A0A077Z8Z7_TRITR Loading...

Transporter, major facilitator family

AlphaFold DB , UniProt , Accession A0A077Z8Z7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 655 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	34.4	Very low	238 Å²	238	145.6 Å²	145.6	100%	1.172	71%	0.709	S	S	*	*				0	37.1	0	-91.2	177.1	164.7	0	0	110.7
2	D	33.6	Very low	34.4	Very low	112 Å²	112	144.9 Å²	144.9	60%	0.599	71%	0.711	S	S	*	*			trans	-117.9	6.1	-166.7	-73	-61.9	0	0	0	115.2	G4	D2-G4 PolarHBondContact O-N 3.22Å
3	C	31	Very low	34.3	Very low	123 Å²	123	144.5 Å²	144.5	83%	0.831	71%	0.712	S	S	*	*	H	α-helix	trans	-69.3	-19.9	175.7	-67.3	0	0	0	0	113.3
4	G	38.3	Very low	33.9	Very low	52 Å²	52	149.6 Å²	149.6	54%	0.536	72%	0.722	S	S	.	*	H	α-helix	trans	-78.2	-26.6	-179.7	0	0	0	0	0	114.5	D2	D2-G4 PolarHBondContact O-N 3.22Å
5	R	33.4	Very low	33.4	Very low	209 Å²	209	146 Å²	146	79%	0.789	72%	0.717	S	S	*	*	H	α-helix	trans	-82.8	-21.3	-170.5	-140	-177.7	-90.4	-169.6	-4.4	113.3
6	I	40.3	Very low	33.1	Very low	121 Å²	121	146.4 Å²	146.4	62%	0.621	73%	0.73	S	S	*	*	H	α-helix	trans	-85.4	-33.6	178.5	-60.3	175.9	0	0	0	111.3	N8 R9	I6-N8 PolarHBondContact O-N 3.13Å; I6-R9 PolarHBondContact O-N 3.08Å
7	A	39.4	Very low	32.8	Very low	59 Å²	59	151.2 Å²	151.2	49%	0.488	74%	0.738	S	S	.	*	H	α-helix	trans	-67.5	-33.1	-177.3	0	0	0	0	0	113.6	R9	A7-R9 VanDerWaalsContact C-N 3.35Å; A7-R9 PolarHBondContact O-N 3.13Å
8	N	35.7	Very low	32.4	Very low	103 Å²	103	153.8 Å²	153.8	55%	0.551	74%	0.744	S	S	*	*	H	α-helix	trans	-74.7	-24.1	-179	-74.2	-4.9	0	0	0	113.2	I6 W10 R11	I6-N8 PolarHBondContact O-N 3.13Å; N8-W10 PolarHBondContact O-N 3.3Å; N8-R11 PolarHBondContact O-N 3.11Å
9	R	33.1	Very low	32.1	Very low	207 Å²	207	151.8 Å²	151.8	78%	0.781	75%	0.748	S	S	*	*	H	α-helix	trans	-70.4	-19.3	179.6	-144.5	177.4	-169.6	-178.8	1.8	113.4	I6 A7	I6-R9 PolarHBondContact O-N 3.08Å; A7-R9 VanDerWaalsContact C-N 3.35Å; A7-R9 PolarHBondContact O-N 3.13Å
10	W	31.7	Very low	32.2	Very low	199 Å²	199	149.3 Å²	149.3	75%	0.754	74%	0.743	S	S	*	*	H	α-helix	trans	-87.5	-20	177.3	-71.6	87.4	0	0	0	113.3	N8	N8-W10 PolarHBondContact O-N 3.3Å
11	R	31.6	Very low	32.1	Very low	179 Å²	179	149.7 Å²	149.7	68%	0.675	75%	0.748	S	S	*	*	H	α-helix	trans	-84.2	-29	-177	-152.3	177.8	-69.8	-172.7	-1	112.6	N8 L13	N8-R11 PolarHBondContact O-N 3.11Å; R11-L13 VanDerWaalsContact C-N 3.29Å; R11-L13 PolarHBondContact O-N 2.94Å
12	D	33.6	Very low	32	Very low	137 Å²	137	145.7 Å²	145.7	73%	0.733	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-14.6	-177.4	-66.1	-19.1	0	0	0	113.8
13	L	33.9	Very low	31.8	Very low	139 Å²	139	148.2 Å²	148.2	73%	0.728	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-11.7	178.4	-90.6	156.7	0	0	0	114.5	R11	R11-L13 VanDerWaalsContact C-N 3.29Å; R11-L13 PolarHBondContact O-N 2.94Å
14	Y	28.2	Very low	31.7	Very low	216 Å²	216	147.4 Å²	147.4	85%	0.847	74%	0.74	S	S	*	*	S	Bend	trans	-124.1	11.9	-176.1	-82.3	-77.3	0	0	0	115.2
15	C	26.7	Very low	31.1	Very low	96 Å²	96	154 Å²	154	65%	0.649	76%	0.757	S	S	*	*			trans	-128.4	80.1	175.1	-76.8	0	0	0	0	110.8	R17	C15-R17 PolarHBondContact O-N 3.05Å
16	V	29	Very low	30.8	Very low	152 Å²	152	154.2 Å²	154.2	92%	0.921	76%	0.758	S	S	*	*			trans	-65	86.3	159	178.9	0	0	0	0	107.2
17	R	26.8	Very low	30	Very low	229 Å²	229	160.2 Å²	160.2	86%	0.864	77%	0.773	S	S	*	*			trans	-87.8	110.3	173.4	-161.9	173.9	-166.2	168.8	3.2	107.5	C15 S19	C15-R17 PolarHBondContact O-N 3.05Å; R17-S19 PolarHBondContact O-N 3.45Å; R17-S19 VanDerWaalsContact O-N 3.17Å
18	K	25.8	Very low	29.4	Very low	198 Å²	198	162.2 Å²	162.2	86%	0.861	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-48.8	117.1	164.1	-93.6	176.7	170.2	178.1	0	108.5
19	S	26.8	Very low	29	Very low	115 Å²	115	162.4 Å²	162.4	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-86.9	124.4	166.3	-163.4	0	0	0	0	107.9	R17	R17-S19 PolarHBondContact O-N 3.45Å; R17-S19 VanDerWaalsContact O-N 3.17Å
20	P	35	Very low	28.7	Very low	101 Å²	101	161.3 Å²	161.3	66%	0.656	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80	150.3	172.3	16.6	-3	0	0	0	110.9
21	D	28.8	Very low	28.4	Very low	158 Å²	158	162.4 Å²	162.4	85%	0.845	81%	0.807	S	S	*	*			trans	57.1	101.5	158.8	-52.3	-27.6	0	0	0	117.9
22	D	29.5	Very low	28.2	Very low	155 Å²	155	159.9 Å²	159.9	83%	0.829	82%	0.816	S	S	*	*			trans	-144.7	113.8	141.7	-145.9	-2.2	0	0	0	111.1	S24	D22-S24 PolarHBondContact O-N 3.02Å
