalsContact O-N 3.15Å; D617-I620 PolarHBondContact O-N 3.07Å; I620-G623 PolarHBondContact O-N 3.38Å; I620-Y624 CarbonylContact O-C 3.48Å; I620-Y624 WeakPolarHBondContact O-CA 3.37Å; I620-Y624 PolarHBondContact O-N 3.4Å; I620-A627 HydrophobicContact CG2-CB 4.5Å
621	D	76.6	Confident	72.9	Confident	107 Å²	107	55.2 Å²	55.2	57%	0.572	32%	0.317	S	S	*	.	H	α-helix	trans	-69.8	-35.7	-177.7	-74.5	-21.1	0	0	0	113.4	D617	D617-D621 PolarHBondContact O-N 2.99Å
622	M	72.6	Confident	74.5	Confident	131 Å²	131	58.2 Å²	58.2	65%	0.645	33%	0.334	S	S	*	.	H	α-helix	trans	-77.6	-32.6	176.7	-70.2	-177.1	-173.3	0	0	113.2	Q618	Q618-M622 VanDerWaalsContact O-CB 3.28Å; Q618-M622 WeakPolarHBondContact O-CB 3.36Å; Q618-M622 WeakPolarHBondContact O-CG 3.4Å; Q618-M622 PolarHBondContact O-N 3.23Å
623	G	70	Confident	76	Confident	27 Å²	27	56.9 Å²	56.9	28%	0.278	32%	0.322	S	S	.	.	H	α-helix	trans	-91.9	-41.8	-175.8	0	0	0	0	0	114	I619 I620	I619-G623 PolarHBondContact O-N 3.38Å; I620-G623 PolarHBondContact O-N 3.38Å
624	Y	74.4	Confident	77.1	Confident	19 Å²	19	55.7 Å²	55.7	8%	0.075	32%	0.315	C	S	.	.	S	Bend	trans	-141.6	68.3	-169.6	-57.6	-89.6	0	0	0	111.1	S560 E587 I590 I620 G626 A627	S560-Y624 PolarHBondContact O-OH 3.29Å; E587-Y624 HydrophobicContact CG-CD1 3.63Å; E587-Y624 HydrophobicContact CG-CE1 4.19Å; E587-Y624 HydrophobicContact CG-CG 4.37Å; I590-Y624 HydrophobicContact CD1-CD2 3.97Å; I590-Y624 HydrophobicContact CD1-CE1 4.39Å; I590-Y624 HydrophobicContact CD1-CE2 3.2Å; I590-Y624 VanDerWaalsContact CD1-CZ 3.45Å; I590-Y624 WeakPolarHBondContact CD1-OH 3.45Å; I590-Y624 HydrophobicContact CG1-CE2 4.49Å; I590-Y624 HydrophobicContact CG2-CD2 4.12Å; I590-Y624 HydrophobicContact CG2-CE2 4.32Å; I620-Y624 CarbonylContact O-C 3.48Å; I620-Y624 WeakPolarHBondContact O-CA 3.37Å; I620-Y624 PolarHBondContact O-N 3.4Å; Y624-G626 PolarHBondContact O-N 3.41Å; Y624-A627 WeakPolarHBondContact O-CB 3.32Å; Y624-A627 PolarHBondContact O-N 2.83Å
625	P	70.6	Confident	78.1	Confident	55 Å²	55	53.9 Å²	53.9	36%	0.357	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	129.3	-178.3	22.7	-32.2	0	0	0	110.9	E567 A627 R630	E567-P625 WeakPolarHBondContact OE1-CG 3.26Å; P625-A627 PolarHBondContact O-N 3.36Å; P625-R630 PolarHBondContact O-NH2 3.15Å
626	G	71.1	Confident	78.9	Confident	31 Å²	31	57.3 Å²	57.3	32%	0.32	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	8.9	-179.7	0	0	0	0	0	115.7	Y624 L628 S629 R630	Y624-G626 PolarHBondContact O-N 3.41Å; G626-L628 VanDerWaalsContact C-N 3.3Å; G626-S629 PolarHBondContact O-OG 3.37Å; G626-S629 VanDerWaalsContact O-OG 3.1Å; G626-R630 WeakPolarHBondContact O-CB 3.41Å; G626-R630 VanDerWaalsContact O-CG 3.29Å; G626-R630 WeakPolarHBondContact O-CG 3.25Å; G626-R630 PolarHBondContact O-N 2.96Å; G626-R630 PolarHBondContact O-NE 3.07Å
627	A	74.7	Confident	79.7	Confident	1 Å²	1	60 Å²	60	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-35.6	170.8	0	0	0	0	0	112.2	E587 V591 I620 Y624 P625 S629 R630 Y631	E587-A627 HydrophobicContact CB-CB 4.49Å; V591-A627 HydrophobicContact CG2-CB 3.66Å; I620-A627 HydrophobicContact CG2-CB 4.5Å; Y624-A627 WeakPolarHBondContact O-CB 3.32Å; Y624-A627 PolarHBondContact O-N 2.83Å; P625-A627 PolarHBondContact O-N 3.36Å; A627-S629 PolarHBondContact O-N 2.95Å; A627-R630 PolarHBondContact O-N 3.49Å; A627-Y631 PolarHBondContact O-N 3.08Å
628	L	74.4	Confident	80.5	Confident	99 Å²	99	57.1 Å²	57.1	52%	0.518	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-41.4	178.8	-162.5	89.6	0	0	0	112.6	V591 L595 G626	V591-L628 HydrophobicContact CG1-CD1 4.19Å; L595-L628 HydrophobicContact CD1-CD1 3.65Å; G626-L628 VanDerWaalsContact C-N 3.3Å
