A0A077ZGN9_TRITR Loading...

BED-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZGN9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 737 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	34.5	Very low	239 Å²	239	150.5 Å²	150.5	100%	1.177	85%	0.851	S	S	*	*				0	125.5	0	-69.6	-177.9	158.5	0	0	107.5
2	S	32.9	Very low	34.4	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	84%	0.844	S	S	*	*			cis	-160.6	143.3	-13.7	-71.8	0	0	0	0	104.5
3	A	31.1	Very low	34.1	Very low	98 Å²	98	146.1 Å²	146.1	81%	0.81	84%	0.842	S	S	*	*			trans	-80.6	159.1	-173.8	0	0	0	0	0	114.1
4	S	36.2	Very low	33.7	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	84%	0.841	S	S	*	*			trans	171.7	106.5	138.1	48.1	0	0	0	0	109.4
5	K	34.8	Very low	33.5	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	84%	0.844	S	S	*	*				52.2	121.6	90.2	-79	-171	178.2	-177.6	0	114.5
6	L	38	Very low	33.2	Very low	178 Å²	178	146.5 Å²	146.5	93%	0.932	84%	0.838	S	S	*	*				-168.1	140.7	112.8	-93.5	163.7	0	0	0	111.9
7	N	32.3	Very low	32.9	Very low	146 Å²	146	145.8 Å²	145.8	78%	0.781	83%	0.831	S	S	*	*			trans	-70.1	156.9	176.9	-108	0.1	0	0	0	111.4
8	E	34	Very low	32.8	Very low	170 Å²	170	146.1 Å²	146.1	79%	0.794	83%	0.83	S	S	*	*				174.5	147.1	101.4	-117.8	156.2	-164.2	0	0	113.9
9	E	34.5	Very low	32.5	Very low	185 Å²	185	147.6 Å²	147.6	86%	0.864	83%	0.829	S	S	*	*			trans	84.8	103.5	153.9	-65.8	179.8	171.8	0	0	122.8
10	A	33.5	Very low	32.3	Very low	92 Å²	92	148.6 Å²	148.6	76%	0.76	83%	0.827	S	S	*	*			trans	-95	176.9	149.9	0	0	0	0	0	108.5
11	P	36.5	Very low	32	Very low	119 Å²	119	147.7 Å²	147.7	77%	0.773	83%	0.831	S	S	*	*			cis	-145.4	164.1	17.7	39.4	-18	0	0	0	117.7
12	S	33	Very low	31.7	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	81%	0.808	S	S	*	*			trans	179.6	108.6	133.1	38.8	0	0	0	0	112.9
13	T	30.7	Very low	31.5	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	81%	0.813	S	S	*	*			trans	45.4	115.6	142.1	57.7	0	0	0	0	122.3
14	S	28.9	Very low	31.5	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	81%	0.81	S	S	*	*			trans	117.5	82.5	132.3	75.9	0	0	0	0	117.4
15	K	29.6	Very low	31.5	Very low	202 Å²	202	148.2 Å²	148.2	88%	0.878	81%	0.813	S	S	*	*			trans	-150.6	151.3	148.3	-84.8	-169.1	177.7	170.4	0	110.9
16	V	29	Very low	31.3	Very low	125 Å²	125	144 Å²	144	76%	0.758	81%	0.808	S	S	*	*			trans	117.2	134.8	143.2	-171.2	0	0	0	0	117.6
17	N	27.8	Very low	31	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	80%	0.802	S	S	*	*			trans	98.9	106.7	162.9	-77.2	-12.8	0	0	0	116.7
18	D	31.7	Very low	30.9	Very low	151 Å²	151	139 Å²	139	81%	0.807	81%	0.805	S	S	*	*				46.3	99.5	64.9	-93.9	-18.9	0	0	0	113.1
19	Q	27.3	Very low	30.7	Very low	174 Å²	174	135 Å²	135	81%	0.813	80%	0.802	S	S	*	*			trans	-179.5	118.9	143.8	-99.3	163	27.3	0	0	113.3
20	Q	27.2	Very low	30.3	Very low	168 Å²	168	131 Å²	131	79%	0.785	80%	0.8	S	S	*	*			trans	29.9	121.6	135.6	-68.5	168.8	-4.4	0	0	120.2	T22	Q20-T22 PolarHBondContact O-N 3.36Å
21	S	27.2	Very low	30	Very low	129 Å²	129	132.2 Å²	132.2	90%	0.902	80%	0.803	S	S	*	*			trans	-74.3	97.4	162.6	58.8	0	0	0	0	111
22	T	28.9	Very low	29.8	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.693	81%	0.807	S	S	*	*			trans	-121.3	123.1	163.1	47.9	0	0	0	0	109.1	Q20 A24	Q20-T22 PolarHBondContact O-N 3.36Å; T22-A24 PolarHBondContact O-N 3.29Å
23	F	29.8	Very low	29.4	Very low	216 Å²	216	142.1 Å²	142.1	95%	0.947	81%	0.813	S	S	*	*			trans	-64.7	113.9	170	-100.4	-97.2	0	0	0	109.7
24	A	30.6	Very low	29.1	Very low	90 Å²	90	147 Å²	147	74%	0.744	82%	0.817	S	S	*	*			trans	-129.5	134.6	166	0	0	0	0	0	108.7	T22	T22-A24 PolarHBondContact O-N 3.29Å
25	L	36.3	Very low	29.2	Very low	160 Å²	160	150.3 Å²	150.3	84%	0.838	82%	0.819	S	S	*	*			trans	-121.2	110.1	167.6	-89	165.3	0	0	0	109.9
26	S	31.3	Very low	29	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	82%	0.821	S	S	*	*			trans	48.8	124.3	141.4	65.4	0	0	0	0	121.1
27	A	31.9	Very low	29.1	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	82%	0.815	S	S	*	*				171.8	112.7	91.2	0	0	0	0	0	113.3
28	S	29.1	Very low	29.6	Very low	120 Å²	120	147 Å²	147	84%	0.839	81%	0.809	S	S	*	*			trans	-2.3	143.6	145.3	-168.6	0	0	0	0	122.9
29	A	29.4	Very low	30	Very low	88 Å²	88	142.1 Å²	142.1	73%	0.727	79%	0.787	S	S	*	*			trans	88.4	115.5	140	0	0	0	0	0	122.4
30	A	27.5	Very low	31	Very low	99 Å²	99	137.1 Å²	137.1	82%	0.818	77%	0.766	S	S	*	*			trans	84.3	124.9	132.6	0	0	0	0	0	121.3
31	S	26.1	Very low	32.6	Very low	118 Å²	118	133.4 Å²	133.4	83%	0.825	75%	0.754	S	S	*	*			trans	100.8	117	145.7	-149.6	0	0	0	0	118.6	R33	S31-R33 PolarHBondContact O-N 3.36Å
32	K	32.5	Very low	34.5	Very low	197 Å²	197	129 Å²	129	86%	0.857	72%	0.718	S	S	*	*			trans	-40.8	121.8	165.8	-65.6	166.9	176	173.8	0	111
33	R	24.8	Very low	36.4	Very low	241 Å²	241	124 Å²	124	91%	0.909	69%	0.686	S	S	*	*			trans	-175.5	114.1	145.9	-103.1	156.1	-171.9	-166.4	3.3	113.5	S31	S31-R33 PolarHBondContact O-N 3.36Å
34	R	25	Very low	38.6	Very low	236 Å²	236	118.8 Å²	118.8	89%	0.891	66%	0.663	S	S	*	*			trans	40.4	119.4	141.3	-74.5	179.1	164.5	174.6	-5.4	120.7
35	H	29.4	Very low	40.9	Very low	188 Å²	188	123.6 Å²	123.6	87%	0.87	66%	0.662	S	S	*	*			trans	2.3	121.5	144.2	-84.3	-87	0	0	0	117.7
36	R	25.9	Very low	43.2	Very low	243 Å²	243	119.1 Å²	119.1	92%	0.917	64%	0.635	S	S	*	*			trans	-145	111	146.9	-81	-166.4	172.2	171.3	-3.8	112.3
37	S	30.9	Very low	45.8	Very low	92 Å²	92	114.8 Å²	114.8	64%	0.643	60%	0.604	S	S	*	*			trans	25.4	137.8	149.6	51.6	0	0	0	0	122.4	S39	S37-S39 PolarHBondContact O-N 3.45Å
38	G	37.9	Very low	48.3	Very low	57 Å²	57	113.2 Å²	113.2	59%	0.588	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-63.5	17.4	-178.3	0	0	0	0	0	118.5	D40	G38-D40 VanDerWaalsContact C-N 3.25Å; G38-D40 PolarHBondContact O-N 2.73Å
39	S	40.2	Very low	50.8	Low	49 Å²	49	116.1 Å²	116.1	34%	0.343	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-76.1	-13.4	175.1	67.8	0	0	0	0	113.5	S37	S37-S39 PolarHBondContact O-N 3.45Å
40	D	48.2	Very low	53.2	Low	69 Å²	69	116.7 Å²	116.7	37%	0.369	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-99.6	6.6	-172.3	-150.5	41	0	0	0	114.7	G38 W43 K44	G38-D40 VanDerWaalsContact C-N 3.25Å; G38-D40 PolarHBondContact O-N 2.73Å; D40-W43 WeakPolarHBondContact OD1-CZ2 3.22Å; D40-W43 PolarHBondContact OD1-NE1 3.4Å; D40-W43 VanDerWaalsContact OD1-NE1 3.16Å; D40-K44 VanDerWaalsContact O-CD 3.25Å; D40-K44 WeakPolarHBondContact O-CD 3.09Å; D40-K44 WeakPolarHBondContact O-CE 3.48Å; D40-K44 PolarHBondContact O-NZ 3.46Å; D40-K44 IonicContact OD2-NZ 3.96Å; D40-K44 PolarHBondContact OD2-NZ 2.88Å
41	V	60.9	Low	55.8	Low	89 Å²	89	114.4 Å²	114.4	54%	0.539	55%	0.554	S	S	.	*	S	Bend	trans	-102.6	-30.4	-179.2	-176.6	0	0	0	0	112.2	K44	V41-K44 PolarHBondContact O-N 2.7Å
42	Y	68.5	Low	58.5	Low	37 Å²	37	117.1 Å²	117.1	15%	0.145	55%	0.551	C	S	.	*	S	Bend	trans	-60.4	-54.3	-170.1	171.1	-107.8	0	0	0	113.8	K44 R45 Y46 L77 I83 F84 D85 P86	Y42-K44 VanDerWaalsContact C-N 3.29Å; Y42-K44 PolarHBondContact O-N 3.19Å; Y42-R45 PolarHBondContact O-N 3.48Å; Y42-Y46 HydrophobicContact CD2-CE2 4.5Å; Y42-Y46 HydrophobicContact CE1-CE2 4.49Å; Y42-Y46 AromaticContact CE2-CE2 3.99Å; Y42-Y46 HydrophobicContact CE2-CE2 3.99Å; Y42-L77 HydrophobicContact CE1-CD1 4.45Å; Y42-I83 HydrophobicContact CE1-CG2 4.12Å; Y42-I83 WeakPolarHBondContact OH-CG2 3.41Å; Y42-F84 PolarHBondContact OH-N 3.21Å; Y42-F84 PolarHBondContact OH-O 3.07Å; Y42-D85 HydrophobicContact CD1-CB 4.23Å; Y42-D85 HydrophobicContact CE1-CB 4.32Å; Y42-P86 VanDerWaalsContact CD2-CD 3.45Å; Y42-P86 HydrophobicContact CD2-CG 3.96Å; Y42-P86 VanDerWaalsContact CE2-CD 3.49Å; Y42-P86 HydrophobicContact CE2-CG 4.21Å
43	W	68.3	Low	61	Low	7 Å²	7	109.3 Å²	109.3	3%	0.027	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-73.5	-21.8	-173.2	59.3	-90.4	0	0	0	112.7	D40 R45 Y46 L54 Y65 S70 F73 K74 L77	D40-W43 WeakPolarHBondContact OD1-CZ2 3.22Å; D40-W43 PolarHBondContact OD1-NE1 3.4Å; D40-W43 VanDerWaalsContact OD1-NE1 3.16Å; W43-R45 PolarHBondContact O-N 3.09Å; W43-R45 VanDerWaalsContact O-N 3.16Å; W43-Y46 PolarHBondContact O-N 2.81Å; W43-Y46 VanDerWaalsContact O-N 3.07Å; W43-L54 HydrophobicContact CE3-CD1 4.23Å; W43-L54 HydrophobicContact CH2-CD1 4.45Å; W43-L54 HydrophobicContact CZ3-CD1 3.71Å; W43-L54 HydrophobicContact CZ3-CD2 4.02Å; W43-Y65 HydrophobicContact CH2-CE2 4Å; W43-S70 VanDerWaalsContact CE2-CB 3.5Å; W43-F73 HydrophobicContact CB-CD1 4.08Å; W43-F73 HydrophobicContact CB-CE1 4.28Å; W43-F73 HydrophobicContact CE3-CD1 4.1Å; W43-K74 HydrophobicContact CB-CG 4.47Å; W43-K74 VanDerWaalsContact CD1-CE 3.41Å; W43-L77 HydrophobicContact CB-CD1 4.07Å
44	K	76.4	Confident	64	Low	107 Å²	107	98 Å²	98	47%	0.465	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-62.7	-19.8	178.6	-71.3	179.6	-178.3	145.6	0	113.3	D40 V41 Y42 Y46	D40-K44 VanDerWaalsContact O-CD 3.25Å; D40-K44 WeakPolarHBondContact O-CD 3.09Å; D40-K44 WeakPolarHBondContact O-CE 3.48Å; D40-K44 PolarHBondContact O-NZ 3.46Å; D40-K44 IonicContact OD2-NZ 3.96Å; D40-K44 PolarHBondContact OD2-NZ 2.88Å; V41-K44 PolarHBondContact O-N 2.7Å; Y42-K44 VanDerWaalsContact C-N 3.29Å; Y42-K44 PolarHBondContact O-N 3.19Å; K44-Y46 VanDerWaalsContact C-N 3.29Å; K44-Y46 PolarHBondContact O-N 3.36Å
45	R	78.8	Confident	67	Low	191 Å²	191	88.9 Å²	88.9	72%	0.721	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-72.8	-17.5	174.9	-70.1	179.6	165.5	163.3	-4.3	114.1	Y42 W43	Y42-R45 PolarHBondContact O-N 3.48Å; W43-R45 PolarHBondContact O-N 3.09Å; W43-R45 VanDerWaalsContact O-N 3.16Å
46	Y	83.9	Confident	69.8	Low	67 Å²	67	80 Å²	80	26%	0.263	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-114	4	-171.6	-57	-77.1	0	0	0	113.6	Y42 W43 K44 L57 F73 L77 I83	Y42-Y46 HydrophobicContact CD2-CE2 4.5Å; Y42-Y46 HydrophobicContact CE1-CE2 4.49Å; Y42-Y46 AromaticContact CE2-CE2 3.99Å; Y42-Y46 HydrophobicContact CE2-CE2 3.99Å; W43-Y46 PolarHBondContact O-N 2.81Å; W43-Y46 VanDerWaalsContact O-N 3.07Å; K44-Y46 VanDerWaalsContact C-N 3.29Å; K44-Y46 PolarHBondContact O-N 3.36Å; Y46-L57 WeakPolarHBondContact O-CB 3.42Å; Y46-L57 PolarHBondContact O-N 2.95Å; Y46-F73 WeakPolarHBondContact O-CZ 3.32Å; Y46-L77 HydrophobicContact CD2-CD1 4.01Å; Y46-L77 HydrophobicContact CD2-CD2 4.27Å; Y46-L77 HydrophobicContact CG-CD1 4.43Å; Y46-L77 HydrophobicContact CG-CD2 3.94Å; Y46-I83 HydrophobicContact CD1-CD1 3.96Å; Y46-I83 HydrophobicContact CD2-CG2 4.22Å; Y46-I83 HydrophobicContact CE1-CD1 3.78Å; Y46-I83 HydrophobicContact CE1-CG2 4.42Å; Y46-I83 HydrophobicContact CE2-CG2 3.79Å
47	C	85.9	Confident	72.6	Confident	17 Å²	17	73.5 Å²	73.5	12%	0.115	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.8	-179.4	60.3	0	0	0	0	113.5	L54 I55 F73	C47-L54 HydrophobicContact CB-CB 4.35Å; C47-L54 HydrophobicContact CB-CD2 4.13Å; C47-I55 CarbonylContact C-O 3.54Å; C47-I55 WeakPolarHBondContact CA-O 3.28Å; C47-I55 WeakPolarHBondContact CB-O 3.35Å; C47-F73 HydrophobicContact CB-CD1 4.49Å; C47-F73 HydrophobicContact CB-CD2 4.36Å; C47-F73 HydrophobicContact CB-CE1 3.81Å; C47-F73 HydrophobicContact CB-CE2 3.7Å; C47-F73 HydrophobicContact CB-CZ 3.43Å; C47-F73 VanDerWaalsContact CB-CZ 3.43Å
48	T	84.9	Confident	74.9	Confident	66 Å²	66	72.2 Å²	72.2	41%	0.405	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.6	154.7	53	0	0	0	0	109.4	I55 L57	T48-I55 PolarHBondContact N-O 3.32Å; T48-I55 PolarHBondContact O-N 2.92Å; T48-I55 WeakPolarHBondContact OG1-CB 3.49Å; T48-L57 HydrophobicContact CG2-CD2 3.77Å; T48-L57 HydrophobicContact CG2-CG 4.35Å
49	R	82.3	Confident	77.2	Confident	181 Å²	181	72.5 Å²	72.5	68%	0.683	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.1	178.9	-177.3	179.6	176.1	-178.5	-1.7	109.7	G51 L54	R49-G51 PolarHBondContact NE-O 3.06Å; R49-L54 HydrophobicContact CB-CD2 4.32Å
50	D	78.1	Confident	79.3	Confident	99 Å²	99	73.7 Å²	73.7	53%	0.529	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	97.5	173	-176.9	20	0	0	0	109.9	K52 S53 I55	D50-K52 PolarHBondContact O-N 3.36Å; D50-K52 VanDerWaalsContact O-N 3.15Å; D50-S53 PolarHBondContact N-O 3Å; D50-S53 WeakPolarHBondContact O-CA 3.35Å; D50-S53 WeakPolarHBondContact O-CB 3.37Å; D50-S53 PolarHBondContact O-N 3.47Å; D50-S53 PolarHBondContact O-OG 3.03Å; D50-S53 VanDerWaalsContact O-OG 3.1Å; D50-I55 HydrophobicContact CB-CD1 3.74Å; D50-I55 HydrophobicContact CB-CG1 4.28Å
51	G	82.3	Confident	81.1	Confident	52 Å²	52	76.3 Å²	76.3	54%	0.536	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	-114.6	-176.8	0	0	0	0	0	113.9	R49 S53	R49-G51 PolarHBondContact NE-O 3.06Å; G51-S53 VanDerWaalsContact C-N 3.28Å
52	K	84.2	Confident	82.4	Confident	174 Å²	174	76 Å²	76	76%	0.757	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	20.4	176.2	-65.4	-177.6	-179.6	176.5	0	112.5	D50 Y65	D50-K52 PolarHBondContact O-N 3.36Å; D50-K52 VanDerWaalsContact O-N 3.15Å; K52-Y65 CarbonylContact O-C 3.56Å; K52-Y65 WeakPolarHBondContact O-CA 3.34Å; K52-Y65 PolarHBondContact O-N 2.95Å
53	S	85.1	Confident	83.4	Confident	33 Å²	33	75.7 Å²	75.7	23%	0.231	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.8	-172.9	-29	0	0	0	0	111.6	D50 G51 L63	D50-S53 PolarHBondContact N-O 3Å; D50-S53 WeakPolarHBondContact O-CA 3.35Å; D50-S53 WeakPolarHBondContact O-CB 3.37Å; D50-S53 PolarHBondContact O-N 3.47Å; D50-S53 PolarHBondContact O-OG 3.03Å; D50-S53 VanDerWaalsContact O-OG 3.1Å; G51-S53 VanDerWaalsContact C-N 3.28Å; S53-L63 CarbonylContact C-O 3.52Å; S53-L63 VanDerWaalsContact CA-O 3.29Å; S53-L63 WeakPolarHBondContact CA-O 3.48Å
54	L	87.7	Confident	84.2	Confident	4 Å²	4	79 Å²	79	2%	0.021	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.4	166.3	-70.6	171.6	0	0	0	109	W43 C47 R49 T62 L63 Y65 F73	W43-L54 HydrophobicContact CE3-CD1 4.23Å; W43-L54 HydrophobicContact CH2-CD1 4.45Å; W43-L54 HydrophobicContact CZ3-CD1 3.71Å; W43-L54 HydrophobicContact CZ3-CD2 4.02Å; C47-L54 HydrophobicContact CB-CB 4.35Å; C47-L54 HydrophobicContact CB-CD2 4.13Å; R49-L54 HydrophobicContact CB-CD2 4.32Å; L54-T62 CarbonylContact O-C 3.56Å; L54-T62 WeakPolarHBondContact O-CA 3.43Å; L54-L63 PolarHBondContact N-O 3.47Å; L54-L63 PolarHBondContact O-N 3.28Å; L54-Y65 HydrophobicContact CD1-CD2 3.46Å; L54-Y65 VanDerWaalsContact CD1-CD2 3.46Å; L54-Y65 HydrophobicContact CD1-CE2 4.03Å; L54-Y65 HydrophobicContact CD1-CG 4.02Å; L54-Y65 HydrophobicContact CD2-CG 4.49Å; L54-Y65 HydrophobicContact CG-CD2 3.9Å; L54-Y65 HydrophobicContact CG-CG 3.92Å; L54-F73 HydrophobicContact CB-CD2 3.85Å; L54-F73 HydrophobicContact CB-CE2 4.44Å; L54-F73 HydrophobicContact CB-CG 4.37Å; L54-F73 HydrophobicContact CD1-CB 3.72Å; L54-F73 HydrophobicContact CD1-CD1 4.47Å; L54-F73 HydrophobicContact CD1-CD2 4.21Å; L54-F73 HydrophobicContact CD1-CG 3.88Å
55	I	86.5	Confident	84.6	Confident	45 Å²	45	75.3 Å²	75.3	23%	0.231	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124	176.5	-57.9	169.7	0	0	0	107.8	C47 T48 D50 L57	C47-I55 CarbonylContact C-O 3.54Å; C47-I55 WeakPolarHBondContact CA-O 3.28Å; C47-I55 WeakPolarHBondContact CB-O 3.35Å; T48-I55 PolarHBondContact N-O 3.32Å; T48-I55 PolarHBondContact O-N 2.92Å; T48-I55 WeakPolarHBondContact OG1-CB 3.49Å; D50-I55 HydrophobicContact CB-CD1 3.74Å; D50-I55 HydrophobicContact CB-CG1 4.28Å; I55-L57 PolarHBondContact O-N 2.71Å
56	C	88.2	Confident	84.2	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.007	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125	175.5	-179.9	0	0	0	0	111.6	C58 A60 K61 F73 H76 H81	C56-C58 PolarHBondContact O-N 2.72Å; C56-C58 PolarHBondContact SG-N 3.08Å; C56-A60 WeakPolarHBondContact O-CA 3.39Å; C56-A60 PolarHBondContact O-N 2.94Å; C56-K61 HydrophobicContact CB-CB 4.49Å; C56-K61 PolarHBondContact N-O 2.89Å; C56-F73 HydrophobicContact CB-CE2 3.95Å; C56-F73 HydrophobicContact CB-CZ 4.49Å; C56-H76 VanDerWaalsContact CB-NE2 3.31Å; C56-H76 WeakPolarHBondContact CB-NE2 3.47Å; C56-H76 PolarHBondContact SG-NE2 3.49Å; C56-H81 PolarHBondContact SG-NE2 2.82Å
57	L	84.8	Confident	83.5	Confident	106 Å²	106	73 Å²	73	56%	0.555	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.8	175.3	-71.3	173.5	0	0	0	113.7	Y46 T48 I55	Y46-L57 WeakPolarHBondContact O-CB 3.42Å; Y46-L57 PolarHBondContact O-N 2.95Å; T48-L57 HydrophobicContact CG2-CD2 3.77Å; T48-L57 HydrophobicContact CG2-CG 4.35Å; I55-L57 PolarHBondContact O-N 2.71Å
58	C	80	Confident	82.7	Confident	66 Å²	66	76.7 Å²	76.7	45%	0.446	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-26	-178.3	-56.4	0	0	0	0	113.4	C56 H81	C56-C58 PolarHBondContact O-N 2.72Å; C56-C58 PolarHBondContact SG-N 3.08Å; C58-H81 WeakPolarHBondContact CB-CE1 3.1Å; C58-H81 WeakPolarHBondContact CB-ND1 3.45Å
59	C	85.6	Confident	82.3	Confident	63 Å²	63	75.9 Å²	75.9	43%	0.426	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146	10.1	-177.6	65	0	0	0	0	115.3	K61 H76 H81	C59-K61 PolarHBondContact O-N 3.32Å; C59-K61 VanDerWaalsContact SG-CB 3.56Å; C59-H76 PolarHBondContact SG-CE1 2.91Å; C59-H76 PolarHBondContact SG-NE2 2.91Å; C59-H81 VanDerWaalsContact SG-CE1 3.57Å; C59-H81 PolarHBondContact SG-NE2 2.77Å; C59-H81 VanDerWaalsContact SG-NE2 3.44Å
60	A	83.9	Confident	82.2	Confident	74 Å²	74	67.9 Å²	67.9	61%	0.612	41%	0.406	S	S	*	.			trans	58.8	13.6	-177.3	0	0	0	0	0	115.6	C56 T62	C56-A60 WeakPolarHBondContact O-CA 3.39Å; C56-A60 PolarHBondContact O-N 2.94Å; A60-T62 PolarHBondContact O-N 3.03Å
61	K	86.2	Confident	82.3	Confident	123 Å²	123	66.8 Å²	66.8	54%	0.535	40%	0.403	S	S	.	.			trans	-71.7	125.8	179.1	-168.6	159.5	-171.5	168.4	0	111.5	C56 C59	C56-K61 HydrophobicContact CB-CB 4.49Å; C56-K61 PolarHBondContact N-O 2.89Å; C59-K61 PolarHBondContact O-N 3.32Å; C59-K61 VanDerWaalsContact SG-CB 3.56Å
62	T	89.5	Confident	82.4	Confident	84 Å²	84	66.2 Å²	66.2	52%	0.515	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.2	176	-51.5	0	0	0	0	110.7	L54 A60	L54-T62 CarbonylContact O-C 3.56Å; L54-T62 WeakPolarHBondContact O-CA 3.43Å; A60-T62 PolarHBondContact O-N 3.03Å
63	L	88.1	Confident	82.6	Confident	29 Å²	29	57.9 Å²	57.9	15%	0.152	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.6	-176.3	-70.8	137.1	0	0	0	110.4	S53 L54 Y65 F73 H76	S53-L63 CarbonylContact C-O 3.52Å; S53-L63 VanDerWaalsContact CA-O 3.29Å; S53-L63 WeakPolarHBondContact CA-O 3.48Å; L54-L63 PolarHBondContact N-O 3.47Å; L54-L63 PolarHBondContact O-N 3.28Å; L63-Y65 PolarHBondContact O-N 3.04Å; L63-F73 HydrophobicContact CD1-CD2 3.6Å; L63-F73 HydrophobicContact CD1-CE2 4.14Å; L63-H76 HydrophobicContact CD1-CB 3.62Å; L63-H76 HydrophobicContact CD2-CB 4.04Å
64	S	85.7	Confident	82.7	Confident	76 Å²	76	59.4 Å²	59.4	53%	0.531	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	130.8	176.3	168.3	0	0	0	0	111.4	A66 S72	S64-A66 PolarHBondContact OG-N 2.9Å; S64-S72 PolarHBondContact O-OG 3.45Å
65	Y	85.2	Confident	82.7	Confident	31 Å²	31	66.2 Å²	66.2	12%	0.122	39%	0.387	C	S	.	.			trans	-120	43.2	171.7	-169.3	-113.8	0	0	0	110.4	W43 K52 L54 L63 C68 S69	W43-Y65 HydrophobicContact CH2-CE2 4Å; K52-Y65 CarbonylContact O-C 3.56Å; K52-Y65 WeakPolarHBondContact O-CA 3.34Å; K52-Y65 PolarHBondContact O-N 2.95Å; L54-Y65 HydrophobicContact CD1-CD2 3.46Å; L54-Y65 VanDerWaalsContact CD1-CD2 3.46Å; L54-Y65 HydrophobicContact CD1-CE2 4.03Å; L54-Y65 HydrophobicContact CD1-CG 4.02Å; L54-Y65 HydrophobicContact CD2-CG 4.49Å; L54-Y65 HydrophobicContact CG-CD2 3.9Å; L54-Y65 HydrophobicContact CG-CG 3.92Å; L63-Y65 PolarHBondContact O-N 3.04Å; Y65-C68 HydrophobicContact CE1-CB 4.45Å; Y65-S69 WeakPolarHBondContact CD2-O 3.28Å
66	A	70.2	Confident	82.8	Confident	48 Å²	48	64.8 Å²	64.8	40%	0.397	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-66	143.5	169.6	0	0	0	0	0	110.4	S64 C68 S69	S64-A66 PolarHBondContact OG-N 2.9Å; A66-C68 PolarHBondContact O-N 3.43Å; A66-S69 WeakPolarHBondContact O-CB 3.3Å; A66-S69 PolarHBondContact O-N 3.23Å; A66-S69 VanDerWaalsContact O-N 3.15Å
67	N	70.2	Confident	82.6	Confident	162 Å²	162	64.8 Å²	64.8	87%	0.866	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	56.8	29.5	177.2	-58.6	-13	0	0	0	115.1	S69	N67-S69 PolarHBondContact O-N 3.44Å; N67-S69 VanDerWaalsContact O-N 3.11Å
68	C	67.8	Low	82.6	Confident	94 Å²	94	61.9 Å²	61.9	64%	0.635	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	55.4	26.5	-176.6	-58.1	0	0	0	0	113.8	Y65 A66 S70	Y65-C68 HydrophobicContact CE1-CB 4.45Å; A66-C68 PolarHBondContact O-N 3.43Å; C68-S70 PolarHBondContact O-N 3.13Å
69	S	76.5	Confident	82.4	Confident	48 Å²	48	61.8 Å²	61.8	34%	0.336	37%	0.371	S	S	.	.			trans	-86.8	110.1	-179.2	-176.8	0	0	0	0	110.4	Y65 A66 N67 T71	Y65-S69 WeakPolarHBondContact CD2-O 3.28Å; A66-S69 WeakPolarHBondContact O-CB 3.3Å; A66-S69 PolarHBondContact O-N 3.23Å; A66-S69 VanDerWaalsContact O-N 3.15Å; N67-S69 PolarHBondContact O-N 3.44Å; N67-S69 VanDerWaalsContact O-N 3.11Å; S69-T71 PolarHBondContact O-N 3.2Å; S69-T71 PolarHBondContact OG-OG1 3.43Å
70	S	79.7	Confident	82	Confident	14 Å²	14	61.5 Å²	61.5	10%	0.098	37%	0.374	C	S	.	.			trans	-81.3	4.3	172.7	56	0	0	0	0	113.2	W43 C68 S72 F73 K74	W43-S70 VanDerWaalsContact CE2-CB 3.5Å; C68-S70 PolarHBondContact O-N 3.13Å; S70-S72 PolarHBondContact O-N 3.19Å; S70-F73 PolarHBondContact O-N 3.09Å; S70-F73 VanDerWaalsContact O-N 3.13Å; S70-K74 WeakPolarHBondContact O-CG 3.48Å; S70-K74 PolarHBondContact O-N 3.14Å; S70-K74 WeakPolarHBondContact OG-CE 2.95Å
71	T	81.5	Confident	81.9	Confident	75 Å²	75	60.6 Å²	60.6	46%	0.46	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-40.6	-171.5	-32.4	0	0	0	0	113.1	S69 F73 K75	S69-T71 PolarHBondContact O-N 3.2Å; S69-T71 PolarHBondContact OG-OG1 3.43Å; T71-F73 VanDerWaalsContact C-N 3.34Å; T71-K75 WeakPolarHBondContact O-CB 3.45Å; T71-K75 VanDerWaalsContact O-CG 3.32Å; T71-K75 WeakPolarHBondContact O-CG 3.46Å; T71-K75 PolarHBondContact O-N 3.08Å
72	S	84.2	Confident	81.3	Confident	40 Å²	40	56.7 Å²	56.7	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-60.9	-43.3	173.8	51.9	0	0	0	0	111.3	S64 S70 H76	S64-S72 PolarHBondContact O-OG 3.45Å; S70-S72 PolarHBondContact O-N 3.19Å; S72-H76 WeakPolarHBondContact O-CB 3.46Å; S72-H76 PolarHBondContact O-N 3.37Å
73	F	88.6	Confident	80.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-72	-41.7	-179.4	-168.3	-97.9	0	0	0	112.7	W43 Y46 C47 L54 C56 L63 S70 T71 K75 H76 L77	W43-F73 HydrophobicContact CB-CD1 4.08Å; W43-F73 HydrophobicContact CB-CE1 4.28Å; W43-F73 HydrophobicContact CE3-CD1 4.1Å; Y46-F73 WeakPolarHBondContact O-CZ 3.32Å; C47-F73 HydrophobicContact CB-CD1 4.49Å; C47-F73 HydrophobicContact CB-CD2 4.36Å; C47-F73 HydrophobicContact CB-CE1 3.81Å; C47-F73 HydrophobicContact CB-CE2 3.7Å; C47-F73 HydrophobicContact CB-CZ 3.43Å; C47-F73 VanDerWaalsContact CB-CZ 3.43Å; L54-F73 HydrophobicContact CB-CD2 3.85Å; L54-F73 HydrophobicContact CB-CE2 4.44Å; L54-F73 HydrophobicContact CB-CG 4.37Å; L54-F73 HydrophobicContact CD1-CB 3.72Å; L54-F73 HydrophobicContact CD1-CD1 4.47Å; L54-F73 HydrophobicContact CD1-CD2 4.21Å; L54-F73 HydrophobicContact CD1-CG 3.88Å; C56-F73 HydrophobicContact CB-CE2 3.95Å; C56-F73 HydrophobicContact CB-CZ 4.49Å; L63-F73 HydrophobicContact CD1-CD2 3.6Å; L63-F73 HydrophobicContact CD1-CE2 4.14Å; S70-F73 PolarHBondContact O-N 3.09Å; S70-F73 VanDerWaalsContact O-N 3.13Å; T71-F73 VanDerWaalsContact C-N 3.34Å; F73-K75 PolarHBondContact O-N 3.5Å; F73-H76 WeakPolarHBondContact O-CB 3.39Å; F73-H76 PolarHBondContact O-N 3.08Å; F73-H76 VanDerWaalsContact O-N 3.14Å; F73-L77 HydrophobicContact CD1-CD1 3.97Å; F73-L77 HydrophobicContact CD1-CG 4.22Å; F73-L77 HydrophobicContact CE1-CD1 3.58Å; F73-L77 HydrophobicContact CE1-CD2 4.14Å; F73-L77 HydrophobicContact CE1-CG 3.8Å; F73-L77 HydrophobicContact CZ-CD1 4.41Å; F73-L77 HydrophobicContact CZ-CD2 4.16Å; F73-L77 HydrophobicContact CZ-CG 4.21Å; F73-L77 PolarHBondContact O-N 3.22Å
74	K	87.5	Confident	80.1	Confident	64 Å²	64	59.6 Å²	59.6	28%	0.278	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-43.1	173	-71.1	-178.8	179.9	-162.5	0	111.8	W43 S70 H76 L77 S78 D85	W43-K74 HydrophobicContact CB-CG 4.47Å; W43-K74 VanDerWaalsContact CD1-CE 3.41Å; S70-K74 WeakPolarHBondContact O-CG 3.48Å; S70-K74 PolarHBondContact O-N 3.14Å; S70-K74 WeakPolarHBondContact OG-CE 2.95Å; K74-H76 VanDerWaalsContact C-N 3.3Å; K74-H76 PolarHBondContact O-N 3.05Å; K74-L77 PolarHBondContact O-N 3.43Å; K74-S78 PolarHBondContact O-N 3.18Å; K74-S78 VanDerWaalsContact O-N 3.14Å; K74-S78 PolarHBondContact O-OG 3.36Å; K74-D85 IonicContact NZ-OD2 2.9Å
75	K	85.8	Confident	79.3	Confident	147 Å²	147	57 Å²	57	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-63.5	-35.3	173.3	-75.5	179.7	-179.9	-176.1	0	112.4	T71 F73 S78 A79	T71-K75 WeakPolarHBondContact O-CB 3.45Å; T71-K75 VanDerWaalsContact O-CG 3.32Å; T71-K75 WeakPolarHBondContact O-CG 3.46Å; T71-K75 PolarHBondContact O-N 3.08Å; F73-K75 PolarHBondContact O-N 3.5Å; K75-S78 PolarHBondContact O-OG 3.07Å; K75-S78 VanDerWaalsContact O-OG 3.09Å; K75-A79 WeakPolarHBondContact O-CB 3.39Å; K75-A79 PolarHBondContact O-N 3.42Å
76	H	89.4	Confident	78.1	Confident	16 Å²	16	59.2 Å²	59.2	7%	0.074	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-44.9	175	169.6	65.4	0	0	0	112.4	C56 C59 L63 S72 F73 K74 S78 A79 A80 H81	C56-H76 VanDerWaalsContact CB-NE2 3.31Å; C56-H76 WeakPolarHBondContact CB-NE2 3.47Å; C56-H76 PolarHBondContact SG-NE2 3.49Å; C59-H76 PolarHBondContact SG-CE1 2.91Å; C59-H76 PolarHBondContact SG-NE2 2.91Å; L63-H76 HydrophobicContact CD1-CB 3.62Å; L63-H76 HydrophobicContact CD2-CB 4.04Å; S72-H76 WeakPolarHBondContact O-CB 3.46Å; S72-H76 PolarHBondContact O-N 3.37Å; F73-H76 WeakPolarHBondContact O-CB 3.39Å; F73-H76 PolarHBondContact O-N 3.08Å; F73-H76 VanDerWaalsContact O-N 3.14Å; K74-H76 VanDerWaalsContact C-N 3.3Å; K74-H76 PolarHBondContact O-N 3.05Å; H76-S78 VanDerWaalsContact C-N 3.34Å; H76-S78 PolarHBondContact O-N 3.42Å; H76-A79 PolarHBondContact O-N 2.89Å; H76-A80 VanDerWaalsContact O-CB 3.27Å; H76-A80 WeakPolarHBondContact O-CB 3.42Å; H76-A80 PolarHBondContact O-N 3.43Å; H76-H81 AromaticContact CD2-NE2 3.86Å; H76-H81 AromaticContact CE1-CD2 3.98Å; H76-H81 AromaticContact CE1-NE2 3.32Å; H76-H81 PolarHBondContact CE1-NE2 3.23Å; H76-H81 VanDerWaalsContact CE1-NE2 3.32Å; H76-H81 AromaticContact NE2-CD2 3.55Å; H76-H81 AromaticContact NE2-NE2 2.94Å; H76-H81 PolarHBondContact NE2-NE2 2.97Å
77	L	84.5	Confident	77.4	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-57.5	-45.1	176	-75.1	177	0	0	0	112.1	Y42 W43 Y46 F73 K74 H81 G82 I83	Y42-L77 HydrophobicContact CE1-CD1 4.45Å; W43-L77 HydrophobicContact CB-CD1 4.07Å; Y46-L77 HydrophobicContact CD2-CD1 4.01Å; Y46-L77 HydrophobicContact CD2-CD2 4.27Å; Y46-L77 HydrophobicContact CG-CD1 4.43Å; Y46-L77 HydrophobicContact CG-CD2 3.94Å; F73-L77 HydrophobicContact CD1-CD1 3.97Å; F73-L77 HydrophobicContact CD1-CG 4.22Å; F73-L77 HydrophobicContact CE1-CD1 3.58Å; F73-L77 HydrophobicContact CE1-CD2 4.14Å; F73-L77 HydrophobicContact CE1-CG 3.8Å; F73-L77 HydrophobicContact CZ-CD1 4.41Å; F73-L77 HydrophobicContact CZ-CD2 4.16Å; F73-L77 HydrophobicContact CZ-CG 4.21Å; F73-L77 PolarHBondContact O-N 3.22Å; K74-L77 PolarHBondContact O-N 3.43Å; L77-H81 CarbonylContact O-C 3.37Å; L77-H81 WeakPolarHBondContact O-CB 3.4Å; L77-H81 PolarHBondContact O-N 3.16Å; L77-G82 PolarHBondContact O-N 2.89Å; L77-G82 VanDerWaalsContact O-N 3.13Å; L77-I83 CarbonylContact C-O 3.58Å; L77-I83 HydrophobicContact CB-CB 4.03Å; L77-I83 HydrophobicContact CB-CG2 4.09Å; L77-I83 HydrophobicContact CD1-CG2 4.19Å; L77-I83 HydrophobicContact CD2-CB 4.26Å; L77-I83 HydrophobicContact CD2-CD1 4.12Å; L77-I83 HydrophobicContact CD2-CG2 4.07Å; L77-I83 HydrophobicContact CG-CG2 4.35Å; L77-I83 PolarHBondContact O-N 3.07Å
78	S	84.9	Confident	76.6	Confident	44 Å²	44	60.5 Å²	60.5	31%	0.308	35%	0.354	S	S	.	.	H	α-helix	trans	-70.7	-43.7	178.6	58.9	0	0	0	0	112.8	K74 K75 H76 G82 I83	K74-S78 PolarHBondContact O-N 3.18Å; K74-S78 VanDerWaalsContact O-N 3.14Å; K74-S78 PolarHBondContact O-OG 3.36Å; K75-S78 PolarHBondContact O-OG 3.07Å; K75-S78 VanDerWaalsContact O-OG 3.09Å; H76-S78 VanDerWaalsContact C-N 3.34Å; H76-S78 PolarHBondContact O-N 3.42Å; S78-G82 PolarHBondContact O-N 3.14Å; S78-I83 PolarHBondContact N-O 3.45Å
79	A	76.3	Confident	75.2	Confident	64 Å²	64	63 Å²	63	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-78.8	-35.5	-174.7	0	0	0	0	0	114.5	K75 H76	K75-A79 WeakPolarHBondContact O-CB 3.39Å; K75-A79 PolarHBondContact O-N 3.42Å; H76-A79 PolarHBondContact O-N 2.89Å
80	A	75.8	Confident	73.2	Confident	58 Å²	58	69.9 Å²	69.9	48%	0.479	38%	0.383	S	S	.	.	H	α-helix	trans	-100.9	-28.9	-173.8	0	0	0	0	0	113.7	H76	H76-A80 VanDerWaalsContact O-CB 3.27Å; H76-A80 WeakPolarHBondContact O-CB 3.42Å; H76-A80 PolarHBondContact O-N 3.43Å
81	H	82.1	Confident	70.8	Confident	55 Å²	55	73.4 Å²	73.4	26%	0.255	41%	0.413	S	S	.	.	H	α-helix	trans	-120.8	-6.4	-171.9	-55.1	-61.9	0	0	0	114.1	C56 C58 C59 H76 L77 I83	C56-H81 PolarHBondContact SG-NE2 2.82Å; C58-H81 WeakPolarHBondContact CB-CE1 3.1Å; C58-H81 WeakPolarHBondContact CB-ND1 3.45Å; C59-H81 VanDerWaalsContact SG-CE1 3.57Å; C59-H81 PolarHBondContact SG-NE2 2.77Å; C59-H81 VanDerWaalsContact SG-NE2 3.44Å; H76-H81 AromaticContact CD2-NE2 3.86Å; H76-H81 AromaticContact CE1-CD2 3.98Å; H76-H81 AromaticContact CE1-NE2 3.32Å; H76-H81 PolarHBondContact CE1-NE2 3.23Å; H76-H81 VanDerWaalsContact CE1-NE2 3.32Å; H76-H81 AromaticContact NE2-CD2 3.55Å; H76-H81 AromaticContact NE2-NE2 2.94Å; H76-H81 PolarHBondContact NE2-NE2 2.97Å; L77-H81 CarbonylContact O-C 3.37Å; L77-H81 WeakPolarHBondContact O-CB 3.4Å; L77-H81 PolarHBondContact O-N 3.16Å; H81-I83 HydrophobicContact CB-CB 4.27Å; H81-I83 HydrophobicContact CB-CD1 3.56Å; H81-I83 HydrophobicContact CB-CG1 3.74Å; H81-I83 PolarHBondContact O-N 3.48Å
82	G	74.5	Confident	68.4	Low	41 Å²	41	76.6 Å²	76.6	42%	0.423	43%	0.433	S	S	.	.			trans	64.2	26	-175	0	0	0	0	0	113.3	L77 S78 F84	L77-G82 PolarHBondContact O-N 2.89Å; L77-G82 VanDerWaalsContact O-N 3.13Å; S78-G82 PolarHBondContact O-N 3.14Å; G82-F84 WeakPolarHBondContact O-CD2 3.31Å; G82-F84 VanDerWaalsContact O-CE2 3.3Å; G82-F84 WeakPolarHBondContact O-CE2 3.43Å
83	I	74.1	Confident	65.7	Low	31 Å²	31	79 Å²	79	16%	0.159	46%	0.455	C	S	.	.			trans	-98.9	109.5	-175.6	-68.9	175.4	0	0	0	108.2	Y42 Y46 L77 S78 H81	Y42-I83 HydrophobicContact CE1-CG2 4.12Å; Y42-I83 WeakPolarHBondContact OH-CG2 3.41Å; Y46-I83 HydrophobicContact CD1-CD1 3.96Å; Y46-I83 HydrophobicContact CD2-CG2 4.22Å; Y46-I83 HydrophobicContact CE1-CD1 3.78Å; Y46-I83 HydrophobicContact CE1-CG2 4.42Å; Y46-I83 HydrophobicContact CE2-CG2 3.79Å; L77-I83 CarbonylContact C-O 3.58Å; L77-I83 HydrophobicContact CB-CB 4.03Å; L77-I83 HydrophobicContact CB-CG2 4.09Å; L77-I83 HydrophobicContact CD1-CG2 4.19Å; L77-I83 HydrophobicContact CD2-CB 4.26Å; L77-I83 HydrophobicContact CD2-CD1 4.12Å; L77-I83 HydrophobicContact CD2-CG2 4.07Å; L77-I83 HydrophobicContact CG-CG2 4.35Å; L77-I83 PolarHBondContact O-N 3.07Å; S78-I83 PolarHBondContact N-O 3.45Å; H81-I83 HydrophobicContact CB-CB 4.27Å; H81-I83 HydrophobicContact CB-CD1 3.56Å; H81-I83 HydrophobicContact CB-CG1 3.74Å; H81-I83 PolarHBondContact O-N 3.48Å
84	F	77.3	Confident	62.9	Low	142 Å²	142	87.7 Å²	87.7	62%	0.623	50%	0.496	S	S	*	.			trans	-107.4	141.9	-174.2	-61.4	-86.3	0	0	0	112.3	Y42 G82 P86	Y42-F84 PolarHBondContact OH-N 3.21Å; Y42-F84 PolarHBondContact OH-O 3.07Å; G82-F84 WeakPolarHBondContact O-CD2 3.31Å; G82-F84 VanDerWaalsContact O-CE2 3.3Å; G82-F84 WeakPolarHBondContact O-CE2 3.43Å; F84-P86 WeakPolarHBondContact O-CD 3.31Å
85	D	69.5	Low	60.2	Low	22 Å²	22	91.6 Å²	91.6	12%	0.118	53%	0.525	C	S	.	.			trans	-64.2	119	176.7	-171.2	-27.2	0	0	0	109.7	Y42 K74 N87 I88	Y42-D85 HydrophobicContact CD1-CB 4.23Å; Y42-D85 HydrophobicContact CE1-CB 4.32Å; K74-D85 IonicContact NZ-OD2 2.9Å; D85-N87 PolarHBondContact O-N 2.87Å; D85-N87 WeakPolarHBondContact OD1-CB 3.23Å; D85-N87 PolarHBondContact OD1-N 3.34Å; D85-N87 PolarHBondContact OD1-ND2 3.01Å; D85-I88 HydrophobicContact CB-CD1 3.77Å; D85-I88 HydrophobicContact CB-CG1 3.89Å; D85-I88 PolarHBondContact O-N 3.48Å; D85-I88 VanDerWaalsContact O-N 3.09Å
86	P	59.3	Low	57.5	Low	78 Å²	78	90.4 Å²	90.4	51%	0.506	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.6	-177.1	24.5	-32.8	0	0	0	113.2	Y42 F84	Y42-P86 VanDerWaalsContact CD2-CD 3.45Å; Y42-P86 HydrophobicContact CD2-CG 3.96Å; Y42-P86 VanDerWaalsContact CE2-CD 3.49Å; Y42-P86 HydrophobicContact CE2-CG 4.21Å; F84-P86 WeakPolarHBondContact O-CD 3.31Å
87	N	55.7	Low	54.6	Low	101 Å²	101	92.5 Å²	92.5	54%	0.54	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.3	2	177.7	-58.3	-58.8	0	0	0	114.1	D85 Q89	D85-N87 PolarHBondContact O-N 2.87Å; D85-N87 WeakPolarHBondContact OD1-CB 3.23Å; D85-N87 PolarHBondContact OD1-N 3.34Å; D85-N87 PolarHBondContact OD1-ND2 3.01Å; N87-Q89 VanDerWaalsContact C-N 3.27Å; N87-Q89 PolarHBondContact O-N 2.94Å
88	I	54.6	Low	52	Low	136 Å²	136	100.6 Å²	100.6	70%	0.697	61%	0.605	S	S	*	*			trans	-97.2	50.8	174	-51.5	176	0	0	0	109.6	D85	D85-I88 HydrophobicContact CB-CD1 3.77Å; D85-I88 HydrophobicContact CB-CG1 3.89Å; D85-I88 PolarHBondContact O-N 3.48Å; D85-I88 VanDerWaalsContact O-N 3.09Å
89	Q	37.6	Very low	49.2	Very low	146 Å²	146	101 Å²	101	68%	0.682	62%	0.616	S	S	*	*			trans	-112.6	128.1	159.4	-62.5	-177.8	7.5	0	0	104.5	N87	N87-Q89 VanDerWaalsContact C-N 3.27Å; N87-Q89 PolarHBondContact O-N 2.94Å
90	H	34.7	Very low	47	Very low	192 Å²	192	106.2 Å²	106.2	89%	0.889	63%	0.634	S	S	*	*	S	Bend	trans	87.3	67.5	-177.6	-44.6	-76.3	0	0	0	117.7
91	A	29.7	Very low	45.1	Very low	89 Å²	89	112 Å²	112	74%	0.736	65%	0.651	S	S	*	*	S	Bend	trans	-159.9	128	145.1	0	0	0	0	0	108.7
92	T	30.2	Very low	42.7	Very low	142 Å²	142	120.3 Å²	120.3	87%	0.871	68%	0.68	S	S	*	*			trans	82.4	59.1	-176.2	71.9	0	0	0	0	116.2
93	A	28.5	Very low	40.9	Very low	91 Å²	91	125.9 Å²	125.9	75%	0.752	70%	0.698	S	S	*	*			trans	-72.3	151.9	130.9	0	0	0	0	0	107.2
94	E	28.4	Very low	39	Very low	181 Å²	181	135.2 Å²	135.2	85%	0.846	73%	0.732	S	S	*	*			trans	83.3	78.6	-178.9	-49.5	174.3	-163.2	0	0	115
95	T	30.8	Very low	36.9	Very low	147 Å²	147	137.3 Å²	137.3	90%	0.902	74%	0.741	S	S	*	*				-166.3	130.5	123.3	-52.3	0	0	0	0	108
96	S	30.3	Very low	35.2	Very low	121 Å²	121	143.4 Å²	143.4	85%	0.846	77%	0.772	S	S	*	*			trans	-41.8	145.8	-178.6	-55.9	0	0	0	0	116.8
97	G	26.9	Very low	33.9	Very low	61 Å²	61	142.9 Å²	142.9	63%	0.629	78%	0.78	S	S	*	*	S	Bend	trans	96.9	109.9	150.1	0	0	0	0	0	116.7	G99	G97-G99 PolarHBondContact O-N 3.46Å
98	N	30	Very low	33.2	Very low	171 Å²	171	149.5 Å²	149.5	91%	0.914	80%	0.798	S	S	*	*	S	Bend	trans	71.7	19.4	144.9	-57.8	-15.4	0	0	0	120.3
99	G	27.2	Very low	32.8	Very low	52 Å²	52	148.9 Å²	148.9	54%	0.536	80%	0.8	S	S	.	*			trans	-87	-24.4	176.3	0	0	0	0	0	116.4	G97 Q101 R102	G97-G99 PolarHBondContact O-N 3.46Å; G99-Q101 PolarHBondContact O-N 3.11Å; G99-R102 PolarHBondContact O-N 3.47Å
100	L	30.8	Very low	33.3	Very low	174 Å²	174	144.2 Å²	144.2	91%	0.911	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-0.2	-169.5	-87.5	155.4	0	0	0	115.4
101	Q	34.8	Very low	34.3	Very low	178 Å²	178	143.4 Å²	143.4	83%	0.832	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-1.9	174.8	-67.5	-168.9	-3.2	0	0	114.2	G99	G99-Q101 PolarHBondContact O-N 3.11Å
102	R	31.1	Very low	35.8	Very low	230 Å²	230	148.4 Å²	148.4	87%	0.868	78%	0.777	S	S	*	*	S	Bend	trans	-99.1	-2.2	-171.4	-112.5	175.4	172.7	168.2	-2.2	116.7	G99	G99-R102 PolarHBondContact O-N 3.47Å
103	I	37.1	Very low	37.2	Very low	158 Å²	158	144.8 Å²	144.8	81%	0.81	76%	0.761	S	S	*	*	S	Bend	trans	-97.9	16	-177.5	-50.2	176	0	0	0	112.2
104	R	34.1	Very low	39.1	Very low	228 Å²	228	143.5 Å²	143.5	86%	0.86	74%	0.741	S	S	*	*	S	Bend	trans	-91.2	7.4	-177.6	-80.8	-173.3	172.3	173.1	-1.2	115.7
105	K	33.6	Very low	41.5	Very low	186 Å²	186	137.2 Å²	137.2	81%	0.809	71%	0.713	S	S	*	*	S	Bend	trans	-139	129.8	-172.9	-66.2	-179	179.4	178.8	0	109.7
106	I	33.1	Very low	44	Very low	150 Å²	150	136.5 Å²	136.5	77%	0.769	70%	0.698	S	S	*	*	S	Bend	trans	107.1	93.3	176.9	-52.2	154.5	0	0	0	112
107	G	33.8	Very low	46.7	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	68%	0.68	S	S	*	*	S	Bend	trans	125.8	90.6	-171.9	0	0	0	0	0	108.4	V109	G107-V109 PolarHBondContact O-N 2.84Å
108	R	40.1	Very low	49.6	Very low	241 Å²	241	132.3 Å²	132.3	91%	0.909	65%	0.654	S	S	*	*			trans	-61.3	105.9	172.6	-84.7	-173.9	-179	179.1	1.3	106.7	P110	R108-P110 WeakPolarHBondContact O-CD 3.22Å; R108-P110 VanDerWaalsContact O-N 3.14Å
109	V	45.1	Very low	52.4	Low	122 Å²	122	126.5 Å²	126.5	74%	0.739	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-48.8	121.5	161.7	179	0	0	0	0	105.5	G107 R111	G107-V109 PolarHBondContact O-N 2.84Å; V109-R111 PolarHBondContact O-N 2.88Å; V109-R111 VanDerWaalsContact O-N 3.15Å
110	P	49.2	Very low	55.4	Low	49 Å²	49	124.7 Å²	124.7	32%	0.318	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-51.9	128.9	177	-22	30.7	0	0	0	107.4	R108 D114 L115 A151	R108-P110 WeakPolarHBondContact O-CD 3.22Å; R108-P110 VanDerWaalsContact O-N 3.14Å; P110-D114 HydrophobicContact CB-CB 3.94Å; P110-L115 HydrophobicContact CB-CD2 4.19Å; P110-L115 HydrophobicContact CB-CG 4.32Å; P110-A151 HydrophobicContact CG-CB 4.24Å
111	R	54.9	Low	58.2	Low	175 Å²	175	122.2 Å²	122.2	66%	0.66	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-58.4	151.2	176.1	-68.4	176.5	-70.6	-175.5	0.1	106.8	V109 A113 D114 L115	V109-R111 PolarHBondContact O-N 2.88Å; V109-R111 VanDerWaalsContact O-N 3.15Å; R111-A113 PolarHBondContact O-N 3.38Å; R111-D114 PolarHBondContact N-OD2 3.17Å; R111-D114 IonicContact NE-OD2 2.72Å; R111-D114 WeakPolarHBondContact O-CA 3.49Å; R111-D114 WeakPolarHBondContact O-CB 3.5Å; R111-D114 PolarHBondContact O-N 3.08Å; R111-L115 PolarHBondContact O-N 2.83Å
112	K	61.3	Low	60.9	Low	194 Å²	194	114.1 Å²	114.1	84%	0.843	55%	0.548	S	S	*	.	H	α-helix	trans	-48.6	-33.1	175	-77.3	-174.7	175.9	-178.8	0	112.5	L115 K116	K112-L115 PolarHBondContact O-N 2.86Å; K112-K116 PolarHBondContact O-N 3.43Å
113	A	59.5	Low	63.7	Low	65 Å²	65	103.2 Å²	103.2	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-40.5	173.3	0	0	0	0	0	113.6	R111 K116 V117	R111-A113 PolarHBondContact O-N 3.38Å; A113-K116 PolarHBondContact O-N 3.08Å; A113-V117 WeakPolarHBondContact O-CG2 3.09Å; A113-V117 PolarHBondContact O-N 3.5Å
114	D	69.7	Low	66	Low	65 Å²	65	99.3 Å²	99.3	35%	0.348	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-36.6	-179.4	-54.8	-34.1	0	0	0	110.8	P110 R111 V117 V118	P110-D114 HydrophobicContact CB-CB 3.94Å; R111-D114 PolarHBondContact N-OD2 3.17Å; R111-D114 IonicContact NE-OD2 2.72Å; R111-D114 WeakPolarHBondContact O-CA 3.49Å; R111-D114 WeakPolarHBondContact O-CB 3.5Å; R111-D114 PolarHBondContact O-N 3.08Å; D114-V117 PolarHBondContact O-N 2.81Å; D114-V118 WeakPolarHBondContact O-CG2 3.34Å; D114-V118 PolarHBondContact O-N 3.03Å; D114-V118 VanDerWaalsContact O-N 3.12Å
115	L	78.5	Confident	68.6	Low	48 Å²	48	91.3 Å²	91.3	25%	0.251	46%	0.457	S	S	.	.	H	α-helix	trans	-67.4	-35.9	176.7	-63.8	174.3	0	0	0	112.8	P110 R111 K112 V118 Q119 A151 F152	P110-L115 HydrophobicContact CB-CD2 4.19Å; P110-L115 HydrophobicContact CB-CG 4.32Å; R111-L115 PolarHBondContact O-N 2.83Å; K112-L115 PolarHBondContact O-N 2.86Å; L115-V118 PolarHBondContact O-N 3.12Å; L115-Q119 PolarHBondContact O-N 3.47Å; L115-A151 HydrophobicContact CD2-CB 4.46Å; L115-F152 HydrophobicContact CB-CD2 4.25Å; L115-F152 HydrophobicContact CD2-CB 3.86Å; L115-F152 HydrophobicContact CD2-CD2 3.97Å; L115-F152 HydrophobicContact CD2-CG 4.39Å; L115-F152 WeakPolarHBondContact O-CE2 3.18Å
116	K	84.2	Confident	71.1	Confident	133 Å²	133	82.5 Å²	82.5	58%	0.578	42%	0.419	S	S	*	.	H	α-helix	trans	-65.6	-42.5	175.3	-173	179.1	177.4	-175.3	0	111.2	K112 A113 V118 Q119 D120	K112-K116 PolarHBondContact O-N 3.43Å; A113-K116 PolarHBondContact O-N 3.08Å; K116-V118 VanDerWaalsContact C-N 3.31Å; K116-V118 PolarHBondContact O-N 3.11Å; K116-Q119 WeakPolarHBondContact O-CB 3.32Å; K116-Q119 PolarHBondContact O-N 2.89Å; K116-D120 VanDerWaalsContact O-CG 3.32Å; K116-D120 PolarHBondContact O-N 3.42Å
117	V	85.6	Confident	73.5	Confident	77 Å²	77	76 Å²	76	47%	0.467	39%	0.385	S	S	.	.	H	α-helix	trans	-60.1	-43	175.7	174.9	0	0	0	0	110.9	A113 D114 Q119 D120 M121	A113-V117 WeakPolarHBondContact O-CG2 3.09Å; A113-V117 PolarHBondContact O-N 3.5Å; D114-V117 PolarHBondContact O-N 2.81Å; V117-Q119 PolarHBondContact O-N 3.5Å; V117-D120 PolarHBondContact O-N 3.07Å; V117-M121 HydrophobicContact CG1-CG 4.46Å; V117-M121 HydrophobicContact CG1-SD 4.16Å; V117-M121 VanDerWaalsContact O-CG 3.3Å; V117-M121 WeakPolarHBondContact O-CG 3.31Å; V117-M121 PolarHBondContact O-N 3.28Å
118	V	87.1	Confident	75.5	Confident	16 Å²	16	80.7 Å²	80.7	10%	0.097	39%	0.387	C	S	.	.	H	α-helix	trans	-61.5	-43.6	175.7	176.2	0	0	0	0	111.2	D114 L115 K116 M121 C122 F149 F152	D114-V118 WeakPolarHBondContact O-CG2 3.34Å; D114-V118 PolarHBondContact O-N 3.03Å; D114-V118 VanDerWaalsContact O-N 3.12Å; L115-V118 PolarHBondContact O-N 3.12Å; K116-V118 VanDerWaalsContact C-N 3.31Å; K116-V118 PolarHBondContact O-N 3.11Å; V118-M121 PolarHBondContact O-N 2.8Å; V118-C122 WeakPolarHBondContact O-CB 3.44Å; V118-C122 PolarHBondContact O-N 3.03Å; V118-C122 PolarHBondContact O-SG 3Å; V118-F149 HydrophobicContact CG1-CD2 3.99Å; V118-F149 HydrophobicContact CG1-CE2 4.19Å; V118-F149 HydrophobicContact CG1-CG 4.18Å; V118-F149 HydrophobicContact CG2-CD1 3.97Å; V118-F149 HydrophobicContact CG2-CE1 3.84Å; V118-F149 HydrophobicContact CG2-CG 4.39Å; V118-F149 HydrophobicContact CG2-CZ 4.16Å; V118-F152 HydrophobicContact CB-CD2 4.46Å; V118-F152 HydrophobicContact CB-CG 4.49Å; V118-F152 HydrophobicContact CG1-CD1 3.57Å; V118-F152 HydrophobicContact CG1-CD2 4.29Å; V118-F152 HydrophobicContact CG1-CE1 3.71Å; V118-F152 HydrophobicContact CG1-CE2 4.43Å; V118-F152 HydrophobicContact CG1-CG 3.89Å; V118-F152 HydrophobicContact CG1-CZ 4.18Å
119	Q	90.2	Very high	77.4	Confident	50 Å²	50	73.5 Å²	73.5	23%	0.234	37%	0.366	C	S	.	.	H	α-helix	trans	-60.5	-46.7	175.4	-171.7	176.8	-75.6	0	0	112.3	L115 K116 V117 M121 C122 C123 F152 P155 I159 H163	L115-Q119 PolarHBondContact O-N 3.47Å; K116-Q119 WeakPolarHBondContact O-CB 3.32Å; K116-Q119 PolarHBondContact O-N 2.89Å; V117-Q119 PolarHBondContact O-N 3.5Å; Q119-M121 VanDerWaalsContact C-N 3.31Å; Q119-M121 PolarHBondContact O-N 2.92Å; Q119-C122 PolarHBondContact O-N 2.73Å; Q119-C123 PolarHBondContact O-N 3.08Å; Q119-C123 PolarHBondContact O-SG 2.89Å; Q119-F152 HydrophobicContact CB-CE2 3.83Å; Q119-F152 HydrophobicContact CB-CZ 3.66Å; Q119-F152 HydrophobicContact CG-CZ 4.18Å; Q119-P155 HydrophobicContact CG-CB 4.46Å; Q119-I159 HydrophobicContact CG-CG2 4.12Å; Q119-I159 VanDerWaalsContact NE2-CG2 3.31Å; Q119-H163 PolarHBondContact NE2-NE2 2.81Å; Q119-H163 VanDerWaalsContact NE2-NE2 3.19Å
120	D	89.2	Confident	78.6	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.07	34%	0.339	C	S	.	.	H	α-helix	trans	-58.7	-44.6	177.5	-69.3	-5.2	0	0	0	110.3	K116 V117 C123 K124 H163 Y596	K116-D120 VanDerWaalsContact O-CG 3.32Å; K116-D120 PolarHBondContact O-N 3.42Å; V117-D120 PolarHBondContact O-N 3.07Å; D120-C123 PolarHBondContact O-N 3.45Å; D120-K124 WeakPolarHBondContact O-CB 3.29Å; D120-K124 VanDerWaalsContact O-CG 3.23Å; D120-K124 WeakPolarHBondContact O-CG 3.28Å; D120-K124 PolarHBondContact O-N 3.23Å; D120-H163 IonicContact OD1-CE1 3.17Å; D120-H163 PolarHBondContact OD1-CE1 2.84Å; D120-H163 IonicContact OD1-ND1 2.94Å; D120-Y596 PolarHBondContact OD2-OH 3.44Å
121	M	89.6	Confident	80.1	Confident	123 Å²	123	69.3 Å²	69.3	61%	0.606	33%	0.334	S	S	*	.	H	α-helix	trans	-64.6	-40.9	176.5	-70.9	-178.7	79.1	0	0	112.3	V117 V118 Q119 C123 K124 M125	V117-M121 HydrophobicContact CG1-CG 4.46Å; V117-M121 HydrophobicContact CG1-SD 4.16Å; V117-M121 VanDerWaalsContact O-CG 3.3Å; V117-M121 WeakPolarHBondContact O-CG 3.31Å; V117-M121 PolarHBondContact O-N 3.28Å; V118-M121 PolarHBondContact O-N 2.8Å; Q119-M121 VanDerWaalsContact C-N 3.31Å; Q119-M121 PolarHBondContact O-N 2.92Å; M121-C123 VanDerWaalsContact C-N 3.34Å; M121-C123 PolarHBondContact O-N 3.42Å; M121-K124 PolarHBondContact O-N 3.48Å; M121-M125 WeakPolarHBondContact O-CB 3.47Å; M121-M125 PolarHBondContact O-N 2.55Å
122	C	91.4	Very high	81.1	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.054	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-39.9	176.4	-69.8	0	0	0	0	112	V118 Q119 V126 W136 P155	V118-C122 WeakPolarHBondContact O-CB 3.44Å; V118-C122 PolarHBondContact O-N 3.03Å; V118-C122 PolarHBondContact O-SG 3Å; Q119-C122 PolarHBondContact O-N 2.73Å; C122-V126 WeakPolarHBondContact O-CG2 3.37Å; C122-V126 PolarHBondContact O-N 2.91Å; C122-W136 HydrophobicContact CB-CZ2 3.73Å; C122-W136 PolarHBondContact O-NE1 2.93Å; C122-P155 HydrophobicContact CB-CG 3.97Å
123	C	90.2	Very high	82.1	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-70.1	-45.6	175.8	-61.7	0	0	0	0	110.9	Q119 D120 M121 M125 V126 F127 H163	Q119-C123 PolarHBondContact O-N 3.08Å; Q119-C123 PolarHBondContact O-SG 2.89Å; D120-C123 PolarHBondContact O-N 3.45Å; M121-C123 VanDerWaalsContact C-N 3.34Å; M121-C123 PolarHBondContact O-N 3.42Å; C123-M125 VanDerWaalsContact C-N 3.27Å; C123-M125 PolarHBondContact O-N 2.63Å; C123-V126 WeakPolarHBondContact O-CB 3.39Å; C123-V126 PolarHBondContact O-N 2.84Å; C123-V126 VanDerWaalsContact O-N 3.08Å; C123-F127 HydrophobicContact CB-CE2 4.16Å; C123-F127 HydrophobicContact CB-CZ 4.09Å; C123-F127 WeakPolarHBondContact O-CD1 3.23Å; C123-F127 WeakPolarHBondContact O-CD2 3.4Å; C123-F127 VanDerWaalsContact O-CG 3.3Å; C123-F127 WeakPolarHBondContact O-CG 3.33Å; C123-F127 PolarHBondContact O-N 3.48Å; C123-F127 VanDerWaalsContact O-N 3.11Å; C123-H163 HydrophobicContact CB-CB 3.87Å
124	K	86.6	Confident	83.3	Confident	76 Å²	76	53.5 Å²	53.5	33%	0.33	26%	0.263	S	S	.	.	H	α-helix	trans	-57.7	-39.2	175.8	-76.1	177.1	-177.4	-173.3	0	112.3	D120 M121 F127 K128 Y596	D120-K124 WeakPolarHBondContact O-CB 3.29Å; D120-K124 VanDerWaalsContact O-CG 3.23Å; D120-K124 WeakPolarHBondContact O-CG 3.28Å; D120-K124 PolarHBondContact O-N 3.23Å; M121-K124 PolarHBondContact O-N 3.48Å; K124-F127 PolarHBondContact O-N 3.3Å; K124-K128 VanDerWaalsContact O-CB 3.28Å; K124-K128 WeakPolarHBondContact O-CB 3.43Å; K124-K128 PolarHBondContact O-N 3.24Å; K124-Y596 VanDerWaalsContact NZ-CD1 3.25Å
125	M	88.6	Confident	84.1	Confident	60 Å²	60	52.2 Å²	52.2	30%	0.296	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-45.4	174.8	-172	-175.2	102.7	0	0	111.3	M121 C123 F127 D129 L131 F135 W136	M121-M125 WeakPolarHBondContact O-CB 3.47Å; M121-M125 PolarHBondContact O-N 2.55Å; C123-M125 VanDerWaalsContact C-N 3.27Å; C123-M125 PolarHBondContact O-N 2.63Å; M125-F127 PolarHBondContact O-N 3.29Å; M125-D129 WeakPolarHBondContact CG-OD2 3.09Å; M125-D129 VanDerWaalsContact O-CB 3.27Å; M125-D129 WeakPolarHBondContact O-CB 3.39Å; M125-D129 PolarHBondContact O-N 3.2Å; M125-L131 HydrophobicContact CE-CD1 3.74Å; M125-F135 HydrophobicContact CE-CD1 4.01Å; M125-F135 HydrophobicContact CE-CE1 3.31Å; M125-F135 HydrophobicContact CE-CZ 3.86Å; M125-W136 HydrophobicContact CE-CH2 3.59Å; M125-W136 HydrophobicContact CE-CZ2 3.39Å; M125-W136 HydrophobicContact SD-CH2 4.18Å; M125-W136 HydrophobicContact SD-CZ2 4.01Å
126	V	85.3	Confident	84.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-39.6	176.5	172.3	0	0	0	0	111.3	C122 C123 R130 L131 L133 F135 V160	C122-V126 WeakPolarHBondContact O-CG2 3.37Å; C122-V126 PolarHBondContact O-N 2.91Å; C123-V126 WeakPolarHBondContact O-CB 3.39Å; C123-V126 PolarHBondContact O-N 2.84Å; C123-V126 VanDerWaalsContact O-N 3.08Å; V126-R130 CarbonylContact O-C 3.52Å; V126-R130 WeakPolarHBondContact O-CA 3.4Å; V126-R130 PolarHBondContact O-N 3.12Å; V126-L131 HydrophobicContact CB-CB 4.49Å; V126-L131 HydrophobicContact CG1-CB 4.24Å; V126-L131 WeakPolarHBondContact CG1-O 3.37Å; V126-L131 HydrophobicContact CG2-CB 4.5Å; V126-L131 PolarHBondContact O-N 3.25Å; V126-L133 HydrophobicContact CG1-CD2 4.39Å; V126-F135 HydrophobicContact CG2-CB 4.31Å; V126-F135 HydrophobicContact CG2-CD1 4.45Å; V126-V160 HydrophobicContact CB-CG1 4.22Å; V126-V160 HydrophobicContact CG1-CG1 3.91Å; V126-V160 HydrophobicContact CG2-CG1 4.44Å
127	F	83.1	Confident	84.7	Confident	15 Å²	15	50.7 Å²	50.7	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-57	179.6	-49.3	-25.9	0	0	0	111.4	C123 K124 M125 D129 R130 L133 V160 H163 L164 M731 V734 C735	C123-F127 HydrophobicContact CB-CE2 4.16Å; C123-F127 HydrophobicContact CB-CZ 4.09Å; C123-F127 WeakPolarHBondContact O-CD1 3.23Å; C123-F127 WeakPolarHBondContact O-CD2 3.4Å; C123-F127 VanDerWaalsContact O-CG 3.3Å; C123-F127 WeakPolarHBondContact O-CG 3.33Å; C123-F127 PolarHBondContact O-N 3.48Å; C123-F127 VanDerWaalsContact O-N 3.11Å; K124-F127 PolarHBondContact O-N 3.3Å; M125-F127 PolarHBondContact O-N 3.29Å; F127-D129 VanDerWaalsContact C-N 3.29Å; F127-D129 PolarHBondContact O-N 2.83Å; F127-R130 WeakPolarHBondContact O-CA 3.38Å; F127-R130 PolarHBondContact O-N 3.33Å; F127-L133 HydrophobicContact CE1-CD2 4.48Å; F127-V160 HydrophobicContact CE1-CG1 3.82Å; F127-V160 HydrophobicContact CZ-CG1 4.28Å; F127-V160 WeakPolarHBondContact CZ-O 3.35Å; F127-H163 HydrophobicContact CE2-CB 4.17Å; F127-H163 HydrophobicContact CZ-CB 3.94Å; F127-L164 HydrophobicContact CD1-CD1 4.29Å; F127-L164 HydrophobicContact CE1-CB 3.79Å; F127-L164 HydrophobicContact CE1-CD1 4.16Å; F127-L164 HydrophobicContact CE1-CG 4.49Å; F127-L164 HydrophobicContact CE2-CB 4.49Å; F127-L164 HydrophobicContact CZ-CB 3.68Å; F127-L164 HydrophobicContact CZ-CD1 4.43Å; F127-M731 HydrophobicContact CB-CE 4.33Å; F127-M731 HydrophobicContact CD1-CE 3.89Å; F127-M731 HydrophobicContact CD1-SD 3.37Å; F127-M731 WeakPolarHBondContact CD1-SD 3.49Å; F127-M731 HydrophobicContact CE1-SD 3.9Å; F127-M731 HydrophobicContact CG-SD 4.26Å; F127-V734 HydrophobicContact CB-CG1 4.31Å; F127-V734 HydrophobicContact CD2-CG1 4.24Å; F127-V734 HydrophobicContact CG-CG1 4.46Å; F127-C735 PolarHBondContact O-SG 2.7Å
128	K	77.1	Confident	84.7	Confident	163 Å²	163	52.4 Å²	52.4	71%	0.709	25%	0.247	S	C	*	.	H	α-helix	trans	-58.3	-40.4	-176.1	-170	178.3	-179.9	-175.4	0	112.8	K124 R130	K124-K128 VanDerWaalsContact O-CB 3.28Å; K124-K128 WeakPolarHBondContact O-CB 3.43Å; K124-K128 PolarHBondContact O-N 3.24Å; K128-R130 VanDerWaalsContact C-N 3.29Å
129	D	79.1	Confident	84.8	Confident	91 Å²	91	59.6 Å²	59.6	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.5	-179	-52.6	-22.2	0	0	0	111.8	M125 F127 L131	M125-D129 WeakPolarHBondContact CG-OD2 3.09Å; M125-D129 VanDerWaalsContact O-CB 3.27Å; M125-D129 WeakPolarHBondContact O-CB 3.39Å; M125-D129 PolarHBondContact O-N 3.2Å; F127-D129 VanDerWaalsContact C-N 3.29Å; F127-D129 PolarHBondContact O-N 2.83Å; D129-L131 HydrophobicContact CB-CD1 4.07Å; D129-L131 HydrophobicContact CB-CD2 4.43Å; D129-L131 HydrophobicContact CB-CG 3.89Å; D129-L131 PolarHBondContact O-N 3.08Å; D129-L131 VanDerWaalsContact O-N 3.12Å
130	R	71.7	Confident	84.7	Confident	44 Å²	44	59.7 Å²	59.7	17%	0.166	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	33.6	175.5	-58.1	170.6	179.7	-137	-15.1	113.1	V126 F127 K128 Q707 S710 Y714	V126-R130 CarbonylContact O-C 3.52Å; V126-R130 WeakPolarHBondContact O-CA 3.4Å; V126-R130 PolarHBondContact O-N 3.12Å; F127-R130 WeakPolarHBondContact O-CA 3.38Å; F127-R130 PolarHBondContact O-N 3.33Å; K128-R130 VanDerWaalsContact C-N 3.29Å; R130-Q707 PolarHBondContact NH1-O 2.59Å; R130-Q707 PolarHBondContact NH2-O 3.35Å; R130-S710 PolarHBondContact NH1-OG 3.36Å; R130-Y714 WeakPolarHBondContact O-CE1 3.13Å; R130-Y714 PolarHBondContact O-OH 3.09Å
131	L	79.6	Confident	84.7	Confident	38 Å²	38	59.7 Å²	59.7	20%	0.199	30%	0.295	C	S	.	.			trans	-75.3	156.1	-176.7	-57.1	170.3	0	0	0	110.7	M125 V126 D129 F135	M125-L131 HydrophobicContact CE-CD1 3.74Å; V126-L131 HydrophobicContact CB-CB 4.49Å; V126-L131 HydrophobicContact CG1-CB 4.24Å; V126-L131 WeakPolarHBondContact CG1-O 3.37Å; V126-L131 HydrophobicContact CG2-CB 4.5Å; V126-L131 PolarHBondContact O-N 3.25Å; D129-L131 HydrophobicContact CB-CD1 4.07Å; D129-L131 HydrophobicContact CB-CD2 4.43Å; D129-L131 HydrophobicContact CB-CG 3.89Å; D129-L131 PolarHBondContact O-N 3.08Å; D129-L131 VanDerWaalsContact O-N 3.12Å; L131-F135 HydrophobicContact CB-CB 4.02Å; L131-F135 HydrophobicContact CB-CD2 4.07Å; L131-F135 HydrophobicContact CB-CG 4.05Å; L131-F135 HydrophobicContact CD1-CD1 3.96Å; L131-F135 HydrophobicContact CD1-CD2 3.82Å; L131-F135 HydrophobicContact CD1-CE1 4.02Å; L131-F135 HydrophobicContact CD1-CE2 3.85Å; L131-F135 HydrophobicContact CD1-CG 3.87Å; L131-F135 HydrophobicContact CD1-CZ 3.95Å; L131-F135 HydrophobicContact CD2-CD2 4.14Å; L131-F135 HydrophobicContact CD2-CE2 4.23Å; L131-F135 HydrophobicContact CG-CD2 4.23Å; L131-F135 HydrophobicContact CG-CG 4.47Å
132	P	76.9	Confident	84.7	Confident	12 Å²	12	54.3 Å²	54.3	8%	0.078	27%	0.27	C	S	.	.			trans	-58.8	147	172.7	-25.4	37.5	0	0	0	111.8	N134 F135 K718	P132-N134 WeakPolarHBondContact CB-OD1 3.28Å; P132-N134 PolarHBondContact O-N 2.73Å; P132-F135 WeakPolarHBondContact O-CB 3.47Å; P132-F135 PolarHBondContact O-N 2.85Å; P132-K718 HydrophobicContact CG-CD 3.95Å
133	L	82	Confident	84.5	Confident	30 Å²	30	60.2 Å²	60.2	16%	0.157	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.6	177	-58.2	-179.3	0	0	0	113.5	V126 F127 V160 K161 L164 M731	V126-L133 HydrophobicContact CG1-CD2 4.39Å; F127-L133 HydrophobicContact CE1-CD2 4.48Å; L133-V160 HydrophobicContact CD2-CG1 3.83Å; L133-K161 HydrophobicContact CD1-CB 4.48Å; L133-L164 HydrophobicContact CD2-CD2 4.27Å; L133-M731 HydrophobicContact CD2-SD 4.1Å