23	D	28.8	Very low	27.8	Very low	165 Å²	165	162 Å²	162	88%	0.882	82%	0.816	S	S	*	*			trans	-61.8	99	177.8	-82.8	-44.1	0	0	0	110.6
24	S	29.2	Very low	27.4	Very low	105 Å²	105	160.6 Å²	160.6	73%	0.734	82%	0.817	S	S	*	*			trans	-130.2	55.7	166.3	54.5	0	0	0	0	111.7	D22 R26	D22-S24 PolarHBondContact O-N 3.02Å; S24-R26 VanDerWaalsContact C-N 3.31Å; S24-R26 PolarHBondContact O-N 3.08Å
25	Q	26.2	Very low	27.3	Very low	190 Å²	190	160.4 Å²	160.4	89%	0.888	82%	0.816	S	S	*	*			trans	-69.9	90.5	153.7	-79.8	-166.2	-2.6	0	0	110
26	R	25.8	Very low	27.3	Very low	215 Å²	215	161.8 Å²	161.8	81%	0.811	82%	0.822	S	S	*	*	S	Bend	trans	167.3	149.3	141	-97.9	173.1	152.4	148.6	-5.3	107.4	S24	S24-R26 VanDerWaalsContact C-N 3.31Å; S24-R26 PolarHBondContact O-N 3.08Å
27	W	24.9	Very low	27.3	Very low	247 Å²	247	162.8 Å²	162.8	94%	0.936	82%	0.817	S	S	*	*	S	Bend	trans	84.6	59.4	170.6	-46.2	87	0	0	0	116.8
28	A	25.7	Very low	27.4	Very low	101 Å²	101	156.9 Å²	156.9	84%	0.835	81%	0.81	S	S	*	*			trans	-161.6	61.4	146.9	0	0	0	0	0	111.6
29	S	26.9	Very low	27.6	Very low	107 Å²	107	152.8 Å²	152.8	75%	0.748	80%	0.802	S	S	*	*			trans	-75.3	139.4	149.9	53.1	0	0	0	0	107.7
30	E	28.5	Very low	28	Very low	183 Å²	183	152.6 Å²	152.6	86%	0.855	80%	0.801	S	S	*	*	S	Bend	trans	84.3	69.8	172.3	-54	177.3	164.5	0	0	117.1
31	R	25.2	Very low	28.1	Very low	222 Å²	222	154.1 Å²	154.1	84%	0.838	80%	0.8	S	S	*	*				-176.1	83.4	129.2	-101	172.3	-156.2	-168.8	6.8	108.8	Y33	R31-Y33 HydrophobicContact CB-CD2 4.38Å; R31-Y33 HydrophobicContact CG-CD2 4.41Å; R31-Y33 HydrophobicContact CG-CE2 4.36Å; R31-Y33 PolarHBondContact O-N 3.23Å
32	S	26.2	Very low	28.6	Very low	126 Å²	126	151 Å²	151	88%	0.881	79%	0.79	S	S	*	*			trans	-71.9	76.3	167.6	53.4	0	0	0	0	109.5
33	Y	26.3	Very low	29.3	Very low	183 Å²	183	152.5 Å²	152.5	72%	0.718	79%	0.792	S	S	*	*			trans	-81.5	112.7	155.8	-85	-83.4	0	0	0	106.7	R31 Y35	R31-Y33 HydrophobicContact CB-CD2 4.38Å; R31-Y33 HydrophobicContact CG-CD2 4.41Å; R31-Y33 HydrophobicContact CG-CE2 4.36Å; R31-Y33 PolarHBondContact O-N 3.23Å; Y33-Y35 VanDerWaalsContact C-N 3.27Å; Y33-Y35 PolarHBondContact O-N 2.85Å
34	S	25.3	Very low	30.1	Very low	109 Å²	109	148.5 Å²	148.5	76%	0.762	77%	0.768	S	S	*	*			trans	-62.3	84.2	177	54.6	0	0	0	0	110.4	T36	S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.39Å
35	Y	26	Very low	31	Very low	211 Å²	211	147.8 Å²	147.8	83%	0.827	76%	0.76	S	S	*	*			trans	-79.8	93.6	152.9	-77.6	-83.8	0	0	0	106.3	Y33 E37	Y33-Y35 VanDerWaalsContact C-N 3.27Å; Y33-Y35 PolarHBondContact O-N 2.85Å; Y35-E37 PolarHBondContact O-N 3.06Å
36	T	27.3	Very low	32.4	Very low	125 Å²	125	144 Å²	144	77%	0.767	74%	0.742	S	S	*	*			trans	-60.9	91.9	151.5	38.4	0	0	0	0	105.9	S34 S38	S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.39Å; T36-S38 PolarHBondContact O-N 3.17Å
37	E	27.7	Very low	34.2	Very low	173 Å²	173	136.6 Å²	136.6	81%	0.808	72%	0.715	S	S	*	*			trans	-56.8	92.6	149.9	-83	178	158	0	0	105.2	Y35 T39	Y35-E37 PolarHBondContact O-N 3.06Å; E37-T39 PolarHBondContact O-N 2.94Å
38	S	28.4	Very low	36.2	Very low	105 Å²	105	125.6 Å²	125.6	73%	0.734	68%	0.676	S	S	*	*			trans	-58.8	91.2	150.7	52.9	0	0	0	0	104.1	T36 S40	T36-S38 PolarHBondContact O-N 3.17Å; S38-S40 PolarHBondContact O-N 3.28Å
39	T	31.6	Very low	38.4	Very low	113 Å²	113	129 Å²	129	69%	0.693	68%	0.675	S	S	*	*			trans	-46.4	102.1	154.7	39.8	0	0	0	0	104.4	E37 E41	E37-T39 PolarHBondContact O-N 2.94Å; T39-E41 PolarHBondContact O-N 2.95Å
40	S	34.7	Very low	41.2	Very low	111 Å²	111	124.9 Å²	124.9	78%	0.776	65%	0.647	S	S	*	*			trans	-61.1	81.3	162.8	53	0	0	0	0	104.4	S38 S42	S38-S40 PolarHBondContact O-N 3.28Å; S40-S42 PolarHBondContact O-N 3.39Å
41	E	36.8	Very low	43.8	Very low	133 Å²	133	119.5 Å²	119.5	62%	0.621	63%	0.628	S	S	*	*			trans	-47.8	106	154.3	-76.2	-176.4	173	0	0	103	T39 E43 R251	T39-E41 PolarHBondContact O-N 2.95Å; E41-E43 PolarHBondContact O-N 2.83Å; E41-E43 VanDerWaalsContact O-N 3.1Å; E41-R251 IonicContact OE2-NH2 3.28Å; E41-R251 PolarHBondContact OE2-NH2 3.46Å
42	S	39.9	Very low	46.8	Very low	93 Å²	93	110.4 Å²	110.4	65%	0.65	60%	0.596	S	S	*	*			trans	-33.2	120.9	175.5	46.9	0	0	0	0	107.9	S40 E44	S40-S42 PolarHBondContact O-N 3.39Å; S42-E44 VanDerWaalsContact C-N 3.26Å; S42-E44 PolarHBondContact O-N 2.8Å
43	E	43	Very low	49.9	Very low	186 Å²	186	104.9 Å²	104.9	87%	0.869	56%	0.559	S	S	*	*			trans	-47.4	99.7	174	-71.5	177.2	156.3	0	0	106.9	E41 T45	E41-E43 PolarHBondContact O-N 2.83Å; E41-E43 VanDerWaalsContact O-N 3.1Å; E43-T45 PolarHBondContact O-N 2.88Å