629	S	78.6	Confident	81.2	Confident	98 Å²	98	57.5 Å²	57.5	69%	0.685	32%	0.317	S	S	*	.	H	α-helix	trans	-78.4	-23.7	179.2	56.8	0	0	0	0	113.1	G626 A627	G626-S629 PolarHBondContact O-OG 3.37Å; G626-S629 VanDerWaalsContact O-OG 3.1Å; A627-S629 PolarHBondContact O-N 2.95Å
630	R	82.6	Confident	82	Confident	73 Å²	73	59.2 Å²	59.2	28%	0.275	33%	0.331	S	S	.	.	H	α-helix	trans	-93.4	-2.5	179.4	-67.9	-179.9	-64.5	172.1	11.6	114.2	E587 P625 G626 A627 T632 L633 D634	E587-R630 IonicContact OE1-NH2 2.84Å; P625-R630 PolarHBondContact O-NH2 3.15Å; G626-R630 WeakPolarHBondContact O-CB 3.41Å; G626-R630 VanDerWaalsContact O-CG 3.29Å; G626-R630 WeakPolarHBondContact O-CG 3.25Å; G626-R630 PolarHBondContact O-N 2.96Å; G626-R630 PolarHBondContact O-NE 3.07Å; A627-R630 PolarHBondContact O-N 3.49Å; R630-T632 VanDerWaalsContact C-N 3.31Å; R630-T632 PolarHBondContact O-N 3.35Å; R630-T632 VanDerWaalsContact O-N 3.09Å; R630-L633 CarbonylContact O-C 3.58Å; R630-L633 WeakPolarHBondContact O-CA 3.38Å; R630-L633 WeakPolarHBondContact O-CB 2.97Å; R630-L633 PolarHBondContact O-N 3Å; R630-D634 WeakPolarHBondContact CB-OD2 3.26Å; R630-D634 PolarHBondContact O-N 3.26Å
631	Y	83.9	Confident	82.6	Confident	54 Å²	54	61.3 Å²	61.3	21%	0.212	34%	0.34	C	S	.	.	H	α-helix	trans	-46.4	-47.1	-175.1	-170.2	-103.9	0	0	0	114.6	L588 V591 T592 A627 F635	L588-Y631 HydrophobicContact CD2-CD2 3.61Å; L588-Y631 HydrophobicContact CD2-CE2 3.76Å; L588-Y631 HydrophobicContact CD2-CG 4.21Å; L588-Y631 WeakPolarHBondContact CD2-O 3.39Å; V591-Y631 HydrophobicContact CB-CD2 3.97Å; V591-Y631 HydrophobicContact CB-CE2 4.1Å; V591-Y631 HydrophobicContact CG1-CD2 3.58Å; V591-Y631 HydrophobicContact CG1-CE2 3.82Å; V591-Y631 HydrophobicContact CG1-CG 4.46Å; T592-Y631 PolarHBondContact OG1-OH 3.22Å; A627-Y631 PolarHBondContact O-N 3.08Å; Y631-F635 HydrophobicContact CD1-CD2 4.36Å; Y631-F635 HydrophobicContact CD1-CE2 4.26Å; Y631-F635 HydrophobicContact CE1-CD2 4.13Å; Y631-F635 AromaticContact CE1-CE2 3.61Å; Y631-F635 HydrophobicContact CE1-CE2 3.61Å; Y631-F635 HydrophobicContact CE2-CE2 4.09Å; Y631-F635 AromaticContact CZ-CE2 3.53Å; Y631-F635 WeakPolarHBondContact O-CD2 3.16Å; Y631-F635 PolarHBondContact O-N 3.49Å
632	T	86.8	Confident	83.3	Confident	107 Å²	107	57.7 Å²	57.7	66%	0.656	32%	0.32	S	S	*	.	H	α-helix	trans	-70.4	-36.3	178.7	52.5	0	0	0	0	112.9	R630 V636	R630-T632 VanDerWaalsContact C-N 3.31Å; R630-T632 PolarHBondContact O-N 3.35Å; R630-T632 VanDerWaalsContact O-N 3.09Å; T632-V636 WeakPolarHBondContact O-CG2 3.48Å; T632-V636 PolarHBondContact O-N 3.33Å
633	L	88.9	Confident	84.3	Confident	91 Å²	91	55.1 Å²	55.1	48%	0.476	31%	0.313	S	S	.	.	H	α-helix	trans	-69.5	-40.3	177.9	-174.8	156.2	0	0	0	110.7	R630 F635 V636 L637	R630-L633 CarbonylContact O-C 3.58Å; R630-L633 WeakPolarHBondContact O-CA 3.38Å; R630-L633 WeakPolarHBondContact O-CB 2.97Å; R630-L633 PolarHBondContact O-N 3Å; L633-F635 VanDerWaalsContact C-N 3.32Å; L633-F635 PolarHBondContact O-N 2.79Å; L633-V636 WeakPolarHBondContact O-CB 3.28Å; L633-V636 PolarHBondContact O-N 2.96Å; L633-V636 VanDerWaalsContact O-N 3.08Å; L633-L637 HydrophobicContact CD2-CD1 3.3Å; L633-L637 HydrophobicContact CD2-CG 3.7Å; L633-L637 WeakPolarHBondContact O-CG 3.42Å; L633-L637 PolarHBondContact O-N 2.93Å
634	D	87.6	Confident	85.4	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-35.1	180	-65.1	-26.4	0	0	0	111.6	Y584 L588 R630 L637 L638	Y584-D634 HydrophobicContact CD1-CB 4.32Å; L588-D634 HydrophobicContact CD1-CB 4.28Å; L588-D634 HydrophobicContact CD2-CB 3.82Å; L588-D634 HydrophobicContact CG-CB 3.91Å; R630-D634 WeakPolarHBondContact CB-OD2 3.26Å; R630-D634 PolarHBondContact O-N 3.26Å; D634-L637 PolarHBondContact O-N 3.15Å; D634-L638 VanDerWaalsContact O-CB 3.23Å; D634-L638 WeakPolarHBondContact O-CB 3.11Å; D634-L638 PolarHBondContact O-N 3.27Å