134	N	83.9	Confident	84.5	Confident	60 Å²	60	66.8 Å²	66.8	32%	0.321	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	12.1	174.4	67.2	2.1	0	0	0	113.8	P132 W136 K137 P157	P132-N134 WeakPolarHBondContact CB-OD1 3.28Å; P132-N134 PolarHBondContact O-N 2.73Å; N134-W136 VanDerWaalsContact C-N 3.26Å; N134-W136 PolarHBondContact O-N 3.41Å; N134-K137 WeakPolarHBondContact O-CB 3.41Å; N134-K137 PolarHBondContact O-N 3.44Å; N134-P157 HydrophobicContact CB-CG 4.22Å
135	F	85.6	Confident	84.6	Confident	39 Å²	39	63.3 Å²	63.3	17%	0.171	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-49.8	-46.4	-178.2	173.6	-99.5	0	0	0	112.5	M125 V126 L131 P132 K137 K138 A141	M125-F135 HydrophobicContact CE-CD1 4.01Å; M125-F135 HydrophobicContact CE-CE1 3.31Å; M125-F135 HydrophobicContact CE-CZ 3.86Å; V126-F135 HydrophobicContact CG2-CB 4.31Å; V126-F135 HydrophobicContact CG2-CD1 4.45Å; L131-F135 HydrophobicContact CB-CB 4.02Å; L131-F135 HydrophobicContact CB-CD2 4.07Å; L131-F135 HydrophobicContact CB-CG 4.05Å; L131-F135 HydrophobicContact CD1-CD1 3.96Å; L131-F135 HydrophobicContact CD1-CD2 3.82Å; L131-F135 HydrophobicContact CD1-CE1 4.02Å; L131-F135 HydrophobicContact CD1-CE2 3.85Å; L131-F135 HydrophobicContact CD1-CG 3.87Å; L131-F135 HydrophobicContact CD1-CZ 3.95Å; L131-F135 HydrophobicContact CD2-CD2 4.14Å; L131-F135 HydrophobicContact CD2-CE2 4.23Å; L131-F135 HydrophobicContact CG-CD2 4.23Å; L131-F135 HydrophobicContact CG-CG 4.47Å; P132-F135 WeakPolarHBondContact O-CB 3.47Å; P132-F135 PolarHBondContact O-N 2.85Å; F135-K137 PolarHBondContact O-N 2.97Å; F135-K138 HydrophobicContact CD2-CD 4.47Å; F135-K138 VanDerWaalsContact O-CB 3.29Å; F135-K138 WeakPolarHBondContact O-CB 3.41Å; F135-K138 WeakPolarHBondContact O-CG 3.41Å; F135-K138 PolarHBondContact O-N 2.75Å; F135-A141 HydrophobicContact CD1-CB 4.36Å; F135-A141 HydrophobicContact CE1-CB 3.79Å; F135-A141 HydrophobicContact CE2-CB 4.43Å; F135-A141 HydrophobicContact CZ-CB 3.85Å
136	W	89.3	Confident	84.4	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.045	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-72.1	-6.2	-179.3	-64.5	111.7	0	0	0	114.9	C122 M125 N134 A141 L145 P154 P155	C122-W136 HydrophobicContact CB-CZ2 3.73Å; C122-W136 PolarHBondContact O-NE1 2.93Å; M125-W136 HydrophobicContact CE-CH2 3.59Å; M125-W136 HydrophobicContact CE-CZ2 3.39Å; M125-W136 HydrophobicContact SD-CH2 4.18Å; M125-W136 HydrophobicContact SD-CZ2 4.01Å; N134-W136 VanDerWaalsContact C-N 3.26Å; N134-W136 PolarHBondContact O-N 3.41Å; W136-A141 HydrophobicContact CE3-CB 4.17Å; W136-A141 HydrophobicContact CZ3-CB 4.4Å; W136-L145 HydrophobicContact CD2-CD2 4.26Å; W136-L145 HydrophobicContact CE3-CB 4.3Å; W136-L145 HydrophobicContact CE3-CD2 3.73Å; W136-L145 HydrophobicContact CH2-CD1 4.22Å; W136-L145 HydrophobicContact CH2-CD2 4.34Å; W136-L145 HydrophobicContact CZ3-CB 3.88Å; W136-L145 HydrophobicContact CZ3-CD1 4.16Å; W136-L145 HydrophobicContact CZ3-CD2 3.79Å; W136-L145 HydrophobicContact CZ3-CG 4.18Å; W136-P154 HydrophobicContact CB-CB 4.13Å; W136-P155 HydrophobicContact CB-CG 4.14Å; W136-P155 HydrophobicContact CD2-CG 4.36Å; W136-P155 HydrophobicContact CG-CG 3.69Å
137	K	86.1	Confident	84.4	Confident	137 Å²	137	74.6 Å²	74.6	60%	0.596	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-81.2	-15.8	167.8	-72.3	-168.1	166	-175.6	0	112.8	N134 F135 E139 P157	N134-K137 WeakPolarHBondContact O-CB 3.41Å; N134-K137 PolarHBondContact O-N 3.44Å; F135-K137 PolarHBondContact O-N 2.97Å; K137-E139 PolarHBondContact O-N 3.26Å; K137-P157 HydrophobicContact CD-CG 3.92Å; K137-P157 HydrophobicContact CG-CG 4.08Å
138	K	86.5	Confident	84.6	Confident	113 Å²	113	76.2 Å²	76.2	49%	0.491	38%	0.376	S	S	.	.	S	Bend	trans	-67.2	132.8	177.4	-64.3	-176	174.2	-169.6	0	109.6	F135 G140 A141 A142	F135-K138 HydrophobicContact CD2-CD 4.47Å; F135-K138 VanDerWaalsContact O-CB 3.29Å; F135-K138 WeakPolarHBondContact O-CB 3.41Å; F135-K138 WeakPolarHBondContact O-CG 3.41Å; F135-K138 PolarHBondContact O-N 2.75Å; K138-G140 PolarHBondContact O-N 2.76Å; K138-A141 HydrophobicContact CB-CB 4.27Å; K138-A141 PolarHBondContact O-N 3.04Å; K138-A141 VanDerWaalsContact O-N 3.12Å; K138-A142 PolarHBondContact O-N 3.35Å
139	E	88.4	Confident	85	Confident	167 Å²	167	73 Å²	73	78%	0.78	36%	0.362	S	S	*	.	H	α-helix	trans	-51.9	-53.7	-173.5	-174.9	174.8	-168.6	0	0	112.8	K137 A141 A142 E143	K137-E139 PolarHBondContact O-N 3.26Å; E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 2.96Å; E139-A142 PolarHBondContact O-N 3.42Å; E139-E143 WeakPolarHBondContact O-CB 3.26Å; E139-E143 PolarHBondContact O-N 3.2Å
140	G	89.6	Confident	85	Confident	51 Å²	51	74.1 Å²	74.1	53%	0.526	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-34.6	-179.9	0	0	0	0	0	114.3	K138 F144	K138-G140 PolarHBondContact O-N 2.76Å; G140-F144 WeakPolarHBondContact O-CB 3.25Å; G140-F144 PolarHBondContact O-N 3.47Å
141	A	89.4	Confident	85.2	Confident	14 Å²	14	74.9 Å²	74.9	12%	0.116	39%	0.39	C	S	.	.	H	α-helix	trans	-70.7	-40	176.2	0	0	0	0	0	111.5	F135 W136 K138 E139 L145	F135-A141 HydrophobicContact CD1-CB 4.36Å; F135-A141 HydrophobicContact CE1-CB 3.79Å; F135-A141 HydrophobicContact CE2-CB 4.43Å; F135-A141 HydrophobicContact CZ-CB 3.85Å; W136-A141 HydrophobicContact CE3-CB 4.17Å; W136-A141 HydrophobicContact CZ3-CB 4.4Å; K138-A141 HydrophobicContact CB-CB 4.27Å; K138-A141 PolarHBondContact O-N 3.04Å; K138-A141 VanDerWaalsContact O-N 3.12Å; E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 2.96Å; A141-L145 WeakPolarHBondContact O-CB 3.28Å; A141-L145 PolarHBondContact O-N 3.26Å; A141-L145 VanDerWaalsContact O-N 3.13Å
142	A	88	Confident	85.3	Confident	9 Å²	9	73.8 Å²	73.8	7%	0.074	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-40.7	176.4	0	0	0	0	0	112.1	K138 E139 L145 R146 P154	K138-A142 PolarHBondContact O-N 3.35Å; E139-A142 PolarHBondContact O-N 3.42Å; A142-L145 PolarHBondContact O-N 3.26Å; A142-R146 VanDerWaalsContact O-CG 3.3Å; A142-R146 WeakPolarHBondContact O-CG 3.48Å; A142-R146 PolarHBondContact O-N 2.65Å; A142-P154 HydrophobicContact CB-CG 4Å
143	E	86.9	Confident	85.7	Confident	132 Å²	132	77.8 Å²	77.8	62%	0.617	41%	0.412	S	S	*	.	H	α-helix	trans	-63.8	-47.8	176.1	-172.8	178.6	-172.5	0	0	111.5	E139 L145 R146 L147	E139-E143 WeakPolarHBondContact O-CB 3.26Å; E139-E143 PolarHBondContact O-N 3.2Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 3.47Å; E143-R146 PolarHBondContact O-N 3.45Å; E143-L147 WeakPolarHBondContact O-CB 3.46Å; E143-L147 PolarHBondContact O-N 3.41Å
144	F	90.4	Very high	86	Confident	139 Å²	139	77.7 Å²	77.7	61%	0.61	41%	0.413	S	S	*	.	H	α-helix	trans	-53.7	-47.3	175	172.1	-98.9	0	0	0	111.9	G140 L147 A148	G140-F144 WeakPolarHBondContact O-CB 3.25Å; G140-F144 PolarHBondContact O-N 3.47Å; F144-L147 PolarHBondContact O-N 3.1Å; F144-A148 WeakPolarHBondContact O-CB 3.47Å; F144-A148 PolarHBondContact O-N 3.27Å
145	L	88.3	Confident	86.2	Confident	4 Å²	4	75 Å²	75	2%	0.021	40%	0.4	C	S	.	.	H	α-helix	trans	-69.3	-38.7	-176.9	-169.5	65.7	0	0	0	112.6	W136 A141 A142 E143 L147 A148 F149 F152 P154	W136-L145 HydrophobicContact CD2-CD2 4.26Å; W136-L145 HydrophobicContact CE3-CB 4.3Å; W136-L145 HydrophobicContact CE3-CD2 3.73Å; W136-L145 HydrophobicContact CH2-CD1 4.22Å; W136-L145 HydrophobicContact CH2-CD2 4.34Å; W136-L145 HydrophobicContact CZ3-CB 3.88Å; W136-L145 HydrophobicContact CZ3-CD1 4.16Å; W136-L145 HydrophobicContact CZ3-CD2 3.79Å; W136-L145 HydrophobicContact CZ3-CG 4.18Å; A141-L145 WeakPolarHBondContact O-CB 3.28Å; A141-L145 PolarHBondContact O-N 3.26Å; A141-L145 VanDerWaalsContact O-N 3.13Å; A142-L145 PolarHBondContact O-N 3.26Å; E143-L145 VanDerWaalsContact C-N 3.3Å; E143-L145 PolarHBondContact O-N 3.47Å; L145-L147 VanDerWaalsContact C-N 3.31Å; L145-A148 PolarHBondContact O-N 3.15Å; L145-F149 HydrophobicContact CD1-CD2 3.91Å; L145-F149 HydrophobicContact CD1-CE2 4.46Å; L145-F149 PolarHBondContact O-N 3.41Å; L145-F152 HydrophobicContact CD1-CD1 4.33Å; L145-F152 HydrophobicContact CD2-CD1 3.89Å; L145-F152 HydrophobicContact CD2-CE1 3.86Å; L145-F152 HydrophobicContact CG-CD1 4.09Å; L145-F152 HydrophobicContact CG-CE1 4.49Å; L145-P154 HydrophobicContact CD2-CB 3.87Å; L145-P154 HydrophobicContact CD2-CG 4.05Å
146	R	84.6	Confident	86.4	Confident	153 Å²	153	78 Å²	78	58%	0.577	41%	0.414	S	S	*	.	H	α-helix	trans	-65.7	-34.4	174.4	-73.3	173.7	-175.9	152	0.5	112.1	A142 E143 F149 P150	A142-R146 VanDerWaalsContact O-CG 3.3Å; A142-R146 WeakPolarHBondContact O-CG 3.48Å; A142-R146 PolarHBondContact O-N 2.65Å; E143-R146 PolarHBondContact O-N 3.45Å; R146-F149 CarbonylContact O-C 3.58Å; R146-P150 WeakPolarHBondContact O-CA 3.33Å
147	L	86.6	Confident	86.2	Confident	144 Å²	144	78.7 Å²	78.7	75%	0.754	42%	0.419	S	S	*	.	H	α-helix	trans	-69.2	-45.3	175.1	-176	67.5	0	0	0	111.4	E143 F144 L145	E143-L147 WeakPolarHBondContact O-CB 3.46Å; E143-L147 PolarHBondContact O-N 3.41Å; F144-L147 PolarHBondContact O-N 3.1Å; L145-L147 VanDerWaalsContact C-N 3.31Å
148	A	86.2	Confident	86.3	Confident	48 Å²	48	75 Å²	75	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-69.7	-38.3	-179.5	0	0	0	0	0	112.8	F144 L145	F144-A148 WeakPolarHBondContact O-CB 3.47Å; F144-A148 PolarHBondContact O-N 3.27Å; L145-A148 PolarHBondContact O-N 3.15Å
149	F	85.4	Confident	86.4	Confident	95 Å²	95	72.4 Å²	72.4	42%	0.417	41%	0.406	S	S	.	.			trans	-135.3	80.7	-178.2	-57.2	-79.8	0	0	0	110.7	V118 L145 R146 A151 F152	V118-F149 HydrophobicContact CG1-CD2 3.99Å; V118-F149 HydrophobicContact CG1-CE2 4.19Å; V118-F149 HydrophobicContact CG1-CG 4.18Å; V118-F149 HydrophobicContact CG2-CD1 3.97Å; V118-F149 HydrophobicContact CG2-CE1 3.84Å; V118-F149 HydrophobicContact CG2-CG 4.39Å; V118-F149 HydrophobicContact CG2-CZ 4.16Å; L145-F149 HydrophobicContact CD1-CD2 3.91Å; L145-F149 HydrophobicContact CD1-CE2 4.46Å; L145-F149 PolarHBondContact O-N 3.41Å; R146-F149 CarbonylContact O-C 3.58Å; F149-A151 PolarHBondContact O-N 3.36Å; F149-F152 HydrophobicContact CB-CB 3.72Å; F149-F152 PolarHBondContact O-N 2.84Å
150	P	79.1	Confident	86.4	Confident	115 Å²	115	64.5 Å²	64.5	75%	0.747	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-25.7	-173.6	-27.1	35.3	0	0	0	115.4	R146	R146-P150 WeakPolarHBondContact O-CA 3.33Å
151	A	76.8	Confident	86.3	Confident	61 Å²	61	66.7 Å²	66.7	50%	0.504	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.6	177.3	0	0	0	0	0	113.9	P110 L115 F149	P110-A151 HydrophobicContact CG-CB 4.24Å; L115-A151 HydrophobicContact CD2-CB 4.46Å; F149-A151 PolarHBondContact O-N 3.36Å
152	F	81.8	Confident	86.4	Confident	14 Å²	14	69.6 Å²	69.6	6%	0.061	38%	0.383	C	S	.	.			trans	-107.4	127.4	-177.4	-173.7	-110	0	0	0	110.8	L115 V118 Q119 L145 F149	L115-F152 HydrophobicContact CB-CD2 4.25Å; L115-F152 HydrophobicContact CD2-CB 3.86Å; L115-F152 HydrophobicContact CD2-CD2 3.97Å; L115-F152 HydrophobicContact CD2-CG 4.39Å; L115-F152 WeakPolarHBondContact O-CE2 3.18Å; V118-F152 HydrophobicContact CB-CD2 4.46Å; V118-F152 HydrophobicContact CB-CG 4.49Å; V118-F152 HydrophobicContact CG1-CD1 3.57Å; V118-F152 HydrophobicContact CG1-CD2 4.29Å; V118-F152 HydrophobicContact CG1-CE1 3.71Å; V118-F152 HydrophobicContact CG1-CE2 4.43Å; V118-F152 HydrophobicContact CG1-CG 3.89Å; V118-F152 HydrophobicContact CG1-CZ 4.18Å; Q119-F152 HydrophobicContact CB-CE2 3.83Å; Q119-F152 HydrophobicContact CB-CZ 3.66Å; Q119-F152 HydrophobicContact CG-CZ 4.18Å; L145-F152 HydrophobicContact CD1-CD1 4.33Å; L145-F152 HydrophobicContact CD2-CD1 3.89Å; L145-F152 HydrophobicContact CD2-CE1 3.86Å; L145-F152 HydrophobicContact CG-CD1 4.09Å; L145-F152 HydrophobicContact CG-CE1 4.49Å; F149-F152 HydrophobicContact CB-CB 3.72Å; F149-F152 PolarHBondContact O-N 2.84Å
153	S	85	Confident	86.5	Confident	96 Å²	96	71.6 Å²	71.6	67%	0.671	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-86.9	138.3	171.9	-69.3	0	0	0	0	110.1
154	P	87.7	Confident	86.5	Confident	28 Å²	28	65.3 Å²	65.3	18%	0.182	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-53.2	139.1	175.7	-23.3	30.5	0	0	0	112.3	W136 A142 L145 H156	W136-P154 HydrophobicContact CB-CB 4.13Å; A142-P154 HydrophobicContact CB-CG 4Å; L145-P154 HydrophobicContact CD2-CB 3.87Å; L145-P154 HydrophobicContact CD2-CG 4.05Å; P154-H156 PolarHBondContact O-N 3.06Å
155	P	88.8	Confident	86.5	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.032	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66.6	133	-174.8	27.6	-35	0	0	0	110.7	Q119 C122 W136 I159 V160	Q119-P155 HydrophobicContact CG-CB 4.46Å; C122-P155 HydrophobicContact CB-CG 3.97Å; W136-P155 HydrophobicContact CB-CG 4.14Å; W136-P155 HydrophobicContact CD2-CG 4.36Å; W136-P155 HydrophobicContact CG-CG 3.69Å; P155-I159 HydrophobicContact CB-CG2 4.47Å; P155-V160 HydrophobicContact CB-CG2 4.08Å; P155-V160 HydrophobicContact CG-CG2 4.17Å
156	H	88.9	Confident	86.7	Confident	102 Å²	102	65 Å²	65	47%	0.472	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-66.3	146.1	174.3	-170.2	-97.6	0	0	0	110.1	P154 A158 I159 V160	P154-H156 PolarHBondContact O-N 3.06Å; H156-A158 WeakPolarHBondContact ND1-CB 3.04Å; H156-A158 PolarHBondContact ND1-N 3.24Å; H156-A158 PolarHBondContact O-N 2.95Å; H156-I159 HydrophobicContact CB-CD1 4.25Å; H156-I159 HydrophobicContact CB-CG1 4.31Å; H156-I159 WeakPolarHBondContact O-CA 3.36Å; H156-I159 VanDerWaalsContact O-CB 3.31Å; H156-I159 WeakPolarHBondContact O-CB 3.33Å; H156-I159 PolarHBondContact O-N 3.28Å; H156-V160 PolarHBondContact O-N 3.44Å; H156-V160 VanDerWaalsContact O-N 3.17Å
157	P	85.6	Confident	86.9	Confident	25 Å²	25	59.1 Å²	59.1	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-55	-28.9	179.6	-29.4	36.6	0	0	0	114.6	N134 K137 I159 V160 K161	N134-P157 HydrophobicContact CB-CG 4.22Å; K137-P157 HydrophobicContact CD-CG 3.92Å; K137-P157 HydrophobicContact CG-CG 4.08Å; P157-I159 VanDerWaalsContact C-N 3.34Å; P157-V160 PolarHBondContact O-N 2.96Å; P157-K161 WeakPolarHBondContact O-CB 3.16Å; P157-K161 PolarHBondContact O-N 2.62Å
158	A	87.8	Confident	87	Confident	61 Å²	61	53.4 Å²	53.4	50%	0.504	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-36.3	173.9	0	0	0	0	0	112.7	H156 S162	H156-A158 WeakPolarHBondContact ND1-CB 3.04Å; H156-A158 PolarHBondContact ND1-N 3.24Å; H156-A158 PolarHBondContact O-N 2.95Å; A158-S162 WeakPolarHBondContact O-CB 3.33Å; A158-S162 PolarHBondContact O-N 2.91Å
159	I	89.8	Confident	87.3	Confident	58 Å²	58	54.7 Å²	54.7	30%	0.297	33%	0.325	S	S	.	.	H	α-helix	trans	-67	-49.4	174.4	-62.1	175	0	0	0	108.9	Q119 P155 H156 P157 K161 S162 H163	Q119-I159 HydrophobicContact CG-CG2 4.12Å; Q119-I159 VanDerWaalsContact NE2-CG2 3.31Å; P155-I159 HydrophobicContact CB-CG2 4.47Å; H156-I159 HydrophobicContact CB-CD1 4.25Å; H156-I159 HydrophobicContact CB-CG1 4.31Å; H156-I159 WeakPolarHBondContact O-CA 3.36Å; H156-I159 VanDerWaalsContact O-CB 3.31Å; H156-I159 WeakPolarHBondContact O-CB 3.33Å; H156-I159 PolarHBondContact O-N 3.28Å; P157-I159 VanDerWaalsContact C-N 3.34Å; I159-K161 VanDerWaalsContact C-N 3.28Å; I159-K161 PolarHBondContact O-N 3.37Å; I159-S162 WeakPolarHBondContact O-CB 3.38Å; I159-S162 PolarHBondContact O-N 3.24Å; I159-S162 VanDerWaalsContact O-N 3.09Å; I159-H163 PolarHBondContact O-CD2 3.2Å; I159-H163 VanDerWaalsContact O-CD2 3.29Å; I159-H163 PolarHBondContact O-N 2.91Å
160	V	88.6	Confident	87.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.1	-43.2	177.4	-174.1	0	0	0	0	110.9	V126 F127 L133 P155 H156 P157 H163 L164	V126-V160 HydrophobicContact CB-CG1 4.22Å; V126-V160 HydrophobicContact CG1-CG1 3.91Å; V126-V160 HydrophobicContact CG2-CG1 4.44Å; F127-V160 HydrophobicContact CE1-CG1 3.82Å; F127-V160 HydrophobicContact CZ-CG1 4.28Å; F127-V160 WeakPolarHBondContact CZ-O 3.35Å; L133-V160 HydrophobicContact CD2-CG1 3.83Å; P155-V160 HydrophobicContact CB-CG2 4.08Å; P155-V160 HydrophobicContact CG-CG2 4.17Å; H156-V160 PolarHBondContact O-N 3.44Å; H156-V160 VanDerWaalsContact O-N 3.17Å; P157-V160 PolarHBondContact O-N 2.96Å; V160-H163 PolarHBondContact O-N 2.82Å; V160-L164 PolarHBondContact O-N 3.4Å
161	K	87.3	Confident	88.2	Confident	97 Å²	97	49.8 Å²	49.8	42%	0.422	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-42.4	175.1	-173.3	-178.9	179.7	-175.8	0	112.6	L133 P157 I159 L164 I165	L133-K161 HydrophobicContact CD1-CB 4.48Å; P157-K161 WeakPolarHBondContact O-CB 3.16Å; P157-K161 PolarHBondContact O-N 2.62Å; I159-K161 VanDerWaalsContact C-N 3.28Å; I159-K161 PolarHBondContact O-N 3.37Å; K161-L164 WeakPolarHBondContact O-CB 3.43Å; K161-L164 PolarHBondContact O-N 3.4Å; K161-I165 HydrophobicContact CG-CD1 4.21Å; K161-I165 WeakPolarHBondContact O-CG1 3.38Å; K161-I165 PolarHBondContact O-N 2.84Å
162	S	89.9	Confident	88.9	Confident	75 Å²	75	49.7 Å²	49.7	52%	0.524	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-43.5	176.7	-176.3	0	0	0	0	111.7	A158 I159 L164 I165 S166	A158-S162 WeakPolarHBondContact O-CB 3.33Å; A158-S162 PolarHBondContact O-N 2.91Å; I159-S162 WeakPolarHBondContact O-CB 3.38Å; I159-S162 PolarHBondContact O-N 3.24Å; I159-S162 VanDerWaalsContact O-N 3.09Å; S162-L164 VanDerWaalsContact C-N 3.3Å; S162-L164 PolarHBondContact O-N 2.84Å; S162-I165 PolarHBondContact O-N 2.66Å; S162-S166 PolarHBondContact O-N 2.74Å
163	H	90.4	Very high	89.4	Confident	51 Å²	51	56.8 Å²	56.8	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-39.3	173.8	-85.8	-96.5	0	0	0	112.2	Q119 D120 C123 F127 I159 V160 S166 A167	Q119-H163 PolarHBondContact NE2-NE2 2.81Å; Q119-H163 VanDerWaalsContact NE2-NE2 3.19Å; D120-H163 IonicContact OD1-CE1 3.17Å; D120-H163 PolarHBondContact OD1-CE1 2.84Å; D120-H163 IonicContact OD1-ND1 2.94Å; C123-H163 HydrophobicContact CB-CB 3.87Å; F127-H163 HydrophobicContact CE2-CB 4.17Å; F127-H163 HydrophobicContact CZ-CB 3.94Å; I159-H163 PolarHBondContact O-CD2 3.2Å; I159-H163 VanDerWaalsContact O-CD2 3.29Å; I159-H163 PolarHBondContact O-N 2.91Å; V160-H163 PolarHBondContact O-N 2.82Å; H163-S166 PolarHBondContact O-N 3.39Å; H163-A167 WeakPolarHBondContact O-CB 3.3Å; H163-A167 PolarHBondContact O-N 2.7Å
164	L	88.2	Confident	89.7	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-49	176.6	175.2	61.9	0	0	0	111.6	F127 L133 V160 K161 S162 S166 A167 Y168 M730 M731 V734	F127-L164 HydrophobicContact CD1-CD1 4.29Å; F127-L164 HydrophobicContact CE1-CB 3.79Å; F127-L164 HydrophobicContact CE1-CD1 4.16Å; F127-L164 HydrophobicContact CE1-CG 4.49Å; F127-L164 HydrophobicContact CE2-CB 4.49Å; F127-L164 HydrophobicContact CZ-CB 3.68Å; F127-L164 HydrophobicContact CZ-CD1 4.43Å; L133-L164 HydrophobicContact CD2-CD2 4.27Å; V160-L164 PolarHBondContact O-N 3.4Å; K161-L164 WeakPolarHBondContact O-CB 3.43Å; K161-L164 PolarHBondContact O-N 3.4Å; S162-L164 VanDerWaalsContact C-N 3.3Å; S162-L164 PolarHBondContact O-N 2.84Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.91Å; L164-A167 PolarHBondContact O-N 3.32Å; L164-Y168 WeakPolarHBondContact O-CB 3.35Å; L164-Y168 PolarHBondContact O-N 2.95Å; L164-M730 HydrophobicContact CD1-CB 4.15Å; L164-M730 HydrophobicContact CD2-CB 4.02Å; L164-M730 HydrophobicContact CG-CB 3.91Å; L164-M731 HydrophobicContact CD1-CG 3.99Å; L164-M731 HydrophobicContact CD1-SD 3.52Å; L164-M731 VanDerWaalsContact CD1-SD 3.52Å; L164-M731 HydrophobicContact CD2-CG 3.57Å; L164-M731 HydrophobicContact CD2-SD 3.75Å; L164-M731 HydrophobicContact CG-CG 4.41Å; L164-M731 HydrophobicContact CG-SD 4.19Å; L164-V734 HydrophobicContact CD1-CB 4.25Å; L164-V734 HydrophobicContact CD1-CG2 4.02Å
165	I	89.7	Confident	89.9	Confident	63 Å²	63	56.2 Å²	56.2	32%	0.323	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-42.9	178.1	-66.8	163.5	0	0	0	110.4	K161 S162 Y168 N169 M730	K161-I165 HydrophobicContact CG-CD1 4.21Å; K161-I165 WeakPolarHBondContact O-CG1 3.38Å; K161-I165 PolarHBondContact O-N 2.84Å; S162-I165 PolarHBondContact O-N 2.66Å; I165-Y168 PolarHBondContact O-N 2.71Å; I165-N169 WeakPolarHBondContact O-CB 3.24Å; I165-N169 VanDerWaalsContact O-CG 3.28Å; I165-N169 PolarHBondContact O-N 3.19Å; I165-N169 PolarHBondContact O-ND2 3.5Å; I165-M730 HydrophobicContact CB-SD 4.48Å; I165-M730 HydrophobicContact CG1-CE 4.3Å; I165-M730 HydrophobicContact CG1-SD 3.7Å
166	S	91.7	Very high	90.1	Very high	73 Å²	73	59 Å²	59	51%	0.51	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-44.3	177.3	-171.9	0	0	0	0	112.2	S162 H163 L164 Q170	S162-S166 PolarHBondContact O-N 2.74Å; H163-S166 PolarHBondContact O-N 3.39Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.91Å; S166-Q170 WeakPolarHBondContact O-CB 3.48Å; S166-Q170 PolarHBondContact O-N 3.47Å
167	A	89.5	Confident	90.2	Very high	30 Å²	30	58.5 Å²	58.5	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-64.7	-42.6	177.9	0	0	0	0	0	111.5	H163 L164 Q170 G171 V734	H163-A167 WeakPolarHBondContact O-CB 3.3Å; H163-A167 PolarHBondContact O-N 2.7Å; L164-A167 PolarHBondContact O-N 3.32Å; A167-Q170 PolarHBondContact O-N 3.17Å; A167-G171 PolarHBondContact O-N 2.88Å; A167-V734 HydrophobicContact CB-CG1 3.98Å; A167-V734 HydrophobicContact CB-CG2 3.91Å
168	Y	89.4	Confident	90.5	Very high	24 Å²	24	59.8 Å²	59.8	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-59	-51.9	175.3	173.9	-96.4	0	0	0	111.7	L164 I165 Q170 G171 R172 M730 F733	L164-Y168 WeakPolarHBondContact O-CB 3.35Å; L164-Y168 PolarHBondContact O-N 2.95Å; I165-Y168 PolarHBondContact O-N 2.71Å; Y168-Q170 VanDerWaalsContact C-N 3.26Å; Y168-Q170 PolarHBondContact O-N 2.83Å; Y168-G171 PolarHBondContact O-N 3.29Å; Y168-R172 VanDerWaalsContact O-CB 3.25Å; Y168-R172 WeakPolarHBondContact O-CB 3.27Å; Y168-R172 PolarHBondContact O-N 3.02Å; Y168-R172 PolarHBondContact OH-NH1 3.43Å; Y168-R172 VanDerWaalsContact OH-NH1 3.09Å; Y168-M730 HydrophobicContact CD1-CE 4.17Å; Y168-M730 HydrophobicContact CD1-CG 4.07Å; Y168-M730 HydrophobicContact CD2-CB 4.02Å; Y168-M730 HydrophobicContact CD2-CG 3.84Å; Y168-M730 HydrophobicContact CE1-CE 4.44Å; Y168-M730 HydrophobicContact CE2-CG 4.3Å; Y168-M730 HydrophobicContact CG-CB 4.11Å; Y168-M730 HydrophobicContact CG-CG 3.72Å; Y168-F733 HydrophobicContact CD2-CB 3.74Å; Y168-F733 AromaticContact CD2-CD1 3.42Å; Y168-F733 HydrophobicContact CD2-CD1 3.42Å; Y168-F733 VanDerWaalsContact CD2-CD1 3.42Å; Y168-F733 HydrophobicContact CD2-CD2 4.49Å; Y168-F733 HydrophobicContact CD2-CE1 4.19Å; Y168-F733 AromaticContact CD2-CG 3.62Å; Y168-F733 HydrophobicContact CD2-CG 3.62Å; Y168-F733 HydrophobicContact CE2-CB 3.78Å; Y168-F733 AromaticContact CE2-CD1 3.8Å; Y168-F733 HydrophobicContact CE2-CD1 3.8Å; Y168-F733 HydrophobicContact CE2-CD2 4.05Å; Y168-F733 HydrophobicContact CE2-CE1 4.46Å; Y168-F733 AromaticContact CE2-CG 3.58Å; Y168-F733 HydrophobicContact CE2-CG 3.58Å; Y168-F733 HydrophobicContact CG-CD1 4.36Å
169	N	92.2	Very high	90.8	Very high	75 Å²	75	57 Å²	57	40%	0.401	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-32.6	179.6	-71.8	-24.1	0	0	0	112.6	I165 R173	I165-N169 WeakPolarHBondContact O-CB 3.24Å; I165-N169 VanDerWaalsContact O-CG 3.28Å; I165-N169 PolarHBondContact O-N 3.19Å; I165-N169 PolarHBondContact O-ND2 3.5Å; N169-R173 WeakPolarHBondContact O-CG 3.46Å; N169-R173 PolarHBondContact O-N 3.49Å; N169-R173 PolarHBondContact O-NE 3.05Å
170	Q	92	Very high	90.8	Very high	98 Å²	98	57 Å²	57	46%	0.458	30%	0.302	S	S	.	.	H	α-helix	trans	-69	-55.9	174.3	177.4	169.1	-1.8	0	0	111.3	S166 A167 Y168 R172 R173 E174	S166-Q170 WeakPolarHBondContact O-CB 3.48Å; S166-Q170 PolarHBondContact O-N 3.47Å; A167-Q170 PolarHBondContact O-N 3.17Å; Y168-Q170 VanDerWaalsContact C-N 3.26Å; Y168-Q170 PolarHBondContact O-N 2.83Å; Q170-R172 PolarHBondContact O-N 3.22Å; Q170-R173 PolarHBondContact O-N 3.23Å; Q170-E174 VanDerWaalsContact CG-OE1 3.23Å; Q170-E174 WeakPolarHBondContact CG-OE1 3.35Å; Q170-E174 PolarHBondContact NE2-OE1 3.39Å; Q170-E174 PolarHBondContact O-N 2.99Å; Q170-E174 VanDerWaalsContact O-N 3.08Å
171	G	91.2	Very high	90.7	Very high	9 Å²	9	61.2 Å²	61.2	9%	0.093	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-34.3	-179.6	0	0	0	0	0	112.5	A167 Y168 R173 E174 L175	A167-G171 PolarHBondContact O-N 2.88Å; Y168-G171 PolarHBondContact O-N 3.29Å; G171-R173 PolarHBondContact O-N 3.29Å; G171-E174 PolarHBondContact O-N 3.31Å; G171-L175 WeakPolarHBondContact O-CB 3.29Å; G171-L175 PolarHBondContact O-N 2.92Å
172	R	91.5	Very high	90.7	Very high	58 Å²	58	56.8 Å²	56.8	22%	0.219	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-39.4	175.1	-174.6	173.3	169.5	154	0.7	112.6	Y168 Q170 I176 F244 F733	Y168-R172 VanDerWaalsContact O-CB 3.25Å; Y168-R172 WeakPolarHBondContact O-CB 3.27Å; Y168-R172 PolarHBondContact O-N 3.02Å; Y168-R172 PolarHBondContact OH-NH1 3.43Å; Y168-R172 VanDerWaalsContact OH-NH1 3.09Å; Q170-R172 PolarHBondContact O-N 3.22Å; R172-I176 HydrophobicContact CG-CD1 4.21Å; R172-I176 WeakPolarHBondContact O-CD1 3.38Å; R172-I176 VanDerWaalsContact O-CG1 3.26Å; R172-I176 WeakPolarHBondContact O-CG1 3.46Å; R172-I176 PolarHBondContact O-N 2.96Å; R172-F244 HydrophobicContact CG-CE1 4.35Å; R172-F244 HydrophobicContact CG-CZ 4.26Å; R172-F733 HydrophobicContact CB-CE1 4.25Å; R172-F733 HydrophobicContact CB-CZ 3.98Å
173	R	92	Very high	90.5	Very high	163 Å²	163	56.9 Å²	56.9	62%	0.615	31%	0.307	S	S	*	.	H	α-helix	trans	-66.9	-46.5	174.9	-74.7	-177.5	-65.3	-169.7	4.2	111.6	N169 Q170 G171 L175 I176 D177	N169-R173 WeakPolarHBondContact O-CG 3.46Å; N169-R173 PolarHBondContact O-N 3.49Å; N169-R173 PolarHBondContact O-NE 3.05Å; Q170-R173 PolarHBondContact O-N 3.23Å; G171-R173 PolarHBondContact O-N 3.29Å; R173-L175 VanDerWaalsContact C-N 3.25Å; R173-L175 PolarHBondContact O-N 3.39Å; R173-I176 PolarHBondContact O-N 2.99Å; R173-I176 VanDerWaalsContact O-N 3.16Å; R173-D177 PolarHBondContact O-N 2.99Å
174	E	91.7	Very high	90.5	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-59.6	-37.5	177.7	-68.1	169.9	-172.1	0	0	111.9	Q170 G171 S178	Q170-E174 VanDerWaalsContact CG-OE1 3.23Å; Q170-E174 WeakPolarHBondContact CG-OE1 3.35Å; Q170-E174 PolarHBondContact NE2-OE1 3.39Å; Q170-E174 PolarHBondContact O-N 2.99Å; Q170-E174 VanDerWaalsContact O-N 3.08Å; G171-E174 PolarHBondContact O-N 3.31Å; E174-S178 WeakPolarHBondContact O-CB 3.22Å; E174-S178 PolarHBondContact O-N 3.22Å; E174-S178 PolarHBondContact O-OG 2.7Å
175	L	91.8	Very high	90.7	Very high	10 Å²	10	57.7 Å²	57.7	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-67.8	-45.2	174.7	-176.6	57.1	0	0	0	112.1	G171 R173 D177 S178 L179 V205 Y207 R217 L219 F244 F733	G171-L175 WeakPolarHBondContact O-CB 3.29Å; G171-L175 PolarHBondContact O-N 2.92Å; R173-L175 VanDerWaalsContact C-N 3.25Å; R173-L175 PolarHBondContact O-N 3.39Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 2.83Å; L175-S178 PolarHBondContact O-N 3.23Å; L175-L179 HydrophobicContact CD1-CD1 3.93Å; L175-L179 HydrophobicContact CD1-CD2 4.49Å; L175-L179 HydrophobicContact CD1-CG 3.98Å; L175-L179 HydrophobicContact CG-CD1 3.81Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CB 3.3Å; L175-L179 VanDerWaalsContact O-CG 3.22Å; L175-L179 WeakPolarHBondContact O-CG 3.49Å; L175-L179 PolarHBondContact O-N 3.42Å; L175-V205 HydrophobicContact CD1-CG1 4.38Å; L175-Y207 HydrophobicContact CD1-CE1 4.04Å; L175-R217 HydrophobicContact CD1-CB 3.83Å; L175-R217 HydrophobicContact CD1-CG 4.05Å; L175-R217 HydrophobicContact CD2-CB 4.18Å; L175-L219 HydrophobicContact CD2-CD2 3.99Å; L175-F244 HydrophobicContact CD2-CE1 4.13Å; L175-F244 HydrophobicContact CG-CE1 4.36Å; L175-F733 HydrophobicContact CD2-CE2 3.87Å; L175-F733 HydrophobicContact CD2-CZ 4.11Å
176	I	92.8	Very high	90.9	Very high	63 Å²	63	54.7 Å²	54.7	32%	0.323	29%	0.292	S	S	.	.	H	α-helix	trans	-58	-46.5	175.7	-71.5	164.6	0	0	0	110.6	R172 R173 S178 L179 A180 F244	R172-I176 HydrophobicContact CG-CD1 4.21Å; R172-I176 WeakPolarHBondContact O-CD1 3.38Å; R172-I176 VanDerWaalsContact O-CG1 3.26Å; R172-I176 WeakPolarHBondContact O-CG1 3.46Å; R172-I176 PolarHBondContact O-N 2.96Å; R173-I176 PolarHBondContact O-N 2.99Å; R173-I176 VanDerWaalsContact O-N 3.16Å; I176-S178 VanDerWaalsContact C-N 3.31Å; I176-S178 PolarHBondContact O-N 3.02Å; I176-L179 PolarHBondContact O-N 3.39Å; I176-A180 PolarHBondContact O-N 3.44Å; I176-F244 HydrophobicContact CD1-CE1 4.45Å; I176-F244 HydrophobicContact CG1-CD1 3.66Å; I176-F244 HydrophobicContact CG1-CE1 3.8Å
177	D	92	Very high	90.9	Very high	92 Å²	92	51.2 Å²	51.2	49%	0.492	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-40.4	178.6	-68	-20.4	0	0	0	111.5	R173 L175 A180	R173-D177 PolarHBondContact O-N 2.99Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 2.83Å; D177-A180 PolarHBondContact O-N 2.76Å
178	S	91.7	Very high	91	Very high	51 Å²	51	49.8 Å²	49.8	36%	0.357	26%	0.256	S	S	.	.	H	α-helix	trans	-66.3	-41.8	176.7	-60.4	0	0	0	0	112.5	E174 L175 I176 A180 V181 A182 Y207	E174-S178 WeakPolarHBondContact O-CB 3.22Å; E174-S178 PolarHBondContact O-N 3.22Å; E174-S178 PolarHBondContact O-OG 2.7Å; L175-S178 PolarHBondContact O-N 3.23Å; I176-S178 VanDerWaalsContact C-N 3.31Å; I176-S178 PolarHBondContact O-N 3.02Å; S178-A180 VanDerWaalsContact C-N 3.33Å; S178-V181 PolarHBondContact O-N 2.67Å; S178-A182 PolarHBondContact O-N 3.04Å; S178-Y207 WeakPolarHBondContact CB-OH 3.32Å
179	L	93.1	Very high	91.1	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-73.2	-24.6	179.5	-67.6	172.8	0	0	0	112.7	L175 I176 V181 A182 V185 V205 Y207 L219 F244 L246 K249	L175-L179 HydrophobicContact CD1-CD1 3.93Å; L175-L179 HydrophobicContact CD1-CD2 4.49Å; L175-L179 HydrophobicContact CD1-CG 3.98Å; L175-L179 HydrophobicContact CG-CD1 3.81Å; L175-L179 HydrophobicContact CG-CG 4.3Å; L175-L179 WeakPolarHBondContact O-CB 3.3Å; L175-L179 VanDerWaalsContact O-CG 3.22Å; L175-L179 WeakPolarHBondContact O-CG 3.49Å; L175-L179 PolarHBondContact O-N 3.42Å; I176-L179 PolarHBondContact O-N 3.39Å; L179-V181 VanDerWaalsContact C-N 3.28Å; L179-V181 PolarHBondContact O-N 3.21Å; L179-A182 PolarHBondContact O-N 3.39Å; L179-V185 HydrophobicContact CD2-CG1 4.1Å; L179-V205 HydrophobicContact CD1-CG1 4.3Å; L179-V205 HydrophobicContact CD2-CG1 4.06Å; L179-V205 HydrophobicContact CD2-CG2 3.76Å; L179-Y207 HydrophobicContact CD2-CD1 3.57Å; L179-Y207 HydrophobicContact CD2-CD2 4.34Å; L179-Y207 HydrophobicContact CD2-CE1 3.81Å; L179-Y207 HydrophobicContact CD2-CG 3.87Å; L179-L219 HydrophobicContact CD1-CD2 3.77Å; L179-F244 HydrophobicContact CD1-CD1 3.9Å; L179-L246 HydrophobicContact CB-CD2 4.32Å; L179-L246 HydrophobicContact CD1-CD1 4.49Å; L179-L246 HydrophobicContact CD1-CD2 4.36Å; L179-K249 PolarHBondContact O-NZ 2.97Å
180	A	89.6	Confident	90.7	Very high	58 Å²	58	45.4 Å²	45.4	48%	0.479	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-38.3	173.6	0	0	0	0	0	111.6	I176 D177 S178 K249	I176-A180 PolarHBondContact O-N 3.44Å; D177-A180 PolarHBondContact O-N 2.76Å; S178-A180 VanDerWaalsContact C-N 3.33Å; A180-K249 PolarHBondContact O-NZ 3.28Å
181	V	87.2	Confident	90.4	Very high	88 Å²	88	41.4 Å²	41.4	53%	0.533	22%	0.215	S	C	.	.	H	α-helix	trans	-82.2	-25	179.2	-176.2	0	0	0	0	112.7	S178 L179 V183	S178-V181 PolarHBondContact O-N 2.67Å; L179-V181 VanDerWaalsContact C-N 3.28Å; L179-V181 PolarHBondContact O-N 3.21Å; V181-V183 PolarHBondContact O-N 3.22Å
182	A	87.4	Confident	89.6	Confident	5 Å²	5	41.6 Å²	41.6	4%	0.041	21%	0.213	C	C	.	.			trans	-60.5	131.5	180	0	0	0	0	0	111.9	S178 L179 V185 Y207 K249	S178-A182 PolarHBondContact O-N 3.04Å; L179-A182 PolarHBondContact O-N 3.39Å; A182-V185 HydrophobicContact CB-CG1 4.15Å; A182-Y207 HydrophobicContact CB-CD2 4.04Å; A182-Y207 HydrophobicContact CB-CG 4.4Å; A182-K249 PolarHBondContact O-NZ 3.39Å
183	V	85	Confident	88.5	Confident	76 Å²	76	40.2 Å²	40.2	46%	0.461	21%	0.211	S	C	.	.	S	Bend	trans	-71.1	-52.9	-179.7	-176.1	0	0	0	0	110.7	V181 F573	V181-V183 PolarHBondContact O-N 3.22Å; V183-F573 HydrophobicContact CG1-CE2 4.31Å
184	R	90	Very high	87.2	Confident	69 Å²	69	33 Å²	33	26%	0.26	19%	0.185	S	C	.	.			trans	-136.3	157.9	174	-55.2	-166.4	76.4	136.9	-4.6	109.9	K249 L694	R184-K249 WeakPolarHBondContact CA-O 3.35Å; R184-L694 HydrophobicContact CB-CD1 4.39Å; R184-L694 HydrophobicContact CB-CD2 4.29Å; R184-L694 HydrophobicContact CG-CD1 4.3Å
185	V	92.9	Very high	85.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	148.2	176.6	-52.2	0	0	0	0	110.2	L179 A182 V205 H206 L246 K249 V250 Q251	L179-V185 HydrophobicContact CD2-CG1 4.1Å; A182-V185 HydrophobicContact CB-CG1 4.15Å; V185-V205 HydrophobicContact CB-CG2 3.74Å; V185-V205 HydrophobicContact CG1-CG2 4.05Å; V185-V205 HydrophobicContact CG2-CG2 4.17Å; V185-H206 CarbonylContact C-O 3.51Å; V185-H206 WeakPolarHBondContact CA-O 3.43Å; V185-L246 HydrophobicContact CG1-CD2 4.3Å; V185-L246 HydrophobicContact CG2-CD2 4.17Å; V185-K249 HydrophobicContact CG2-CB 4.28Å; V185-K249 PolarHBondContact N-O 3.49Å; V185-V250 HydrophobicContact CG2-CG2 4.05Å; V185-V250 CarbonylContact O-C 3.29Å; V185-V250 WeakPolarHBondContact O-CA 3.41Å; V185-Q251 PolarHBondContact O-N 3.07Å
186	S	93.4	Very high	84	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	153.7	163.8	-52.8	0	0	0	0	108.8	H206 Q251 R252 I698	S186-H206 PolarHBondContact N-O 2.92Å; S186-H206 PolarHBondContact O-N 3.35Å; S186-Q251 VanDerWaalsContact OG-CG 3.3Å; S186-Q251 WeakPolarHBondContact OG-CG 3.28Å; S186-Q251 PolarHBondContact OG-NE2 3.02Å; S186-R252 CarbonylContact C-O 3.53Å; S186-R252 VanDerWaalsContact CA-O 3.32Å; S186-R252 WeakPolarHBondContact CA-O 3.44Å; S186-I698 WeakPolarHBondContact OG-CG1 3.3Å
187	L	93.5	Very high	82.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.4	176.9	-58.2	173.8	0	0	0	109.8	F189 T204 V205 L219 L241 L246 V250 R252 V253 T254	L187-F189 HydrophobicContact CB-CD1 4.31Å; L187-F189 HydrophobicContact CB-CE1 3.7Å; L187-F189 HydrophobicContact CB-CZ 4.36Å; L187-F189 HydrophobicContact CD1-CE1 3.84Å; L187-F189 HydrophobicContact CD1-CZ 3.95Å; L187-F189 HydrophobicContact CG-CE1 4.35Å; L187-T204 CarbonylContact C-O 3.39Å; L187-T204 VanDerWaalsContact CA-O 3.23Å; L187-T204 WeakPolarHBondContact CA-O 3.39Å; L187-V205 HydrophobicContact CD2-CB 3.89Å; L187-V205 HydrophobicContact CD2-CG2 3.9Å; L187-L219 HydrophobicContact CD2-CD1 3.81Å; L187-L241 HydrophobicContact CD1-CD2 3.47Å; L187-L241 VanDerWaalsContact CD1-CD2 3.47Å; L187-L246 HydrophobicContact CD2-CD1 4.46Å; L187-V250 HydrophobicContact CD1-CG1 4.08Å; L187-V250 HydrophobicContact CD1-CG2 3.65Å; L187-V250 HydrophobicContact CG-CG1 4.32Å; L187-V250 HydrophobicContact CG-CG2 4.2Å; L187-R252 PolarHBondContact N-O 3.25Å; L187-V253 HydrophobicContact CB-CG2 4.24Å; L187-V253 HydrophobicContact CD1-CG2 4.33Å; L187-V253 CarbonylContact O-C 3.6Å; L187-V253 WeakPolarHBondContact O-CA 3.27Å; L187-T254 PolarHBondContact O-N 3.35Å
188	S	91.5	Very high	81.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130	164.1	82.9	0	0	0	0	109.5	T204 H206 T254 S702 P704	S188-T204 PolarHBondContact N-O 3.39Å; S188-T204 PolarHBondContact O-N 2.78Å; S188-T204 WeakPolarHBondContact OG-CB 3.36Å; S188-H206 PolarHBondContact OG-NE2 3.37Å; S188-T254 CarbonylContact C-O 3.58Å; S188-T254 VanDerWaalsContact CA-O 3.23Å; S188-T254 WeakPolarHBondContact CA-O 3.17Å; S188-S702 WeakPolarHBondContact CB-O 3.49Å; S188-S702 PolarHBondContact OG-O 2.8Å; S188-P704 WeakPolarHBondContact OG-CD 3.34Å
189	F	91	Very high	81.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.2	179.6	-66	-8	0	0	0	109	L187 L201 A202 I203 I237 V253 T254 T255 I261 V265 S702	L187-F189 HydrophobicContact CB-CD1 4.31Å; L187-F189 HydrophobicContact CB-CE1 3.7Å; L187-F189 HydrophobicContact CB-CZ 4.36Å; L187-F189 HydrophobicContact CD1-CE1 3.84Å; L187-F189 HydrophobicContact CD1-CZ 3.95Å; L187-F189 HydrophobicContact CG-CE1 4.35Å; F189-L201 HydrophobicContact CB-CD1 4.08Å; F189-A202 WeakPolarHBondContact CA-O 3.42Å; F189-I203 HydrophobicContact CD1-CB 4.35Å; F189-I203 HydrophobicContact CD1-CG1 4.1Å; F189-I203 HydrophobicContact CD1-CG2 3.96Å; F189-I203 HydrophobicContact CE1-CB 4.45Å; F189-I203 HydrophobicContact CE1-CG1 4.27Å; F189-I203 HydrophobicContact CE1-CG2 3.65Å; F189-I237 HydrophobicContact CD2-CD1 3.97Å; F189-I237 HydrophobicContact CE1-CG2 4.49Å; F189-I237 HydrophobicContact CE2-CD1 3.69Å; F189-I237 HydrophobicContact CE2-CG1 4.12Å; F189-I237 HydrophobicContact CE2-CG2 3.77Å; F189-I237 HydrophobicContact CZ-CD1 4.45Å; F189-I237 HydrophobicContact CZ-CG1 4.42Å; F189-I237 HydrophobicContact CZ-CG2 3.54Å; F189-V253 HydrophobicContact CB-CG1 4.42Å; F189-V253 HydrophobicContact CD1-CG1 4.05Å; F189-V253 HydrophobicContact CD2-CG1 3.4Å; F189-V253 HydrophobicContact CE1-CG1 4.04Å; F189-V253 HydrophobicContact CE2-CB 4.48Å; F189-V253 HydrophobicContact CE2-CG1 3.43Å; F189-V253 VanDerWaalsContact CE2-CG1 3.43Å; F189-V253 HydrophobicContact CE2-CG2 4.26Å; F189-V253 HydrophobicContact CG-CG1 3.71Å; F189-V253 HydrophobicContact CZ-CG1 3.74Å; F189-V253 HydrophobicContact CZ-CG2 4.1Å; F189-T254 PolarHBondContact N-O 2.77Å; F189-T255 PolarHBondContact O-OG1 3.27Å; F189-I261 HydrophobicContact CB-CG1 4.49Å; F189-I261 HydrophobicContact CD2-CD1 4.26Å; F189-V265 HydrophobicContact CD2-CG2 3.69Å; F189-V265 HydrophobicContact CE2-CG2 3.77Å; F189-S702 VanDerWaalsContact O-CB 3.31Å; F189-S702 WeakPolarHBondContact O-CB 2.78Å
190	D	83.5	Confident	80.6	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.032	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	110	168.3	-164.8	44.9	0	0	0	110.4	W192 L201 A202 R338 M703	D190-W192 HydrophobicContact CB-CE3 4.21Å; D190-W192 HydrophobicContact CB-CZ3 3.97Å; D190-W192 VanDerWaalsContact O-CZ3 3.23Å; D190-W192 WeakPolarHBondContact O-CZ3 3.5Å; D190-W192 WeakPolarHBondContact OD2-CZ3 3.36Å; D190-L201 CarbonylContact O-C 3.55Å; D190-L201 VanDerWaalsContact O-CA 3.31Å; D190-L201 WeakPolarHBondContact O-CA 3.48Å; D190-A202 HydrophobicContact CB-CB 4.26Å; D190-A202 PolarHBondContact N-O 3.25Å; D190-A202 PolarHBondContact O-N 3.43Å; D190-R338 IonicContact OD2-CZ 3.96Å; D190-R338 IonicContact OD2-NH1 2.69Å; D190-R338 PolarHBondContact OD2-NH1 2.91Å; D190-M703 HydrophobicContact CB-CE 3.68Å; D190-M703 HydrophobicContact CB-CG 3.36Å; D190-M703 HydrophobicContact CB-SD 3.68Å; D190-M703 VanDerWaalsContact CG-CE 3.41Å; D190-M703 WeakPolarHBondContact OD1-CG 3.07Å; D190-M703 WeakPolarHBondContact OD2-CE 3.43Å; D190-M703 VanDerWaalsContact OD2-CG 3.26Å; D190-M703 WeakPolarHBondContact OD2-CG 3.33Å
191	Y	84.9	Confident	80.4	Confident	14 Å²	14	27 Å²	27	6%	0.055	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.6	175.3	-179.3	-104.9	0	0	0	109.4	S199 Y200 L201 L233 E258 R260 I261	Y191-S199 VanDerWaalsContact OH-CB 3.32Å; Y191-S199 WeakPolarHBondContact OH-CB 3.25Å; Y191-S199 PolarHBondContact OH-OG 2.91Å; Y191-Y200 WeakPolarHBondContact CA-O 3.35Å; Y191-Y200 VanDerWaalsContact CD2-O 3.27Å; Y191-Y200 WeakPolarHBondContact CD2-O 3.24Å; Y191-L201 HydrophobicContact CD2-CB 4.19Å; Y191-L201 HydrophobicContact CD2-CD1 4.44Å; Y191-L233 HydrophobicContact CD2-CD1 4.42Å; Y191-L233 HydrophobicContact CD2-CD2 4.05Å; Y191-L233 HydrophobicContact CE1-CD1 4.4Å; Y191-L233 HydrophobicContact CE2-CD1 4.06Å; Y191-L233 HydrophobicContact CE2-CD2 3.62Å; Y191-L233 HydrophobicContact CE2-CG 4.49Å; Y191-E258 HydrophobicContact CD1-CG 4.28Å; Y191-E258 WeakPolarHBondContact CD1-OE2 3.32Å; Y191-E258 HydrophobicContact CE1-CG 4.45Å; Y191-E258 WeakPolarHBondContact CE1-OE1 3.26Å; Y191-E258 WeakPolarHBondContact CE1-OE2 3.26Å; Y191-R260 PolarHBondContact OH-NH1 3.19Å; Y191-R260 PolarHBondContact OH-NH2 3.42Å; Y191-I261 HydrophobicContact CD1-CB 4.26Å; Y191-I261 HydrophobicContact CG-CB 4.24Å
192	W	75.8	Confident	80.4	Confident	13 Å²	13	22.9 Å²	22.9	5%	0.049	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	150.3	174.6	68.3	97.1	0	0	0	111.5	D190 S199 Y200 A202 F221 R338 M703 S712	D190-W192 HydrophobicContact CB-CE3 4.21Å; D190-W192 HydrophobicContact CB-CZ3 3.97Å; D190-W192 VanDerWaalsContact O-CZ3 3.23Å; D190-W192 WeakPolarHBondContact O-CZ3 3.5Å; D190-W192 WeakPolarHBondContact OD2-CZ3 3.36Å; W192-S199 CarbonylContact O-C 3.31Å; W192-S199 VanDerWaalsContact O-CA 3.22Å; W192-S199 WeakPolarHBondContact O-CA 3.24Å; W192-S199 WeakPolarHBondContact O-CB 3.49Å; W192-Y200 HydrophobicContact CZ2-CD2 4.33Å; W192-Y200 AromaticContact CZ2-CG 3.96Å; W192-Y200 HydrophobicContact CZ2-CG 3.96Å; W192-Y200 PolarHBondContact N-O 3.01Å; W192-Y200 AromaticContact NE1-CD2 3.6Å; W192-Y200 PolarHBondContact O-N 2.82Å; W192-A202 HydrophobicContact CH2-CB 4.27Å; W192-A202 HydrophobicContact CZ3-CB 4.05Å; W192-F221 HydrophobicContact CH2-CD2 4.28Å; W192-F221 AromaticContact CH2-CE2 3.42Å; W192-F221 HydrophobicContact CH2-CE2 3.42Å; W192-F221 VanDerWaalsContact CH2-CE2 3.42Å; W192-F221 AromaticContact CH2-CZ 3.85Å; W192-F221 HydrophobicContact CH2-CZ 3.85Å; W192-F221 AromaticContact CZ2-CE2 3.81Å; W192-F221 HydrophobicContact CZ2-CE2 3.81Å; W192-F221 AromaticContact CZ2-CZ 3.78Å; W192-F221 HydrophobicContact CZ2-CZ 3.78Å; W192-R338 HydrophobicContact CB-CB 4.29Å; W192-R338 HydrophobicContact CB-CG 4.14Å; W192-R338 HydrophobicContact CG-CG 4.42Å; W192-M703 HydrophobicContact CZ3-CE 4.25Å; W192-S712 WeakPolarHBondContact CZ2-OG 3.24Å
193	T	68.5	Low	80.5	Confident	29 Å²	29	22.7 Å²	22.7	18%	0.178	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.3	172.2	-56.8	0	0	0	0	108.8	R260	T193-R260 PolarHBondContact OG1-NH2 2.84Å; T193-R260 VanDerWaalsContact OG1-NH2 3.14Å
194	C	63.3	Low	80.8	Confident	11 Å²	11	19.3 Å²	19.3	7%	0.074	10%	0.102	C	C	.	.			trans	-83	169.8	175.8	-73.7	0	0	0	0	111	C196 H198 Y200	C194-C196 CarbonylContact C-O 3.55Å; C194-C196 WeakPolarHBondContact CB-SG 3.35Å; C194-C196 PolarHBondContact O-N 3.37Å; C194-H198 WeakPolarHBondContact CB-O 3.42Å; C194-H198 PolarHBondContact N-O 2.85Å; C194-Y200 HydrophobicContact CB-CE2 4.28Å; C194-Y200 WeakPolarHBondContact SG-CE2 3.35Å
195	Q	54.2	Low	80.9	Confident	72 Å²	72	16 Å²	16	34%	0.336	9%	0.09	S	C	.	.	S	Bend	trans	-73.1	-17.3	173.1	-64.1	178.2	-0.4	0	0	113.1	A299	Q195-A299 HydrophobicContact CG-CB 4.37Å
196	C	62.1	Low	80.8	Confident	44 Å²	44	16.2 Å²	16.2	30%	0.297	9%	0.091	S	C	.	.	S	Bend	trans	-79.8	161.4	163.6	51.4	0	0	0	0	109.1	C194 H198	C194-C196 CarbonylContact C-O 3.55Å; C194-C196 WeakPolarHBondContact CB-SG 3.35Å; C194-C196 PolarHBondContact O-N 3.37Å; C196-H198 PolarHBondContact O-N 3.49Å
197	P	68.3	Low	80.5	Confident	94 Å²	94	16.7 Å²	16.7	61%	0.61	9%	0.092	S	C	*	.	S	Bend	trans	-72.9	54.9	-179.8	33.7	-37.9	0	0	0	111	T225	P197-T225 CarbonylContact C-O 3.56Å; P197-T225 VanDerWaalsContact C-O 3.29Å; P197-T225 CarbonylContact O-C 3.48Å; P197-T225 WeakPolarHBondContact O-CA 3.38Å
198	H	73.7	Confident	80.2	Confident	34 Å²	34	18 Å²	18	16%	0.157	10%	0.099	C	C	.	.			trans	-141.1	135.3	180	-59.5	-47.4	0	0	0	109.4	C194 C196 Y200 R223 F224	C194-H198 WeakPolarHBondContact CB-O 3.42Å; C194-H198 PolarHBondContact N-O 2.85Å; C196-H198 PolarHBondContact O-N 3.49Å; H198-Y200 HydrophobicContact CB-CE2 3.91Å; H198-R223 HydrophobicContact CB-CG 4.44Å; H198-R223 PolarHBondContact CD2-NH2 2.74Å; H198-R223 PolarHBondContact CE1-NH2 2.93Å; H198-R223 VanDerWaalsContact CG-NE 3.3Å; H198-R223 PolarHBondContact ND1-NE 3.36Å; H198-R223 PolarHBondContact ND1-NH2 3.19Å; H198-R223 PolarHBondContact NE2-NH2 3.46Å; H198-F224 WeakPolarHBondContact CA-O 3.28Å; H198-F224 WeakPolarHBondContact CB-O 3.42Å; H198-F224 PolarHBondContact ND1-O 3.31Å
199	S	77	Confident	79.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	159.3	164.3	52.5	0	0	0	0	109.6	Y191 W192 R223 F224 E228	Y191-S199 VanDerWaalsContact OH-CB 3.32Å; Y191-S199 WeakPolarHBondContact OH-CB 3.25Å; Y191-S199 PolarHBondContact OH-OG 2.91Å; W192-S199 CarbonylContact O-C 3.31Å; W192-S199 VanDerWaalsContact O-CA 3.22Å; W192-S199 WeakPolarHBondContact O-CA 3.24Å; W192-S199 WeakPolarHBondContact O-CB 3.49Å; S199-R223 CarbonylContact O-C 3.59Å; S199-F224 PolarHBondContact N-O 3.18Å; S199-F224 PolarHBondContact O-N 3.39Å; S199-E228 PolarHBondContact OG-OE1 2.89Å
200	Y	80	Confident	79.2	Confident	12 Å²	12	23.9 Å²	23.9	5%	0.047	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.1	-179.2	-59.9	-93.2	0	0	0	109.8	Y191 W192 C194 H198 F221 K222 R223 E719	Y191-Y200 WeakPolarHBondContact CA-O 3.35Å; Y191-Y200 VanDerWaalsContact CD2-O 3.27Å; Y191-Y200 WeakPolarHBondContact CD2-O 3.24Å; W192-Y200 HydrophobicContact CZ2-CD2 4.33Å; W192-Y200 AromaticContact CZ2-CG 3.96Å; W192-Y200 HydrophobicContact CZ2-CG 3.96Å; W192-Y200 PolarHBondContact N-O 3.01Å; W192-Y200 AromaticContact NE1-CD2 3.6Å; W192-Y200 PolarHBondContact O-N 2.82Å; C194-Y200 HydrophobicContact CB-CE2 4.28Å; C194-Y200 WeakPolarHBondContact SG-CE2 3.35Å; H198-Y200 HydrophobicContact CB-CE2 3.91Å; Y200-F221 HydrophobicContact CD1-CD1 4.35Å; Y200-F221 AromaticContact CD1-CE1 3.34Å; Y200-F221 HydrophobicContact CD1-CE1 3.34Å; Y200-F221 AromaticContact CD1-CZ 3.68Å; Y200-F221 HydrophobicContact CD1-CZ 3.68Å; Y200-F221 AromaticContact CE1-CE1 3.94Å; Y200-F221 HydrophobicContact CE1-CE1 3.94Å; Y200-F221 HydrophobicContact CE1-CZ 4.39Å; Y200-F221 HydrophobicContact CG-CE1 4.18Å; Y200-F221 HydrophobicContact CG-CZ 4.12Å; Y200-K222 CarbonylContact C-O 3.35Å; Y200-K222 WeakPolarHBondContact CA-O 3.44Å; Y200-R223 HydrophobicContact CD1-CB 3.82Å; Y200-R223 HydrophobicContact CD1-CG 4.05Å; Y200-R223 HydrophobicContact CE1-CB 3.73Å; Y200-R223 HydrophobicContact CE1-CG 3.6Å; Y200-E719 VanDerWaalsContact OH-CD 3.25Å; Y200-E719 PolarHBondContact OH-OE1 3.47Å; Y200-E719 PolarHBondContact OH-OE2 3.05Å
201	L	85.7	Confident	79.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	114	173.9	178	62.9	0	0	0	108.8	F189 D190 Y191 I203 F221 K222 F224 I237 I261	F189-L201 HydrophobicContact CB-CD1 4.08Å; D190-L201 CarbonylContact O-C 3.55Å; D190-L201 VanDerWaalsContact O-CA 3.31Å; D190-L201 WeakPolarHBondContact O-CA 3.48Å; Y191-L201 HydrophobicContact CD2-CB 4.19Å; Y191-L201 HydrophobicContact CD2-CD1 4.44Å; L201-I203 HydrophobicContact CD1-CG1 4.47Å; L201-I203 HydrophobicContact CD2-CD1 4Å; L201-I203 HydrophobicContact CD2-CG1 4.06Å; L201-I203 HydrophobicContact CG-CD1 4.37Å; L201-I203 HydrophobicContact CG-CG1 3.89Å; L201-F221 CarbonylContact O-C 3.48Å; L201-F221 WeakPolarHBondContact O-CA 3.49Å; L201-K222 PolarHBondContact N-O 3.06Å; L201-K222 PolarHBondContact O-N 3.38Å; L201-F224 HydrophobicContact CB-CE2 3.67Å; L201-F224 HydrophobicContact CB-CZ 4.37Å; L201-F224 HydrophobicContact CD2-CZ 4.46Å; L201-I237 HydrophobicContact CD2-CD1 4.11Å; L201-I237 HydrophobicContact CD2-CG1 3.66Å; L201-I261 HydrophobicContact CD1-CD1 3.89Å
202	A	85.7	Confident	78.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.5	166.4	0	0	0	0	0	109.2	F189 D190 W192 L218 F221	F189-A202 WeakPolarHBondContact CA-O 3.42Å; D190-A202 HydrophobicContact CB-CB 4.26Å; D190-A202 PolarHBondContact N-O 3.25Å; D190-A202 PolarHBondContact O-N 3.43Å; W192-A202 HydrophobicContact CH2-CB 4.27Å; W192-A202 HydrophobicContact CZ3-CB 4.05Å; A202-L218 HydrophobicContact CB-CD1 4.11Å; A202-F221 HydrophobicContact CB-CD2 4.07Å
203	I	90.8	Very high	78.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	112.9	176.7	-59.1	179.4	0	0	0	107.7	F189 L201 L219 D220 I237 V240	F189-I203 HydrophobicContact CD1-CB 4.35Å; F189-I203 HydrophobicContact CD1-CG1 4.1Å; F189-I203 HydrophobicContact CD1-CG2 3.96Å; F189-I203 HydrophobicContact CE1-CB 4.45Å; F189-I203 HydrophobicContact CE1-CG1 4.27Å; F189-I203 HydrophobicContact CE1-CG2 3.65Å; L201-I203 HydrophobicContact CD1-CG1 4.47Å; L201-I203 HydrophobicContact CD2-CD1 4Å; L201-I203 HydrophobicContact CD2-CG1 4.06Å; L201-I203 HydrophobicContact CG-CD1 4.37Å; L201-I203 HydrophobicContact CG-CG1 3.89Å; I203-L219 HydrophobicContact CB-CB 4.45Å; I203-L219 HydrophobicContact CG2-CB 4.09Å; I203-L219 HydrophobicContact CG2-CD1 3.93Å; I203-L219 HydrophobicContact CG2-CG 4.46Å; I203-L219 WeakPolarHBondContact O-CB 3.47Å; I203-L219 PolarHBondContact O-N 3.19Å; I203-D220 PolarHBondContact N-O 2.93Å; I203-D220 PolarHBondContact O-N 2.98Å; I203-I237 HydrophobicContact CD1-CG1 4.12Å; I203-V240 HydrophobicContact CD1-CB 4.13Å; I203-V240 HydrophobicContact CD1-CG1 4.22Å; I203-V240 HydrophobicContact CD1-CG2 4.07Å
204	T	90	Very high	79.4	Confident	5 Å²	5	34 Å²	34	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.1	178.7	-55.4	0	0	0	0	109.7	L187 S188 R217 P704	L187-T204 CarbonylContact C-O 3.39Å; L187-T204 VanDerWaalsContact CA-O 3.23Å; L187-T204 WeakPolarHBondContact CA-O 3.39Å; S188-T204 PolarHBondContact N-O 3.39Å; S188-T204 PolarHBondContact O-N 2.78Å; S188-T204 WeakPolarHBondContact OG-CB 3.36Å; T204-R217 CarbonylContact C-O 3.53Å; T204-R217 WeakPolarHBondContact CA-O 3.3Å; T204-R217 WeakPolarHBondContact CG2-O 3.36Å; T204-P704 HydrophobicContact CG2-CG 4.4Å
205	V	92.4	Very high	80.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.8	173.2	65.7	0	0	0	0	111	L175 L179 V185 L187 Y207 S216 R217 L219	L175-V205 HydrophobicContact CD1-CG1 4.38Å; L179-V205 HydrophobicContact CD1-CG1 4.3Å; L179-V205 HydrophobicContact CD2-CG1 4.06Å; L179-V205 HydrophobicContact CD2-CG2 3.76Å; V185-V205 HydrophobicContact CB-CG2 3.74Å; V185-V205 HydrophobicContact CG1-CG2 4.05Å; V185-V205 HydrophobicContact CG2-CG2 4.17Å; L187-V205 HydrophobicContact CD2-CB 3.89Å; L187-V205 HydrophobicContact CD2-CG2 3.9Å; V205-Y207 HydrophobicContact CG1-CD1 4.2Å; V205-Y207 HydrophobicContact CG1-CE1 4.32Å; V205-Y207 HydrophobicContact CG2-CD1 4.28Å; V205-S216 CarbonylContact O-C 3.41Å; V205-S216 VanDerWaalsContact O-CA 3.31Å; V205-S216 WeakPolarHBondContact O-CA 3.21Å; V205-R217 HydrophobicContact CG1-CB 4.19Å; V205-R217 WeakPolarHBondContact CG1-O 3.08Å; V205-R217 PolarHBondContact N-O 3.29Å; V205-R217 PolarHBondContact O-N 2.87Å; V205-L219 HydrophobicContact CB-CD1 3.84Å; V205-L219 HydrophobicContact CB-CD2 3.95Å; V205-L219 HydrophobicContact CB-CG 3.72Å; V205-L219 HydrophobicContact CG1-CD1 4.38Å; V205-L219 HydrophobicContact CG1-CD2 3.55Å; V205-L219 HydrophobicContact CG1-CG 3.75Å
206	H	90.4	Very high	81.9	Confident	3 Å²	3	33.4 Å²	33.4	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.5	176.8	-57	-82.8	0	0	0	108.6	V185 S186 S188 L214 Q215 S216 P704	V185-H206 CarbonylContact C-O 3.51Å; V185-H206 WeakPolarHBondContact CA-O 3.43Å; S186-H206 PolarHBondContact N-O 2.92Å; S186-H206 PolarHBondContact O-N 3.35Å; S188-H206 PolarHBondContact OG-NE2 3.37Å; H206-L214 HydrophobicContact CB-CD1 4.32Å; H206-Q215 VanDerWaalsContact CA-O 3.29Å; H206-Q215 WeakPolarHBondContact CA-O 3.34Å; H206-S216 PolarHBondContact CE1-OG 3.41Å; H206-S216 VanDerWaalsContact CE1-OG 3.3Å; H206-S216 PolarHBondContact ND1-OG 2.84Å; H206-P704 WeakPolarHBondContact CE1-CG 3.37Å
207	Y	89	Confident	83.1	Confident	10 Å²	10	34.3 Å²	34.3	4%	0.039	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	157.5	-177.1	68.2	-80	0	0	0	110.8	L175 S178 L179 A182 V205 N209 Q215	L175-Y207 HydrophobicContact CD1-CE1 4.04Å; S178-Y207 WeakPolarHBondContact CB-OH 3.32Å; L179-Y207 HydrophobicContact CD2-CD1 3.57Å; L179-Y207 HydrophobicContact CD2-CD2 4.34Å; L179-Y207 HydrophobicContact CD2-CE1 3.81Å; L179-Y207 HydrophobicContact CD2-CG 3.87Å; A182-Y207 HydrophobicContact CB-CD2 4.04Å; A182-Y207 HydrophobicContact CB-CG 4.4Å; V205-Y207 HydrophobicContact CG1-CD1 4.2Å; V205-Y207 HydrophobicContact CG1-CE1 4.32Å; V205-Y207 HydrophobicContact CG2-CD1 4.28Å; Y207-N209 HydrophobicContact CE2-CB 4.33Å; Y207-Q215 HydrophobicContact CD1-CB 4.09Å; Y207-Q215 HydrophobicContact CE1-CB 3.65Å; Y207-Q215 HydrophobicContact CE2-CB 4.14Å; Y207-Q215 HydrophobicContact CE2-CG 4.29Å; Y207-Q215 PolarHBondContact N-O 3.44Å; Y207-Q215 PolarHBondContact O-N 3.04Å
208	L	85.7	Confident	84	Confident	27 Å²	27	30 Å²	30	14%	0.141	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.9	169	-60.2	176.4	0	0	0	108.4	E213 L214 L694	L208-E213 WeakPolarHBondContact CA-O 3.39Å; L208-L214 HydrophobicContact CD2-CB 4.15Å; L208-L694 HydrophobicContact CD1-CD2 3.84Å; L208-L694 HydrophobicContact CD1-CG 4.08Å; L208-L694 HydrophobicContact CG-CD2 4.2Å
209	N	82.7	Confident	84.7	Confident	30 Å²	30	28.4 Å²	28.4	16%	0.16	15%	0.147	C	C	.	.			trans	-72.8	-179.2	173.1	69.5	10.7	0	0	0	111	Y207 Q211 E212 E213 Q215	Y207-N209 HydrophobicContact CE2-CB 4.33Å; N209-Q211 VanDerWaalsContact CG-OE1 3.3Å; N209-Q211 PolarHBondContact ND2-OE1 3.32Å; N209-Q211 PolarHBondContact O-N 3.08Å; N209-Q211 WeakPolarHBondContact OD1-CA 3.45Å; N209-Q211 WeakPolarHBondContact OD1-CB 3.44Å; N209-Q211 PolarHBondContact OD1-N 2.78Å; N209-Q211 PolarHBondContact OD1-OE1 3.41Å; N209-E212 PolarHBondContact O-N 3.2Å; N209-E212 PolarHBondContact OD1-N 3.04Å; N209-E213 PolarHBondContact N-O 2.92Å; N209-E213 PolarHBondContact ND2-OE2 3.03Å; N209-E213 WeakPolarHBondContact OD1-CB 3.38Å; N209-E213 PolarHBondContact OD1-N 2.88Å; N209-E213 PolarHBondContact OD1-O 3.46Å; N209-Q215 HydrophobicContact CB-CG 3.98Å; N209-Q215 PolarHBondContact ND2-NE2 3.49Å
210	S	79.9	Confident	85.2	Confident	96 Å²	96	29.3 Å²	29.3	67%	0.671	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.3	177.1	47.1	0	0	0	0	115.1
211	Q	80.1	Confident	85.3	Confident	121 Å²	121	28.9 Å²	28.9	57%	0.565	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	8.6	177.5	-63.8	74.3	14	0	0	112.1	N209 E213	N209-Q211 VanDerWaalsContact CG-OE1 3.3Å; N209-Q211 PolarHBondContact ND2-OE1 3.32Å; N209-Q211 PolarHBondContact O-N 3.08Å; N209-Q211 WeakPolarHBondContact OD1-CA 3.45Å; N209-Q211 WeakPolarHBondContact OD1-CB 3.44Å; N209-Q211 PolarHBondContact OD1-N 2.78Å; N209-Q211 PolarHBondContact OD1-OE1 3.41Å; Q211-E213 HydrophobicContact CB-CG 4.04Å; Q211-E213 PolarHBondContact O-N 2.84Å
212	E	73.7	Confident	85.2	Confident	66 Å²	66	30.8 Å²	30.8	31%	0.308	16%	0.159	S	C	.	.	S	Bend	trans	59.9	24.2	-174.1	-57	-173.1	152.1	0	0	113.8	N209 K689	N209-E212 PolarHBondContact O-N 3.2Å; N209-E212 PolarHBondContact OD1-N 3.04Å; E212-K689 WeakPolarHBondContact OE2-CE 3.17Å; E212-K689 IonicContact OE2-NZ 2.76Å; E212-K689 PolarHBondContact OE2-NZ 2.75Å