44	E	45.9	Very low	53	Low	80 Å²	80	99.1 Å²	99.1	37%	0.374	56%	0.555	S	S	.	*			trans	-60.3	115	-175.2	-74.3	174.6	138.1	0	0	105.1	S42 E46 R247 R251	S42-E44 VanDerWaalsContact C-N 3.26Å; S42-E44 PolarHBondContact O-N 2.8Å; E44-E46 PolarHBondContact O-N 3.45Å; E44-R247 IonicContact OE1-CZ 3.72Å; E44-R247 IonicContact OE1-NH1 3.52Å; E44-R247 PolarHBondContact OE1-NH1 3.11Å; E44-R251 IonicContact OE2-CZ 3.44Å; E44-R251 IonicContact OE2-NH1 3.8Å; E44-R251 PolarHBondContact OE2-NH1 3.35Å; E44-R251 IonicContact OE2-NH2 2.76Å; E44-R251 PolarHBondContact OE2-NH2 3.27Å
45	T	47.6	Very low	56.3	Low	91 Å²	91	98.6 Å²	98.6	56%	0.558	54%	0.537	S	S	*	.			trans	-58.6	127	-167.2	48	0	0	0	0	109.9	E43 F47	E43-T45 PolarHBondContact O-N 2.88Å; T45-F47 PolarHBondContact O-N 3.2Å
46	E	56.3	Low	59.6	Low	111 Å²	111	88.5 Å²	88.5	52%	0.519	50%	0.498	S	S	.	.	S	Bend	trans	-60	-9.7	176.2	-159.8	168.9	-175.4	0	0	112.4	E44 E239	E44-E46 PolarHBondContact O-N 3.45Å; E46-E239 HydrophobicContact CG-CG 4.03Å
47	F	63.2	Low	62.9	Low	58 Å²	58	86.8 Å²	86.8	25%	0.254	48%	0.477	S	S	.	.	S	Bend	trans	-109.2	142.3	-170.2	-57.8	-81.6	0	0	0	112.2	T45 E49 W237 L585	T45-F47 PolarHBondContact O-N 3.2Å; F47-E49 PolarHBondContact O-N 3.08Å; F47-W237 HydrophobicContact CD1-CH2 4.23Å; F47-W237 AromaticContact CD1-CZ3 3.58Å; F47-W237 HydrophobicContact CD1-CZ3 3.58Å; F47-W237 HydrophobicContact CE1-CZ3 4.11Å; F47-L585 HydrophobicContact CD1-CB 4.12Å; F47-L585 HydrophobicContact CD1-CD2 4.24Å; F47-L585 HydrophobicContact CE1-CB 4.31Å
48	P	66.7	Low	66.2	Low	17 Å²	17	81 Å²	81	11%	0.11	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-61.4	133.9	170.7	25.5	-32	0	0	0	109.6	A50 L235 W237 P238	P48-A50 PolarHBondContact O-N 3.49Å; P48-L235 HydrophobicContact CB-CB 4.38Å; P48-L235 HydrophobicContact CB-CD2 4.18Å; P48-L235 HydrophobicContact CG-CB 4.33Å; P48-W237 VanDerWaalsContact CD-CZ3 3.46Å; P48-W237 HydrophobicContact CG-CD2 4.05Å; P48-W237 HydrophobicContact CG-CE3 4.06Å; P48-W237 HydrophobicContact CG-CH2 4.49Å; P48-W237 HydrophobicContact CG-CZ2 4.49Å; P48-W237 HydrophobicContact CG-CZ3 4.3Å; P48-P238 VanDerWaalsContact N-CD 3.34Å
49	E	73.7	Confident	69.5	Low	172 Å²	172	76 Å²	76	80%	0.804	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-62.5	123.9	170.9	-70.2	-176.5	173.4	0	0	109.2	F47	F47-E49 PolarHBondContact O-N 3.08Å
50	A	84.6	Confident	72.7	Confident	21 Å²	21	70.7 Å²	70.7	17%	0.174	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-66.3	128.3	178.4	0	0	0	0	0	109.4	P48 D52 E177	P48-A50 PolarHBondContact O-N 3.49Å; A50-D52 PolarHBondContact O-N 3.35Å; A50-E177 HydrophobicContact CB-CB 3.85Å
51	P	84.4	Confident	75.7	Confident	70 Å²	70	70.9 Å²	70.9	46%	0.455	37%	0.373	S	S	.	.			trans	-68.6	-16.6	-177.8	26.3	-35.7	0	0	0	113.6	G53 Y175	P51-G53 PolarHBondContact O-N 3.38Å; P51-Y175 WeakPolarHBondContact CD-O 3.47Å; P51-Y175 HydrophobicContact CG-CD1 3.52Å; P51-Y175 HydrophobicContact CG-CE1 3.99Å; P51-Y175 HydrophobicContact CG-CG 4.49Å
52	D	88.1	Confident	78.6	Confident	31 Å²	31	64.5 Å²	64.5	17%	0.166	34%	0.344	C	S	.	.	S	Bend	trans	50.5	31.2	178.3	-85.1	-41.3	0	0	0	113.9	A50 Y175 F176 E177 R178 R179	A50-D52 PolarHBondContact O-N 3.35Å; D52-Y175 PolarHBondContact N-O 2.88Å; D52-F176 WeakPolarHBondContact OD1-CA 3.21Å; D52-E177 PolarHBondContact OD1-N 3.28Å; D52-R178 PolarHBondContact OD1-N 2.74Å; D52-R178 WeakPolarHBondContact OD2-CB 3.45Å; D52-R178 VanDerWaalsContact OD2-CG 3.32Å; D52-R178 WeakPolarHBondContact OD2-CG 3.33Å; D52-R178 PolarHBondContact OD2-N 2.92Å; D52-R179 PolarHBondContact OD1-N 3.17Å
53	G	89.8	Confident	81.4	Confident	10 Å²	10	60.1 Å²	60.1	10%	0.103	31%	0.313	C	S	.	.	S	Bend	trans	159.6	-158.2	-177	0	0	0	0	0	113.8	P51 Y55 G56	P51-G53 PolarHBondContact O-N 3.38Å; G53-Y55 PolarHBondContact O-N 3.07Å; G53-G56 PolarHBondContact O-N 3.19Å
54	G	91.6	Very high	84	Confident	62 Å²	62	53 Å²	53	64%	0.639	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	-123.8	-179.6	0	0	0	0	0	112.4	G56 W57	G54-G56 PolarHBondContact O-N 3.07Å; G54-W57 PolarHBondContact O-N 3.06Å; G54-W57 VanDerWaalsContact O-N 3.14Å