635	F	89.6	Confident	86.2	Confident	41 Å²	41	56.2 Å²	56.2	18%	0.18	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-47.1	168.9	-93.8	-73.1	0	0	0	111.9	C515 V519 L588 Y631 L633 L637 L638 Y639	C515-F635 HydrophobicContact CB-CZ 4.32Å; V519-F635 HydrophobicContact CG2-CE1 3.61Å; V519-F635 HydrophobicContact CG2-CZ 3.67Å; L588-F635 HydrophobicContact CD1-CD1 4.11Å; L588-F635 HydrophobicContact CD1-CD2 4.13Å; L588-F635 HydrophobicContact CD1-CE1 4.28Å; L588-F635 HydrophobicContact CD1-CE2 4.29Å; L588-F635 HydrophobicContact CD1-CG 4.03Å; L588-F635 HydrophobicContact CD1-CZ 4.36Å; L588-F635 HydrophobicContact CD2-CD2 3.51Å; L588-F635 HydrophobicContact CD2-CE2 3.6Å; L588-F635 HydrophobicContact CD2-CG 4.2Å; L588-F635 HydrophobicContact CD2-CZ 4.36Å; L588-F635 HydrophobicContact CG-CD2 4.47Å; L588-F635 HydrophobicContact CG-CE2 4.48Å; Y631-F635 HydrophobicContact CD1-CD2 4.36Å; Y631-F635 HydrophobicContact CD1-CE2 4.26Å; Y631-F635 HydrophobicContact CE1-CD2 4.13Å; Y631-F635 AromaticContact CE1-CE2 3.61Å; Y631-F635 HydrophobicContact CE1-CE2 3.61Å; Y631-F635 HydrophobicContact CE2-CE2 4.09Å; Y631-F635 AromaticContact CZ-CE2 3.53Å; Y631-F635 WeakPolarHBondContact O-CD2 3.16Å; Y631-F635 PolarHBondContact O-N 3.49Å; L633-F635 VanDerWaalsContact C-N 3.32Å; L633-F635 PolarHBondContact O-N 2.79Å; F635-L637 PolarHBondContact O-N 3.39Å; F635-L638 PolarHBondContact O-N 3.19Å; F635-Y639 HydrophobicContact CD1-CD2 4.45Å; F635-Y639 HydrophobicContact CD1-CE2 4.09Å; F635-Y639 VanDerWaalsContact O-CD2 3.31Å; F635-Y639 WeakPolarHBondContact O-CD2 3.34Å; F635-Y639 PolarHBondContact O-N 3.27Å
636	V	91.8	Very high	87.2	Confident	103 Å²	103	55.2 Å²	55.2	62%	0.624	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-44.3	179	174.5	0	0	0	0	110.9	T632 L633 Y639 S640	T632-V636 WeakPolarHBondContact O-CG2 3.48Å; T632-V636 PolarHBondContact O-N 3.33Å; L633-V636 WeakPolarHBondContact O-CB 3.28Å; L633-V636 PolarHBondContact O-N 2.96Å; L633-V636 VanDerWaalsContact O-N 3.08Å; V636-Y639 PolarHBondContact O-N 3.26Å; V636-S640 WeakPolarHBondContact O-CB 3.44Å; V636-S640 PolarHBondContact O-N 3.44Å
637	L	91	Very high	88.2	Confident	56 Å²	56	57.3 Å²	57.3	29%	0.293	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-44.9	178.2	-72.6	-175.2	0	0	0	111.8	Y584 L633 D634 F635 Y639 S640 F641	Y584-L637 HydrophobicContact CD1-CB 4.16Å; Y584-L637 HydrophobicContact CD1-CD1 4.06Å; Y584-L637 HydrophobicContact CE1-CB 4.12Å; Y584-L637 HydrophobicContact CE1-CD1 3.33Å; Y584-L637 HydrophobicContact CE1-CG 4.39Å; Y584-L637 HydrophobicContact CG-CB 4.4Å; L633-L637 HydrophobicContact CD2-CD1 3.3Å; L633-L637 HydrophobicContact CD2-CG 3.7Å; L633-L637 WeakPolarHBondContact O-CG 3.42Å; L633-L637 PolarHBondContact O-N 2.93Å; D634-L637 PolarHBondContact O-N 3.15Å; F635-L637 PolarHBondContact O-N 3.39Å; L637-Y639 PolarHBondContact O-N 3.32Å; L637-S640 WeakPolarHBondContact O-CB 3.25Å; L637-S640 PolarHBondContact O-N 2.84Å; L637-S640 VanDerWaalsContact O-N 3.16Å; L637-S640 PolarHBondContact O-OG 2.83Å; L637-F641 WeakPolarHBondContact O-CD2 3.47Å