213	E	79.4	Confident	85	Confident	60 Å²	60	34.5 Å²	34.5	28%	0.28	17%	0.172	S	C	.	.			trans	-92.2	132.1	175.3	-57	176.6	145.4	0	0	110	L208 N209 Q211 Q215 F616	L208-E213 WeakPolarHBondContact CA-O 3.39Å; N209-E213 PolarHBondContact N-O 2.92Å; N209-E213 PolarHBondContact ND2-OE2 3.03Å; N209-E213 WeakPolarHBondContact OD1-CB 3.38Å; N209-E213 PolarHBondContact OD1-N 2.88Å; N209-E213 PolarHBondContact OD1-O 3.46Å; Q211-E213 HydrophobicContact CB-CG 4.04Å; Q211-E213 PolarHBondContact O-N 2.84Å; E213-Q215 PolarHBondContact O-N 3.38Å; E213-F616 HydrophobicContact CB-CD1 4Å; E213-F616 HydrophobicContact CB-CD2 3.86Å; E213-F616 HydrophobicContact CB-CE1 3.88Å; E213-F616 HydrophobicContact CB-CE2 3.71Å; E213-F616 HydrophobicContact CB-CG 4Å; E213-F616 HydrophobicContact CB-CZ 3.72Å; E213-F616 HydrophobicContact CG-CD2 3.68Å; E213-F616 HydrophobicContact CG-CE2 3.82Å; E213-F616 HydrophobicContact CG-CG 4.08Å; E213-F616 HydrophobicContact CG-CZ 4.36Å
214	L	82.3	Confident	84.7	Confident	27 Å²	27	35.9 Å²	35.9	14%	0.141	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	114	174.6	176.1	57.6	0	0	0	111	H206 L208 P487 F616	H206-L214 HydrophobicContact CB-CD1 4.32Å; L208-L214 HydrophobicContact CD2-CB 4.15Å; L214-P487 HydrophobicContact CD2-CG 4.43Å; L214-F616 HydrophobicContact CB-CD1 4Å; L214-F616 HydrophobicContact CB-CE1 3.74Å; L214-F616 VanDerWaalsContact O-CE1 3.26Å; L214-F616 WeakPolarHBondContact O-CE1 3.11Å
215	Q	85.2	Confident	84.1	Confident	31 Å²	31	39.8 Å²	39.8	15%	0.145	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.5	170.6	-60.4	-56.4	-43.4	0	0	109.5	H206 Y207 N209 E213	H206-Q215 VanDerWaalsContact CA-O 3.29Å; H206-Q215 WeakPolarHBondContact CA-O 3.34Å; Y207-Q215 HydrophobicContact CD1-CB 4.09Å; Y207-Q215 HydrophobicContact CE1-CB 3.65Å; Y207-Q215 HydrophobicContact CE2-CB 4.14Å; Y207-Q215 HydrophobicContact CE2-CG 4.29Å; Y207-Q215 PolarHBondContact N-O 3.44Å; Y207-Q215 PolarHBondContact O-N 3.04Å; N209-Q215 HydrophobicContact CB-CG 3.98Å; N209-Q215 PolarHBondContact ND2-NE2 3.49Å; E213-Q215 PolarHBondContact O-N 3.38Å
216	S	86	Confident	83	Confident	39 Å²	39	40.7 Å²	40.7	27%	0.273	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.1	166.5	-56.6	0	0	0	0	107.5	V205 H206	V205-S216 CarbonylContact O-C 3.41Å; V205-S216 VanDerWaalsContact O-CA 3.31Å; V205-S216 WeakPolarHBondContact O-CA 3.21Å; H206-S216 PolarHBondContact CE1-OG 3.41Å; H206-S216 VanDerWaalsContact CE1-OG 3.3Å; H206-S216 PolarHBondContact ND1-OG 2.84Å
217	R	86.5	Confident	82.3	Confident	64 Å²	64	44.8 Å²	44.8	24%	0.242	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.3	-178.4	-70.7	-60.6	-173.6	-68.5	-0.1	111	L175 T204 V205 L219 E736 S737	L175-R217 HydrophobicContact CD1-CB 3.83Å; L175-R217 HydrophobicContact CD1-CG 4.05Å; L175-R217 HydrophobicContact CD2-CB 4.18Å; T204-R217 CarbonylContact C-O 3.53Å; T204-R217 WeakPolarHBondContact CA-O 3.3Å; T204-R217 WeakPolarHBondContact CG2-O 3.36Å; V205-R217 HydrophobicContact CG1-CB 4.19Å; V205-R217 WeakPolarHBondContact CG1-O 3.08Å; V205-R217 PolarHBondContact N-O 3.29Å; V205-R217 PolarHBondContact O-N 2.87Å; R217-L219 PolarHBondContact O-N 3.24Å; R217-E736 VanDerWaalsContact CD-O 3.23Å; R217-E736 WeakPolarHBondContact CD-O 3.5Å; R217-E736 PolarHBondContact NE-O 3.39Å; R217-S737 VanDerWaalsContact CZ-O 3.28Å; R217-S737 PolarHBondContact NE-O 3.47Å; R217-S737 PolarHBondContact NH2-O 3.46Å
218	L	86.7	Confident	81.9	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.8	173	-169.3	71.1	0	0	0	109.6	A202 F221 T732 F733 E736	A202-L218 HydrophobicContact CB-CD1 4.11Å; L218-F221 HydrophobicContact CD2-CB 4.28Å; L218-T732 HydrophobicContact CD2-CG2 3.72Å; L218-F733 HydrophobicContact CD2-CB 4.47Å; L218-F733 VanDerWaalsContact O-CD2 3.23Å; L218-F733 WeakPolarHBondContact O-CD2 3.48Å; L218-F733 WeakPolarHBondContact O-CE2 3.41Å; L218-E736 HydrophobicContact CB-CB 4.39Å; L218-E736 WeakPolarHBondContact CB-OE2 3.37Å
219	L	89.7	Confident	82.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-49.8	171.1	-70.2	-179.1	0	0	0	111	L175 L179 L187 I203 V205 R217 V240 F244 L246	L175-L219 HydrophobicContact CD2-CD2 3.99Å; L179-L219 HydrophobicContact CD1-CD2 3.77Å; L187-L219 HydrophobicContact CD2-CD1 3.81Å; I203-L219 HydrophobicContact CB-CB 4.45Å; I203-L219 HydrophobicContact CG2-CB 4.09Å; I203-L219 HydrophobicContact CG2-CD1 3.93Å; I203-L219 HydrophobicContact CG2-CG 4.46Å; I203-L219 WeakPolarHBondContact O-CB 3.47Å; I203-L219 PolarHBondContact O-N 3.19Å; V205-L219 HydrophobicContact CB-CD1 3.84Å; V205-L219 HydrophobicContact CB-CD2 3.95Å; V205-L219 HydrophobicContact CB-CG 3.72Å; V205-L219 HydrophobicContact CG1-CD1 4.38Å; V205-L219 HydrophobicContact CG1-CD2 3.55Å; V205-L219 HydrophobicContact CG1-CG 3.75Å; R217-L219 PolarHBondContact O-N 3.24Å; L219-V240 HydrophobicContact CB-CG1 4.02Å; L219-V240 HydrophobicContact CD1-CG1 4.31Å; L219-F244 HydrophobicContact CB-CE2 4.19Å; L219-F244 HydrophobicContact CD2-CD1 3.86Å; L219-F244 HydrophobicContact CD2-CD2 4.05Å; L219-F244 HydrophobicContact CD2-CE1 3.91Å; L219-F244 HydrophobicContact CD2-CE2 4.11Å; L219-F244 HydrophobicContact CD2-CG 3.93Å; L219-F244 HydrophobicContact CD2-CZ 4.03Å; L219-L246 HydrophobicContact CD1-CD1 3.54Å; L219-L246 HydrophobicContact CD2-CD1 4.35Å
220	D	87	Confident	82.6	Confident	19 Å²	19	45.2 Å²	45.2	10%	0.102	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155.3	-177.4	-154.7	0.2	0	0	0	111.2	I203 K222 V240	I203-D220 PolarHBondContact N-O 2.93Å; I203-D220 PolarHBondContact O-N 2.98Å; D220-K222 VanDerWaalsContact OD2-CE 3.27Å; D220-K222 WeakPolarHBondContact OD2-CE 3.4Å; D220-K222 IonicContact OD2-NZ 2.74Å; D220-K222 PolarHBondContact OD2-NZ 2.83Å; D220-V240 HydrophobicContact CB-CG1 4.07Å; D220-V240 HydrophobicContact CB-CG2 3.8Å; D220-V240 VanDerWaalsContact OD2-CG2 3.26Å; D220-V240 WeakPolarHBondContact OD2-CG2 3.28Å
221	F	83	Confident	83.4	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.013	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	109.7	172	-176.3	-81.7	0	0	0	106.9	W192 Y200 L201 A202 L218 L715 L728 E729	W192-F221 HydrophobicContact CH2-CD2 4.28Å; W192-F221 AromaticContact CH2-CE2 3.42Å; W192-F221 HydrophobicContact CH2-CE2 3.42Å; W192-F221 VanDerWaalsContact CH2-CE2 3.42Å; W192-F221 AromaticContact CH2-CZ 3.85Å; W192-F221 HydrophobicContact CH2-CZ 3.85Å; W192-F221 AromaticContact CZ2-CE2 3.81Å; W192-F221 HydrophobicContact CZ2-CE2 3.81Å; W192-F221 AromaticContact CZ2-CZ 3.78Å; W192-F221 HydrophobicContact CZ2-CZ 3.78Å; Y200-F221 HydrophobicContact CD1-CD1 4.35Å; Y200-F221 AromaticContact CD1-CE1 3.34Å; Y200-F221 HydrophobicContact CD1-CE1 3.34Å; Y200-F221 AromaticContact CD1-CZ 3.68Å; Y200-F221 HydrophobicContact CD1-CZ 3.68Å; Y200-F221 AromaticContact CE1-CE1 3.94Å; Y200-F221 HydrophobicContact CE1-CE1 3.94Å; Y200-F221 HydrophobicContact CE1-CZ 4.39Å; Y200-F221 HydrophobicContact CG-CE1 4.18Å; Y200-F221 HydrophobicContact CG-CZ 4.12Å; L201-F221 CarbonylContact O-C 3.48Å; L201-F221 WeakPolarHBondContact O-CA 3.49Å; A202-F221 HydrophobicContact CB-CD2 4.07Å; L218-F221 HydrophobicContact CD2-CB 4.28Å; F221-L715 HydrophobicContact CE1-CD1 4.47Å; F221-L715 HydrophobicContact CE2-CD1 4.41Å; F221-L715 HydrophobicContact CZ-CD1 3.97Å; F221-L728 HydrophobicContact CE1-CD2 4.38Å; F221-E729 HydrophobicContact CB-CG 4.49Å; F221-E729 HydrophobicContact CD1-CG 4.1Å; F221-E729 VanDerWaalsContact O-CD 3.24Å; F221-E729 WeakPolarHBondContact O-CG 3.06Å
222	K	83.3	Confident	84	Confident	41 Å²	41	42.7 Å²	42.7	18%	0.178	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.4	-176.7	-66.1	-167.4	-179.4	-56.4	0	110.7	Y200 L201 D220 F224 A236 V240	Y200-K222 CarbonylContact C-O 3.35Å; Y200-K222 WeakPolarHBondContact CA-O 3.44Å; L201-K222 PolarHBondContact N-O 3.06Å; L201-K222 PolarHBondContact O-N 3.38Å; D220-K222 VanDerWaalsContact OD2-CE 3.27Å; D220-K222 WeakPolarHBondContact OD2-CE 3.4Å; D220-K222 IonicContact OD2-NZ 2.74Å; D220-K222 PolarHBondContact OD2-NZ 2.83Å; K222-F224 HydrophobicContact CB-CD2 4.47Å; K222-F224 HydrophobicContact CB-CE2 3.69Å; K222-F224 HydrophobicContact CB-CZ 3.87Å; K222-F224 HydrophobicContact CD-CZ 4.17Å; K222-A236 HydrophobicContact CD-CB 3.78Å; K222-A236 VanDerWaalsContact CE-O 3.27Å; K222-A236 WeakPolarHBondContact CE-O 3.49Å; K222-V240 VanDerWaalsContact CE-CG2 3.42Å
223	R	81.1	Confident	85	Confident	78 Å²	78	39.6 Å²	39.6	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.3	166.1	179	175.3	164.7	-177.5	-15.5	110.2	H198 S199 Y200 E719 V725	H198-R223 HydrophobicContact CB-CG 4.44Å; H198-R223 PolarHBondContact CD2-NH2 2.74Å; H198-R223 PolarHBondContact CE1-NH2 2.93Å; H198-R223 VanDerWaalsContact CG-NE 3.3Å; H198-R223 PolarHBondContact ND1-NE 3.36Å; H198-R223 PolarHBondContact ND1-NH2 3.19Å; H198-R223 PolarHBondContact NE2-NH2 3.46Å; S199-R223 CarbonylContact O-C 3.59Å; Y200-R223 HydrophobicContact CD1-CB 3.82Å; Y200-R223 HydrophobicContact CD1-CG 4.05Å; Y200-R223 HydrophobicContact CE1-CB 3.73Å; Y200-R223 HydrophobicContact CE1-CG 3.6Å; R223-E719 IonicContact CZ-OE1 3.71Å; R223-E719 IonicContact NE-OE1 3.26Å; R223-E719 IonicContact NH1-OE1 2.65Å; R223-E719 PolarHBondContact NH1-OE1 3.01Å; R223-V725 HydrophobicContact CB-CG1 3.78Å; R223-V725 HydrophobicContact CG-CG1 4.43Å
224	F	83.8	Confident	85.8	Confident	30 Å²	30	37.2 Å²	37.2	13%	0.132	20%	0.199	C	C	.	.			trans	-130	-179.5	172.2	-47.4	-102.2	0	0	0	111.4	H198 S199 L201 K222 E228 L233 A236	H198-F224 WeakPolarHBondContact CA-O 3.28Å; H198-F224 WeakPolarHBondContact CB-O 3.42Å; H198-F224 PolarHBondContact ND1-O 3.31Å; S199-F224 PolarHBondContact N-O 3.18Å; S199-F224 PolarHBondContact O-N 3.39Å; L201-F224 HydrophobicContact CB-CE2 3.67Å; L201-F224 HydrophobicContact CB-CZ 4.37Å; L201-F224 HydrophobicContact CD2-CZ 4.46Å; K222-F224 HydrophobicContact CB-CD2 4.47Å; K222-F224 HydrophobicContact CB-CE2 3.69Å; K222-F224 HydrophobicContact CB-CZ 3.87Å; K222-F224 HydrophobicContact CD-CZ 4.17Å; F224-E228 HydrophobicContact CB-CG 3.64Å; F224-E228 WeakPolarHBondContact CB-OE1 3.36Å; F224-E228 HydrophobicContact CD1-CB 4.48Å; F224-E228 HydrophobicContact CD1-CG 3.76Å; F224-E228 HydrophobicContact CG-CG 4.02Å; F224-L233 HydrophobicContact CD2-CD2 4.35Å; F224-L233 HydrophobicContact CE1-CD2 3.99Å; F224-L233 HydrophobicContact CE2-CD2 3.83Å; F224-L233 HydrophobicContact CZ-CD2 3.63Å; F224-A236 HydrophobicContact CE1-CB 3.86Å; F224-A236 HydrophobicContact CZ-CB 3.84Å
225	T	77.4	Confident	86.4	Confident	88 Å²	88	41.7 Å²	41.7	54%	0.54	22%	0.223	S	C	.	.			trans	-90.6	7.2	-176.1	36.7	0	0	0	0	115.2	P197 S227 E228	P197-T225 CarbonylContact C-O 3.56Å; P197-T225 VanDerWaalsContact C-O 3.29Å; P197-T225 CarbonylContact O-C 3.48Å; P197-T225 WeakPolarHBondContact O-CA 3.38Å; T225-S227 PolarHBondContact O-N 3.43Å; T225-E228 VanDerWaalsContact C-OE1 3.23Å; T225-E228 WeakPolarHBondContact CA-OE1 3.34Å; T225-E228 PolarHBondContact N-OE1 3.29Å; T225-E228 VanDerWaalsContact OG1-CD 3.26Å; T225-E228 PolarHBondContact OG1-OE1 3.27Å; T225-E228 PolarHBondContact OG1-OE2 2.87Å
226	G	70	Confident	86.8	Confident	18 Å²	18	41 Å²	41	19%	0.186	22%	0.222	C	C	.	.	S	Bend	trans	80.9	-17.2	-179.4	0	0	0	0	0	115.5	E228 R260	G226-E228 WeakPolarHBondContact CA-OE1 3.48Å; G226-E228 PolarHBondContact N-OE1 2.88Å; G226-R260 PolarHBondContact O-NH1 3.25Å; G226-R260 VanDerWaalsContact O-NH1 3.16Å
227	S	75.4	Confident	87.3	Confident	89 Å²	89	39.1 Å²	39.1	62%	0.622	21%	0.209	S	C	*	.			trans	-95.6	14.3	-174.7	48.2	0	0	0	0	114.1	T225	T225-S227 PolarHBondContact O-N 3.43Å
228	E	81.8	Confident	87.8	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.047	20%	0.201	C	C	.	.			trans	-79.8	140.8	-157.3	-79	59.2	80.6	0	0	111.4	S199 F224 T225 G226 E232 R260	S199-E228 PolarHBondContact OG-OE1 2.89Å; F224-E228 HydrophobicContact CB-CG 3.64Å; F224-E228 WeakPolarHBondContact CB-OE1 3.36Å; F224-E228 HydrophobicContact CD1-CB 4.48Å; F224-E228 HydrophobicContact CD1-CG 3.76Å; F224-E228 HydrophobicContact CG-CG 4.02Å; T225-E228 VanDerWaalsContact C-OE1 3.23Å; T225-E228 WeakPolarHBondContact CA-OE1 3.34Å; T225-E228 PolarHBondContact N-OE1 3.29Å; T225-E228 VanDerWaalsContact OG1-CD 3.26Å; T225-E228 PolarHBondContact OG1-OE1 3.27Å; T225-E228 PolarHBondContact OG1-OE2 2.87Å; G226-E228 WeakPolarHBondContact CA-OE1 3.48Å; G226-E228 PolarHBondContact N-OE1 2.88Å; E228-E232 VanDerWaalsContact CA-OE2 3.26Å; E228-E232 WeakPolarHBondContact CA-OE2 3.36Å; E228-R260 VanDerWaalsContact O-CD 3.23Å; E228-R260 WeakPolarHBondContact O-CD 3.37Å; E228-R260 PolarHBondContact O-NH1 2.89Å
229	T	90.6	Very high	88.2	Confident	62 Å²	62	38.9 Å²	38.9	38%	0.38	22%	0.218	S	C	.	.			trans	-78.2	158.2	177.1	61.5	0	0	0	0	110.1	E231 E232 L233	T229-E231 WeakPolarHBondContact CB-OE2 3.27Å; T229-E231 PolarHBondContact O-N 3.18Å; T229-E232 PolarHBondContact N-OE2 2.96Å; T229-E232 PolarHBondContact O-N 2.98Å; T229-E232 VanDerWaalsContact OG1-CG 3.28Å; T229-E232 WeakPolarHBondContact OG1-CG 3.32Å; T229-E232 PolarHBondContact OG1-N 3.06Å; T229-E232 VanDerWaalsContact OG1-N 3.17Å; T229-E232 PolarHBondContact OG1-OE2 3.17Å; T229-E232 VanDerWaalsContact OG1-OE2 3.12Å; T229-L233 PolarHBondContact O-N 3.29Å; T229-L233 VanDerWaalsContact O-N 3.12Å
230	A	93	Very high	88.4	Confident	4 Å²	4	38.9 Å²	38.9	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-31.9	173.7	0	0	0	0	0	111.2	L233 S234 R260 K263 A264 M267	A230-L233 PolarHBondContact O-N 3.26Å; A230-S234 WeakPolarHBondContact O-CB 3.35Å; A230-S234 PolarHBondContact O-N 3.43Å; A230-R260 WeakPolarHBondContact CB-O 3.39Å; A230-K263 HydrophobicContact CB-CB 3.7Å; A230-K263 HydrophobicContact CB-CD 3.62Å; A230-K263 HydrophobicContact CB-CG 3.7Å; A230-A264 HydrophobicContact CB-CB 4.42Å; A230-A264 VanDerWaalsContact O-CB 3.22Å; A230-A264 WeakPolarHBondContact O-CB 3.31Å; A230-M267 HydrophobicContact CB-SD 4.27Å
231	E	95	Very high	88.8	Confident	74 Å²	74	38.2 Å²	38.2	35%	0.346	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-48.7	176.3	-63.9	62.5	-152.8	0	0	110.7	T229 S234 L235 K263 M267	T229-E231 WeakPolarHBondContact CB-OE2 3.27Å; T229-E231 PolarHBondContact O-N 3.18Å; E231-S234 PolarHBondContact O-N 3.32Å; E231-S234 PolarHBondContact O-OG 2.64Å; E231-L235 WeakPolarHBondContact O-CG 3.44Å; E231-L235 PolarHBondContact O-N 3.41Å; E231-K263 IonicContact OE1-NZ 3.19Å; E231-K263 PolarHBondContact OE1-NZ 2.77Å; E231-K263 IonicContact OE2-NZ 2.74Å; E231-M267 HydrophobicContact CB-CE 4.18Å; E231-M267 HydrophobicContact CG-CE 3.62Å; E231-M267 HydrophobicContact CG-SD 4.22Å
232	E	93.4	Very high	89.4	Confident	91 Å²	91	42.2 Å²	42.2	43%	0.425	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-41.5	176.4	-73.9	164.5	152.8	0	0	112.5	E228 T229 S234 L235 A236	E228-E232 VanDerWaalsContact CA-OE2 3.26Å; E228-E232 WeakPolarHBondContact CA-OE2 3.36Å; T229-E232 PolarHBondContact N-OE2 2.96Å; T229-E232 PolarHBondContact O-N 2.98Å; T229-E232 VanDerWaalsContact OG1-CG 3.28Å; T229-E232 WeakPolarHBondContact OG1-CG 3.32Å; T229-E232 PolarHBondContact OG1-N 3.06Å; T229-E232 VanDerWaalsContact OG1-N 3.17Å; T229-E232 PolarHBondContact OG1-OE2 3.17Å; T229-E232 VanDerWaalsContact OG1-OE2 3.12Å; E232-S234 VanDerWaalsContact C-N 3.33Å; E232-S234 PolarHBondContact O-N 2.99Å; E232-L235 PolarHBondContact O-N 3.2Å; E232-A236 WeakPolarHBondContact O-CB 3.14Å; E232-A236 PolarHBondContact O-N 3.01Å
233	L	94	Very high	89.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-43	173.9	-68.4	176.5	0	0	0	111.2	Y191 F224 T229 A230 L235 A236 I237 R260 A264	Y191-L233 HydrophobicContact CD2-CD1 4.42Å; Y191-L233 HydrophobicContact CD2-CD2 4.05Å; Y191-L233 HydrophobicContact CE1-CD1 4.4Å; Y191-L233 HydrophobicContact CE2-CD1 4.06Å; Y191-L233 HydrophobicContact CE2-CD2 3.62Å; Y191-L233 HydrophobicContact CE2-CG 4.49Å; F224-L233 HydrophobicContact CD2-CD2 4.35Å; F224-L233 HydrophobicContact CE1-CD2 3.99Å; F224-L233 HydrophobicContact CE2-CD2 3.83Å; F224-L233 HydrophobicContact CZ-CD2 3.63Å; T229-L233 PolarHBondContact O-N 3.29Å; T229-L233 VanDerWaalsContact O-N 3.12Å; A230-L233 PolarHBondContact O-N 3.26Å; L233-L235 PolarHBondContact O-N 3.32Å; L233-A236 PolarHBondContact O-N 3.4Å; L233-I237 WeakPolarHBondContact O-CD1 3.41Å; L233-I237 VanDerWaalsContact O-CG1 3.28Å; L233-I237 WeakPolarHBondContact O-CG1 3.22Å; L233-I237 PolarHBondContact O-N 3.23Å; L233-R260 HydrophobicContact CD1-CB 3.97Å; L233-A264 HydrophobicContact CB-CB 3.68Å
234	S	95.9	Very high	90.4	Very high	10 Å²	10	41 Å²	41	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-43.3	179.6	78.5	0	0	0	0	111.8	A230 E231 E232 A236 I237 A238	A230-S234 WeakPolarHBondContact O-CB 3.35Å; A230-S234 PolarHBondContact O-N 3.43Å; E231-S234 PolarHBondContact O-N 3.32Å; E231-S234 PolarHBondContact O-OG 2.64Å; E232-S234 VanDerWaalsContact C-N 3.33Å; E232-S234 PolarHBondContact O-N 2.99Å; S234-A236 VanDerWaalsContact C-N 3.35Å; S234-A236 PolarHBondContact O-N 2.96Å; S234-I237 PolarHBondContact O-N 3.46Å; S234-A238 VanDerWaalsContact O-CB 3.24Å; S234-A238 WeakPolarHBondContact O-CB 3.47Å; S234-A238 PolarHBondContact O-N 3.42Å
235	L	95.6	Very high	90.8	Very high	122 Å²	122	43.3 Å²	43.3	64%	0.639	26%	0.259	S	S	*	.	H	α-helix	trans	-64.8	-40.2	176.4	-71.2	172.7	0	0	0	111.6	E231 E232 L233 A238 S239	E231-L235 WeakPolarHBondContact O-CG 3.44Å; E231-L235 PolarHBondContact O-N 3.41Å; E232-L235 PolarHBondContact O-N 3.2Å; L233-L235 PolarHBondContact O-N 3.32Å; L235-A238 PolarHBondContact O-N 3.45Å; L235-S239 WeakPolarHBondContact O-CB 3.26Å; L235-S239 PolarHBondContact O-N 2.68Å
236	A	94.2	Very high	91.6	Very high	15 Å²	15	39.1 Å²	39.1	12%	0.124	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-41.9	177.6	0	0	0	0	0	111.9	K222 F224 E232 L233 S234 V240	K222-A236 HydrophobicContact CD-CB 3.78Å; K222-A236 VanDerWaalsContact CE-O 3.27Å; K222-A236 WeakPolarHBondContact CE-O 3.49Å; F224-A236 HydrophobicContact CE1-CB 3.86Å; F224-A236 HydrophobicContact CZ-CB 3.84Å; E232-A236 WeakPolarHBondContact O-CB 3.14Å; E232-A236 PolarHBondContact O-N 3.01Å; L233-A236 PolarHBondContact O-N 3.4Å; S234-A236 VanDerWaalsContact C-N 3.35Å; S234-A236 PolarHBondContact O-N 2.96Å; A236-V240 WeakPolarHBondContact O-CG2 3.43Å; A236-V240 PolarHBondContact O-N 3.13Å
237	I	96.1	Very high	92.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.6	-49.4	174.9	-67.5	158.6	0	0	0	110.3	F189 L201 I203 L233 S234 S239 V240 L241 I261 A264 L268	F189-I237 HydrophobicContact CD2-CD1 3.97Å; F189-I237 HydrophobicContact CE1-CG2 4.49Å; F189-I237 HydrophobicContact CE2-CD1 3.69Å; F189-I237 HydrophobicContact CE2-CG1 4.12Å; F189-I237 HydrophobicContact CE2-CG2 3.77Å; F189-I237 HydrophobicContact CZ-CD1 4.45Å; F189-I237 HydrophobicContact CZ-CG1 4.42Å; F189-I237 HydrophobicContact CZ-CG2 3.54Å; L201-I237 HydrophobicContact CD2-CD1 4.11Å; L201-I237 HydrophobicContact CD2-CG1 3.66Å; I203-I237 HydrophobicContact CD1-CG1 4.12Å; L233-I237 WeakPolarHBondContact O-CD1 3.41Å; L233-I237 VanDerWaalsContact O-CG1 3.28Å; L233-I237 WeakPolarHBondContact O-CG1 3.22Å; L233-I237 PolarHBondContact O-N 3.23Å; S234-I237 PolarHBondContact O-N 3.46Å; I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 PolarHBondContact O-N 2.94Å; I237-V240 WeakPolarHBondContact O-CB 3.44Å; I237-V240 PolarHBondContact O-N 2.8Å; I237-L241 HydrophobicContact CG2-CD1 4.1Å; I237-L241 HydrophobicContact CG2-CG 4.24Å; I237-L241 WeakPolarHBondContact O-CG 3.48Å; I237-L241 PolarHBondContact O-N 2.81Å; I237-I261 HydrophobicContact CD1-CD1 3.83Å; I237-A264 HydrophobicContact CD1-CB 4.49Å; I237-L268 HydrophobicContact CB-CD1 3.74Å; I237-L268 HydrophobicContact CD1-CD1 4.47Å; I237-L268 HydrophobicContact CG2-CD1 3.41Å; I237-L268 VanDerWaalsContact CG2-CD1 3.41Å
238	A	96.2	Very high	93	Very high	9 Å²	9	44 Å²	44	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-52.1	-46.1	177.9	0	0	0	0	0	112.1	S234 L235 V240 L241 D242 L268	S234-A238 VanDerWaalsContact O-CB 3.24Å; S234-A238 WeakPolarHBondContact O-CB 3.47Å; S234-A238 PolarHBondContact O-N 3.42Å; L235-A238 PolarHBondContact O-N 3.45Å; A238-V240 VanDerWaalsContact C-N 3.3Å; A238-V240 PolarHBondContact O-N 3.25Å; A238-L241 PolarHBondContact O-N 3.32Å; A238-D242 PolarHBondContact O-N 2.69Å; A238-L268 HydrophobicContact CB-CD2 3.88Å
239	S	95.9	Very high	93.5	Very high	53 Å²	53	45.8 Å²	45.8	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-58.7	-40.1	176.7	-175.3	0	0	0	0	112.6	L235 I237 Q243	L235-S239 WeakPolarHBondContact O-CB 3.26Å; L235-S239 PolarHBondContact O-N 2.68Å; I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 PolarHBondContact O-N 2.94Å; S239-Q243 WeakPolarHBondContact O-CB 3.3Å; S239-Q243 WeakPolarHBondContact O-CG 3.22Å; S239-Q243 PolarHBondContact O-N 2.9Å; S239-Q243 PolarHBondContact O-NE2 3.01Å; S239-Q243 PolarHBondContact OG-NE2 3.23Å; S239-Q243 VanDerWaalsContact OG-NE2 3.07Å
240	V	94.3	Very high	93.6	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-43.5	176.8	175.7	0	0	0	0	110.5	I203 L219 D220 K222 A236 I237 A238 D242 Q243 F244	I203-V240 HydrophobicContact CD1-CB 4.13Å; I203-V240 HydrophobicContact CD1-CG1 4.22Å; I203-V240 HydrophobicContact CD1-CG2 4.07Å; L219-V240 HydrophobicContact CB-CG1 4.02Å; L219-V240 HydrophobicContact CD1-CG1 4.31Å; D220-V240 HydrophobicContact CB-CG1 4.07Å; D220-V240 HydrophobicContact CB-CG2 3.8Å; D220-V240 VanDerWaalsContact OD2-CG2 3.26Å; D220-V240 WeakPolarHBondContact OD2-CG2 3.28Å; K222-V240 VanDerWaalsContact CE-CG2 3.42Å; A236-V240 WeakPolarHBondContact O-CG2 3.43Å; A236-V240 PolarHBondContact O-N 3.13Å; I237-V240 WeakPolarHBondContact O-CB 3.44Å; I237-V240 PolarHBondContact O-N 2.8Å; A238-V240 VanDerWaalsContact C-N 3.3Å; A238-V240 PolarHBondContact O-N 3.25Å; V240-D242 VanDerWaalsContact C-N 3.28Å; V240-D242 PolarHBondContact O-N 3.23Å; V240-Q243 PolarHBondContact O-N 3.12Å; V240-F244 HydrophobicContact CG1-CD2 4.04Å; V240-F244 HydrophobicContact CG1-CE2 4.22Å; V240-F244 WeakPolarHBondContact O-CD2 3.49Å; V240-F244 PolarHBondContact O-N 2.67Å
241	L	95.3	Very high	93.5	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-38.6	177.2	-60.9	-178.6	0	0	0	112.2	L187 I237 A238 A245 L246 R247 V250 L270	L187-L241 HydrophobicContact CD1-CD2 3.47Å; L187-L241 VanDerWaalsContact CD1-CD2 3.47Å; I237-L241 HydrophobicContact CG2-CD1 4.1Å; I237-L241 HydrophobicContact CG2-CG 4.24Å; I237-L241 WeakPolarHBondContact O-CG 3.48Å; I237-L241 PolarHBondContact O-N 2.81Å; A238-L241 PolarHBondContact O-N 3.32Å; L241-A245 PolarHBondContact O-N 2.8Å; L241-L246 HydrophobicContact CD2-CB 4.15Å; L241-L246 PolarHBondContact O-N 3.17Å; L241-R247 HydrophobicContact CB-CG 4.02Å; L241-V250 HydrophobicContact CD2-CG2 4.26Å; L241-L270 HydrophobicContact CD1-CD1 3.97Å
242	D	94.2	Very high	93.4	Very high	87 Å²	87	41.7 Å²	41.7	47%	0.465	24%	0.24	S	C	.	.	H	α-helix	trans	-67.6	-44.8	175.8	-72.6	-34.4	0	0	0	112.1	A238 V240 F244 A245 R247	A238-D242 PolarHBondContact O-N 2.69Å; V240-D242 VanDerWaalsContact C-N 3.28Å; V240-D242 PolarHBondContact O-N 3.23Å; D242-F244 PolarHBondContact O-N 3.27Å; D242-A245 PolarHBondContact O-N 3.44Å; D242-A245 VanDerWaalsContact O-N 3.08Å; D242-R247 WeakPolarHBondContact OD1-CD 3.44Å; D242-R247 IonicContact OD1-CZ 3.82Å; D242-R247 IonicContact OD1-NE 3.52Å; D242-R247 PolarHBondContact OD1-NE 2.94Å; D242-R247 IonicContact OD1-NH2 3.57Å; D242-R247 IonicContact OD2-CZ 2.72Å; D242-R247 IonicContact OD2-NE 3.28Å; D242-R247 PolarHBondContact OD2-NE 3.28Å; D242-R247 IonicContact OD2-NH2 3.34Å; D242-R247 PolarHBondContact OD2-NH2 2.99Å
243	Q	92.1	Very high	93.4	Very high	83 Å²	83	37.3 Å²	37.3	39%	0.388	22%	0.22	S	C	.	.	H	α-helix	trans	-59.5	-29.9	179.1	-76.4	172.9	49.9	0	0	113.5	S239 V240	S239-Q243 WeakPolarHBondContact O-CB 3.3Å; S239-Q243 WeakPolarHBondContact O-CG 3.22Å; S239-Q243 PolarHBondContact O-N 2.9Å; S239-Q243 PolarHBondContact O-NE2 3.01Å; S239-Q243 PolarHBondContact OG-NE2 3.23Å; S239-Q243 VanDerWaalsContact OG-NE2 3.07Å; V240-Q243 PolarHBondContact O-N 3.12Å
244	F	93.6	Very high	93.3	Very high	12 Å²	12	37.3 Å²	37.3	5%	0.053	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	7	178.1	-70.4	-88.7	0	0	0	113.3	R172 L175 I176 L179 L219 V240 D242 L246	R172-F244 HydrophobicContact CG-CE1 4.35Å; R172-F244 HydrophobicContact CG-CZ 4.26Å; L175-F244 HydrophobicContact CD2-CE1 4.13Å; L175-F244 HydrophobicContact CG-CE1 4.36Å; I176-F244 HydrophobicContact CD1-CE1 4.45Å; I176-F244 HydrophobicContact CG1-CD1 3.66Å; I176-F244 HydrophobicContact CG1-CE1 3.8Å; L179-F244 HydrophobicContact CD1-CD1 3.9Å; L219-F244 HydrophobicContact CB-CE2 4.19Å; L219-F244 HydrophobicContact CD2-CD1 3.86Å; L219-F244 HydrophobicContact CD2-CD2 4.05Å; L219-F244 HydrophobicContact CD2-CE1 3.91Å; L219-F244 HydrophobicContact CD2-CE2 4.11Å; L219-F244 HydrophobicContact CD2-CG 3.93Å; L219-F244 HydrophobicContact CD2-CZ 4.03Å; V240-F244 HydrophobicContact CG1-CD2 4.04Å; V240-F244 HydrophobicContact CG1-CE2 4.22Å; V240-F244 WeakPolarHBondContact O-CD2 3.49Å; V240-F244 PolarHBondContact O-N 2.67Å; D242-F244 PolarHBondContact O-N 3.27Å; F244-L246 VanDerWaalsContact C-N 3.3Å; F244-L246 HydrophobicContact CB-CD1 3.8Å; F244-L246 HydrophobicContact CB-CD2 4.49Å; F244-L246 HydrophobicContact CB-CG 3.7Å; F244-L246 WeakPolarHBondContact O-CG 3.33Å; F244-L246 PolarHBondContact O-N 3.12Å
245	A	93.1	Very high	93	Very high	78 Å²	78	36.9 Å²	36.9	65%	0.645	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	42.5	-178	0	0	0	0	0	114.1	L241 D242	L241-A245 PolarHBondContact O-N 2.8Å; D242-A245 PolarHBondContact O-N 3.44Å; D242-A245 VanDerWaalsContact O-N 3.08Å
246	L	94.1	Very high	92.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.188	C	C	.	.			trans	-97	-13	-171.9	-64	-179.3	0	0	0	115	L179 V185 L187 L219 L241 F244 G248 K249 V250	L179-L246 HydrophobicContact CB-CD2 4.32Å; L179-L246 HydrophobicContact CD1-CD1 4.49Å; L179-L246 HydrophobicContact CD1-CD2 4.36Å; V185-L246 HydrophobicContact CG1-CD2 4.3Å; V185-L246 HydrophobicContact CG2-CD2 4.17Å; L187-L246 HydrophobicContact CD2-CD1 4.46Å; L219-L246 HydrophobicContact CD1-CD1 3.54Å; L219-L246 HydrophobicContact CD2-CD1 4.35Å; L241-L246 HydrophobicContact CD2-CB 4.15Å; L241-L246 PolarHBondContact O-N 3.17Å; F244-L246 VanDerWaalsContact C-N 3.3Å; F244-L246 HydrophobicContact CB-CD1 3.8Å; F244-L246 HydrophobicContact CB-CD2 4.49Å; F244-L246 HydrophobicContact CB-CG 3.7Å; F244-L246 WeakPolarHBondContact O-CG 3.33Å; F244-L246 PolarHBondContact O-N 3.12Å; L246-G248 VanDerWaalsContact C-N 3.27Å; L246-G248 PolarHBondContact O-N 3.49Å; L246-K249 PolarHBondContact O-N 3.43Å; L246-V250 HydrophobicContact CB-CG2 4.33Å; L246-V250 WeakPolarHBondContact O-CG2 3.48Å; L246-V250 PolarHBondContact O-N 2.87Å
247	R	87.8	Confident	92	Very high	130 Å²	130	32.8 Å²	32.8	49%	0.491	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-41.8	-170.5	-72.6	-165.3	-178.6	-122	9.1	114.7	L241 D242	L241-R247 HydrophobicContact CB-CG 4.02Å; D242-R247 WeakPolarHBondContact OD1-CD 3.44Å; D242-R247 IonicContact OD1-CZ 3.82Å; D242-R247 IonicContact OD1-NE 3.52Å; D242-R247 PolarHBondContact OD1-NE 2.94Å; D242-R247 IonicContact OD1-NH2 3.57Å; D242-R247 IonicContact OD2-CZ 2.72Å; D242-R247 IonicContact OD2-NE 3.28Å; D242-R247 PolarHBondContact OD2-NE 3.28Å; D242-R247 IonicContact OD2-NH2 3.34Å; D242-R247 PolarHBondContact OD2-NH2 2.99Å
248	G	87.5	Confident	91.3	Very high	78 Å²	78	34.2 Å²	34.2	80%	0.804	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-6.7	178.9	0	0	0	0	0	115.6	L246	L246-G248 VanDerWaalsContact C-N 3.27Å; L246-G248 PolarHBondContact O-N 3.49Å
249	K	91.7	Very high	90.9	Very high	49 Å²	49	39.7 Å²	39.7	21%	0.213	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-19	-175.6	-63.4	-169.3	176.6	-160.3	0	113.4	L179 A180 A182 R184 V185 L246 Q251	L179-K249 PolarHBondContact O-NZ 2.97Å; A180-K249 PolarHBondContact O-NZ 3.28Å; A182-K249 PolarHBondContact O-NZ 3.39Å; R184-K249 WeakPolarHBondContact CA-O 3.35Å; V185-K249 HydrophobicContact CG2-CB 4.28Å; V185-K249 PolarHBondContact N-O 3.49Å; L246-K249 PolarHBondContact O-N 3.43Å; K249-Q251 PolarHBondContact O-N 3.36Å
250	V	93.1	Very high	90.5	Very high	18 Å²	18	40.4 Å²	40.4	11%	0.109	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	119	-178.6	-178.8	0	0	0	0	109.5	V185 L187 L241 L246 V253 L270	V185-V250 HydrophobicContact CG2-CG2 4.05Å; V185-V250 CarbonylContact O-C 3.29Å; V185-V250 WeakPolarHBondContact O-CA 3.41Å; L187-V250 HydrophobicContact CD1-CG1 4.08Å; L187-V250 HydrophobicContact CD1-CG2 3.65Å; L187-V250 HydrophobicContact CG-CG1 4.32Å; L187-V250 HydrophobicContact CG-CG2 4.2Å; L241-V250 HydrophobicContact CD2-CG2 4.26Å; L246-V250 HydrophobicContact CB-CG2 4.33Å; L246-V250 WeakPolarHBondContact O-CG2 3.48Å; L246-V250 PolarHBondContact O-N 2.87Å; V250-V253 HydrophobicContact CG1-CG2 4.03Å; V250-L270 HydrophobicContact CB-CD2 4.29Å; V250-L270 HydrophobicContact CG1-CD2 4.17Å
251	Q	90.6	Very high	90.4	Very high	13 Å²	13	40.4 Å²	40.4	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-33.8	171.8	70.9	177.6	-42.9	0	0	112.4	V185 S186 K249 L694 I698	V185-Q251 PolarHBondContact O-N 3.07Å; S186-Q251 VanDerWaalsContact OG-CG 3.3Å; S186-Q251 WeakPolarHBondContact OG-CG 3.28Å; S186-Q251 PolarHBondContact OG-NE2 3.02Å; K249-Q251 PolarHBondContact O-N 3.36Å; Q251-L694 PolarHBondContact NE2-O 2.78Å; Q251-I698 HydrophobicContact CG-CD1 4.49Å; Q251-I698 HydrophobicContact CG-CG1 4.34Å
252	R	92	Very high	90.2	Very high	22 Å²	22	41.1 Å²	41.1	8%	0.083	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	149.4	-177.1	-163.5	143.7	-76.2	-141.1	5.5	112.7	S186 L187 A271 L273 D537 I698	S186-R252 CarbonylContact C-O 3.53Å; S186-R252 VanDerWaalsContact CA-O 3.32Å; S186-R252 WeakPolarHBondContact CA-O 3.44Å; L187-R252 PolarHBondContact N-O 3.25Å; R252-A271 CarbonylContact C-O 3.48Å; R252-A271 WeakPolarHBondContact CA-O 3.37Å; R252-L273 HydrophobicContact CG-CB 4.23Å; R252-D537 IonicContact CZ-OD1 3.53Å; R252-D537 IonicContact CZ-OD2 3.93Å; R252-D537 IonicContact NH1-OD1 2.65Å; R252-D537 PolarHBondContact NH1-OD1 3.45Å; R252-D537 IonicContact NH1-OD2 3.45Å; R252-D537 PolarHBondContact NH1-OD2 2.86Å; R252-D537 IonicContact NH2-OD1 3.42Å; R252-D537 PolarHBondContact NH2-OD1 2.94Å; R252-D537 IonicContact NH2-OD2 3.39Å; R252-D537 PolarHBondContact NH2-OD2 3.13Å; R252-I698 HydrophobicContact CB-CD1 4.32Å; R252-I698 HydrophobicContact CB-CG2 4.34Å; R252-I698 HydrophobicContact CG-CG2 4.41Å
253	V	93.3	Very high	90.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.6	172.8	-179.6	0	0	0	0	109.9	L187 F189 V250 V265 L270 A271 Y272 L273	L187-V253 HydrophobicContact CB-CG2 4.24Å; L187-V253 HydrophobicContact CD1-CG2 4.33Å; L187-V253 CarbonylContact O-C 3.6Å; L187-V253 WeakPolarHBondContact O-CA 3.27Å; F189-V253 HydrophobicContact CB-CG1 4.42Å; F189-V253 HydrophobicContact CD1-CG1 4.05Å; F189-V253 HydrophobicContact CD2-CG1 3.4Å; F189-V253 HydrophobicContact CE1-CG1 4.04Å; F189-V253 HydrophobicContact CE2-CB 4.48Å; F189-V253 HydrophobicContact CE2-CG1 3.43Å; F189-V253 VanDerWaalsContact CE2-CG1 3.43Å; F189-V253 HydrophobicContact CE2-CG2 4.26Å; F189-V253 HydrophobicContact CG-CG1 3.71Å; F189-V253 HydrophobicContact CZ-CG1 3.74Å; F189-V253 HydrophobicContact CZ-CG2 4.1Å; V250-V253 HydrophobicContact CG1-CG2 4.03Å; V253-V265 HydrophobicContact CB-CG1 4.41Å; V253-V265 HydrophobicContact CG1-CG2 4.34Å; V253-L270 HydrophobicContact CG2-CB 4Å; V253-L270 HydrophobicContact CG2-CD1 3.86Å; V253-L270 HydrophobicContact CG2-CG 4.46Å; V253-A271 PolarHBondContact N-O 3.4Å; V253-Y272 CarbonylContact O-C 3Å; V253-Y272 WeakPolarHBondContact O-CA 3.22Å; V253-Y272 WeakPolarHBondContact O-CB 3.42Å; V253-L273 PolarHBondContact O-N 3.32Å
254	T	91.6	Very high	90.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	117.6	169.7	-54.6	0	0	0	0	109.7	L187 S188 F189 L273 P699 L701	L187-T254 PolarHBondContact O-N 3.35Å; S188-T254 CarbonylContact C-O 3.58Å; S188-T254 VanDerWaalsContact CA-O 3.23Å; S188-T254 WeakPolarHBondContact CA-O 3.17Å; F189-T254 PolarHBondContact N-O 2.77Å; T254-L273 CarbonylContact C-O 3.55Å; T254-L273 WeakPolarHBondContact CA-O 3.21Å; T254-L273 WeakPolarHBondContact CG2-O 3.1Å; T254-P699 WeakPolarHBondContact CB-O 3.48Å; T254-P699 WeakPolarHBondContact CG2-O 3.45Å; T254-P699 PolarHBondContact OG1-O 2.98Å; T254-L701 VanDerWaalsContact CG2-C 3.4Å
255	T	90.3	Very high	90.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	167.8	-175.5	-165.8	0	0	0	0	111.7	F189 I261 V262 V265 Y272 L273 P274 C275	F189-T255 PolarHBondContact O-OG1 3.27Å; T255-I261 VanDerWaalsContact OG1-CG1 3.32Å; T255-I261 WeakPolarHBondContact OG1-CG1 3.45Å; T255-V262 HydrophobicContact CG2-CG2 4.34Å; T255-V265 HydrophobicContact CG2-CG2 4.35Å; T255-Y272 HydrophobicContact CG2-CD2 3.96Å; T255-L273 PolarHBondContact N-O 2.92Å; T255-P274 CarbonylContact O-C 3.51Å; T255-C275 VanDerWaalsContact O-CB 3.31Å; T255-C275 WeakPolarHBondContact O-CB 3.35Å; T255-C275 PolarHBondContact O-N 3.26Å
256	G	84.9	Confident	90.3	Very high	5 Å²	5	39.3 Å²	39.3	5%	0.052	20%	0.196	C	C	.	.			trans	-67.9	-177.7	176.2	0	0	0	0	0	113.7	E258 V262 Q278	G256-E258 VanDerWaalsContact C-N 3.26Å; G256-V262 WeakPolarHBondContact O-CG2 3.35Å; G256-Q278 VanDerWaalsContact C-OE1 3.29Å
257	L	83.6	Confident	90.4	Very high	47 Å²	47	43.7 Å²	43.7	25%	0.246	22%	0.218	C	C	.	.	S	Bend	trans	-89.5	8.6	174.1	-60.7	177.8	0	0	0	112.3	P274 Q278 I279 A282 F528	L257-P274 HydrophobicContact CD2-CB 3.83Å; L257-Q278 HydrophobicContact CD1-CB 4.19Å; L257-Q278 HydrophobicContact CG-CB 4.17Å; L257-I279 HydrophobicContact CD1-CG1 4.22Å; L257-I279 HydrophobicContact CD2-CG1 4.25Å; L257-A282 HydrophobicContact CD1-CB 4.28Å; L257-F528 HydrophobicContact CD1-CE1 3.88Å; L257-F528 HydrophobicContact CD1-CZ 4.25Å
258	E	82.2	Confident	90.7	Very high	29 Å²	29	39.1 Å²	39.1	14%	0.136	20%	0.203	C	C	.	.			trans	-72.5	128	-174.8	-164.4	-98	176.9	0	0	111.4	Y191 G256 R260 I261 V262 T342	Y191-E258 HydrophobicContact CD1-CG 4.28Å; Y191-E258 WeakPolarHBondContact CD1-OE2 3.32Å; Y191-E258 HydrophobicContact CE1-CG 4.45Å; Y191-E258 WeakPolarHBondContact CE1-OE1 3.26Å; Y191-E258 WeakPolarHBondContact CE1-OE2 3.26Å; G256-E258 VanDerWaalsContact C-N 3.26Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 3.47Å; E258-R260 IonicContact OE1-CZ 2.7Å; E258-R260 VanDerWaalsContact OE1-CZ 3.26Å; E258-R260 IonicContact OE1-NE 3.95Å; E258-R260 PolarHBondContact OE1-NE 2.96Å; E258-R260 IonicContact OE1-NH2 2.77Å; E258-R260 PolarHBondContact OE1-NH2 3.04Å; E258-R260 WeakPolarHBondContact OE2-CB 3.49Å; E258-R260 PolarHBondContact OE2-N 2.98Å; E258-I261 HydrophobicContact CB-CG2 3.88Å; E258-I261 VanDerWaalsContact O-CG2 3.25Å; E258-I261 WeakPolarHBondContact O-CG2 3.49Å; E258-I261 PolarHBondContact O-N 3.16Å; E258-I261 PolarHBondContact OE2-N 2.92Å; E258-V262 WeakPolarHBondContact O-CB 3.26Å; E258-V262 VanDerWaalsContact O-CG2 3.26Å; E258-V262 WeakPolarHBondContact O-CG2 3.25Å; E258-V262 PolarHBondContact O-N 3.32Å; E258-T342 HydrophobicContact CB-CG2 4.05Å; E258-T342 HydrophobicContact CG-CG2 3.81Å
259	E	87	Confident	90.9	Very high	125 Å²	125	42.8 Å²	42.8	58%	0.584	20%	0.204	S	C	*	.	H	α-helix	trans	-61.3	-39.7	-166.9	-173.6	-175.5	170.7	0	0	111.7	V262 K263 T342	E259-V262 PolarHBondContact O-N 3.21Å; E259-K263 VanDerWaalsContact O-CB 3.24Å; E259-K263 WeakPolarHBondContact O-CB 3.47Å; E259-K263 PolarHBondContact O-N 3.35Å; E259-T342 HydrophobicContact CB-CG2 4.31Å; E259-T342 VanDerWaalsContact N-CG2 3.26Å
260	R	89.2	Confident	90.9	Very high	68 Å²	68	41.7 Å²	41.7	26%	0.257	20%	0.2	S	C	.	.	H	α-helix	trans	-66.3	-48.7	-178.8	-64.1	-178.4	-73.5	174.6	-2.6	111.5	Y191 T193 G226 E228 A230 L233 E258 K263 A264	Y191-R260 PolarHBondContact OH-NH1 3.19Å; Y191-R260 PolarHBondContact OH-NH2 3.42Å; T193-R260 PolarHBondContact OG1-NH2 2.84Å; T193-R260 VanDerWaalsContact OG1-NH2 3.14Å; G226-R260 PolarHBondContact O-NH1 3.25Å; G226-R260 VanDerWaalsContact O-NH1 3.16Å; E228-R260 VanDerWaalsContact O-CD 3.23Å; E228-R260 WeakPolarHBondContact O-CD 3.37Å; E228-R260 PolarHBondContact O-NH1 2.89Å; A230-R260 WeakPolarHBondContact CB-O 3.39Å; L233-R260 HydrophobicContact CD1-CB 3.97Å; E258-R260 VanDerWaalsContact C-N 3.29Å; E258-R260 PolarHBondContact O-N 3.47Å; E258-R260 IonicContact OE1-CZ 2.7Å; E258-R260 VanDerWaalsContact OE1-CZ 3.26Å; E258-R260 IonicContact OE1-NE 3.95Å; E258-R260 PolarHBondContact OE1-NE 2.96Å; E258-R260 IonicContact OE1-NH2 2.77Å; E258-R260 PolarHBondContact OE1-NH2 3.04Å; E258-R260 WeakPolarHBondContact OE2-CB 3.49Å; E258-R260 PolarHBondContact OE2-N 2.98Å; R260-K263 PolarHBondContact O-N 2.76Å; R260-A264 WeakPolarHBondContact O-CB 3.41Å; R260-A264 PolarHBondContact O-N 2.91Å
261	I	90.2	Very high	90.7	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-38.2	177	-167.5	62.6	0	0	0	111.9	F189 Y191 L201 I237 T255 E258 A264 V265	F189-I261 HydrophobicContact CB-CG1 4.49Å; F189-I261 HydrophobicContact CD2-CD1 4.26Å; Y191-I261 HydrophobicContact CD1-CB 4.26Å; Y191-I261 HydrophobicContact CG-CB 4.24Å; L201-I261 HydrophobicContact CD1-CD1 3.89Å; I237-I261 HydrophobicContact CD1-CD1 3.83Å; T255-I261 VanDerWaalsContact OG1-CG1 3.32Å; T255-I261 WeakPolarHBondContact OG1-CG1 3.45Å; E258-I261 HydrophobicContact CB-CG2 3.88Å; E258-I261 VanDerWaalsContact O-CG2 3.25Å; E258-I261 WeakPolarHBondContact O-CG2 3.49Å; E258-I261 PolarHBondContact O-N 3.16Å; E258-I261 PolarHBondContact OE2-N 2.92Å; I261-A264 WeakPolarHBondContact O-CB 3.23Å; I261-A264 PolarHBondContact O-N 2.79Å; I261-V265 VanDerWaalsContact O-CG2 3.24Å; I261-V265 WeakPolarHBondContact O-CG2 3.33Å; I261-V265 PolarHBondContact O-N 3.28Å
262	V	91.2	Very high	90.7	Very high	19 Å²	19	44.8 Å²	44.8	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-44.2	176.3	171.5	0	0	0	0	110.8	T255 G256 E258 E259 V265 K266 Y272	T255-V262 HydrophobicContact CG2-CG2 4.34Å; G256-V262 WeakPolarHBondContact O-CG2 3.35Å; E258-V262 WeakPolarHBondContact O-CB 3.26Å; E258-V262 VanDerWaalsContact O-CG2 3.26Å; E258-V262 WeakPolarHBondContact O-CG2 3.25Å; E258-V262 PolarHBondContact O-N 3.32Å; E259-V262 PolarHBondContact O-N 3.21Å; V262-V265 PolarHBondContact O-N 3.05Å; V262-K266 HydrophobicContact CG1-CD 4.2Å; V262-K266 WeakPolarHBondContact O-CG 3.23Å; V262-K266 PolarHBondContact O-N 3.07Å; V262-Y272 HydrophobicContact CG1-CE2 4.29Å
263	K	93.7	Very high	90.6	Very high	97 Å²	97	43.9 Å²	43.9	42%	0.422	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-43	174.7	-173.3	-178.8	179.7	-144.2	0	110.8	A230 E231 E259 R260 V265 K266 M267	A230-K263 HydrophobicContact CB-CB 3.7Å; A230-K263 HydrophobicContact CB-CD 3.62Å; A230-K263 HydrophobicContact CB-CG 3.7Å; E231-K263 IonicContact OE1-NZ 3.19Å; E231-K263 PolarHBondContact OE1-NZ 2.77Å; E231-K263 IonicContact OE2-NZ 2.74Å; E259-K263 VanDerWaalsContact O-CB 3.24Å; E259-K263 WeakPolarHBondContact O-CB 3.47Å; E259-K263 PolarHBondContact O-N 3.35Å; R260-K263 PolarHBondContact O-N 2.76Å; K263-V265 PolarHBondContact O-N 3.24Å; K263-K266 PolarHBondContact O-N 2.64Å; K263-M267 HydrophobicContact CG-SD 4.42Å; K263-M267 VanDerWaalsContact O-CG 3.25Å; K263-M267 WeakPolarHBondContact O-CG 3.31Å; K263-M267 PolarHBondContact O-N 2.85Å
264	A	95.1	Very high	90.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-41.7	177.3	0	0	0	0	0	112.7	A230 L233 I237 R260 I261 M267 L268	A230-A264 HydrophobicContact CB-CB 4.42Å; A230-A264 VanDerWaalsContact O-CB 3.22Å; A230-A264 WeakPolarHBondContact O-CB 3.31Å; L233-A264 HydrophobicContact CB-CB 3.68Å; I237-A264 HydrophobicContact CD1-CB 4.49Å; R260-A264 WeakPolarHBondContact O-CB 3.41Å; R260-A264 PolarHBondContact O-N 2.91Å; I261-A264 WeakPolarHBondContact O-CB 3.23Å; I261-A264 PolarHBondContact O-N 2.79Å; A264-M267 PolarHBondContact O-N 3.41Å; A264-L268 WeakPolarHBondContact O-CG 3.41Å; A264-L268 PolarHBondContact O-N 3.44Å
265	V	93.9	Very high	90.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-42.5	176.6	174.5	0	0	0	0	111.2	F189 V253 T255 I261 V262 K263 M267 L268 L270 Y272	F189-V265 HydrophobicContact CD2-CG2 3.69Å; F189-V265 HydrophobicContact CE2-CG2 3.77Å; V253-V265 HydrophobicContact CB-CG1 4.41Å; V253-V265 HydrophobicContact CG1-CG2 4.34Å; T255-V265 HydrophobicContact CG2-CG2 4.35Å; I261-V265 VanDerWaalsContact O-CG2 3.24Å; I261-V265 WeakPolarHBondContact O-CG2 3.33Å; I261-V265 PolarHBondContact O-N 3.28Å; V262-V265 PolarHBondContact O-N 3.05Å; K263-V265 PolarHBondContact O-N 3.24Å; V265-M267 VanDerWaalsContact C-N 3.33Å; V265-M267 PolarHBondContact O-N 3.22Å; V265-L268 PolarHBondContact O-N 3.02Å; V265-L268 VanDerWaalsContact O-N 3.15Å; V265-L270 HydrophobicContact CG1-CB 4.05Å; V265-L270 PolarHBondContact O-N 3.2Å; V265-Y272 HydrophobicContact CG1-CD1 4.48Å; V265-Y272 HydrophobicContact CG1-CG 4.29Å
266	K	93.1	Very high	90	Very high	125 Å²	125	44.4 Å²	44.4	54%	0.543	22%	0.22	S	C	.	.	H	α-helix	trans	-62	-38.4	175.1	-72.8	175.1	178.6	-178.6	0	112.4	V262 K263 L268 D269 Y272	V262-K266 HydrophobicContact CG1-CD 4.2Å; V262-K266 WeakPolarHBondContact O-CG 3.23Å; V262-K266 PolarHBondContact O-N 3.07Å; K263-K266 PolarHBondContact O-N 2.64Å; K266-L268 PolarHBondContact O-N 2.88Å; K266-D269 PolarHBondContact O-N 3.32Å; K266-D269 VanDerWaalsContact O-N 3.1Å; K266-Y272 HydrophobicContact CG-CE1 4.34Å
267	M	95.6	Very high	89.9	Confident	91 Å²	91	44.7 Å²	44.7	45%	0.448	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-23.5	176	-72.5	175.7	76.5	0	0	113.6	A230 E231 K263 A264 V265 D269	A230-M267 HydrophobicContact CB-SD 4.27Å; E231-M267 HydrophobicContact CB-CE 4.18Å; E231-M267 HydrophobicContact CG-CE 3.62Å; E231-M267 HydrophobicContact CG-SD 4.22Å; K263-M267 HydrophobicContact CG-SD 4.42Å; K263-M267 VanDerWaalsContact O-CG 3.25Å; K263-M267 WeakPolarHBondContact O-CG 3.31Å; K263-M267 PolarHBondContact O-N 2.85Å; A264-M267 PolarHBondContact O-N 3.41Å; V265-M267 VanDerWaalsContact C-N 3.33Å; V265-M267 PolarHBondContact O-N 3.22Å; M267-D269 VanDerWaalsContact C-N 3.35Å
268	L	94.2	Very high	89.8	Confident	35 Å²	35	43.9 Å²	43.9	18%	0.183	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	2.3	176.8	-65.1	174	0	0	0	113.5	I237 A238 A264 V265 K266 L270	I237-L268 HydrophobicContact CB-CD1 3.74Å; I237-L268 HydrophobicContact CD1-CD1 4.47Å; I237-L268 HydrophobicContact CG2-CD1 3.41Å; I237-L268 VanDerWaalsContact CG2-CD1 3.41Å; A238-L268 HydrophobicContact CB-CD2 3.88Å; A264-L268 WeakPolarHBondContact O-CG 3.41Å; A264-L268 PolarHBondContact O-N 3.44Å; V265-L268 PolarHBondContact O-N 3.02Å; V265-L268 VanDerWaalsContact O-N 3.15Å; K266-L268 PolarHBondContact O-N 2.88Å; L268-L270 HydrophobicContact CB-CD1 3.9Å; L268-L270 HydrophobicContact CB-CG 3.86Å; L268-L270 HydrophobicContact CD1-CD1 4.09Å; L268-L270 PolarHBondContact O-N 2.91Å
269	D	92.6	Very high	90.1	Very high	155 Å²	155	42.5 Å²	42.5	83%	0.829	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	36.6	-175.4	-161.5	33.1	0	0	0	113	K266 M267	K266-D269 PolarHBondContact O-N 3.32Å; K266-D269 VanDerWaalsContact O-N 3.1Å; M267-D269 VanDerWaalsContact C-N 3.35Å
270	L	91.6	Very high	90.1	Very high	25 Å²	25	36.5 Å²	36.5	13%	0.131	18%	0.183	C	C	.	.			trans	-95.4	127.4	177.8	-64.9	175.2	0	0	0	110.2	L241 V250 V253 V265 L268 Y272	L241-L270 HydrophobicContact CD1-CD1 3.97Å; V250-L270 HydrophobicContact CB-CD2 4.29Å; V250-L270 HydrophobicContact CG1-CD2 4.17Å; V253-L270 HydrophobicContact CG2-CB 4Å; V253-L270 HydrophobicContact CG2-CD1 3.86Å; V253-L270 HydrophobicContact CG2-CG 4.46Å; V265-L270 HydrophobicContact CG1-CB 4.05Å; V265-L270 PolarHBondContact O-N 3.2Å; L268-L270 HydrophobicContact CB-CD1 3.9Å; L268-L270 HydrophobicContact CB-CG 3.86Å; L268-L270 HydrophobicContact CD1-CD1 4.09Å; L268-L270 PolarHBondContact O-N 2.91Å; L270-Y272 PolarHBondContact O-N 2.67Å
271	A	89.9	Confident	89.8	Confident	49 Å²	49	34.4 Å²	34.4	41%	0.405	18%	0.176	S	C	.	.			trans	-60.8	130.2	169.3	0	0	0	0	0	109.8	R252 V253	R252-A271 CarbonylContact C-O 3.48Å; R252-A271 WeakPolarHBondContact CA-O 3.37Å; V253-A271 PolarHBondContact N-O 3.4Å
272	Y	90.2	Very high	89.6	Confident	48 Å²	48	34.8 Å²	34.8	19%	0.188	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151	-175.8	83.3	-83.7	0	0	0	113.3	V253 T255 V262 V265 K266 L270 P274	V253-Y272 CarbonylContact O-C 3Å; V253-Y272 WeakPolarHBondContact O-CA 3.22Å; V253-Y272 WeakPolarHBondContact O-CB 3.42Å; T255-Y272 HydrophobicContact CG2-CD2 3.96Å; V262-Y272 HydrophobicContact CG1-CE2 4.29Å; V265-Y272 HydrophobicContact CG1-CD1 4.48Å; V265-Y272 HydrophobicContact CG1-CG 4.29Å; K266-Y272 HydrophobicContact CG-CE1 4.34Å; L270-Y272 PolarHBondContact O-N 2.67Å; Y272-P274 HydrophobicContact CD2-CG 4.3Å; Y272-P274 HydrophobicContact CE2-CG 3.81Å
273	L	89.8	Confident	89.5	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120	170.9	179.6	65.7	0	0	0	108	R252 V253 T254 T255 I489 L535 L539 L540 I698	R252-L273 HydrophobicContact CG-CB 4.23Å; V253-L273 PolarHBondContact O-N 3.32Å; T254-L273 CarbonylContact C-O 3.55Å; T254-L273 WeakPolarHBondContact CA-O 3.21Å; T254-L273 WeakPolarHBondContact CG2-O 3.1Å; T255-L273 PolarHBondContact N-O 2.92Å; L273-I489 HydrophobicContact CD2-CD1 3.74Å; L273-I489 HydrophobicContact CD2-CG1 4.35Å; L273-L535 HydrophobicContact CD1-CD2 4.17Å; L273-L539 HydrophobicContact CD2-CD2 4.48Å; L273-L540 HydrophobicContact CD1-CD2 4.41Å; L273-I698 HydrophobicContact CD2-CG2 4.19Å
274	P	88.6	Confident	89.3	Confident	8 Å²	8	29.2 Å²	29.2	5%	0.052	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	138.5	168.5	-26.2	32.8	0	0	0	112.6	T255 L257 Y272 F276 I279 L535	T255-P274 CarbonylContact O-C 3.51Å; L257-P274 HydrophobicContact CD2-CB 3.83Å; Y272-P274 HydrophobicContact CD2-CG 4.3Å; Y272-P274 HydrophobicContact CE2-CG 3.81Å; P274-F276 PolarHBondContact O-N 3.12Å; P274-I279 HydrophobicContact CB-CD1 3.8Å; P274-I279 HydrophobicContact CB-CG1 4.34Å; P274-L535 HydrophobicContact CB-CD2 4.09Å; P274-L535 HydrophobicContact CG-CD2 3.6Å; P274-L535 HydrophobicContact CG-CG 4.14Å
275	C	87.4	Confident	89	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.014	16%	0.161	C	C	.	.			trans	-62.5	120.4	179.1	176.9	0	0	0	0	111.3	T255 A277 Q278 I279 S702	T255-C275 VanDerWaalsContact O-CB 3.31Å; T255-C275 WeakPolarHBondContact O-CB 3.35Å; T255-C275 PolarHBondContact O-N 3.26Å; C275-A277 PolarHBondContact O-N 3.49Å; C275-Q278 HydrophobicContact CB-CB 4.1Å; C275-Q278 HydrophobicContact CB-CG 3.94Å; C275-Q278 PolarHBondContact O-N 2.94Å; C275-Q278 VanDerWaalsContact O-N 3.07Å; C275-I279 PolarHBondContact O-N 2.98Å; C275-S702 PolarHBondContact SG-N 3.32Å; C275-S702 PolarHBondContact SG-OG 2.84Å; C275-S702 VanDerWaalsContact SG-OG 3.34Å
276	F	86.3	Confident	88.8	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-42.9	-174.7	-130.8	-101.9	0	0	0	113.2	P274 Q278 I279 L280 L481 A492 E496 Y529 A700 L701	P274-F276 PolarHBondContact O-N 3.12Å; F276-Q278 VanDerWaalsContact C-N 3.28Å; F276-Q278 PolarHBondContact O-N 3Å; F276-I279 PolarHBondContact O-N 2.84Å; F276-L280 WeakPolarHBondContact O-CG 3.43Å; F276-L280 PolarHBondContact O-N 3.28Å; F276-L481 HydrophobicContact CB-CD1 4.17Å; F276-L481 HydrophobicContact CD1-CD1 3.79Å; F276-L481 HydrophobicContact CG-CD1 4.35Å; F276-A492 HydrophobicContact CB-CB 4.37Å; F276-A492 HydrophobicContact CD1-CB 3.86Å; F276-A492 HydrophobicContact CD2-CB 3.79Å; F276-A492 HydrophobicContact CE1-CB 3.92Å; F276-A492 WeakPolarHBondContact CE1-O 3.37Å; F276-A492 HydrophobicContact CE2-CB 3.85Å; F276-A492 HydrophobicContact CG-CB 3.75Å; F276-A492 VanDerWaalsContact CZ-C 3.43Å; F276-A492 HydrophobicContact CZ-CB 3.89Å; F276-A492 WeakPolarHBondContact CZ-O 3.29Å; F276-E496 HydrophobicContact CE1-CB 3.54Å; F276-E496 HydrophobicContact CE1-CG 4.49Å; F276-E496 HydrophobicContact CZ-CB 3.35Å; F276-E496 HydrophobicContact CZ-CG 4.1Å; F276-Y529 HydrophobicContact CE2-CE1 4.19Å; F276-Y529 WeakPolarHBondContact CE2-OH 3.28Å; F276-Y529 HydrophobicContact CZ-CE1 4.3Å; F276-Y529 WeakPolarHBondContact CZ-OH 3.35Å; F276-A700 HydrophobicContact CB-CB 4.44Å; F276-A700 PolarHBondContact N-O 3.37Å; F276-L701 HydrophobicContact CB-CD2 3.98Å
277	A	83.5	Confident	88.7	Confident	10 Å²	10	30.4 Å²	30.4	8%	0.083	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-33.9	177.6	0	0	0	0	0	112.2	C275 L280 H281 V478 L701	C275-A277 PolarHBondContact O-N 3.49Å; A277-L280 PolarHBondContact O-N 3.05Å; A277-H281 WeakPolarHBondContact O-CB 3.34Å; A277-H281 PolarHBondContact O-N 3.35Å; A277-V478 HydrophobicContact CB-CG1 4.39Å; A277-L701 HydrophobicContact CB-CD1 4.47Å; A277-L701 HydrophobicContact CB-CD2 3.53Å; A277-L701 VanDerWaalsContact N-CD2 3.34Å
278	Q	81.5	Confident	88.5	Confident	30 Å²	30	26.3 Å²	26.3	14%	0.14	14%	0.139	C	C	.	.	H	α-helix	trans	-72.5	-34.9	176.1	-65.5	-166.1	0.4	0	0	112.1	G256 L257 C275 F276 H281 A282 F339	G256-Q278 VanDerWaalsContact C-OE1 3.29Å; L257-Q278 HydrophobicContact CD1-CB 4.19Å; L257-Q278 HydrophobicContact CG-CB 4.17Å; C275-Q278 HydrophobicContact CB-CB 4.1Å; C275-Q278 HydrophobicContact CB-CG 3.94Å; C275-Q278 PolarHBondContact O-N 2.94Å; C275-Q278 VanDerWaalsContact O-N 3.07Å; F276-Q278 VanDerWaalsContact C-N 3.28Å; F276-Q278 PolarHBondContact O-N 3Å; Q278-H281 PolarHBondContact O-N 3.46Å; Q278-A282 WeakPolarHBondContact O-CB 2.97Å; Q278-A282 PolarHBondContact O-N 3.02Å; Q278-F339 HydrophobicContact CB-CE1 4.43Å; Q278-F339 HydrophobicContact CB-CZ 4.43Å; Q278-F339 HydrophobicContact CG-CE1 4.07Å; Q278-F339 HydrophobicContact CG-CZ 3.97Å
279	I	86.9	Confident	88.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-49.8	170.9	-64.8	159.6	0	0	0	110.2	L257 P274 C275 F276 H281 A282 V283 F528 Y529 L535	L257-I279 HydrophobicContact CD1-CG1 4.22Å; L257-I279 HydrophobicContact CD2-CG1 4.25Å; P274-I279 HydrophobicContact CB-CD1 3.8Å; P274-I279 HydrophobicContact CB-CG1 4.34Å; C275-I279 PolarHBondContact O-N 2.98Å; F276-I279 PolarHBondContact O-N 2.84Å; I279-H281 VanDerWaalsContact C-N 3.25Å; I279-H281 PolarHBondContact O-N 3.01Å; I279-A282 PolarHBondContact O-N 3.16Å; I279-A282 VanDerWaalsContact O-N 3.08Å; I279-V283 HydrophobicContact CG2-CG2 4.21Å; I279-V283 WeakPolarHBondContact O-CG2 3.49Å; I279-V283 PolarHBondContact O-N 2.8Å; I279-F528 HydrophobicContact CG1-CD1 4.24Å; I279-F528 HydrophobicContact CG2-CB 3.84Å; I279-F528 HydrophobicContact CG2-CD1 3.99Å; I279-F528 HydrophobicContact CG2-CD2 4.08Å; I279-F528 HydrophobicContact CG2-CG 3.72Å; I279-Y529 HydrophobicContact CG2-CE2 3.57Å; I279-L535 HydrophobicContact CD1-CD1 3.36Å; I279-L535 HydrophobicContact CD1-CD2 4.38Å; I279-L535 HydrophobicContact CD1-CG 4.47Å; I279-L535 HydrophobicContact CG1-CD1 4.36Å
280	L	86.9	Confident	88.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-40.3	177	-66.7	-176.7	0	0	0	111.4	F276 A277 V283 V284 F474 A477 V478 L499 F525	F276-L280 WeakPolarHBondContact O-CG 3.43Å; F276-L280 PolarHBondContact O-N 3.28Å; A277-L280 PolarHBondContact O-N 3.05Å; L280-V283 PolarHBondContact O-N 3.12Å; L280-V284 WeakPolarHBondContact O-CG2 3.47Å; L280-V284 PolarHBondContact O-N 3.31Å; L280-F474 HydrophobicContact CD2-CD1 4.17Å; L280-F474 HydrophobicContact CD2-CE1 4.45Å; L280-A477 HydrophobicContact CD1-CB 4.01Å; L280-V478 HydrophobicContact CB-CG2 4.39Å; L280-V478 HydrophobicContact CD1-CG2 3.9Å; L280-L499 HydrophobicContact CD1-CD1 4.08Å; L280-L499 HydrophobicContact CD2-CD1 3.6Å; L280-F525 HydrophobicContact CD2-CE1 3.93Å; L280-F525 HydrophobicContact CD2-CZ 3.89Å
281	H	84.2	Confident	87.9	Confident	24 Å²	24	20.7 Å²	20.7	11%	0.111	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-47.6	173.5	-179.3	82.8	0	0	0	112.1	A277 Q278 I279 V283 V284 S285 F339 W416	A277-H281 WeakPolarHBondContact O-CB 3.34Å; A277-H281 PolarHBondContact O-N 3.35Å; Q278-H281 PolarHBondContact O-N 3.46Å; I279-H281 VanDerWaalsContact C-N 3.25Å; I279-H281 PolarHBondContact O-N 3.01Å; H281-V283 PolarHBondContact O-N 3.13Å; H281-V284 PolarHBondContact O-N 3.45Å; H281-S285 PolarHBondContact CE1-OG 2.89Å; H281-S285 PolarHBondContact NE2-OG 3.15Å; H281-S285 VanDerWaalsContact NE2-OG 3.16Å; H281-S285 WeakPolarHBondContact O-CB 3.5Å; H281-S285 PolarHBondContact O-N 2.95Å; H281-S285 PolarHBondContact O-OG 2.85Å; H281-F339 HydrophobicContact CB-CE2 4.22Å; H281-F339 HydrophobicContact CB-CZ 4.16Å; H281-F339 AromaticContact CD2-CD2 3.53Å; H281-F339 AromaticContact CD2-CE2 3.31Å; H281-F339 WeakPolarHBondContact CD2-CE2 3.44Å; H281-F339 AromaticContact CD2-CZ 3.65Å; H281-F339 AromaticContact CE1-CD2 3.79Å; H281-F339 AromaticContact CE1-CE2 3.82Å; H281-F339 AromaticContact CG-CE2 3.5Å; H281-F339 AromaticContact CG-CZ 3.85Å; H281-F339 AromaticContact ND1-CE2 3.8Å; H281-F339 AromaticContact NE2-CD2 3.34Å; H281-F339 VanDerWaalsContact NE2-CD2 3.34Å; H281-F339 WeakPolarHBondContact NE2-CD2 3.23Å; H281-F339 AromaticContact NE2-CE2 3.58Å; H281-F339 AromaticContact NE2-CG 3.95Å; H281-W416 AromaticContact CE1-CD1 3.88Å; H281-W416 AromaticContact CG-NE1 3.91Å; H281-W416 AromaticContact ND1-CD1 3.33Å; H281-W416 VanDerWaalsContact ND1-CD1 3.33Å; H281-W416 AromaticContact ND1-NE1 3.3Å; H281-W416 PolarHBondContact ND1-NE1 3.18Å