55	Y	94.1	Very high	86.5	Confident	97 Å²	97	51.7 Å²	51.7	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.1	177.6	-160.3	-96.2	0	0	0	113.1	G53 W57 V58 V59 Y175 L231 R233	G53-Y55 PolarHBondContact O-N 3.07Å; Y55-W57 PolarHBondContact O-N 3.16Å; Y55-V58 HydrophobicContact CD1-CB 4.49Å; Y55-V58 HydrophobicContact CD2-CB 4.21Å; Y55-V58 HydrophobicContact CD2-CG2 4.06Å; Y55-V58 HydrophobicContact CE1-CB 4.46Å; Y55-V58 HydrophobicContact CE2-CB 4.18Å; Y55-V58 HydrophobicContact CE2-CG1 4.12Å; Y55-V58 HydrophobicContact CE2-CG2 4.24Å; Y55-V58 HydrophobicContact CG-CB 4.37Å; Y55-V58 WeakPolarHBondContact O-CA 3.27Å; Y55-V58 VanDerWaalsContact O-CB 3.32Å; Y55-V58 WeakPolarHBondContact O-CB 3.37Å; Y55-V58 PolarHBondContact O-N 3.29Å; Y55-V59 HydrophobicContact CD1-CG2 3.96Å; Y55-V59 HydrophobicContact CE1-CG2 4.07Å; Y55-V59 PolarHBondContact O-N 3.32Å; Y55-V59 VanDerWaalsContact O-N 3.11Å; Y55-Y175 HydrophobicContact CD1-CE1 4.45Å; Y55-L231 VanDerWaalsContact CE1-O 3.3Å; Y55-L231 WeakPolarHBondContact CE1-O 3.39Å; Y55-L231 PolarHBondContact OH-O 3.19Å; Y55-R233 HydrophobicContact CD1-CB 4.12Å; Y55-R233 HydrophobicContact CE1-CB 3.52Å
56	G	95.3	Very high	88.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-55.4	-32.7	172.6	0	0	0	0	0	112.8	G53 G54 V58 V59 V60 F176	G53-G56 PolarHBondContact O-N 3.19Å; G54-G56 PolarHBondContact O-N 3.07Å; G56-V58 VanDerWaalsContact C-N 3.34Å; G56-V58 PolarHBondContact O-N 2.77Å; G56-V59 WeakPolarHBondContact O-CB 3.45Å; G56-V59 PolarHBondContact O-N 3.11Å; G56-V60 WeakPolarHBondContact O-CG2 3.22Å; G56-V60 PolarHBondContact O-N 3.42Å; G56-F176 WeakPolarHBondContact O-CE2 3.48Å
57	W	97.3	Very high	90.8	Very high	88 Å²	88	42 Å²	42	33%	0.333	22%	0.222	S	C	.	.	H	α-helix	trans	-70.3	-28.9	174.9	-67.7	114.7	0	0	0	113.5	G54 Y55 V59 V60 F61 F176 M182 I186	G54-W57 PolarHBondContact O-N 3.06Å; G54-W57 VanDerWaalsContact O-N 3.14Å; Y55-W57 PolarHBondContact O-N 3.16Å; W57-V59 VanDerWaalsContact C-N 3.35Å; W57-V60 HydrophobicContact CE3-CB 4.33Å; W57-V60 HydrophobicContact CE3-CG1 4.39Å; W57-V60 HydrophobicContact CE3-CG2 4.39Å; W57-V60 PolarHBondContact O-N 3.05Å; W57-F61 WeakPolarHBondContact O-CB 3.43Å; W57-F61 PolarHBondContact O-N 2.98Å; W57-F176 HydrophobicContact CD2-CZ 4.12Å; W57-F176 HydrophobicContact CE3-CZ 4.31Å; W57-F176 HydrophobicContact CH2-CE1 4.47Å; W57-F176 HydrophobicContact CZ2-CE1 4.15Å; W57-F176 HydrophobicContact CZ2-CZ 4.49Å; W57-M182 HydrophobicContact CH2-CE 4.16Å; W57-M182 HydrophobicContact CH2-SD 4.44Å; W57-I186 HydrophobicContact CH2-CD1 4.38Å; W57-I186 HydrophobicContact CZ3-CD1 3.84Å
58	V	97.7	Very high	92.4	Very high	51 Å²	51	40.2 Å²	40.2	31%	0.309	22%	0.215	S	C	.	.	H	α-helix	trans	-68.6	-39.3	171.4	-177.5	0	0	0	0	110	Y55 G56 F61 A62 L231	Y55-V58 HydrophobicContact CD1-CB 4.49Å; Y55-V58 HydrophobicContact CD2-CB 4.21Å; Y55-V58 HydrophobicContact CD2-CG2 4.06Å; Y55-V58 HydrophobicContact CE1-CB 4.46Å; Y55-V58 HydrophobicContact CE2-CB 4.18Å; Y55-V58 HydrophobicContact CE2-CG1 4.12Å; Y55-V58 HydrophobicContact CE2-CG2 4.24Å; Y55-V58 HydrophobicContact CG-CB 4.37Å; Y55-V58 WeakPolarHBondContact O-CA 3.27Å; Y55-V58 VanDerWaalsContact O-CB 3.32Å; Y55-V58 WeakPolarHBondContact O-CB 3.37Å; Y55-V58 PolarHBondContact O-N 3.29Å; G56-V58 VanDerWaalsContact C-N 3.34Å; G56-V58 PolarHBondContact O-N 2.77Å; V58-F61 PolarHBondContact O-N 3.32Å; V58-A62 WeakPolarHBondContact O-CB 3.38Å; V58-A62 PolarHBondContact O-N 3.34Å; V58-L231 HydrophobicContact CG1-CB 4.49Å; V58-L231 HydrophobicContact CG1-CD2 4.32Å
59	V	97.2	Very high	93.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-41.9	174.8	177.3	0	0	0	0	111.3	Y55 G56 W57 F61 A62 A63 A171 V172 Y175	Y55-V59 HydrophobicContact CD1-CG2 3.96Å; Y55-V59 HydrophobicContact CE1-CG2 4.07Å; Y55-V59 PolarHBondContact O-N 3.32Å; Y55-V59 VanDerWaalsContact O-N 3.11Å; G56-V59 WeakPolarHBondContact O-CB 3.45Å; G56-V59 PolarHBondContact O-N 3.11Å; W57-V59 VanDerWaalsContact C-N 3.35Å; V59-F61 VanDerWaalsContact C-N 3.33Å; V59-F61 PolarHBondContact O-N 3.32Å; V59-A62 PolarHBondContact O-N 3.42Å; V59-A63 WeakPolarHBondContact O-CB 3.35Å; V59-A63 PolarHBondContact O-N 3.01Å; V59-A171 HydrophobicContact CG1-CB 3.74Å; V59-V172 HydrophobicContact CG1-CG2 4.27Å; V59-Y175 HydrophobicContact CB-CD2 4.21Å; V59-Y175 HydrophobicContact CB-CE2 4.43Å; V59-Y175 HydrophobicContact CG1-CD2 4.04Å; V59-Y175 HydrophobicContact CG1-CE2 4.41Å; V59-Y175 HydrophobicContact CG2-CD2 3.93Å; V59-Y175 HydrophobicContact CG2-CE1 4.37Å; V59-Y175 HydrophobicContact CG2-CE2 3.65Å; V59-Y175 HydrophobicContact CG2-CG 4.4Å