638	L	92.3	Very high	89.1	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-47.7	177.7	-179.6	58.6	0	0	0	111.4	V519 V522 F581 S585 L588 D634 F635 S640 F641	V519-L638 HydrophobicContact CG1-CD2 4Å; V522-L638 HydrophobicContact CB-CD1 4.1Å; V522-L638 HydrophobicContact CB-CD2 4.17Å; V522-L638 HydrophobicContact CB-CG 3.88Å; V522-L638 HydrophobicContact CG1-CD1 3.69Å; V522-L638 HydrophobicContact CG1-CG 3.73Å; V522-L638 WeakPolarHBondContact CG1-O 3.5Å; V522-L638 HydrophobicContact CG2-CD2 4.38Å; V522-L638 HydrophobicContact CG2-CG 4.2Å; F581-L638 HydrophobicContact CB-CD1 4.07Å; S585-L638 VanDerWaalsContact OG-CD1 3.32Å; S585-L638 WeakPolarHBondContact OG-CD1 3.4Å; L588-L638 HydrophobicContact CD1-CB 4.5Å; L588-L638 HydrophobicContact CD1-CD2 3.87Å; D634-L638 VanDerWaalsContact O-CB 3.23Å; D634-L638 WeakPolarHBondContact O-CB 3.11Å; D634-L638 PolarHBondContact O-N 3.27Å; F635-L638 PolarHBondContact O-N 3.19Å; L638-S640 VanDerWaalsContact C-N 3.29Å; L638-S640 PolarHBondContact O-N 3.44Å; L638-F641 PolarHBondContact O-N 3.45Å
639	Y	93.2	Very high	89.7	Confident	89 Å²	89	57.4 Å²	57.4	35%	0.349	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-22.8	178.7	-84.2	-96.5	0	0	0	113.5	A518 V522 F635 V636 L637 F641 L642 P643	A518-Y639 PolarHBondContact O-OH 3.01Å; V522-Y639 HydrophobicContact CG2-CD1 4.05Å; V522-Y639 HydrophobicContact CG2-CD2 3.93Å; V522-Y639 HydrophobicContact CG2-CE1 3.75Å; V522-Y639 HydrophobicContact CG2-CE2 3.63Å; V522-Y639 HydrophobicContact CG2-CG 4.15Å; F635-Y639 HydrophobicContact CD1-CD2 4.45Å; F635-Y639 HydrophobicContact CD1-CE2 4.09Å; F635-Y639 VanDerWaalsContact O-CD2 3.31Å; F635-Y639 WeakPolarHBondContact O-CD2 3.34Å; F635-Y639 PolarHBondContact O-N 3.27Å; V636-Y639 PolarHBondContact O-N 3.26Å; L637-Y639 PolarHBondContact O-N 3.32Å; Y639-F641 PolarHBondContact O-N 3.25Å; Y639-L642 HydrophobicContact CD1-CD1 4.19Å; Y639-L642 PolarHBondContact O-N 3.4Å; Y639-P643 WeakPolarHBondContact O-CD 3.25Å
640	S	92.9	Very high	90.3	Very high	55 Å²	55	55.6 Å²	55.6	39%	0.385	30%	0.301	S	S	.	.	H	α-helix	trans	-65.1	-23.3	177.8	79.8	0	0	0	0	113.8	V636 L637 L638 L642 P643 A644	V636-S640 WeakPolarHBondContact O-CB 3.44Å; V636-S640 PolarHBondContact O-N 3.44Å; L637-S640 WeakPolarHBondContact O-CB 3.25Å; L637-S640 PolarHBondContact O-N 2.84Å; L637-S640 VanDerWaalsContact O-N 3.16Å; L637-S640 PolarHBondContact O-OG 2.83Å; L638-S640 VanDerWaalsContact C-N 3.29Å; L638-S640 PolarHBondContact O-N 3.44Å; S640-L642 VanDerWaalsContact C-N 3.3Å; S640-L642 PolarHBondContact O-N 3.48Å; S640-P643 VanDerWaalsContact O-CD 3.28Å; S640-P643 WeakPolarHBondContact O-CD 3.3Å; S640-P643 WeakPolarHBondContact O-CG 3.4Å; S640-A644 PolarHBondContact O-N 2.61Å
641	F	91.4	Very high	90.6	Very high	47 Å²	47	56.5 Å²	56.5	21%	0.206	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-33.6	175.6	-76.7	-86.8	0	0	0	112.7	L579 F581 Y584 L637 L638 Y639 A644 L645	L579-F641 WeakPolarHBondContact O-CE1 3.17Å; F581-F641 HydrophobicContact CB-CD2 4.09Å; F581-F641 HydrophobicContact CB-CE2 4.2Å; F581-F641 HydrophobicContact CB-CG 4.28Å; F581-F641 HydrophobicContact CB-CZ 4.46Å; Y584-F641 AromaticContact CD2-CE2 3.95Å; Y584-F641 HydrophobicContact CD2-CE2 3.95Å; Y584-F641 AromaticContact CE2-CE2 4Å; Y584-F641 HydrophobicContact CE2-CE2 4Å; Y584-F641 HydrophobicContact CE2-CZ 4.25Å; L637-F641 WeakPolarHBondContact O-CD2 3.47Å; L638-F641 PolarHBondContact O-N 3.45Å; Y639-F641 PolarHBondContact O-N 3.25Å; F641-A644 PolarHBondContact O-N 3.06Å; F641-L645 WeakPolarHBondContact O-CB 3Å; F641-L645 VanDerWaalsContact O-CG 3.3Å; F641-L645 WeakPolarHBondContact O-CG 3.36Å; F641-L645 PolarHBondContact O-N 2.93Å