282	A	84.6	Confident	87	Confident	8 Å²	8	22.2 Å²	22.2	7%	0.066	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-42.6	177.8	0	0	0	0	0	112	L257 Q278 I279 R286 F528	L257-A282 HydrophobicContact CD1-CB 4.28Å; Q278-A282 WeakPolarHBondContact O-CB 2.97Å; Q278-A282 PolarHBondContact O-N 3.02Å; I279-A282 PolarHBondContact O-N 3.16Å; I279-A282 VanDerWaalsContact O-N 3.08Å; A282-R286 WeakPolarHBondContact O-CB 3.35Å; A282-R286 VanDerWaalsContact O-CG 3.24Å; A282-R286 WeakPolarHBondContact O-CG 3.46Å; A282-R286 PolarHBondContact O-N 3.41Å; A282-F528 HydrophobicContact CB-CE2 3.75Å; A282-F528 HydrophobicContact CB-CZ 3.47Å; A282-F528 VanDerWaalsContact CB-CZ 3.47Å
283	V	89.8	Confident	85.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-50.6	177	168	0	0	0	0	111	I279 L280 H281 G287 F474 L521 Q524 F525 F528	I279-V283 HydrophobicContact CG2-CG2 4.21Å; I279-V283 WeakPolarHBondContact O-CG2 3.49Å; I279-V283 PolarHBondContact O-N 2.8Å; L280-V283 PolarHBondContact O-N 3.12Å; H281-V283 PolarHBondContact O-N 3.13Å; V283-G287 VanDerWaalsContact O-CA 3.31Å; V283-G287 WeakPolarHBondContact O-CA 3.38Å; V283-G287 PolarHBondContact O-N 3.2Å; V283-F474 HydrophobicContact CG1-CE1 4Å; V283-L521 HydrophobicContact CG1-CD2 4.09Å; V283-Q524 HydrophobicContact CB-CB 4.29Å; V283-Q524 HydrophobicContact CG1-CB 4.1Å; V283-Q524 HydrophobicContact CG2-CB 4.25Å; V283-F525 HydrophobicContact CG1-CD1 4.34Å; V283-F525 HydrophobicContact CG1-CD2 3.72Å; V283-F525 HydrophobicContact CG1-CE1 4.35Å; V283-F525 HydrophobicContact CG1-CE2 3.76Å; V283-F525 HydrophobicContact CG1-CG 4.03Å; V283-F525 HydrophobicContact CG1-CZ 4.06Å; V283-F525 HydrophobicContact CG2-CD1 4.06Å; V283-F525 HydrophobicContact CG2-CE1 4.29Å; V283-F525 HydrophobicContact CG2-CG 4.31Å; V283-F528 HydrophobicContact CG2-CD2 3.7Å; V283-F528 HydrophobicContact CG2-CE2 4.08Å
284	V	90.4	Very high	83.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.7	-50.1	-178.2	176.4	0	0	0	0	111.5	L280 H281 R286 G287 L288 W291 W416 L471 F474 L521	L280-V284 WeakPolarHBondContact O-CG2 3.47Å; L280-V284 PolarHBondContact O-N 3.31Å; H281-V284 PolarHBondContact O-N 3.45Å; V284-R286 PolarHBondContact O-N 3.26Å; V284-G287 PolarHBondContact O-N 3.44Å; V284-L288 HydrophobicContact CG1-CD1 3.85Å; V284-L288 HydrophobicContact CG1-CG 4.44Å; V284-L288 WeakPolarHBondContact O-CG 3.38Å; V284-L288 PolarHBondContact O-N 3.01Å; V284-W291 HydrophobicContact CG1-CH2 4.14Å; V284-W291 HydrophobicContact CG1-CZ3 4.06Å; V284-W416 HydrophobicContact CB-CD2 4.13Å; V284-W416 HydrophobicContact CB-CG 4.13Å; V284-W416 HydrophobicContact CG1-CB 3.8Å; V284-W416 HydrophobicContact CG1-CD2 3.68Å; V284-W416 HydrophobicContact CG1-CE3 4.13Å; V284-W416 HydrophobicContact CG1-CG 3.53Å; V284-W416 HydrophobicContact CG2-CD2 4.41Å; V284-W416 HydrophobicContact CG2-CZ2 4.31Å; V284-L471 HydrophobicContact CG1-CD2 3.59Å; V284-F474 HydrophobicContact CG2-CB 4.08Å; V284-F474 HydrophobicContact CG2-CD1 3.36Å; V284-F474 HydrophobicContact CG2-CD2 4.33Å; V284-F474 HydrophobicContact CG2-CE1 3.74Å; V284-F474 HydrophobicContact CG2-CG 3.68Å; V284-F474 HydrophobicContact CG2-CZ 4.37Å; V284-L521 HydrophobicContact CB-CD2 4.48Å; V284-L521 HydrophobicContact CG2-CD2 4.25Å
285	S	87.4	Confident	81.9	Confident	23 Å²	23	30 Å²	30	16%	0.161	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-46.1	-176.4	-64.6	0	0	0	0	111.7	H281 N289	H281-S285 PolarHBondContact CE1-OG 2.89Å; H281-S285 PolarHBondContact NE2-OG 3.15Å; H281-S285 VanDerWaalsContact NE2-OG 3.16Å; H281-S285 WeakPolarHBondContact O-CB 3.5Å; H281-S285 PolarHBondContact O-N 2.95Å; H281-S285 PolarHBondContact O-OG 2.85Å; S285-N289 WeakPolarHBondContact O-CA 3.38Å; S285-N289 PolarHBondContact O-N 2.91Å
286	R	89.6	Confident	79.6	Confident	121 Å²	121	33.9 Å²	33.9	46%	0.457	19%	0.189	S	C	.	.	H	α-helix	trans	-75.9	-36.9	178.9	-61.9	174.2	-178.7	165.3	-0.6	112.2	A282 V284 Q524	A282-R286 WeakPolarHBondContact O-CB 3.35Å; A282-R286 VanDerWaalsContact O-CG 3.24Å; A282-R286 WeakPolarHBondContact O-CG 3.46Å; A282-R286 PolarHBondContact O-N 3.41Å; V284-R286 PolarHBondContact O-N 3.26Å; R286-Q524 HydrophobicContact CB-CG 4.25Å
287	G	91.1	Very high	77.2	Confident	6 Å²	6	42.3 Å²	42.3	6%	0.062	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-44	-176.8	0	0	0	0	0	112.3	V283 V284 N520	V283-G287 VanDerWaalsContact O-CA 3.31Å; V283-G287 WeakPolarHBondContact O-CA 3.38Å; V283-G287 PolarHBondContact O-N 3.2Å; V284-G287 PolarHBondContact O-N 3.44Å; G287-N520 WeakPolarHBondContact O-CB 3.43Å
288	L	92.2	Very high	75.1	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-90	-26.1	-179.4	-49.8	179.7	0	0	0	112.4	V284 L290 W291 L467 V470 L471 L517 L521	V284-L288 HydrophobicContact CG1-CD1 3.85Å; V284-L288 HydrophobicContact CG1-CG 4.44Å; V284-L288 WeakPolarHBondContact O-CG 3.38Å; V284-L288 PolarHBondContact O-N 3.01Å; L288-L290 HydrophobicContact CB-CD1 4.12Å; L288-L290 HydrophobicContact CB-CG 3.98Å; L288-L290 WeakPolarHBondContact O-CG 3.4Å; L288-L290 PolarHBondContact O-N 2.9Å; L288-L290 VanDerWaalsContact O-N 3.16Å; L288-W291 HydrophobicContact CB-CH2 4.4Å; L288-W291 HydrophobicContact CB-CZ3 3.9Å; L288-W291 HydrophobicContact CD1-CH2 3.9Å; L288-W291 HydrophobicContact CD1-CZ3 4.08Å; L288-W291 HydrophobicContact CG-CZ3 4.48Å; L288-L467 HydrophobicContact CD1-CD1 4.3Å; L288-V470 HydrophobicContact CD2-CG1 4.46Å; L288-L471 HydrophobicContact CD1-CD2 3.54Å; L288-L471 HydrophobicContact CD1-CG 4.38Å; L288-L517 HydrophobicContact CD2-CB 3.81Å; L288-L517 HydrophobicContact CD2-CD1 4.46Å; L288-L517 HydrophobicContact CD2-CD2 3.87Å; L288-L517 HydrophobicContact CD2-CG 4.21Å; L288-L521 HydrophobicContact CD2-CD1 4.02Å; L288-L521 HydrophobicContact CD2-CD2 3.96Å; L288-L521 HydrophobicContact CD2-CG 3.83Å; L288-L521 HydrophobicContact CG-CD2 4.01Å; L288-L521 HydrophobicContact CG-CG 4.43Å
289	N	90.5	Very high	73.2	Confident	77 Å²	77	46.1 Å²	46.1	41%	0.412	25%	0.246	S	C	.	.			trans	52.5	37.4	177	-167.2	17.6	0	0	0	113.3	S285 R358	S285-N289 WeakPolarHBondContact O-CA 3.38Å; S285-N289 PolarHBondContact O-N 2.91Å; N289-R358 PolarHBondContact ND2-NH2 3.3Å; N289-R358 PolarHBondContact O-NE 3.03Å; N289-R358 PolarHBondContact O-NH2 3.2Å; N289-R358 PolarHBondContact OD1-NH2 2.9Å
290	L	89.3	Confident	70.6	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	28%	0.276	C	S	.	.			trans	-96.4	-9.7	-177.8	-61.6	178.4	0	0	0	113.7	L288 R358 C361 L362 L365 L467	L288-L290 HydrophobicContact CB-CD1 4.12Å; L288-L290 HydrophobicContact CB-CG 3.98Å; L288-L290 WeakPolarHBondContact O-CG 3.4Å; L288-L290 PolarHBondContact O-N 2.9Å; L288-L290 VanDerWaalsContact O-N 3.16Å; L290-R358 HydrophobicContact CD2-CG 3.99Å; L290-C361 HydrophobicContact CD1-CB 3.95Å; L290-C361 HydrophobicContact CD2-CB 3.58Å; L290-C361 HydrophobicContact CG-CB 4.44Å; L290-L362 HydrophobicContact CB-CD2 4.29Å; L290-L362 HydrophobicContact CD2-CD2 4.17Å; L290-L362 HydrophobicContact CD2-CG 4.01Å; L290-L362 VanDerWaalsContact O-CD2 3.22Å; L290-L362 WeakPolarHBondContact O-CD2 3.45Å; L290-L365 HydrophobicContact CB-CD1 4.41Å; L290-L365 HydrophobicContact CD1-CD1 4.35Å; L290-L467 HydrophobicContact CD1-CD1 3.79Å; L290-L467 HydrophobicContact CD1-CD2 3.96Å
291	W	85.9	Confident	68	Low	17 Å²	17	58 Å²	58	6%	0.064	30%	0.302	C	S	.	.	S	Bend	trans	-115	134.2	-175.8	-58.5	-90.7	0	0	0	109.4	V284 L288 W416 T419 L471	V284-W291 HydrophobicContact CG1-CH2 4.14Å; V284-W291 HydrophobicContact CG1-CZ3 4.06Å; L288-W291 HydrophobicContact CB-CH2 4.4Å; L288-W291 HydrophobicContact CB-CZ3 3.9Å; L288-W291 HydrophobicContact CD1-CH2 3.9Å; L288-W291 HydrophobicContact CD1-CZ3 4.08Å; L288-W291 HydrophobicContact CG-CZ3 4.48Å; W291-W416 HydrophobicContact CD2-CB 4.09Å; W291-W416 HydrophobicContact CE3-CB 4.17Å; W291-W416 HydrophobicContact CH2-CB 3.42Å; W291-W416 VanDerWaalsContact CH2-CB 3.42Å; W291-W416 VanDerWaalsContact CZ2-CA 3.45Å; W291-W416 HydrophobicContact CZ2-CB 3.3Å; W291-W416 HydrophobicContact CZ3-CB 3.83Å; W291-T419 HydrophobicContact CZ2-CG2 4.19Å; W291-T419 PolarHBondContact NE1-OG1 3.41Å; W291-L471 HydrophobicContact CH2-CD1 4.5Å; W291-L471 HydrophobicContact CH2-CD2 4.16Å
292	P	71.8	Confident	65.6	Low	80 Å²	80	58.3 Å²	58.3	52%	0.519	31%	0.309	S	S	.	.			trans	-62.4	141.5	176.2	26.7	-34.2	0	0	0	110.3	R294 Q413	P292-R294 PolarHBondContact O-N 2.93Å; P292-Q413 WeakPolarHBondContact CD-O 3.44Å
293	V	61.6	Low	63.2	Low	116 Å²	116	61.2 Å²	61.2	70%	0.703	33%	0.326	S	S	*	.			trans	-69	123.5	165	-177.3	0	0	0	0	106.8	T295	V293-T295 PolarHBondContact O-N 3.24Å; V293-T295 VanDerWaalsContact O-N 3.09Å
294	R	51.5	Low	60.5	Low	39 Å²	39	67.6 Å²	67.6	15%	0.147	35%	0.354	C	S	.	.			trans	-63.6	113.6	174.6	-95.7	-176.8	159.4	-175.5	0.2	108.6	P292 E337 Y414	P292-R294 PolarHBondContact O-N 2.93Å; R294-E337 PolarHBondContact NH1-O 3.04Å; R294-Y414 PolarHBondContact NH2-OH 3.09Å
295	T	47.5	Very low	57.6	Low	68 Å²	68	77.1 Å²	77.1	42%	0.417	39%	0.389	S	S	.	.			trans	-84.6	151.6	165.5	67.8	0	0	0	0	109.1	V293 Y297 D298	V293-T295 PolarHBondContact O-N 3.24Å; V293-T295 VanDerWaalsContact O-N 3.09Å; T295-Y297 PolarHBondContact O-N 3.19Å; T295-D298 PolarHBondContact O-N 3.38Å; T295-D298 VanDerWaalsContact O-N 3.15Å; T295-D298 PolarHBondContact OG1-OD2 2.96Å; T295-D298 VanDerWaalsContact OG1-OD2 3.05Å
296	S	40.3	Very low	55	Low	83 Å²	83	80 Å²	80	58%	0.58	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-21.2	176.2	62.3	0	0	0	0	114
297	Y	33.9	Very low	52.1	Low	179 Å²	179	83.5 Å²	83.5	70%	0.702	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-35.8	179.4	-76	-88.5	0	0	0	114	T295 A299 K300	T295-Y297 PolarHBondContact O-N 3.19Å; Y297-A299 PolarHBondContact O-N 3.3Å; Y297-K300 PolarHBondContact O-N 2.89Å
298	D	41.1	Very low	49.1	Very low	95 Å²	95	93.1 Å²	93.1	51%	0.508	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-22.3	-177.4	-66	-48.9	0	0	0	113.1	T295 K300 D301 A302	T295-D298 PolarHBondContact O-N 3.38Å; T295-D298 VanDerWaalsContact O-N 3.15Å; T295-D298 PolarHBondContact OG1-OD2 2.96Å; T295-D298 VanDerWaalsContact OG1-OD2 3.05Å; D298-K300 PolarHBondContact O-N 3.15Å; D298-D301 PolarHBondContact O-N 3.42Å; D298-A302 PolarHBondContact O-N 3.44Å
299	A	39.8	Very low	46.3	Very low	25 Å²	25	96.6 Å²	96.6	21%	0.207	48%	0.476	C	S	.	.	H	α-helix	trans	-62.4	-28.7	-180	0	0	0	0	0	113.2	Q195 Y297 D301 T303	Q195-A299 HydrophobicContact CG-CB 4.37Å; Y297-A299 PolarHBondContact O-N 3.3Å; A299-D301 PolarHBondContact O-N 3.31Å; A299-T303 PolarHBondContact O-N 2.84Å; A299-T303 PolarHBondContact O-OG1 3.06Å
300	K	32.6	Very low	43.5	Very low	146 Å²	146	96.3 Å²	96.3	64%	0.635	48%	0.48	S	S	*	.	H	α-helix	trans	-69.9	-28.8	-179.6	-70.4	-179	-179.9	172.7	0	113.3	Y297 D298 T303	Y297-K300 PolarHBondContact O-N 2.89Å; D298-K300 PolarHBondContact O-N 3.15Å; K300-T303 PolarHBondContact O-OG1 2.85Å
301	D	33.6	Very low	40.6	Very low	103 Å²	103	99.4 Å²	99.4	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-87.8	-28.3	178.6	-89.3	-14	0	0	0	112.8	D298 A299 T303 K304 R305	D298-D301 PolarHBondContact O-N 3.42Å; A299-D301 PolarHBondContact O-N 3.31Å; D301-T303 VanDerWaalsContact C-N 3.33Å; D301-T303 PolarHBondContact O-N 2.87Å; D301-K304 PolarHBondContact O-N 3.22Å; D301-K304 IonicContact OD1-NZ 3.02Å; D301-K304 PolarHBondContact OD1-NZ 2.99Å; D301-R305 PolarHBondContact O-N 2.73Å
302	A	33.9	Very low	38	Very low	30 Å²	30	102.4 Å²	102.4	25%	0.248	53%	0.534	C	S	.	.	H	α-helix	trans	-60.4	-42.9	170	0	0	0	0	0	111.4	D298 K304 R305 T306	D298-A302 PolarHBondContact O-N 3.44Å; A302-K304 VanDerWaalsContact C-N 3.33Å; A302-K304 PolarHBondContact O-N 3.25Å; A302-R305 WeakPolarHBondContact O-CB 3.29Å; A302-R305 PolarHBondContact O-N 3.12Å; A302-T306 PolarHBondContact O-N 3.49Å; A302-T306 PolarHBondContact O-OG1 3.04Å
303	T	34.2	Very low	36.1	Very low	70 Å²	70	106.3 Å²	106.3	43%	0.429	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-34	179	8.4	0	0	0	0	113.3	A299 K300 D301 R305 R307	A299-T303 PolarHBondContact O-N 2.84Å; A299-T303 PolarHBondContact O-OG1 3.06Å; K300-T303 PolarHBondContact O-OG1 2.85Å; D301-T303 VanDerWaalsContact C-N 3.33Å; D301-T303 PolarHBondContact O-N 2.87Å; T303-R305 VanDerWaalsContact C-N 3.31Å; T303-R307 PolarHBondContact O-N 3.31Å
304	K	32.2	Very low	34.5	Very low	134 Å²	134	105.6 Å²	105.6	58%	0.583	55%	0.545	S	S	*	.	H	α-helix	trans	-65.7	-35.7	172.6	-70.1	178.5	-166.1	150.9	0	111.8	D301 A302 R308	D301-K304 PolarHBondContact O-N 3.22Å; D301-K304 IonicContact OD1-NZ 3.02Å; D301-K304 PolarHBondContact OD1-NZ 2.99Å; A302-K304 VanDerWaalsContact C-N 3.33Å; A302-K304 PolarHBondContact O-N 3.25Å; K304-R308 PolarHBondContact O-N 2.94Å
305	R	29.3	Very low	33.2	Very low	199 Å²	199	112.6 Å²	112.6	75%	0.751	58%	0.577	S	S	*	*	H	α-helix	trans	-71.5	-43.1	179.5	-131.9	172.4	-172.1	146.8	-0.2	111.5	D301 A302 T303 R307 R308 T309	D301-R305 PolarHBondContact O-N 2.73Å; A302-R305 WeakPolarHBondContact O-CB 3.29Å; A302-R305 PolarHBondContact O-N 3.12Å; T303-R305 VanDerWaalsContact C-N 3.31Å; R305-R307 PolarHBondContact O-N 2.85Å; R305-R308 PolarHBondContact O-N 3.35Å; R305-T309 PolarHBondContact O-N 3.36Å; R305-T309 VanDerWaalsContact O-N 3.13Å; R305-T309 PolarHBondContact O-OG1 2.9Å
306	T	33.4	Very low	32.2	Very low	84 Å²	84	115.1 Å²	115.1	52%	0.515	59%	0.588	S	S	.	*	H	α-helix	trans	-65.1	-38.1	178.5	-39.7	0	0	0	0	112.2	A302 R308 T309 S310	A302-T306 PolarHBondContact O-N 3.49Å; A302-T306 PolarHBondContact O-OG1 3.04Å; T306-R308 VanDerWaalsContact C-N 3.33Å; T306-R308 PolarHBondContact O-N 3.38Å; T306-T309 WeakPolarHBondContact CA-OG1 3.25Å; T306-T309 PolarHBondContact O-N 2.71Å; T306-T309 PolarHBondContact O-OG1 3.15Å; T306-S310 PolarHBondContact O-N 2.69Å; T306-S310 PolarHBondContact O-OG 2.83Å; T306-S310 VanDerWaalsContact O-OG 3.1Å
307	R	29.2	Very low	31.5	Very low	195 Å²	195	117.5 Å²	117.5	74%	0.736	60%	0.602	S	S	*	*	H	α-helix	trans	-62.1	-37.2	173.7	-81.7	-175.6	176.6	177.7	0.5	113.1	T303 R305 S310 A311	T303-R307 PolarHBondContact O-N 3.31Å; R305-R307 PolarHBondContact O-N 2.85Å; R307-S310 WeakPolarHBondContact CA-OG 3.43Å; R307-S310 PolarHBondContact O-OG 3.09Å; R307-A311 WeakPolarHBondContact O-CB 3.32Å; R307-A311 PolarHBondContact O-N 3.14Å; R307-A311 VanDerWaalsContact O-N 3.15Å
308	R	27.8	Very low	31.3	Very low	208 Å²	208	114.9 Å²	114.9	79%	0.785	60%	0.604	S	S	*	*	H	α-helix	trans	-70.1	-37	176.4	-86	-179.9	158.5	171	-5.3	112.2	K304 R305 T306 A312	K304-R308 PolarHBondContact O-N 2.94Å; R305-R308 PolarHBondContact O-N 3.35Å; T306-R308 VanDerWaalsContact C-N 3.33Å; T306-R308 PolarHBondContact O-N 3.38Å; R308-A312 PolarHBondContact O-N 3.16Å
309	T	33.1	Very low	30.7	Very low	78 Å²	78	115.1 Å²	115.1	48%	0.479	61%	0.613	S	S	.	*	H	α-helix	trans	-72.9	-34.7	176.6	45.4	0	0	0	0	113.3	R305 T306 A312 Q313	R305-T309 PolarHBondContact O-N 3.36Å; R305-T309 VanDerWaalsContact O-N 3.13Å; R305-T309 PolarHBondContact O-OG1 2.9Å; T306-T309 WeakPolarHBondContact CA-OG1 3.25Å; T306-T309 PolarHBondContact O-N 2.71Å; T306-T309 PolarHBondContact O-OG1 3.15Å; T309-A312 PolarHBondContact O-N 2.95Å; T309-Q313 WeakPolarHBondContact O-CG 3.12Å; T309-Q313 PolarHBondContact O-N 2.87Å
310	S	31	Very low	30	Very low	71 Å²	71	118 Å²	118	50%	0.497	65%	0.645	S	S	.	*	H	α-helix	trans	-71.5	-30.4	174.2	53.8	0	0	0	0	113	T306 R307	T306-S310 PolarHBondContact O-N 2.69Å; T306-S310 PolarHBondContact O-OG 2.83Å; T306-S310 VanDerWaalsContact O-OG 3.1Å; R307-S310 WeakPolarHBondContact CA-OG 3.43Å; R307-S310 PolarHBondContact O-OG 3.09Å
311	A	29.8	Very low	29.7	Very low	67 Å²	67	116.5 Å²	116.5	55%	0.554	64%	0.644	S	S	*	*	H	α-helix	trans	-74.2	-25.4	174	0	0	0	0	0	113	R307 Q313 S314	R307-A311 WeakPolarHBondContact O-CB 3.32Å; R307-A311 PolarHBondContact O-N 3.14Å; R307-A311 VanDerWaalsContact O-N 3.15Å; A311-Q313 VanDerWaalsContact C-N 3.34Å; A311-S314 PolarHBondContact O-OG 2.85Å
312	A	30.5	Very low	29.4	Very low	80 Å²	80	120.3 Å²	120.3	66%	0.661	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-10.9	175.9	0	0	0	0	0	113.8	R308 T309	R308-A312 PolarHBondContact O-N 3.16Å; T309-A312 PolarHBondContact O-N 2.95Å
313	Q	31.2	Very low	29	Very low	162 Å²	162	123.1 Å²	123.1	76%	0.757	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	5.4	179.7	-74.4	176.4	-5.9	0	0	113.8	T309 A311 F315	T309-Q313 WeakPolarHBondContact O-CG 3.12Å; T309-Q313 PolarHBondContact O-N 2.87Å; A311-Q313 VanDerWaalsContact C-N 3.34Å; Q313-F315 PolarHBondContact O-N 2.95Å
314	S	27.9	Very low	28.6	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	69%	0.687	S	S	*	*			trans	-82.7	21.6	176.7	70	0	0	0	0	114.3	A311	A311-S314 PolarHBondContact O-OG 2.85Å
315	F	25.2	Very low	28.4	Very low	187 Å²	187	130 Å²	130	82%	0.82	69%	0.692	S	S	*	*	S	Bend	trans	-105.9	109	-179.2	-125.2	-96.4	0	0	0	111.2	Q313	Q313-F315 PolarHBondContact O-N 2.95Å
316	N	26.5	Very low	28.4	Very low	121 Å²	121	127.3 Å²	127.3	65%	0.647	69%	0.687	S	S	*	*			trans	28.3	111.1	163.6	-97.7	-18.8	0	0	0	119.8	T318	N316-T318 VanDerWaalsContact C-N 3.33Å; N316-T318 PolarHBondContact O-N 3.34Å
317	P	26.3	Very low	28.3	Very low	133 Å²	133	130 Å²	130	86%	0.864	69%	0.694	S	S	*	*	S	Bend	trans	-82.2	74.6	171.6	35	-31	0	0	0	110.5
318	T	27.9	Very low	28.3	Very low	123 Å²	123	123.9 Å²	123.9	76%	0.755	68%	0.679	S	S	*	*			trans	-134.1	12	174	48.7	0	0	0	0	114.4	N316	N316-T318 VanDerWaalsContact C-N 3.33Å; N316-T318 PolarHBondContact O-N 3.34Å
319	S	28.8	Very low	28.5	Very low	100 Å²	100	115.4 Å²	115.4	70%	0.699	65%	0.651	S	S	*	*	S	Bend	trans	-128.2	118.4	171.3	68.5	0	0	0	0	111.2	N321	S319-N321 VanDerWaalsContact C-N 3.25Å; S319-N321 PolarHBondContact O-N 2.75Å
320	G	25.5	Very low	28.6	Very low	85 Å²	85	114.1 Å²	114.1	88%	0.876	64%	0.637	S	S	*	*			trans	-74.5	59.2	-170.4	0	0	0	0	0	115.2
321	N	26.6	Very low	28.7	Very low	116 Å²	116	111 Å²	111	62%	0.62	62%	0.615	S	S	*	*			trans	-123.7	73.2	172.8	-80.2	-34.3	0	0	0	110.3	S319	S319-N321 VanDerWaalsContact C-N 3.25Å; S319-N321 PolarHBondContact O-N 2.75Å
322	E	26.3	Very low	29.3	Very low	182 Å²	182	108 Å²	108	85%	0.85	59%	0.589	S	S	*	*			trans	-81	121.9	163.2	-153.2	163.4	-152.4	0	0	107.3	Y324	E322-Y324 PolarHBondContact O-N 3.38Å
323	P	26.3	Very low	29.6	Very low	89 Å²	89	105.8 Å²	105.8	58%	0.578	57%	0.567	S	S	*	*			trans	-68.1	117	178.5	26	-30.5	0	0	0	109	Y325	P323-Y325 HydrophobicContact CB-CD2 4.41Å; P323-Y325 HydrophobicContact CB-CE2 4.2Å; P323-Y325 HydrophobicContact CG-CD2 4.34Å; P323-Y325 HydrophobicContact CG-CE2 3.91Å; P323-Y325 PolarHBondContact O-N 2.95Å; P323-Y325 VanDerWaalsContact O-N 3.08Å
324	Y	25.5	Very low	30	Very low	178 Å²	178	98.8 Å²	98.8	70%	0.698	53%	0.534	S	S	*	.			trans	-65.1	102	167.7	-165.8	-99.3	0	0	0	107.5	E322	E322-Y324 PolarHBondContact O-N 3.38Å
325	Y	28.2	Very low	30.4	Very low	172 Å²	172	95.4 Å²	95.4	68%	0.675	51%	0.51	S	S	*	.			trans	-80.9	125.7	169	-84.1	-92.4	0	0	0	107.6	P323 E327	P323-Y325 HydrophobicContact CB-CD2 4.41Å; P323-Y325 HydrophobicContact CB-CE2 4.2Å; P323-Y325 HydrophobicContact CG-CD2 4.34Å; P323-Y325 HydrophobicContact CG-CE2 3.91Å; P323-Y325 PolarHBondContact O-N 2.95Å; P323-Y325 VanDerWaalsContact O-N 3.08Å; Y325-E327 PolarHBondContact O-N 3.32Å
326	E	28.8	Very low	31	Very low	142 Å²	142	86.6 Å²	86.6	66%	0.664	47%	0.472	S	S	*	.			trans	-58.5	125.5	169	-75.5	179	159.1	0	0	109.2	T328 S329	E326-T328 PolarHBondContact O-N 3.06Å; E326-T328 VanDerWaalsContact O-N 3.08Å; E326-S329 PolarHBondContact O-N 3.34Å; E326-S329 VanDerWaalsContact O-N 3.09Å
327	E	31.2	Very low	31.5	Very low	140 Å²	140	84.1 Å²	84.1	65%	0.654	46%	0.456	S	S	*	.	H	α-helix	trans	-54.2	-31.5	-170	-70.4	175.1	148.1	0	0	112.8	Y325	Y325-E327 PolarHBondContact O-N 3.32Å
328	T	30.3	Very low	32.4	Very low	67 Å²	67	79.6 Å²	79.6	41%	0.411	42%	0.422	S	S	.	.	H	α-helix	trans	-71.7	-29.7	179.9	42.7	0	0	0	0	115.1	E326 W330	E326-T328 PolarHBondContact O-N 3.06Å; E326-T328 VanDerWaalsContact O-N 3.08Å; T328-W330 VanDerWaalsContact C-N 3.25Å; T328-W330 PolarHBondContact O-N 3.49Å
329	S	31.4	Very low	33	Very low	29 Å²	29	76.9 Å²	76.9	20%	0.203	40%	0.4	C	S	.	.	H	α-helix	trans	-67.2	-29.7	-177	-174.9	0	0	0	0	112.4	E326 D333	E326-S329 PolarHBondContact O-N 3.34Å; E326-S329 VanDerWaalsContact O-N 3.09Å; S329-D333 PolarHBondContact O-N 3.18Å
330	W	35	Very low	33.3	Very low	52 Å²	52	75.1 Å²	75.1	20%	0.197	38%	0.382	C	S	.	.	H	α-helix	trans	-81	-24.5	-171.1	167.3	101	0	0	0	112.6	T328 L332 N334 E706 F709	T328-W330 VanDerWaalsContact C-N 3.25Å; T328-W330 PolarHBondContact O-N 3.49Å; W330-L332 PolarHBondContact O-N 3.45Å; W330-N334 WeakPolarHBondContact CZ2-ND2 3.27Å; W330-N334 PolarHBondContact NE1-ND2 2.97Å; W330-N334 VanDerWaalsContact NE1-ND2 3.11Å; W330-N334 PolarHBondContact O-N 3.45Å; W330-N334 VanDerWaalsContact O-N 3.14Å; W330-E706 WeakPolarHBondContact CH2-O 3.37Å; W330-E706 HydrophobicContact CZ3-CG 4.23Å; W330-E706 WeakPolarHBondContact CZ3-O 3.26Å; W330-F709 HydrophobicContact CH2-CB 2.97Å; W330-F709 HydrophobicContact CH2-CG 4.21Å; W330-F709 WeakPolarHBondContact CH2-O 3.38Å; W330-F709 HydrophobicContact CZ2-CB 3.77Å; W330-F709 WeakPolarHBondContact CZ2-O 3.36Å; W330-F709 HydrophobicContact CZ3-CB 3.55Å; W330-F709 HydrophobicContact CZ3-CG 4.46Å
331	Y	33.9	Very low	33.7	Very low	4 Å²	4	77 Å²	77	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-58.4	-39.7	173.7	-171.2	-92	0	0	0	110.8	C335 S482 L701 M703 F709	Y331-C335 WeakPolarHBondContact O-CB 3.2Å; Y331-C335 PolarHBondContact O-N 3.04Å; Y331-C335 PolarHBondContact O-SG 2.89Å; Y331-S482 WeakPolarHBondContact CD1-OG 3.23Å; Y331-S482 WeakPolarHBondContact CE1-OG 3.32Å; Y331-L701 WeakPolarHBondContact OH-CD1 3.48Å; Y331-M703 WeakPolarHBondContact CE2-O 3.31Å; Y331-M703 PolarHBondContact OH-O 3.31Å; Y331-F709 HydrophobicContact CD2-CD2 4.49Å; Y331-F709 HydrophobicContact CD2-CE2 4.11Å; Y331-F709 HydrophobicContact CE2-CD2 4.28Å; Y331-F709 AromaticContact CE2-CE2 3.56Å; Y331-F709 HydrophobicContact CE2-CE2 3.56Å; Y331-F709 HydrophobicContact CE2-CZ 4.14Å
332	L	42.6	Very low	34.1	Very low	5 Å²	5	74 Å²	74	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-78	-44.6	-174.8	-68	164.4	0	0	0	112.2	W330 N334 C335 T336 C415 C417 L475 V478	W330-L332 PolarHBondContact O-N 3.45Å; L332-N334 VanDerWaalsContact C-N 3.27Å; L332-N334 PolarHBondContact O-N 3.49Å; L332-C335 PolarHBondContact O-N 3.08Å; L332-T336 WeakPolarHBondContact O-CG2 3.37Å; L332-T336 PolarHBondContact O-N 3.03Å; L332-T336 PolarHBondContact O-OG1 3.48Å; L332-C415 PolarHBondContact O-SG 3.2Å; L332-C417 HydrophobicContact CB-CB 3.64Å; L332-C417 HydrophobicContact CD1-CB 3.68Å; L332-C417 HydrophobicContact CD2-CB 3.58Å; L332-C417 WeakPolarHBondContact CD2-SG 3.43Å; L332-C417 HydrophobicContact CG-CB 3.77Å; L332-L475 HydrophobicContact CD1-CD1 3.5Å; L332-L475 VanDerWaalsContact CD1-CD1 3.5Å; L332-V478 HydrophobicContact CD2-CB 4.26Å; L332-V478 HydrophobicContact CD2-CG1 3.45Å; L332-V478 VanDerWaalsContact CD2-CG1 3.45Å
333	D	36.2	Very low	34.2	Very low	34 Å²	34	67.8 Å²	67.8	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-62.8	-32.9	176.5	-70.2	-28.3	0	0	0	112	S329 T336 E337 V412 S418	S329-D333 PolarHBondContact O-N 3.18Å; D333-T336 PolarHBondContact O-OG1 3.38Å; D333-E337 PolarHBondContact O-N 3.27Å; D333-V412 HydrophobicContact CB-CG2 4.35Å; D333-S418 WeakPolarHBondContact OD1-CB 2.74Å; D333-S418 PolarHBondContact OD1-OG 3.02Å
334	N	38.9	Very low	34.4	Very low	15 Å²	15	68.9 Å²	68.9	8%	0.08	35%	0.347	C	S	.	.	H	α-helix	trans	-84.9	-36	176.9	-81.2	-16.2	0	0	0	114.5	W330 L332 T336 E337 R338 F709	W330-N334 WeakPolarHBondContact CZ2-ND2 3.27Å; W330-N334 PolarHBondContact NE1-ND2 2.97Å; W330-N334 VanDerWaalsContact NE1-ND2 3.11Å; W330-N334 PolarHBondContact O-N 3.45Å; W330-N334 VanDerWaalsContact O-N 3.14Å; L332-N334 VanDerWaalsContact C-N 3.27Å; L332-N334 PolarHBondContact O-N 3.49Å; N334-T336 PolarHBondContact O-N 2.86Å; N334-E337 PolarHBondContact O-N 3.1Å; N334-R338 WeakPolarHBondContact O-CD 3.16Å; N334-R338 WeakPolarHBondContact O-CG 3.31Å; N334-R338 PolarHBondContact O-NE 3.41Å; N334-F709 HydrophobicContact CB-CD1 4.3Å
335	C	38	Very low	34.5	Very low	29 Å²	29	65.4 Å²	65.4	20%	0.196	35%	0.349	C	S	.	.	H	α-helix	trans	-57	-32	174.7	-79.8	0	0	0	0	110.9	Y331 L332 F339	Y331-C335 WeakPolarHBondContact O-CB 3.2Å; Y331-C335 PolarHBondContact O-N 3.04Å; Y331-C335 PolarHBondContact O-SG 2.89Å; L332-C335 PolarHBondContact O-N 3.08Å; C335-F339 WeakPolarHBondContact O-CD2 3.31Å; C335-F339 WeakPolarHBondContact O-CE2 3.15Å
336	T	36.6	Very low	34.4	Very low	3 Å²	3	66 Å²	66	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-89.3	-27.3	-173.8	53.5	0	0	0	0	113.2	L332 D333 N334 R338 F339 Y414 C415	L332-T336 WeakPolarHBondContact O-CG2 3.37Å; L332-T336 PolarHBondContact O-N 3.03Å; L332-T336 PolarHBondContact O-OG1 3.48Å; D333-T336 PolarHBondContact O-OG1 3.38Å; N334-T336 PolarHBondContact O-N 2.86Å; T336-R338 PolarHBondContact O-N 3.43Å; T336-R338 VanDerWaalsContact O-N 3.1Å; T336-F339 HydrophobicContact CG2-CE2 4.48Å; T336-Y414 VanDerWaalsContact C-CE2 3.48Å; T336-Y414 WeakPolarHBondContact O-CD2 3.05Å; T336-C415 VanDerWaalsContact CB-CB 3.44Å; T336-C415 HydrophobicContact CG2-CB 3.67Å; T336-C415 WeakPolarHBondContact CG2-SG 3.27Å; T336-C415 WeakPolarHBondContact OG1-CB 3.41Å; T336-C415 PolarHBondContact OG1-SG 3.34Å
337	E	37.7	Very low	34.5	Very low	68 Å²	68	66.8 Å²	66.8	32%	0.318	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-21.6	167.7	-91.1	-167.4	174	0	0	113	R294 D333 N334 Y414	R294-E337 PolarHBondContact NH1-O 3.04Å; D333-E337 PolarHBondContact O-N 3.27Å; N334-E337 PolarHBondContact O-N 3.1Å; E337-Y414 HydrophobicContact CB-CE2 4.07Å; E337-Y414 HydrophobicContact CG-CE2 3.49Å; E337-Y414 VanDerWaalsContact CG-CE2 3.49Å; E337-Y414 WeakPolarHBondContact CG-OH 3.44Å; E337-Y414 VanDerWaalsContact N-CE2 3.34Å; E337-Y414 PolarHBondContact OE1-OH 3.15Å
338	R	43.7	Very low	34.5	Very low	38 Å²	38	65.4 Å²	65.4	14%	0.143	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-10.7	-166.8	-68	167.4	176.9	-140.3	-8.6	115.9	D190 W192 N334 T336 I340 F709	D190-R338 IonicContact OD2-CZ 3.96Å; D190-R338 IonicContact OD2-NH1 2.69Å; D190-R338 PolarHBondContact OD2-NH1 2.91Å; W192-R338 HydrophobicContact CB-CB 4.29Å; W192-R338 HydrophobicContact CB-CG 4.14Å; W192-R338 HydrophobicContact CG-CG 4.42Å; N334-R338 WeakPolarHBondContact O-CD 3.16Å; N334-R338 WeakPolarHBondContact O-CG 3.31Å; N334-R338 PolarHBondContact O-NE 3.41Å; T336-R338 PolarHBondContact O-N 3.43Å; T336-R338 VanDerWaalsContact O-N 3.1Å; R338-I340 VanDerWaalsContact C-N 3.26Å; R338-I340 PolarHBondContact O-N 3.4Å; R338-F709 VanDerWaalsContact NH1-CD1 3.27Å
339	F	40.9	Very low	34.5	Very low	66 Å²	66	65.5 Å²	65.5	29%	0.289	38%	0.382	S	S	.	.			trans	-81.5	76.9	178.1	-63.9	-71.2	0	0	0	110.3	Q278 H281 C335 T336	Q278-F339 HydrophobicContact CB-CE1 4.43Å; Q278-F339 HydrophobicContact CB-CZ 4.43Å; Q278-F339 HydrophobicContact CG-CE1 4.07Å; Q278-F339 HydrophobicContact CG-CZ 3.97Å; H281-F339 HydrophobicContact CB-CE2 4.22Å; H281-F339 HydrophobicContact CB-CZ 4.16Å; H281-F339 AromaticContact CD2-CD2 3.53Å; H281-F339 AromaticContact CD2-CE2 3.31Å; H281-F339 WeakPolarHBondContact CD2-CE2 3.44Å; H281-F339 AromaticContact CD2-CZ 3.65Å; H281-F339 AromaticContact CE1-CD2 3.79Å; H281-F339 AromaticContact CE1-CE2 3.82Å; H281-F339 AromaticContact CG-CE2 3.5Å; H281-F339 AromaticContact CG-CZ 3.85Å; H281-F339 AromaticContact ND1-CE2 3.8Å; H281-F339 AromaticContact NE2-CD2 3.34Å; H281-F339 VanDerWaalsContact NE2-CD2 3.34Å; H281-F339 WeakPolarHBondContact NE2-CD2 3.23Å; H281-F339 AromaticContact NE2-CE2 3.58Å; H281-F339 AromaticContact NE2-CG 3.95Å; C335-F339 WeakPolarHBondContact O-CD2 3.31Å; C335-F339 WeakPolarHBondContact O-CE2 3.15Å; T336-F339 HydrophobicContact CG2-CE2 4.48Å
340	I	36	Very low	34.8	Very low	63 Å²	63	67.2 Å²	67.2	32%	0.323	40%	0.404	S	S	.	.			trans	-87.6	119	158.7	-62	175.9	0	0	0	105.9	R338	R338-I340 VanDerWaalsContact C-N 3.26Å; R338-I340 PolarHBondContact O-N 3.4Å
341	E	33.1	Very low	35.1	Very low	125 Å²	125	67.7 Å²	67.7	58%	0.584	42%	0.416	S	S	*	.			trans	31.7	98.1	160	-66.9	171.4	179.9	0	0	116.6
342	T	35.6	Very low	35.6	Very low	52 Å²	52	74.1 Å²	74.1	32%	0.319	46%	0.455	S	S	.	.			trans	-103.8	115.6	141	25	0	0	0	0	111.1	E258 E259 C344	E258-T342 HydrophobicContact CB-CG2 4.05Å; E258-T342 HydrophobicContact CG-CG2 3.81Å; E259-T342 HydrophobicContact CB-CG2 4.31Å; E259-T342 VanDerWaalsContact N-CG2 3.26Å; T342-C344 PolarHBondContact O-N 2.81Å
343	G	29	Very low	35.8	Very low	53 Å²	53	81.6 Å²	81.6	55%	0.546	49%	0.49	S	S	.	.			trans	-53.5	119.6	167.8	0	0	0	0	0	110.8
344	C	28.7	Very low	37	Very low	111 Å²	111	81.9 Å²	81.9	75%	0.75	49%	0.491	S	S	*	.			trans	-144.3	114.2	140.8	-88	0	0	0	0	103.8	T342	T342-C344 PolarHBondContact O-N 2.81Å
345	S	27.8	Very low	38.7	Very low	105 Å²	105	84.2 Å²	84.2	73%	0.734	50%	0.504	S	S	*	.			trans	-3.6	129.7	170.1	41.8	0	0	0	0	116.8	E347	S345-E347 VanDerWaalsContact C-N 3.3Å; S345-E347 PolarHBondContact O-N 3.07Å
346	E	26.6	Very low	41.1	Very low	185 Å²	185	85.3 Å²	85.3	86%	0.864	51%	0.512	S	S	*	.			trans	-49.3	92.1	162.7	-66.7	-179.9	151.7	0	0	110.7	S348	E346-S348 VanDerWaalsContact C-N 3.26Å
347	E	30.9	Very low	43.6	Very low	158 Å²	158	85.8 Å²	85.8	74%	0.738	51%	0.514	S	S	*	.			trans	-93.9	71.5	148	-73.7	-171.2	170.5	0	0	107.3	S345 G349 K527	S345-E347 VanDerWaalsContact C-N 3.3Å; S345-E347 PolarHBondContact O-N 3.07Å; E347-G349 PolarHBondContact O-N 3.22Å; E347-K527 IonicContact OE2-NZ 3.75Å
348	S	32.2	Very low	46.1	Very low	111 Å²	111	86.6 Å²	86.6	78%	0.776	51%	0.514	S	S	*	.			trans	-68.8	65	156.8	42.9	0	0	0	0	108.8	E346	E346-S348 VanDerWaalsContact C-N 3.26Å
349	G	30.4	Very low	48.3	Very low	70 Å²	70	91.6 Å²	91.6	72%	0.722	53%	0.533	S	S	*	.			trans	-118.1	16.8	-179.3	0	0	0	0	0	114	E347 S351	E347-G349 PolarHBondContact O-N 3.22Å; G349-S351 PolarHBondContact O-N 3.41Å
350	G	36.9	Very low	50.8	Low	64 Å²	64	92.7 Å²	92.7	66%	0.66	54%	0.539	S	S	*	.			trans	-73.7	112.8	173.1	0	0	0	0	0	110.5
351	S	40.4	Very low	53.5	Low	63 Å²	63	89.7 Å²	89.7	44%	0.441	52%	0.523	S	S	.	.			trans	-44.6	144.3	176.2	50.1	0	0	0	0	113.5	G349 E353	G349-S351 PolarHBondContact O-N 3.41Å; S351-E353 PolarHBondContact O-N 3.45Å
352	V	44.5	Very low	56.4	Low	139 Å²	139	85.8 Å²	85.8	84%	0.842	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-52.2	-17.7	-178.7	175.5	0	0	0	0	114	N354 D355	V352-N354 PolarHBondContact O-N 3.37Å; V352-D355 PolarHBondContact O-N 2.98Å
353	E	48.1	Very low	59.1	Low	161 Å²	161	86 Å²	86	75%	0.752	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.4	-175.6	-71.2	-179.5	148.1	0	0	114.9	S351	S351-E353 PolarHBondContact O-N 3.45Å
354	N	60	Low	62.2	Low	40 Å²	40	83.6 Å²	83.6	21%	0.214	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-92.7	-1.3	-174.6	-80	-3.5	0	0	0	115.2	V352 S356 R358 T516 N520 R523	V352-N354 PolarHBondContact O-N 3.37Å; N354-S356 PolarHBondContact O-N 3.45Å; N354-R358 WeakPolarHBondContact O-CB 3.23Å; N354-R358 PolarHBondContact O-N 2.88Å; N354-T516 WeakPolarHBondContact OD1-CG2 3.25Å; N354-N520 PolarHBondContact ND2-ND2 2.96Å; N354-N520 PolarHBondContact ND2-OD1 2.81Å; N354-R523 PolarHBondContact ND2-NH2 3.22Å
355	D	76	Confident	65.3	Low	64 Å²	64	78.3 Å²	78.3	34%	0.342	45%	0.449	S	S	.	.	H	α-helix	trans	-75.4	-25.9	-167	-167.8	53.6	0	0	0	113.2	V352 R359	V352-D355 PolarHBondContact O-N 2.98Å; D355-R359 VanDerWaalsContact O-CB 3.31Å; D355-R359 WeakPolarHBondContact O-CB 3.41Å; D355-R359 VanDerWaalsContact O-CG 3.24Å; D355-R359 WeakPolarHBondContact O-CG 3.38Å; D355-R359 PolarHBondContact O-N 3.4Å; D355-R359 VanDerWaalsContact O-N 3.09Å; D355-R359 PolarHBondContact O-NE 2.91Å; D355-R359 IonicContact OD1-NE 2.63Å; D355-R359 IonicContact OD2-CZ 2.81Å; D355-R359 IonicContact OD2-NE 3.28Å; D355-R359 PolarHBondContact OD2-NE 2.89Å; D355-R359 IonicContact OD2-NH2 2.73Å; D355-R359 PolarHBondContact OD2-NH2 3.44Å
356	S	87.9	Confident	68.3	Low	53 Å²	53	78 Å²	78	37%	0.371	44%	0.436	S	S	.	.	H	α-helix	trans	-71	-54.2	180	-179.3	0	0	0	0	112.4	N354 R358 R359 Q360	N354-S356 PolarHBondContact O-N 3.45Å; S356-R358 VanDerWaalsContact C-N 3.3Å; S356-R358 PolarHBondContact O-N 2.9Å; S356-R359 PolarHBondContact O-N 2.81Å; S356-R359 VanDerWaalsContact O-N 3.17Å; S356-Q360 WeakPolarHBondContact O-CG 3.24Å; S356-Q360 PolarHBondContact O-N 3.3Å
357	E	88.8	Confident	71.5	Confident	13 Å²	13	71.3 Å²	71.3	6%	0.061	40%	0.404	C	S	.	.	H	α-helix	trans	-59.9	-42.3	-179.8	-74.3	77.5	-173.8	0	0	110.9	Q360 C361 K512 L513	E357-Q360 WeakPolarHBondContact O-CB 3.17Å; E357-Q360 PolarHBondContact O-N 3.48Å; E357-C361 PolarHBondContact O-N 3.46Å; E357-C361 VanDerWaalsContact O-N 3.11Å; E357-K512 WeakPolarHBondContact OE1-CE 3.19Å; E357-K512 IonicContact OE1-NZ 3.55Å; E357-K512 PolarHBondContact OE1-NZ 3.36Å; E357-L513 HydrophobicContact CB-CD1 3.63Å; E357-L513 HydrophobicContact CG-CD1 4.01Å
358	R	89.9	Confident	74.4	Confident	85 Å²	85	63.8 Å²	63.8	32%	0.321	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-47.1	174.5	-176.1	-175.3	174.5	-131.6	2.1	111.8	N289 L290 N354 S356 Q360 C361 L362	N289-R358 PolarHBondContact ND2-NH2 3.3Å; N289-R358 PolarHBondContact O-NE 3.03Å; N289-R358 PolarHBondContact O-NH2 3.2Å; N289-R358 PolarHBondContact OD1-NH2 2.9Å; L290-R358 HydrophobicContact CD2-CG 3.99Å; N354-R358 WeakPolarHBondContact O-CB 3.23Å; N354-R358 PolarHBondContact O-N 2.88Å; S356-R358 VanDerWaalsContact C-N 3.3Å; S356-R358 PolarHBondContact O-N 2.9Å; R358-Q360 VanDerWaalsContact C-N 3.3Å; R358-Q360 PolarHBondContact O-N 3.25Å; R358-C361 PolarHBondContact O-N 2.77Å; R358-L362 HydrophobicContact CG-CD1 4.16Å; R358-L362 WeakPolarHBondContact O-CG 3.36Å; R358-L362 PolarHBondContact O-N 3.08Å
359	R	90.6	Very high	77.3	Confident	143 Å²	143	59.5 Å²	59.5	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-37.9	177.4	-83.5	-174.3	-88.4	132.5	-7.6	112.2	D355 S356 L362 S363	D355-R359 VanDerWaalsContact O-CB 3.31Å; D355-R359 WeakPolarHBondContact O-CB 3.41Å; D355-R359 VanDerWaalsContact O-CG 3.24Å; D355-R359 WeakPolarHBondContact O-CG 3.38Å; D355-R359 PolarHBondContact O-N 3.4Å; D355-R359 VanDerWaalsContact O-N 3.09Å; D355-R359 PolarHBondContact O-NE 2.91Å; D355-R359 IonicContact OD1-NE 2.63Å; D355-R359 IonicContact OD2-CZ 2.81Å; D355-R359 IonicContact OD2-NE 3.28Å; D355-R359 PolarHBondContact OD2-NE 2.89Å; D355-R359 IonicContact OD2-NH2 2.73Å; D355-R359 PolarHBondContact OD2-NH2 3.44Å; S356-R359 PolarHBondContact O-N 2.81Å; S356-R359 VanDerWaalsContact O-N 3.17Å; R359-L362 PolarHBondContact O-N 3.36Å; R359-S363 WeakPolarHBondContact O-CB 3.19Å; R359-S363 PolarHBondContact O-N 3.37Å
360	Q	92.6	Very high	80.1	Confident	88 Å²	88	60.7 Å²	60.7	41%	0.411	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-50.7	174.7	-71.2	173.9	-15.3	0	0	111.3	S356 E357 R358 L362 S363 C364	S356-Q360 WeakPolarHBondContact O-CG 3.24Å; S356-Q360 PolarHBondContact O-N 3.3Å; E357-Q360 WeakPolarHBondContact O-CB 3.17Å; E357-Q360 PolarHBondContact O-N 3.48Å; R358-Q360 VanDerWaalsContact C-N 3.3Å; R358-Q360 PolarHBondContact O-N 3.25Å; Q360-L362 PolarHBondContact O-N 2.88Å; Q360-S363 PolarHBondContact O-N 3.15Å; Q360-C364 PolarHBondContact O-N 3Å; Q360-C364 VanDerWaalsContact O-N 3.08Å; Q360-C364 PolarHBondContact O-SG 3.36Å; Q360-C364 VanDerWaalsContact O-SG 3.33Å
361	C	94	Very high	82.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-48.8	176.3	-70	0	0	0	0	112.2	L290 E357 R358 S363 C364 L365 L467	L290-C361 HydrophobicContact CD1-CB 3.95Å; L290-C361 HydrophobicContact CD2-CB 3.58Å; L290-C361 HydrophobicContact CG-CB 4.44Å; E357-C361 PolarHBondContact O-N 3.46Å; E357-C361 VanDerWaalsContact O-N 3.11Å; R358-C361 PolarHBondContact O-N 2.77Å; C361-S363 VanDerWaalsContact C-N 3.34Å; C361-S363 PolarHBondContact O-N 3.44Å; C361-C364 PolarHBondContact O-N 3.32Å; C361-L365 VanDerWaalsContact O-CG 3.31Å; C361-L365 WeakPolarHBondContact O-CG 3.18Å; C361-L365 PolarHBondContact O-N 3Å; C361-L467 HydrophobicContact CB-CD2 4.43Å
362	L	92.9	Very high	84.8	Confident	44 Å²	44	54.9 Å²	54.9	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-44.7	179.4	-73.3	173.2	0	0	0	112.1	L290 R358 R359 Q360 C364 L365 E366	L290-L362 HydrophobicContact CB-CD2 4.29Å; L290-L362 HydrophobicContact CD2-CD2 4.17Å; L290-L362 HydrophobicContact CD2-CG 4.01Å; L290-L362 VanDerWaalsContact O-CD2 3.22Å; L290-L362 WeakPolarHBondContact O-CD2 3.45Å; R358-L362 HydrophobicContact CG-CD1 4.16Å; R358-L362 WeakPolarHBondContact O-CG 3.36Å; R358-L362 PolarHBondContact O-N 3.08Å; R359-L362 PolarHBondContact O-N 3.36Å; Q360-L362 PolarHBondContact O-N 2.88Å; L362-C364 PolarHBondContact O-N 3.26Å; L362-L365 PolarHBondContact O-N 2.98Å; L362-E366 WeakPolarHBondContact O-CG 3.33Å; L362-E366 PolarHBondContact O-N 3.2Å
363	S	92.7	Very high	86.6	Confident	55 Å²	55	50.2 Å²	50.2	39%	0.385	24%	0.243	S	C	.	.	H	α-helix	trans	-58.1	-47.2	176.5	180	0	0	0	0	111.9	R359 Q360 C361 E366 K367	R359-S363 WeakPolarHBondContact O-CB 3.19Å; R359-S363 PolarHBondContact O-N 3.37Å; Q360-S363 PolarHBondContact O-N 3.15Å; C361-S363 VanDerWaalsContact C-N 3.34Å; C361-S363 PolarHBondContact O-N 3.44Å; S363-E366 PolarHBondContact O-N 3.31Å; S363-K367 PolarHBondContact O-N 3.19Å
364	C	94.3	Very high	88.2	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.02	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-45.2	177.3	-65.4	0	0	0	0	112	Q360 C361 L362 E366 K367 C368 V463 L464	Q360-C364 PolarHBondContact O-N 3Å; Q360-C364 VanDerWaalsContact O-N 3.08Å; Q360-C364 PolarHBondContact O-SG 3.36Å; Q360-C364 VanDerWaalsContact O-SG 3.33Å; C361-C364 PolarHBondContact O-N 3.32Å; L362-C364 PolarHBondContact O-N 3.26Å; C364-E366 PolarHBondContact O-N 3Å; C364-K367 WeakPolarHBondContact O-CB 3.39Å; C364-K367 PolarHBondContact O-N 2.92Å; C364-C368 PolarHBondContact O-N 3.43Å; C364-C368 PolarHBondContact O-SG 3.46Å; C364-C368 VanDerWaalsContact O-SG 3.41Å; C364-V463 HydrophobicContact CB-CG1 4.3Å; C364-L464 HydrophobicContact CB-CD2 3.83Å; C364-L464 HydrophobicContact CB-CG 4.27Å
365	L	93.6	Very high	89.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-42.1	178.7	-67.9	-179.3	0	0	0	112.2	L290 C361 L362 K367 C368 R369 T419 M422 I423 L467	L290-L365 HydrophobicContact CB-CD1 4.41Å; L290-L365 HydrophobicContact CD1-CD1 4.35Å; C361-L365 VanDerWaalsContact O-CG 3.31Å; C361-L365 WeakPolarHBondContact O-CG 3.18Å; C361-L365 PolarHBondContact O-N 3Å; L362-L365 PolarHBondContact O-N 2.98Å; L365-K367 VanDerWaalsContact C-N 3.35Å; L365-K367 PolarHBondContact O-N 3.06Å; L365-C368 PolarHBondContact O-N 3.33Å; L365-R369 VanDerWaalsContact O-CG 3.31Å; L365-R369 WeakPolarHBondContact O-CG 3.44Å; L365-R369 PolarHBondContact O-N 3.18Å; L365-T419 HydrophobicContact CD1-CG2 4.03Å; L365-T419 HydrophobicContact CD2-CG2 3.52Å; L365-T419 HydrophobicContact CG-CG2 4.41Å; L365-M422 HydrophobicContact CD2-CE 4.1Å; L365-I423 HydrophobicContact CD2-CD1 3.96Å; L365-I423 HydrophobicContact CD2-CG1 4.06Å; L365-L467 HydrophobicContact CD1-CD2 4.34Å; L365-L467 HydrophobicContact CD2-CD2 4.16Å; L365-L467 HydrophobicContact CG-CD2 4.39Å
366	E	91.7	Very high	89.3	Confident	99 Å²	99	47 Å²	47	46%	0.463	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-41.4	174.4	-77.6	-172.8	-165.2	0	0	112.6	L362 S363 C364 R369 K370	L362-E366 WeakPolarHBondContact O-CG 3.33Å; L362-E366 PolarHBondContact O-N 3.2Å; S363-E366 PolarHBondContact O-N 3.31Å; C364-E366 PolarHBondContact O-N 3Å; E366-R369 PolarHBondContact O-N 3.48Å; E366-K370 WeakPolarHBondContact O-CB 3.34Å; E366-K370 VanDerWaalsContact O-CG 3.3Å; E366-K370 WeakPolarHBondContact O-CG 3.42Å; E366-K370 PolarHBondContact O-N 3.48Å; E366-K370 IonicContact OE2-NZ 3.72Å; E366-K370 PolarHBondContact OE2-NZ 2.99Å
367	K	92.8	Very high	88.7	Confident	44 Å²	44	51.5 Å²	51.5	19%	0.191	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-49.9	174.4	-77.2	-170.9	177.3	-172.1	0	110.8	S363 C364 L365 R369 K370 I371 L456 E460	S363-K367 PolarHBondContact O-N 3.19Å; C364-K367 WeakPolarHBondContact O-CB 3.39Å; C364-K367 PolarHBondContact O-N 2.92Å; L365-K367 VanDerWaalsContact C-N 3.35Å; L365-K367 PolarHBondContact O-N 3.06Å; K367-R369 VanDerWaalsContact C-N 3.33Å; K367-R369 PolarHBondContact O-N 3.07Å; K367-K370 PolarHBondContact O-N 2.72Å; K367-K370 VanDerWaalsContact O-N 3.14Å; K367-I371 VanDerWaalsContact O-CG1 3.22Å; K367-I371 WeakPolarHBondContact O-CG1 3.41Å; K367-I371 PolarHBondContact O-N 3.22Å; K367-L456 HydrophobicContact CB-CD2 3.94Å; K367-L456 HydrophobicContact CD-CD2 4.07Å; K367-E460 VanDerWaalsContact CD-OE1 3.32Å; K367-E460 WeakPolarHBondContact CD-OE1 3.46Å; K367-E460 WeakPolarHBondContact CE-OE1 2.98Å; K367-E460 IonicContact NZ-OE1 3.88Å; K367-E460 PolarHBondContact NZ-OE1 2.89Å; K367-E460 IonicContact NZ-OE2 2.71Å; K367-E460 PolarHBondContact NZ-OE2 3.47Å
368	C	92.8	Very high	88.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-52.5	-49.8	175.8	-69.9	0	0	0	0	112	C364 L365 K370 I371 I372 M422 F426	C364-C368 PolarHBondContact O-N 3.43Å; C364-C368 PolarHBondContact O-SG 3.46Å; C364-C368 VanDerWaalsContact O-SG 3.41Å; L365-C368 PolarHBondContact O-N 3.33Å; C368-K370 PolarHBondContact O-N 3.43Å; C368-I371 PolarHBondContact O-N 2.76Å; C368-I372 VanDerWaalsContact O-CG1 3.3Å; C368-I372 WeakPolarHBondContact O-CG1 3.45Å; C368-I372 PolarHBondContact O-N 3.43Å; C368-M422 HydrophobicContact CB-CE 3.92Å; C368-M422 HydrophobicContact CB-SD 4.2Å; C368-F426 HydrophobicContact CB-CD1 4.38Å; C368-F426 HydrophobicContact CB-CE1 3.95Å; C368-F426 HydrophobicContact CB-CE2 4.23Å; C368-F426 HydrophobicContact CB-CZ 3.86Å; C368-F426 VanDerWaalsContact SG-CD1 3.6Å
369	R	91.7	Very high	87.8	Confident	21 Å²	21	53.1 Å²	53.1	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-42.4	178.4	-70.3	165.8	-176.5	149.7	2.5	112.7	L365 E366 K367 S373 L410 D411 M422	L365-R369 VanDerWaalsContact O-CG 3.31Å; L365-R369 WeakPolarHBondContact O-CG 3.44Å; L365-R369 PolarHBondContact O-N 3.18Å; E366-R369 PolarHBondContact O-N 3.48Å; K367-R369 VanDerWaalsContact C-N 3.33Å; K367-R369 PolarHBondContact O-N 3.07Å; R369-S373 VanDerWaalsContact O-CB 3.3Å; R369-S373 WeakPolarHBondContact O-CB 3.31Å; R369-S373 PolarHBondContact O-N 3.26Å; R369-S373 PolarHBondContact O-OG 3.33Å; R369-L410 HydrophobicContact CB-CD1 4.11Å; R369-L410 HydrophobicContact CG-CD1 4.07Å; R369-D411 VanDerWaalsContact CG-OD1 3.27Å; R369-D411 WeakPolarHBondContact CG-OD1 3.37Å; R369-D411 IonicContact CZ-OD1 2.69Å; R369-D411 IonicContact CZ-OD2 2.71Å; R369-D411 IonicContact NE-OD1 2.78Å; R369-D411 PolarHBondContact NE-OD1 2.7Å; R369-D411 IonicContact NE-OD2 2.64Å; R369-D411 PolarHBondContact NE-OD2 2.63Å; R369-D411 IonicContact NH2-OD1 3.88Å; R369-D411 IonicContact NH2-OD2 2.77Å; R369-D411 PolarHBondContact NH2-OD2 3.48Å; R369-M422 HydrophobicContact CG-CE 4.36Å; R369-M422 HydrophobicContact CG-SD 4.23Å
370	K	89.3	Confident	87.2	Confident	95 Å²	95	53.4 Å²	53.4	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-48.1	175.8	-74.2	166.5	-176.1	159.3	0	110.3	E366 K367 C368 I372 S373 F374 L454	E366-K370 WeakPolarHBondContact O-CB 3.34Å; E366-K370 VanDerWaalsContact O-CG 3.3Å; E366-K370 WeakPolarHBondContact O-CG 3.42Å; E366-K370 PolarHBondContact O-N 3.48Å; E366-K370 IonicContact OE2-NZ 3.72Å; E366-K370 PolarHBondContact OE2-NZ 2.99Å; K367-K370 PolarHBondContact O-N 2.72Å; K367-K370 VanDerWaalsContact O-N 3.14Å; C368-K370 PolarHBondContact O-N 3.43Å; K370-I372 PolarHBondContact O-N 3.37Å; K370-S373 WeakPolarHBondContact O-CB 3.25Å; K370-S373 PolarHBondContact O-N 2.86Å; K370-F374 WeakPolarHBondContact O-CD2 3.35Å; K370-F374 PolarHBondContact O-N 3.26Å; K370-L454 HydrophobicContact CB-CD1 4.45Å; K370-L454 HydrophobicContact CB-CD2 4.38Å; K370-L454 HydrophobicContact CD-CD2 4.26Å
371	I	89.2	Confident	86.6	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-55.8	-51.3	178.2	-64.9	168.7	0	0	0	110.9	K367 C368 S373 F374 L375 F426 L433 F437 L454 L456	K367-I371 VanDerWaalsContact O-CG1 3.22Å; K367-I371 WeakPolarHBondContact O-CG1 3.41Å; K367-I371 PolarHBondContact O-N 3.22Å; C368-I371 PolarHBondContact O-N 2.76Å; I371-S373 VanDerWaalsContact C-N 3.33Å; I371-S373 PolarHBondContact O-N 3.31Å; I371-F374 PolarHBondContact O-N 3.36Å; I371-L375 HydrophobicContact CG2-CD1 3.97Å; I371-L375 HydrophobicContact CG2-CG 4.43Å; I371-L375 WeakPolarHBondContact O-CG 3.43Å; I371-L375 PolarHBondContact O-N 2.93Å; I371-F426 HydrophobicContact CB-CE1 4.36Å; I371-F426 HydrophobicContact CB-CZ 4.14Å; I371-F426 HydrophobicContact CD1-CE1 3.98Å; I371-F426 HydrophobicContact CG2-CE1 4.26Å; I371-F426 HydrophobicContact CG2-CZ 4.06Å; I371-L433 HydrophobicContact CG2-CD2 4.23Å; I371-F437 HydrophobicContact CB-CZ 4.45Å; I371-F437 HydrophobicContact CD1-CE2 4.04Å; I371-F437 HydrophobicContact CD1-CZ 3.81Å; I371-F437 HydrophobicContact CG1-CE2 4.44Å; I371-F437 HydrophobicContact CG1-CZ 3.77Å; I371-F437 HydrophobicContact CG2-CE2 4.24Å; I371-F437 HydrophobicContact CG2-CZ 3.89Å; I371-L454 WeakPolarHBondContact CD1-O 3.37Å; I371-L454 HydrophobicContact CG1-CB 4.22Å; I371-L456 HydrophobicContact CD1-CG 4.22Å
372	I	86.8	Confident	86	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-43.5	179.2	-59.8	164.7	0	0	0	110.8	C368 K370 F374 L375 R376 P409 L410 M422 F426	C368-I372 VanDerWaalsContact O-CG1 3.3Å; C368-I372 WeakPolarHBondContact O-CG1 3.45Å; C368-I372 PolarHBondContact O-N 3.43Å; K370-I372 PolarHBondContact O-N 3.37Å; I372-F374 VanDerWaalsContact C-N 3.33Å; I372-F374 PolarHBondContact O-N 3.31Å; I372-L375 PolarHBondContact O-N 3.03Å; I372-R376 HydrophobicContact CG2-CG 4.17Å; I372-R376 WeakPolarHBondContact O-CB 3.13Å; I372-R376 WeakPolarHBondContact O-CG 3.4Å; I372-R376 PolarHBondContact O-N 2.84Å; I372-P409 WeakPolarHBondContact CD1-O 3.22Å; I372-L410 HydrophobicContact CB-CD1 4.22Å; I372-L410 HydrophobicContact CD1-CD1 4.18Å; I372-L410 HydrophobicContact CG2-CB 3.84Å; I372-L410 HydrophobicContact CG2-CD1 4.26Å; I372-M422 HydrophobicContact CD1-CG 3.64Å; I372-M422 HydrophobicContact CD1-SD 3.46Å; I372-M422 WeakPolarHBondContact CD1-SD 3.37Å; I372-F426 HydrophobicContact CD1-CE2 3.52Å; I372-F426 HydrophobicContact CD1-CZ 4.1Å; I372-F426 HydrophobicContact CG1-CE2 3.47Å; I372-F426 VanDerWaalsContact CG1-CE2 3.47Å; I372-F426 HydrophobicContact CG1-CZ 3.69Å
373	S	83.1	Confident	85.4	Confident	41 Å²	41	54.1 Å²	54.1	29%	0.287	28%	0.279	S	S	.	.	H	α-helix	trans	-59.3	-44.5	178.5	-61.4	0	0	0	0	111.3	R369 K370 I371 R376 L377	R369-S373 VanDerWaalsContact O-CB 3.3Å; R369-S373 WeakPolarHBondContact O-CB 3.31Å; R369-S373 PolarHBondContact O-N 3.26Å; R369-S373 PolarHBondContact O-OG 3.33Å; K370-S373 WeakPolarHBondContact O-CB 3.25Å; K370-S373 PolarHBondContact O-N 2.86Å; I371-S373 VanDerWaalsContact C-N 3.33Å; I371-S373 PolarHBondContact O-N 3.31Å; S373-R376 PolarHBondContact O-N 2.64Å; S373-L377 VanDerWaalsContact O-CB 3.27Å; S373-L377 WeakPolarHBondContact O-CB 3.32Å; S373-L377 WeakPolarHBondContact O-CG 3.3Å; S373-L377 PolarHBondContact O-N 2.87Å
374	F	80.7	Confident	84.8	Confident	84 Å²	84	52.9 Å²	52.9	37%	0.368	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-45.9	176	-82.2	-69.1	0	0	0	112.6	K370 I371 I372 R376 L377 S378 L454	K370-F374 WeakPolarHBondContact O-CD2 3.35Å; K370-F374 PolarHBondContact O-N 3.26Å; I371-F374 PolarHBondContact O-N 3.36Å; I372-F374 VanDerWaalsContact C-N 3.33Å; I372-F374 PolarHBondContact O-N 3.31Å; F374-R376 VanDerWaalsContact C-N 3.28Å; F374-R376 PolarHBondContact O-N 2.9Å; F374-L377 PolarHBondContact O-N 3.08Å; F374-S378 PolarHBondContact O-N 3.02Å; F374-S378 VanDerWaalsContact O-N 3.12Å; F374-L454 HydrophobicContact CD2-CD1 3.51Å; F374-L454 HydrophobicContact CE2-CD1 3.46Å; F374-L454 VanDerWaalsContact CE2-CD1 3.46Å; F374-L454 HydrophobicContact CZ-CD1 4.48Å
375	L	82.3	Confident	84.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-32.3	178.4	-71.4	177.6	0	0	0	112.9	I371 I372 H381 H382 F385 V405 L408 L433 Y436	I371-L375 HydrophobicContact CG2-CD1 3.97Å; I371-L375 HydrophobicContact CG2-CG 4.43Å; I371-L375 WeakPolarHBondContact O-CG 3.43Å; I371-L375 PolarHBondContact O-N 2.93Å; I372-L375 PolarHBondContact O-N 3.03Å; L375-H381 HydrophobicContact CD2-CB 4.39Å; L375-H382 WeakPolarHBondContact O-CB 3.23Å; L375-F385 HydrophobicContact CD1-CD2 4.18Å; L375-F385 HydrophobicContact CD1-CE2 4.44Å; L375-F385 HydrophobicContact CD1-CG 4.28Å; L375-F385 HydrophobicContact CD2-CB 3.66Å; L375-F385 HydrophobicContact CD2-CD2 4.24Å; L375-F385 HydrophobicContact CD2-CG 3.98Å; L375-V405 HydrophobicContact CB-CG1 4.47Å; L375-L408 HydrophobicContact CD1-CD1 3.95Å; L375-L433 HydrophobicContact CD1-CD2 4.34Å; L375-Y436 HydrophobicContact CD2-CD2 4.43Å; L375-Y436 HydrophobicContact CD2-CE1 4.07Å; L375-Y436 HydrophobicContact CD2-CE2 3.75Å
376	R	77.7	Confident	83.4	Confident	114 Å²	114	53.7 Å²	53.7	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-82.2	-38.4	178.8	-72.5	-179.3	179.2	-160.1	-6.3	113.4	I372 S373 F374 V405 L408 P409 L410	I372-R376 HydrophobicContact CG2-CG 4.17Å; I372-R376 WeakPolarHBondContact O-CB 3.13Å; I372-R376 WeakPolarHBondContact O-CG 3.4Å; I372-R376 PolarHBondContact O-N 2.84Å; S373-R376 PolarHBondContact O-N 2.64Å; F374-R376 VanDerWaalsContact C-N 3.28Å; F374-R376 PolarHBondContact O-N 2.9Å; R376-V405 HydrophobicContact CG-CG1 3.95Å; R376-L408 PolarHBondContact NH2-O 2.87Å; R376-P409 VanDerWaalsContact NH2-CA 3.33Å; R376-L410 VanDerWaalsContact NH2-N 3.13Å
377	L	75.6	Confident	82.8	Confident	147 Å²	147	55.6 Å²	55.6	77%	0.77	28%	0.276	S	S	*	.	H	α-helix	trans	-84.6	-27.6	-173.1	-68.3	171.5	0	0	0	113.6	S373 F374 P379	S373-L377 VanDerWaalsContact O-CB 3.27Å; S373-L377 WeakPolarHBondContact O-CB 3.32Å; S373-L377 WeakPolarHBondContact O-CG 3.3Å; S373-L377 PolarHBondContact O-N 2.87Å; F374-L377 PolarHBondContact O-N 3.08Å; L377-P379 WeakPolarHBondContact O-CD 3.24Å
378	S	79.1	Confident	82	Confident	25 Å²	25	54.8 Å²	54.8	18%	0.175	27%	0.273	C	S	.	.			trans	-101.3	113.3	179.8	170.5	0	0	0	0	111.4	F374 E380 H381 H382	F374-S378 PolarHBondContact O-N 3.02Å; F374-S378 VanDerWaalsContact O-N 3.12Å; S378-E380 PolarHBondContact O-N 2.78Å; S378-H381 PolarHBondContact O-N 2.79Å; S378-H381 PolarHBondContact OG-CD2 3.33Å; S378-H381 VanDerWaalsContact OG-CD2 3.24Å; S378-H381 PolarHBondContact OG-N 3.32Å; S378-H382 WeakPolarHBondContact O-CB 3.42Å; S378-H382 PolarHBondContact O-N 3.13Å
379	P	79.5	Confident	81.1	Confident	106 Å²	106	54.8 Å²	54.8	69%	0.688	27%	0.273	S	S	*	.	H	α-helix	trans	-58	-33.5	175	-24.5	34.4	0	0	0	113.1	L377 S383	L377-P379 WeakPolarHBondContact O-CD 3.24Å; P379-S383 VanDerWaalsContact O-CB 3.27Å; P379-S383 WeakPolarHBondContact O-CB 3.48Å; P379-S383 PolarHBondContact O-N 3.38Å
380	E	79.2	Confident	80.1	Confident	150 Å²	150	55.2 Å²	55.2	70%	0.701	28%	0.281	S	S	*	.	H	α-helix	trans	-67.6	-45.7	178.9	-64.2	-176.9	179.2	0	0	111.8	S378 S383 T384	S378-E380 PolarHBondContact O-N 2.78Å; E380-S383 PolarHBondContact O-N 2.73Å; E380-T384 WeakPolarHBondContact O-CB 3.45Å; E380-T384 PolarHBondContact O-N 3.47Å; E380-T384 PolarHBondContact O-OG1 3.04Å
381	H	80	Confident	79.3	Confident	10 Å²	10	56.5 Å²	56.5	5%	0.046	29%	0.292	C	S	.	.	H	α-helix	trans	-70.7	-38.6	177.1	-71.3	-53.2	0	0	0	112	L375 S378 T384 F385 Y436 M440	L375-H381 HydrophobicContact CD2-CB 4.39Å; S378-H381 PolarHBondContact O-N 2.79Å; S378-H381 PolarHBondContact OG-CD2 3.33Å; S378-H381 VanDerWaalsContact OG-CD2 3.24Å; S378-H381 PolarHBondContact OG-N 3.32Å; H381-T384 PolarHBondContact O-N 3.16Å; H381-F385 VanDerWaalsContact O-CB 3.31Å; H381-F385 WeakPolarHBondContact O-CB 3.42Å; H381-F385 PolarHBondContact O-N 3.16Å; H381-Y436 HydrophobicContact CB-CE2 4.44Å; H381-Y436 WeakPolarHBondContact CB-OH 3.12Å; H381-Y436 PolarHBondContact ND1-OH 2.87Å; H381-M440 VanDerWaalsContact ND1-CE 3.27Å; H381-M440 WeakPolarHBondContact ND1-CE 3.26Å
382	H	81	Confident	78.3	Confident	61 Å²	61	57.2 Å²	57.2	28%	0.282	30%	0.299	S	S	.	.	H	α-helix	trans	-53.9	-54.9	170.5	-172.9	138.4	0	0	0	110.3	L375 S378 T384 F385 N386 V405	L375-H382 WeakPolarHBondContact O-CB 3.23Å; S378-H382 WeakPolarHBondContact O-CB 3.42Å; S378-H382 PolarHBondContact O-N 3.13Å; H382-T384 VanDerWaalsContact C-N 3.33Å; H382-T384 PolarHBondContact O-N 3Å; H382-F385 PolarHBondContact O-N 3.39Å; H382-N386 PolarHBondContact CD2-ND2 3.3Å; H382-N386 PolarHBondContact NE2-ND2 3.15Å; H382-N386 PolarHBondContact O-N 3.25Å; H382-V405 HydrophobicContact CB-CG2 4.47Å
383	S	79.4	Confident	77.2	Confident	75 Å²	75	58.7 Å²	58.7	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-42.5	-179.7	-178.6	0	0	0	0	111.7	P379 E380 N386 R387	P379-S383 VanDerWaalsContact O-CB 3.27Å; P379-S383 WeakPolarHBondContact O-CB 3.48Å; P379-S383 PolarHBondContact O-N 3.38Å; E380-S383 PolarHBondContact O-N 2.73Å; S383-N386 PolarHBondContact O-N 3.4Å; S383-R387 WeakPolarHBondContact O-CB 3.46Å; S383-R387 PolarHBondContact O-N 3.32Å
384	T	80.5	Confident	76.1	Confident	30 Å²	30	65.7 Å²	65.7	18%	0.184	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-44.2	178.1	-58.2	0	0	0	0	111.8	E380 H381 H382 R387 Q388 Y436 M440	E380-T384 WeakPolarHBondContact O-CB 3.45Å; E380-T384 PolarHBondContact O-N 3.47Å; E380-T384 PolarHBondContact O-OG1 3.04Å; H381-T384 PolarHBondContact O-N 3.16Å; H382-T384 VanDerWaalsContact C-N 3.33Å; H382-T384 PolarHBondContact O-N 3Å; T384-R387 PolarHBondContact O-N 3Å; T384-Q388 HydrophobicContact CG2-CG 4.45Å; T384-Q388 WeakPolarHBondContact O-CG 3.27Å; T384-Q388 PolarHBondContact O-N 3.21Å; T384-Y436 HydrophobicContact CG2-CD2 4.35Å; T384-Y436 HydrophobicContact CG2-CE2 4.44Å; T384-M440 HydrophobicContact CG2-CE 3.59Å