60	V	98	Very high	94.9	Very high	3 Å²	3	32 Å²	32	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-42.1	173.3	170.4	0	0	0	0	111.1	G56 W57 A63 F64 V172 F176 A183 I186	G56-V60 WeakPolarHBondContact O-CG2 3.22Å; G56-V60 PolarHBondContact O-N 3.42Å; W57-V60 HydrophobicContact CE3-CB 4.33Å; W57-V60 HydrophobicContact CE3-CG1 4.39Å; W57-V60 HydrophobicContact CE3-CG2 4.39Å; W57-V60 PolarHBondContact O-N 3.05Å; V60-A63 PolarHBondContact O-N 3.17Å; V60-F64 WeakPolarHBondContact O-CB 3.36Å; V60-F64 PolarHBondContact O-N 3.26Å; V60-V172 HydrophobicContact CG2-CG1 4.08Å; V60-V172 HydrophobicContact CG2-CG2 4.09Å; V60-F176 HydrophobicContact CG2-CD2 4.24Å; V60-F176 HydrophobicContact CG2-CE2 3.48Å; V60-F176 VanDerWaalsContact CG2-CE2 3.48Å; V60-F176 HydrophobicContact CG2-CZ 4.04Å; V60-A183 HydrophobicContact CG2-CB 3.83Å; V60-I186 HydrophobicContact CG1-CB 3.95Å; V60-I186 HydrophobicContact CG1-CG2 3.55Å
61	F	98	Very high	95.3	Very high	114 Å²	114	32.3 Å²	32.3	50%	0.5	18%	0.175	S	C	.	.	H	α-helix	trans	-63.8	-42.8	175.1	176.9	-99.6	0	0	0	112.3	W57 V58 V59 F64 M65	W57-F61 WeakPolarHBondContact O-CB 3.43Å; W57-F61 PolarHBondContact O-N 2.98Å; V58-F61 PolarHBondContact O-N 3.32Å; V59-F61 VanDerWaalsContact C-N 3.33Å; V59-F61 PolarHBondContact O-N 3.32Å; F61-F64 WeakPolarHBondContact O-CB 3.38Å; F61-F64 PolarHBondContact O-N 3.1Å; F61-M65 HydrophobicContact CD2-CE 4.3Å; F61-M65 HydrophobicContact CE1-CG 4.08Å; F61-M65 HydrophobicContact CE2-CE 3.4Å; F61-M65 VanDerWaalsContact CE2-CE 3.4Å; F61-M65 HydrophobicContact CE2-CG 4.33Å; F61-M65 HydrophobicContact CZ-CE 3.55Å; F61-M65 HydrophobicContact CZ-CG 3.98Å; F61-M65 HydrophobicContact CZ-SD 4.49Å; F61-M65 WeakPolarHBondContact O-CG 3.28Å; F61-M65 PolarHBondContact O-N 3.14Å
62	A	98.2	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-44	174.7	0	0	0	0	0	111.3	V58 V59 M65 V66 C228 L231 I232	V58-A62 WeakPolarHBondContact O-CB 3.38Å; V58-A62 PolarHBondContact O-N 3.34Å; V59-A62 PolarHBondContact O-N 3.42Å; A62-M65 PolarHBondContact O-N 2.89Å; A62-V66 WeakPolarHBondContact O-CG2 3.31Å; A62-V66 PolarHBondContact O-N 3.18Å; A62-C228 HydrophobicContact CB-CB 4.44Å; A62-L231 HydrophobicContact CB-CB 3.98Å; A62-L231 HydrophobicContact CB-CD1 4.44Å; A62-I232 HydrophobicContact CB-CG1 4.21Å
63	A	98.2	Very high	95.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-39.6	176.4	0	0	0	0	0	112.3	V59 V60 V66 H67 A168 V172 A187	V59-A63 WeakPolarHBondContact O-CB 3.35Å; V59-A63 PolarHBondContact O-N 3.01Å; V60-A63 PolarHBondContact O-N 3.17Å; A63-V66 WeakPolarHBondContact O-CB 3.2Å; A63-V66 PolarHBondContact O-N 3.49Å; A63-H67 PolarHBondContact O-N 3.38Å; A63-H67 PolarHBondContact O-ND1 3.31Å; A63-A168 HydrophobicContact CB-CB 3.83Å; A63-V172 HydrophobicContact CB-CG2 3.51Å; A63-A187 HydrophobicContact CB-CB 3.76Å
64	F	98	Very high	96	Very high	38 Å²	38	27.4 Å²	27.4	17%	0.167	14%	0.143	C	C	.	.	H	α-helix	trans	-58.3	-46.5	171.8	174.6	-88.3	0	0	0	111.7	V60 F61 V66 H67 L68 I186 A187 C189 G190 L193	V60-F64 WeakPolarHBondContact O-CB 3.36Å; V60-F64 PolarHBondContact O-N 3.26Å; F61-F64 WeakPolarHBondContact O-CB 3.38Å; F61-F64 PolarHBondContact O-N 3.1Å; F64-V66 VanDerWaalsContact C-N 3.33Å; F64-V66 PolarHBondContact O-N 3.25Å; F64-H67 PolarHBondContact O-N 2.68Å; F64-L68 HydrophobicContact CE1-CD1 3.71Å; F64-L68 HydrophobicContact CZ-CD1 4.13Å; F64-L68 VanDerWaalsContact O-CB 3.26Å; F64-L68 WeakPolarHBondContact O-CB 3.31Å; F64-L68 PolarHBondContact O-N 3.41Å; F64-I186 VanDerWaalsContact CD2-O 3.3Å; F64-I186 WeakPolarHBondContact CD2-O 3.2Å; F64-A187 WeakPolarHBondContact CA-O 3.32Å; F64-C189 HydrophobicContact CE2-CB 4.28Å; F64-G190 VanDerWaalsContact CD2-CA 3.47Å; F64-G190 VanDerWaalsContact CD2-N 3.29Å; F64-G190 VanDerWaalsContact CE2-N 3.31Å; F64-L193 HydrophobicContact CE1-CD2 4.37Å; F64-L193 HydrophobicContact CZ-CD2 3.76Å
65	M	98	Very high	95.8	Very high	51 Å²	51	29.8 Å²	29.8	25%	0.251	14%	0.135	S	C	.	.	H	α-helix	trans	-66.1	-35.5	177.4	-70.7	-61.6	156.7	0	0	112.5	F61 A62 L68 I69	F61-M65 HydrophobicContact CD2-CE 4.3Å; F61-M65 HydrophobicContact CE1-CG 4.08Å; F61-M65 HydrophobicContact CE2-CE 3.4Å; F61-M65 VanDerWaalsContact CE2-CE 3.4Å; F61-M65 HydrophobicContact CE2-CG 4.33Å; F61-M65 HydrophobicContact CZ-CE 3.55Å; F61-M65 HydrophobicContact CZ-CG 3.98Å; F61-M65 HydrophobicContact CZ-SD 4.49Å; F61-M65 WeakPolarHBondContact O-CG 3.28Å; F61-M65 PolarHBondContact O-N 3.14Å; A62-M65 PolarHBondContact O-N 2.89Å; M65-L68 PolarHBondContact O-N 3.15Å; M65-I69 WeakPolarHBondContact O-CB 3.5Å; M65-I69 WeakPolarHBondContact O-CG1 3.36Å; M65-I69 PolarHBondContact O-N 2.71Å