642	L	91.8	Very high	90.8	Very high	31 Å²	31	54.5 Å²	54.5	16%	0.162	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-57.4	-178	-61.6	-179.6	0	0	0	112.9	V522 I525 L529 Y639 S640 A644 L645 V646	V522-L642 HydrophobicContact CG1-CD1 4.36Å; V522-L642 HydrophobicContact CG1-CD2 4.18Å; V522-L642 HydrophobicContact CG1-CG 4.14Å; V522-L642 HydrophobicContact CG2-CD1 4.44Å; I525-L642 HydrophobicContact CB-CD2 4.01Å; I525-L642 HydrophobicContact CG2-CD2 3.65Å; L529-L642 HydrophobicContact CD1-CD2 4.08Å; Y639-L642 HydrophobicContact CD1-CD1 4.19Å; Y639-L642 PolarHBondContact O-N 3.4Å; S640-L642 VanDerWaalsContact C-N 3.3Å; S640-L642 PolarHBondContact O-N 3.48Å; L642-A644 VanDerWaalsContact C-N 3.28Å; L642-A644 PolarHBondContact O-N 3.43Å; L642-L645 PolarHBondContact O-N 3.2Å; L642-V646 WeakPolarHBondContact O-CG2 3.36Å; L642-V646 PolarHBondContact O-N 3.44Å
643	P	92.9	Very high	90.8	Very high	77 Å²	77	49.4 Å²	49.4	50%	0.5	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-34.1	177.7	25.7	-34.1	0	0	0	112.1	Y639 S640 L645 V646 V647	Y639-P643 WeakPolarHBondContact O-CD 3.25Å; S640-P643 VanDerWaalsContact O-CD 3.28Å; S640-P643 WeakPolarHBondContact O-CD 3.3Å; S640-P643 WeakPolarHBondContact O-CG 3.4Å; P643-L645 PolarHBondContact O-N 3.25Å; P643-V646 PolarHBondContact O-N 2.93Å; P643-V647 WeakPolarHBondContact O-CG2 3.49Å; P643-V647 PolarHBondContact O-N 3.37Å
644	A	92.5	Very high	90.7	Very high	55 Å²	55	52.4 Å²	52.4	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-44.8	176.3	0	0	0	0	0	112	S640 F641 L642 V647 M648	S640-A644 PolarHBondContact O-N 2.61Å; F641-A644 PolarHBondContact O-N 3.06Å; L642-A644 VanDerWaalsContact C-N 3.28Å; L642-A644 PolarHBondContact O-N 3.43Å; A644-V647 PolarHBondContact O-N 3.19Å; A644-M648 WeakPolarHBondContact O-CB 3.44Å; A644-M648 PolarHBondContact O-N 3.49Å
645	L	92.3	Very high	90.6	Very high	15 Å²	15	57 Å²	57	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-67.9	-35.1	176.7	-72.8	169	0	0	0	112.7	T526 L529 L530 F641 L642 P643 M648 G649	T526-L645 HydrophobicContact CG2-CD1 3.69Å; L529-L645 HydrophobicContact CB-CB 4.24Å; L529-L645 HydrophobicContact CB-CD1 4.38Å; L529-L645 HydrophobicContact CD1-CB 4.34Å; L530-L645 HydrophobicContact CB-CD2 4.39Å; L530-L645 HydrophobicContact CD1-CD2 3.88Å; F641-L645 WeakPolarHBondContact O-CB 3Å; F641-L645 VanDerWaalsContact O-CG 3.3Å; F641-L645 WeakPolarHBondContact O-CG 3.36Å; F641-L645 PolarHBondContact O-N 2.93Å; L642-L645 PolarHBondContact O-N 3.2Å; P643-L645 PolarHBondContact O-N 3.25Å; L645-M648 PolarHBondContact O-N 3.06Å; L645-G649 PolarHBondContact O-N 2.89Å
646	V	92.1	Very high	90.2	Very high	33 Å²	33	55.6 Å²	55.6	20%	0.2	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-45.4	173.5	173.9	0	0	0	0	110.7	F478 I482 L529 L642 P643 G649 M650	F478-V646 HydrophobicContact CE1-CG1 4.5Å; F478-V646 WeakPolarHBondContact CE1-O 3.34Å; I482-V646 HydrophobicContact CD1-CB 4.45Å; I482-V646 HydrophobicContact CD1-CG1 4.03Å; I482-V646 HydrophobicContact CD1-CG2 3.9Å; L529-V646 HydrophobicContact CD1-CG2 4.21Å; L642-V646 WeakPolarHBondContact O-CG2 3.36Å; L642-V646 PolarHBondContact O-N 3.44Å; P643-V646 PolarHBondContact O-N 2.93Å; V646-G649 PolarHBondContact O-N 2.86Å; V646-M650 WeakPolarHBondContact O-CG 3.42Å; V646-M650 PolarHBondContact O-N 3.06Å
647	V	92.2	Very high	89.5	Confident	75 Å²	75	51.6 Å²	51.6	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-45.5	176.6	173.5	0	0	0	0	111.1	P643 A644 G649 M650 I651	P643-V647 WeakPolarHBondContact O-CG2 3.49Å; P643-V647 PolarHBondContact O-N 3.37Å; A644-V647 PolarHBondContact O-N 3.19Å; V647-G649 VanDerWaalsContact C-N 3.3Å; V647-G649 PolarHBondContact O-N 3.32Å; V647-M650 HydrophobicContact CB-CE 4.42Å; V647-M650 HydrophobicContact CG2-CE 4.07Å; V647-M650 PolarHBondContact O-N 3.36Å; V647-I651 HydrophobicContact CG1-CD1 3.97Å; V647-I651 WeakPolarHBondContact O-CG1 3.21Å; V647-I651 PolarHBondContact O-N 3.41Å