385	F	81.1	Confident	74.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-48.8	176.6	178.5	-100	0	0	0	111.5	L375 H381 H382 R387 Q388 S389 L404 V405 L408 M432 L433 Y436	L375-F385 HydrophobicContact CD1-CD2 4.18Å; L375-F385 HydrophobicContact CD1-CE2 4.44Å; L375-F385 HydrophobicContact CD1-CG 4.28Å; L375-F385 HydrophobicContact CD2-CB 3.66Å; L375-F385 HydrophobicContact CD2-CD2 4.24Å; L375-F385 HydrophobicContact CD2-CG 3.98Å; H381-F385 VanDerWaalsContact O-CB 3.31Å; H381-F385 WeakPolarHBondContact O-CB 3.42Å; H381-F385 PolarHBondContact O-N 3.16Å; H382-F385 PolarHBondContact O-N 3.39Å; F385-R387 VanDerWaalsContact C-N 3.27Å; F385-R387 PolarHBondContact O-N 3.01Å; F385-Q388 PolarHBondContact O-N 2.87Å; F385-S389 VanDerWaalsContact O-CB 3.25Å; F385-S389 WeakPolarHBondContact O-CB 3.36Å; F385-S389 PolarHBondContact O-N 2.95Å; F385-S389 PolarHBondContact O-OG 3.11Å; F385-L404 HydrophobicContact CE1-CB 4.21Å; F385-V405 HydrophobicContact CD1-CG2 3.7Å; F385-V405 HydrophobicContact CE1-CG2 4.33Å; F385-L408 HydrophobicContact CE1-CD1 3.93Å; F385-L408 HydrophobicContact CE2-CD1 4.36Å; F385-L408 HydrophobicContact CZ-CD1 3.64Å; F385-M432 HydrophobicContact CE2-CB 4.3Å; F385-M432 HydrophobicContact CZ-CB 4.36Å; F385-L433 HydrophobicContact CD2-CD2 4.44Å; F385-L433 HydrophobicContact CE2-CD2 3.69Å; F385-L433 HydrophobicContact CE2-CG 4.11Å; F385-L433 HydrophobicContact CZ-CD2 4.35Å; F385-Y436 HydrophobicContact CB-CD2 3.74Å; F385-Y436 HydrophobicContact CB-CE2 4Å; F385-Y436 HydrophobicContact CB-CG 4.47Å; F385-Y436 HydrophobicContact CD2-CD2 4.04Å; F385-Y436 AromaticContact CD2-CG 3.91Å; F385-Y436 HydrophobicContact CD2-CG 3.91Å; F385-Y436 HydrophobicContact CG-CD2 4.42Å
386	N	78.3	Confident	73.1	Confident	19 Å²	19	72.4 Å²	72.4	10%	0.102	39%	0.386	C	S	.	.	H	α-helix	trans	-60.1	-38.2	176.8	-74	-7.4	0	0	0	111.9	H382 S383 A390 S401	H382-N386 PolarHBondContact CD2-ND2 3.3Å; H382-N386 PolarHBondContact NE2-ND2 3.15Å; H382-N386 PolarHBondContact O-N 3.25Å; S383-N386 PolarHBondContact O-N 3.4Å; N386-A390 VanDerWaalsContact O-CB 3.31Å; N386-A390 WeakPolarHBondContact O-CB 3.34Å; N386-A390 PolarHBondContact O-N 3.18Å; N386-S401 WeakPolarHBondContact CB-O 3.21Å; N386-S401 PolarHBondContact ND2-O 3.25Å; N386-S401 PolarHBondContact OD1-O 2.98Å
387	R	77.7	Confident	71.6	Confident	140 Å²	140	69.1 Å²	69.1	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-66.2	-47.6	176.5	-174.3	175.6	67.4	141.4	-3.8	112.2	S383 T384 F385 S389 A390 L391	S383-R387 WeakPolarHBondContact O-CB 3.46Å; S383-R387 PolarHBondContact O-N 3.32Å; T384-R387 PolarHBondContact O-N 3Å; F385-R387 VanDerWaalsContact C-N 3.27Å; F385-R387 PolarHBondContact O-N 3.01Å; R387-S389 VanDerWaalsContact C-N 3.3Å; R387-S389 PolarHBondContact O-N 2.95Å; R387-A390 PolarHBondContact O-N 3Å; R387-L391 HydrophobicContact CG-CD1 4.48Å; R387-L391 WeakPolarHBondContact O-CG 3.07Å; R387-L391 PolarHBondContact O-N 3.17Å; R387-L391 VanDerWaalsContact O-N 3.07Å
388	Q	77.4	Confident	70.4	Confident	26 Å²	26	71.1 Å²	71.1	12%	0.121	38%	0.383	C	S	.	.	H	α-helix	trans	-65.2	-37.4	178	-68.3	-54.6	-30.5	0	0	111.7	T384 F385 L391 A392 K439	T384-Q388 HydrophobicContact CG2-CG 4.45Å; T384-Q388 WeakPolarHBondContact O-CG 3.27Å; T384-Q388 PolarHBondContact O-N 3.21Å; F385-Q388 PolarHBondContact O-N 2.87Å; Q388-L391 PolarHBondContact O-N 3.09Å; Q388-A392 WeakPolarHBondContact O-CB 2.89Å; Q388-A392 PolarHBondContact O-N 3.27Å; Q388-K439 HydrophobicContact CG-CB 4.44Å
389	S	73.6	Confident	68.9	Low	0 Å²	0	77.4 Å²	77.4	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-66.7	-42.5	176.4	-55.2	0	0	0	0	111.6	F385 R387 L391 A392 S393	F385-S389 VanDerWaalsContact O-CB 3.25Å; F385-S389 WeakPolarHBondContact O-CB 3.36Å; F385-S389 PolarHBondContact O-N 2.95Å; F385-S389 PolarHBondContact O-OG 3.11Å; R387-S389 VanDerWaalsContact C-N 3.3Å; R387-S389 PolarHBondContact O-N 2.95Å; S389-L391 PolarHBondContact O-N 3.14Å; S389-A392 WeakPolarHBondContact O-CB 3.43Å; S389-A392 PolarHBondContact O-N 3.36Å; S389-A392 VanDerWaalsContact O-N 3.09Å; S389-S393 VanDerWaalsContact O-CB 3.23Å; S389-S393 WeakPolarHBondContact O-CB 3.37Å; S389-S393 PolarHBondContact O-N 3.36Å; S389-S393 PolarHBondContact O-OG 2.93Å
390	A	71	Confident	67.3	Low	31 Å²	31	77.3 Å²	77.3	26%	0.256	40%	0.403	S	S	.	.	H	α-helix	trans	-58.8	-46.3	174	0	0	0	0	0	111.6	N386 R387 A392 S393	N386-A390 VanDerWaalsContact O-CB 3.31Å; N386-A390 WeakPolarHBondContact O-CB 3.34Å; N386-A390 PolarHBondContact O-N 3.18Å; R387-A390 PolarHBondContact O-N 3Å; A390-A392 VanDerWaalsContact C-N 3.26Å; A390-A392 PolarHBondContact O-N 2.97Å; A390-S393 PolarHBondContact O-N 2.96Å; A390-S393 PolarHBondContact O-OG 2.96Å
391	L	72.1	Confident	65.8	Low	121 Å²	121	71.6 Å²	71.6	63%	0.634	38%	0.379	S	S	*	.	H	α-helix	trans	-62.3	-32.9	174.7	-69.3	169.2	0	0	0	112.7	R387 Q388 S389	R387-L391 HydrophobicContact CG-CD1 4.48Å; R387-L391 WeakPolarHBondContact O-CG 3.07Å; R387-L391 PolarHBondContact O-N 3.17Å; R387-L391 VanDerWaalsContact O-N 3.07Å; Q388-L391 PolarHBondContact O-N 3.09Å; S389-L391 PolarHBondContact O-N 3.14Å
392	A	67.5	Low	64.4	Low	20 Å²	20	74.1 Å²	74.1	17%	0.165	40%	0.402	C	S	.	.	H	α-helix	trans	-76.9	-28.1	-179	0	0	0	0	0	114.2	Q388 S389 A390 M432 K435	Q388-A392 WeakPolarHBondContact O-CB 2.89Å; Q388-A392 PolarHBondContact O-N 3.27Å; S389-A392 WeakPolarHBondContact O-CB 3.43Å; S389-A392 PolarHBondContact O-N 3.36Å; S389-A392 VanDerWaalsContact O-N 3.09Å; A390-A392 VanDerWaalsContact C-N 3.26Å; A390-A392 PolarHBondContact O-N 2.97Å; A392-M432 HydrophobicContact CB-CG 4.34Å; A392-K435 VanDerWaalsContact CA-NZ 3.32Å; A392-K435 HydrophobicContact CB-CD 3.48Å; A392-K435 VanDerWaalsContact CB-CD 3.48Å
393	S	63.6	Low	63.5	Low	31 Å²	31	76.6 Å²	76.6	22%	0.217	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-3.3	-166.1	67.5	0	0	0	0	114	S389 A390 L395	S389-S393 VanDerWaalsContact O-CB 3.23Å; S389-S393 WeakPolarHBondContact O-CB 3.37Å; S389-S393 PolarHBondContact O-N 3.36Å; S389-S393 PolarHBondContact O-OG 2.93Å; A390-S393 PolarHBondContact O-N 2.96Å; A390-S393 PolarHBondContact O-OG 2.96Å; S393-L395 WeakPolarHBondContact O-CD1 3.44Å; S393-L395 PolarHBondContact O-N 2.56Å
394	E	60.5	Low	62.8	Low	189 Å²	189	74.2 Å²	74.2	88%	0.883	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	12.7	-170.8	-65.4	-175.6	175.4	0	0	114.2	S396	E394-S396 PolarHBondContact O-N 3.22Å
395	L	53.6	Low	61.9	Low	96 Å²	96	73 Å²	73	50%	0.503	39%	0.386	S	S	.	.			trans	-83.2	114.1	-176.1	-85.5	130.9	0	0	0	110	S393 C397 L400	S393-L395 WeakPolarHBondContact O-CD1 3.44Å; S393-L395 PolarHBondContact O-N 2.56Å; L395-C397 PolarHBondContact O-N 3.31Å; L395-L400 HydrophobicContact CD2-CD1 3.48Å; L395-L400 VanDerWaalsContact CD2-CD1 3.48Å
396	S	45.7	Very low	61.2	Low	129 Å²	129	76.9 Å²	76.9	90%	0.902	41%	0.413	S	S	*	.			trans	-71	-3.5	-177.5	61.3	0	0	0	0	115.2	E394	E394-S396 PolarHBondContact O-N 3.22Å
397	C	48	Very low	60.9	Low	45 Å²	45	77.8 Å²	77.8	30%	0.304	42%	0.421	S	S	.	.			trans	-104.1	112.6	-169.6	-168	0	0	0	0	113.1	L395 Q399 L400	L395-C397 PolarHBondContact O-N 3.31Å; C397-Q399 PolarHBondContact O-N 3.12Å; C397-L400 HydrophobicContact CB-CD1 4.05Å; C397-L400 PolarHBondContact O-N 3.27Å; C397-L400 VanDerWaalsContact O-N 3.08Å
398	K	49.1	Very low	61.1	Low	189 Å²	189	71.2 Å²	71.2	82%	0.822	40%	0.396	S	S	*	.	H	α-helix	trans	-54.8	-20.7	172.9	-72.6	-178.9	177.6	177.7	0	114.3	S401	K398-S401 PolarHBondContact O-OG 2.9Å
399	Q	47.8	Very low	61.2	Low	158 Å²	158	72.2 Å²	72.2	74%	0.738	41%	0.405	S	S	*	.	H	α-helix	trans	-79.3	-29	179.2	-67.5	172.7	-36.9	0	0	112.8	C397	C397-Q399 PolarHBondContact O-N 3.12Å
400	L	47	Very low	61.6	Low	104 Å²	104	75.2 Å²	75.2	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-78.2	-34.4	177.7	-76.6	160.3	0	0	0	111.3	L395 C397 A402 K403	L395-L400 HydrophobicContact CD2-CD1 3.48Å; L395-L400 VanDerWaalsContact CD2-CD1 3.48Å; C397-L400 HydrophobicContact CB-CD1 4.05Å; C397-L400 PolarHBondContact O-N 3.27Å; C397-L400 VanDerWaalsContact O-N 3.08Å; L400-A402 VanDerWaalsContact C-N 3.32Å; L400-A402 PolarHBondContact O-N 3.46Å; L400-K403 PolarHBondContact O-N 2.84Å
401	S	47.7	Very low	62.2	Low	29 Å²	29	74.1 Å²	74.1	20%	0.203	41%	0.41	C	S	.	.	H	α-helix	trans	-69	-26.7	-180	62.7	0	0	0	0	114.2	N386 K398 K403	N386-S401 WeakPolarHBondContact CB-O 3.21Å; N386-S401 PolarHBondContact ND2-O 3.25Å; N386-S401 PolarHBondContact OD1-O 2.98Å; K398-S401 PolarHBondContact O-OG 2.9Å; S401-K403 PolarHBondContact O-N 3.19Å
402	A	50.9	Low	62.2	Low	64 Å²	64	69.8 Å²	69.8	53%	0.529	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.6	-179.2	0	0	0	0	0	114.5	L400	L400-A402 VanDerWaalsContact C-N 3.32Å; L400-A402 PolarHBondContact O-N 3.46Å
403	K	61.9	Low	62.6	Low	112 Å²	112	73.4 Å²	73.4	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	10.3	-177.9	-69.5	-174.9	178.7	-178.5	0	114.1	L400 S401 S406 S407	L400-K403 PolarHBondContact O-N 2.84Å; S401-K403 PolarHBondContact O-N 3.19Å; K403-S406 VanDerWaalsContact C-OG 3.24Å; K403-S406 WeakPolarHBondContact CA-OG 3.33Å; K403-S406 PolarHBondContact O-N 2.81Å; K403-S406 PolarHBondContact O-OG 2.91Å; K403-S407 PolarHBondContact O-N 2.68Å
404	L	63.3	Low	62.8	Low	25 Å²	25	74.2 Å²	74.2	13%	0.131	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-33.6	-177.2	-73.8	158.2	0	0	0	113.3	F385 S406 S407 M432	F385-L404 HydrophobicContact CE1-CB 4.21Å; L404-S406 VanDerWaalsContact C-N 3.27Å; L404-S406 PolarHBondContact O-N 2.97Å; L404-S407 PolarHBondContact O-N 3.45Å; L404-S407 PolarHBondContact O-OG 3.3Å; L404-M432 HydrophobicContact CD2-CE 4.34Å; L404-M432 HydrophobicContact CD2-SD 4.05Å
405	V	62.3	Low	63.3	Low	6 Å²	6	65.2 Å²	65.2	4%	0.036	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-33.2	170.9	176	0	0	0	0	111.3	L375 R376 H382 F385 S407 L408	L375-V405 HydrophobicContact CB-CG1 4.47Å; R376-V405 HydrophobicContact CG-CG1 3.95Å; H382-V405 HydrophobicContact CB-CG2 4.47Å; F385-V405 HydrophobicContact CD1-CG2 3.7Å; F385-V405 HydrophobicContact CE1-CG2 4.33Å; V405-S407 PolarHBondContact O-N 3.42Å; V405-L408 PolarHBondContact O-N 2.89Å
406	S	67	Low	64.8	Low	80 Å²	80	60.7 Å²	60.7	56%	0.559	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.8	174.5	45.9	0	0	0	0	113.6	K403 L404 L408	K403-S406 VanDerWaalsContact C-OG 3.24Å; K403-S406 WeakPolarHBondContact CA-OG 3.33Å; K403-S406 PolarHBondContact O-N 2.81Å; K403-S406 PolarHBondContact O-OG 2.91Å; L404-S406 VanDerWaalsContact C-N 3.27Å; L404-S406 PolarHBondContact O-N 2.97Å; S406-L408 VanDerWaalsContact C-N 3.26Å; S406-L408 PolarHBondContact O-N 2.97Å
407	S	71.3	Confident	66.6	Low	39 Å²	39	54.7 Å²	54.7	27%	0.273	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.3	173.6	68.3	0	0	0	0	113.2	K403 L404 V405 P409 S425 H429	K403-S407 PolarHBondContact O-N 2.68Å; L404-S407 PolarHBondContact O-N 3.45Å; L404-S407 PolarHBondContact O-OG 3.3Å; V405-S407 PolarHBondContact O-N 3.42Å; S407-P409 WeakPolarHBondContact O-CD 3.47Å; S407-S425 WeakPolarHBondContact O-CB 3Å; S407-S425 PolarHBondContact O-OG 2.86Å; S407-H429 PolarHBondContact OG-CE1 3.27Å; S407-H429 VanDerWaalsContact OG-CE1 3.23Å; S407-H429 PolarHBondContact OG-NE2 3.2Å
408	L	81.2	Confident	68.1	Low	2 Å²	2	52.9 Å²	52.9	1%	0.01	28%	0.281	C	S	.	.	S	Bend	trans	-99.5	87.6	170.9	-67	167.2	0	0	0	110.2	L375 R376 F385 V405 S406 S425 F426 H429 L433	L375-L408 HydrophobicContact CD1-CD1 3.95Å; R376-L408 PolarHBondContact NH2-O 2.87Å; F385-L408 HydrophobicContact CE1-CD1 3.93Å; F385-L408 HydrophobicContact CE2-CD1 4.36Å; F385-L408 HydrophobicContact CZ-CD1 3.64Å; V405-L408 PolarHBondContact O-N 2.89Å; S406-L408 VanDerWaalsContact C-N 3.26Å; S406-L408 PolarHBondContact O-N 2.97Å; L408-S425 VanDerWaalsContact CD2-OG 3.3Å; L408-S425 WeakPolarHBondContact CD2-OG 3.21Å; L408-F426 HydrophobicContact CD2-CD2 3.88Å; L408-F426 HydrophobicContact CD2-CE2 3.96Å; L408-H429 HydrophobicContact CD2-CB 4.26Å; L408-L433 HydrophobicContact CD1-CD2 4.29Å
409	P	79.9	Confident	70	Confident	46 Å²	46	43.9 Å²	43.9	30%	0.299	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-69.6	130.8	179.2	29.3	-34.5	0	0	0	110.7	I372 R376 S407 M422	I372-P409 WeakPolarHBondContact CD1-O 3.22Å; R376-P409 VanDerWaalsContact NH2-CA 3.33Å; S407-P409 WeakPolarHBondContact O-CD 3.47Å; P409-M422 WeakPolarHBondContact O-CB 3.34Å; P409-M422 VanDerWaalsContact O-CG 3.31Å; P409-M422 WeakPolarHBondContact O-CG 3.33Å
410	L	81.9	Confident	71.9	Confident	64 Å²	64	36.3 Å²	36.3	34%	0.335	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-72.5	126.5	166.3	-178.6	64.1	0	0	0	107.8	R369 I372 R376	R369-L410 HydrophobicContact CB-CD1 4.11Å; R369-L410 HydrophobicContact CG-CD1 4.07Å; I372-L410 HydrophobicContact CB-CD1 4.22Å; I372-L410 HydrophobicContact CD1-CD1 4.18Å; I372-L410 HydrophobicContact CG2-CB 3.84Å; I372-L410 HydrophobicContact CG2-CD1 4.26Å; R376-L410 VanDerWaalsContact NH2-N 3.13Å
411	D	83.7	Confident	73.8	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.043	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-67.5	152.2	-179.5	76.4	-35.3	0	0	0	112.6	R369 Q413 T419 M422	R369-D411 VanDerWaalsContact CG-OD1 3.27Å; R369-D411 WeakPolarHBondContact CG-OD1 3.37Å; R369-D411 IonicContact CZ-OD1 2.69Å; R369-D411 IonicContact CZ-OD2 2.71Å; R369-D411 IonicContact NE-OD1 2.78Å; R369-D411 PolarHBondContact NE-OD1 2.7Å; R369-D411 IonicContact NE-OD2 2.64Å; R369-D411 PolarHBondContact NE-OD2 2.63Å; R369-D411 IonicContact NH2-OD1 3.88Å; R369-D411 IonicContact NH2-OD2 2.77Å; R369-D411 PolarHBondContact NH2-OD2 3.48Å; D411-Q413 PolarHBondContact O-N 3.19Å; D411-T419 PolarHBondContact OD2-OG1 3.39Å; D411-M422 HydrophobicContact CB-CB 3.95Å; D411-M422 HydrophobicContact CB-CE 4.01Å; D411-M422 HydrophobicContact CB-CG 4.46Å; D411-M422 HydrophobicContact CB-SD 3.76Å
412	V	72.7	Confident	75.9	Confident	30 Å²	30	32.3 Å²	32.3	18%	0.182	18%	0.183	C	C	.	.			trans	-80.5	110.5	163.2	177.2	0	0	0	0	107.8	D333 Y414 C415 S418	D333-V412 HydrophobicContact CB-CG2 4.35Å; V412-Y414 HydrophobicContact CG1-CD1 4Å; V412-Y414 HydrophobicContact CG1-CD2 3.57Å; V412-Y414 HydrophobicContact CG1-CE1 3.49Å; V412-Y414 VanDerWaalsContact CG1-CE1 3.49Å; V412-Y414 HydrophobicContact CG1-CE2 3.02Å; V412-Y414 HydrophobicContact CG1-CG 4.03Å; V412-Y414 VanDerWaalsContact CG1-OH 3.24Å; V412-Y414 WeakPolarHBondContact CG1-OH 3.15Å; V412-Y414 PolarHBondContact O-N 3.05Å; V412-C415 HydrophobicContact CB-CB 3.76Å; V412-C415 HydrophobicContact CG1-CB 3.88Å; V412-C415 WeakPolarHBondContact O-CA 3.2Å; V412-C415 VanDerWaalsContact O-CB 3.28Å; V412-C415 WeakPolarHBondContact O-CB 3.18Å; V412-C415 PolarHBondContact O-N 3.16Å; V412-S418 PolarHBondContact N-OG 3.26Å
413	Q	76.3	Confident	78	Confident	95 Å²	95	29.3 Å²	29.3	44%	0.444	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-0.6	-168.2	-59.8	-167.9	19.2	0	0	116.5	P292 D411	P292-Q413 WeakPolarHBondContact CD-O 3.44Å; D411-Q413 PolarHBondContact O-N 3.19Å
414	Y	67.2	Low	79.4	Confident	48 Å²	48	24.6 Å²	24.6	19%	0.188	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	10	172.8	44.7	-92.3	0	0	0	111.1	R294 T336 E337 V412	R294-Y414 PolarHBondContact NH2-OH 3.09Å; T336-Y414 VanDerWaalsContact C-CE2 3.48Å; T336-Y414 WeakPolarHBondContact O-CD2 3.05Å; E337-Y414 HydrophobicContact CB-CE2 4.07Å; E337-Y414 HydrophobicContact CG-CE2 3.49Å; E337-Y414 VanDerWaalsContact CG-CE2 3.49Å; E337-Y414 WeakPolarHBondContact CG-OH 3.44Å; E337-Y414 VanDerWaalsContact N-CE2 3.34Å; E337-Y414 PolarHBondContact OE1-OH 3.15Å; V412-Y414 HydrophobicContact CG1-CD1 4Å; V412-Y414 HydrophobicContact CG1-CD2 3.57Å; V412-Y414 HydrophobicContact CG1-CE1 3.49Å; V412-Y414 VanDerWaalsContact CG1-CE1 3.49Å; V412-Y414 HydrophobicContact CG1-CE2 3.02Å; V412-Y414 HydrophobicContact CG1-CG 4.03Å; V412-Y414 VanDerWaalsContact CG1-OH 3.24Å; V412-Y414 WeakPolarHBondContact CG1-OH 3.15Å; V412-Y414 PolarHBondContact O-N 3.05Å
415	C	71.8	Confident	80.6	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.			trans	-123	100.8	-175.7	-173.2	0	0	0	0	111.7	L332 T336 V412 C417 S418 T419	L332-C415 PolarHBondContact O-SG 3.2Å; T336-C415 VanDerWaalsContact CB-CB 3.44Å; T336-C415 HydrophobicContact CG2-CB 3.67Å; T336-C415 WeakPolarHBondContact CG2-SG 3.27Å; T336-C415 WeakPolarHBondContact OG1-CB 3.41Å; T336-C415 PolarHBondContact OG1-SG 3.34Å; V412-C415 HydrophobicContact CB-CB 3.76Å; V412-C415 HydrophobicContact CG1-CB 3.88Å; V412-C415 WeakPolarHBondContact O-CA 3.2Å; V412-C415 VanDerWaalsContact O-CB 3.28Å; V412-C415 WeakPolarHBondContact O-CB 3.18Å; V412-C415 PolarHBondContact O-N 3.16Å; C415-C417 PolarHBondContact O-N 3.23Å; C415-S418 WeakPolarHBondContact O-CB 3.15Å; C415-S418 PolarHBondContact O-N 2.92Å; C415-S418 VanDerWaalsContact O-N 3.16Å; C415-S418 VanDerWaalsContact SG-CB 3.58Å; C415-S418 PolarHBondContact SG-N 3.46Å; C415-T419 PolarHBondContact O-N 3.32Å; C415-T419 PolarHBondContact O-OG1 2.96Å; C415-T419 VanDerWaalsContact O-OG1 3.12Å
416	W	84.9	Confident	82.1	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-30.8	177.9	67.6	-100.8	0	0	0	112.9	H281 V284 W291 T419 A420 L471 F474 L475 V478	H281-W416 AromaticContact CE1-CD1 3.88Å; H281-W416 AromaticContact CG-NE1 3.91Å; H281-W416 AromaticContact ND1-CD1 3.33Å; H281-W416 VanDerWaalsContact ND1-CD1 3.33Å; H281-W416 AromaticContact ND1-NE1 3.3Å; H281-W416 PolarHBondContact ND1-NE1 3.18Å; V284-W416 HydrophobicContact CB-CD2 4.13Å; V284-W416 HydrophobicContact CB-CG 4.13Å; V284-W416 HydrophobicContact CG1-CB 3.8Å; V284-W416 HydrophobicContact CG1-CD2 3.68Å; V284-W416 HydrophobicContact CG1-CE3 4.13Å; V284-W416 HydrophobicContact CG1-CG 3.53Å; V284-W416 HydrophobicContact CG2-CD2 4.41Å; V284-W416 HydrophobicContact CG2-CZ2 4.31Å; W291-W416 HydrophobicContact CD2-CB 4.09Å; W291-W416 HydrophobicContact CE3-CB 4.17Å; W291-W416 HydrophobicContact CH2-CB 3.42Å; W291-W416 VanDerWaalsContact CH2-CB 3.42Å; W291-W416 VanDerWaalsContact CZ2-CA 3.45Å; W291-W416 HydrophobicContact CZ2-CB 3.3Å; W291-W416 HydrophobicContact CZ3-CB 3.83Å; W416-T419 WeakPolarHBondContact O-CB 3.26Å; W416-T419 PolarHBondContact O-N 2.99Å; W416-A420 WeakPolarHBondContact O-CB 3.41Å; W416-A420 PolarHBondContact O-N 3.45Å; W416-L471 HydrophobicContact CE3-CD2 4.05Å; W416-F474 HydrophobicContact CH2-CB 3.54Å; W416-F474 HydrophobicContact CZ2-CB 4.32Å; W416-F474 HydrophobicContact CZ3-CB 3.83Å; W416-L475 HydrophobicContact CH2-CB 4.44Å; W416-L475 HydrophobicContact CZ3-CB 3.97Å; W416-V478 HydrophobicContact CH2-CG2 4.09Å; W416-V478 HydrophobicContact CZ2-CG2 4Å
417	C	82.1	Confident	83.3	Confident	3 Å²	3	22 Å²	22	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-70.8	-40.5	178.5	-49.8	0	0	0	0	112.1	L332 C415 T419 A420 N421 L475	L332-C417 HydrophobicContact CB-CB 3.64Å; L332-C417 HydrophobicContact CD1-CB 3.68Å; L332-C417 HydrophobicContact CD2-CB 3.58Å; L332-C417 WeakPolarHBondContact CD2-SG 3.43Å; L332-C417 HydrophobicContact CG-CB 3.77Å; C415-C417 PolarHBondContact O-N 3.23Å; C417-T419 VanDerWaalsContact C-N 3.3Å; C417-A420 PolarHBondContact O-N 3.38Å; C417-N421 PolarHBondContact O-N 3.1Å; C417-L475 HydrophobicContact CB-CD1 3.75Å
418	S	80.3	Confident	84.1	Confident	6 Å²	6	26.7 Å²	26.7	4%	0.042	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-41	172.4	-157.5	0	0	0	0	110.5	D333 V412 C415 N421 M422	D333-S418 WeakPolarHBondContact OD1-CB 2.74Å; D333-S418 PolarHBondContact OD1-OG 3.02Å; V412-S418 PolarHBondContact N-OG 3.26Å; C415-S418 WeakPolarHBondContact O-CB 3.15Å; C415-S418 PolarHBondContact O-N 2.92Å; C415-S418 VanDerWaalsContact O-N 3.16Å; C415-S418 VanDerWaalsContact SG-CB 3.58Å; C415-S418 PolarHBondContact SG-N 3.46Å; S418-N421 PolarHBondContact O-N 3.49Å; S418-M422 WeakPolarHBondContact O-CB 3.11Å; S418-M422 PolarHBondContact O-N 2.96Å
419	T	89	Confident	84.4	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-44.7	172.7	-55	0	0	0	0	111.4	W291 L365 D411 C415 W416 C417 N421 M422 I423	W291-T419 HydrophobicContact CZ2-CG2 4.19Å; W291-T419 PolarHBondContact NE1-OG1 3.41Å; L365-T419 HydrophobicContact CD1-CG2 4.03Å; L365-T419 HydrophobicContact CD2-CG2 3.52Å; L365-T419 HydrophobicContact CG-CG2 4.41Å; D411-T419 PolarHBondContact OD2-OG1 3.39Å; C415-T419 PolarHBondContact O-N 3.32Å; C415-T419 PolarHBondContact O-OG1 2.96Å; C415-T419 VanDerWaalsContact O-OG1 3.12Å; W416-T419 WeakPolarHBondContact O-CB 3.26Å; W416-T419 PolarHBondContact O-N 2.99Å; C417-T419 VanDerWaalsContact C-N 3.3Å; T419-N421 VanDerWaalsContact C-N 3.33Å; T419-N421 PolarHBondContact O-N 2.63Å; T419-M422 HydrophobicContact CG2-CE 4.33Å; T419-M422 WeakPolarHBondContact O-CB 3.39Å; T419-M422 PolarHBondContact O-N 2.76Å; T419-I423 HydrophobicContact CG2-CD1 3.97Å; T419-I423 HydrophobicContact CG2-CG1 4.38Å; T419-I423 VanDerWaalsContact O-CG1 3.23Å; T419-I423 WeakPolarHBondContact O-CG1 3.41Å; T419-I423 PolarHBondContact O-N 2.96Å
420	A	88.3	Confident	84.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-37.6	176	0	0	0	0	0	112.5	W416 C417 G424 Q468 L471 L475	W416-A420 WeakPolarHBondContact O-CB 3.41Å; W416-A420 PolarHBondContact O-N 3.45Å; C417-A420 PolarHBondContact O-N 3.38Å; A420-G424 PolarHBondContact O-N 2.88Å; A420-Q468 PolarHBondContact O-NE2 3.4Å; A420-Q468 PolarHBondContact O-OE1 2.95Å; A420-L471 HydrophobicContact CB-CB 3.97Å; A420-L471 HydrophobicContact CB-CD1 4.08Å; A420-L475 HydrophobicContact CB-CD2 4.04Å
421	N	86.8	Confident	85.1	Confident	49 Å²	49	33.1 Å²	33.1	26%	0.262	17%	0.165	S	C	.	.	H	α-helix	trans	-66.9	-42.2	173.3	-72.6	-20.6	0	0	0	111.8	C417 S418 T419 G424 S425 L475	C417-N421 PolarHBondContact O-N 3.1Å; S418-N421 PolarHBondContact O-N 3.49Å; T419-N421 VanDerWaalsContact C-N 3.33Å; T419-N421 PolarHBondContact O-N 2.63Å; N421-G424 PolarHBondContact O-N 2.97Å; N421-S425 WeakPolarHBondContact O-CB 3.31Å; N421-S425 PolarHBondContact O-N 3.02Å; N421-L475 WeakPolarHBondContact OD1-CD2 2.97Å
422	M	92.2	Very high	85.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.1	-48.5	174.3	178.4	-176.2	71.8	0	0	111.1	L365 C368 R369 I372 P409 D411 S418 T419 S425 F426	L365-M422 HydrophobicContact CD2-CE 4.1Å; C368-M422 HydrophobicContact CB-CE 3.92Å; C368-M422 HydrophobicContact CB-SD 4.2Å; R369-M422 HydrophobicContact CG-CE 4.36Å; R369-M422 HydrophobicContact CG-SD 4.23Å; I372-M422 HydrophobicContact CD1-CG 3.64Å; I372-M422 HydrophobicContact CD1-SD 3.46Å; I372-M422 WeakPolarHBondContact CD1-SD 3.37Å; P409-M422 WeakPolarHBondContact O-CB 3.34Å; P409-M422 VanDerWaalsContact O-CG 3.31Å; P409-M422 WeakPolarHBondContact O-CG 3.33Å; D411-M422 HydrophobicContact CB-CB 3.95Å; D411-M422 HydrophobicContact CB-CE 4.01Å; D411-M422 HydrophobicContact CB-CG 4.46Å; D411-M422 HydrophobicContact CB-SD 3.76Å; S418-M422 WeakPolarHBondContact O-CB 3.11Å; S418-M422 PolarHBondContact O-N 2.96Å; T419-M422 HydrophobicContact CG2-CE 4.33Å; T419-M422 WeakPolarHBondContact O-CB 3.39Å; T419-M422 PolarHBondContact O-N 2.76Å; M422-S425 PolarHBondContact O-N 3.33Å; M422-F426 HydrophobicContact CG-CD2 4.22Å; M422-F426 HydrophobicContact CG-CE2 4.3Å; M422-F426 WeakPolarHBondContact O-CD2 3.49Å; M422-F426 PolarHBondContact O-N 2.75Å
423	I	94.2	Very high	86	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-48.1	178.1	-63.2	164.4	0	0	0	110.3	L365 T419 S425 F426 L427 L464 L467 Q468 L471	L365-I423 HydrophobicContact CD2-CD1 3.96Å; L365-I423 HydrophobicContact CD2-CG1 4.06Å; T419-I423 HydrophobicContact CG2-CD1 3.97Å; T419-I423 HydrophobicContact CG2-CG1 4.38Å; T419-I423 VanDerWaalsContact O-CG1 3.23Å; T419-I423 WeakPolarHBondContact O-CG1 3.41Å; T419-I423 PolarHBondContact O-N 2.96Å; I423-S425 VanDerWaalsContact C-N 3.25Å; I423-S425 PolarHBondContact O-N 3.36Å; I423-F426 WeakPolarHBondContact O-CB 3.44Å; I423-F426 PolarHBondContact O-N 3.33Å; I423-L427 HydrophobicContact CG2-CD1 3.91Å; I423-L427 HydrophobicContact CG2-CG 4.27Å; I423-L427 WeakPolarHBondContact O-CG 2.98Å; I423-L427 PolarHBondContact O-N 3.19Å; I423-L464 HydrophobicContact CG1-CD2 4.27Å; I423-L464 HydrophobicContact CG2-CB 4.14Å; I423-L464 HydrophobicContact CG2-CD2 4.48Å; I423-L464 WeakPolarHBondContact CG2-O 3.49Å; I423-L467 HydrophobicContact CD1-CB 4.48Å; I423-L467 HydrophobicContact CD1-CD2 3.67Å; I423-L467 HydrophobicContact CD1-CG 3.9Å; I423-Q468 VanDerWaalsContact CB-OE1 3.27Å; I423-Q468 HydrophobicContact CG2-CB 3.8Å; I423-Q468 HydrophobicContact CG2-CG 4.36Å; I423-Q468 VanDerWaalsContact CG2-OE1 3.31Å; I423-L471 HydrophobicContact CD1-CD1 4.18Å
424	G	91.5	Very high	86.6	Confident	13 Å²	13	31.3 Å²	31.3	13%	0.134	16%	0.156	C	C	.	.	H	α-helix	trans	-55.4	-41.4	176.6	0	0	0	0	0	112.4	A420 N421 L427 N428	A420-G424 PolarHBondContact O-N 2.88Å; N421-G424 PolarHBondContact O-N 2.97Å; G424-L427 PolarHBondContact O-N 2.81Å; G424-N428 WeakPolarHBondContact O-CB 3.41Å; G424-N428 PolarHBondContact O-N 3.48Å; G424-N428 PolarHBondContact O-ND2 3.48Å
425	S	88.9	Confident	87.5	Confident	11 Å²	11	33.3 Å²	33.3	8%	0.077	17%	0.166	C	C	.	.	H	α-helix	trans	-65.4	-43.3	173.7	-180	0	0	0	0	112.8	S407 L408 N421 M422 I423 L427 N428 H429	S407-S425 WeakPolarHBondContact O-CB 3Å; S407-S425 PolarHBondContact O-OG 2.86Å; L408-S425 VanDerWaalsContact CD2-OG 3.3Å; L408-S425 WeakPolarHBondContact CD2-OG 3.21Å; N421-S425 WeakPolarHBondContact O-CB 3.31Å; N421-S425 PolarHBondContact O-N 3.02Å; M422-S425 PolarHBondContact O-N 3.33Å; I423-S425 VanDerWaalsContact C-N 3.25Å; I423-S425 PolarHBondContact O-N 3.36Å; S425-L427 VanDerWaalsContact C-N 3.33Å; S425-L427 PolarHBondContact O-N 2.91Å; S425-N428 PolarHBondContact O-N 3.04Å; S425-H429 PolarHBondContact O-N 2.92Å; S425-H429 PolarHBondContact O-ND1 3.48Å; S425-H429 PolarHBondContact OG-ND1 3.23Å
426	F	92.7	Very high	88.3	Confident	1 Å²	1	33.4 Å²	33.4	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-57.7	-46.3	175.4	-96	-111.3	0	0	0	112	C368 I371 I372 L408 M422 I423 H429 R430 L433 L456 W461	C368-F426 HydrophobicContact CB-CD1 4.38Å; C368-F426 HydrophobicContact CB-CE1 3.95Å; C368-F426 HydrophobicContact CB-CE2 4.23Å; C368-F426 HydrophobicContact CB-CZ 3.86Å; C368-F426 VanDerWaalsContact SG-CD1 3.6Å; I371-F426 HydrophobicContact CB-CE1 4.36Å; I371-F426 HydrophobicContact CB-CZ 4.14Å; I371-F426 HydrophobicContact CD1-CE1 3.98Å; I371-F426 HydrophobicContact CG2-CE1 4.26Å; I371-F426 HydrophobicContact CG2-CZ 4.06Å; I372-F426 HydrophobicContact CD1-CE2 3.52Å; I372-F426 HydrophobicContact CD1-CZ 4.1Å; I372-F426 HydrophobicContact CG1-CE2 3.47Å; I372-F426 VanDerWaalsContact CG1-CE2 3.47Å; I372-F426 HydrophobicContact CG1-CZ 3.69Å; L408-F426 HydrophobicContact CD2-CD2 3.88Å; L408-F426 HydrophobicContact CD2-CE2 3.96Å; M422-F426 HydrophobicContact CG-CD2 4.22Å; M422-F426 HydrophobicContact CG-CE2 4.3Å; M422-F426 WeakPolarHBondContact O-CD2 3.49Å; M422-F426 PolarHBondContact O-N 2.75Å; I423-F426 WeakPolarHBondContact O-CB 3.44Å; I423-F426 PolarHBondContact O-N 3.33Å; F426-H429 CarbonylContact O-C 3.5Å; F426-H429 PolarHBondContact O-N 2.92Å; F426-R430 PolarHBondContact O-N 3.15Å; F426-L433 HydrophobicContact CD1-CD1 3.76Å; F426-L433 HydrophobicContact CE1-CD1 4.04Å; F426-L433 HydrophobicContact CG-CD1 4.23Å; F426-L456 HydrophobicContact CD1-CD1 3.92Å; F426-L456 HydrophobicContact CE1-CD1 4.26Å; F426-W461 HydrophobicContact CB-CH2 4.42Å; F426-W461 HydrophobicContact CB-CZ3 4.15Å; F426-W461 HydrophobicContact CD1-CH2 4.25Å; F426-W461 WeakPolarHBondContact O-CH2 3.3Å; F426-W461 WeakPolarHBondContact O-CZ3 3.38Å
427	L	92.3	Very high	88.5	Confident	46 Å²	46	34 Å²	34	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-42.8	178.8	-66.5	171.7	0	0	0	111.4	I423 G424 S425 H429 R430 W461 L464 K465 Q468	I423-L427 HydrophobicContact CG2-CD1 3.91Å; I423-L427 HydrophobicContact CG2-CG 4.27Å; I423-L427 WeakPolarHBondContact O-CG 2.98Å; I423-L427 PolarHBondContact O-N 3.19Å; G424-L427 PolarHBondContact O-N 2.81Å; S425-L427 VanDerWaalsContact C-N 3.33Å; S425-L427 PolarHBondContact O-N 2.91Å; L427-H429 VanDerWaalsContact C-N 3.28Å; L427-H429 PolarHBondContact O-N 3.38Å; L427-R430 WeakPolarHBondContact O-CB 2.97Å; L427-R430 PolarHBondContact O-N 3.39Å; L427-W461 HydrophobicContact CD2-CE3 4.05Å; L427-W461 HydrophobicContact CD2-CZ3 4.25Å; L427-L464 HydrophobicContact CD2-CB 4.42Å; L427-K465 HydrophobicContact CD2-CB 4.25Å; L427-Q468 HydrophobicContact CD1-CB 3.66Å; L427-Q468 HydrophobicContact CD1-CG 3.79Å
428	N	88.4	Confident	88.7	Confident	137 Å²	137	36.1 Å²	36.1	73%	0.733	19%	0.187	S	C	*	.	H	α-helix	trans	-65.1	-29.9	177.1	-72.1	-17	0	0	0	113.1	G424 S425	G424-N428 WeakPolarHBondContact O-CB 3.41Å; G424-N428 PolarHBondContact O-N 3.48Å; G424-N428 PolarHBondContact O-ND2 3.48Å; S425-N428 PolarHBondContact O-N 3.04Å
429	H	87.9	Confident	89	Confident	29 Å²	29	39.6 Å²	39.6	13%	0.134	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	13.3	-178.1	-59.8	89.9	0	0	0	113.7	S407 L408 S425 F426 L427 Q431 M432 L433	S407-H429 PolarHBondContact OG-CE1 3.27Å; S407-H429 VanDerWaalsContact OG-CE1 3.23Å; S407-H429 PolarHBondContact OG-NE2 3.2Å; L408-H429 HydrophobicContact CD2-CB 4.26Å; S425-H429 PolarHBondContact O-N 2.92Å; S425-H429 PolarHBondContact O-ND1 3.48Å; S425-H429 PolarHBondContact OG-ND1 3.23Å; F426-H429 CarbonylContact O-C 3.5Å; F426-H429 PolarHBondContact O-N 2.92Å; L427-H429 VanDerWaalsContact C-N 3.28Å; L427-H429 PolarHBondContact O-N 3.38Å; H429-Q431 PolarHBondContact O-N 2.78Å; H429-M432 WeakPolarHBondContact O-CB 3.23Å; H429-M432 PolarHBondContact O-N 3.03Å; H429-L433 PolarHBondContact O-N 3.01Å
430	R	90.7	Very high	88.8	Confident	73 Å²	73	39.9 Å²	39.9	28%	0.275	20%	0.203	S	C	.	.	H	α-helix	trans	-49.1	-51.3	-176.6	173.1	169.7	174.5	-179.6	-2	113.2	F426 L427 M432 L433 D434 E458 W461	F426-R430 PolarHBondContact O-N 3.15Å; L427-R430 WeakPolarHBondContact O-CB 2.97Å; L427-R430 PolarHBondContact O-N 3.39Å; R430-M432 PolarHBondContact O-N 3.34Å; R430-L433 PolarHBondContact O-N 3.48Å; R430-L433 VanDerWaalsContact O-N 3.13Å; R430-D434 WeakPolarHBondContact CG-OD2 3.31Å; R430-D434 IonicContact NE-OD2 3.83Å; R430-D434 VanDerWaalsContact O-CG 3.31Å; R430-D434 PolarHBondContact O-N 3.37Å; R430-E458 IonicContact CZ-OE1 2.73Å; R430-E458 IonicContact CZ-OE2 2.85Å; R430-E458 IonicContact NH2-OE1 3.71Å; R430-E458 PolarHBondContact NH2-OE1 3.44Å; R430-E458 IonicContact NH2-OE2 2.72Å; R430-E458 PolarHBondContact NH2-OE2 2.98Å; R430-W461 HydrophobicContact CB-CH2 3.81Å; R430-W461 HydrophobicContact CB-CZ2 4.06Å; R430-W461 HydrophobicContact CB-CZ3 4.09Å; R430-W461 HydrophobicContact CG-CD2 4.15Å; R430-W461 HydrophobicContact CG-CE3 4.37Å; R430-W461 HydrophobicContact CG-CH2 3.97Å; R430-W461 HydrophobicContact CG-CZ2 3.71Å; R430-W461 HydrophobicContact CG-CZ3 4.29Å
431	Q	86	Confident	88.6	Confident	145 Å²	145	47 Å²	47	68%	0.678	23%	0.234	S	C	*	.	H	α-helix	trans	-58	-35.6	-179.4	-64.2	-177.3	4.2	0	0	113.1	H429 K435	H429-Q431 PolarHBondContact O-N 2.78Å; Q431-K435 WeakPolarHBondContact O-CG 3.41Å; Q431-K435 PolarHBondContact O-N 3.04Å
432	M	85.4	Confident	88.5	Confident	33 Å²	33	50.9 Å²	50.9	16%	0.163	25%	0.25	C	S	.	.	H	α-helix	trans	-74.6	-41.4	179.4	-60.4	-179.4	-177.1	0	0	111.1	F385 A392 L404 H429 R430 K435 Y436	F385-M432 HydrophobicContact CE2-CB 4.3Å; F385-M432 HydrophobicContact CZ-CB 4.36Å; A392-M432 HydrophobicContact CB-CG 4.34Å; L404-M432 HydrophobicContact CD2-CE 4.34Å; L404-M432 HydrophobicContact CD2-SD 4.05Å; H429-M432 WeakPolarHBondContact O-CB 3.23Å; H429-M432 PolarHBondContact O-N 3.03Å; R430-M432 PolarHBondContact O-N 3.34Å; M432-K435 PolarHBondContact O-N 3.1Å; M432-Y436 WeakPolarHBondContact O-CB 3.47Å; M432-Y436 PolarHBondContact O-N 3.18Å
433	L	88.8	Confident	87.9	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-44.4	175.1	-72.2	165.2	0	0	0	111.1	I371 L375 F385 L408 F426 H429 R430 K435 Y436 F437 W461	I371-L433 HydrophobicContact CG2-CD2 4.23Å; L375-L433 HydrophobicContact CD1-CD2 4.34Å; F385-L433 HydrophobicContact CD2-CD2 4.44Å; F385-L433 HydrophobicContact CE2-CD2 3.69Å; F385-L433 HydrophobicContact CE2-CG 4.11Å; F385-L433 HydrophobicContact CZ-CD2 4.35Å; L408-L433 HydrophobicContact CD1-CD2 4.29Å; F426-L433 HydrophobicContact CD1-CD1 3.76Å; F426-L433 HydrophobicContact CE1-CD1 4.04Å; F426-L433 HydrophobicContact CG-CD1 4.23Å; H429-L433 PolarHBondContact O-N 3.01Å; R430-L433 PolarHBondContact O-N 3.48Å; R430-L433 VanDerWaalsContact O-N 3.13Å; L433-K435 PolarHBondContact O-N 3.49Å; L433-Y436 WeakPolarHBondContact O-CB 3.24Å; L433-Y436 PolarHBondContact O-N 3.14Å; L433-F437 HydrophobicContact CD2-CE2 4.32Å; L433-F437 WeakPolarHBondContact O-CD2 3.26Å; L433-F437 PolarHBondContact O-N 2.98Å; L433-W461 HydrophobicContact CB-CZ2 4.41Å; L433-W461 HydrophobicContact CD1-CH2 3.85Å; L433-W461 HydrophobicContact CD1-CZ2 4.39Å
434	D	89.6	Confident	87	Confident	60 Å²	60	62.1 Å²	62.1	32%	0.321	30%	0.304	S	S	.	.	H	α-helix	trans	-60	-44.8	178.1	-69.4	-23.9	0	0	0	111.4	R430 F437 A438 W461	R430-D434 WeakPolarHBondContact CG-OD2 3.31Å; R430-D434 IonicContact NE-OD2 3.83Å; R430-D434 VanDerWaalsContact O-CG 3.31Å; R430-D434 PolarHBondContact O-N 3.37Å; D434-F437 PolarHBondContact O-N 3.47Å; D434-A438 WeakPolarHBondContact O-CB 3.43Å; D434-A438 PolarHBondContact O-N 3.11Å; D434-W461 PolarHBondContact OD1-NE1 2.88Å
435	K	85.8	Confident	86.4	Confident	91 Å²	91	63.9 Å²	63.9	40%	0.396	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-41.1	174.7	-76	174.5	176.6	179.6	0	112.6	A392 Q431 M432 L433 K439	A392-K435 VanDerWaalsContact CA-NZ 3.32Å; A392-K435 HydrophobicContact CB-CD 3.48Å; A392-K435 VanDerWaalsContact CB-CD 3.48Å; Q431-K435 WeakPolarHBondContact O-CG 3.41Å; Q431-K435 PolarHBondContact O-N 3.04Å; M432-K435 PolarHBondContact O-N 3.1Å; L433-K435 PolarHBondContact O-N 3.49Å; K435-K439 PolarHBondContact O-N 3.14Å
436	Y	87.8	Confident	85.9	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-48.4	175	167	-94.6	0	0	0	111.7	L375 H381 T384 F385 M432 L433 K439 M440 V451	L375-Y436 HydrophobicContact CD2-CD2 4.43Å; L375-Y436 HydrophobicContact CD2-CE1 4.07Å; L375-Y436 HydrophobicContact CD2-CE2 3.75Å; H381-Y436 HydrophobicContact CB-CE2 4.44Å; H381-Y436 WeakPolarHBondContact CB-OH 3.12Å; H381-Y436 PolarHBondContact ND1-OH 2.87Å; T384-Y436 HydrophobicContact CG2-CD2 4.35Å; T384-Y436 HydrophobicContact CG2-CE2 4.44Å; F385-Y436 HydrophobicContact CB-CD2 3.74Å; F385-Y436 HydrophobicContact CB-CE2 4Å; F385-Y436 HydrophobicContact CB-CG 4.47Å; F385-Y436 HydrophobicContact CD2-CD2 4.04Å; F385-Y436 AromaticContact CD2-CG 3.91Å; F385-Y436 HydrophobicContact CD2-CG 3.91Å; F385-Y436 HydrophobicContact CG-CD2 4.42Å; M432-Y436 WeakPolarHBondContact O-CB 3.47Å; M432-Y436 PolarHBondContact O-N 3.18Å; L433-Y436 WeakPolarHBondContact O-CB 3.24Å; L433-Y436 PolarHBondContact O-N 3.14Å; Y436-K439 WeakPolarHBondContact O-CB 3.06Å; Y436-K439 PolarHBondContact O-N 3.38Å; Y436-M440 HydrophobicContact CD1-CG 4.5Å; Y436-M440 HydrophobicContact CD2-CE 3.92Å; Y436-M440 HydrophobicContact CE1-CG 4.07Å; Y436-M440 HydrophobicContact CE2-CE 3.26Å; Y436-M440 HydrophobicContact CE2-CG 4.36Å; Y436-M440 WeakPolarHBondContact O-CG 3.31Å; Y436-M440 PolarHBondContact O-N 3.47Å; Y436-V451 HydrophobicContact CE1-CG1 4.38Å
437	F	89.5	Confident	85	Confident	13 Å²	13	73.5 Å²	73.5	6%	0.057	37%	0.365	C	S	.	.	H	α-helix	trans	-69.6	-35.2	179.5	-76.4	-66.7	0	0	0	112.7	I371 L433 D434 K439 M440 K441 V451 L454	I371-F437 HydrophobicContact CB-CZ 4.45Å; I371-F437 HydrophobicContact CD1-CE2 4.04Å; I371-F437 HydrophobicContact CD1-CZ 3.81Å; I371-F437 HydrophobicContact CG1-CE2 4.44Å; I371-F437 HydrophobicContact CG1-CZ 3.77Å; I371-F437 HydrophobicContact CG2-CE2 4.24Å; I371-F437 HydrophobicContact CG2-CZ 3.89Å; L433-F437 HydrophobicContact CD2-CE2 4.32Å; L433-F437 WeakPolarHBondContact O-CD2 3.26Å; L433-F437 PolarHBondContact O-N 2.98Å; D434-F437 PolarHBondContact O-N 3.47Å; F437-K439 VanDerWaalsContact C-N 3.26Å; F437-K439 PolarHBondContact O-N 2.71Å; F437-M440 PolarHBondContact O-N 3.46Å; F437-K441 WeakPolarHBondContact O-CG 3.48Å; F437-K441 PolarHBondContact O-N 3.42Å; F437-V451 HydrophobicContact CE1-CG1 4.26Å; F437-V451 WeakPolarHBondContact CE1-O 3.47Å; F437-L454 HydrophobicContact CE1-CB 4.45Å
438	A	87.2	Confident	84.2	Confident	48 Å²	48	72.1 Å²	72.1	40%	0.397	36%	0.359	S	S	.	.	H	α-helix	trans	-56.2	-44.2	169.8	0	0	0	0	0	110.7	D434 M440 K441 E442	D434-A438 WeakPolarHBondContact O-CB 3.43Å; D434-A438 PolarHBondContact O-N 3.11Å; A438-M440 PolarHBondContact O-N 3.31Å; A438-K441 WeakPolarHBondContact O-CB 3.35Å; A438-K441 PolarHBondContact O-N 3.31Å; A438-E442 PolarHBondContact O-N 3.49Å
439	K	85.4	Confident	83.5	Confident	79 Å²	79	72.6 Å²	72.6	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-36.9	176.8	-168.6	61.6	-176.4	172.3	0	113.3	Q388 K435 Y436 F437 K441 E442	Q388-K439 HydrophobicContact CG-CB 4.44Å; K435-K439 PolarHBondContact O-N 3.14Å; Y436-K439 WeakPolarHBondContact O-CB 3.06Å; Y436-K439 PolarHBondContact O-N 3.38Å; F437-K439 VanDerWaalsContact C-N 3.26Å; F437-K439 PolarHBondContact O-N 2.71Å; K439-K441 VanDerWaalsContact C-N 3.31Å; K439-E442 WeakPolarHBondContact CD-OE2 3.42Å; K439-E442 IonicContact NZ-OE2 3.72Å; K439-E442 PolarHBondContact NZ-OE2 2.98Å; K439-E442 PolarHBondContact O-N 3.29Å
440	M	85.2	Confident	83	Confident	7 Å²	7	78.3 Å²	78.3	3%	0.034	37%	0.374	C	S	.	.	H	α-helix	trans	-66.8	-33.2	176	-66.9	-58.5	156.2	0	0	112.2	H381 T384 Y436 F437 A438 E442 S443 C448 V451	H381-M440 VanDerWaalsContact ND1-CE 3.27Å; H381-M440 WeakPolarHBondContact ND1-CE 3.26Å; T384-M440 HydrophobicContact CG2-CE 3.59Å; Y436-M440 HydrophobicContact CD1-CG 4.5Å; Y436-M440 HydrophobicContact CD2-CE 3.92Å; Y436-M440 HydrophobicContact CE1-CG 4.07Å; Y436-M440 HydrophobicContact CE2-CE 3.26Å; Y436-M440 HydrophobicContact CE2-CG 4.36Å; Y436-M440 WeakPolarHBondContact O-CG 3.31Å; Y436-M440 PolarHBondContact O-N 3.47Å; F437-M440 PolarHBondContact O-N 3.46Å; A438-M440 PolarHBondContact O-N 3.31Å; M440-E442 VanDerWaalsContact C-N 3.34Å; M440-S443 PolarHBondContact O-N 3.46Å; M440-C448 HydrophobicContact SD-CB 4.24Å; M440-V451 HydrophobicContact CG-CG1 4.31Å
441	K	84.8	Confident	82.5	Confident	149 Å²	149	75 Å²	75	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-66.1	-32.8	174.4	-71.2	178.1	-178.8	178.6	0	112.9	F437 A438 K439 S443	F437-K441 WeakPolarHBondContact O-CG 3.48Å; F437-K441 PolarHBondContact O-N 3.42Å; A438-K441 WeakPolarHBondContact O-CB 3.35Å; A438-K441 PolarHBondContact O-N 3.31Å; K439-K441 VanDerWaalsContact C-N 3.31Å; K441-S443 VanDerWaalsContact C-N 3.31Å; K441-S443 PolarHBondContact O-N 2.96Å
442	E	83.8	Confident	82.2	Confident	131 Å²	131	69 Å²	69	61%	0.612	34%	0.337	S	S	*	.	H	α-helix	trans	-72.6	-21.8	177	-67.6	173.1	-170.7	0	0	113.8	A438 K439 M440	A438-E442 PolarHBondContact O-N 3.49Å; K439-E442 WeakPolarHBondContact CD-OE2 3.42Å; K439-E442 IonicContact NZ-OE2 3.72Å; K439-E442 PolarHBondContact NZ-OE2 2.98Å; K439-E442 PolarHBondContact O-N 3.29Å; M440-E442 VanDerWaalsContact C-N 3.34Å
443	S	81	Confident	82.1	Confident	41 Å²	41	71.5 Å²	71.5	29%	0.287	36%	0.357	S	S	.	.			trans	-76.9	133.4	-174.6	-178.4	0	0	0	0	111.9	M440 K441 S445 C448	M440-S443 PolarHBondContact O-N 3.46Å; K441-S443 VanDerWaalsContact C-N 3.31Å; K441-S443 PolarHBondContact O-N 2.96Å; S443-S445 PolarHBondContact O-N 2.97Å; S443-S445 PolarHBondContact OG-N 3.25Å; S443-C448 VanDerWaalsContact CB-CB 3.47Å; S443-C448 WeakPolarHBondContact OG-CB 3.24Å; S443-C448 PolarHBondContact OG-SG 3.23Å
444	K	75	Confident	82.1	Confident	194 Å²	194	72.8 Å²	72.8	84%	0.843	36%	0.364	S	S	*	.			trans	-74.4	-10.9	178.1	-64.9	-174.7	179.3	-178.6	0	113.7
445	S	79.2	Confident	82	Confident	50 Å²	50	70.7 Å²	70.7	35%	0.35	36%	0.356	S	S	.	.			trans	-62.6	135.9	-179.8	144	0	0	0	0	111.5	S443 E447 C448 R449	S443-S445 PolarHBondContact O-N 2.97Å; S443-S445 PolarHBondContact OG-N 3.25Å; S445-E447 PolarHBondContact O-N 2.89Å; S445-E447 PolarHBondContact OG-N 2.72Å; S445-C448 PolarHBondContact O-N 3.16Å; S445-C448 PolarHBondContact OG-N 3.28Å; S445-C448 PolarHBondContact OG-SG 3.38Å; S445-C448 VanDerWaalsContact OG-SG 3.41Å; S445-R449 PolarHBondContact O-N 3.32Å; S445-R449 VanDerWaalsContact O-N 3.09Å
446	V	76.4	Confident	82.3	Confident	93 Å²	93	67.2 Å²	67.2	56%	0.564	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-37.9	175.3	176.3	0	0	0	0	110.7	R449 K450	V446-R449 PolarHBondContact O-N 3.41Å; V446-K450 PolarHBondContact O-N 3.12Å; V446-K450 VanDerWaalsContact O-N 3.11Å
447	E	74.9	Confident	82.6	Confident	122 Å²	122	70.4 Å²	70.4	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-67.6	-43.5	178.3	-170.8	158.2	-170.8	0	0	111.6	S445 R449 K450 V451	S445-E447 PolarHBondContact O-N 2.89Å; S445-E447 PolarHBondContact OG-N 2.72Å; E447-R449 VanDerWaalsContact C-N 3.27Å; E447-R449 PolarHBondContact O-N 2.98Å; E447-K450 PolarHBondContact O-N 3.38Å; E447-K450 VanDerWaalsContact O-N 3.14Å; E447-V451 WeakPolarHBondContact O-CG2 3.5Å; E447-V451 PolarHBondContact O-N 3.19Å
448	C	75.6	Confident	82.8	Confident	17 Å²	17	75 Å²	75	12%	0.115	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-34	174.7	-65.3	0	0	0	0	112.6	M440 S443 S445 V451 S452	M440-C448 HydrophobicContact SD-CB 4.24Å; S443-C448 VanDerWaalsContact CB-CB 3.47Å; S443-C448 WeakPolarHBondContact OG-CB 3.24Å; S443-C448 PolarHBondContact OG-SG 3.23Å; S445-C448 PolarHBondContact O-N 3.16Å; S445-C448 PolarHBondContact OG-N 3.28Å; S445-C448 PolarHBondContact OG-SG 3.38Å; S445-C448 VanDerWaalsContact OG-SG 3.41Å; C448-V451 PolarHBondContact O-N 3.33Å; C448-S452 VanDerWaalsContact O-CB 3.32Å; C448-S452 WeakPolarHBondContact O-CB 3.43Å; C448-S452 PolarHBondContact O-N 3.08Å; C448-S452 PolarHBondContact O-OG 3.31Å
449	R	73.5	Confident	83.1	Confident	147 Å²	147	80 Å²	80	56%	0.555	40%	0.399	S	S	*	.	H	α-helix	trans	-68.5	-37.2	174	-76.9	-172.6	-81.6	166.2	-8	113.2	S445 V446 E447 S452 S453	S445-R449 PolarHBondContact O-N 3.32Å; S445-R449 VanDerWaalsContact O-N 3.09Å; V446-R449 PolarHBondContact O-N 3.41Å; E447-R449 VanDerWaalsContact C-N 3.27Å; E447-R449 PolarHBondContact O-N 2.98Å; R449-S452 WeakPolarHBondContact CA-OG 3.16Å; R449-S452 PolarHBondContact O-N 3.43Å; R449-S452 PolarHBondContact O-OG 2.92Å; R449-S453 PolarHBondContact O-N 2.82Å
450	K	78.1	Confident	83.6	Confident	148 Å²	148	77.4 Å²	77.4	64%	0.643	39%	0.388	S	S	*	.	H	α-helix	trans	-64.7	-45.2	172.5	-70.8	179.7	-179.9	-179	0	110.6	V446 E447 S452 S453	V446-K450 PolarHBondContact O-N 3.12Å; V446-K450 VanDerWaalsContact O-N 3.11Å; E447-K450 PolarHBondContact O-N 3.38Å; E447-K450 VanDerWaalsContact O-N 3.14Å; K450-S452 VanDerWaalsContact C-N 3.35Å; K450-S452 PolarHBondContact O-N 3.36Å; K450-S453 PolarHBondContact O-N 2.82Å; K450-S453 PolarHBondContact O-OG 3.22Å
451	V	80.3	Confident	84.1	Confident	4 Å²	4	77.3 Å²	77.3	2%	0.024	39%	0.387	C	S	.	.	H	α-helix	trans	-65.2	-38.4	177.8	176.1	0	0	0	0	111.4	Y436 F437 M440 E447 C448 S453 L454	Y436-V451 HydrophobicContact CE1-CG1 4.38Å; F437-V451 HydrophobicContact CE1-CG1 4.26Å; F437-V451 WeakPolarHBondContact CE1-O 3.47Å; M440-V451 HydrophobicContact CG-CG1 4.31Å; E447-V451 WeakPolarHBondContact O-CG2 3.5Å; E447-V451 PolarHBondContact O-N 3.19Å; C448-V451 PolarHBondContact O-N 3.33Å; V451-S453 PolarHBondContact O-N 3.24Å; V451-L454 VanDerWaalsContact O-CB 3.32Å; V451-L454 WeakPolarHBondContact O-CB 3.48Å; V451-L454 PolarHBondContact O-N 3.09Å
452	S	79.4	Confident	84.7	Confident	19 Å²	19	74 Å²	74	13%	0.133	38%	0.376	C	S	.	.	H	α-helix	trans	-65.2	-27.6	179.8	71.9	0	0	0	0	113.4	C448 R449 K450 L454 G455	C448-S452 VanDerWaalsContact O-CB 3.32Å; C448-S452 WeakPolarHBondContact O-CB 3.43Å; C448-S452 PolarHBondContact O-N 3.08Å; C448-S452 PolarHBondContact O-OG 3.31Å; R449-S452 WeakPolarHBondContact CA-OG 3.16Å; R449-S452 PolarHBondContact O-N 3.43Å; R449-S452 PolarHBondContact O-OG 2.92Å; K450-S452 VanDerWaalsContact C-N 3.35Å; K450-S452 PolarHBondContact O-N 3.36Å; S452-L454 PolarHBondContact O-N 3.08Å; S452-G455 PolarHBondContact O-N 3.42Å
453	S	83.5	Confident	85.3	Confident	85 Å²	85	68.6 Å²	68.6	59%	0.594	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.9	173.1	76.4	0	0	0	0	114.2	R449 K450 V451 G455	R449-S453 PolarHBondContact O-N 2.82Å; K450-S453 PolarHBondContact O-N 2.82Å; K450-S453 PolarHBondContact O-OG 3.22Å; V451-S453 PolarHBondContact O-N 3.24Å; S453-G455 VanDerWaalsContact C-N 3.3Å
454	L	87.1	Confident	86	Confident	28 Å²	28	66.7 Å²	66.7	15%	0.147	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.1	174.1	-62.8	171.7	0	0	0	112.9	K370 I371 F374 F437 V451 S452 L456	K370-L454 HydrophobicContact CB-CD1 4.45Å; K370-L454 HydrophobicContact CB-CD2 4.38Å; K370-L454 HydrophobicContact CD-CD2 4.26Å; I371-L454 WeakPolarHBondContact CD1-O 3.37Å; I371-L454 HydrophobicContact CG1-CB 4.22Å; F374-L454 HydrophobicContact CD2-CD1 3.51Å; F374-L454 HydrophobicContact CE2-CD1 3.46Å; F374-L454 VanDerWaalsContact CE2-CD1 3.46Å; F374-L454 HydrophobicContact CZ-CD1 4.48Å; F437-L454 HydrophobicContact CE1-CB 4.45Å; V451-L454 VanDerWaalsContact O-CB 3.32Å; V451-L454 WeakPolarHBondContact O-CB 3.48Å; V451-L454 PolarHBondContact O-N 3.09Å; S452-L454 PolarHBondContact O-N 3.08Å; L454-L456 PolarHBondContact O-N 3.06Å
455	G	88.3	Confident	87	Confident	16 Å²	16	62.8 Å²	62.8	17%	0.165	32%	0.322	C	S	.	.	S	Bend	trans	-55.5	137.9	177.2	0	0	0	0	0	111.3	S452 S453	S452-G455 PolarHBondContact O-N 3.42Å; S453-G455 VanDerWaalsContact C-N 3.3Å
456	L	92.3	Very high	87.8	Confident	18 Å²	18	61.9 Å²	61.9	9%	0.094	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-74.2	135.1	179.2	-63.7	170.3	0	0	0	110	K367 I371 F426 L454 E460 W461 L464	K367-L456 HydrophobicContact CB-CD2 3.94Å; K367-L456 HydrophobicContact CD-CD2 4.07Å; I371-L456 HydrophobicContact CD1-CG 4.22Å; F426-L456 HydrophobicContact CD1-CD1 3.92Å; F426-L456 HydrophobicContact CE1-CD1 4.26Å; L454-L456 PolarHBondContact O-N 3.06Å; L456-E460 WeakPolarHBondContact CA-OE2 3.4Å; L456-E460 HydrophobicContact CB-CB 4.34Å; L456-E460 HydrophobicContact CD2-CB 4.11Å; L456-W461 HydrophobicContact CB-CD2 4.26Å; L456-W461 HydrophobicContact CB-CG 4.39Å; L456-W461 HydrophobicContact CB-CZ2 4.32Å; L456-W461 HydrophobicContact CD1-CD2 4.14Å; L456-W461 HydrophobicContact CD1-CE3 4.17Å; L456-W461 HydrophobicContact CD1-CH2 3.88Å; L456-W461 HydrophobicContact CD1-CZ2 3.84Å; L456-W461 HydrophobicContact CD1-CZ3 4.05Å; L456-L464 HydrophobicContact CD1-CD1 3.6Å
457	T	93.7	Very high	88.7	Confident	69 Å²	69	57.5 Å²	57.5	42%	0.423	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-78.1	166.4	171.2	61.9	0	0	0	0	111.2	E459 E460 W461	T457-E459 VanDerWaalsContact C-N 3.26Å; T457-E459 PolarHBondContact O-N 2.86Å; T457-E460 PolarHBondContact N-OE2 3.25Å; T457-E460 PolarHBondContact O-N 3.33Å; T457-E460 VanDerWaalsContact O-N 3.15Å; T457-E460 VanDerWaalsContact OG1-CG 3.23Å; T457-E460 WeakPolarHBondContact OG1-CG 3.45Å; T457-E460 PolarHBondContact OG1-N 2.95Å; T457-E460 PolarHBondContact OG1-OE2 2.97Å; T457-E460 VanDerWaalsContact OG1-OE2 3.13Å; T457-W461 VanDerWaalsContact O-CD1 3.25Å; T457-W461 PolarHBondContact O-N 3.2Å
458	E	94.4	Very high	89.7	Confident	109 Å²	109	52.6 Å²	52.6	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-58.1	-39.2	174.6	-72.6	-59.2	132.7	0	0	112.5	R430 W461 N462	R430-E458 IonicContact CZ-OE1 2.73Å; R430-E458 IonicContact CZ-OE2 2.85Å; R430-E458 IonicContact NH2-OE1 3.71Å; R430-E458 PolarHBondContact NH2-OE1 3.44Å; R430-E458 IonicContact NH2-OE2 2.72Å; R430-E458 PolarHBondContact NH2-OE2 2.98Å; E458-W461 PolarHBondContact O-N 3.2Å; E458-N462 VanDerWaalsContact O-CG 3.28Å; E458-N462 PolarHBondContact O-N 2.98Å; E458-N462 PolarHBondContact O-ND2 3.15Å
459	E	93.8	Very high	90.5	Very high	155 Å²	155	55.5 Å²	55.5	72%	0.724	28%	0.278	S	S	*	.	H	α-helix	trans	-62.4	-43.4	174.9	-66.4	177.2	-173.6	0	0	111.4	T457 N462 V463	T457-E459 VanDerWaalsContact C-N 3.26Å; T457-E459 PolarHBondContact O-N 2.86Å; E459-N462 WeakPolarHBondContact O-CB 3.39Å; E459-N462 PolarHBondContact O-N 3.44Å; E459-V463 WeakPolarHBondContact O-CG2 3.19Å; E459-V463 PolarHBondContact O-N 3.21Å
460	E	95.4	Very high	91.4	Very high	24 Å²	24	48.5 Å²	48.5	11%	0.112	25%	0.252	C	S	.	.	H	α-helix	trans	-68.5	-36	178.1	-68.4	172.2	137.5	0	0	112.4	K367 L456 T457 N462 V463 L464	K367-E460 VanDerWaalsContact CD-OE1 3.32Å; K367-E460 WeakPolarHBondContact CD-OE1 3.46Å; K367-E460 WeakPolarHBondContact CE-OE1 2.98Å; K367-E460 IonicContact NZ-OE1 3.88Å; K367-E460 PolarHBondContact NZ-OE1 2.89Å; K367-E460 IonicContact NZ-OE2 2.71Å; K367-E460 PolarHBondContact NZ-OE2 3.47Å; L456-E460 WeakPolarHBondContact CA-OE2 3.4Å; L456-E460 HydrophobicContact CB-CB 4.34Å; L456-E460 HydrophobicContact CD2-CB 4.11Å; T457-E460 PolarHBondContact N-OE2 3.25Å; T457-E460 PolarHBondContact O-N 3.33Å; T457-E460 VanDerWaalsContact O-N 3.15Å; T457-E460 VanDerWaalsContact OG1-CG 3.23Å; T457-E460 WeakPolarHBondContact OG1-CG 3.45Å; T457-E460 PolarHBondContact OG1-N 2.95Å; T457-E460 PolarHBondContact OG1-OE2 2.97Å; T457-E460 VanDerWaalsContact OG1-OE2 3.13Å; E460-N462 VanDerWaalsContact C-N 3.3Å; E460-N462 PolarHBondContact O-N 3.31Å; E460-V463 PolarHBondContact O-N 3.03Å; E460-L464 WeakPolarHBondContact O-CG 3.35Å; E460-L464 PolarHBondContact O-N 3.44Å
461	W	96.3	Very high	92.1	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-61.1	-39.6	170.6	-80.9	122.5	0	0	0	111.9	F426 L427 R430 L433 D434 L456 T457 E458 L464 K465	F426-W461 HydrophobicContact CB-CH2 4.42Å; F426-W461 HydrophobicContact CB-CZ3 4.15Å; F426-W461 HydrophobicContact CD1-CH2 4.25Å; F426-W461 WeakPolarHBondContact O-CH2 3.3Å; F426-W461 WeakPolarHBondContact O-CZ3 3.38Å; L427-W461 HydrophobicContact CD2-CE3 4.05Å; L427-W461 HydrophobicContact CD2-CZ3 4.25Å; R430-W461 HydrophobicContact CB-CH2 3.81Å; R430-W461 HydrophobicContact CB-CZ2 4.06Å; R430-W461 HydrophobicContact CB-CZ3 4.09Å; R430-W461 HydrophobicContact CG-CD2 4.15Å; R430-W461 HydrophobicContact CG-CE3 4.37Å; R430-W461 HydrophobicContact CG-CH2 3.97Å; R430-W461 HydrophobicContact CG-CZ2 3.71Å; R430-W461 HydrophobicContact CG-CZ3 4.29Å; L433-W461 HydrophobicContact CB-CZ2 4.41Å; L433-W461 HydrophobicContact CD1-CH2 3.85Å; L433-W461 HydrophobicContact CD1-CZ2 4.39Å; D434-W461 PolarHBondContact OD1-NE1 2.88Å; L456-W461 HydrophobicContact CB-CD2 4.26Å; L456-W461 HydrophobicContact CB-CG 4.39Å; L456-W461 HydrophobicContact CB-CZ2 4.32Å; L456-W461 HydrophobicContact CD1-CD2 4.14Å; L456-W461 HydrophobicContact CD1-CE3 4.17Å; L456-W461 HydrophobicContact CD1-CH2 3.88Å; L456-W461 HydrophobicContact CD1-CZ2 3.84Å; L456-W461 HydrophobicContact CD1-CZ3 4.05Å; T457-W461 VanDerWaalsContact O-CD1 3.25Å; T457-W461 PolarHBondContact O-N 3.2Å; E458-W461 PolarHBondContact O-N 3.2Å; W461-L464 HydrophobicContact CE3-CD1 4.16Å; W461-L464 HydrophobicContact CZ3-CD1 4.27Å; W461-L464 PolarHBondContact O-N 3.26Å; W461-K465 WeakPolarHBondContact O-CB 3.4Å; W461-K465 PolarHBondContact O-N 3.29Å
462	N	95.7	Very high	92.5	Very high	79 Å²	79	45 Å²	45	42%	0.422	24%	0.24	S	C	.	.	H	α-helix	trans	-66.9	-41.6	175.5	-68.9	-30.2	0	0	0	111.7	E458 E459 E460 L464 K465 D466	E458-N462 VanDerWaalsContact O-CG 3.28Å; E458-N462 PolarHBondContact O-N 2.98Å; E458-N462 PolarHBondContact O-ND2 3.15Å; E459-N462 WeakPolarHBondContact O-CB 3.39Å; E459-N462 PolarHBondContact O-N 3.44Å; E460-N462 VanDerWaalsContact C-N 3.3Å; E460-N462 PolarHBondContact O-N 3.31Å; N462-L464 VanDerWaalsContact C-N 3.34Å; N462-L464 PolarHBondContact O-N 3.29Å; N462-K465 WeakPolarHBondContact O-CB 3.08Å; N462-K465 PolarHBondContact O-N 2.69Å; N462-D466 WeakPolarHBondContact O-CB 3.49Å; N462-D466 PolarHBondContact O-N 3.45Å
463	V	96.3	Very high	92.9	Very high	19 Å²	19	46.1 Å²	46.1	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-44.6	173.7	171.4	0	0	0	0	111.4	C364 E459 E460 D466 L467 L513	C364-V463 HydrophobicContact CB-CG1 4.3Å; E459-V463 WeakPolarHBondContact O-CG2 3.19Å; E459-V463 PolarHBondContact O-N 3.21Å; E460-V463 PolarHBondContact O-N 3.03Å; V463-D466 PolarHBondContact O-N 3.3Å; V463-L467 WeakPolarHBondContact O-CB 3.47Å; V463-L467 PolarHBondContact O-N 3.48Å; V463-L513 HydrophobicContact CB-CD2 4.29Å; V463-L513 HydrophobicContact CG1-CD2 3.9Å; V463-L513 HydrophobicContact CG2-CD2 4.22Å
464	L	96.6	Very high	93.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-41.3	176.3	-70.8	-177.7	0	0	0	112	C364 I423 L427 L456 E460 W461 N462 Q468	C364-L464 HydrophobicContact CB-CD2 3.83Å; C364-L464 HydrophobicContact CB-CG 4.27Å; I423-L464 HydrophobicContact CG1-CD2 4.27Å; I423-L464 HydrophobicContact CG2-CB 4.14Å; I423-L464 HydrophobicContact CG2-CD2 4.48Å; I423-L464 WeakPolarHBondContact CG2-O 3.49Å; L427-L464 HydrophobicContact CD2-CB 4.42Å; L456-L464 HydrophobicContact CD1-CD1 3.6Å; E460-L464 WeakPolarHBondContact O-CG 3.35Å; E460-L464 PolarHBondContact O-N 3.44Å; W461-L464 HydrophobicContact CE3-CD1 4.16Å; W461-L464 HydrophobicContact CZ3-CD1 4.27Å; W461-L464 PolarHBondContact O-N 3.26Å; N462-L464 VanDerWaalsContact C-N 3.34Å; N462-L464 PolarHBondContact O-N 3.29Å; L464-Q468 WeakPolarHBondContact O-CB 3.3Å; L464-Q468 PolarHBondContact O-N 2.73Å
465	K	96.3	Very high	92.9	Very high	112 Å²	112	41 Å²	41	49%	0.487	21%	0.213	S	C	.	.	H	α-helix	trans	-63.3	-44.9	176.8	-174	-178.4	178.1	-174.7	0	111.5	L427 W461 N462 Q468 N469	L427-K465 HydrophobicContact CD2-CB 4.25Å; W461-K465 WeakPolarHBondContact O-CB 3.4Å; W461-K465 PolarHBondContact O-N 3.29Å; N462-K465 WeakPolarHBondContact O-CB 3.08Å; N462-K465 PolarHBondContact O-N 2.69Å; K465-Q468 WeakPolarHBondContact O-CB 3.36Å; K465-Q468 PolarHBondContact O-N 3.17Å; K465-N469 WeakPolarHBondContact O-CB 3.45Å; K465-N469 PolarHBondContact O-N 3.27Å; K465-N469 PolarHBondContact O-ND2 2.78Å; K465-N469 PolarHBondContact O-OD1 3Å