66	V	98.3	Very high	95.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.8	-51.4	172.5	168.5	0	0	0	0	110.9	A62 A63 F64 L68 I69 A70 C164 A168 L225 C228	A62-V66 WeakPolarHBondContact O-CG2 3.31Å; A62-V66 PolarHBondContact O-N 3.18Å; A63-V66 WeakPolarHBondContact O-CB 3.2Å; A63-V66 PolarHBondContact O-N 3.49Å; F64-V66 VanDerWaalsContact C-N 3.33Å; F64-V66 PolarHBondContact O-N 3.25Å; V66-L68 PolarHBondContact O-N 3.05Å; V66-I69 PolarHBondContact O-N 3.1Å; V66-A70 WeakPolarHBondContact O-CB 3.42Å; V66-A70 PolarHBondContact O-N 2.71Å; V66-C164 HydrophobicContact CG1-CB 3.77Å; V66-A168 HydrophobicContact CB-CB 4.12Å; V66-A168 HydrophobicContact CG1-CB 3.96Å; V66-A168 HydrophobicContact CG2-CB 4.44Å; V66-L225 HydrophobicContact CB-CD2 4.2Å; V66-L225 HydrophobicContact CG1-CD2 4.26Å; V66-L225 HydrophobicContact CG2-CD2 4.02Å; V66-C228 HydrophobicContact CG2-CB 3.66Å
67	H	97.2	Very high	95.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.6	-40.9	178.9	-72	77.2	0	0	0	111.6	A63 F64 I69 D71 F165	A63-H67 PolarHBondContact O-N 3.38Å; A63-H67 PolarHBondContact O-ND1 3.31Å; F64-H67 PolarHBondContact O-N 2.68Å; H67-I69 VanDerWaalsContact C-N 3.34Å; H67-I69 PolarHBondContact O-N 2.94Å; H67-D71 IonicContact CD2-OD2 4Å; H67-D71 VanDerWaalsContact O-CB 3.24Å; H67-D71 WeakPolarHBondContact O-CB 3.3Å; H67-D71 PolarHBondContact O-N 2.91Å; H67-F165 AromaticContact CD2-CD2 3.84Å; H67-F165 AromaticContact CD2-CE2 3.66Å; H67-F165 AromaticContact NE2-CD2 3.48Å; H67-F165 WeakPolarHBondContact NE2-CD2 3.43Å; H67-F165 AromaticContact NE2-CE2 3.25Å; H67-F165 WeakPolarHBondContact NE2-CE2 3.42Å
68	L	97	Very high	94.5	Very high	19 Å²	19	24.2 Å²	24.2	10%	0.099	13%	0.131	C	C	.	.	H	α-helix	trans	-58.4	-44.4	178	-178.9	149	0	0	0	112.5	F64 M65 V66 G72 G190 L193 G194 L197 F198	F64-L68 HydrophobicContact CE1-CD1 3.71Å; F64-L68 HydrophobicContact CZ-CD1 4.13Å; F64-L68 VanDerWaalsContact O-CB 3.26Å; F64-L68 WeakPolarHBondContact O-CB 3.31Å; F64-L68 PolarHBondContact O-N 3.41Å; M65-L68 PolarHBondContact O-N 3.15Å; V66-L68 PolarHBondContact O-N 3.05Å; L68-G72 WeakPolarHBondContact O-CA 3.28Å; L68-G72 PolarHBondContact O-N 3.3Å; L68-G190 WeakPolarHBondContact CA-O 3.24Å; L68-L193 HydrophobicContact CD1-CB 4.37Å; L68-L193 HydrophobicContact CD1-CD2 3.84Å; L68-L193 HydrophobicContact CD1-CG 4.08Å; L68-G194 WeakPolarHBondContact O-CA 3.47Å; L68-L197 HydrophobicContact CD1-CD1 4.48Å; L68-F198 HydrophobicContact CD2-CE2 3.8Å; L68-F198 WeakPolarHBondContact O-CE2 3.27Å
69	I	96.9	Very high	93.9	Very high	14 Å²	14	23.9 Å²	23.9	7%	0.072	13%	0.129	C	C	.	.	H	α-helix	trans	-77.8	-50.3	179.7	-65.8	169.1	0	0	0	110.5	M65 V66 H67 I73 F198 V221 N224 L225	M65-I69 WeakPolarHBondContact O-CB 3.5Å; M65-I69 WeakPolarHBondContact O-CG1 3.36Å; M65-I69 PolarHBondContact O-N 2.71Å; V66-I69 PolarHBondContact O-N 3.1Å; H67-I69 VanDerWaalsContact C-N 3.34Å; H67-I69 PolarHBondContact O-N 2.94Å; I69-I73 HydrophobicContact CG2-CD1 3.8Å; I69-I73 WeakPolarHBondContact O-CB 3.16Å; I69-I73 WeakPolarHBondContact O-CD1 3.26Å; I69-I73 WeakPolarHBondContact O-CG1 3.05Å; I69-I73 PolarHBondContact O-N 3.42Å; I69-F198 HydrophobicContact CG1-CZ 4.32Å; I69-V221 HydrophobicContact CG1-CG1 4.42Å; I69-V221 HydrophobicContact CG2-CG1 3.99Å; I69-N224 HydrophobicContact CD1-CB 4.16Å; I69-L225 HydrophobicContact CB-CD2 3.95Å; I69-L225 HydrophobicContact CD1-CD2 4.27Å; I69-L225 HydrophobicContact CG2-CD1 4.43Å; I69-L225 HydrophobicContact CG2-CD2 4.03Å; I69-L225 HydrophobicContact CG2-CG 4.13Å
70	A	95.9	Very high	93.4	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-53	-172.6	0	0	0	0	0	111.8	V66 S74 F161	V66-A70 WeakPolarHBondContact O-CB 3.42Å; V66-A70 PolarHBondContact O-N 2.71Å; A70-S74 WeakPolarHBondContact O-CB 3.5Å; A70-S74 PolarHBondContact O-N 3.49Å; A70-S74 PolarHBondContact O-OG 2.95Å; A70-F161 VanDerWaalsContact CA-CE2 3.45Å; A70-F161 HydrophobicContact CB-CD2 3.7Å; A70-F161 HydrophobicContact CB-CE2 3.95Å; A70-F161 HydrophobicContact CB-CG 4.03Å; A70-F161 HydrophobicContact CB-CZ 4.5Å; A70-F161 WeakPolarHBondContact O-CE2 3.42Å