648	M	91.6	Very high	88.7	Confident	102 Å²	102	55.8 Å²	55.8	50%	0.502	29%	0.286	S	S	.	.	H	α-helix	trans	-59.7	-41.1	176.2	-169.6	-175.9	-64.5	0	0	111.8	V533 A644 L645 I651 S652	V533-M648 HydrophobicContact CG1-CG 4.01Å; V533-M648 HydrophobicContact CG1-SD 4.11Å; A644-M648 WeakPolarHBondContact O-CB 3.44Å; A644-M648 PolarHBondContact O-N 3.49Å; L645-M648 PolarHBondContact O-N 3.06Å; M648-I651 PolarHBondContact O-N 3.23Å; M648-S652 WeakPolarHBondContact O-CB 3.19Å; M648-S652 PolarHBondContact O-N 3.44Å
649	G	88.8	Confident	87.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-46.5	174.5	0	0	0	0	0	112.9	L645 V646 V647 I651 S652 F653	L645-G649 PolarHBondContact O-N 2.89Å; V646-G649 PolarHBondContact O-N 2.86Å; V647-G649 VanDerWaalsContact C-N 3.3Å; V647-G649 PolarHBondContact O-N 3.32Å; G649-I651 VanDerWaalsContact C-N 3.26Å; G649-I651 PolarHBondContact O-N 3.38Å; G649-S652 WeakPolarHBondContact O-CB 3.18Å; G649-S652 PolarHBondContact O-N 3.25Å; G649-S652 VanDerWaalsContact O-N 3.13Å; G649-F653 VanDerWaalsContact O-CD2 3.26Å; G649-F653 WeakPolarHBondContact O-CD2 3.22Å; G649-F653 PolarHBondContact O-N 3.46Å
650	M	89.6	Confident	86.4	Confident	60 Å²	60	58.5 Å²	58.5	30%	0.296	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-40.5	175.2	-71.6	-168.9	-62.4	0	0	112.2	F478 V646 V647 R654	F478-M650 HydrophobicContact CD1-CG 4.22Å; F478-M650 HydrophobicContact CE1-CG 4.26Å; V646-M650 WeakPolarHBondContact O-CG 3.42Å; V646-M650 PolarHBondContact O-N 3.06Å; V647-M650 HydrophobicContact CB-CE 4.42Å; V647-M650 HydrophobicContact CG2-CE 4.07Å; V647-M650 PolarHBondContact O-N 3.36Å; M650-R654 WeakPolarHBondContact O-CB 3.23Å; M650-R654 WeakPolarHBondContact O-CG 3.3Å; M650-R654 PolarHBondContact O-N 3.07Å
651	I	89.3	Confident	84.6	Confident	93 Å²	93	61.6 Å²	61.6	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-47.6	175.6	-65.9	165.9	0	0	0	110.2	V647 M648 G649 F653 R654 I655	V647-I651 HydrophobicContact CG1-CD1 3.97Å; V647-I651 WeakPolarHBondContact O-CG1 3.21Å; V647-I651 PolarHBondContact O-N 3.41Å; M648-I651 PolarHBondContact O-N 3.23Å; G649-I651 VanDerWaalsContact C-N 3.26Å; G649-I651 PolarHBondContact O-N 3.38Å; I651-F653 PolarHBondContact O-N 2.87Å; I651-R654 PolarHBondContact O-N 2.92Å; I651-I655 HydrophobicContact CG2-CD1 3.65Å; I651-I655 HydrophobicContact CG2-CG1 4.3Å; I651-I655 VanDerWaalsContact O-CG1 3.31Å; I651-I655 WeakPolarHBondContact O-CG1 3.4Å; I651-I655 PolarHBondContact O-N 3.26Å
652	S	88.3	Confident	82.1	Confident	11 Å²	11	65.2 Å²	65.2	8%	0.077	33%	0.326	C	S	.	.	H	α-helix	trans	-54.8	-50.3	177.3	177.8	0	0	0	0	111.8	V533 V537 M648 G649 R654 I655 R656	V533-S652 PolarHBondContact O-OG 2.99Å; V537-S652 VanDerWaalsContact CG2-OG 3.32Å; V537-S652 WeakPolarHBondContact CG2-OG 3.45Å; M648-S652 WeakPolarHBondContact O-CB 3.19Å; M648-S652 PolarHBondContact O-N 3.44Å; G649-S652 WeakPolarHBondContact O-CB 3.18Å; G649-S652 PolarHBondContact O-N 3.25Å; G649-S652 VanDerWaalsContact O-N 3.13Å; S652-R654 PolarHBondContact O-N 3.11Å; S652-I655 PolarHBondContact O-N 2.72Å; S652-R656 WeakPolarHBondContact O-CB 3.28Å; S652-R656 PolarHBondContact O-N 2.84Å
653	F	87.3	Confident	81.6	Confident	1 Å²	1	67 Å²	67	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-69	-30.6	179	-78	-79.8	0	0	0	113.4	F456 K474 W475 M477 F478 V532 G649 I651 R656 D657	F456-F653 HydrophobicContact CE1-CE1 4.09Å; F456-F653 AromaticContact CE1-CZ 3.6Å; F456-F653 HydrophobicContact CE1-CZ 3.6Å; F456-F653 HydrophobicContact CE2-CZ 4.47Å; F456-F653 AromaticContact CZ-CE1 3.75Å; F456-F653 HydrophobicContact CZ-CE1 3.75Å; F456-F653 HydrophobicContact CZ-CE2 4.23Å; F456-F653 AromaticContact CZ-CZ 3.3Å; F456-F653 HydrophobicContact CZ-CZ 3.3Å; K474-F653 HydrophobicContact CB-CB 4.33Å; K474-F653 