466	D	95.7	Very high	92.4	Very high	31 Å²	31	43 Å²	43	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-45.5	177.8	-78.1	-6.8	0	0	0	111.7	N462 V463 Q468 N469 V470 S511 L513 V514	N462-D466 WeakPolarHBondContact O-CB 3.49Å; N462-D466 PolarHBondContact O-N 3.45Å; V463-D466 PolarHBondContact O-N 3.3Å; D466-Q468 VanDerWaalsContact C-N 3.33Å; D466-Q468 PolarHBondContact O-N 3.37Å; D466-N469 PolarHBondContact O-N 2.93Å; D466-V470 WeakPolarHBondContact O-CG2 3.38Å; D466-V470 PolarHBondContact O-N 3.37Å; D466-V470 VanDerWaalsContact O-N 3.12Å; D466-S511 VanDerWaalsContact OD2-CB 3.24Å; D466-S511 WeakPolarHBondContact OD2-CB 3.38Å; D466-S511 PolarHBondContact OD2-OG 3.36Å; D466-L513 HydrophobicContact CB-CD2 4.04Å; D466-V514 HydrophobicContact CB-CG2 3.56Å
467	L	95.7	Very high	91.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-40.6	175.2	-176.6	58.2	0	0	0	111.5	L288 L290 C361 L365 I423 V463 V470 L471 L517	L288-L467 HydrophobicContact CD1-CD1 4.3Å; L290-L467 HydrophobicContact CD1-CD1 3.79Å; L290-L467 HydrophobicContact CD1-CD2 3.96Å; C361-L467 HydrophobicContact CB-CD2 4.43Å; L365-L467 HydrophobicContact CD1-CD2 4.34Å; L365-L467 HydrophobicContact CD2-CD2 4.16Å; L365-L467 HydrophobicContact CG-CD2 4.39Å; I423-L467 HydrophobicContact CD1-CB 4.48Å; I423-L467 HydrophobicContact CD1-CD2 3.67Å; I423-L467 HydrophobicContact CD1-CG 3.9Å; V463-L467 WeakPolarHBondContact O-CB 3.47Å; V463-L467 PolarHBondContact O-N 3.48Å; L467-V470 PolarHBondContact O-N 3.41Å; L467-L471 HydrophobicContact CD1-CD1 3.97Å; L467-L471 HydrophobicContact CD1-CG 4.12Å; L467-L471 HydrophobicContact CG-CD1 3.9Å; L467-L471 HydrophobicContact CG-CG 4.42Å; L467-L471 WeakPolarHBondContact O-CB 3.24Å; L467-L471 WeakPolarHBondContact O-CG 3.22Å; L467-L471 PolarHBondContact O-N 2.95Å; L467-L517 HydrophobicContact CD1-CD1 3.94Å
468	Q	94.9	Very high	90.9	Very high	19 Å²	19	39.4 Å²	39.4	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-44.8	174.4	-171.2	67.3	8.5	0	0	111.7	A420 I423 L427 L464 K465 D466 V470 L471 L472	A420-Q468 PolarHBondContact O-NE2 3.4Å; A420-Q468 PolarHBondContact O-OE1 2.95Å; I423-Q468 VanDerWaalsContact CB-OE1 3.27Å; I423-Q468 HydrophobicContact CG2-CB 3.8Å; I423-Q468 HydrophobicContact CG2-CG 4.36Å; I423-Q468 VanDerWaalsContact CG2-OE1 3.31Å; L427-Q468 HydrophobicContact CD1-CB 3.66Å; L427-Q468 HydrophobicContact CD1-CG 3.79Å; L464-Q468 WeakPolarHBondContact O-CB 3.3Å; L464-Q468 PolarHBondContact O-N 2.73Å; K465-Q468 WeakPolarHBondContact O-CB 3.36Å; K465-Q468 PolarHBondContact O-N 3.17Å; D466-Q468 VanDerWaalsContact C-N 3.33Å; D466-Q468 PolarHBondContact O-N 3.37Å; Q468-V470 PolarHBondContact O-N 3.09Å; Q468-L471 PolarHBondContact O-N 3.3Å; Q468-L472 WeakPolarHBondContact O-CB 3.41Å; Q468-L472 PolarHBondContact O-N 3.17Å
469	N	92.2	Very high	89.8	Confident	79 Å²	79	36.8 Å²	36.8	42%	0.422	19%	0.193	S	C	.	.	H	α-helix	trans	-60.9	-32.2	179.7	-70.1	-22.9	0	0	0	112	K465 D466 P473	K465-N469 WeakPolarHBondContact O-CB 3.45Å; K465-N469 PolarHBondContact O-N 3.27Å; K465-N469 PolarHBondContact O-ND2 2.78Å; K465-N469 PolarHBondContact O-OD1 3Å; D466-N469 PolarHBondContact O-N 2.93Å; N469-P473 VanDerWaalsContact O-CD 3.27Å; N469-P473 WeakPolarHBondContact O-CD 3.01Å
470	V	93.6	Very high	88.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-77.9	-41.7	175.6	174	0	0	0	0	112.1	L288 D466 L467 Q468 F474 V514 L517 L521	L288-V470 HydrophobicContact CD2-CG1 4.46Å; D466-V470 WeakPolarHBondContact O-CG2 3.38Å; D466-V470 PolarHBondContact O-N 3.37Å; D466-V470 VanDerWaalsContact O-N 3.12Å; L467-V470 PolarHBondContact O-N 3.41Å; Q468-V470 PolarHBondContact O-N 3.09Å; V470-F474 VanDerWaalsContact O-CD2 3.3Å; V470-F474 WeakPolarHBondContact O-CD2 2.92Å; V470-V514 HydrophobicContact CG2-CG1 4.02Å; V470-V514 HydrophobicContact CG2-CG2 4.38Å; V470-L517 HydrophobicContact CG1-CB 4.22Å; V470-L517 HydrophobicContact CG2-CB 4.24Å; V470-L517 HydrophobicContact CG2-CD1 4.27Å; V470-L521 HydrophobicContact CG1-CD1 3.39Å
471	L	91.7	Very high	87.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-77.8	-31.4	-176.8	-70.2	176.6	0	0	0	113.9	V284 L288 W291 W416 A420 I423 L467 Q468 F474 L475	V284-L471 HydrophobicContact CG1-CD2 3.59Å; L288-L471 HydrophobicContact CD1-CD2 3.54Å; L288-L471 HydrophobicContact CD1-CG 4.38Å; W291-L471 HydrophobicContact CH2-CD1 4.5Å; W291-L471 HydrophobicContact CH2-CD2 4.16Å; W416-L471 HydrophobicContact CE3-CD2 4.05Å; A420-L471 HydrophobicContact CB-CB 3.97Å; A420-L471 HydrophobicContact CB-CD1 4.08Å; I423-L471 HydrophobicContact CD1-CD1 4.18Å; L467-L471 HydrophobicContact CD1-CD1 3.97Å; L467-L471 HydrophobicContact CD1-CG 4.12Å; L467-L471 HydrophobicContact CG-CD1 3.9Å; L467-L471 HydrophobicContact CG-CG 4.42Å; L467-L471 WeakPolarHBondContact O-CB 3.24Å; L467-L471 WeakPolarHBondContact O-CG 3.22Å; L467-L471 PolarHBondContact O-N 2.95Å; Q468-L471 PolarHBondContact O-N 3.3Å; L471-F474 PolarHBondContact O-N 2.96Å; L471-L475 PolarHBondContact O-N 2.66Å
472	L	89.6	Confident	86.4	Confident	78 Å²	78	31.6 Å²	31.6	41%	0.408	17%	0.174	S	C	.	.	H	α-helix	trans	-61.2	-44.5	-170.7	-176.4	70	0	0	0	113.5	Q468 F474 L475 S476	Q468-L472 WeakPolarHBondContact O-CB 3.41Å; Q468-L472 PolarHBondContact O-N 3.17Å; L472-F474 VanDerWaalsContact C-N 3.28Å; L472-F474 PolarHBondContact O-N 2.72Å; L472-L475 PolarHBondContact O-N 2.75Å; L472-S476 PolarHBondContact O-N 2.96Å; L472-S476 PolarHBondContact O-OG 3.49Å
473	P	88.8	Confident	84.6	Confident	41 Å²	41	29.1 Å²	29.1	27%	0.266	17%	0.165	S	C	.	.	H	α-helix	trans	-57.5	-40.1	176	-26.5	36.4	0	0	0	113.1	N469 S476 A477 L499 F502	N469-P473 VanDerWaalsContact O-CD 3.27Å; N469-P473 WeakPolarHBondContact O-CD 3.01Å; P473-S476 PolarHBondContact O-N 2.8Å; P473-A477 PolarHBondContact O-N 3.06Å; P473-L499 HydrophobicContact CB-CD2 3.63Å; P473-F502 HydrophobicContact CG-CD1 4.39Å; P473-F502 HydrophobicContact CG-CD2 4.4Å; P473-F502 HydrophobicContact CG-CE1 4.06Å; P473-F502 HydrophobicContact CG-CE2 4.07Å; P473-F502 HydrophobicContact CG-CZ 3.89Å
474	F	87.7	Confident	82.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-42.6	177.6	-68.4	-101.2	0	0	0	111.2	L280 V283 V284 W416 V470 L471 L472 S476 A477 V478 L499 F502 L521 F525	L280-F474 HydrophobicContact CD2-CD1 4.17Å; L280-F474 HydrophobicContact CD2-CE1 4.45Å; V283-F474 HydrophobicContact CG1-CE1 4Å; V284-F474 HydrophobicContact CG2-CB 4.08Å; V284-F474 HydrophobicContact CG2-CD1 3.36Å; V284-F474 HydrophobicContact CG2-CD2 4.33Å; V284-F474 HydrophobicContact CG2-CE1 3.74Å; V284-F474 HydrophobicContact CG2-CG 3.68Å; V284-F474 HydrophobicContact CG2-CZ 4.37Å; W416-F474 HydrophobicContact CH2-CB 3.54Å; W416-F474 HydrophobicContact CZ2-CB 4.32Å; W416-F474 HydrophobicContact CZ3-CB 3.83Å; V470-F474 VanDerWaalsContact O-CD2 3.3Å; V470-F474 WeakPolarHBondContact O-CD2 2.92Å; L471-F474 PolarHBondContact O-N 2.96Å; L472-F474 VanDerWaalsContact C-N 3.28Å; L472-F474 PolarHBondContact O-N 2.72Å; F474-S476 VanDerWaalsContact C-N 3.32Å; F474-S476 PolarHBondContact O-N 3.09Å; F474-A477 PolarHBondContact O-N 3.1Å; F474-V478 WeakPolarHBondContact O-CG2 3.49Å; F474-V478 PolarHBondContact O-N 3.46Å; F474-L499 HydrophobicContact CD1-CD1 4.02Å; F474-L499 HydrophobicContact CD1-CD2 4.26Å; F474-L499 HydrophobicContact CD2-CD2 3.99Å; F474-L499 HydrophobicContact CE1-CD1 4.35Å; F474-L499 HydrophobicContact CE1-CD2 4.49Å; F474-L499 HydrophobicContact CE2-CD2 4.2Å; F474-L499 HydrophobicContact CG-CD1 4.45Å; F474-L499 HydrophobicContact CG-CD2 4.03Å; F474-L499 HydrophobicContact CZ-CD2 4.46Å; F474-F502 HydrophobicContact CE2-CD1 4.47Å; F474-F502 HydrophobicContact CE2-CE1 4.43Å; F474-L521 HydrophobicContact CE2-CD1 3.74Å; F474-L521 HydrophobicContact CZ-CB 4.37Å; F474-L521 HydrophobicContact CZ-CD1 3.8Å; F474-L521 HydrophobicContact CZ-CD2 4.16Å; F474-L521 HydrophobicContact CZ-CG 4.35Å; F474-F525 HydrophobicContact CD1-CZ 4.42Å; F474-F525 AromaticContact CE1-CE2 3.43Å; F474-F525 HydrophobicContact CE1-CE2 3.43Å; F474-F525 VanDerWaalsContact CE1-CE2 3.43Å; F474-F525 AromaticContact CE1-CZ 3.48Å; F474-F525 HydrophobicContact CE1-CZ 3.48Å; F474-F525 VanDerWaalsContact CE1-CZ 3.48Å; F474-F525 AromaticContact CZ-CE2 3.52Å; F474-F525 HydrophobicContact CZ-CE2 3.52Å; F474-F525 HydrophobicContact CZ-CZ 4.04Å
475	L	81	Confident	81	Confident	7 Å²	7	40 Å²	40	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-44.9	177	-178.9	63	0	0	0	110.8	L332 W416 C417 A420 N421 L471 L472 A477 V478 N479	L332-L475 HydrophobicContact CD1-CD1 3.5Å; L332-L475 VanDerWaalsContact CD1-CD1 3.5Å; W416-L475 HydrophobicContact CH2-CB 4.44Å; W416-L475 HydrophobicContact CZ3-CB 3.97Å; C417-L475 HydrophobicContact CB-CD1 3.75Å; A420-L475 HydrophobicContact CB-CD2 4.04Å; N421-L475 WeakPolarHBondContact OD1-CD2 2.97Å; L471-L475 PolarHBondContact O-N 2.66Å; L472-L475 PolarHBondContact O-N 2.75Å; L475-A477 VanDerWaalsContact C-N 3.35Å; L475-A477 PolarHBondContact O-N 2.85Å; L475-V478 PolarHBondContact O-N 2.73Å; L475-N479 WeakPolarHBondContact O-CB 3.39Å; L475-N479 VanDerWaalsContact O-CG 3.27Å; L475-N479 PolarHBondContact O-N 2.93Å; L475-N479 PolarHBondContact O-ND2 3.44Å
476	S	79.2	Confident	79.5	Confident	58 Å²	58	37.9 Å²	37.9	41%	0.406	20%	0.195	S	C	.	.	H	α-helix	trans	-59.9	-43.4	175.3	-65.5	0	0	0	0	112	L472 P473 F474 N479 V480	L472-S476 PolarHBondContact O-N 2.96Å; L472-S476 PolarHBondContact O-OG 3.49Å; P473-S476 PolarHBondContact O-N 2.8Å; F474-S476 VanDerWaalsContact C-N 3.32Å; F474-S476 PolarHBondContact O-N 3.09Å; S476-N479 PolarHBondContact O-N 3.47Å; S476-V480 WeakPolarHBondContact O-CG2 3.11Å; S476-V480 PolarHBondContact O-N 3.39Å
477	A	79.6	Confident	78.4	Confident	6 Å²	6	37.7 Å²	37.7	5%	0.05	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-47.7	176.7	0	0	0	0	0	111.9	L280 P473 F474 L475 N479 V480 L481 C495 L499	L280-A477 HydrophobicContact CD1-CB 4.01Å; P473-A477 PolarHBondContact O-N 3.06Å; F474-A477 PolarHBondContact O-N 3.1Å; L475-A477 VanDerWaalsContact C-N 3.35Å; L475-A477 PolarHBondContact O-N 2.85Å; A477-N479 VanDerWaalsContact C-N 3.35Å; A477-N479 PolarHBondContact O-N 2.95Å; A477-V480 PolarHBondContact O-N 3.27Å; A477-L481 VanDerWaalsContact O-CG 3.24Å; A477-L481 WeakPolarHBondContact O-CG 3.34Å; A477-L481 PolarHBondContact O-N 3.27Å; A477-C495 HydrophobicContact CB-CB 3.91Å; A477-L499 HydrophobicContact CB-CD1 3.76Å
478	V	75	Confident	77.6	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-45	177.5	178.3	0	0	0	0	110.8	A277 L280 L332 W416 F474 L475 V480 L481 S482	A277-V478 HydrophobicContact CB-CG1 4.39Å; L280-V478 HydrophobicContact CB-CG2 4.39Å; L280-V478 HydrophobicContact CD1-CG2 3.9Å; L332-V478 HydrophobicContact CD2-CB 4.26Å; L332-V478 HydrophobicContact CD2-CG1 3.45Å; L332-V478 VanDerWaalsContact CD2-CG1 3.45Å; W416-V478 HydrophobicContact CH2-CG2 4.09Å; W416-V478 HydrophobicContact CZ2-CG2 4Å; F474-V478 WeakPolarHBondContact O-CG2 3.49Å; F474-V478 PolarHBondContact O-N 3.46Å; L475-V478 PolarHBondContact O-N 2.73Å; V478-V480 VanDerWaalsContact C-N 3.33Å; V478-V480 PolarHBondContact O-N 3.34Å; V478-L481 PolarHBondContact O-N 3.3Å; V478-L481 VanDerWaalsContact O-N 3.15Å; V478-S482 WeakPolarHBondContact O-CB 3.41Å; V478-S482 PolarHBondContact O-N 3.47Å; V478-S482 PolarHBondContact O-OG 3.41Å
479	N	71.6	Confident	77.2	Confident	54 Å²	54	37.4 Å²	37.4	29%	0.289	20%	0.195	S	C	.	.	H	α-helix	trans	-60.9	-39	179	-72.7	-18.3	0	0	0	113.2	L475 S476 A477	L475-N479 WeakPolarHBondContact O-CB 3.39Å; L475-N479 VanDerWaalsContact O-CG 3.27Å; L475-N479 PolarHBondContact O-N 2.93Å; L475-N479 PolarHBondContact O-ND2 3.44Å; S476-N479 PolarHBondContact O-N 3.47Å; A477-N479 VanDerWaalsContact C-N 3.35Å; A477-N479 PolarHBondContact O-N 2.95Å
480	V	70.8	Confident	76.6	Confident	59 Å²	59	33.7 Å²	33.7	36%	0.358	18%	0.176	S	C	.	.	H	α-helix	trans	-67.7	-41	175.6	170	0	0	0	0	110.8	S476 A477 V478 Y486 L491	S476-V480 WeakPolarHBondContact O-CG2 3.11Å; S476-V480 PolarHBondContact O-N 3.39Å; A477-V480 PolarHBondContact O-N 3.27Å; V478-V480 VanDerWaalsContact C-N 3.33Å; V478-V480 PolarHBondContact O-N 3.34Å; V480-Y486 PolarHBondContact O-OH 2.76Å; V480-L491 HydrophobicContact CG1-CD1 4.08Å; V480-L491 HydrophobicContact CG1-CD2 4.32Å
481	L	74.7	Confident	76	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-75	-25.9	-178.5	-63.7	175.4	0	0	0	113.5	F276 A477 V478 A483 T488 L491 A492 C495 L701	F276-L481 HydrophobicContact CB-CD1 4.17Å; F276-L481 HydrophobicContact CD1-CD1 3.79Å; F276-L481 HydrophobicContact CG-CD1 4.35Å; A477-L481 VanDerWaalsContact O-CG 3.24Å; A477-L481 WeakPolarHBondContact O-CG 3.34Å; A477-L481 PolarHBondContact O-N 3.27Å; V478-L481 PolarHBondContact O-N 3.3Å; V478-L481 VanDerWaalsContact O-N 3.15Å; L481-A483 PolarHBondContact O-N 3.04Å; L481-T488 WeakPolarHBondContact O-CG2 3.46Å; L481-L491 HydrophobicContact CD2-CB 3.87Å; L481-A492 HydrophobicContact CD1-CB 4.31Å; L481-A492 HydrophobicContact CD2-CB 3.83Å; L481-C495 HydrophobicContact CD1-CB 4.46Å; L481-L701 VanDerWaalsContact C-CD1 3.47Å; L481-L701 HydrophobicContact CB-CD1 4.05Å; L481-L701 HydrophobicContact CB-CD2 4.2Å; L481-L701 HydrophobicContact CB-CG 4.3Å; L481-L701 WeakPolarHBondContact O-CD1 3.27Å
482	S	68	Low	75.5	Confident	14 Å²	14	35.2 Å²	35.2	10%	0.098	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.6	178.7	-67.4	0	0	0	0	114	Y331 V478	Y331-S482 WeakPolarHBondContact CD1-OG 3.23Å; Y331-S482 WeakPolarHBondContact CE1-OG 3.32Å; V478-S482 WeakPolarHBondContact O-CB 3.41Å; V478-S482 PolarHBondContact O-N 3.47Å; V478-S482 PolarHBondContact O-OG 3.41Å
483	A	57.2	Low	75.2	Confident	27 Å²	27	31.8 Å²	31.8	22%	0.223	17%	0.166	C	C	.	.			trans	-72.2	139.4	177.6	0	0	0	0	0	112.2	L481 Y486 T488	L481-A483 PolarHBondContact O-N 3.04Å; A483-Y486 HydrophobicContact CB-CD1 4.18Å; A483-Y486 HydrophobicContact CB-CE1 3.27Å; A483-Y486 HydrophobicContact CB-CE2 3.88Å; A483-Y486 WeakPolarHBondContact CB-OH 3.42Å; A483-T488 WeakPolarHBondContact O-CG2 3.47Å
484	F	57.1	Low	74.7	Confident	85 Å²	85	31.9 Å²	31.9	37%	0.373	16%	0.164	S	C	.	.	S	Bend	trans	-106.9	0	-166.1	60.4	-89.7	0	0	0	114.6	P704	F484-P704 VanDerWaalsContact CB-O 3.26Å; F484-P704 WeakPolarHBondContact CB-O 3.35Å
485	R	60.7	Low	74.5	Confident	161 Å²	161	32.8 Å²	32.8	61%	0.608	17%	0.17	S	C	*	.	S	Bend	trans	-107.7	4.3	-171.5	-62.5	-169.3	177.3	176.4	-0.1	114.8	L615	R485-L615 HydrophobicContact CB-CD1 4.14Å
486	Y	65.1	Low	74.6	Confident	68 Å²	68	33 Å²	33	27%	0.267	17%	0.171	S	C	.	.	S	Bend	trans	-147.3	157.6	-177.7	51.2	-103	0	0	0	111.7	V480 A483 T488 L491 L615	V480-Y486 PolarHBondContact O-OH 2.76Å; A483-Y486 HydrophobicContact CB-CD1 4.18Å; A483-Y486 HydrophobicContact CB-CE1 3.27Å; A483-Y486 HydrophobicContact CB-CE2 3.88Å; A483-Y486 WeakPolarHBondContact CB-OH 3.42Å; Y486-T488 HydrophobicContact CD2-CG2 4.23Å; Y486-T488 HydrophobicContact CE2-CG2 4.22Å; Y486-T488 PolarHBondContact O-N 3.28Å; Y486-L491 HydrophobicContact CD2-CD1 3.7Å; Y486-L491 HydrophobicContact CE2-CD1 3.25Å; Y486-L615 HydrophobicContact CD1-CD2 4.13Å
487	P	72.8	Confident	74.6	Confident	28 Å²	28	32.6 Å²	32.6	18%	0.182	16%	0.163	C	C	.	.			trans	-50.8	118.9	169.7	-32.3	40.1	0	0	0	113	L214 M696	L214-P487 HydrophobicContact CD2-CG 4.43Å; P487-M696 HydrophobicContact CB-CB 4.44Å; P487-M696 WeakPolarHBondContact CB-O 3.47Å
488	T	79.3	Confident	74.7	Confident	12 Å²	12	37 Å²	37	7%	0.074	18%	0.182	C	C	.	.			trans	-99.8	-21.8	-175.7	51	0	0	0	0	114.2	L481 A483 Y486 G490 L491 A492 A700	L481-T488 WeakPolarHBondContact O-CG2 3.46Å; A483-T488 WeakPolarHBondContact O-CG2 3.47Å; Y486-T488 HydrophobicContact CD2-CG2 4.23Å; Y486-T488 HydrophobicContact CE2-CG2 4.22Å; Y486-T488 PolarHBondContact O-N 3.28Å; T488-G490 PolarHBondContact O-N 2.81Å; T488-L491 WeakPolarHBondContact O-CB 3.31Å; T488-L491 PolarHBondContact O-N 3.01Å; T488-L491 VanDerWaalsContact O-N 3.15Å; T488-A492 PolarHBondContact O-N 3.01Å; T488-A700 WeakPolarHBondContact OG1-CB 3.46Å; T488-A700 PolarHBondContact OG1-N 3.44Å
489	I	85.2	Confident	75.4	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-38.5	-175.6	-165.9	167.5	0	0	0	113.4	L273 L491 A492 V493 L539 I543 M696 I698	L273-I489 HydrophobicContact CD2-CD1 3.74Å; L273-I489 HydrophobicContact CD2-CG1 4.35Å; I489-L491 VanDerWaalsContact C-N 3.31Å; I489-L491 PolarHBondContact O-N 3.5Å; I489-A492 WeakPolarHBondContact O-CB 3.34Å; I489-A492 PolarHBondContact O-N 3.35Å; I489-V493 PolarHBondContact O-N 2.97Å; I489-L539 HydrophobicContact CD1-CD1 4.26Å; I489-L539 HydrophobicContact CD1-CD2 3.7Å; I489-L539 HydrophobicContact CD1-CG 4.08Å; I489-I543 HydrophobicContact CD1-CD1 4.29Å; I489-I543 HydrophobicContact CD1-CG1 3.89Å; I489-I543 HydrophobicContact CG1-CG1 4.06Å; I489-I543 HydrophobicContact CG1-CG2 4.27Å; I489-I543 HydrophobicContact CG2-CD1 3.81Å; I489-I543 HydrophobicContact CG2-CG1 4.21Å; I489-I543 HydrophobicContact CG2-CG2 4.17Å; I489-M696 WeakPolarHBondContact CG2-O 3.23Å; I489-I698 VanDerWaalsContact CB-O 3.28Å; I489-I698 WeakPolarHBondContact CB-O 3.47Å; I489-I698 HydrophobicContact CD1-CB 3.86Å; I489-I698 HydrophobicContact CD1-CG2 3.78Å; I489-I698 WeakPolarHBondContact CG2-O 3.49Å
490	G	81.1	Confident	76.1	Confident	2 Å²	2	39.2 Å²	39.2	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-41.9	173.6	0	0	0	0	0	112.1	T488 A492 M494 F550	T488-G490 PolarHBondContact O-N 2.81Å; G490-A492 VanDerWaalsContact C-N 3.34Å; G490-M494 WeakPolarHBondContact O-CG 3.5Å; G490-M494 PolarHBondContact O-N 3.41Å; G490-F550 WeakPolarHBondContact O-CZ 3.14Å
491	L	79.3	Confident	76.8	Confident	31 Å²	31	42.6 Å²	42.6	16%	0.162	20%	0.196	C	C	.	.	H	α-helix	trans	-69.6	-32.3	176.2	-70.6	165	0	0	0	112.4	V480 L481 Y486 T488 I489 M494 C495 F621	V480-L491 HydrophobicContact CG1-CD1 4.08Å; V480-L491 HydrophobicContact CG1-CD2 4.32Å; L481-L491 HydrophobicContact CD2-CB 3.87Å; Y486-L491 HydrophobicContact CD2-CD1 3.7Å; Y486-L491 HydrophobicContact CE2-CD1 3.25Å; T488-L491 WeakPolarHBondContact O-CB 3.31Å; T488-L491 PolarHBondContact O-N 3.01Å; T488-L491 VanDerWaalsContact O-N 3.15Å; I489-L491 VanDerWaalsContact C-N 3.31Å; I489-L491 PolarHBondContact O-N 3.5Å; L491-M494 HydrophobicContact CD2-SD 4.32Å; L491-M494 WeakPolarHBondContact O-CB 3.44Å; L491-M494 PolarHBondContact O-N 2.86Å; L491-C495 WeakPolarHBondContact O-CB 3.36Å; L491-C495 PolarHBondContact O-N 2.88Å; L491-C495 PolarHBondContact O-SG 3.31Å; L491-F621 HydrophobicContact CD2-CE1 4.16Å; L491-F621 HydrophobicContact CD2-CZ 3.57Å; L491-F621 HydrophobicContact CG-CZ 4.41Å
492	A	82.8	Confident	77.4	Confident	1 Å²	1	45 Å²	45	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-48.2	178.5	0	0	0	0	0	110.9	F276 L481 T488 I489 G490 M494 C495 E496 A700	F276-A492 HydrophobicContact CB-CB 4.37Å; F276-A492 HydrophobicContact CD1-CB 3.86Å; F276-A492 HydrophobicContact CD2-CB 3.79Å; F276-A492 HydrophobicContact CE1-CB 3.92Å; F276-A492 WeakPolarHBondContact CE1-O 3.37Å; F276-A492 HydrophobicContact CE2-CB 3.85Å; F276-A492 HydrophobicContact CG-CB 3.75Å; F276-A492 VanDerWaalsContact CZ-C 3.43Å; F276-A492 HydrophobicContact CZ-CB 3.89Å; F276-A492 WeakPolarHBondContact CZ-O 3.29Å; L481-A492 HydrophobicContact CD1-CB 4.31Å; L481-A492 HydrophobicContact CD2-CB 3.83Å; T488-A492 PolarHBondContact O-N 3.01Å; I489-A492 WeakPolarHBondContact O-CB 3.34Å; I489-A492 PolarHBondContact O-N 3.35Å; G490-A492 VanDerWaalsContact C-N 3.34Å; A492-M494 VanDerWaalsContact C-N 3.26Å; A492-M494 PolarHBondContact O-N 2.83Å; A492-C495 PolarHBondContact O-N 3.32Å; A492-C495 VanDerWaalsContact O-N 3.12Å; A492-E496 PolarHBondContact O-N 2.63Å; A492-A700 HydrophobicContact CB-CB 3.56Å
493	V	81.5	Confident	78.4	Confident	6 Å²	6	44.3 Å²	44.3	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-57.2	-41	174.4	178.3	0	0	0	0	110.9	I489 Q497 L540 I543 A544 F550	I489-V493 PolarHBondContact O-N 2.97Å; V493-Q497 WeakPolarHBondContact O-CG 3.35Å; V493-Q497 PolarHBondContact O-N 3.18Å; V493-Q497 VanDerWaalsContact O-N 3.13Å; V493-L540 HydrophobicContact CG2-CB 4.5Å; V493-L540 HydrophobicContact CG2-CD2 3.88Å; V493-I543 HydrophobicContact CG2-CB 4.35Å; V493-I543 HydrophobicContact CG2-CG2 3.97Å; V493-A544 HydrophobicContact CG1-CB 4.21Å; V493-F550 HydrophobicContact CB-CE1 4.36Å; V493-F550 HydrophobicContact CB-CE2 4.46Å; V493-F550 HydrophobicContact CB-CZ 3.74Å; V493-F550 HydrophobicContact CG1-CE1 3.84Å; V493-F550 HydrophobicContact CG1-CE2 4.38Å; V493-F550 HydrophobicContact CG1-CZ 3.64Å
494	M	79.5	Confident	79.8	Confident	43 Å²	43	46.9 Å²	46.9	21%	0.212	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-48.6	175.7	-65.9	-175.1	75.5	0	0	111.3	G490 L491 A492 E496 Q497 Q498 F550 F621	G490-M494 WeakPolarHBondContact O-CG 3.5Å; G490-M494 PolarHBondContact O-N 3.41Å; L491-M494 HydrophobicContact CD2-SD 4.32Å; L491-M494 WeakPolarHBondContact O-CB 3.44Å; L491-M494 PolarHBondContact O-N 2.86Å; A492-M494 VanDerWaalsContact C-N 3.26Å; A492-M494 PolarHBondContact O-N 2.83Å; M494-E496 VanDerWaalsContact C-N 3.35Å; M494-E496 PolarHBondContact O-N 3.21Å; M494-Q497 PolarHBondContact O-N 3.37Å; M494-Q498 WeakPolarHBondContact O-CB 3.38Å; M494-Q498 VanDerWaalsContact O-CG 3.22Å; M494-Q498 WeakPolarHBondContact O-CG 3.42Å; M494-Q498 PolarHBondContact O-N 2.9Å; M494-F550 HydrophobicContact CB-CE1 4Å; M494-F550 HydrophobicContact CB-CZ 3.91Å; M494-F550 HydrophobicContact CG-CD1 4.31Å; M494-F550 HydrophobicContact CG-CE1 3.3Å; M494-F550 HydrophobicContact CG-CE2 3.79Å; M494-F550 HydrophobicContact CG-CZ 2.99Å; M494-F550 HydrophobicContact SD-CZ 4.34Å; M494-F621 HydrophobicContact CE-CE1 3.97Å; M494-F621 HydrophobicContact CE-CZ 4.3Å; M494-F621 HydrophobicContact SD-CE1 3.54Å; M494-F621 VanDerWaalsContact SD-CE1 3.54Å; M494-F621 HydrophobicContact SD-CE2 4.16Å; M494-F621 HydrophobicContact SD-CZ 3.26Å; M494-F621 WeakPolarHBondContact SD-CZ 3.49Å
495	C	82.5	Confident	81.1	Confident	20 Å²	20	45.3 Å²	45.3	14%	0.135	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-44.7	-177.8	-70.9	0	0	0	0	111.1	A477 L481 L491 A492 L499	A477-C495 HydrophobicContact CB-CB 3.91Å; L481-C495 HydrophobicContact CD1-CB 4.46Å; L491-C495 WeakPolarHBondContact O-CB 3.36Å; L491-C495 PolarHBondContact O-N 2.88Å; L491-C495 PolarHBondContact O-SG 3.31Å; A492-C495 PolarHBondContact O-N 3.32Å; A492-C495 VanDerWaalsContact O-N 3.12Å; C495-L499 VanDerWaalsContact O-CB 3.25Å; C495-L499 WeakPolarHBondContact O-CB 3.44Å; C495-L499 WeakPolarHBondContact O-CD1 3.11Å; C495-L499 WeakPolarHBondContact O-CG 3.37Å; C495-L499 PolarHBondContact O-N 3.48Å
496	E	84.2	Confident	82	Confident	11 Å²	11	43.4 Å²	43.4	5%	0.051	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-50.9	177.1	179.8	-78.7	147.6	0	0	112.1	F276 A492 M494 Q498 L499 R500 Y529	F276-E496 HydrophobicContact CE1-CB 3.54Å; F276-E496 HydrophobicContact CE1-CG 4.49Å; F276-E496 HydrophobicContact CZ-CB 3.35Å; F276-E496 HydrophobicContact CZ-CG 4.1Å; A492-E496 PolarHBondContact O-N 2.63Å; M494-E496 VanDerWaalsContact C-N 3.35Å; M494-E496 PolarHBondContact O-N 3.21Å; E496-Q498 VanDerWaalsContact C-N 3.3Å; E496-Q498 PolarHBondContact O-N 3.38Å; E496-L499 PolarHBondContact O-N 3.28Å; E496-R500 VanDerWaalsContact O-CB 3.27Å; E496-R500 WeakPolarHBondContact O-CB 3.29Å; E496-R500 PolarHBondContact O-N 3.15Å; E496-R500 WeakPolarHBondContact OE1-CD 3.41Å; E496-R500 IonicContact OE1-CZ 3.34Å; E496-R500 IonicContact OE1-NE 3.68Å; E496-R500 IonicContact OE1-NH1 3.78Å; E496-R500 PolarHBondContact OE1-NH1 3.46Å; E496-R500 IonicContact OE2-NH1 2.71Å; E496-Y529 HydrophobicContact CG-CD1 3.95Å; E496-Y529 HydrophobicContact CG-CD2 3.95Å; E496-Y529 HydrophobicContact CG-CE1 3.76Å; E496-Y529 HydrophobicContact CG-CE2 3.72Å; E496-Y529 HydrophobicContact CG-CG 4.03Å
497	Q	79.4	Confident	82.9	Confident	50 Å²	50	43.7 Å²	43.7	23%	0.234	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-42.6	-178.4	-71.1	179.2	-0.6	0	0	111.7	V493 M494 K501	V493-Q497 WeakPolarHBondContact O-CG 3.35Å; V493-Q497 PolarHBondContact O-N 3.18Å; V493-Q497 VanDerWaalsContact O-N 3.13Å; M494-Q497 PolarHBondContact O-N 3.37Å; Q497-K501 VanDerWaalsContact O-CB 3.32Å; Q497-K501 WeakPolarHBondContact O-CB 3.49Å; Q497-K501 PolarHBondContact O-N 3.04Å
498	Q	82.2	Confident	83.2	Confident	97 Å²	97	52.4 Å²	52.4	45%	0.453	25%	0.251	S	S	.	.	H	α-helix	trans	-68.7	-41.5	178.7	-66.2	-65.4	-11.6	0	0	112.1	M494 E496 K501 F502	M494-Q498 WeakPolarHBondContact O-CB 3.38Å; M494-Q498 VanDerWaalsContact O-CG 3.22Å; M494-Q498 WeakPolarHBondContact O-CG 3.42Å; M494-Q498 PolarHBondContact O-N 2.9Å; E496-Q498 VanDerWaalsContact C-N 3.3Å; E496-Q498 PolarHBondContact O-N 3.38Å; Q498-K501 PolarHBondContact O-N 3.29Å; Q498-F502 VanDerWaalsContact O-CB 3.29Å; Q498-F502 WeakPolarHBondContact O-CB 3.45Å; Q498-F502 PolarHBondContact O-N 3.3Å
499	L	88.1	Confident	83.6	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-39.4	177.3	-71.5	172.5	0	0	0	112	L280 P473 F474 A477 C495 E496 F502 C503 F525	L280-L499 HydrophobicContact CD1-CD1 4.08Å; L280-L499 HydrophobicContact CD2-CD1 3.6Å; P473-L499 HydrophobicContact CB-CD2 3.63Å; F474-L499 HydrophobicContact CD1-CD1 4.02Å; F474-L499 HydrophobicContact CD1-CD2 4.26Å; F474-L499 HydrophobicContact CD2-CD2 3.99Å; F474-L499 HydrophobicContact CE1-CD1 4.35Å; F474-L499 HydrophobicContact CE1-CD2 4.49Å; F474-L499 HydrophobicContact CE2-CD2 4.2Å; F474-L499 HydrophobicContact CG-CD1 4.45Å; F474-L499 HydrophobicContact CG-CD2 4.03Å; F474-L499 HydrophobicContact CZ-CD2 4.46Å; A477-L499 HydrophobicContact CB-CD1 3.76Å; C495-L499 VanDerWaalsContact O-CB 3.25Å; C495-L499 WeakPolarHBondContact O-CB 3.44Å; C495-L499 WeakPolarHBondContact O-CD1 3.11Å; C495-L499 WeakPolarHBondContact O-CG 3.37Å; C495-L499 PolarHBondContact O-N 3.48Å; E496-L499 PolarHBondContact O-N 3.28Å; L499-F502 WeakPolarHBondContact O-CB 2.95Å; L499-F502 PolarHBondContact O-N 2.93Å; L499-C503 PolarHBondContact O-N 3.33Å; L499-C503 PolarHBondContact O-SG 3.45Å; L499-F525 HydrophobicContact CB-CE2 4.08Å; L499-F525 HydrophobicContact CB-CZ 3.65Å; L499-F525 HydrophobicContact CD1-CZ 4.26Å
500	R	86	Confident	83.7	Confident	99 Å²	99	57.8 Å²	57.8	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-62.6	-48	174.5	-172.6	176.1	67.3	-157	8.8	110.6	E496 F502 C503 L504	E496-R500 VanDerWaalsContact O-CB 3.27Å; E496-R500 WeakPolarHBondContact O-CB 3.29Å; E496-R500 PolarHBondContact O-N 3.15Å; E496-R500 WeakPolarHBondContact OE1-CD 3.41Å; E496-R500 IonicContact OE1-CZ 3.34Å; E496-R500 IonicContact OE1-NE 3.68Å; E496-R500 IonicContact OE1-NH1 3.78Å; E496-R500 PolarHBondContact OE1-NH1 3.46Å; E496-R500 IonicContact OE2-NH1 2.71Å; R500-F502 VanDerWaalsContact C-N 3.32Å; R500-F502 PolarHBondContact O-N 2.92Å; R500-C503 PolarHBondContact O-N 3.42Å; R500-L504 HydrophobicContact CG-CD1 4.02Å; R500-L504 WeakPolarHBondContact O-CG 3.48Å; R500-L504 PolarHBondContact O-N 2.95Å
501	K	85.8	Confident	84.3	Confident	130 Å²	130	59.5 Å²	59.5	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-58.9	-42.8	173.9	-176.2	178.2	179	179.5	0	111.7	Q497 Q498 C503 L504 T505	Q497-K501 VanDerWaalsContact O-CB 3.32Å; Q497-K501 WeakPolarHBondContact O-CB 3.49Å; Q497-K501 PolarHBondContact O-N 3.04Å; Q498-K501 PolarHBondContact O-N 3.29Å; K501-C503 VanDerWaalsContact C-N 3.32Å; K501-C503 PolarHBondContact O-N 3Å; K501-L504 PolarHBondContact O-N 3.12Å; K501-T505 WeakPolarHBondContact O-CB 3.47Å; K501-T505 PolarHBondContact O-N 2.65Å; K501-T505 PolarHBondContact O-OG1 3.42Å
502	F	88.7	Confident	84.9	Confident	53 Å²	53	64.9 Å²	64.9	23%	0.232	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-41.6	176.4	168.8	-100.3	0	0	0	112.4	P473 F474 Q498 L499 R500 K518	P473-F502 HydrophobicContact CG-CD1 4.39Å; P473-F502 HydrophobicContact CG-CD2 4.4Å; P473-F502 HydrophobicContact CG-CE1 4.06Å; P473-F502 HydrophobicContact CG-CE2 4.07Å; P473-F502 HydrophobicContact CG-CZ 3.89Å; F474-F502 HydrophobicContact CE2-CD1 4.47Å; F474-F502 HydrophobicContact CE2-CE1 4.43Å; Q498-F502 VanDerWaalsContact O-CB 3.29Å; Q498-F502 WeakPolarHBondContact O-CB 3.45Å; Q498-F502 PolarHBondContact O-N 3.3Å; L499-F502 WeakPolarHBondContact O-CB 2.95Å; L499-F502 PolarHBondContact O-N 2.93Å; R500-F502 VanDerWaalsContact C-N 3.32Å; R500-F502 PolarHBondContact O-N 2.92Å; F502-K518 HydrophobicContact CE1-CG 4.49Å; F502-K518 WeakPolarHBondContact O-CE 3.24Å
503	C	88.8	Confident	85.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71.8	-31.6	177.8	-62.2	0	0	0	0	112.8	L499 R500 K501 Q522	L499-C503 PolarHBondContact O-N 3.33Å; L499-C503 PolarHBondContact O-SG 3.45Å; R500-C503 PolarHBondContact O-N 3.42Å; K501-C503 VanDerWaalsContact C-N 3.32Å; K501-C503 PolarHBondContact O-N 3Å; C503-Q522 HydrophobicContact CB-CB 4.08Å
504	L	86.6	Confident	85.9	Confident	80 Å²	80	65.3 Å²	65.3	42%	0.419	32%	0.324	S	S	.	.	H	α-helix	trans	-77.6	-26.3	176.9	-76.1	164.2	0	0	0	113.8	R500 K501 H506 Q522	R500-L504 HydrophobicContact CG-CD1 4.02Å; R500-L504 WeakPolarHBondContact O-CG 3.48Å; R500-L504 PolarHBondContact O-N 2.95Å; K501-L504 PolarHBondContact O-N 3.12Å; L504-H506 PolarHBondContact O-N 2.95Å; L504-Q522 HydrophobicContact CD2-CG 4Å; L504-Q522 HydrophobicContact CG-CG 4.32Å
505	T	83.7	Confident	86.5	Confident	53 Å²	53	67 Å²	67	33%	0.325	33%	0.331	S	S	.	.			trans	-80.4	111.3	-173.4	-54	0	0	0	0	110.6	K501 N507 K518	K501-T505 WeakPolarHBondContact O-CB 3.47Å; K501-T505 PolarHBondContact O-N 2.65Å; K501-T505 PolarHBondContact O-OG1 3.42Å; T505-N507 WeakPolarHBondContact CG2-OD1 3.42Å; T505-N507 PolarHBondContact O-N 3.38Å; T505-K518 PolarHBondContact O-NZ 3.01Å
506	H	79.5	Confident	87	Confident	120 Å²	120	67.1 Å²	67.1	56%	0.556	33%	0.331	S	S	*	.			trans	-83.5	104.9	168.8	-66.3	-76.1	0	0	0	110.1	L504	L504-H506 PolarHBondContact O-N 2.95Å
507	N	83.5	Confident	87.4	Confident	74 Å²	74	66.8 Å²	66.8	40%	0.396	33%	0.33	S	S	.	.			trans	-88.2	143.3	172.9	-60.9	-42.3	0	0	0	110	T505 S509 D510	T505-N507 WeakPolarHBondContact CG2-OD1 3.42Å; T505-N507 PolarHBondContact O-N 3.38Å; N507-S509 PolarHBondContact O-N 2.96Å; N507-S509 VanDerWaalsContact O-N 3.12Å; N507-D510 PolarHBondContact N-OD2 2.85Å; N507-D510 WeakPolarHBondContact O-CB 3.48Å; N507-D510 PolarHBondContact O-N 2.72Å
508	Q	80.7	Confident	88.2	Confident	211 Å²	211	64.6 Å²	64.6	99%	0.986	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.5	175.5	-66.4	179.5	0.1	0	0	113.1
509	S	86.4	Confident	88.7	Confident	105 Å²	105	61.8 Å²	61.8	73%	0.734	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-10	177	59	0	0	0	0	114.3	N507 S511	N507-S509 PolarHBondContact O-N 2.96Å; N507-S509 VanDerWaalsContact O-N 3.12Å; S509-S511 PolarHBondContact O-N 2.82Å
510	D	88.6	Confident	88.9	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.118	31%	0.314	C	S	.	.			trans	-72.1	126.6	-176.8	-70.3	-13.9	0	0	0	109.6	N507 V514 Q515 K518	N507-D510 PolarHBondContact N-OD2 2.85Å; N507-D510 WeakPolarHBondContact O-CB 3.48Å; N507-D510 PolarHBondContact O-N 2.72Å; D510-V514 HydrophobicContact CB-CB 4.13Å; D510-V514 HydrophobicContact CB-CG1 3.88Å; D510-Q515 HydrophobicContact CB-CG 3.82Å; D510-Q515 PolarHBondContact O-NE2 3.17Å; D510-K518 IonicContact OD1-NZ 3.51Å; D510-K518 IonicContact OD2-NZ 3.8Å; D510-K518 PolarHBondContact OD2-NZ 3.27Å
511	S	92.4	Very high	89.2	Confident	37 Å²	37	57.7 Å²	57.7	26%	0.259	30%	0.296	S	S	.	.			trans	-64.4	161.6	172.5	77.2	0	0	0	0	111	D466 S509 L513 V514 Q515	D466-S511 VanDerWaalsContact OD2-CB 3.24Å; D466-S511 WeakPolarHBondContact OD2-CB 3.38Å; D466-S511 PolarHBondContact OD2-OG 3.36Å; S509-S511 PolarHBondContact O-N 2.82Å; S511-L513 PolarHBondContact O-N 3.04Å; S511-L513 PolarHBondContact OG-N 3Å; S511-V514 PolarHBondContact O-N 3.44Å; S511-V514 WeakPolarHBondContact OG-CG2 3.26Å; S511-V514 PolarHBondContact OG-N 2.98Å; S511-Q515 WeakPolarHBondContact O-CG 3.37Å; S511-Q515 PolarHBondContact O-N 3.29Å
512	K	91.8	Very high	89.5	Confident	144 Å²	144	53.4 Å²	53.4	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-53.2	-39.3	174.3	-171	-173.4	179.8	-136.8	0	111.6	E357 Q515 T516	E357-K512 WeakPolarHBondContact OE1-CE 3.19Å; E357-K512 IonicContact OE1-NZ 3.55Å; E357-K512 PolarHBondContact OE1-NZ 3.36Å; K512-Q515 PolarHBondContact O-N 3.48Å; K512-T516 PolarHBondContact O-N 2.92Å; K512-T516 PolarHBondContact O-OG1 2.86Å; K512-T516 VanDerWaalsContact O-OG1 3.08Å
513	L	92.6	Very high	89.6	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-53.5	175.3	175.3	62.4	0	0	0	111.1	E357 V463 D466 S511 Q515 T516 L517	E357-L513 HydrophobicContact CB-CD1 3.63Å; E357-L513 HydrophobicContact CG-CD1 4.01Å; V463-L513 HydrophobicContact CB-CD2 4.29Å; V463-L513 HydrophobicContact CG1-CD2 3.9Å; V463-L513 HydrophobicContact CG2-CD2 4.22Å; D466-L513 HydrophobicContact CB-CD2 4.04Å; S511-L513 PolarHBondContact O-N 3.04Å; S511-L513 PolarHBondContact OG-N 3Å; L513-Q515 VanDerWaalsContact C-N 3.29Å; L513-Q515 PolarHBondContact O-N 2.76Å; L513-T516 PolarHBondContact O-N 2.88Å; L513-L517 HydrophobicContact CD1-CD1 4.05Å; L513-L517 HydrophobicContact CD1-CD2 4.12Å; L513-L517 HydrophobicContact CD1-CG 3.93Å; L513-L517 HydrophobicContact CG-CD1 4.12Å; L513-L517 HydrophobicContact CG-CG 4.32Å; L513-L517 VanDerWaalsContact O-CG 3.31Å; L513-L517 WeakPolarHBondContact O-CG 3.46Å; L513-L517 PolarHBondContact O-N 3.32Å
514	V	93.5	Very high	89.6	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-57.6	-43	-179.9	173.5	0	0	0	0	111.4	D466 V470 D510 S511 L517 K518	D466-V514 HydrophobicContact CB-CG2 3.56Å; V470-V514 HydrophobicContact CG2-CG1 4.02Å; V470-V514 HydrophobicContact CG2-CG2 4.38Å; D510-V514 HydrophobicContact CB-CB 4.13Å; D510-V514 HydrophobicContact CB-CG1 3.88Å; S511-V514 PolarHBondContact O-N 3.44Å; S511-V514 WeakPolarHBondContact OG-CG2 3.26Å; S511-V514 PolarHBondContact OG-N 2.98Å; V514-L517 PolarHBondContact O-N 3.03Å; V514-K518 HydrophobicContact CG1-CD 4.07Å; V514-K518 HydrophobicContact CG1-CG 4.32Å; V514-K518 WeakPolarHBondContact O-CB 3.46Å; V514-K518 WeakPolarHBondContact O-CG 3.18Å; V514-K518 PolarHBondContact O-N 3.17Å
515	Q	92.1	Very high	89.7	Confident	77 Å²	77	54 Å²	54	36%	0.36	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-49.9	177.5	-65.9	175.4	29.3	0	0	111.1	D510 S511 K512 L513 L517 K518 S519	D510-Q515 HydrophobicContact CB-CG 3.82Å; D510-Q515 PolarHBondContact O-NE2 3.17Å; S511-Q515 WeakPolarHBondContact O-CG 3.37Å; S511-Q515 PolarHBondContact O-N 3.29Å; K512-Q515 PolarHBondContact O-N 3.48Å; L513-Q515 VanDerWaalsContact C-N 3.29Å; L513-Q515 PolarHBondContact O-N 2.76Å; Q515-L517 PolarHBondContact O-N 3.42Å; Q515-K518 PolarHBondContact O-N 3.29Å; Q515-S519 PolarHBondContact O-N 2.83Å; Q515-S519 PolarHBondContact O-OG 3.19Å; Q515-S519 VanDerWaalsContact O-OG 3.13Å
516	T	92.2	Very high	89.8	Confident	24 Å²	24	56.4 Å²	56.4	15%	0.147	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-46	176.9	-60.6	0	0	0	0	112	N354 K512 L513 S519 N520	N354-T516 WeakPolarHBondContact OD1-CG2 3.25Å; K512-T516 PolarHBondContact O-N 2.92Å; K512-T516 PolarHBondContact O-OG1 2.86Å; K512-T516 VanDerWaalsContact O-OG1 3.08Å; L513-T516 PolarHBondContact O-N 2.88Å; T516-S519 PolarHBondContact O-N 3.24Å; T516-N520 PolarHBondContact O-N 3.11Å; T516-N520 PolarHBondContact O-ND2 3.12Å; T516-N520 PolarHBondContact O-OD1 3.2Å
517	L	93.8	Very high	90	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-45.5	179.6	-62.9	-174.3	0	0	0	111.5	L288 L467 V470 L513 V514 Q515 N520 L521	L288-L517 HydrophobicContact CD2-CB 3.81Å; L288-L517 HydrophobicContact CD2-CD1 4.46Å; L288-L517 HydrophobicContact CD2-CD2 3.87Å; L288-L517 HydrophobicContact CD2-CG 4.21Å; L467-L517 HydrophobicContact CD1-CD1 3.94Å; V470-L517 HydrophobicContact CG1-CB 4.22Å; V470-L517 HydrophobicContact CG2-CB 4.24Å; V470-L517 HydrophobicContact CG2-CD1 4.27Å; L513-L517 HydrophobicContact CD1-CD1 4.05Å; L513-L517 HydrophobicContact CD1-CD2 4.12Å; L513-L517 HydrophobicContact CD1-CG 3.93Å; L513-L517 HydrophobicContact CG-CD1 4.12Å; L513-L517 HydrophobicContact CG-CG 4.32Å; L513-L517 VanDerWaalsContact O-CG 3.31Å; L513-L517 WeakPolarHBondContact O-CG 3.46Å; L513-L517 PolarHBondContact O-N 3.32Å; V514-L517 PolarHBondContact O-N 3.03Å; Q515-L517 PolarHBondContact O-N 3.42Å; L517-N520 PolarHBondContact O-N 3.25Å; L517-L521 VanDerWaalsContact O-CG 3.32Å; L517-L521 WeakPolarHBondContact O-CG 3.46Å; L517-L521 PolarHBondContact O-N 3.28Å
518	K	94.2	Very high	89.8	Confident	3 Å²	3	54.9 Å²	54.9	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-46.2	176.3	-80.5	-177.8	172.4	-179.7	0	112.2	F502 T505 D510 V514 Q515 N520 L521 Q522	F502-K518 HydrophobicContact CE1-CG 4.49Å; F502-K518 WeakPolarHBondContact O-CE 3.24Å; T505-K518 PolarHBondContact O-NZ 3.01Å; D510-K518 IonicContact OD1-NZ 3.51Å; D510-K518 IonicContact OD2-NZ 3.8Å; D510-K518 PolarHBondContact OD2-NZ 3.27Å; V514-K518 HydrophobicContact CG1-CD 4.07Å; V514-K518 HydrophobicContact CG1-CG 4.32Å; V514-K518 WeakPolarHBondContact O-CB 3.46Å; V514-K518 WeakPolarHBondContact O-CG 3.18Å; V514-K518 PolarHBondContact O-N 3.17Å; Q515-K518 PolarHBondContact O-N 3.29Å; K518-N520 VanDerWaalsContact C-N 3.28Å; K518-N520 PolarHBondContact O-N 2.56Å; K518-L521 PolarHBondContact O-N 3.11Å; K518-Q522 WeakPolarHBondContact O-CB 3.28Å; K518-Q522 PolarHBondContact O-N 2.93Å
519	S	92.6	Very high	89.6	Confident	39 Å²	39	46 Å²	46	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-34.4	177.6	-63.6	0	0	0	0	112.4	Q515 T516 R523	Q515-S519 PolarHBondContact O-N 2.83Å; Q515-S519 PolarHBondContact O-OG 3.19Å; Q515-S519 VanDerWaalsContact O-OG 3.13Å; T516-S519 PolarHBondContact O-N 3.24Å; S519-R523 WeakPolarHBondContact O-CG 3.44Å; S519-R523 PolarHBondContact O-N 2.86Å
520	N	93	Very high	88.7	Confident	18 Å²	18	41.9 Å²	41.9	10%	0.096	20%	0.202	C	C	.	.	H	α-helix	trans	-69.5	-41.3	174.5	-62.3	-16.7	0	0	0	112.3	G287 N354 T516 L517 K518 R523 Q524	G287-N520 WeakPolarHBondContact O-CB 3.43Å; N354-N520 PolarHBondContact ND2-ND2 2.96Å; N354-N520 PolarHBondContact ND2-OD1 2.81Å; T516-N520 PolarHBondContact O-N 3.11Å; T516-N520 PolarHBondContact O-ND2 3.12Å; T516-N520 PolarHBondContact O-OD1 3.2Å; L517-N520 PolarHBondContact O-N 3.25Å; K518-N520 VanDerWaalsContact C-N 3.28Å; K518-N520 PolarHBondContact O-N 2.56Å; N520-R523 PolarHBondContact O-N 3.37Å; N520-R523 PolarHBondContact OD1-NH2 3.37Å; N520-Q524 PolarHBondContact O-N 2.95Å
521	L	93.2	Very high	87.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-42.4	175.8	-68.9	169	0	0	0	111.7	V283 V284 L288 V470 F474 L517 K518 R523 Q524 F525	V283-L521 HydrophobicContact CG1-CD2 4.09Å; V284-L521 HydrophobicContact CB-CD2 4.48Å; V284-L521 HydrophobicContact CG2-CD2 4.25Å; L288-L521 HydrophobicContact CD2-CD1 4.02Å; L288-L521 HydrophobicContact CD2-CD2 3.96Å; L288-L521 HydrophobicContact CD2-CG 3.83Å; L288-L521 HydrophobicContact CG-CD2 4.01Å; L288-L521 HydrophobicContact CG-CG 4.43Å; V470-L521 HydrophobicContact CG1-CD1 3.39Å; F474-L521 HydrophobicContact CE2-CD1 3.74Å; F474-L521 HydrophobicContact CZ-CB 4.37Å; F474-L521 HydrophobicContact CZ-CD1 3.8Å; F474-L521 HydrophobicContact CZ-CD2 4.16Å; F474-L521 HydrophobicContact CZ-CG 4.35Å; L517-L521 VanDerWaalsContact O-CG 3.32Å; L517-L521 WeakPolarHBondContact O-CG 3.46Å; L517-L521 PolarHBondContact O-N 3.28Å; K518-L521 PolarHBondContact O-N 3.11Å; L521-R523 PolarHBondContact O-N 2.86Å; L521-Q524 PolarHBondContact O-N 3.47Å; L521-Q524 VanDerWaalsContact O-N 3.12Å; L521-F525 PolarHBondContact O-N 3.21Å
522	Q	91.4	Very high	85.8	Confident	39 Å²	39	47.9 Å²	47.9	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-57	-48.7	175.8	-176.1	-165.9	-25.9	0	0	111.4	C503 L504 K518 Q524 F525 E526	C503-Q522 HydrophobicContact CB-CB 4.08Å; L504-Q522 HydrophobicContact CD2-CG 4Å; L504-Q522 HydrophobicContact CG-CG 4.32Å; K518-Q522 WeakPolarHBondContact O-CB 3.28Å; K518-Q522 PolarHBondContact O-N 2.93Å; Q522-Q524 PolarHBondContact O-N 3.08Å; Q522-F525 WeakPolarHBondContact O-CB 2.97Å; Q522-F525 PolarHBondContact O-N 3.27Å; Q522-E526 PolarHBondContact NE2-OE1 3.43Å; Q522-E526 PolarHBondContact O-N 3.33Å
523	R	90.5	Very high	84.2	Confident	112 Å²	112	42 Å²	42	42%	0.423	23%	0.234	S	C	.	.	H	α-helix	trans	-57.5	-35.3	176.7	-76.2	-172.5	-74.7	170.3	-9.8	112.6	N354 S519 N520 L521	N354-R523 PolarHBondContact ND2-NH2 3.22Å; S519-R523 WeakPolarHBondContact O-CG 3.44Å; S519-R523 PolarHBondContact O-N 2.86Å; N520-R523 PolarHBondContact O-N 3.37Å; N520-R523 PolarHBondContact OD1-NH2 3.37Å; L521-R523 PolarHBondContact O-N 2.86Å
524	Q	90.2	Very high	82.3	Confident	31 Å²	31	45.2 Å²	45.2	15%	0.145	26%	0.263	C	S	.	.	H	α-helix	trans	-74.7	-38.9	175.1	-63.3	-58.5	-41.5	0	0	112.3	V283 R286 N520 L521 Q522 E526 K527 F528	V283-Q524 HydrophobicContact CB-CB 4.29Å; V283-Q524 HydrophobicContact CG1-CB 4.1Å; V283-Q524 HydrophobicContact CG2-CB 4.25Å; R286-Q524 HydrophobicContact CB-CG 4.25Å; N520-Q524 PolarHBondContact O-N 2.95Å; L521-Q524 PolarHBondContact O-N 3.47Å; L521-Q524 VanDerWaalsContact O-N 3.12Å; Q522-Q524 PolarHBondContact O-N 3.08Å; Q524-E526 VanDerWaalsContact C-N 3.31Å; Q524-E526 PolarHBondContact O-N 2.88Å; Q524-K527 WeakPolarHBondContact O-CB 3.46Å; Q524-K527 PolarHBondContact O-N 3.32Å; Q524-F528 WeakPolarHBondContact O-CD2 3.41Å; Q524-F528 PolarHBondContact O-N 3.33Å
525	F	88.2	Confident	80.7	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.013	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-43.1	173.8	-92	-63.2	0	0	0	111.9	L280 V283 F474 L499 L521 Q522 K527 F528 Y529	L280-F525 HydrophobicContact CD2-CE1 3.93Å; L280-F525 HydrophobicContact CD2-CZ 3.89Å; V283-F525 HydrophobicContact CG1-CD1 4.34Å; V283-F525 HydrophobicContact CG1-CD2 3.72Å; V283-F525 HydrophobicContact CG1-CE1 4.35Å; V283-F525 HydrophobicContact CG1-CE2 3.76Å; V283-F525 HydrophobicContact CG1-CG 4.03Å; V283-F525 HydrophobicContact CG1-CZ 4.06Å; V283-F525 HydrophobicContact CG2-CD1 4.06Å; V283-F525 HydrophobicContact CG2-CE1 4.29Å; V283-F525 HydrophobicContact CG2-CG 4.31Å; F474-F525 HydrophobicContact CD1-CZ 4.42Å; F474-F525 AromaticContact CE1-CE2 3.43Å; F474-F525 HydrophobicContact CE1-CE2 3.43Å; F474-F525 VanDerWaalsContact CE1-CE2 3.43Å; F474-F525 AromaticContact CE1-CZ 3.48Å; F474-F525 HydrophobicContact CE1-CZ 3.48Å; F474-F525 VanDerWaalsContact CE1-CZ 3.48Å; F474-F525 AromaticContact CZ-CE2 3.52Å; F474-F525 HydrophobicContact CZ-CE2 3.52Å; F474-F525 HydrophobicContact CZ-CZ 4.04Å; L499-F525 HydrophobicContact CB-CE2 4.08Å; L499-F525 HydrophobicContact CB-CZ 3.65Å; L499-F525 HydrophobicContact CD1-CZ 4.26Å; L521-F525 PolarHBondContact O-N 3.21Å; Q522-F525 WeakPolarHBondContact O-CB 2.97Å; Q522-F525 PolarHBondContact O-N 3.27Å; F525-K527 VanDerWaalsContact C-N 3.26Å; F525-K527 PolarHBondContact O-N 2.92Å; F525-F528 PolarHBondContact O-N 2.89Å; F525-Y529 AromaticContact CD1-CD2 3.89Å; F525-Y529 HydrophobicContact CD1-CD2 3.89Å; F525-Y529 HydrophobicContact CD1-CE2 4.07Å; F525-Y529 HydrophobicContact CE1-CE2 4.26Å; F525-Y529 PolarHBondContact O-N 3.26Å
526	E	84.7	Confident	79	Confident	104 Å²	104	47.7 Å²	47.7	49%	0.486	27%	0.274	S	S	.	.	H	α-helix	trans	-60.9	-32	177.5	-73.5	169.7	-170	0	0	112.6	Q522 Q524 F528 G530	Q522-E526 PolarHBondContact NE2-OE1 3.43Å; Q522-E526 PolarHBondContact O-N 3.33Å; Q524-E526 VanDerWaalsContact C-N 3.31Å; Q524-E526 PolarHBondContact O-N 2.88Å; E526-F528 VanDerWaalsContact C-N 3.29Å; E526-F528 PolarHBondContact O-N 3.38Å; E526-G530 WeakPolarHBondContact O-CA 3.23Å; E526-G530 PolarHBondContact O-N 3.19Å
527	K	84.6	Confident	77.8	Confident	130 Å²	130	48.4 Å²	48.4	57%	0.565	28%	0.277	S	S	*	.	H	α-helix	trans	-66.6	-30	174.1	-67	-172.7	179	-158.2	0	113.1	E347 Q524 F525	E347-K527 IonicContact OE2-NZ 3.75Å; Q524-K527 WeakPolarHBondContact O-CB 3.46Å; Q524-K527 PolarHBondContact O-N 3.32Å; F525-K527 VanDerWaalsContact C-N 3.26Å; F525-K527 PolarHBondContact O-N 2.92Å
528	F	78.6	Confident	77.3	Confident	31 Å²	31	51.3 Å²	51.3	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-96.1	-33.5	-178.7	-73.5	-77.5	0	0	0	113.5	L257 I279 A282 V283 Q524 F525 E526 S533 L535	L257-F528 HydrophobicContact CD1-CE1 3.88Å; L257-F528 HydrophobicContact CD1-CZ 4.25Å; I279-F528 HydrophobicContact CG1-CD1 4.24Å; I279-F528 HydrophobicContact CG2-CB 3.84Å; I279-F528 HydrophobicContact CG2-CD1 3.99Å; I279-F528 HydrophobicContact CG2-CD2 4.08Å; I279-F528 HydrophobicContact CG2-CG 3.72Å; A282-F528 HydrophobicContact CB-CE2 3.75Å; A282-F528 HydrophobicContact CB-CZ 3.47Å; A282-F528 VanDerWaalsContact CB-CZ 3.47Å; V283-F528 HydrophobicContact CG2-CD2 3.7Å; V283-F528 HydrophobicContact CG2-CE2 4.08Å; Q524-F528 WeakPolarHBondContact O-CD2 3.41Å; Q524-F528 PolarHBondContact O-N 3.33Å; F525-F528 PolarHBondContact O-N 2.89Å; E526-F528 VanDerWaalsContact C-N 3.29Å; E526-F528 PolarHBondContact O-N 3.38Å; F528-S533 VanDerWaalsContact C-CB 3.48Å; F528-S533 WeakPolarHBondContact O-CB 3.27Å; F528-S533 PolarHBondContact O-OG 3.4Å; F528-L535 HydrophobicContact CB-CD1 4.44Å; F528-L535 WeakPolarHBondContact O-CD1 3.12Å
529	Y	76.5	Confident	76.9	Confident	24 Å²	24	51.2 Å²	51.2	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-126.1	2.7	-173.2	-63.4	-81.8	0	0	0	114.3	F276 I279 E496 F525 S533 L535 L540	F276-Y529 HydrophobicContact CE2-CE1 4.19Å; F276-Y529 WeakPolarHBondContact CE2-OH 3.28Å; F276-Y529 HydrophobicContact CZ-CE1 4.3Å; F276-Y529 WeakPolarHBondContact CZ-OH 3.35Å; I279-Y529 HydrophobicContact CG2-CE2 3.57Å; E496-Y529 HydrophobicContact CG-CD1 3.95Å; E496-Y529 HydrophobicContact CG-CD2 3.95Å; E496-Y529 HydrophobicContact CG-CE1 3.76Å; E496-Y529 HydrophobicContact CG-CE2 3.72Å; E496-Y529 HydrophobicContact CG-CG 4.03Å; F525-Y529 AromaticContact CD1-CD2 3.89Å; F525-Y529 HydrophobicContact CD1-CD2 3.89Å; F525-Y529 HydrophobicContact CD1-CE2 4.07Å; F525-Y529 HydrophobicContact CE1-CE2 4.26Å; F525-Y529 PolarHBondContact O-N 3.26Å; Y529-S533 WeakPolarHBondContact CA-OG 3.3Å; Y529-L535 HydrophobicContact CD1-CB 3.99Å; Y529-L535 HydrophobicContact CD1-CD1 3.81Å; Y529-L535 HydrophobicContact CE1-CB 4.15Å; Y529-L535 HydrophobicContact CE1-CD1 3.4Å; Y529-L535 VanDerWaalsContact CE1-CD1 3.4Å; Y529-L535 HydrophobicContact CE1-CG 4.27Å; Y529-L535 HydrophobicContact CE2-CD1 4.31Å; Y529-L535 HydrophobicContact CG-CD1 4.4Å; Y529-L540 HydrophobicContact CE1-CD1 4.41Å
530	G	68.5	Low	76.5	Confident	19 Å²	19	50.7 Å²	50.7	20%	0.196	29%	0.286	C	S	.	.	S	Bend	trans	-71.2	170.8	175.1	0	0	0	0	0	112.5	E526 G532 S533	E526-G530 WeakPolarHBondContact O-CA 3.23Å; E526-G530 PolarHBondContact O-N 3.19Å; G530-G532 PolarHBondContact O-N 3.38Å; G530-S533 WeakPolarHBondContact O-CB 3.12Å; G530-S533 PolarHBondContact O-N 2.96Å; G530-S533 PolarHBondContact O-OG 3.43Å
531	S	61.6	Low	76.1	Confident	115 Å²	115	54 Å²	54	80%	0.804	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	125.8	177.9	54.4	0	0	0	0	111.7	E536	S531-E536 WeakPolarHBondContact CA-OE1 3.31Å
532	G	57.2	Low	75.9	Confident	70 Å²	70	53.9 Å²	53.9	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	6.2	-175.1	0	0	0	0	0	115	G530 E536	G530-G532 PolarHBondContact O-N 3.38Å; G532-E536 PolarHBondContact N-OE2 3.23Å
533	S	59.8	Low	75.8	Confident	21 Å²	21	52 Å²	52	15%	0.147	29%	0.29	C	S	.	.			trans	-73.3	158	175.1	87	0	0	0	0	112	F528 Y529 G530 L535 E536	F528-S533 VanDerWaalsContact C-CB 3.48Å; F528-S533 WeakPolarHBondContact O-CB 3.27Å; F528-S533 PolarHBondContact O-OG 3.4Å; Y529-S533 WeakPolarHBondContact CA-OG 3.3Å; G530-S533 WeakPolarHBondContact O-CB 3.12Å; G530-S533 PolarHBondContact O-N 2.96Å; G530-S533 PolarHBondContact O-OG 3.43Å; S533-L535 PolarHBondContact O-N 3.14Å; S533-L535 PolarHBondContact OG-N 2.74Å; S533-E536 PolarHBondContact O-N 3.41Å
534	A	52.5	Low	75.4	Confident	79 Å²	79	46.9 Å²	46.9	65%	0.653	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-6.5	176.5	0	0	0	0	0	114.4
535	L	59.9	Low	75.3	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.037	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	2.4	-177.5	-73	165.5	0	0	0	113.5	L273 P274 I279 F528 Y529 S533 D537 L540	L273-L535 HydrophobicContact CD1-CD2 4.17Å; P274-L535 HydrophobicContact CB-CD2 4.09Å; P274-L535 HydrophobicContact CG-CD2 3.6Å; P274-L535 HydrophobicContact CG-CG 4.14Å; I279-L535 HydrophobicContact CD1-CD1 3.36Å; I279-L535 HydrophobicContact CD1-CD2 4.38Å; I279-L535 HydrophobicContact CD1-CG 4.47Å; I279-L535 HydrophobicContact CG1-CD1 4.36Å; F528-L535 HydrophobicContact CB-CD1 4.44Å; F528-L535 WeakPolarHBondContact O-CD1 3.12Å; Y529-L535 HydrophobicContact CD1-CB 3.99Å; Y529-L535 HydrophobicContact CD1-CD1 3.81Å; Y529-L535 HydrophobicContact CE1-CB 4.15Å; Y529-L535 HydrophobicContact CE1-CD1 3.4Å; Y529-L535 VanDerWaalsContact CE1-CD1 3.4Å; Y529-L535 HydrophobicContact CE1-CG 4.27Å; Y529-L535 HydrophobicContact CE2-CD1 4.31Å; Y529-L535 HydrophobicContact CG-CD1 4.4Å; S533-L535 PolarHBondContact O-N 3.14Å; S533-L535 PolarHBondContact OG-N 2.74Å; L535-D537 PolarHBondContact O-N 2.95Å; L535-L540 HydrophobicContact CB-CD1 4.5Å; L535-L540 WeakPolarHBondContact O-CD1 3.46Å
536	E	56.2	Low	75.2	Confident	127 Å²	127	45.4 Å²	45.4	59%	0.593	27%	0.265	S	S	*	.			trans	-69.1	68.6	165.6	-76.9	-165.1	137.7	0	0	109.9	S531 G532 S533	S531-E536 WeakPolarHBondContact CA-OE1 3.31Å; G532-E536 PolarHBondContact N-OE2 3.23Å; S533-E536 PolarHBondContact O-N 3.41Å
537	D	66.9	Low	74.9	Confident	40 Å²	40	40.6 Å²	40.6	21%	0.214	24%	0.242	C	C	.	.			trans	-104.5	132.1	-174.8	-156.5	-49.2	0	0	0	109	R252 L535 L539 L540	R252-D537 IonicContact CZ-OD1 3.53Å; R252-D537 IonicContact CZ-OD2 3.93Å; R252-D537 IonicContact NH1-OD1 2.65Å; R252-D537 PolarHBondContact NH1-OD1 3.45Å; R252-D537 IonicContact NH1-OD2 3.45Å; R252-D537 PolarHBondContact NH1-OD2 2.86Å; R252-D537 IonicContact NH2-OD1 3.42Å; R252-D537 PolarHBondContact NH2-OD1 2.94Å; R252-D537 IonicContact NH2-OD2 3.39Å; R252-D537 PolarHBondContact NH2-OD2 3.13Å; L535-D537 PolarHBondContact O-N 2.95Å; D537-L539 HydrophobicContact CB-CB 4.31Å; D537-L539 PolarHBondContact O-N 3.33Å; D537-L539 WeakPolarHBondContact OD1-CB 3.32Å; D537-L539 PolarHBondContact OD1-N 2.86Å; D537-L540 PolarHBondContact O-N 3.02Å
538	D	82.7	Confident	74.5	Confident	65 Å²	65	34.9 Å²	34.9	35%	0.348	22%	0.219	S	C	.	.	H	α-helix	trans	-46.9	-31	166.9	-89.9	2.1	0	0	0	111.3	L540 K541 E542 V565 R568	D538-L540 PolarHBondContact O-N 2.99Å; D538-K541 PolarHBondContact O-N 3.26Å; D538-E542 VanDerWaalsContact O-CB 3.23Å; D538-E542 WeakPolarHBondContact O-CB 3.46Å; D538-E542 PolarHBondContact O-N 2.99Å; D538-V565 HydrophobicContact CB-CG1 3.68Å; D538-V565 HydrophobicContact CB-CG2 4.18Å; D538-V565 WeakPolarHBondContact OD1-CG2 3.5Å; D538-R568 IonicContact OD2-NH2 3.82Å; D538-R568 PolarHBondContact OD2-NH2 3.23Å
539	L	86.9	Confident	74.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-46.1	172.9	176.6	66.3	0	0	0	113.7	L273 I489 D537 K541 E542 I543 I698	L273-L539 HydrophobicContact CD2-CD2 4.48Å; I489-L539 HydrophobicContact CD1-CD1 4.26Å; I489-L539 HydrophobicContact CD1-CD2 3.7Å; I489-L539 HydrophobicContact CD1-CG 4.08Å; D537-L539 HydrophobicContact CB-CB 4.31Å; D537-L539 PolarHBondContact O-N 3.33Å; D537-L539 WeakPolarHBondContact OD1-CB 3.32Å; D537-L539 PolarHBondContact OD1-N 2.86Å; L539-K541 VanDerWaalsContact C-N 3.31Å; L539-K541 PolarHBondContact O-N 2.54Å; L539-E542 WeakPolarHBondContact O-CB 3.48Å; L539-E542 PolarHBondContact O-N 3.29Å; L539-I543 HydrophobicContact CD1-CD1 4.01Å; L539-I543 HydrophobicContact CD1-CG1 3.67Å; L539-I543 HydrophobicContact CG-CG1 4.1Å; L539-I543 WeakPolarHBondContact O-CB 3.23Å; L539-I543 VanDerWaalsContact O-CG1 3.24Å; L539-I543 WeakPolarHBondContact O-CG1 3.45Å; L539-I543 PolarHBondContact O-N 3.26Å; L539-I698 HydrophobicContact CD1-CD1 3.64Å; L539-I698 HydrophobicContact CD2-CD1 4.08Å
540	L	83.8	Confident	73.8	Confident	27 Å²	27	34.2 Å²	34.2	14%	0.141	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-37.4	-176.2	-63	-174	0	0	0	111	L273 V493 Y529 L535 D537 D538 E542 A544	L273-L540 HydrophobicContact CD1-CD2 4.41Å; V493-L540 HydrophobicContact CG2-CB 4.5Å; V493-L540 HydrophobicContact CG2-CD2 3.88Å; Y529-L540 HydrophobicContact CE1-CD1 4.41Å; L535-L540 HydrophobicContact CB-CD1 4.5Å; L535-L540 WeakPolarHBondContact O-CD1 3.46Å; D537-L540 PolarHBondContact O-N 3.02Å; D538-L540 PolarHBondContact O-N 2.99Å; L540-E542 VanDerWaalsContact C-N 3.35Å; L540-A544 WeakPolarHBondContact O-CB 3.23Å; L540-A544 PolarHBondContact O-N 3.08Å
541	K	85	Confident	74.3	Confident	87 Å²	87	34.4 Å²	34.4	38%	0.378	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-46.7	171.9	-66.1	179.5	-178.5	174.5	0	110.6	D538 L539 A544 Y545 A562	D538-K541 PolarHBondContact O-N 3.26Å; L539-K541 VanDerWaalsContact C-N 3.31Å; L539-K541 PolarHBondContact O-N 2.54Å; K541-A544 WeakPolarHBondContact O-CB 3.31Å; K541-A544 PolarHBondContact O-N 2.76Å; K541-Y545 PolarHBondContact O-N 3.02Å; K541-A562 HydrophobicContact CB-CB 3.95Å; K541-A562 WeakPolarHBondContact O-CB 3.27Å