71	D	92.9	Very high	92.7	Very high	28 Å²	28	26.9 Å²	26.9	15%	0.15	14%	0.141	C	C	.	.	H	α-helix	trans	-73.7	-36.7	-179.1	-60.6	-23.6	0	0	0	110.8	H67 I73 S74 F75 S191	H67-D71 IonicContact CD2-OD2 4Å; H67-D71 VanDerWaalsContact O-CB 3.24Å; H67-D71 WeakPolarHBondContact O-CB 3.3Å; H67-D71 PolarHBondContact O-N 2.91Å; D71-I73 PolarHBondContact O-N 3.13Å; D71-S74 PolarHBondContact O-N 2.97Å; D71-F75 HydrophobicContact CB-CD2 4.08Å; D71-F75 HydrophobicContact CB-CE2 3.85Å; D71-F75 WeakPolarHBondContact O-CB 3.34Å; D71-F75 WeakPolarHBondContact O-CD2 3.24Å; D71-F75 WeakPolarHBondContact O-CG 3.5Å; D71-F75 PolarHBondContact O-N 3.14Å; D71-S191 WeakPolarHBondContact OD2-CB 3.46Å
72	G	92.3	Very high	92.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-56.9	-46.6	175.7	0	0	0	0	0	112.5	L68 S76 G194 F198	L68-G72 WeakPolarHBondContact O-CA 3.28Å; L68-G72 PolarHBondContact O-N 3.3Å; G72-S76 VanDerWaalsContact O-CB 3.24Å; G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.5Å; G72-S76 PolarHBondContact O-OG 2.84Å; G72-G194 VanDerWaalsContact CA-C 3.43Å; G72-F198 VanDerWaalsContact O-CB 3.31Å; G72-F198 WeakPolarHBondContact O-CB 3.39Å
73	I	92.5	Very high	91.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-69.2	-41.9	175.7	-64.1	169.4	0	0	0	111.2	I69 D71 S76 F77 F102 F137 F161 F198 L218 V221	I69-I73 HydrophobicContact CG2-CD1 3.8Å; I69-I73 WeakPolarHBondContact O-CB 3.16Å; I69-I73 WeakPolarHBondContact O-CD1 3.26Å; I69-I73 WeakPolarHBondContact O-CG1 3.05Å; I69-I73 PolarHBondContact O-N 3.42Å; D71-I73 PolarHBondContact O-N 3.13Å; I73-S76 PolarHBondContact O-N 2.96Å; I73-F77 PolarHBondContact O-N 2.92Å; I73-F102 HydrophobicContact CG2-CE1 4.25Å; I73-F102 HydrophobicContact CG2-CZ 4.39Å; I73-F137 HydrophobicContact CG2-CE1 3.84Å; I73-F137 HydrophobicContact CG2-CE2 4.47Å; I73-F137 HydrophobicContact CG2-CZ 3.44Å; I73-F137 VanDerWaalsContact CG2-CZ 3.44Å; I73-F161 HydrophobicContact CB-CE2 4.33Å; I73-F161 HydrophobicContact CD1-CZ 4.2Å; I73-F198 HydrophobicContact CD1-CE1 3.94Å; I73-F198 HydrophobicContact CD1-CZ 4.48Å; I73-F198 HydrophobicContact CG1-CD1 3.56Å; I73-F198 HydrophobicContact CG1-CE1 3.43Å; I73-F198 VanDerWaalsContact CG1-CE1 3.43Å; I73-F198 HydrophobicContact CG1-CG 4.37Å; I73-F198 HydrophobicContact CG1-CZ 4.15Å; I73-L218 HydrophobicContact CD1-CD2 4.33Å; I73-L218 HydrophobicContact CG1-CD2 4.2Å; I73-V221 HydrophobicContact CD1-CG1 4.34Å
74	S	91.5	Very high	91	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.042	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-49.3	-178.6	-59	0	0	0	0	112.5	A70 D71 S76 F77 F102	A70-S74 WeakPolarHBondContact O-CB 3.5Å; A70-S74 PolarHBondContact O-N 3.49Å; A70-S74 PolarHBondContact O-OG 2.95Å; D71-S74 PolarHBondContact O-N 2.97Å; S74-S76 VanDerWaalsContact C-N 3.29Å; S74-S76 PolarHBondContact O-N 3.5Å; S74-F77 WeakPolarHBondContact O-CB 3.45Å; S74-F77 PolarHBondContact O-N 3.04Å; S74-F102 WeakPolarHBondContact OG-CE1 3.36Å
75	F	88.1	Confident	90.4	Very high	111 Å²	111	30 Å²	30	49%	0.487	16%	0.162	S	C	.	.	H	α-helix	trans	-76.4	-16.9	-179.8	-60.4	-35.6	0	0	0	113.3	D71 F77 M103 T195	D71-F75 HydrophobicContact CB-CD2 4.08Å; D71-F75 HydrophobicContact CB-CE2 3.85Å; D71-F75 WeakPolarHBondContact O-CB 3.34Å; D71-F75 WeakPolarHBondContact O-CD2 3.24Å; D71-F75 WeakPolarHBondContact O-CG 3.5Å; D71-F75 PolarHBondContact O-N 3.14Å; F75-F77 VanDerWaalsContact C-N 3.28Å; F75-F77 PolarHBondContact O-N 3.11Å; F75-M103 HydrophobicContact CD1-SD 4.36Å; F75-T195 HydrophobicContact CB-CG2 4.04Å; F75-T195 WeakPolarHBondContact CD2-OG1 3.31Å
76	S	88.8	Confident	89.9	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.014	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.5	172.8	-57.6	0	0	0	0	113.8	G72 I73 S74 G78 V79 F198 A199	G72-S76 VanDerWaalsContact O-CB 3.24Å; G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.5Å; G72-S76 PolarHBondContact O-OG 2.84Å; I73-S76 PolarHBondContact O-N 2.96Å; S74-S76 VanDerWaalsContact C-N 3.29Å; S74-S76 PolarHBondContact O-N 3.5Å; S76-G78 PolarHBondContact O-N 3.08Å; S76-G78 VanDerWaalsContact O-N 3.14Å; S76-V79 WeakPolarHBondContact O-CB 3.47Å; S76-V79 PolarHBondContact O-N 3.07Å; S76-F198 VanDerWaalsContact OG-C 3.28Å; S76-F198 WeakPolarHBondContact OG-CB 3.24Å; S76-A199 PolarHBondContact OG-N 3.28Å; S76-A199 VanDerWaalsContact OG-N 3.12Å