HydrophobicContact CB-CD1 4.17Å; W475-F653 HydrophobicContact CB-CB 4.38Å; M477-F653 HydrophobicContact CE-CD1 4.27Å; M477-F653 HydrophobicContact CE-CE1 3.88Å; M477-F653 HydrophobicContact CE-CZ 4.49Å; F478-F653 HydrophobicContact CB-CD2 3.66Å; F478-F653 HydrophobicContact CB-CE2 4.03Å; F478-F653 HydrophobicContact CB-CG 4.05Å; F478-F653 HydrophobicContact CD1-CD2 4.31Å; F478-F653 AromaticContact CD2-CD2 3.71Å; F478-F653 HydrophobicContact CD2-CD2 3.71Å; F478-F653 AromaticContact CD2-CE2 3.43Å; F478-F653 HydrophobicContact CD2-CE2 3.43Å; F478-F653 VanDerWaalsContact CD2-CE2 3.43Å; F478-F653 HydrophobicContact CD2-CZ 4.35Å; F478-F653 HydrophobicContact CE2-CD2 4.43Å; F478-F653 HydrophobicContact CE2-CE2 4.07Å; F478-F653 AromaticContact CG-CD2 3.63Å; F478-F653 HydrophobicContact CG-CD2 3.63Å; F478-F653 AromaticContact CG-CE2 3.86Å; F478-F653 HydrophobicContact CG-CE2 3.86Å; F478-F653 HydrophobicContact CG-CG 4.48Å; V532-F653 HydrophobicContact CG1-CE2 4.08Å; V532-F653 HydrophobicContact CG1-CZ 4.22Å; G649-F653 VanDerWaalsContact O-CD2 3.26Å; G649-F653 WeakPolarHBondContact O-CD2 3.22Å; G649-F653 PolarHBondContact O-N 3.46Å; I651-F653 PolarHBondContact O-N 2.87Å; F653-R656 PolarHBondContact O-N 3.18Å; F653-D657 PolarHBondContact O-N 3.05Å
654	R	86.3	Confident	81.1	Confident	154 Å²	154	66.4 Å²	66.4	58%	0.581	33%	0.326	S	S	*	.	H	α-helix	trans	-70.3	-36.3	171	-82.4	-167.6	177.7	177.7	2.8	113.1	W475 M650 I651 S652 D657 K658	W475-R654 HydrophobicContact CB-CG 4.38Å; W475-R654 HydrophobicContact CG-CG 4.45Å; M650-R654 WeakPolarHBondContact O-CB 3.23Å; M650-R654 WeakPolarHBondContact O-CG 3.3Å; M650-R654 PolarHBondContact O-N 3.07Å; I651-R654 PolarHBondContact O-N 2.92Å; S652-R654 PolarHBondContact O-N 3.11Å; R654-D657 WeakPolarHBondContact O-CB 3.49Å; R654-K658 PolarHBondContact O-N 2.91Å
655	I	84.8	Confident	80.4	Confident	99 Å²	99	67.1 Å²	67.1	51%	0.508	32%	0.318	S	S	.	.	H	α-helix	trans	-68	-41.9	173.8	-67.5	168	0	0	0	109.2	I651 S652 D657 K658 L659	I651-I655 HydrophobicContact CG2-CD1 3.65Å; I651-I655 HydrophobicContact CG2-CG1 4.3Å; I651-I655 VanDerWaalsContact O-CG1 3.31Å; I651-I655 WeakPolarHBondContact O-CG1 3.4Å; I651-I655 PolarHBondContact O-N 3.26Å; S652-I655 PolarHBondContact O-N 2.72Å; I655-D657 VanDerWaalsContact C-N 3.31Å; I655-D657 PolarHBondContact O-N 3.46Å; I655-K658 CarbonylContact O-C 3.57Å; I655-K658 WeakPolarHBondContact O-CA 3.49Å; I655-K658 WeakPolarHBondContact O-CB 3.3Å; I655-K658 PolarHBondContact O-N 2.02Å; I655-L659 PolarHBondContact O-N 3.12Å
656	R	82.7	Confident	79.7	Confident	12 Å²	12	70.1 Å²	70.1	5%	0.045	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-39.1	175	-172.6	-166.3	-179.3	97.2	2.6	112.5	R460 D464 K474 L535 G536 S652 F653 K658 L659 I660	R460-R656 VanDerWaalsContact CD-NH2 3.27Å; R460-R656 VanDerWaalsContact CZ-NH2 3.25Å; R460-R656 VanDerWaalsContact NE-NH2 3.15Å; D464-R656 IonicContact OD1-CZ 2.94Å; D464-R656 IonicContact OD1-NE 3.59Å; D464-R656 PolarHBondContact OD1-NE 3.15Å; D464-R656 IonicContact OD1-NH2 3.71Å; D464-R656 IonicContact OD2-CZ 3.01Å; D464-R656 IonicContact OD2-NE 2.73Å; D464-R656 IonicContact OD2-NH2 3.77Å; D464-R656 PolarHBondContact OD2-NH2 3.29Å; K474-R656 HydrophobicContact CD-CG 4.37Å; L535-R656 PolarHBondContact O-NH1 3.49Å; G536-R656 WeakPolarHBondContact O-CD 3.35Å; G536-R656 PolarHBondContact O-NH1 3.19Å; S652-R656 WeakPolarHBondContact O-CB 3.28Å; S652-R656 PolarHBondContact O-N 2.84Å; F653-R656 PolarHBondContact O-N 3.18Å; R656-K658 PolarHBondContact O-N 3.22Å; R656-L659 PolarHBondContact O-N 2.76Å; R656-I660 HydrophobicContact CG-CD1 3.72Å; R656-I660 HydrophobicContact CG-CG1 4.25Å; R656-I660 PolarHBondContact O-N 2.98Å