542	E	88.8	Confident	74.8	Confident	0 Å²	0	32 Å²	32	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-46.9	178.8	-165.3	-162.2	136.2	0	0	112.2	D538 L539 L540 A544 Y545 L546 V565 V566 N569 Y691 R695	D538-E542 VanDerWaalsContact O-CB 3.23Å; D538-E542 WeakPolarHBondContact O-CB 3.46Å; D538-E542 PolarHBondContact O-N 2.99Å; L539-E542 WeakPolarHBondContact O-CB 3.48Å; L539-E542 PolarHBondContact O-N 3.29Å; L540-E542 VanDerWaalsContact C-N 3.35Å; E542-A544 VanDerWaalsContact C-N 3.34Å; E542-A544 PolarHBondContact O-N 2.71Å; E542-Y545 PolarHBondContact O-N 3.26Å; E542-L546 HydrophobicContact CG-CD1 4.23Å; E542-L546 VanDerWaalsContact O-CG 3.28Å; E542-L546 WeakPolarHBondContact O-CG 3.5Å; E542-L546 PolarHBondContact O-N 3.45Å; E542-V565 HydrophobicContact CB-CG1 4.15Å; E542-V565 HydrophobicContact CG-CG1 4.48Å; E542-V566 HydrophobicContact CB-CG2 4.19Å; E542-V566 HydrophobicContact CG-CB 4.43Å; E542-V566 HydrophobicContact CG-CG2 3.48Å; E542-V566 VanDerWaalsContact CG-CG2 3.48Å; E542-N569 PolarHBondContact OE2-ND2 3.43Å; E542-Y691 VanDerWaalsContact OE1-CZ 3.26Å; E542-Y691 PolarHBondContact OE1-OH 3.44Å; E542-Y691 PolarHBondContact OE2-OH 3.31Å; E542-R695 VanDerWaalsContact CD-NE 3.32Å; E542-R695 WeakPolarHBondContact OE1-CD 3.33Å; E542-R695 WeakPolarHBondContact OE1-CG 3.4Å; E542-R695 IonicContact OE1-CZ 3.44Å; E542-R695 IonicContact OE1-NE 3.4Å; E542-R695 PolarHBondContact OE1-NE 3.34Å; E542-R695 IonicContact OE1-NH2 3.87Å; E542-R695 IonicContact OE2-CZ 3.47Å; E542-R695 IonicContact OE2-NE 3.37Å; E542-R695 PolarHBondContact OE2-NE 3.49Å; E542-R695 IonicContact OE2-NH2 2.62Å; E542-R695 PolarHBondContact OE2-NH2 3.13Å
543	I	88	Confident	75.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-38.1	177.3	-65.2	-61.3	0	0	0	111.5	I489 V493 L539 Y545 L546 N547 R695 M696	I489-I543 HydrophobicContact CD1-CD1 4.29Å; I489-I543 HydrophobicContact CD1-CG1 3.89Å; I489-I543 HydrophobicContact CG1-CG1 4.06Å; I489-I543 HydrophobicContact CG1-CG2 4.27Å; I489-I543 HydrophobicContact CG2-CD1 3.81Å; I489-I543 HydrophobicContact CG2-CG1 4.21Å; I489-I543 HydrophobicContact CG2-CG2 4.17Å; V493-I543 HydrophobicContact CG2-CB 4.35Å; V493-I543 HydrophobicContact CG2-CG2 3.97Å; L539-I543 HydrophobicContact CD1-CD1 4.01Å; L539-I543 HydrophobicContact CD1-CG1 3.67Å; L539-I543 HydrophobicContact CG-CG1 4.1Å; L539-I543 WeakPolarHBondContact O-CB 3.23Å; L539-I543 VanDerWaalsContact O-CG1 3.24Å; L539-I543 WeakPolarHBondContact O-CG1 3.45Å; L539-I543 PolarHBondContact O-N 3.26Å; I543-Y545 VanDerWaalsContact C-N 3.32Å; I543-L546 PolarHBondContact O-N 3.39Å; I543-N547 PolarHBondContact O-N 3.2Å; I543-R695 HydrophobicContact CD1-CB 4.18Å; I543-R695 WeakPolarHBondContact CD1-O 3.39Å; I543-M696 HydrophobicContact CD1-SD 3.79Å; I543-M696 HydrophobicContact CG2-SD 4.04Å
544	A	83.7	Confident	76.3	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-43.4	173	0	0	0	0	0	110.9	V493 L540 K541 E542 N547 F550 M554	V493-A544 HydrophobicContact CG1-CB 4.21Å; L540-A544 WeakPolarHBondContact O-CB 3.23Å; L540-A544 PolarHBondContact O-N 3.08Å; K541-A544 WeakPolarHBondContact O-CB 3.31Å; K541-A544 PolarHBondContact O-N 2.76Å; E542-A544 VanDerWaalsContact C-N 3.34Å; E542-A544 PolarHBondContact O-N 2.71Å; A544-N547 PolarHBondContact O-N 3.45Å; A544-N547 VanDerWaalsContact O-O 3.08Å; A544-F550 HydrophobicContact CB-CG 4.48Å; A544-F550 WeakPolarHBondContact O-CB 3.4Å; A544-F550 WeakPolarHBondContact O-CD2 3.4Å; A544-M554 HydrophobicContact CB-CE 3.9Å; A544-M554 HydrophobicContact CB-SD 4.06Å
545	Y	88	Confident	77.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.3	-39.9	176.2	-179.2	-84.8	0	0	0	112.8	K541 E542 I543 N547 H551 F559 A562 R563 V566 L664 Y667 E668	K541-Y545 PolarHBondContact O-N 3.02Å; E542-Y545 PolarHBondContact O-N 3.26Å; I543-Y545 VanDerWaalsContact C-N 3.32Å; Y545-N547 PolarHBondContact O-N 3.19Å; Y545-H551 PolarHBondContact O-NE2 2.85Å; Y545-F559 HydrophobicContact CD2-CD2 4.35Å; Y545-F559 HydrophobicContact CD2-CE2 4Å; Y545-F559 HydrophobicContact CD2-CZ 4.2Å; Y545-F559 HydrophobicContact CE2-CE1 4.07Å; Y545-F559 AromaticContact CE2-CE2 3.87Å; Y545-F559 HydrophobicContact CE2-CE2 3.87Å; Y545-F559 AromaticContact CE2-CZ 3.61Å; Y545-F559 HydrophobicContact CE2-CZ 3.61Å; Y545-A562 HydrophobicContact CD2-CB 4.38Å; Y545-A562 HydrophobicContact CG-CB 4.48Å; Y545-R563 HydrophobicContact CD2-CB 4.05Å; Y545-R563 HydrophobicContact CE2-CB 3.54Å; Y545-R563 HydrophobicContact CE2-CG 3.88Å; Y545-V566 HydrophobicContact CD1-CB 4.09Å; Y545-V566 HydrophobicContact CD1-CG1 4.15Å; Y545-V566 HydrophobicContact CD1-CG2 3.5Å; Y545-V566 VanDerWaalsContact CD1-CG2 3.5Å; Y545-V566 HydrophobicContact CE1-CB 4.33Å; Y545-V566 HydrophobicContact CE1-CG1 4.18Å; Y545-V566 HydrophobicContact CE1-CG2 4.22Å; Y545-V566 HydrophobicContact CG-CG2 3.86Å; Y545-L664 HydrophobicContact CE1-CD2 3.66Å; Y545-Y667 HydrophobicContact CD1-CD1 4.47Å; Y545-Y667 AromaticContact CD1-CE1 3.92Å; Y545-Y667 HydrophobicContact CD1-CE1 3.92Å; Y545-Y667 AromaticContact CE1-CD1 3.55Å; Y545-Y667 HydrophobicContact CE1-CD1 3.55Å; Y545-Y667 AromaticContact CE1-CE1 3.41Å; Y545-Y667 HydrophobicContact CE1-CE1 3.41Å; Y545-Y667 VanDerWaalsContact CE1-CE1 3.41Å; Y545-Y667 AromaticContact CZ-CD1 3.88Å; Y545-Y667 AromaticContact CZ-CE1 3.89Å; Y545-Y667 PolarHBondContact O-OH 3.26Å; Y545-E668 WeakPolarHBondContact OH-CG 3.34Å; Y545-E668 PolarHBondContact OH-OE1 2.85Å
546	L	86.6	Confident	79	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-70.8	-16.5	-178.3	-70.1	173.9	0	0	0	113.4	E542 I543 V566 W619 Y667 F688 Y691 A692 R695 M696	E542-L546 HydrophobicContact CG-CD1 4.23Å; E542-L546 VanDerWaalsContact O-CG 3.28Å; E542-L546 WeakPolarHBondContact O-CG 3.5Å; E542-L546 PolarHBondContact O-N 3.45Å; I543-L546 PolarHBondContact O-N 3.39Å; L546-V566 HydrophobicContact CD2-CG1 4.21Å; L546-W619 WeakPolarHBondContact O-CH2 3.13Å; L546-W619 WeakPolarHBondContact O-CZ3 3.34Å; L546-Y667 VanDerWaalsContact C-OH 3.24Å; L546-Y667 PolarHBondContact O-OH 3.29Å; L546-Y667 VanDerWaalsContact O-OH 3.04Å; L546-F688 HydrophobicContact CD2-CE2 3.78Å; L546-F688 HydrophobicContact CD2-CZ 3.75Å; L546-Y691 HydrophobicContact CD1-CE1 4.26Å; L546-Y691 HydrophobicContact CD2-CE1 4.49Å; L546-A692 HydrophobicContact CD1-CB 4.42Å; L546-A692 HydrophobicContact CD2-CB 3.91Å; L546-R695 HydrophobicContact CD1-CB 3.83Å; L546-R695 HydrophobicContact CD1-CG 4.47Å; L546-M696 HydrophobicContact CB-SD 4.3Å
547	N	78.1	Confident	80.5	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	23%	0.227	C	C	.	.	S	Bend	trans	-103.3	107.1	174.7	174	5.3	0	0	0	110.3	I543 A544 Y545 S549 F550 M696	I543-N547 PolarHBondContact O-N 3.2Å; A544-N547 PolarHBondContact O-N 3.45Å; A544-N547 VanDerWaalsContact O-O 3.08Å; Y545-N547 PolarHBondContact O-N 3.19Å; N547-S549 PolarHBondContact O-N 3Å; N547-S549 VanDerWaalsContact OD1-CB 3.3Å; N547-S549 WeakPolarHBondContact OD1-CB 3.42Å; N547-S549 PolarHBondContact OD1-N 3.1Å; N547-S549 PolarHBondContact OD1-OG 3.47Å; N547-F550 HydrophobicContact CB-CD2 3.51Å; N547-F550 HydrophobicContact CB-CE2 3.68Å; N547-F550 WeakPolarHBondContact ND2-CE2 3.5Å; N547-F550 WeakPolarHBondContact O-CD2 3.47Å; N547-F550 PolarHBondContact O-N 3.02Å; N547-M696 HydrophobicContact CB-CE 4.43Å
548	P	76.1	Confident	81.4	Confident	11 Å²	11	42.9 Å²	42.9	7%	0.071	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56.8	-29.7	-174.1	-27	36.9	0	0	0	113.2	F550 H551 W619 Y667 A671 L674	P548-F550 PolarHBondContact O-N 3.41Å; P548-H551 WeakPolarHBondContact O-CB 3.41Å; P548-H551 PolarHBondContact O-N 3.29Å; P548-W619 HydrophobicContact CG-CE3 3.62Å; P548-W619 HydrophobicContact CG-CZ3 3.31Å; P548-Y667 HydrophobicContact CG-CE2 4.32Å; P548-Y667 WeakPolarHBondContact CG-OH 3.41Å; P548-A671 HydrophobicContact CB-CB 3.98Å; P548-A671 HydrophobicContact CG-CB 4.09Å; P548-L674 HydrophobicContact CG-CD1 4.31Å
549	S	68.9	Low	81.6	Confident	39 Å²	39	41.6 Å²	41.6	27%	0.273	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-59.2	-15.6	179.5	-38.3	0	0	0	0	112.9	N547 H553	N547-S549 PolarHBondContact O-N 3Å; N547-S549 VanDerWaalsContact OD1-CB 3.3Å; N547-S549 WeakPolarHBondContact OD1-CB 3.42Å; N547-S549 PolarHBondContact OD1-N 3.1Å; N547-S549 PolarHBondContact OD1-OG 3.47Å; S549-H553 PolarHBondContact O-CD2 3.2Å
550	F	70	Confident	81.8	Confident	2 Å²	2	45 Å²	45	1%	0.009	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-94.7	-16.5	175	-66.9	-77.1	0	0	0	114.7	G490 V493 M494 A544 N547 P548 G552 H553 M554	G490-F550 WeakPolarHBondContact O-CZ 3.14Å; V493-F550 HydrophobicContact CB-CE1 4.36Å; V493-F550 HydrophobicContact CB-CE2 4.46Å; V493-F550 HydrophobicContact CB-CZ 3.74Å; V493-F550 HydrophobicContact CG1-CE1 3.84Å; V493-F550 HydrophobicContact CG1-CE2 4.38Å; V493-F550 HydrophobicContact CG1-CZ 3.64Å; M494-F550 HydrophobicContact CB-CE1 4Å; M494-F550 HydrophobicContact CB-CZ 3.91Å; M494-F550 HydrophobicContact CG-CD1 4.31Å; M494-F550 HydrophobicContact CG-CE1 3.3Å; M494-F550 HydrophobicContact CG-CE2 3.79Å; M494-F550 HydrophobicContact CG-CZ 2.99Å; M494-F550 HydrophobicContact SD-CZ 4.34Å; A544-F550 HydrophobicContact CB-CG 4.48Å; A544-F550 WeakPolarHBondContact O-CB 3.4Å; A544-F550 WeakPolarHBondContact O-CD2 3.4Å; N547-F550 HydrophobicContact CB-CD2 3.51Å; N547-F550 HydrophobicContact CB-CE2 3.68Å; N547-F550 WeakPolarHBondContact ND2-CE2 3.5Å; N547-F550 WeakPolarHBondContact O-CD2 3.47Å; N547-F550 PolarHBondContact O-N 3.02Å; P548-F550 PolarHBondContact O-N 3.41Å; F550-G552 PolarHBondContact O-N 3.13Å; F550-H553 WeakPolarHBondContact O-CA 3.38Å; F550-H553 WeakPolarHBondContact O-CB 3.4Å; F550-H553 PolarHBondContact O-N 3.31Å; F550-M554 WeakPolarHBondContact O-CG 3.33Å; F550-M554 PolarHBondContact O-N 2.83Å; F550-M554 VanDerWaalsContact O-N 3.12Å
551	H	79.2	Confident	82.1	Confident	22 Å²	22	45.8 Å²	45.8	10%	0.102	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-56.4	-43.5	-173.4	-68	-175	0	0	0	110.8	Y545 P548 H553 M554 F559 Y667	Y545-H551 PolarHBondContact O-NE2 2.85Å; P548-H551 WeakPolarHBondContact O-CB 3.41Å; P548-H551 PolarHBondContact O-N 3.29Å; H551-H553 PolarHBondContact O-N 3Å; H551-M554 PolarHBondContact O-N 2.91Å; H551-F559 HydrophobicContact CB-CD2 4.47Å; H551-F559 HydrophobicContact CB-CE2 4.13Å; H551-F559 AromaticContact CD2-CE2 3.79Å; H551-F559 AromaticContact CE1-CE2 4Å; H551-F559 AromaticContact CG-CE2 3.67Å; H551-F559 AromaticContact ND1-CE2 3.83Å; H551-F559 AromaticContact NE2-CE2 3.98Å; H551-Y667 AromaticContact CE1-CE1 3.6Å; H551-Y667 AromaticContact CE1-CZ 3.82Å; H551-Y667 AromaticContact NE2-CE1 3.87Å; H551-Y667 PolarHBondContact NE2-OH 2.69Å
552	G	72.4	Confident	82.3	Confident	66 Å²	66	41.6 Å²	41.6	68%	0.68	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-69.4	-10.7	175	0	0	0	0	0	115.9	F550	F550-G552 PolarHBondContact O-N 3.13Å
553	H	71.4	Confident	82.5	Confident	126 Å²	126	43.9 Å²	43.9	58%	0.583	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-101.2	-14.2	177.5	-66.6	-48.8	0	0	0	113.5	S549 F550 H551	S549-H553 PolarHBondContact O-CD2 3.2Å; F550-H553 WeakPolarHBondContact O-CA 3.38Å; F550-H553 WeakPolarHBondContact O-CB 3.4Å; F550-H553 PolarHBondContact O-N 3.31Å; H551-H553 PolarHBondContact O-N 3Å
554	M	76.9	Confident	82.7	Confident	31 Å²	31	47.7 Å²	47.7	15%	0.153	27%	0.265	C	S	.	.	S	Bend	trans	-83.9	141.8	178.9	-65.4	176.8	91.6	0	0	110.5	A544 F550 H551 D558 F559 A562	A544-M554 HydrophobicContact CB-CE 3.9Å; A544-M554 HydrophobicContact CB-SD 4.06Å; F550-M554 WeakPolarHBondContact O-CG 3.33Å; F550-M554 PolarHBondContact O-N 2.83Å; F550-M554 VanDerWaalsContact O-N 3.12Å; H551-M554 PolarHBondContact O-N 2.91Å; M554-D558 HydrophobicContact CB-CB 4.33Å; M554-D558 HydrophobicContact CE-CB 4.24Å; M554-F559 HydrophobicContact CB-CB 4.25Å; M554-F559 HydrophobicContact SD-CD2 4.46Å; M554-A562 HydrophobicContact CE-CB 3.64Å
555	S	83.7	Confident	83.1	Confident	56 Å²	56	47.6 Å²	47.6	39%	0.392	27%	0.265	S	S	.	.			trans	-65.5	156.1	164.9	79.2	0	0	0	0	109.4	A557 D558 F559	S555-A557 PolarHBondContact O-N 3.14Å; S555-A557 VanDerWaalsContact O-N 3.17Å; S555-D558 WeakPolarHBondContact CB-OD2 3.39Å; S555-D558 PolarHBondContact O-N 3.02Å; S555-D558 VanDerWaalsContact O-N 3.07Å; S555-D558 PolarHBondContact OG-N 3.49Å; S555-D558 VanDerWaalsContact OG-N 3.14Å; S555-D558 PolarHBondContact OG-OD2 3.4Å; S555-F559 WeakPolarHBondContact O-CB 3.31Å; S555-F559 PolarHBondContact O-N 3.12Å
556	R	87.2	Confident	83.3	Confident	205 Å²	205	47.6 Å²	47.6	77%	0.774	27%	0.265	S	S	*	.	H	α-helix	trans	-55.7	-35.6	176.8	-175.9	175.8	176.4	87.5	0.6	112.2	L560	R556-L560 HydrophobicContact CG-CD1 4.24Å; R556-L560 VanDerWaalsContact O-CG 3.3Å; R556-L560 WeakPolarHBondContact O-CG 3.06Å; R556-L560 PolarHBondContact O-N 3.42Å; R556-L560 VanDerWaalsContact O-N 3.11Å
557	A	86.9	Confident	83.7	Confident	70 Å²	70	49.2 Å²	49.2	58%	0.579	27%	0.272	S	S	*	.	H	α-helix	trans	-67.5	-44.7	177.1	0	0	0	0	0	111.7	S555 L560 S561	S555-A557 PolarHBondContact O-N 3.14Å; S555-A557 VanDerWaalsContact O-N 3.17Å; A557-L560 PolarHBondContact O-N 3.39Å; A557-S561 WeakPolarHBondContact O-CB 3.34Å; A557-S561 PolarHBondContact O-N 2.9Å
558	D	84.7	Confident	84.3	Confident	84 Å²	84	55.2 Å²	55.2	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-65.6	-41.5	177.9	-61.5	-42.1	0	0	0	111.6	M554 S555 S561 A562	M554-D558 HydrophobicContact CB-CB 4.33Å; M554-D558 HydrophobicContact CE-CB 4.24Å; S555-D558 WeakPolarHBondContact CB-OD2 3.39Å; S555-D558 PolarHBondContact O-N 3.02Å; S555-D558 VanDerWaalsContact O-N 3.07Å; S555-D558 PolarHBondContact OG-N 3.49Å; S555-D558 VanDerWaalsContact OG-N 3.14Å; S555-D558 PolarHBondContact OG-OD2 3.4Å; D558-S561 PolarHBondContact O-N 3.28Å; D558-A562 VanDerWaalsContact O-CB 3.31Å; D558-A562 WeakPolarHBondContact O-CB 3.44Å; D558-A562 PolarHBondContact O-N 3.22Å
559	F	88	Confident	85.1	Confident	38 Å²	38	57.1 Å²	57.1	17%	0.167	30%	0.304	C	S	.	.	H	α-helix	trans	-59.4	-50.2	176.8	-177.4	-89.4	0	0	0	111.3	Y545 H551 M554 S555 S561 A562 R563 E668	Y545-F559 HydrophobicContact CD2-CD2 4.35Å; Y545-F559 HydrophobicContact CD2-CE2 4Å; Y545-F559 HydrophobicContact CD2-CZ 4.2Å; Y545-F559 HydrophobicContact CE2-CE1 4.07Å; Y545-F559 AromaticContact CE2-CE2 3.87Å; Y545-F559 HydrophobicContact CE2-CE2 3.87Å; Y545-F559 AromaticContact CE2-CZ 3.61Å; Y545-F559 HydrophobicContact CE2-CZ 3.61Å; H551-F559 HydrophobicContact CB-CD2 4.47Å; H551-F559 HydrophobicContact CB-CE2 4.13Å; H551-F559 AromaticContact CD2-CE2 3.79Å; H551-F559 AromaticContact CE1-CE2 4Å; H551-F559 AromaticContact CG-CE2 3.67Å; H551-F559 AromaticContact ND1-CE2 3.83Å; H551-F559 AromaticContact NE2-CE2 3.98Å; M554-F559 HydrophobicContact CB-CB 4.25Å; M554-F559 HydrophobicContact SD-CD2 4.46Å; S555-F559 WeakPolarHBondContact O-CB 3.31Å; S555-F559 PolarHBondContact O-N 3.12Å; F559-S561 PolarHBondContact O-N 3.43Å; F559-A562 PolarHBondContact O-N 2.89Å; F559-R563 WeakPolarHBondContact O-CB 3.32Å; F559-R563 PolarHBondContact O-N 3.31Å; F559-E668 HydrophobicContact CZ-CG 4.19Å
560	L	91.1	Very high	86.2	Confident	73 Å²	73	55.2 Å²	55.2	38%	0.382	29%	0.291	S	S	.	.	H	α-helix	trans	-64.3	-40	177.8	-70.7	173.1	0	0	0	112	R556 A557 A562 R563 N564	R556-L560 HydrophobicContact CG-CD1 4.24Å; R556-L560 VanDerWaalsContact O-CG 3.3Å; R556-L560 WeakPolarHBondContact O-CG 3.06Å; R556-L560 PolarHBondContact O-N 3.42Å; R556-L560 VanDerWaalsContact O-N 3.11Å; A557-L560 PolarHBondContact O-N 3.39Å; L560-A562 VanDerWaalsContact C-N 3.31Å; L560-A562 PolarHBondContact O-N 3.44Å; L560-R563 PolarHBondContact O-N 2.76Å; L560-N564 WeakPolarHBondContact O-CB 3.48Å; L560-N564 PolarHBondContact O-N 2.95Å; L560-N564 PolarHBondContact O-ND2 3.25Å
561	S	89.5	Confident	87.2	Confident	42 Å²	42	55.1 Å²	55.1	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-43.7	174.2	179.7	0	0	0	0	111.1	A557 D558 F559 N564 V565	A557-S561 WeakPolarHBondContact O-CB 3.34Å; A557-S561 PolarHBondContact O-N 2.9Å; D558-S561 PolarHBondContact O-N 3.28Å; F559-S561 PolarHBondContact O-N 3.43Å; S561-N564 PolarHBondContact O-N 3.19Å; S561-V565 WeakPolarHBondContact O-CG2 3.43Å; S561-V565 PolarHBondContact O-N 3.43Å
562	A	89.6	Confident	87.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-70.6	-41.3	-179.4	0	0	0	0	0	112.2	K541 Y545 M554 D558 F559 L560 N564 V565 V566	K541-A562 HydrophobicContact CB-CB 3.95Å; K541-A562 WeakPolarHBondContact O-CB 3.27Å; Y545-A562 HydrophobicContact CD2-CB 4.38Å; Y545-A562 HydrophobicContact CG-CB 4.48Å; M554-A562 HydrophobicContact CE-CB 3.64Å; D558-A562 VanDerWaalsContact O-CB 3.31Å; D558-A562 WeakPolarHBondContact O-CB 3.44Å; D558-A562 PolarHBondContact O-N 3.22Å; F559-A562 PolarHBondContact O-N 2.89Å; L560-A562 VanDerWaalsContact C-N 3.31Å; L560-A562 PolarHBondContact O-N 3.44Å; A562-N564 VanDerWaalsContact C-N 3.3Å; A562-N564 PolarHBondContact O-N 3.31Å; A562-V565 WeakPolarHBondContact O-CB 3.3Å; A562-V565 PolarHBondContact O-N 3.02Å; A562-V565 VanDerWaalsContact O-N 3.16Å; A562-V566 VanDerWaalsContact O-CG2 3.23Å; A562-V566 WeakPolarHBondContact O-CG2 3.4Å; A562-V566 PolarHBondContact O-N 3.48Å
563	R	93	Very high	88.5	Confident	47 Å²	47	53 Å²	53	18%	0.177	27%	0.268	C	S	.	.	H	α-helix	trans	-54.7	-45.8	171.9	-174.9	-177.4	-179.7	-90.9	2.2	111.5	Y545 F559 L560 V565 V566 H567 L664 D665 E668	Y545-R563 HydrophobicContact CD2-CB 4.05Å; Y545-R563 HydrophobicContact CE2-CB 3.54Å; Y545-R563 HydrophobicContact CE2-CG 3.88Å; F559-R563 WeakPolarHBondContact O-CB 3.32Å; F559-R563 PolarHBondContact O-N 3.31Å; L560-R563 PolarHBondContact O-N 2.76Å; R563-V565 VanDerWaalsContact C-N 3.33Å; R563-V565 PolarHBondContact O-N 3.38Å; R563-V566 PolarHBondContact O-N 2.95Å; R563-H567 WeakPolarHBondContact O-CB 3.3Å; R563-H567 PolarHBondContact O-N 3.44Å; R563-L664 HydrophobicContact CG-CD1 4.47Å; R563-D665 IonicContact CZ-OD1 3.99Å; R563-D665 IonicContact NH2-OD1 2.69Å; R563-D665 PolarHBondContact NH2-OD1 2.88Å; R563-E668 WeakPolarHBondContact CD-OE1 3.47Å; R563-E668 IonicContact CZ-OE1 2.71Å; R563-E668 IonicContact NE-OE1 3.45Å; R563-E668 PolarHBondContact NE-OE1 2.92Å
564	N	92.5	Very high	89.3	Confident	81 Å²	81	47.1 Å²	47.1	43%	0.433	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-38.2	179	-70.8	-17.6	0	0	0	112.4	L560 S561 A562 R568	L560-N564 WeakPolarHBondContact O-CB 3.48Å; L560-N564 PolarHBondContact O-N 2.95Å; L560-N564 PolarHBondContact O-ND2 3.25Å; S561-N564 PolarHBondContact O-N 3.19Å; A562-N564 VanDerWaalsContact C-N 3.3Å; A562-N564 PolarHBondContact O-N 3.31Å; N564-R568 WeakPolarHBondContact O-CG 3.35Å; N564-R568 PolarHBondContact O-N 2.85Å
565	V	92	Very high	89.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-62.6	-48.6	173.8	172.1	0	0	0	0	110.4	D538 E542 S561 A562 R563 H567 R568 N569	D538-V565 HydrophobicContact CB-CG1 3.68Å; D538-V565 HydrophobicContact CB-CG2 4.18Å; D538-V565 WeakPolarHBondContact OD1-CG2 3.5Å; E542-V565 HydrophobicContact CB-CG1 4.15Å; E542-V565 HydrophobicContact CG-CG1 4.48Å; S561-V565 WeakPolarHBondContact O-CG2 3.43Å; S561-V565 PolarHBondContact O-N 3.43Å; A562-V565 WeakPolarHBondContact O-CB 3.3Å; A562-V565 PolarHBondContact O-N 3.02Å; A562-V565 VanDerWaalsContact O-N 3.16Å; R563-V565 VanDerWaalsContact C-N 3.33Å; R563-V565 PolarHBondContact O-N 3.38Å; V565-H567 PolarHBondContact O-N 3.36Å; V565-R568 PolarHBondContact O-N 2.72Å; V565-N569 WeakPolarHBondContact O-CB 3.3Å; V565-N569 VanDerWaalsContact O-CG 3.31Å; V565-N569 PolarHBondContact O-N 3.2Å
566	V	92	Very high	89.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-42.6	-179.5	-179.9	0	0	0	0	110.7	E542 Y545 L546 A562 R563 N569 L570 L664 Y691	E542-V566 HydrophobicContact CB-CG2 4.19Å; E542-V566 HydrophobicContact CG-CB 4.43Å; E542-V566 HydrophobicContact CG-CG2 3.48Å; E542-V566 VanDerWaalsContact CG-CG2 3.48Å; Y545-V566 HydrophobicContact CD1-CB 4.09Å; Y545-V566 HydrophobicContact CD1-CG1 4.15Å; Y545-V566 HydrophobicContact CD1-CG2 3.5Å; Y545-V566 VanDerWaalsContact CD1-CG2 3.5Å; Y545-V566 HydrophobicContact CE1-CB 4.33Å; Y545-V566 HydrophobicContact CE1-CG1 4.18Å; Y545-V566 HydrophobicContact CE1-CG2 4.22Å; Y545-V566 HydrophobicContact CG-CG2 3.86Å; L546-V566 HydrophobicContact CD2-CG1 4.21Å; A562-V566 VanDerWaalsContact O-CG2 3.23Å; A562-V566 WeakPolarHBondContact O-CG2 3.4Å; A562-V566 PolarHBondContact O-N 3.48Å; R563-V566 PolarHBondContact O-N 2.95Å; V566-N569 PolarHBondContact O-N 3.25Å; V566-L570 WeakPolarHBondContact O-CB 3.47Å; V566-L570 PolarHBondContact O-N 3.47Å; V566-L664 HydrophobicContact CB-CD2 4.4Å; V566-L664 HydrophobicContact CG1-CD1 4.39Å; V566-L664 HydrophobicContact CG1-CD2 3.57Å; V566-Y691 HydrophobicContact CG1-CE1 4.05Å
567	H	93.8	Very high	89.3	Confident	36 Å²	36	44.5 Å²	44.5	17%	0.167	23%	0.229	C	C	.	.	H	α-helix	trans	-57.5	-51.5	177.6	178.3	-87.2	0	0	0	111.6	R563 V565 N569 L570 A571 E657 L664	R563-H567 WeakPolarHBondContact O-CB 3.3Å; R563-H567 PolarHBondContact O-N 3.44Å; V565-H567 PolarHBondContact O-N 3.36Å; H567-N569 PolarHBondContact O-N 2.63Å; H567-L570 PolarHBondContact O-N 3.19Å; H567-A571 WeakPolarHBondContact O-CB 3.34Å; H567-A571 PolarHBondContact O-N 3.37Å; H567-E657 PolarHBondContact NE2-O 3.19Å; H567-L664 HydrophobicContact CB-CD1 3.61Å
568	R	92.5	Very high	88.2	Confident	129 Å²	129	46.9 Å²	46.9	49%	0.487	23%	0.232	S	C	.	.	H	α-helix	trans	-58.9	-46.9	178.1	-70.4	-171	-52.8	-117	6.8	112.2	D538 N564 V565 A572	D538-R568 IonicContact OD2-NH2 3.82Å; D538-R568 PolarHBondContact OD2-NH2 3.23Å; N564-R568 WeakPolarHBondContact O-CG 3.35Å; N564-R568 PolarHBondContact O-N 2.85Å; V565-R568 PolarHBondContact O-N 2.72Å; R568-A572 WeakPolarHBondContact O-CB 3.14Å; R568-A572 PolarHBondContact O-N 2.88Å
569	N	91.7	Very high	86.9	Confident	51 Å²	51	45.1 Å²	45.1	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-72.2	-37.3	-176.1	-70.1	-11.4	0	0	0	112	E542 V565 V566 H567 A572 F573 Y691	E542-N569 PolarHBondContact OE2-ND2 3.43Å; V565-N569 WeakPolarHBondContact O-CB 3.3Å; V565-N569 VanDerWaalsContact O-CG 3.31Å; V565-N569 PolarHBondContact O-N 3.2Å; V566-N569 PolarHBondContact O-N 3.25Å; H567-N569 PolarHBondContact O-N 2.63Å; N569-A572 PolarHBondContact O-N 2.86Å; N569-F573 WeakPolarHBondContact O-CB 3.48Å; N569-F573 PolarHBondContact O-N 3.13Å; N569-Y691 HydrophobicContact CB-CE2 3.92Å; N569-Y691 WeakPolarHBondContact CB-OH 3.46Å
570	L	91.6	Very high	84.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-51.7	173.4	178.8	61	0	0	0	109.9	V566 H567 A572 F573 I574 A660 L664 F688 Y691	V566-L570 WeakPolarHBondContact O-CB 3.47Å; V566-L570 PolarHBondContact O-N 3.47Å; H567-L570 PolarHBondContact O-N 3.19Å; L570-A572 PolarHBondContact O-N 3.18Å; L570-F573 CarbonylContact O-C 3.55Å; L570-F573 WeakPolarHBondContact O-CA 3.3Å; L570-F573 WeakPolarHBondContact O-CB 3.37Å; L570-F573 PolarHBondContact O-N 3.02Å; L570-I574 HydrophobicContact CD1-CD1 4.47Å; L570-I574 HydrophobicContact CD1-CG1 4.34Å; L570-I574 HydrophobicContact CG-CD1 4.22Å; L570-I574 HydrophobicContact CG-CG1 4.44Å; L570-I574 VanDerWaalsContact O-CG1 3.31Å; L570-I574 WeakPolarHBondContact O-CG1 3.22Å; L570-I574 PolarHBondContact O-N 3.26Å; L570-A660 HydrophobicContact CB-CB 4.21Å; L570-A660 HydrophobicContact CD2-CB 3.87Å; L570-A660 HydrophobicContact CG-CB 3.91Å; L570-L664 HydrophobicContact CD2-CD2 4.41Å; L570-L664 HydrophobicContact CD2-CG 4.21Å; L570-F688 HydrophobicContact CD1-CB 4.48Å; L570-F688 HydrophobicContact CD1-CD2 4.49Å; L570-F688 HydrophobicContact CD2-CB 4.49Å; L570-F688 HydrophobicContact CD2-CD2 3.87Å; L570-Y691 HydrophobicContact CD1-CD1 4.13Å; L570-Y691 HydrophobicContact CD1-CD2 4.24Å; L570-Y691 HydrophobicContact CD1-CG 3.74Å
571	A	92.4	Very high	82.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.3	-40.9	176.7	0	0	0	0	0	111.9	H567 I574 R575 E657 A660	H567-A571 WeakPolarHBondContact O-CB 3.34Å; H567-A571 PolarHBondContact O-N 3.37Å; A571-I574 PolarHBondContact O-N 3.47Å; A571-R575 WeakPolarHBondContact O-CG 3.06Å; A571-R575 PolarHBondContact O-N 2.86Å; A571-R575 VanDerWaalsContact O-N 3.13Å; A571-R575 PolarHBondContact O-NE 3.4Å; A571-E657 HydrophobicContact CB-CG 4.05Å; A571-A660 HydrophobicContact CB-CB 3.96Å
572	A	89.6	Confident	79.9	Confident	35 Å²	35	57.3 Å²	57.3	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-38.6	173.1	0	0	0	0	0	113.3	R568 N569 L570 R575 Q576	R568-A572 WeakPolarHBondContact O-CB 3.14Å; R568-A572 PolarHBondContact O-N 2.88Å; N569-A572 PolarHBondContact O-N 2.86Å; L570-A572 PolarHBondContact O-N 3.18Å; A572-R575 PolarHBondContact O-N 3.15Å; A572-Q576 WeakPolarHBondContact O-CG 3.44Å; A572-Q576 PolarHBondContact O-N 3.12Å
573	F	88.7	Confident	77.1	Confident	7 Å²	7	61.2 Å²	61.2	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-67.5	-41.1	176.1	179	-107.5	0	0	0	112.7	V183 N569 L570 R575 Q576 I577 P687 Q690 Y691 L694	V183-F573 HydrophobicContact CG1-CE2 4.31Å; N569-F573 WeakPolarHBondContact O-CB 3.48Å; N569-F573 PolarHBondContact O-N 3.13Å; L570-F573 CarbonylContact O-C 3.55Å; L570-F573 WeakPolarHBondContact O-CA 3.3Å; L570-F573 WeakPolarHBondContact O-CB 3.37Å; L570-F573 PolarHBondContact O-N 3.02Å; F573-R575 VanDerWaalsContact C-N 3.33Å; F573-R575 PolarHBondContact O-N 3.2Å; F573-Q576 WeakPolarHBondContact O-CB 3.49Å; F573-Q576 PolarHBondContact O-N 3.36Å; F573-Q576 VanDerWaalsContact O-N 3.09Å; F573-I577 HydrophobicContact CD1-CD1 3.69Å; F573-I577 HydrophobicContact CD2-CD1 4.41Å; F573-I577 HydrophobicContact CE1-CD1 3.15Å; F573-I577 HydrophobicContact CE1-CG1 4.29Å; F573-I577 HydrophobicContact CE2-CD1 3.94Å; F573-I577 HydrophobicContact CE2-CG1 4.35Å; F573-I577 HydrophobicContact CG-CD1 4.32Å; F573-I577 HydrophobicContact CZ-CD1 3.31Å; F573-I577 HydrophobicContact CZ-CG1 4.17Å; F573-I577 PolarHBondContact O-N 2.98Å; F573-I577 VanDerWaalsContact O-N 3.08Å; F573-P687 HydrophobicContact CD1-CB 4.29Å; F573-P687 HydrophobicContact CE1-CB 4.21Å; F573-Q690 HydrophobicContact CE1-CB 3.99Å; F573-Q690 HydrophobicContact CZ-CB 3.99Å; F573-Y691 HydrophobicContact CB-CD2 3.67Å; F573-Y691 HydrophobicContact CB-CE2 4.25Å; F573-Y691 AromaticContact CD1-CD2 3.98Å; F573-Y691 HydrophobicContact CD1-CD2 3.98Å; F573-Y691 HydrophobicContact CD1-CG 4.31Å; F573-Y691 HydrophobicContact CD2-CD2 4.4Å; F573-Y691 AromaticContact CG-CD2 3.79Å; F573-Y691 HydrophobicContact CG-CD2 3.79Å; F573-L694 HydrophobicContact CE2-CD1 3.54Å; F573-L694 HydrophobicContact CZ-CD1 3.71Å
574	I	88.9	Confident	74.3	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-57.2	-48.9	174.4	-59.4	-175	0	0	0	109.8	L570 A571 Q576 I577 D578 A656 M659 A660 P687	L570-I574 HydrophobicContact CD1-CD1 4.47Å; L570-I574 HydrophobicContact CD1-CG1 4.34Å; L570-I574 HydrophobicContact CG-CD1 4.22Å; L570-I574 HydrophobicContact CG-CG1 4.44Å; L570-I574 VanDerWaalsContact O-CG1 3.31Å; L570-I574 WeakPolarHBondContact O-CG1 3.22Å; L570-I574 PolarHBondContact O-N 3.26Å; A571-I574 PolarHBondContact O-N 3.47Å; I574-Q576 PolarHBondContact O-N 2.95Å; I574-I577 PolarHBondContact O-N 3.19Å; I574-I577 VanDerWaalsContact O-N 3.14Å; I574-D578 PolarHBondContact O-N 3Å; I574-D578 VanDerWaalsContact O-N 3.08Å; I574-A656 HydrophobicContact CB-CB 4.27Å; I574-A656 HydrophobicContact CG2-CB 4.1Å; I574-M659 HydrophobicContact CD1-CB 4.06Å; I574-M659 HydrophobicContact CD1-CG 3.88Å; I574-M659 HydrophobicContact CD1-SD 4Å; I574-M659 HydrophobicContact CG2-SD 4.19Å; I574-A660 HydrophobicContact CD1-CB 4.24Å; I574-P687 HydrophobicContact CB-CG 4.44Å; I574-P687 HydrophobicContact CD1-CG 3.6Å; I574-P687 HydrophobicContact CG1-CB 4.11Å; I574-P687 HydrophobicContact CG1-CG 3.42Å; I574-P687 VanDerWaalsContact CG1-CG 3.42Å; I574-P687 HydrophobicContact CG2-CG 4.5Å
575	R	87.1	Confident	71.4	Confident	88 Å²	88	68.6 Å²	68.6	33%	0.332	36%	0.358	S	S	.	.	H	α-helix	trans	-56.5	-34	176	-71.4	-177.6	-79	-119.6	4.8	113.2	A571 A572 F573 S579 A656 E657	A571-R575 WeakPolarHBondContact O-CG 3.06Å; A571-R575 PolarHBondContact O-N 2.86Å; A571-R575 VanDerWaalsContact O-N 3.13Å; A571-R575 PolarHBondContact O-NE 3.4Å; A572-R575 PolarHBondContact O-N 3.15Å; F573-R575 VanDerWaalsContact C-N 3.33Å; F573-R575 PolarHBondContact O-N 3.2Å; R575-S579 PolarHBondContact O-N 3.47Å; R575-A656 HydrophobicContact CG-CB 3.75Å; R575-E657 IonicContact NH1-OE1 3.53Å; R575-E657 PolarHBondContact NH1-OE1 2.84Å
576	Q	81.4	Confident	68.3	Low	92 Å²	92	72.7 Å²	72.7	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-75.8	-35.7	178.9	-73.8	177.9	-0.7	0	0	113.3	A572 F573 I574 N582	A572-Q576 WeakPolarHBondContact O-CG 3.44Å; A572-Q576 PolarHBondContact O-N 3.12Å; F573-Q576 WeakPolarHBondContact O-CB 3.49Å; F573-Q576 PolarHBondContact O-N 3.36Å; F573-Q576 VanDerWaalsContact O-N 3.09Å; I574-Q576 PolarHBondContact O-N 2.95Å; Q576-N582 PolarHBondContact O-ND2 3.03Å
577	I	77.4	Confident	65.3	Low	56 Å²	56	78.2 Å²	78.2	29%	0.287	43%	0.428	S	S	.	.	H	α-helix	trans	-73.6	-39.1	179	-66.6	168.3	0	0	0	110.9	F573 I574 S579 P687	F573-I577 HydrophobicContact CD1-CD1 3.69Å; F573-I577 HydrophobicContact CD2-CD1 4.41Å; F573-I577 HydrophobicContact CE1-CD1 3.15Å; F573-I577 HydrophobicContact CE1-CG1 4.29Å; F573-I577 HydrophobicContact CE2-CD1 3.94Å; F573-I577 HydrophobicContact CE2-CG1 4.35Å; F573-I577 HydrophobicContact CG-CD1 4.32Å; F573-I577 HydrophobicContact CZ-CD1 3.31Å; F573-I577 HydrophobicContact CZ-CG1 4.17Å; F573-I577 PolarHBondContact O-N 2.98Å; F573-I577 VanDerWaalsContact O-N 3.08Å; I574-I577 PolarHBondContact O-N 3.19Å; I574-I577 VanDerWaalsContact O-N 3.14Å; I577-S579 PolarHBondContact O-N 3.49Å; I577-P687 HydrophobicContact CD1-CB 4.27Å
578	D	65.3	Low	62.3	Low	120 Å²	120	81.2 Å²	81.2	64%	0.642	45%	0.451	S	S	*	.	S	Bend	trans	-79.2	-5.5	-178.7	-70.7	-24.5	0	0	0	113.7	I574	I574-D578 PolarHBondContact O-N 3Å; I574-D578 VanDerWaalsContact O-N 3.08Å
579	S	57.3	Low	59.3	Low	48 Å²	48	83.1 Å²	83.1	34%	0.336	46%	0.463	S	S	.	.	S	Bend	trans	-67.5	131.2	176.5	-178.7	0	0	0	0	111.1	R575 I577 F581 N582	R575-S579 PolarHBondContact O-N 3.47Å; I577-S579 PolarHBondContact O-N 3.49Å; S579-F581 PolarHBondContact O-N 3.23Å; S579-N582 PolarHBondContact O-N 3.19Å
580	P	36.6	Very low	56.2	Low	114 Å²	114	86.4 Å²	86.4	74%	0.74	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-61.2	-9.7	-178.1	21.7	-31.3	0	0	0	114.5	N582	P580-N582 VanDerWaalsContact C-N 3.32Å
581	F	41.8	Very low	53.2	Low	195 Å²	195	95.7 Å²	95.7	86%	0.855	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-76.6	-11.4	173.8	-82.2	-85.5	0	0	0	114.6	S579 A583	S579-F581 PolarHBondContact O-N 3.23Å; F581-A583 VanDerWaalsContact C-N 3.33Å
582	N	42.9	Very low	50.1	Low	99 Å²	99	99.4 Å²	99.4	53%	0.529	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-93.3	20.7	177.2	-106.8	-25.2	0	0	0	113.8	Q576 S579 P580 K584	Q576-N582 PolarHBondContact O-ND2 3.03Å; S579-N582 PolarHBondContact O-N 3.19Å; P580-N582 VanDerWaalsContact C-N 3.32Å; N582-K584 PolarHBondContact O-N 3.21Å; N582-K584 VanDerWaalsContact O-N 3.08Å
583	A	31	Very low	47.1	Very low	83 Å²	83	104.9 Å²	104.9	69%	0.686	59%	0.588	S	S	*	*			trans	-52.1	117.2	173.2	0	0	0	0	0	110.6	F581	F581-A583 VanDerWaalsContact C-N 3.33Å
584	K	33.2	Very low	44.2	Very low	196 Å²	196	113.4 Å²	113.4	85%	0.852	63%	0.625	S	S	*	*			trans	-38.1	125.8	-177	-76.8	176.3	175.7	173.7	0	111.6	N582 A586	N582-K584 PolarHBondContact O-N 3.21Å; N582-K584 VanDerWaalsContact O-N 3.08Å; K584-A586 PolarHBondContact O-N 3.13Å
585	P	32.2	Very low	41.2	Very low	86 Å²	86	120 Å²	120	56%	0.558	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-60.6	137.4	168.9	24.4	-29.5	0	0	0	108.9
586	A	27.9	Very low	38.4	Very low	88 Å²	88	121.5 Å²	121.5	73%	0.727	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-52.1	144.4	176.7	0	0	0	0	0	110.6	K584	K584-A586 PolarHBondContact O-N 3.13Å
587	P	28.4	Very low	35.8	Very low	115 Å²	115	120.1 Å²	120.1	75%	0.747	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-56.8	138.3	-179	23.2	-32.5	0	0	0	110.2	K589	P587-K589 PolarHBondContact O-N 2.88Å
588	P	30.2	Very low	33.3	Very low	100 Å²	100	124.7 Å²	124.7	65%	0.649	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-61	136.6	176.6	23.8	-30	0	0	0	109.3	S590	P588-S590 PolarHBondContact O-N 3.49Å
589	K	29.5	Very low	31.4	Very low	168 Å²	168	124.6 Å²	124.6	73%	0.73	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-53.2	124.7	174.7	-71.1	179.7	178.7	177.3	0	108.6	P587 Y591	P587-K589 PolarHBondContact O-N 2.88Å; K589-Y591 HydrophobicContact CB-CE2 4.14Å; K589-Y591 WeakPolarHBondContact O-CD2 3.3Å; K589-Y591 PolarHBondContact O-N 3.34Å
590	S	26.9	Very low	30	Very low	121 Å²	121	128.7 Å²	128.7	85%	0.846	73%	0.725	S	S	*	*			trans	-60.3	101.2	174	58.6	0	0	0	0	109.6	P588	P588-S590 PolarHBondContact O-N 3.49Å
591	Y	29.7	Very low	29.5	Very low	195 Å²	195	133.2 Å²	133.2	77%	0.765	73%	0.728	S	S	*	*			trans	-83	124.6	165.7	-68.2	-78.6	0	0	0	107.9	K589 L593	K589-Y591 HydrophobicContact CB-CE2 4.14Å; K589-Y591 WeakPolarHBondContact O-CD2 3.3Å; K589-Y591 PolarHBondContact O-N 3.34Å; Y591-L593 PolarHBondContact O-N 2.65Å
592	G	26	Very low	28.7	Very low	78 Å²	78	129.2 Å²	129.2	80%	0.804	72%	0.721	S	S	*	*			trans	-48.3	113.5	-174.3	0	0	0	0	0	112.7	F594	G592-F594 PolarHBondContact O-N 3.12Å
593	L	27.4	Very low	28	Very low	150 Å²	150	131.1 Å²	131.1	79%	0.785	73%	0.732	S	S	*	*			trans	-61.5	114	175.1	-82	147.4	0	0	0	110.4	Y591 N595	Y591-L593 PolarHBondContact O-N 2.65Å; L593-N595 VanDerWaalsContact C-N 3.29Å; L593-N595 PolarHBondContact O-N 3.48Å; L593-N595 VanDerWaalsContact O-N 3.14Å
594	F	27.2	Very low	27.9	Very low	185 Å²	185	136.2 Å²	136.2	81%	0.811	74%	0.738	S	S	*	*			trans	-71.7	97.3	145.5	-92	-83.7	0	0	0	106.8	G592 Y596	G592-F594 PolarHBondContact O-N 3.12Å; F594-Y596 VanDerWaalsContact C-N 3.32Å; F594-Y596 HydrophobicContact CB-CD2 4.49Å; F594-Y596 HydrophobicContact CB-CE2 4.34Å; F594-Y596 PolarHBondContact O-N 2.97Å
595	N	26	Very low	27.5	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	73%	0.731	S	S	*	*			trans	-56.5	90.8	172.6	-105.7	-17.3	0	0	0	110.2	L593 G597	L593-N595 VanDerWaalsContact C-N 3.29Å; L593-N595 PolarHBondContact O-N 3.48Å; L593-N595 VanDerWaalsContact O-N 3.14Å; N595-G597 PolarHBondContact O-N 3.37Å
596	Y	29.2	Very low	27.1	Very low	119 Å²	119	135.1 Å²	135.1	47%	0.467	74%	0.736	S	S	.	*			trans	-85.4	72.1	157.1	-75.4	-79.3	0	0	0	107.7	D120 K124 F594 F598	D120-Y596 PolarHBondContact OD2-OH 3.44Å; K124-Y596 VanDerWaalsContact NZ-CD1 3.25Å; F594-Y596 VanDerWaalsContact C-N 3.32Å; F594-Y596 HydrophobicContact CB-CD2 4.49Å; F594-Y596 HydrophobicContact CB-CE2 4.34Å; F594-Y596 PolarHBondContact O-N 2.97Å; Y596-F598 PolarHBondContact O-N 3.15Å
597	G	25.3	Very low	26.9	Very low	64 Å²	64	136.9 Å²	136.9	66%	0.66	74%	0.737	S	S	*	*			trans	-59.5	110.6	172	0	0	0	0	0	109.6	N595 P599	N595-G597 PolarHBondContact O-N 3.37Å; G597-P599 WeakPolarHBondContact O-CD 3.43Å
598	F	26.5	Very low	26.7	Very low	152 Å²	152	140.7 Å²	140.7	67%	0.667	74%	0.742	S	S	*	*			trans	-72.3	121.7	167.9	-74.9	-85.6	0	0	0	108.4	Y596 T600	Y596-F598 PolarHBondContact O-N 3.15Å; F598-T600 PolarHBondContact O-N 3.28Å; F598-T600 VanDerWaalsContact O-N 3.15Å
599	P	25	Very low	26.4	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	74%	0.744	S	S	*	*			trans	-73.3	104.3	159.4	15.8	-2.5	0	0	0	106.7	G597 R601	G597-P599 WeakPolarHBondContact O-CD 3.43Å; P599-R601 PolarHBondContact O-N 3.32Å
600	T	26.9	Very low	26.4	Very low	134 Å²	134	141.7 Å²	141.7	82%	0.822	74%	0.744	S	S	*	*			trans	-62.2	98.1	163.6	49.4	0	0	0	0	107.9	F598	F598-T600 PolarHBondContact O-N 3.28Å; F598-T600 VanDerWaalsContact O-N 3.15Å
601	R	25.7	Very low	26.4	Very low	208 Å²	208	138.5 Å²	138.5	79%	0.785	73%	0.73	S	S	*	*			trans	-70.9	135.8	165.3	-91.8	-173.7	175.1	-176.9	-0	108.7	P599 D603	P599-R601 PolarHBondContact O-N 3.32Å; R601-D603 PolarHBondContact O-N 2.93Å; R601-D603 VanDerWaalsContact O-N 3.12Å
602	P	25	Very low	26.3	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	74%	0.737	S	S	*	*			trans	-79.4	91.7	171.2	32.1	-28.4	0	0	0	107.7	K604	P602-K604 VanDerWaalsContact C-N 3.34Å; P602-K604 PolarHBondContact O-N 3.43Å
603	D	30	Very low	26.5	Very low	139 Å²	139	141 Å²	141	74%	0.743	73%	0.725	S	S	*	*			trans	-76.2	93.7	173.4	-78	-30.8	0	0	0	110.1	R601	R601-D603 PolarHBondContact O-N 2.93Å; R601-D603 VanDerWaalsContact O-N 3.12Å
604	K	27.5	Very low	26.7	Very low	189 Å²	189	139.4 Å²	139.4	82%	0.822	72%	0.717	S	S	*	*			trans	19.9	102.3	138.9	-64.5	-179.3	178.9	-179.8	0	117.1	P602	P602-K604 VanDerWaalsContact C-N 3.34Å; P602-K604 PolarHBondContact O-N 3.43Å
605	K	24.3	Very low	26.9	Very low	163 Å²	163	133.4 Å²	133.4	71%	0.709	69%	0.693	S	S	*	*				25.7	103.5	129	-65.4	-168.8	-179.8	-134.8	0	116.5	E609	K605-E609 WeakPolarHBondContact CE-OE1 3.39Å; K605-E609 IonicContact NZ-OE1 3.11Å; K605-E609 PolarHBondContact NZ-OE1 2.81Å
606	C	24	Very low	27.2	Very low	97 Å²	97	130 Å²	130	66%	0.655	67%	0.671	S	S	*	*			trans	-144.9	99.6	131.3	-89.8	0	0	0	0	109.1
607	V	24.8	Very low	27.6	Very low	124 Å²	124	127 Å²	127	75%	0.752	66%	0.664	S	S	*	*	S	Bend	trans	47.7	102.8	140.7	-161.5	0	0	0	0	116.6
608	F	24.1	Very low	28.3	Very low	195 Å²	195	125.4 Å²	125.4	86%	0.855	64%	0.641	S	S	*	*			cis	-117	130.2	32.1	-81.4	-106.1	0	0	0	112.6	I610	F608-I610 PolarHBondContact O-N 3.49Å
609	E	23.8	Very low	29.2	Very low	147 Å²	147	120.3 Å²	120.3	69%	0.687	62%	0.618	S	S	*	*			trans	-71.7	92.9	173.8	-81	178.3	163	0	0	110.9	K605	K605-E609 WeakPolarHBondContact CE-OE1 3.39Å; K605-E609 IonicContact NZ-OE1 3.11Å; K605-E609 PolarHBondContact NZ-OE1 2.81Å
610	I	29	Very low	29.8	Very low	143 Å²	143	119.1 Å²	119.1	73%	0.733	60%	0.599	S	S	*	*			trans	-94.6	97	151.3	-57.3	178.4	0	0	0	106	F608	F608-I610 PolarHBondContact O-N 3.49Å
611	G	28	Very low	30.4	Very low	53 Å²	53	117.3 Å²	117.3	55%	0.546	58%	0.579	S	S	.	*			trans	-63.4	141.8	-166.4	0	0	0	0	0	114.7	Q613	G611-Q613 PolarHBondContact O-N 3.44Å
612	K	27.4	Very low	30.7	Very low	210 Å²	210	115.8 Å²	115.8	91%	0.913	57%	0.574	S	S	*	*	S	Bend	trans	-7.8	83.5	156	-63	179.7	176.9	-178.1	0	115.3
613	Q	28.7	Very low	30.9	Very low	117 Å²	117	113.3 Å²	113.3	55%	0.547	56%	0.559	S	S	.	*			trans	-147	144.1	164.9	-70.2	-170.4	-10.1	0	0	108.4	G611 L615	G611-Q613 PolarHBondContact O-N 3.44Å; Q613-L615 PolarHBondContact O-N 3.19Å
614	N	32.6	Very low	30.9	Very low	116 Å²	116	112.6 Å²	112.6	62%	0.62	56%	0.56	S	S	*	*			trans	-63.1	106.8	-169	-143.7	-2	0	0	0	110.2	F616	N614-F616 PolarHBondContact O-N 3Å
615	L	31.4	Very low	31.3	Very low	59 Å²	59	112.4 Å²	112.4	31%	0.309	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	6.3	-172.9	-82.9	145.8	0	0	0	114.4	R485 Y486 Q613	R485-L615 HydrophobicContact CB-CD1 4.14Å; Y486-L615 HydrophobicContact CD1-CD2 4.13Å; Q613-L615 PolarHBondContact O-N 3.19Å
616	F	32.1	Very low	31.5	Very low	70 Å²	70	115 Å²	115	31%	0.307	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	16.8	-175.4	-64.9	-64.9	0	0	0	114.3	E213 L214 N614 P618	E213-F616 HydrophobicContact CB-CD1 4Å; E213-F616 HydrophobicContact CB-CD2 3.86Å; E213-F616 HydrophobicContact CB-CE1 3.88Å; E213-F616 HydrophobicContact CB-CE2 3.71Å; E213-F616 HydrophobicContact CB-CG 4Å; E213-F616 HydrophobicContact CB-CZ 3.72Å; E213-F616 HydrophobicContact CG-CD2 3.68Å; E213-F616 HydrophobicContact CG-CE2 3.82Å; E213-F616 HydrophobicContact CG-CG 4.08Å; E213-F616 HydrophobicContact CG-CZ 4.36Å; L214-F616 HydrophobicContact CB-CD1 4Å; L214-F616 HydrophobicContact CB-CE1 3.74Å; L214-F616 VanDerWaalsContact O-CE1 3.26Å; L214-F616 WeakPolarHBondContact O-CE1 3.11Å; N614-F616 PolarHBondContact O-N 3Å; F616-P618 WeakPolarHBondContact O-CD 3.43Å
617	D	36.7	Very low	31.7	Very low	58 Å²	58	120.5 Å²	120.5	31%	0.31	57%	0.572	S	S	.	*			trans	-96	107.5	171.8	-147	-13.7	0	0	0	108.3	W619 Y620	D617-W619 PolarHBondContact O-N 2.88Å; D617-W619 VanDerWaalsContact OD1-CD1 3.29Å; D617-Y620 PolarHBondContact O-N 3.22Å
618	P	40.8	Very low	31.9	Very low	29 Å²	29	122.2 Å²	122.2	19%	0.188	58%	0.577	C	S	.	*	T	Hydrogen-bonded Turn	trans	-58.1	-1.9	-178.7	-24.4	35.4	0	0	0	115	F616	F616-P618 WeakPolarHBondContact O-CD 3.43Å
619	W	44.8	Very low	32	Very low	46 Å²	46	116 Å²	116	17%	0.174	57%	0.567	C	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	21.3	-172.8	-48.7	94.2	0	0	0	112.9	L546 P548 D617 F621 Y667 L674 F684	L546-W619 WeakPolarHBondContact O-CH2 3.13Å; L546-W619 WeakPolarHBondContact O-CZ3 3.34Å; P548-W619 HydrophobicContact CG-CE3 3.62Å; P548-W619 HydrophobicContact CG-CZ3 3.31Å; D617-W619 PolarHBondContact O-N 2.88Å; D617-W619 VanDerWaalsContact OD1-CD1 3.29Å; W619-F621 PolarHBondContact O-N 2.98Å; W619-Y667 HydrophobicContact CH2-CD2 4.04Å; W619-Y667 AromaticContact CH2-CE2 3.25Å; W619-Y667 HydrophobicContact CH2-CE2 3.25Å; W619-Y667 HydrophobicContact CZ2-CE2 4.39Å; W619-Y667 AromaticContact CZ3-CE2 3.46Å; W619-Y667 HydrophobicContact CZ3-CE2 3.46Å; W619-Y667 VanDerWaalsContact CZ3-CE2 3.46Å; W619-L674 HydrophobicContact CE3-CD1 4.27Å; W619-F684 HydrophobicContact CH2-CE2 4.41Å; W619-F684 HydrophobicContact CZ2-CD2 4.36Å; W619-F684 HydrophobicContact CZ2-CE2 4.16Å
620	Y	38.6	Very low	32.3	Very low	93 Å²	93	116.6 Å²	116.6	37%	0.365	58%	0.575	S	S	.	*			trans	-64.3	16.3	-169.7	-162.8	-103.3	0	0	0	116.9	D617 R622	D617-Y620 PolarHBondContact O-N 3.22Å; Y620-R622 VanDerWaalsContact C-N 3.35Å; Y620-R622 PolarHBondContact O-N 3.18Å
621	F	38.3	Very low	32.2	Very low	95 Å²	95	117.7 Å²	117.7	42%	0.417	58%	0.581	S	S	.	*	S	Bend	trans	-81.4	9.6	-174	-84.3	-78.9	0	0	0	116.6	L491 M494 W619	L491-F621 HydrophobicContact CD2-CE1 4.16Å; L491-F621 HydrophobicContact CD2-CZ 3.57Å; L491-F621 HydrophobicContact CG-CZ 4.41Å; M494-F621 HydrophobicContact CE-CE1 3.97Å; M494-F621 HydrophobicContact CE-CZ 4.3Å; M494-F621 HydrophobicContact SD-CE1 3.54Å; M494-F621 VanDerWaalsContact SD-CE1 3.54Å; M494-F621 HydrophobicContact SD-CE2 4.16Å; M494-F621 HydrophobicContact SD-CZ 3.26Å; M494-F621 WeakPolarHBondContact SD-CZ 3.49Å; W619-F621 PolarHBondContact O-N 2.98Å
622	R	32.2	Very low	32.4	Very low	176 Å²	176	121.9 Å²	121.9	66%	0.664	60%	0.595	S	S	*	*			trans	-157	7.6	-179	-124.9	171.8	177	179.3	-0.4	120.6	Y620 T624 E675	Y620-R622 VanDerWaalsContact C-N 3.35Å; Y620-R622 PolarHBondContact O-N 3.18Å; R622-T624 PolarHBondContact O-N 3.4Å; R622-E675 VanDerWaalsContact NH1-C 3.28Å; R622-E675 PolarHBondContact NH1-O 3.41Å
623	S	30.1	Very low	32.6	Very low	61 Å²	61	117.1 Å²	117.1	43%	0.427	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76	23.5	-170.7	59.1	0	0	0	0	116.9	F625	S623-F625 PolarHBondContact O-N 3.39Å
624	T	30.8	Very low	32.7	Very low	123 Å²	123	115.8 Å²	115.8	76%	0.755	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-3.6	170.7	-41.9	0	0	0	0	113.8	R622	R622-T624 PolarHBondContact O-N 3.4Å
625	F	35	Very low	32.5	Very low	186 Å²	186	117.9 Å²	117.9	82%	0.816	62%	0.615	S	S	*	*	S	Bend	trans	-127	95.9	-177.7	-75.3	-83.3	0	0	0	115.3	S623	S623-F625 PolarHBondContact O-N 3.39Å
626	R	28	Very low	32.5	Very low	217 Å²	217	123.3 Å²	123.3	82%	0.819	64%	0.644	S	S	*	*			trans	34.1	119.5	140.2	-76.2	-174.4	-178.3	-173.9	2.6	122
627	R	27.7	Very low	32.3	Very low	213 Å²	213	127 Å²	127	80%	0.804	67%	0.667	S	S	*	*				55.2	132.2	117.8	-73.9	-175.2	178.3	157.4	0.3	121.2
628	N	30	Very low	32.2	Very low	160 Å²	160	133.1 Å²	133.1	86%	0.856	69%	0.693	S	S	*	*			trans	84.7	124.8	164.7	-56.6	-12.4	0	0	0	113
629	G	27.3	Very low	31.7	Very low	63 Å²	63	136.8 Å²	136.8	65%	0.649	72%	0.72	S	S	*	*			cis	127.4	109.9	20.5	0	0	0	0	0	107.3
630	N	28.2	Very low	30.8	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	75%	0.754	S	S	*	*			trans	82.9	113.3	177.7	-51.1	-24.6	0	0	0	115.9
631	I	27.3	Very low	30.5	Very low	166 Å²	166	145.4 Å²	145.4	85%	0.851	78%	0.777	S	S	*	*			trans	167.9	63.7	146.8	-79.9	148.8	0	0	0	108.7
632	V	31.8	Very low	30.1	Very low	141 Å²	141	147.7 Å²	147.7	86%	0.855	80%	0.799	S	S	*	*			trans	-146.9	40.1	168.3	-161.2	0	0	0	0	111
633	A	32.2	Very low	30.1	Very low	110 Å²	110	143 Å²	143	91%	0.909	81%	0.805	S	S	*	*	S	Bend	trans	-111.9	16	173.8	0	0	0	0	0	112.4
634	A	31.1	Very low	30.2	Very low	89 Å²	89	145.8 Å²	145.8	74%	0.736	83%	0.825	S	S	*	*	S	Bend	trans	-129.9	7.6	-166.8	0	0	0	0	0	116
635	L	28.9	Very low	30.3	Very low	161 Å²	161	142 Å²	142	84%	0.843	81%	0.806	S	S	*	*	S	Bend	trans	-135.8	15	-170	-72.8	170.7	0	0	0	116.3
636	N	31.1	Very low	30.3	Very low	173 Å²	173	140.7 Å²	140.7	93%	0.925	81%	0.808	S	S	*	*			trans	-106.6	33.6	-178.6	-100.2	-2.2	0	0	0	114.7
637	D	28.7	Very low	30.6	Very low	147 Å²	147	134 Å²	134	79%	0.786	80%	0.799	S	S	*	*			trans	-134.1	79	178.8	-147.1	11	0	0	0	110
638	Q	33.3	Very low	31.1	Very low	186 Å²	186	129.9 Å²	129.9	87%	0.869	79%	0.787	S	S	*	*			trans	-170.4	111.3	150	-102.9	155.5	59.8	0	0	114.7
639	S	30.3	Very low	32.1	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	78%	0.781	S	S	*	*			trans	65.8	101.5	141.3	67.3	0	0	0	0	121.3
640	M	26.6	Very low	33.2	Very low	181 Å²	181	131.9 Å²	131.9	89%	0.892	78%	0.782	S	S	*	*			trans	-57.4	139.7	134.4	-69.2	-163	155.6	0	0	111.7
641	T	31.7	Very low	34.6	Very low	139 Å²	139	127.3 Å²	127.3	85%	0.853	76%	0.763	S	S	*	*			trans	-144.7	123.4	140.3	44.3	0	0	0	0	109.5
642	T	29.8	Very low	36	Very low	144 Å²	144	122.3 Å²	122.3	88%	0.883	74%	0.74	S	S	*	*			trans	-87	121.8	173.5	40.4	0	0	0	0	109.2
643	G	32	Very low	37.5	Very low	76 Å²	76	119 Å²	119	78%	0.784	72%	0.718	S	S	*	*			trans	-112.2	134.4	178.4	0	0	0	0	0	112.3
644	S	33.7	Very low	39.6	Very low	120 Å²	120	119 Å²	119	84%	0.839	70%	0.703	S	S	*	*			trans	-46.4	133.8	-174	-168.5	0	0	0	0	115.9
645	A	31.5	Very low	42.2	Very low	44 Å²	44	117.5 Å²	117.5	36%	0.364	69%	0.69	S	S	.	*			trans	-78.9	117.2	165.7	0	0	0	0	0	109.1	K648	A645-K648 HydrophobicContact CB-CD 4.1Å
646	D	34.4	Very low	44.9	Very low	159 Å²	159	110 Å²	110	85%	0.85	65%	0.651	S	S	*	*			trans	173.5	71.1	150.8	-83	-22.4	0	0	0	110.6
647	A	36	Very low	47.7	Very low	77 Å²	77	105.8 Å²	105.8	64%	0.636	63%	0.626	S	S	*	*	S	Bend	trans	-171.5	44.6	166.4	0	0	0	0	0	110.9	S651	A647-S651 PolarHBondContact O-OG 2.88Å
648	K	37.9	Very low	50.5	Low	125 Å²	125	104 Å²	104	54%	0.543	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.1	1.3	-138.3	-102.3	-175.1	173	-175.7	0	120.2	A645 T652	A645-K648 HydrophobicContact CB-CD 4.1Å; K648-T652 HydrophobicContact CG-CG2 4.19Å; K648-T652 WeakPolarHBondContact O-CB 3.13Å; K648-T652 WeakPolarHBondContact O-CG2 3.4Å; K648-T652 PolarHBondContact O-OG1 3.3Å
649	D	50.4	Low	53.1	Low	138 Å²	138	98.9 Å²	98.9	74%	0.738	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-34.2	-175.9	-79.5	-8.6	0	0	0	115.7	T652	D649-T652 PolarHBondContact O-OG1 3.02Å
650	N	51	Low	55.9	Low	127 Å²	127	93.9 Å²	93.9	68%	0.679	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-35.5	175.3	-75.1	-6.7	0	0	0	113.1	T652 L653 D654	N650-T652 PolarHBondContact O-N 3.19Å; N650-L653 PolarHBondContact O-N 3.33Å; N650-D654 PolarHBondContact O-N 3.47Å
651	S	56.4	Low	58.9	Low	64 Å²	64	86.5 Å²	86.5	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-28.9	179.7	63	0	0	0	0	113.1	A647 A655	A647-S651 PolarHBondContact O-OG 2.88Å; S651-A655 WeakPolarHBondContact O-CB 3.47Å; S651-A655 PolarHBondContact O-N 2.89Å; S651-A655 VanDerWaalsContact O-N 3.07Å
652	T	58.2	Low	61.6	Low	61 Å²	61	83.6 Å²	83.6	37%	0.374	50%	0.5	S	S	.	.	H	α-helix	trans	-79.6	-33.8	-179.4	52.3	0	0	0	0	112.6	K648 D649 N650 A656	K648-T652 HydrophobicContact CG-CG2 4.19Å; K648-T652 WeakPolarHBondContact O-CB 3.13Å; K648-T652 WeakPolarHBondContact O-CG2 3.4Å; K648-T652 PolarHBondContact O-OG1 3.3Å; D649-T652 PolarHBondContact O-OG1 3.02Å; N650-T652 PolarHBondContact O-N 3.19Å; T652-A656 WeakPolarHBondContact O-CB 3.48Å; T652-A656 PolarHBondContact O-N 2.94Å; T652-A656 VanDerWaalsContact O-N 3.09Å
653	L	61.4	Low	64.3	Low	73 Å²	73	78.1 Å²	78.1	38%	0.382	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-51.2	172.9	-81.2	165.7	0	0	0	110.3	N650 A656 E657	N650-L653 PolarHBondContact O-N 3.33Å; L653-A656 PolarHBondContact O-N 3.42Å; L653-E657 WeakPolarHBondContact O-CG 3.13Å; L653-E657 PolarHBondContact O-N 3.26Å
654	D	76.7	Confident	67	Low	110 Å²	110	74.5 Å²	74.5	59%	0.588	43%	0.427	S	S	*	.	H	α-helix	trans	-66.8	-38.7	-180	-66.2	-15.8	0	0	0	111.7	N650 E657 Q658	N650-D654 PolarHBondContact O-N 3.47Å; D654-E657 PolarHBondContact O-N 3.06Å; D654-Q658 WeakPolarHBondContact O-CB 3.38Å; D654-Q658 PolarHBondContact O-N 3.37Å
655	A	85.7	Confident	69.6	Low	56 Å²	56	71.8 Å²	71.8	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-41.8	179.1	0	0	0	0	0	113	S651 M659	S651-A655 WeakPolarHBondContact O-CB 3.47Å; S651-A655 PolarHBondContact O-N 2.89Å; S651-A655 VanDerWaalsContact O-N 3.07Å; A655-M659 VanDerWaalsContact O-CB 3.28Å; A655-M659 WeakPolarHBondContact O-CB 3.32Å; A655-M659 PolarHBondContact O-N 3.27Å
656	A	86.2	Confident	72.1	Confident	5 Å²	5	73.2 Å²	73.2	4%	0.041	41%	0.408	C	S	.	.	H	α-helix	trans	-68.2	-38.2	177.8	0	0	0	0	0	111.9	I574 R575 T652 L653 A660	I574-A656 HydrophobicContact CB-CB 4.27Å; I574-A656 HydrophobicContact CG2-CB 4.1Å; R575-A656 HydrophobicContact CG-CB 3.75Å; T652-A656 WeakPolarHBondContact O-CB 3.48Å; T652-A656 PolarHBondContact O-N 2.94Å; T652-A656 VanDerWaalsContact O-N 3.09Å; L653-A656 PolarHBondContact O-N 3.42Å; A656-A660 VanDerWaalsContact O-CB 3.28Å; A656-A660 WeakPolarHBondContact O-CB 3.48Å; A656-A660 PolarHBondContact O-N 2.7Å
657	E	89.7	Confident	74.4	Confident	83 Å²	83	65.6 Å²	65.6	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-68.9	-40.8	176.8	-72.3	-175.4	-172	0	0	112.4	H567 A571 R575 L653 D654 A660 S661	H567-E657 PolarHBondContact NE2-O 3.19Å; A571-E657 HydrophobicContact CB-CG 4.05Å; R575-E657 IonicContact NH1-OE1 3.53Å; R575-E657 PolarHBondContact NH1-OE1 2.84Å; L653-E657 WeakPolarHBondContact O-CG 3.13Å; L653-E657 PolarHBondContact O-N 3.26Å; D654-E657 PolarHBondContact O-N 3.06Å; E657-A660 PolarHBondContact O-N 3.41Å; E657-S661 PolarHBondContact O-N 2.99Å
658	Q	88.3	Confident	76.7	Confident	110 Å²	110	64 Å²	64	51%	0.514	35%	0.346	S	S	.	.	H	α-helix	trans	-64.3	-48.3	174.4	-172.7	61.1	44.9	0	0	111	D654 A660 S661 D662	D654-Q658 WeakPolarHBondContact O-CB 3.38Å; D654-Q658 PolarHBondContact O-N 3.37Å; Q658-A660 VanDerWaalsContact C-N 3.3Å; Q658-A660 PolarHBondContact O-N 2.93Å; Q658-S661 WeakPolarHBondContact O-CB 3.38Å; Q658-S661 PolarHBondContact O-N 3.35Å; Q658-D662 PolarHBondContact NE2-OD1 3.32Å; Q658-D662 VanDerWaalsContact O-CG 3.28Å; Q658-D662 PolarHBondContact O-N 3.48Å
659	M	87.1	Confident	78.7	Confident	79 Å²	79	62.3 Å²	62.3	39%	0.389	34%	0.343	S	S	.	.	H	α-helix	trans	-60.5	-40.9	177.8	-175.5	177.4	-64.9	0	0	111.9	I574 A655 S661 D662 Q663 P687	I574-M659 HydrophobicContact CD1-CB 4.06Å; I574-M659 HydrophobicContact CD1-CG 3.88Å; I574-M659 HydrophobicContact CD1-SD 4Å; I574-M659 HydrophobicContact CG2-SD 4.19Å; A655-M659 VanDerWaalsContact O-CB 3.28Å; A655-M659 WeakPolarHBondContact O-CB 3.32Å; A655-M659 PolarHBondContact O-N 3.27Å; M659-S661 VanDerWaalsContact C-N 3.33Å; M659-D662 PolarHBondContact O-N 3.38Å; M659-Q663 WeakPolarHBondContact O-CB 3.39Å; M659-Q663 WeakPolarHBondContact O-CG 3.37Å; M659-Q663 PolarHBondContact O-N 3.08Å; M659-P687 HydrophobicContact SD-CG 4.21Å
660	A	88.5	Confident	79.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-41.8	174.4	0	0	0	0	0	111.6	L570 A571 I574 A656 E657 Q658 L664	L570-A660 HydrophobicContact CB-CB 4.21Å; L570-A660 HydrophobicContact CD2-CB 3.87Å; L570-A660 HydrophobicContact CG-CB 3.91Å; A571-A660 HydrophobicContact CB-CB 3.96Å; I574-A660 HydrophobicContact CD1-CB 4.24Å; A656-A660 VanDerWaalsContact O-CB 3.28Å; A656-A660 WeakPolarHBondContact O-CB 3.48Å; A656-A660 PolarHBondContact O-N 2.7Å; E657-A660 PolarHBondContact O-N 3.41Å; Q658-A660 VanDerWaalsContact C-N 3.3Å; Q658-A660 PolarHBondContact O-N 2.93Å; A660-L664 WeakPolarHBondContact O-CB 3.32Å; A660-L664 VanDerWaalsContact O-CG 3.22Å; A660-L664 WeakPolarHBondContact O-CG 3.43Å; A660-L664 PolarHBondContact O-N 3.16Å; A660-L664 VanDerWaalsContact O-N 3.08Å
661	S	90.7	Very high	81	Confident	27 Å²	27	50.8 Å²	50.8	19%	0.189	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-50.6	175.9	-165.7	0	0	0	0	111.7	E657 Q658 M659 Q663 L664 D665	E657-S661 PolarHBondContact O-N 2.99Å; Q658-S661 WeakPolarHBondContact O-CB 3.38Å; Q658-S661 PolarHBondContact O-N 3.35Å; M659-S661 VanDerWaalsContact C-N 3.33Å; S661-Q663 VanDerWaalsContact C-N 3.29Å; S661-Q663 PolarHBondContact O-N 2.99Å; S661-L664 PolarHBondContact O-N 3.37Å; S661-L664 VanDerWaalsContact O-N 3.08Å; S661-D665 PolarHBondContact O-N 3.09Å
662	D	87.7	Confident	81.6	Confident	78 Å²	78	52.5 Å²	52.5	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-39.4	-177.5	-63.8	-16.1	0	0	0	111.8	Q658 M659 T666	Q658-D662 PolarHBondContact NE2-OD1 3.32Å; Q658-D662 VanDerWaalsContact O-CG 3.28Å; Q658-D662 PolarHBondContact O-N 3.48Å; M659-D662 PolarHBondContact O-N 3.38Å; D662-T666 WeakPolarHBondContact O-CB 3.37Å; D662-T666 PolarHBondContact O-N 3.46Å; D662-T666 PolarHBondContact O-OG1 2.84Å
663	Q	86.9	Confident	81.9	Confident	28 Å²	28	56.1 Å²	56.1	13%	0.131	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-33.6	176.7	-70.8	-161.9	-24.4	0	0	112.7	M659 S661 Y667 P686 P687 F688	M659-Q663 WeakPolarHBondContact O-CB 3.39Å; M659-Q663 WeakPolarHBondContact O-CG 3.37Å; M659-Q663 PolarHBondContact O-N 3.08Å; S661-Q663 VanDerWaalsContact C-N 3.29Å; S661-Q663 PolarHBondContact O-N 2.99Å; Q663-Y667 VanDerWaalsContact O-CB 3.29Å; Q663-Y667 WeakPolarHBondContact O-CB 3.15Å; Q663-Y667 PolarHBondContact O-N 3.45Å; Q663-P686 PolarHBondContact NE2-O 3.37Å; Q663-P686 VanDerWaalsContact NE2-O 3.08Å; Q663-P687 VanDerWaalsContact NE2-CD 3.33Å; Q663-F688 HydrophobicContact CB-CB 4.07Å
664	L	88.7	Confident	81.8	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-70.3	-41.1	174.1	-71.2	175.2	0	0	0	112	Y545 R563 V566 H567 L570 A660 S661 T666 Y667 E668 F688	Y545-L664 HydrophobicContact CE1-CD2 3.66Å; R563-L664 HydrophobicContact CG-CD1 4.47Å; V566-L664 HydrophobicContact CB-CD2 4.4Å; V566-L664 HydrophobicContact CG1-CD1 4.39Å; V566-L664 HydrophobicContact CG1-CD2 3.57Å; H567-L664 HydrophobicContact CB-CD1 3.61Å; L570-L664 HydrophobicContact CD2-CD2 4.41Å; L570-L664 HydrophobicContact CD2-CG 4.21Å; A660-L664 WeakPolarHBondContact O-CB 3.32Å; A660-L664 VanDerWaalsContact O-CG 3.22Å; A660-L664 WeakPolarHBondContact O-CG 3.43Å; A660-L664 PolarHBondContact O-N 3.16Å; A660-L664 VanDerWaalsContact O-N 3.08Å; S661-L664 PolarHBondContact O-N 3.37Å; S661-L664 VanDerWaalsContact O-N 3.08Å; L664-T666 VanDerWaalsContact C-N 3.3Å; L664-T666 PolarHBondContact O-N 3.3Å; L664-Y667 CarbonylContact O-C 3.59Å; L664-Y667 WeakPolarHBondContact O-CA 3.33Å; L664-Y667 VanDerWaalsContact O-CB 3.31Å; L664-Y667 WeakPolarHBondContact O-CB 3.33Å; L664-Y667 PolarHBondContact O-N 3.35Å; L664-Y667 VanDerWaalsContact O-N 3.11Å; L664-E668 WeakPolarHBondContact O-CG 3.44Å; L664-E668 PolarHBondContact O-N 3.05Å; L664-F688 HydrophobicContact CD2-CD2 4.22Å; L664-F688 HydrophobicContact CD2-CE2 3.75Å