657	D	76.9	Confident	79	Confident	19 Å²	19	72.4 Å²	72.4	10%	0.102	34%	0.341	C	S	.	.	H	α-helix	trans	-54.9	-42.4	172.8	-87.9	-28.1	0	0	0	111.2	K474 F653 R654 I655 R661	K474-D657 VanDerWaalsContact CB-OD1 3.31Å; K474-D657 WeakPolarHBondContact CB-OD1 3.18Å; K474-D657 WeakPolarHBondContact CD-OD1 3.47Å; K474-D657 WeakPolarHBondContact CE-OD1 3.31Å; K474-D657 WeakPolarHBondContact CG-OD1 3.45Å; K474-D657 PolarHBondContact N-OD2 2.94Å; F653-D657 PolarHBondContact O-N 3.05Å; R654-D657 WeakPolarHBondContact O-CB 3.49Å; I655-D657 VanDerWaalsContact C-N 3.31Å; I655-D657 PolarHBondContact O-N 3.46Å; D657-R661 VanDerWaalsContact O-CB 3.29Å; D657-R661 WeakPolarHBondContact O-CB 3.26Å; D657-R661 WeakPolarHBondContact O-CD 2.94Å; D657-R661 WeakPolarHBondContact O-CG 3.06Å; D657-R661 PolarHBondContact O-N 3.12Å
658	K	73.8	Confident	78.1	Confident	144 Å²	144	72.3 Å²	72.3	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-71.6	-44.3	174.8	-64.8	-174.4	178	-175.8	0	111.8	R654 I655 R656 I660 R661 H662	R654-K658 PolarHBondContact O-N 2.91Å; I655-K658 CarbonylContact O-C 3.57Å; I655-K658 WeakPolarHBondContact O-CA 3.49Å; I655-K658 WeakPolarHBondContact O-CB 3.3Å; I655-K658 PolarHBondContact O-N 2.02Å; R656-K658 PolarHBondContact O-N 3.22Å; K658-I660 VanDerWaalsContact C-N 3.33Å; K658-I660 PolarHBondContact O-N 2.9Å; K658-R661 PolarHBondContact O-N 3.14Å; K658-H662 VanDerWaalsContact O-CB 3.27Å; K658-H662 WeakPolarHBondContact O-CB 3.4Å; K658-H662 PolarHBondContact O-CD2 3.16Å; K658-H662 VanDerWaalsContact O-CG 3.23Å; K658-H662 PolarHBondContact O-N 3.26Å
659	L	71.4	Confident	77.1	Confident	105 Å²	105	70.1 Å²	70.1	55%	0.55	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-29.1	-174.6	-166.6	133.1	0	0	0	113.7	I655 R656	I655-L659 PolarHBondContact O-N 3.12Å; R656-L659 PolarHBondContact O-N 2.76Å
660	I	65.6	Low	76.2	Confident	40 Å²	40	75.5 Å²	75.5	21%	0.205	35%	0.346	C	S	.	.	H	α-helix	trans	-89.8	-20.9	175.7	-68.6	178.3	0	0	0	111.8	D464 K474 R656 K658 H662	D464-I660 VanDerWaalsContact OD1-CD1 3.32Å; D464-I660 WeakPolarHBondContact OD1-CD1 3.04Å; K474-I660 VanDerWaalsContact NZ-CD1 3.32Å; R656-I660 HydrophobicContact CG-CD1 3.72Å; R656-I660 HydrophobicContact CG-CG1 4.25Å; R656-I660 PolarHBondContact O-N 2.98Å; K658-I660 VanDerWaalsContact C-N 3.33Å; K658-I660 PolarHBondContact O-N 2.9Å; I660-H662 VanDerWaalsContact C-N 3.29Å
661	R	54.3	Low	75.1	Confident	121 Å²	121	76.8 Å²	76.8	46%	0.457	35%	0.35	S	S	.	.	H	α-helix	trans	-79.8	-12.2	169.7	-76.9	178.4	-178.1	-159	-3	112.9	D657 K658	D657-R661 VanDerWaalsContact O-CB 3.29Å; D657-R661 WeakPolarHBondContact O-CB 3.26Å; D657-R661 WeakPolarHBondContact O-CD 2.94Å; D657-R661 WeakPolarHBondContact O-CG 3.06Å; D657-R661 PolarHBondContact O-N 3.12Å; K658-R661 PolarHBondContact O-N 3.14Å
662	H	40.3	Very low	73.8	Confident	123 Å²	123	75.4 Å²	75.4	57%	0.569	34%	0.339	S	S	*	.			trans	-113.9	0	-175.7	-74	-46.2	0	0	0	111.5	G114 S115 K658 I660	G114-H662 CarbonylContact C-O 3.59Å; G114-H662 WeakPolarHBondContact CA-O 3.42Å; S115-H662 WeakPolarHBondContact CB-ND1 3.46Å; S115-H662 PolarHBondContact N-O 2.63Å; S115-H662 WeakPolarHBondContact OG-CB 3.41Å; S115-H662 VanDerWaalsContact OG-CG 3.29Å; S115-H662 PolarHBondContact OG-ND1 3.27Å; K658-H662 VanDerWaalsContact O-CB 3.27Å; K658-H662 WeakPolarHBondContact O-CB 3.4Å; K658-H662 PolarHBondContact O-CD2 3.16Å; K658-H662 VanDerWaalsContact O-CG 3.23Å; K658-H662 PolarHBondContact O-N 3.26Å; I660-H662 VanDerWaalsContact C-N 3.29Å

Retrieved 662 of 662 residues in 664.7 ms (Link to these results)

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