665	D	87.8	Confident	80.5	Confident	64 Å²	64	52.9 Å²	52.9	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-40.7	176	-64.8	-19.3	0	0	0	110.7	R563 S661 Y667 E668 I669	R563-D665 IonicContact CZ-OD1 3.99Å; R563-D665 IonicContact NH2-OD1 2.69Å; R563-D665 PolarHBondContact NH2-OD1 2.88Å; S661-D665 PolarHBondContact O-N 3.09Å; D665-Y667 VanDerWaalsContact C-N 3.34Å; D665-Y667 PolarHBondContact O-N 2.96Å; D665-E668 PolarHBondContact O-N 3.04Å; D665-I669 WeakPolarHBondContact O-CD1 3.43Å; D665-I669 VanDerWaalsContact O-CG1 3.28Å; D665-I669 WeakPolarHBondContact O-CG1 3.38Å; D665-I669 PolarHBondContact O-N 3.41Å; D665-I669 VanDerWaalsContact O-N 3.12Å
666	T	84.3	Confident	78.5	Confident	73 Å²	73	57.4 Å²	57.4	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-41.4	172.5	-57	0	0	0	0	111.7	D662 L664 I669 I670	D662-T666 WeakPolarHBondContact O-CB 3.37Å; D662-T666 PolarHBondContact O-N 3.46Å; D662-T666 PolarHBondContact O-OG1 2.84Å; L664-T666 VanDerWaalsContact C-N 3.3Å; L664-T666 PolarHBondContact O-N 3.3Å; T666-I669 PolarHBondContact O-N 3.06Å; T666-I670 HydrophobicContact CG2-CD1 3.97Å; T666-I670 WeakPolarHBondContact O-CG1 3.4Å; T666-I670 PolarHBondContact O-N 3.34Å; T666-I670 VanDerWaalsContact O-N 3.07Å
667	Y	83.8	Confident	76.4	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-49.3	174.8	169.2	-107.9	0	0	0	112.8	Y545 L546 P548 H551 W619 Q663 L664 D665 I669 I670 A671 F684 F688	Y545-Y667 HydrophobicContact CD1-CD1 4.47Å; Y545-Y667 AromaticContact CD1-CE1 3.92Å; Y545-Y667 HydrophobicContact CD1-CE1 3.92Å; Y545-Y667 AromaticContact CE1-CD1 3.55Å; Y545-Y667 HydrophobicContact CE1-CD1 3.55Å; Y545-Y667 AromaticContact CE1-CE1 3.41Å; Y545-Y667 HydrophobicContact CE1-CE1 3.41Å; Y545-Y667 VanDerWaalsContact CE1-CE1 3.41Å; Y545-Y667 AromaticContact CZ-CD1 3.88Å; Y545-Y667 AromaticContact CZ-CE1 3.89Å; Y545-Y667 PolarHBondContact O-OH 3.26Å; L546-Y667 VanDerWaalsContact C-OH 3.24Å; L546-Y667 PolarHBondContact O-OH 3.29Å; L546-Y667 VanDerWaalsContact O-OH 3.04Å; P548-Y667 HydrophobicContact CG-CE2 4.32Å; P548-Y667 WeakPolarHBondContact CG-OH 3.41Å; H551-Y667 AromaticContact CE1-CE1 3.6Å; H551-Y667 AromaticContact CE1-CZ 3.82Å; H551-Y667 AromaticContact NE2-CE1 3.87Å; H551-Y667 PolarHBondContact NE2-OH 2.69Å; W619-Y667 HydrophobicContact CH2-CD2 4.04Å; W619-Y667 AromaticContact CH2-CE2 3.25Å; W619-Y667 HydrophobicContact CH2-CE2 3.25Å; W619-Y667 HydrophobicContact CZ2-CE2 4.39Å; W619-Y667 AromaticContact CZ3-CE2 3.46Å; W619-Y667 HydrophobicContact CZ3-CE2 3.46Å; W619-Y667 VanDerWaalsContact CZ3-CE2 3.46Å; Q663-Y667 VanDerWaalsContact O-CB 3.29Å; Q663-Y667 WeakPolarHBondContact O-CB 3.15Å; Q663-Y667 PolarHBondContact O-N 3.45Å; L664-Y667 CarbonylContact O-C 3.59Å; L664-Y667 WeakPolarHBondContact O-CA 3.33Å; L664-Y667 VanDerWaalsContact O-CB 3.31Å; L664-Y667 WeakPolarHBondContact O-CB 3.33Å; L664-Y667 PolarHBondContact O-N 3.35Å; L664-Y667 VanDerWaalsContact O-N 3.11Å; D665-Y667 VanDerWaalsContact C-N 3.34Å; D665-Y667 PolarHBondContact O-N 2.96Å; Y667-I669 PolarHBondContact O-N 3.32Å; Y667-I670 PolarHBondContact O-N 2.96Å; Y667-A671 HydrophobicContact CE2-CB 4.25Å; Y667-A671 VanDerWaalsContact O-CB 3.26Å; Y667-A671 WeakPolarHBondContact O-CB 3.48Å; Y667-A671 PolarHBondContact O-N 3.36Å; Y667-F684 AromaticContact CD2-CE1 3.95Å; Y667-F684 HydrophobicContact CD2-CE1 3.95Å; Y667-F684 HydrophobicContact CD2-CE2 4.29Å; Y667-F684 AromaticContact CD2-CZ 3.62Å; Y667-F684 HydrophobicContact CD2-CZ 3.62Å; Y667-F684 HydrophobicContact CE2-CZ 4.33Å; Y667-F688 AromaticContact CD1-CZ 3.99Å; Y667-F688 HydrophobicContact CD1-CZ 3.99Å; Y667-F688 AromaticContact CD2-CE1 3.51Å; Y667-F688 HydrophobicContact CD2-CE1 3.51Å; Y667-F688 AromaticContact CD2-CZ 3.55Å; Y667-F688 HydrophobicContact CD2-CZ 3.55Å; Y667-F688 HydrophobicContact CE1-CZ 4.41Å; Y667-F688 HydrophobicContact CE2-CE1 4.21Å; Y667-F688 HydrophobicContact CE2-CZ 4.07Å; Y667-F688 AromaticContact CG-CE1 3.8Å; Y667-F688 HydrophobicContact CG-CE1 3.8Å; Y667-F688 HydrophobicContact CG-CE2 4.33Å; Y667-F688 AromaticContact CG-CZ 3.5Å; Y667-F688 HydrophobicContact CG-CZ 3.5Å; Y667-F688 VanDerWaalsContact CG-CZ 3.5Å
668	E	83.5	Confident	74.1	Confident	42 Å²	42	63.7 Å²	63.7	20%	0.196	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-44.5	179.6	-69.2	172	-147.2	0	0	111.3	Y545 F559 R563 L664 D665 I670 A671 D672	Y545-E668 WeakPolarHBondContact OH-CG 3.34Å; Y545-E668 PolarHBondContact OH-OE1 2.85Å; F559-E668 HydrophobicContact CZ-CG 4.19Å; R563-E668 WeakPolarHBondContact CD-OE1 3.47Å; R563-E668 IonicContact CZ-OE1 2.71Å; R563-E668 IonicContact NE-OE1 3.45Å; R563-E668 PolarHBondContact NE-OE1 2.92Å; L664-E668 WeakPolarHBondContact O-CG 3.44Å; L664-E668 PolarHBondContact O-N 3.05Å; D665-E668 PolarHBondContact O-N 3.04Å; E668-I670 VanDerWaalsContact C-N 3.31Å; E668-I670 PolarHBondContact O-N 3.14Å; E668-A671 PolarHBondContact O-N 3.11Å; E668-D672 PolarHBondContact O-N 2.97Å
669	I	80.6	Confident	71.8	Confident	91 Å²	91	60.6 Å²	60.6	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-60.1	-41.9	176.2	-66.6	164.4	0	0	0	111.5	D665 T666 Y667 R673	D665-I669 WeakPolarHBondContact O-CD1 3.43Å; D665-I669 VanDerWaalsContact O-CG1 3.28Å; D665-I669 WeakPolarHBondContact O-CG1 3.38Å; D665-I669 PolarHBondContact O-N 3.41Å; D665-I669 VanDerWaalsContact O-N 3.12Å; T666-I669 PolarHBondContact O-N 3.06Å; Y667-I669 PolarHBondContact O-N 3.32Å; I669-R673 VanDerWaalsContact O-CG 3.28Å; I669-R673 WeakPolarHBondContact O-CG 3.47Å; I669-R673 PolarHBondContact O-N 3.09Å
670	I	74.4	Confident	69.8	Low	21 Å²	21	59.2 Å²	59.2	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-73	-41.6	179	-68.5	170.8	0	0	0	110.3	T666 Y667 E668 D672 R673 L674 I679 F684	T666-I670 HydrophobicContact CG2-CD1 3.97Å; T666-I670 WeakPolarHBondContact O-CG1 3.4Å; T666-I670 PolarHBondContact O-N 3.34Å; T666-I670 VanDerWaalsContact O-N 3.07Å; Y667-I670 PolarHBondContact O-N 2.96Å; E668-I670 VanDerWaalsContact C-N 3.31Å; E668-I670 PolarHBondContact O-N 3.14Å; I670-D672 VanDerWaalsContact C-N 3.32Å; I670-D672 PolarHBondContact O-N 3.31Å; I670-R673 CarbonylContact O-C 3.59Å; I670-R673 WeakPolarHBondContact O-CA 3.29Å; I670-R673 WeakPolarHBondContact O-CB 3.21Å; I670-R673 PolarHBondContact O-N 3.2Å; I670-L674 HydrophobicContact CG2-CD1 4Å; I670-L674 HydrophobicContact CG2-CG 4.02Å; I670-L674 VanDerWaalsContact O-CG 3.25Å; I670-L674 WeakPolarHBondContact O-CG 3.27Å; I670-L674 PolarHBondContact O-N 3.4Å; I670-I679 HydrophobicContact CG2-CG2 4.44Å; I670-F684 HydrophobicContact CB-CE1 3.8Å; I670-F684 HydrophobicContact CB-CZ 3.53Å; I670-F684 HydrophobicContact CD1-CD1 3.98Å; I670-F684 HydrophobicContact CD1-CE1 3.38Å; I670-F684 HydrophobicContact CD1-CZ 3.87Å; I670-F684 HydrophobicContact CG1-CE1 4.11Å; I670-F684 HydrophobicContact CG1-CZ 4.28Å; I670-F684 HydrophobicContact CG2-CE1 4.04Å; I670-F684 HydrophobicContact CG2-CE2 3.98Å; I670-F684 HydrophobicContact CG2-CZ 3.35Å
671	A	74	Confident	67.8	Low	1 Å²	1	59.3 Å²	59.3	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-55.4	-46.1	176.5	0	0	0	0	0	111.6	P548 Y667 E668 R673 L674 E675	P548-A671 HydrophobicContact CB-CB 3.98Å; P548-A671 HydrophobicContact CG-CB 4.09Å; Y667-A671 HydrophobicContact CE2-CB 4.25Å; Y667-A671 VanDerWaalsContact O-CB 3.26Å; Y667-A671 WeakPolarHBondContact O-CB 3.48Å; Y667-A671 PolarHBondContact O-N 3.36Å; E668-A671 PolarHBondContact O-N 3.11Å; A671-R673 VanDerWaalsContact C-N 3.31Å; A671-R673 PolarHBondContact O-N 3.24Å; A671-L674 WeakPolarHBondContact O-CB 3.44Å; A671-L674 PolarHBondContact O-N 3.25Å; A671-E675 PolarHBondContact O-N 3.01Å
672	D	69.1	Low	65.8	Low	100 Å²	100	67.3 Å²	67.3	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-62.4	-37.4	174.8	-75.7	-7	0	0	0	112.3	E668 I670 H676	E668-D672 PolarHBondContact O-N 2.97Å; I670-D672 VanDerWaalsContact C-N 3.32Å; I670-D672 PolarHBondContact O-N 3.31Å; D672-H676 PolarHBondContact O-ND1 2.89Å
673	R	64.6	Low	64.1	Low	138 Å²	138	68.2 Å²	68.2	52%	0.521	35%	0.346	S	S	.	.	H	α-helix	trans	-74.3	-30.2	176.5	-71.4	175.8	-174.8	-171.3	3.7	112.8	I669 I670 A671 E675 H676 Q677 I679	I669-R673 VanDerWaalsContact O-CG 3.28Å; I669-R673 WeakPolarHBondContact O-CG 3.47Å; I669-R673 PolarHBondContact O-N 3.09Å; I670-R673 CarbonylContact O-C 3.59Å; I670-R673 WeakPolarHBondContact O-CA 3.29Å; I670-R673 WeakPolarHBondContact O-CB 3.21Å; I670-R673 PolarHBondContact O-N 3.2Å; A671-R673 VanDerWaalsContact C-N 3.31Å; A671-R673 PolarHBondContact O-N 3.24Å; R673-E675 PolarHBondContact O-N 3.01Å; R673-H676 CarbonylContact O-C 3.59Å; R673-H676 WeakPolarHBondContact O-CA 3.46Å; R673-H676 PolarHBondContact O-N 3.22Å; R673-Q677 PolarHBondContact O-N 3.32Å; R673-I679 HydrophobicContact CB-CD1 3.78Å
674	L	59.4	Low	62.8	Low	27 Å²	27	67.4 Å²	67.4	14%	0.141	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-32.8	175.8	-74	171.3	0	0	0	111.2	P548 W619 I670 A671 H676 I679	P548-L674 HydrophobicContact CG-CD1 4.31Å; W619-L674 HydrophobicContact CE3-CD1 4.27Å; I670-L674 HydrophobicContact CG2-CD1 4Å; I670-L674 HydrophobicContact CG2-CG 4.02Å; I670-L674 VanDerWaalsContact O-CG 3.25Å; I670-L674 WeakPolarHBondContact O-CG 3.27Å; I670-L674 PolarHBondContact O-N 3.4Å; A671-L674 WeakPolarHBondContact O-CB 3.44Å; A671-L674 PolarHBondContact O-N 3.25Å; L674-H676 PolarHBondContact O-N 2.83Å; L674-I679 HydrophobicContact CD2-CB 3.69Å; L674-I679 WeakPolarHBondContact CD2-O 3.32Å
675	E	49.8	Very low	61.6	Low	87 Å²	87	73.7 Å²	73.7	41%	0.407	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-17.8	171	-70.9	-165.2	161.2	0	0	113.3	R622 A671 R673	R622-E675 VanDerWaalsContact NH1-C 3.28Å; R622-E675 PolarHBondContact NH1-O 3.41Å; A671-E675 PolarHBondContact O-N 3.01Å; R673-E675 PolarHBondContact O-N 3.01Å
676	H	42.9	Very low	60.8	Low	151 Å²	151	74.2 Å²	74.2	70%	0.699	38%	0.382	S	S	*	.	H	α-helix	trans	-120.8	-26	-171	-65.6	82.1	0	0	0	114.7	D672 R673 L674	D672-H676 PolarHBondContact O-ND1 2.89Å; R673-H676 CarbonylContact O-C 3.59Å; R673-H676 WeakPolarHBondContact O-CA 3.46Å; R673-H676 PolarHBondContact O-N 3.22Å; L674-H676 PolarHBondContact O-N 2.83Å
677	Q	43.1	Very low	60.7	Low	153 Å²	153	71.6 Å²	71.6	72%	0.715	37%	0.366	S	S	*	.	H	α-helix	trans	-140.8	3.9	-164.9	-64.6	-163.7	-12.8	0	0	117.3	R673 I679	R673-Q677 PolarHBondContact O-N 3.32Å; Q677-I679 PolarHBondContact O-N 3.33Å
678	G	40.5	Very low	60.8	Low	68 Å²	68	71.7 Å²	71.7	70%	0.701	37%	0.367	S	S	*	.			trans	64.7	35.9	168.8	0	0	0	0	0	115.4
679	I	39.7	Very low	60.7	Low	44 Å²	44	72.5 Å²	72.5	23%	0.226	37%	0.369	C	S	.	.			trans	-62.2	144.8	172.1	-57.5	175.5	0	0	0	108.9	I670 R673 L674 Q677 D683	I670-I679 HydrophobicContact CG2-CG2 4.44Å; R673-I679 HydrophobicContact CB-CD1 3.78Å; L674-I679 HydrophobicContact CD2-CB 3.69Å; L674-I679 WeakPolarHBondContact CD2-O 3.32Å; Q677-I679 PolarHBondContact O-N 3.33Å; I679-D683 WeakPolarHBondContact CG2-OD2 3.49Å
680	S	46.4	Very low	60.6	Low	50 Å²	50	71.1 Å²	71.1	35%	0.35	36%	0.361	S	S	.	.			trans	-92.1	144.6	174.4	86.2	0	0	0	0	109.4	R682 D683	S680-R682 PolarHBondContact O-N 2.79Å; S680-R682 WeakPolarHBondContact OG-CB 3.39Å; S680-R682 WeakPolarHBondContact OG-CG 3.41Å; S680-D683 PolarHBondContact O-N 2.89Å
681	G	46.3	Very low	61.2	Low	2 Å²	2	70.5 Å²	70.5	2%	0.021	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-61.8	7.5	179.8	0	0	0	0	0	115.9	D683	G681-D683 PolarHBondContact O-N 3.27Å
682	R	48.2	Very low	61.8	Low	196 Å²	196	70.7 Å²	70.7	74%	0.74	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-69.3	-16.7	173.3	-64.9	-174.5	-175.5	-160.3	0.4	113.7	S680 F684	S680-R682 PolarHBondContact O-N 2.79Å; S680-R682 WeakPolarHBondContact OG-CB 3.39Å; S680-R682 WeakPolarHBondContact OG-CG 3.41Å; R682-F684 VanDerWaalsContact C-N 3.28Å; R682-F684 PolarHBondContact O-N 3.46Å
683	D	52	Low	62.4	Low	97 Å²	97	66.5 Å²	66.5	52%	0.519	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-83	-6.3	-175.9	-61.1	-20.2	0	0	0	113	I679 S680 G681	I679-D683 WeakPolarHBondContact CG2-OD2 3.49Å; S680-D683 PolarHBondContact O-N 2.89Å; G681-D683 PolarHBondContact O-N 3.27Å
684	F	60	Low	63.4	Low	11 Å²	11	60.5 Å²	60.5	5%	0.048	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-81	125	174.8	-65.9	-63.3	0	0	0	111.9	W619 Y667 I670 R682 F688 K689	W619-F684 HydrophobicContact CH2-CE2 4.41Å; W619-F684 HydrophobicContact CZ2-CD2 4.36Å; W619-F684 HydrophobicContact CZ2-CE2 4.16Å; Y667-F684 AromaticContact CD2-CE1 3.95Å; Y667-F684 HydrophobicContact CD2-CE1 3.95Å; Y667-F684 HydrophobicContact CD2-CE2 4.29Å; Y667-F684 AromaticContact CD2-CZ 3.62Å; Y667-F684 HydrophobicContact CD2-CZ 3.62Å; Y667-F684 HydrophobicContact CE2-CZ 4.33Å; I670-F684 HydrophobicContact CB-CE1 3.8Å; I670-F684 HydrophobicContact CB-CZ 3.53Å; I670-F684 HydrophobicContact CD1-CD1 3.98Å; I670-F684 HydrophobicContact CD1-CE1 3.38Å; I670-F684 HydrophobicContact CD1-CZ 3.87Å; I670-F684 HydrophobicContact CG1-CE1 4.11Å; I670-F684 HydrophobicContact CG1-CZ 4.28Å; I670-F684 HydrophobicContact CG2-CE1 4.04Å; I670-F684 HydrophobicContact CG2-CE2 3.98Å; I670-F684 HydrophobicContact CG2-CZ 3.35Å; R682-F684 VanDerWaalsContact C-N 3.28Å; R682-F684 PolarHBondContact O-N 3.46Å; F684-F688 HydrophobicContact CB-CD1 4.41Å; F684-F688 HydrophobicContact CD1-CD1 4.25Å; F684-F688 HydrophobicContact CD1-CE1 4.47Å; F684-F688 HydrophobicContact CG-CD1 4.27Å; F684-K689 HydrophobicContact CB-CB 4.21Å
685	L	63.1	Low	64.8	Low	132 Å²	132	60.6 Å²	60.6	69%	0.691	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-74.3	142.9	174.4	-65.3	169.7	0	0	0	110.4
686	P	71.4	Confident	66.4	Low	75 Å²	75	57 Å²	57	49%	0.487	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	147.7	160.3	-22.2	33.4	0	0	0	109.9	Q663	Q663-P686 PolarHBondContact NE2-O 3.37Å; Q663-P686 VanDerWaalsContact NE2-O 3.08Å
687	P	82.4	Confident	68.4	Low	17 Å²	17	50 Å²	50	11%	0.11	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	cis	-87.5	-16.2	7.9	28	-33.6	0	0	0	116.7	F573 I574 I577 M659 Q663 K689 Q690 Y691	F573-P687 HydrophobicContact CD1-CB 4.29Å; F573-P687 HydrophobicContact CE1-CB 4.21Å; I574-P687 HydrophobicContact CB-CG 4.44Å; I574-P687 HydrophobicContact CD1-CG 3.6Å; I574-P687 HydrophobicContact CG1-CB 4.11Å; I574-P687 HydrophobicContact CG1-CG 3.42Å; I574-P687 VanDerWaalsContact CG1-CG 3.42Å; I574-P687 HydrophobicContact CG2-CG 4.5Å; I577-P687 HydrophobicContact CD1-CB 4.27Å; M659-P687 HydrophobicContact SD-CG 4.21Å; Q663-P687 VanDerWaalsContact NE2-CD 3.33Å; P687-K689 VanDerWaalsContact C-N 3.33Å; P687-K689 PolarHBondContact O-N 3.26Å; P687-Q690 PolarHBondContact O-N 2.93Å; P687-Q690 VanDerWaalsContact O-N 3.08Å; P687-Y691 PolarHBondContact O-N 3.36Å
688	F	85.3	Confident	70.6	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-54	-44.6	-176.5	176.4	-100.6	0	0	0	113.6	L546 L570 Q663 L664 Y667 F684 Q690 Y691 A692	L546-F688 HydrophobicContact CD2-CE2 3.78Å; L546-F688 HydrophobicContact CD2-CZ 3.75Å; L570-F688 HydrophobicContact CD1-CB 4.48Å; L570-F688 HydrophobicContact CD1-CD2 4.49Å; L570-F688 HydrophobicContact CD2-CB 4.49Å; L570-F688 HydrophobicContact CD2-CD2 3.87Å; Q663-F688 HydrophobicContact CB-CB 4.07Å; L664-F688 HydrophobicContact CD2-CD2 4.22Å; L664-F688 HydrophobicContact CD2-CE2 3.75Å; Y667-F688 AromaticContact CD1-CZ 3.99Å; Y667-F688 HydrophobicContact CD1-CZ 3.99Å; Y667-F688 AromaticContact CD2-CE1 3.51Å; Y667-F688 HydrophobicContact CD2-CE1 3.51Å; Y667-F688 AromaticContact CD2-CZ 3.55Å; Y667-F688 HydrophobicContact CD2-CZ 3.55Å; Y667-F688 HydrophobicContact CE1-CZ 4.41Å; Y667-F688 HydrophobicContact CE2-CE1 4.21Å; Y667-F688 HydrophobicContact CE2-CZ 4.07Å; Y667-F688 AromaticContact CG-CE1 3.8Å; Y667-F688 HydrophobicContact CG-CE1 3.8Å; Y667-F688 HydrophobicContact CG-CE2 4.33Å; Y667-F688 AromaticContact CG-CZ 3.5Å; Y667-F688 HydrophobicContact CG-CZ 3.5Å; Y667-F688 VanDerWaalsContact CG-CZ 3.5Å; F684-F688 HydrophobicContact CB-CD1 4.41Å; F684-F688 HydrophobicContact CD1-CD1 4.25Å; F684-F688 HydrophobicContact CD1-CE1 4.47Å; F684-F688 HydrophobicContact CG-CD1 4.27Å; F688-Q690 VanDerWaalsContact C-N 3.3Å; F688-Q690 PolarHBondContact O-N 3.03Å; F688-Y691 WeakPolarHBondContact O-CB 3.47Å; F688-Y691 PolarHBondContact O-N 3.34Å; F688-A692 HydrophobicContact CE1-CB 4.35Å; F688-A692 HydrophobicContact CZ-CB 4.34Å; F688-A692 WeakPolarHBondContact O-CB 3.48Å; F688-A692 PolarHBondContact O-N 2.91Å
689	K	80.8	Confident	72.8	Confident	59 Å²	59	39.8 Å²	39.8	26%	0.257	20%	0.2	S	C	.	.	H	α-helix	trans	-57.1	-44.4	178.8	-171.9	-167.3	179	-151.7	0	112.1	E212 F684 P687 S693	E212-K689 WeakPolarHBondContact OE2-CE 3.17Å; E212-K689 IonicContact OE2-NZ 2.76Å; E212-K689 PolarHBondContact OE2-NZ 2.75Å; F684-K689 HydrophobicContact CB-CB 4.21Å; P687-K689 VanDerWaalsContact C-N 3.33Å; P687-K689 PolarHBondContact O-N 3.26Å; K689-S693 VanDerWaalsContact O-CB 3.3Å; K689-S693 WeakPolarHBondContact O-CB 3.44Å; K689-S693 PolarHBondContact O-N 3.34Å; K689-S693 PolarHBondContact O-OG 3.42Å
690	Q	79.2	Confident	75.1	Confident	63 Å²	63	37.7 Å²	37.7	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-67.5	-43.7	179.9	-67.6	179.6	-8.4	0	0	110.7	F573 P687 F688 S693 L694	F573-Q690 HydrophobicContact CE1-CB 3.99Å; F573-Q690 HydrophobicContact CZ-CB 3.99Å; P687-Q690 PolarHBondContact O-N 2.93Å; P687-Q690 VanDerWaalsContact O-N 3.08Å; F688-Q690 VanDerWaalsContact C-N 3.3Å; F688-Q690 PolarHBondContact O-N 3.03Å; Q690-S693 PolarHBondContact O-N 3.5Å; Q690-L694 VanDerWaalsContact O-CG 3.29Å; Q690-L694 WeakPolarHBondContact O-CG 3.49Å; Q690-L694 PolarHBondContact O-N 2.93Å
691	Y	87	Confident	77	Confident	8 Å²	8	35.4 Å²	35.4	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-55.9	-57.5	174.7	175.6	-94.5	0	0	0	111.2	E542 L546 V566 N569 L570 F573 P687 F688 S693 L694 R695	E542-Y691 VanDerWaalsContact OE1-CZ 3.26Å; E542-Y691 PolarHBondContact OE1-OH 3.44Å; E542-Y691 PolarHBondContact OE2-OH 3.31Å; L546-Y691 HydrophobicContact CD1-CE1 4.26Å; L546-Y691 HydrophobicContact CD2-CE1 4.49Å; V566-Y691 HydrophobicContact CG1-CE1 4.05Å; N569-Y691 HydrophobicContact CB-CE2 3.92Å; N569-Y691 WeakPolarHBondContact CB-OH 3.46Å; L570-Y691 HydrophobicContact CD1-CD1 4.13Å; L570-Y691 HydrophobicContact CD1-CD2 4.24Å; L570-Y691 HydrophobicContact CD1-CG 3.74Å; F573-Y691 HydrophobicContact CB-CD2 3.67Å; F573-Y691 HydrophobicContact CB-CE2 4.25Å; F573-Y691 AromaticContact CD1-CD2 3.98Å; F573-Y691 HydrophobicContact CD1-CD2 3.98Å; F573-Y691 HydrophobicContact CD1-CG 4.31Å; F573-Y691 HydrophobicContact CD2-CD2 4.4Å; F573-Y691 AromaticContact CG-CD2 3.79Å; F573-Y691 HydrophobicContact CG-CD2 3.79Å; P687-Y691 PolarHBondContact O-N 3.36Å; F688-Y691 WeakPolarHBondContact O-CB 3.47Å; F688-Y691 PolarHBondContact O-N 3.34Å; Y691-S693 VanDerWaalsContact C-N 3.3Å; Y691-S693 PolarHBondContact O-N 3.29Å; Y691-L694 PolarHBondContact O-N 2.72Å; Y691-L694 VanDerWaalsContact O-N 3.17Å; Y691-R695 HydrophobicContact CD1-CG 4.43Å; Y691-R695 HydrophobicContact CD2-CG 4.47Å; Y691-R695 HydrophobicContact CE1-CG 4.02Å; Y691-R695 HydrophobicContact CE2-CG 4.13Å; Y691-R695 VanDerWaalsContact O-CG 3.27Å; Y691-R695 WeakPolarHBondContact O-CG 3.25Å; Y691-R695 PolarHBondContact O-N 3.15Å
692	A	85.7	Confident	78.7	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-42.4	-178.7	0	0	0	0	0	111.6	L546 F688 L694 R695 M696	L546-A692 HydrophobicContact CD1-CB 4.42Å; L546-A692 HydrophobicContact CD2-CB 3.91Å; F688-A692 HydrophobicContact CE1-CB 4.35Å; F688-A692 HydrophobicContact CZ-CB 4.34Å; F688-A692 WeakPolarHBondContact O-CB 3.48Å; F688-A692 PolarHBondContact O-N 2.91Å; A692-L694 PolarHBondContact O-N 3.07Å; A692-R695 PolarHBondContact O-N 3.04Å; A692-M696 WeakPolarHBondContact O-CB 3.45Å; A692-M696 VanDerWaalsContact O-CG 3.22Å; A692-M696 WeakPolarHBondContact O-CG 3.45Å; A692-M696 PolarHBondContact O-N 2.93Å
693	S	83.2	Confident	79.7	Confident	13 Å²	13	26.2 Å²	26.2	9%	0.091	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-42.3	178.8	-57.5	0	0	0	0	112	K689 Q690 Y691 R695 S697	K689-S693 VanDerWaalsContact O-CB 3.3Å; K689-S693 WeakPolarHBondContact O-CB 3.44Å; K689-S693 PolarHBondContact O-N 3.34Å; K689-S693 PolarHBondContact O-OG 3.42Å; Q690-S693 PolarHBondContact O-N 3.5Å; Y691-S693 VanDerWaalsContact C-N 3.3Å; Y691-S693 PolarHBondContact O-N 3.29Å; S693-R695 PolarHBondContact O-N 3.19Å; S693-S697 WeakPolarHBondContact O-CB 3.38Å; S693-S697 PolarHBondContact O-N 3.34Å
694	L	85	Confident	79.5	Confident	11 Å²	11	22.4 Å²	22.4	6%	0.058	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-40.2	177.1	-73.1	170.3	0	0	0	111.6	R184 L208 Q251 F573 Q690 Y691 A692 S697	R184-L694 HydrophobicContact CB-CD1 4.39Å; R184-L694 HydrophobicContact CB-CD2 4.29Å; R184-L694 HydrophobicContact CG-CD1 4.3Å; L208-L694 HydrophobicContact CD1-CD2 3.84Å; L208-L694 HydrophobicContact CD1-CG 4.08Å; L208-L694 HydrophobicContact CG-CD2 4.2Å; Q251-L694 PolarHBondContact NE2-O 2.78Å; F573-L694 HydrophobicContact CE2-CD1 3.54Å; F573-L694 HydrophobicContact CZ-CD1 3.71Å; Q690-L694 VanDerWaalsContact O-CG 3.29Å; Q690-L694 WeakPolarHBondContact O-CG 3.49Å; Q690-L694 PolarHBondContact O-N 2.93Å; Y691-L694 PolarHBondContact O-N 2.72Å; Y691-L694 VanDerWaalsContact O-N 3.17Å; A692-L694 PolarHBondContact O-N 3.07Å; L694-S697 PolarHBondContact O-N 3.32Å; L694-S697 PolarHBondContact O-OG 3.27Å
695	R	88.6	Confident	78.9	Confident	30 Å²	30	22.7 Å²	22.7	11%	0.113	12%	0.122	C	C	.	.	H	α-helix	trans	-72.2	-42.5	-179.2	-60	-64.7	-67.9	173.2	-12.5	111.6	E542 I543 L546 Y691 A692 S693 S697 I698	E542-R695 VanDerWaalsContact CD-NE 3.32Å; E542-R695 WeakPolarHBondContact OE1-CD 3.33Å; E542-R695 WeakPolarHBondContact OE1-CG 3.4Å; E542-R695 IonicContact OE1-CZ 3.44Å; E542-R695 IonicContact OE1-NE 3.4Å; E542-R695 PolarHBondContact OE1-NE 3.34Å; E542-R695 IonicContact OE1-NH2 3.87Å; E542-R695 IonicContact OE2-CZ 3.47Å; E542-R695 IonicContact OE2-NE 3.37Å; E542-R695 PolarHBondContact OE2-NE 3.49Å; E542-R695 IonicContact OE2-NH2 2.62Å; E542-R695 PolarHBondContact OE2-NH2 3.13Å; I543-R695 HydrophobicContact CD1-CB 4.18Å; I543-R695 WeakPolarHBondContact CD1-O 3.39Å; L546-R695 HydrophobicContact CD1-CB 3.83Å; L546-R695 HydrophobicContact CD1-CG 4.47Å; Y691-R695 HydrophobicContact CD1-CG 4.43Å; Y691-R695 HydrophobicContact CD2-CG 4.47Å; Y691-R695 HydrophobicContact CE1-CG 4.02Å; Y691-R695 HydrophobicContact CE2-CG 4.13Å; Y691-R695 VanDerWaalsContact O-CG 3.27Å; Y691-R695 WeakPolarHBondContact O-CG 3.25Å; Y691-R695 PolarHBondContact O-N 3.15Å; A692-R695 PolarHBondContact O-N 3.04Å; S693-R695 PolarHBondContact O-N 3.19Å; R695-S697 PolarHBondContact O-N 3.48Å; R695-I698 WeakPolarHBondContact O-CB 3.48Å; R695-I698 WeakPolarHBondContact O-CD1 3.39Å; R695-I698 VanDerWaalsContact O-CG1 3.3Å; R695-I698 WeakPolarHBondContact O-CG1 3.18Å; R695-I698 PolarHBondContact O-N 2.94Å
696	M	84.3	Confident	78	Confident	11 Å²	11	18.2 Å²	18.2	5%	0.054	10%	0.098	C	C	.	.	H	α-helix	trans	-66.6	-25	174.6	-66.3	-61.5	-74.6	0	0	112.8	P487 I489 I543 L546 N547 A692 I698	P487-M696 HydrophobicContact CB-CB 4.44Å; P487-M696 WeakPolarHBondContact CB-O 3.47Å; I489-M696 WeakPolarHBondContact CG2-O 3.23Å; I543-M696 HydrophobicContact CD1-SD 3.79Å; I543-M696 HydrophobicContact CG2-SD 4.04Å; L546-M696 HydrophobicContact CB-SD 4.3Å; N547-M696 HydrophobicContact CB-CE 4.43Å; A692-M696 WeakPolarHBondContact O-CB 3.45Å; A692-M696 VanDerWaalsContact O-CG 3.22Å; A692-M696 WeakPolarHBondContact O-CG 3.45Å; A692-M696 PolarHBondContact O-N 2.93Å; M696-I698 PolarHBondContact O-N 3.27Å
697	S	84.2	Confident	76.7	Confident	4 Å²	4	18.6 Å²	18.6	3%	0.028	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-6.8	176.4	73.9	0	0	0	0	115.5	S693 L694 R695	S693-S697 WeakPolarHBondContact O-CB 3.38Å; S693-S697 PolarHBondContact O-N 3.34Å; L694-S697 PolarHBondContact O-N 3.32Å; L694-S697 PolarHBondContact O-OG 3.27Å; R695-S697 PolarHBondContact O-N 3.48Å
698	I	88.9	Confident	74.6	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.088	C	C	.	.	S	Bend	trans	-62.9	127.3	175.5	-62.1	165.4	0	0	0	108.3	S186 Q251 R252 L273 I489 L539 R695 M696	S186-I698 WeakPolarHBondContact OG-CG1 3.3Å; Q251-I698 HydrophobicContact CG-CD1 4.49Å; Q251-I698 HydrophobicContact CG-CG1 4.34Å; R252-I698 HydrophobicContact CB-CD1 4.32Å; R252-I698 HydrophobicContact CB-CG2 4.34Å; R252-I698 HydrophobicContact CG-CG2 4.41Å; L273-I698 HydrophobicContact CD2-CG2 4.19Å; I489-I698 VanDerWaalsContact CB-O 3.28Å; I489-I698 WeakPolarHBondContact CB-O 3.47Å; I489-I698 HydrophobicContact CD1-CB 3.86Å; I489-I698 HydrophobicContact CD1-CG2 3.78Å; I489-I698 WeakPolarHBondContact CG2-O 3.49Å; L539-I698 HydrophobicContact CD1-CD1 3.64Å; L539-I698 HydrophobicContact CD2-CD1 4.08Å; R695-I698 WeakPolarHBondContact O-CB 3.48Å; R695-I698 WeakPolarHBondContact O-CD1 3.39Å; R695-I698 VanDerWaalsContact O-CG1 3.3Å; R695-I698 WeakPolarHBondContact O-CG1 3.18Å; R695-I698 PolarHBondContact O-N 2.94Å; M696-I698 PolarHBondContact O-N 3.27Å
699	P	87.9	Confident	72.6	Confident	6 Å²	6	17.7 Å²	17.7	4%	0.039	9%	0.087	C	C	.	.			trans	-72.5	135.5	178.8	30.8	-36.3	0	0	0	110.3	T254 L701	T254-P699 WeakPolarHBondContact CB-O 3.48Å; T254-P699 WeakPolarHBondContact CG2-O 3.45Å; T254-P699 PolarHBondContact OG1-O 2.98Å; P699-L701 VanDerWaalsContact C-N 3.25Å; P699-L701 PolarHBondContact O-N 3.32Å
700	A	86.8	Confident	70.9	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-71.9	-22.2	172.9	0	0	0	0	0	113.3	F276 T488 A492	F276-A700 HydrophobicContact CB-CB 4.44Å; F276-A700 PolarHBondContact N-O 3.37Å; T488-A700 WeakPolarHBondContact OG1-CB 3.46Å; T488-A700 PolarHBondContact OG1-N 3.44Å; A492-A700 HydrophobicContact CB-CB 3.56Å
701	L	86.6	Confident	68.9	Low	2 Å²	2	14.8 Å²	14.8	1%	0.01	8%	0.082	C	C	.	.	S	Bend	trans	-114.3	142.8	-173.8	-54.9	-171.6	0	0	0	110.3	T254 F276 A277 Y331 L481 P699 M703	T254-L701 VanDerWaalsContact CG2-C 3.4Å; F276-L701 HydrophobicContact CB-CD2 3.98Å; A277-L701 HydrophobicContact CB-CD1 4.47Å; A277-L701 HydrophobicContact CB-CD2 3.53Å; A277-L701 VanDerWaalsContact N-CD2 3.34Å; Y331-L701 WeakPolarHBondContact OH-CD1 3.48Å; L481-L701 VanDerWaalsContact C-CD1 3.47Å; L481-L701 HydrophobicContact CB-CD1 4.05Å; L481-L701 HydrophobicContact CB-CD2 4.2Å; L481-L701 HydrophobicContact CB-CG 4.3Å; L481-L701 WeakPolarHBondContact O-CD1 3.27Å; P699-L701 VanDerWaalsContact C-N 3.25Å; P699-L701 PolarHBondContact O-N 3.32Å; L701-M703 PolarHBondContact O-N 3.32Å; L701-M703 VanDerWaalsContact O-N 3.1Å
702	S	83.1	Confident	66.8	Low	2 Å²	2	14.8 Å²	14.8	1%	0.014	8%	0.083	C	C	.	.	S	Bend	trans	-60.8	-16	168.5	55.3	0	0	0	0	112.4	S188 F189 C275	S188-S702 WeakPolarHBondContact CB-O 3.49Å; S188-S702 PolarHBondContact OG-O 2.8Å; F189-S702 VanDerWaalsContact O-CB 3.31Å; F189-S702 WeakPolarHBondContact O-CB 2.78Å; C275-S702 PolarHBondContact SG-N 3.32Å; C275-S702 PolarHBondContact SG-OG 2.84Å; C275-S702 VanDerWaalsContact SG-OG 3.34Å
703	M	68.4	Low	64.9	Low	3 Å²	3	14.8 Å²	14.8	2%	0.015	8%	0.084	C	C	.	.			trans	-136.6	71.5	-161.7	-107.8	-55	-153.6	0	0	112.4	D190 W192 Y331 L701 A708 F709	D190-M703 HydrophobicContact CB-CE 3.68Å; D190-M703 HydrophobicContact CB-CG 3.36Å; D190-M703 HydrophobicContact CB-SD 3.68Å; D190-M703 VanDerWaalsContact CG-CE 3.41Å; D190-M703 WeakPolarHBondContact OD1-CG 3.07Å; D190-M703 WeakPolarHBondContact OD2-CE 3.43Å; D190-M703 VanDerWaalsContact OD2-CG 3.26Å; D190-M703 WeakPolarHBondContact OD2-CG 3.33Å; W192-M703 HydrophobicContact CZ3-CE 4.25Å; Y331-M703 WeakPolarHBondContact CE2-O 3.31Å; Y331-M703 PolarHBondContact OH-O 3.31Å; L701-M703 PolarHBondContact O-N 3.32Å; L701-M703 VanDerWaalsContact O-N 3.1Å; M703-A708 HydrophobicContact CE-CB 4.05Å; M703-F709 HydrophobicContact CB-CE2 3.34Å; M703-F709 HydrophobicContact CB-CZ 3.4Å; M703-F709 VanDerWaalsContact CB-CZ 3.4Å; M703-F709 HydrophobicContact CE-CD1 3.82Å; M703-F709 HydrophobicContact CE-CD2 3.41Å; M703-F709 VanDerWaalsContact CE-CD2 3.41Å; M703-F709 HydrophobicContact CE-CE1 3.79Å; M703-F709 HydrophobicContact CE-CE2 3.44Å; M703-F709 VanDerWaalsContact CE-CE2 3.44Å; M703-F709 HydrophobicContact CE-CG 3.62Å; M703-F709 HydrophobicContact CE-CZ 3.6Å; M703-F709 HydrophobicContact CG-CD2 4.21Å; M703-F709 HydrophobicContact CG-CE1 4.06Å; M703-F709 HydrophobicContact CG-CE2 3.21Å; M703-F709 HydrophobicContact CG-CZ 3.08Å; M703-F709 HydrophobicContact SD-CD2 3.41Å; M703-F709 WeakPolarHBondContact SD-CD2 3.37Å; M703-F709 HydrophobicContact SD-CE1 4.25Å; M703-F709 HydrophobicContact SD-CE2 2.98Å; M703-F709 WeakPolarHBondContact SD-CE2 3.46Å; M703-F709 HydrophobicContact SD-CG 4.23Å; M703-F709 HydrophobicContact SD-CZ 3.44Å; M703-F709 WeakPolarHBondContact SD-CZ 3.31Å
704	P	48.7	Very low	63.2	Low	16 Å²	16	17.4 Å²	17.4	10%	0.104	9%	0.092	C	C	.	.			trans	-82.4	-25.6	-177	26.8	-26.2	0	0	0	113	S188 T204 H206 F484 E706	S188-P704 WeakPolarHBondContact OG-CD 3.34Å; T204-P704 HydrophobicContact CG2-CG 4.4Å; H206-P704 WeakPolarHBondContact CE1-CG 3.37Å; F484-P704 VanDerWaalsContact CB-O 3.26Å; F484-P704 WeakPolarHBondContact CB-O 3.35Å; P704-E706 PolarHBondContact O-N 3.28Å
705	S	47.5	Very low	61.4	Low	18 Å²	18	17.8 Å²	17.8	13%	0.126	9%	0.094	C	C	.	.			trans	-89.5	97.6	-179.6	60.1	0	0	0	0	110.6	Q707 A708 F709 E736	S705-Q707 PolarHBondContact O-N 3.05Å; S705-A708 PolarHBondContact O-N 3.44Å; S705-A708 WeakPolarHBondContact OG-CB 3.37Å; S705-A708 PolarHBondContact OG-N 3.42Å; S705-F709 WeakPolarHBondContact O-CD2 3.31Å; S705-F709 PolarHBondContact O-N 3.18Å; S705-E736 PolarHBondContact OG-OE2 3.05Å
706	E	42.5	Very low	59.5	Low	38 Å²	38	20 Å²	20	18%	0.178	11%	0.105	C	C	.	.	H	α-helix	trans	-44.9	-28.9	160.5	-157.7	178.9	-155.7	0	0	111.2	W330 P704 S710	W330-E706 WeakPolarHBondContact CH2-O 3.37Å; W330-E706 HydrophobicContact CZ3-CG 4.23Å; W330-E706 WeakPolarHBondContact CZ3-O 3.26Å; P704-E706 PolarHBondContact O-N 3.28Å; E706-S710 WeakPolarHBondContact O-CB 3.27Å; E706-S710 PolarHBondContact O-N 3.48Å; E706-S710 VanDerWaalsContact O-N 3.1Å
707	Q	44.1	Very low	57.8	Low	82 Å²	82	27.6 Å²	27.6	38%	0.383	13%	0.134	S	C	.	.	H	α-helix	trans	-67.8	-42.9	172.5	-73.1	-170.5	14	0	0	115.4	R130 S705 F709 S710 A711 C735 E736	R130-Q707 PolarHBondContact NH1-O 2.59Å; R130-Q707 PolarHBondContact NH2-O 3.35Å; S705-Q707 PolarHBondContact O-N 3.05Å; Q707-F709 PolarHBondContact O-N 2.86Å; Q707-S710 PolarHBondContact O-N 2.86Å; Q707-A711 PolarHBondContact O-N 2.99Å; Q707-C735 PolarHBondContact OE1-O 3.14Å; Q707-E736 HydrophobicContact CB-CG 4.09Å
708	A	39.4	Very low	56	Low	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-36.2	178.7	0	0	0	0	0	110.5	M703 S705 S710 A711 S712 E736	M703-A708 HydrophobicContact CE-CB 4.05Å; S705-A708 PolarHBondContact O-N 3.44Å; S705-A708 WeakPolarHBondContact OG-CB 3.37Å; S705-A708 PolarHBondContact OG-N 3.42Å; A708-S710 VanDerWaalsContact C-N 3.35Å; A708-A711 WeakPolarHBondContact O-CB 3.47Å; A708-S712 WeakPolarHBondContact O-CB 2.88Å; A708-S712 PolarHBondContact O-N 3.41Å; A708-S712 PolarHBondContact O-OG 2.95Å; A708-E736 WeakPolarHBondContact CA-OE1 3.44Å; A708-E736 WeakPolarHBondContact CB-OE1 3.34Å; A708-E736 PolarHBondContact N-OE1 3.11Å
709	F	43.4	Very low	54.1	Low	1 Å²	1	32.9 Å²	32.9	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-70.5	-33.3	173.7	-69.7	-96.5	0	0	0	111.8	W330 Y331 N334 R338 M703 S705 Q707 A711 S712 G713	W330-F709 HydrophobicContact CH2-CB 2.97Å; W330-F709 HydrophobicContact CH2-CG 4.21Å; W330-F709 WeakPolarHBondContact CH2-O 3.38Å; W330-F709 HydrophobicContact CZ2-CB 3.77Å; W330-F709 WeakPolarHBondContact CZ2-O 3.36Å; W330-F709 HydrophobicContact CZ3-CB 3.55Å; W330-F709 HydrophobicContact CZ3-CG 4.46Å; Y331-F709 HydrophobicContact CD2-CD2 4.49Å; Y331-F709 HydrophobicContact CD2-CE2 4.11Å; Y331-F709 HydrophobicContact CE2-CD2 4.28Å; Y331-F709 AromaticContact CE2-CE2 3.56Å; Y331-F709 HydrophobicContact CE2-CE2 3.56Å; Y331-F709 HydrophobicContact CE2-CZ 4.14Å; N334-F709 HydrophobicContact CB-CD1 4.3Å; R338-F709 VanDerWaalsContact NH1-CD1 3.27Å; M703-F709 HydrophobicContact CB-CE2 3.34Å; M703-F709 HydrophobicContact CB-CZ 3.4Å; M703-F709 VanDerWaalsContact CB-CZ 3.4Å; M703-F709 HydrophobicContact CE-CD1 3.82Å; M703-F709 HydrophobicContact CE-CD2 3.41Å; M703-F709 VanDerWaalsContact CE-CD2 3.41Å; M703-F709 HydrophobicContact CE-CE1 3.79Å; M703-F709 HydrophobicContact CE-CE2 3.44Å; M703-F709 VanDerWaalsContact CE-CE2 3.44Å; M703-F709 HydrophobicContact CE-CG 3.62Å; M703-F709 HydrophobicContact CE-CZ 3.6Å; M703-F709 HydrophobicContact CG-CD2 4.21Å; M703-F709 HydrophobicContact CG-CE1 4.06Å; M703-F709 HydrophobicContact CG-CE2 3.21Å; M703-F709 HydrophobicContact CG-CZ 3.08Å; M703-F709 HydrophobicContact SD-CD2 3.41Å; M703-F709 WeakPolarHBondContact SD-CD2 3.37Å; M703-F709 HydrophobicContact SD-CE1 4.25Å; M703-F709 HydrophobicContact SD-CE2 2.98Å; M703-F709 WeakPolarHBondContact SD-CE2 3.46Å; M703-F709 HydrophobicContact SD-CG 4.23Å; M703-F709 HydrophobicContact SD-CZ 3.44Å; M703-F709 WeakPolarHBondContact SD-CZ 3.31Å; S705-F709 WeakPolarHBondContact O-CD2 3.31Å; S705-F709 PolarHBondContact O-N 3.18Å; Q707-F709 PolarHBondContact O-N 2.86Å; F709-A711 VanDerWaalsContact C-N 3.26Å; F709-A711 CarbonylContact O-C 3.48Å; F709-A711 PolarHBondContact O-N 3.07Å; F709-S712 VanDerWaalsContact C-N 3.33Å; F709-S712 CarbonylContact O-C 3.5Å; F709-S712 WeakPolarHBondContact O-CA 3.15Å; F709-S712 WeakPolarHBondContact O-CB 3.3Å; F709-S712 PolarHBondContact O-N 2.99Å; F709-G713 PolarHBondContact O-N 3.46Å
710	S	43.7	Very low	51.9	Low	53 Å²	53	40.4 Å²	40.4	37%	0.371	20%	0.196	S	C	.	.	H	α-helix	trans	-77.2	-32.4	-169.6	166.8	0	0	0	0	107.9	R130 E706 Q707 A708 Y714	R130-S710 PolarHBondContact NH1-OG 3.36Å; E706-S710 WeakPolarHBondContact O-CB 3.27Å; E706-S710 PolarHBondContact O-N 3.48Å; E706-S710 VanDerWaalsContact O-N 3.1Å; Q707-S710 PolarHBondContact O-N 2.86Å; A708-S710 VanDerWaalsContact C-N 3.35Å; S710-Y714 WeakPolarHBondContact O-CB 3.16Å; S710-Y714 PolarHBondContact O-N 3.23Å
711	A	37.7	Very low	49.7	Very low	7 Å²	7	43.1 Å²	43.1	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-56	-78	151.6	0	0	0	0	0	107.6	Q707 A708 F709 G713 Y714 L715 T732	Q707-A711 PolarHBondContact O-N 2.99Å; A708-A711 WeakPolarHBondContact O-CB 3.47Å; F709-A711 VanDerWaalsContact C-N 3.26Å; F709-A711 CarbonylContact O-C 3.48Å; F709-A711 PolarHBondContact O-N 3.07Å; A711-G713 PolarHBondContact O-N 2.91Å; A711-G713 VanDerWaalsContact O-N 3.09Å; A711-Y714 CarbonylContact O-C 3.56Å; A711-Y714 VanDerWaalsContact O-C 3.31Å; A711-Y714 WeakPolarHBondContact O-CA 3.37Å; A711-Y714 WeakPolarHBondContact O-CB 3.27Å; A711-Y714 PolarHBondContact O-N 3.32Å; A711-L715 HydrophobicContact CB-CD1 4.01Å; A711-L715 HydrophobicContact CB-CD2 4.15Å; A711-L715 HydrophobicContact CB-CG 4.15Å; A711-L715 VanDerWaalsContact O-CG 3.26Å; A711-L715 WeakPolarHBondContact O-CG 3.49Å; A711-L715 PolarHBondContact O-N 3.06Å; A711-T732 HydrophobicContact CB-CG2 4.01Å
712	S	44.1	Very low	47.6	Very low	8 Å²	8	45 Å²	45	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-40.3	-51.7	-169.4	-53.9	0	0	0	0	117.5	W192 A708 F709 Y714 L715 Q716	W192-S712 WeakPolarHBondContact CZ2-OG 3.24Å; A708-S712 WeakPolarHBondContact O-CB 2.88Å; A708-S712 PolarHBondContact O-N 3.41Å; A708-S712 PolarHBondContact O-OG 2.95Å; F709-S712 VanDerWaalsContact C-N 3.33Å; F709-S712 CarbonylContact O-C 3.5Å; F709-S712 WeakPolarHBondContact O-CA 3.15Å; F709-S712 WeakPolarHBondContact O-CB 3.3Å; F709-S712 PolarHBondContact O-N 2.99Å; S712-Y714 VanDerWaalsContact C-N 3.3Å; S712-Y714 PolarHBondContact O-N 3.37Å; S712-L715 CarbonylContact O-C 3.49Å; S712-L715 WeakPolarHBondContact O-CA 3.22Å; S712-L715 WeakPolarHBondContact O-CB 3.46Å; S712-L715 PolarHBondContact O-N 2.91Å; S712-L715 VanDerWaalsContact O-N 3.1Å; S712-Q716 WeakPolarHBondContact O-CB 3.31Å; S712-Q716 PolarHBondContact O-N 3.09Å
713	G	45	Very low	45.8	Very low	5 Å²	5	51.9 Å²	51.9	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-72.3	-21	177.5	0	0	0	0	0	113.7	F709 A711 R717	F709-G713 PolarHBondContact O-N 3.46Å; A711-G713 PolarHBondContact O-N 2.91Å; A711-G713 VanDerWaalsContact O-N 3.09Å; G713-R717 PolarHBondContact O-NE 3.19Å
714	Y	46.7	Very low	45.3	Very low	68 Å²	68	56.7 Å²	56.7	27%	0.267	30%	0.297	S	S	.	.	H	α-helix	trans	-81.4	-34.8	163.3	-178.7	-95.5	0	0	0	112	R130 S710 A711 S712 R717 K718	R130-Y714 WeakPolarHBondContact O-CE1 3.13Å; R130-Y714 PolarHBondContact O-OH 3.09Å; S710-Y714 WeakPolarHBondContact O-CB 3.16Å; S710-Y714 PolarHBondContact O-N 3.23Å; A711-Y714 CarbonylContact O-C 3.56Å; A711-Y714 VanDerWaalsContact O-C 3.31Å; A711-Y714 WeakPolarHBondContact O-CA 3.37Å; A711-Y714 WeakPolarHBondContact O-CB 3.27Å; A711-Y714 PolarHBondContact O-N 3.32Å; S712-Y714 VanDerWaalsContact C-N 3.3Å; S712-Y714 PolarHBondContact O-N 3.37Å; Y714-R717 CarbonylContact O-C 3.5Å; Y714-R717 PolarHBondContact O-N 3.29Å; Y714-K718 HydrophobicContact CD1-CD 4.19Å; Y714-K718 HydrophobicContact CD1-CG 4.39Å; Y714-K718 HydrophobicContact CD2-CD 4.47Å; Y714-K718 HydrophobicContact CE1-CD 3.58Å; Y714-K718 HydrophobicContact CE1-CG 4.26Å; Y714-K718 HydrophobicContact CE2-CD 3.89Å; Y714-K718 HydrophobicContact CE2-CG 4.47Å; Y714-K718 VanDerWaalsContact CZ-CD 3.44Å; Y714-K718 WeakPolarHBondContact O-CB 3.47Å; Y714-K718 PolarHBondContact O-N 3.16Å; Y714-K718 WeakPolarHBondContact OH-CE 3.44Å; Y714-K718 PolarHBondContact OH-NZ 3.14Å
715	L	47.2	Very low	45.8	Very low	18 Å²	18	57.6 Å²	57.6	9%	0.094	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-41.2	177.1	-55.8	174.7	0	0	0	110.1	F221 A711 S712 R717 K718 E719 L728	F221-L715 HydrophobicContact CE1-CD1 4.47Å; F221-L715 HydrophobicContact CE2-CD1 4.41Å; F221-L715 HydrophobicContact CZ-CD1 3.97Å; A711-L715 HydrophobicContact CB-CD1 4.01Å; A711-L715 HydrophobicContact CB-CD2 4.15Å; A711-L715 HydrophobicContact CB-CG 4.15Å; A711-L715 VanDerWaalsContact O-CG 3.26Å; A711-L715 WeakPolarHBondContact O-CG 3.49Å; A711-L715 PolarHBondContact O-N 3.06Å; S712-L715 CarbonylContact O-C 3.49Å; S712-L715 WeakPolarHBondContact O-CA 3.22Å; S712-L715 WeakPolarHBondContact O-CB 3.46Å; S712-L715 PolarHBondContact O-N 2.91Å; S712-L715 VanDerWaalsContact O-N 3.1Å; L715-R717 VanDerWaalsContact C-N 3.29Å; L715-R717 PolarHBondContact O-N 3.45Å; L715-K718 CarbonylContact O-C 3.51Å; L715-K718 PolarHBondContact O-N 3.38Å; L715-K718 VanDerWaalsContact O-N 3.17Å; L715-E719 PolarHBondContact O-N 3.48Å; L715-L728 HydrophobicContact CB-CD1 3.9Å; L715-L728 HydrophobicContact CB-CD2 3.97Å; L715-L728 HydrophobicContact CB-CG 4.18Å; L715-L728 HydrophobicContact CD1-CD1 4.08Å; L715-L728 HydrophobicContact CD1-CD2 3.62Å; L715-L728 HydrophobicContact CD1-CG 3.54Å; L715-L728 HydrophobicContact CD2-CD1 3.09Å; L715-L728 HydrophobicContact CD2-CD2 4.29Å; L715-L728 HydrophobicContact CD2-CG 3.53Å; L715-L728 HydrophobicContact CG-CD1 3.69Å; L715-L728 HydrophobicContact CG-CD2 3.98Å; L715-L728 HydrophobicContact CG-CG 3.76Å
716	Q	49.4	Very low	46.6	Very low	76 Å²	76	59.8 Å²	59.8	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-33.5	175.4	-162.4	172.9	6.5	0	0	111.9	S712	S712-Q716 WeakPolarHBondContact O-CB 3.31Å; S712-Q716 PolarHBondContact O-N 3.09Å
717	R	47.7	Very low	47.9	Very low	172 Å²	172	58.4 Å²	58.4	65%	0.649	31%	0.31	S	S	*	.	H	α-helix	trans	-79.1	-22.5	174.5	-76.7	-175.7	-92.7	-156.6	-7.4	113.3	G713 Y714 L715	G713-R717 PolarHBondContact O-NE 3.19Å; Y714-R717 CarbonylContact O-C 3.5Å; Y714-R717 PolarHBondContact O-N 3.29Å; L715-R717 VanDerWaalsContact C-N 3.29Å; L715-R717 PolarHBondContact O-N 3.45Å
718	K	46.6	Very low	48.9	Very low	51 Å²	51	55.9 Å²	55.9	22%	0.222	30%	0.299	C	S	.	.	H	α-helix	trans	-116.3	-3.1	-174.5	-69.5	-152.1	-177.8	-179	0	116.7	P132 Y714 L715 L720 A721 A722	P132-K718 HydrophobicContact CG-CD 3.95Å; Y714-K718 HydrophobicContact CD1-CD 4.19Å; Y714-K718 HydrophobicContact CD1-CG 4.39Å; Y714-K718 HydrophobicContact CD2-CD 4.47Å; Y714-K718 HydrophobicContact CE1-CD 3.58Å; Y714-K718 HydrophobicContact CE1-CG 4.26Å; Y714-K718 HydrophobicContact CE2-CD 3.89Å; Y714-K718 HydrophobicContact CE2-CG 4.47Å; Y714-K718 VanDerWaalsContact CZ-CD 3.44Å; Y714-K718 WeakPolarHBondContact O-CB 3.47Å; Y714-K718 PolarHBondContact O-N 3.16Å; Y714-K718 WeakPolarHBondContact OH-CE 3.44Å; Y714-K718 PolarHBondContact OH-NZ 3.14Å; L715-K718 CarbonylContact O-C 3.51Å; L715-K718 PolarHBondContact O-N 3.38Å; L715-K718 VanDerWaalsContact O-N 3.17Å; K718-L720 PolarHBondContact O-N 2.81Å; K718-A721 HydrophobicContact CB-CB 4.33Å; K718-A721 HydrophobicContact CG-CB 4.37Å; K718-A721 CarbonylContact O-C 3.57Å; K718-A721 WeakPolarHBondContact O-CA 3.49Å; K718-A721 PolarHBondContact O-N 3.19Å; K718-A722 PolarHBondContact O-N 2.83Å
719	E	49.2	Very low	50.5	Low	64 Å²	64	58.1 Å²	58.1	30%	0.299	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.9	160.6	-98.3	-167.1	163.9	0	0	110.3	Y200 R223 L715 A721	Y200-E719 VanDerWaalsContact OH-CD 3.25Å; Y200-E719 PolarHBondContact OH-OE1 3.47Å; Y200-E719 PolarHBondContact OH-OE2 3.05Å; R223-E719 IonicContact CZ-OE1 3.71Å; R223-E719 IonicContact NE-OE1 3.26Å; R223-E719 IonicContact NH1-OE1 2.65Å; R223-E719 PolarHBondContact NH1-OE1 3.01Å; L715-E719 PolarHBondContact O-N 3.48Å; E719-A721 VanDerWaalsContact C-N 3.28Å; E719-A721 PolarHBondContact O-N 3.49Å
720	L	41.3	Very low	52.2	Low	164 Å²	164	59.6 Å²	59.6	86%	0.859	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-8.3	170.9	-71.3	163.2	0	0	0	114.5	K718	K718-L720 PolarHBondContact O-N 2.81Å
721	A	41.5	Very low	53.7	Low	58 Å²	58	58.1 Å²	58.1	48%	0.479	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-12.8	-168.8	0	0	0	0	0	116.2	K718 E719	K718-A721 HydrophobicContact CB-CB 4.33Å; K718-A721 HydrophobicContact CG-CB 4.37Å; K718-A721 CarbonylContact O-C 3.57Å; K718-A721 WeakPolarHBondContact O-CA 3.49Å; K718-A721 PolarHBondContact O-N 3.19Å; E719-A721 VanDerWaalsContact C-N 3.28Å; E719-A721 PolarHBondContact O-N 3.49Å
722	A	42.2	Very low	55.3	Low	40 Å²	40	57.9 Å²	57.9	33%	0.331	30%	0.302	S	S	.	.	S	Bend	trans	-149.8	142.3	-177.4	0	0	0	0	0	114.3	K718	K718-A722 PolarHBondContact O-N 2.83Å
723	N	45.8	Very low	57	Low	147 Å²	147	57.9 Å²	57.9	79%	0.786	30%	0.301	S	S	*	.			trans	-72.5	133.6	-163	-62.8	-43.4	0	0	0	116.2
724	N	57.2	Low	58.6	Low	104 Å²	104	58.7 Å²	58.7	56%	0.556	31%	0.305	S	S	*	.			trans	64.9	125.9	164.8	-162.5	-8.5	0	0	0	117.6	V726 G727	N724-V726 PolarHBondContact O-N 3.4Å; N724-V726 PolarHBondContact OD1-N 2.8Å; N724-G727 PolarHBondContact O-N 3.25Å
725	V	60.2	Low	59.7	Low	35 Å²	35	56.7 Å²	56.7	21%	0.212	30%	0.301	C	S	.	.	H	α-helix	trans	-46.2	-43	174.7	-176	0	0	0	0	112.3	R223 G727 L728 E729	R223-V725 HydrophobicContact CB-CG1 3.78Å; R223-V725 HydrophobicContact CG-CG1 4.43Å; V725-G727 PolarHBondContact O-N 2.93Å; V725-L728 WeakPolarHBondContact O-CA 3.44Å; V725-L728 WeakPolarHBondContact O-CB 3.18Å; V725-L728 PolarHBondContact O-N 2.82Å; V725-E729 HydrophobicContact CG1-CG 4.42Å; V725-E729 WeakPolarHBondContact CG1-OE1 3.29Å; V725-E729 WeakPolarHBondContact O-CG 3.38Å; V725-E729 PolarHBondContact O-N 3.45Å; V725-E729 VanDerWaalsContact O-N 3.16Å
726	V	64.1	Low	60.5	Low	65 Å²	65	56.7 Å²	56.7	39%	0.394	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-36	-179	-179.8	0	0	0	0	112.3	N724 L728 M730	N724-V726 PolarHBondContact O-N 3.4Å; N724-V726 PolarHBondContact OD1-N 2.8Å; V726-L728 VanDerWaalsContact C-N 3.28Å; V726-L728 PolarHBondContact O-N 3.1Å; V726-M730 HydrophobicContact CG1-CE 3.7Å; V726-M730 HydrophobicContact CG1-SD 4.18Å; V726-M730 VanDerWaalsContact O-CG 3.3Å; V726-M730 WeakPolarHBondContact O-CG 3.25Å; V726-M730 PolarHBondContact O-N 3.01Å
727	G	69.1	Low	60.9	Low	8 Å²	8	56.9 Å²	56.9	8%	0.082	31%	0.31	C	S	.	.	H	α-helix	trans	-68.7	-31	176.8	0	0	0	0	0	112.3	N724 V725 M731	N724-G727 PolarHBondContact O-N 3.25Å; V725-G727 PolarHBondContact O-N 2.93Å; G727-M731 VanDerWaalsContact O-CB 3.29Å; G727-M731 WeakPolarHBondContact O-CB 3.4Å; G727-M731 WeakPolarHBondContact O-CG 3.37Å; G727-M731 PolarHBondContact O-N 3.15Å
728	L	66.1	Low	61.6	Low	29 Å²	29	51.2 Å²	51.2	15%	0.152	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-48.3	178.6	-153	78.7	0	0	0	111.4	F221 L715 V725 V726 M731 T732	F221-L728 HydrophobicContact CE1-CD2 4.38Å; L715-L728 HydrophobicContact CB-CD1 3.9Å; L715-L728 HydrophobicContact CB-CD2 3.97Å; L715-L728 HydrophobicContact CB-CG 4.18Å; L715-L728 HydrophobicContact CD1-CD1 4.08Å; L715-L728 HydrophobicContact CD1-CD2 3.62Å; L715-L728 HydrophobicContact CD1-CG 3.54Å; L715-L728 HydrophobicContact CD2-CD1 3.09Å; L715-L728 HydrophobicContact CD2-CD2 4.29Å; L715-L728 HydrophobicContact CD2-CG 3.53Å; L715-L728 HydrophobicContact CG-CD1 3.69Å; L715-L728 HydrophobicContact CG-CD2 3.98Å; L715-L728 HydrophobicContact CG-CG 3.76Å; V725-L728 WeakPolarHBondContact O-CA 3.44Å; V725-L728 WeakPolarHBondContact O-CB 3.18Å; V725-L728 PolarHBondContact O-N 2.82Å; V726-L728 VanDerWaalsContact C-N 3.28Å; V726-L728 PolarHBondContact O-N 3.1Å; L728-M731 PolarHBondContact O-N 3.39Å; L728-T732 WeakPolarHBondContact O-CB 3.38Å; L728-T732 PolarHBondContact O-N 3.36Å; L728-T732 PolarHBondContact O-OG1 3.13Å
729	E	71.4	Confident	62.3	Low	47 Å²	47	51.2 Å²	51.2	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-49.9	179	-60.7	173.6	170.7	0	0	109.8	F221 V725 M731 T732 F733	F221-E729 HydrophobicContact CB-CG 4.49Å; F221-E729 HydrophobicContact CD1-CG 4.1Å; F221-E729 VanDerWaalsContact O-CD 3.24Å; F221-E729 WeakPolarHBondContact O-CG 3.06Å; V725-E729 HydrophobicContact CG1-CG 4.42Å; V725-E729 WeakPolarHBondContact CG1-OE1 3.29Å; V725-E729 WeakPolarHBondContact O-CG 3.38Å; V725-E729 PolarHBondContact O-N 3.45Å; V725-E729 VanDerWaalsContact O-N 3.16Å; E729-M731 PolarHBondContact O-N 2.86Å; E729-T732 PolarHBondContact O-N 3.4Å; E729-F733 PolarHBondContact O-N 3.41Å
730	M	79.4	Confident	63.1	Low	32 Å²	32	50.4 Å²	50.4	16%	0.158	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-42.3	178.3	-68.3	177.4	176.1	0	0	112.7	L164 I165 Y168 V726 F733 V734	L164-M730 HydrophobicContact CD1-CB 4.15Å; L164-M730 HydrophobicContact CD2-CB 4.02Å; L164-M730 HydrophobicContact CG-CB 3.91Å; I165-M730 HydrophobicContact CB-SD 4.48Å; I165-M730 HydrophobicContact CG1-CE 4.3Å; I165-M730 HydrophobicContact CG1-SD 3.7Å; Y168-M730 HydrophobicContact CD1-CE 4.17Å; Y168-M730 HydrophobicContact CD1-CG 4.07Å; Y168-M730 HydrophobicContact CD2-CB 4.02Å; Y168-M730 HydrophobicContact CD2-CG 3.84Å; Y168-M730 HydrophobicContact CE1-CE 4.44Å; Y168-M730 HydrophobicContact CE2-CG 4.3Å; Y168-M730 HydrophobicContact CG-CB 4.11Å; Y168-M730 HydrophobicContact CG-CG 3.72Å; V726-M730 HydrophobicContact CG1-CE 3.7Å; V726-M730 HydrophobicContact CG1-SD 4.18Å; V726-M730 VanDerWaalsContact O-CG 3.3Å; V726-M730 WeakPolarHBondContact O-CG 3.25Å; V726-M730 PolarHBondContact O-N 3.01Å; M730-F733 PolarHBondContact O-N 2.76Å; M730-V734 WeakPolarHBondContact O-CB 3.45Å; M730-V734 VanDerWaalsContact O-CG2 3.3Å; M730-V734 WeakPolarHBondContact O-CG2 3.14Å; M730-V734 PolarHBondContact O-N 2.88Å
731	M	75.4	Confident	64.3	Low	22 Å²	22	43.8 Å²	43.8	11%	0.108	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-45.9	177	-79.7	-67.3	-59.8	0	0	111.2	F127 L133 L164 G727 L728 E729 V734 C735	F127-M731 HydrophobicContact CB-CE 4.33Å; F127-M731 HydrophobicContact CD1-CE 3.89Å; F127-M731 HydrophobicContact CD1-SD 3.37Å; F127-M731 WeakPolarHBondContact CD1-SD 3.49Å; F127-M731 HydrophobicContact CE1-SD 3.9Å; F127-M731 HydrophobicContact CG-SD 4.26Å; L133-M731 HydrophobicContact CD2-SD 4.1Å; L164-M731 HydrophobicContact CD1-CG 3.99Å; L164-M731 HydrophobicContact CD1-SD 3.52Å; L164-M731 VanDerWaalsContact CD1-SD 3.52Å; L164-M731 HydrophobicContact CD2-CG 3.57Å; L164-M731 HydrophobicContact CD2-SD 3.75Å; L164-M731 HydrophobicContact CG-CG 4.41Å; L164-M731 HydrophobicContact CG-SD 4.19Å; G727-M731 VanDerWaalsContact O-CB 3.29Å; G727-M731 WeakPolarHBondContact O-CB 3.4Å; G727-M731 WeakPolarHBondContact O-CG 3.37Å; G727-M731 PolarHBondContact O-N 3.15Å; L728-M731 PolarHBondContact O-N 3.39Å; E729-M731 PolarHBondContact O-N 2.86Å; M731-V734 PolarHBondContact O-N 3.39Å; M731-C735 WeakPolarHBondContact O-CB 3.38Å; M731-C735 PolarHBondContact O-N 2.9Å; M731-C735 PolarHBondContact O-SG 3.16Å
732	T	71.7	Confident	65.8	Low	3 Å²	3	42.9 Å²	42.9	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-45.7	-178.6	-49.5	0	0	0	0	110.1	L218 A711 L728 E729 V734 C735 E736	L218-T732 HydrophobicContact CD2-CG2 3.72Å; A711-T732 HydrophobicContact CB-CG2 4.01Å; L728-T732 WeakPolarHBondContact O-CB 3.38Å; L728-T732 PolarHBondContact O-N 3.36Å; L728-T732 PolarHBondContact O-OG1 3.13Å; E729-T732 PolarHBondContact O-N 3.4Å; T732-V734 PolarHBondContact O-N 2.83Å; T732-C735 PolarHBondContact O-N 2.85Å; T732-E736 WeakPolarHBondContact CG2-OE1 3.32Å; T732-E736 WeakPolarHBondContact O-CG 3.37Å; T732-E736 PolarHBondContact O-N 3.19Å; T732-E736 VanDerWaalsContact O-N 3.14Å
733	F	79	Confident	67.3	Low	8 Å²	8	43.1 Å²	43.1	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-49.5	174.3	-178.5	-84.9	0	0	0	112.8	Y168 R172 L175 L218 E729 M730 C735 E736 S737	Y168-F733 HydrophobicContact CD2-CB 3.74Å; Y168-F733 AromaticContact CD2-CD1 3.42Å; Y168-F733 HydrophobicContact CD2-CD1 3.42Å; Y168-F733 VanDerWaalsContact CD2-CD1 3.42Å; Y168-F733 HydrophobicContact CD2-CD2 4.49Å; Y168-F733 HydrophobicContact CD2-CE1 4.19Å; Y168-F733 AromaticContact CD2-CG 3.62Å; Y168-F733 HydrophobicContact CD2-CG 3.62Å; Y168-F733 HydrophobicContact CE2-CB 3.78Å; Y168-F733 AromaticContact CE2-CD1 3.8Å; Y168-F733 HydrophobicContact CE2-CD1 3.8Å; Y168-F733 HydrophobicContact CE2-CD2 4.05Å; Y168-F733 HydrophobicContact CE2-CE1 4.46Å; Y168-F733 AromaticContact CE2-CG 3.58Å; Y168-F733 HydrophobicContact CE2-CG 3.58Å; Y168-F733 HydrophobicContact CG-CD1 4.36Å; R172-F733 HydrophobicContact CB-CE1 4.25Å; R172-F733 HydrophobicContact CB-CZ 3.98Å; L175-F733 HydrophobicContact CD2-CE2 3.87Å; L175-F733 HydrophobicContact CD2-CZ 4.11Å; L218-F733 HydrophobicContact CD2-CB 4.47Å; L218-F733 VanDerWaalsContact O-CD2 3.23Å; L218-F733 WeakPolarHBondContact O-CD2 3.48Å; L218-F733 WeakPolarHBondContact O-CE2 3.41Å; E729-F733 PolarHBondContact O-N 3.41Å; M730-F733 PolarHBondContact O-N 2.76Å; F733-C735 VanDerWaalsContact C-N 3.3Å; F733-C735 PolarHBondContact O-N 3.48Å; F733-E736 PolarHBondContact O-N 3.39Å; F733-S737 PolarHBondContact O-N 3.15Å
734	V	78.8	Confident	68.9	Low	22 Å²	22	35.6 Å²	35.6	13%	0.133	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-26.9	-178.4	171.4	0	0	0	0	112.8	F127 L164 A167 M730 M731 T732 S737	F127-V734 HydrophobicContact CB-CG1 4.31Å; F127-V734 HydrophobicContact CD2-CG1 4.24Å; F127-V734 HydrophobicContact CG-CG1 4.46Å; L164-V734 HydrophobicContact CD1-CB 4.25Å; L164-V734 HydrophobicContact CD1-CG2 4.02Å; A167-V734 HydrophobicContact CB-CG1 3.98Å; A167-V734 HydrophobicContact CB-CG2 3.91Å; M730-V734 WeakPolarHBondContact O-CB 3.45Å; M730-V734 VanDerWaalsContact O-CG2 3.3Å; M730-V734 WeakPolarHBondContact O-CG2 3.14Å; M730-V734 PolarHBondContact O-N 2.88Å; M731-V734 PolarHBondContact O-N 3.39Å; T732-V734 PolarHBondContact O-N 2.83Å; V734-S737 PolarHBondContact O-OG 3.38Å
735	C	70.2	Confident	69.8	Low	26 Å²	26	30.4 Å²	30.4	18%	0.176	18%	0.18	C	C	.	.	H	α-helix	trans	-77.3	-25.1	175.6	-66.7	0	0	0	0	112.8	F127 Q707 M731 T732 F733	F127-C735 PolarHBondContact O-SG 2.7Å; Q707-C735 PolarHBondContact OE1-O 3.14Å; M731-C735 WeakPolarHBondContact O-CB 3.38Å; M731-C735 PolarHBondContact O-N 2.9Å; M731-C735 PolarHBondContact O-SG 3.16Å; T732-C735 PolarHBondContact O-N 2.85Å; F733-C735 VanDerWaalsContact C-N 3.3Å; F733-C735 PolarHBondContact O-N 3.48Å
736	E	63.7	Low	70.6	Confident	17 Å²	17	30 Å²	30	8%	0.079	18%	0.177	C	C	.	.	H	α-helix	trans	-98.6	-12.9	-177.5	-70	-174.3	-156.1	0	0	113.7	R217 L218 S705 Q707 A708 T732 F733	R217-E736 VanDerWaalsContact CD-O 3.23Å; R217-E736 WeakPolarHBondContact CD-O 3.5Å; R217-E736 PolarHBondContact NE-O 3.39Å; L218-E736 HydrophobicContact CB-CB 4.39Å; L218-E736 WeakPolarHBondContact CB-OE2 3.37Å; S705-E736 PolarHBondContact OG-OE2 3.05Å; Q707-E736 HydrophobicContact CB-CG 4.09Å; A708-E736 WeakPolarHBondContact CA-OE1 3.44Å; A708-E736 WeakPolarHBondContact CB-OE1 3.34Å; A708-E736 PolarHBondContact N-OE1 3.11Å; T732-E736 WeakPolarHBondContact CG2-OE1 3.32Å; T732-E736 WeakPolarHBondContact O-CG 3.37Å; T732-E736 PolarHBondContact O-N 3.19Å; T732-E736 VanDerWaalsContact O-N 3.14Å; F733-E736 PolarHBondContact O-N 3.39Å
737	S	58.2	Low	71.2	Confident	81 Å²	81	26.8 Å²	26.8	57%	0.566	16%	0.157	S	C	*	.			trans	-72.1	0	172.7	63	0	0	0	0	112.4	R217 F733 V734	R217-S737 VanDerWaalsContact CZ-O 3.28Å; R217-S737 PolarHBondContact NE-O 3.47Å; R217-S737 PolarHBondContact NH2-O 3.46Å; F733-S737 PolarHBondContact O-N 3.15Å; V734-S737 PolarHBondContact O-OG 3.38Å

Retrieved 737 of 737 residues in 591 ms (Link to these results)

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