77	F	86.3	Confident	89.4	Confident	13 Å²	13	38.5 Å²	38.5	6%	0.057	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-30.8	178.9	-177.2	-92.5	0	0	0	112.9	I73 S74 F75 V79 L80 Y81 I84 V98 G99 F153	I73-F77 PolarHBondContact O-N 2.92Å; S74-F77 WeakPolarHBondContact O-CB 3.45Å; S74-F77 PolarHBondContact O-N 3.04Å; F75-F77 VanDerWaalsContact C-N 3.28Å; F75-F77 PolarHBondContact O-N 3.11Å; F77-V79 PolarHBondContact O-N 3.1Å; F77-V79 VanDerWaalsContact O-N 3.1Å; F77-L80 HydrophobicContact CD2-CD1 4.46Å; F77-L80 WeakPolarHBondContact O-CB 3.42Å; F77-L80 PolarHBondContact O-N 2.95Å; F77-Y81 HydrophobicContact CE1-CD2 4.26Å; F77-Y81 PolarHBondContact O-N 2.89Å; F77-Y81 VanDerWaalsContact O-N 3.11Å; F77-I84 HydrophobicContact CE2-CD1 3.81Å; F77-I84 HydrophobicContact CZ-CD1 3.7Å; F77-V98 HydrophobicContact CE2-CB 4.49Å; F77-V98 HydrophobicContact CE2-CG1 4.02Å; F77-V98 HydrophobicContact CZ-CB 4.02Å; F77-V98 HydrophobicContact CZ-CG1 4.05Å; F77-G99 VanDerWaalsContact CD1-CA 3.43Å; F77-G99 VanDerWaalsContact CZ-CA 3.4Å; F77-G99 VanDerWaalsContact CZ-N 3.25Å; F77-F153 AromaticContact CD2-CE1 3.44Å; F77-F153 HydrophobicContact CD2-CE1 3.44Å; F77-F153 VanDerWaalsContact CD2-CE1 3.44Å; F77-F153 AromaticContact CD2-CZ 3.65Å; F77-F153 HydrophobicContact CD2-CZ 3.65Å; F77-F153 HydrophobicContact CE2-CD1 4.16Å; F77-F153 AromaticContact CE2-CE1 3.45Å; F77-F153 HydrophobicContact CE2-CE1 3.45Å; F77-F153 VanDerWaalsContact CE2-CE1 3.45Å; F77-F153 AromaticContact CE2-CZ 3.95Å; F77-F153 HydrophobicContact CE2-CZ 3.95Å
78	G	82.6	Confident	88.9	Confident	54 Å²	54	40.4 Å²	40.4	56%	0.557	21%	0.21	S	C	*	.	H	α-helix	trans	-54.8	-28.6	175.9	0	0	0	0	0	113.8	S76 P82	S76-G78 PolarHBondContact O-N 3.08Å; S76-G78 VanDerWaalsContact O-N 3.14Å; G78-P82 WeakPolarHBondContact O-CD 3.27Å
79	V	86.5	Confident	88.5	Confident	44 Å²	44	48.8 Å²	48.8	27%	0.267	25%	0.246	S	C	.	.	H	α-helix	trans	-75	-33.2	177	-169.7	0	0	0	0	111.7	S76 F77 V202 E203 L206	S76-V79 WeakPolarHBondContact O-CB 3.47Å; S76-V79 PolarHBondContact O-N 3.07Å; F77-V79 PolarHBondContact O-N 3.1Å; F77-V79 VanDerWaalsContact O-N 3.1Å; V79-V202 HydrophobicContact CB-CG1 4.01Å; V79-V202 HydrophobicContact CG1-CG1 4.07Å; V79-E203 HydrophobicContact CG1-CB 3.93Å; V79-L206 HydrophobicContact CG1-CD1 3.91Å
80	L	85.9	Confident	87.8	Confident	7 Å²	7	49 Å²	49	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-76.3	-25.4	176.9	-71.7	163.3	0	0	0	112.5	F77 K83 I84 F153 V202 L206 L218	F77-L80 HydrophobicContact CD2-CD1 4.46Å; F77-L80 WeakPolarHBondContact O-CB 3.42Å; F77-L80 PolarHBondContact O-N 2.95Å; L80-K83 PolarHBondContact O-N 2.74Å; L80-K83 VanDerWaalsContact O-N 3.16Å; L80-I84 HydrophobicContact CB-CD1 4.22Å; L80-I84 WeakPolarHBondContact O-CG1 3.39Å; L80-I84 PolarHBondContact O-N 2.64Å; L80-F153 HydrophobicContact CD1-CZ 4.45Å; L80-V202 HydrophobicContact CD2-CG1 4.26Å; L80-V202 HydrophobicContact CG-CG1 3.98Å; L80-L206 HydrophobicContact CD2-CD1 3.94Å; L80-L206 HydrophobicContact CD2-CD2 3.78Å; L80-L206 HydrophobicContact CD2-CG 4.22Å; L80-L206 HydrophobicContact CG-CD1 4.47Å; L80-L218 HydrophobicContact CD1-CD1 4.4Å
81	Y	83.8	Confident	87.3	Confident	58 Å²	58	54.3 Å²	54.3	23%	0.227	28%	0.277	C	S	.	.	H	α-helix	trans	-56	-50.1	-170.6	174.8	-101.3	0	0	0	114.8	F77 K83 I84 Q85 K92 A96	F77-Y81 HydrophobicContact CE1-CD2 4.26Å; F77-Y81 PolarHBondContact O-N 2.89Å; F77-Y81 VanDerWaalsContact O-N 3.11Å; Y81-K83 VanDerWaalsContact C-N 3.27Å; Y81-K83 PolarHBondContact O-N 3.15Å; Y81-I84 PolarHBondContact O-N 3.35Å; Y81-Q85 PolarHBondContact O-N 2.82Å; Y81-Q85 PolarHBondContact OH-NE2 3.14Å; Y81-K92 WeakPolarHBondContact OH-CA 3.25Å; Y81-K92 WeakPolarHBondContact OH-CB 3.46Å; Y81-K92 PolarHBondContact OH-O 3.4Å; Y81-A96 HydrophobicContact CE2-CB 3.76Å
82	P	85.8	Confident	86.5	Confident	69 Å²	69	60.3 Å²	60.3	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-33.9	178.9	-21.4	33.5	0	0	0	112.8	G78 Q85 E86	G78-P82 WeakPolarHBondContact O-CD 3.27Å; P82-Q85 PolarHBondContact O-N 3.17Å; P82-E86 WeakPolarHBondContact O-CB 3.15Å; P82-E86 PolarHBondContact O-N 3.41Å; P82-E86 VanDerWaalsContact O-N 3.07Å
83	K	87	Confident	85.7	Confident	94 Å²	94	64.3 Å²	64.3	41%	0.409	33%	0.33	S	S	.	.	H	α-helix	trans	-71.8	-34.7	179.8	-67	-64.6	173.6	-167.9	0	112.6	L80 Y81 E86 Q87 L206	L80-K83 PolarHBondContact O-N 2.74Å; L80-K83 VanDerWaalsContact O-N 3.16Å; Y81-K83 VanDerWaalsContact C-N 3.27Å; Y81-K83 PolarHBondContact O-N 3.15Å; K83-E86 IonicContact NZ-OE2 3.35Å; K83-E86 PolarHBondContact NZ-OE2 2.97Å; K83-Q87 VanDerWaalsContact O-CB 3.3Å; K83-Q87 WeakPolarHBondContact O-CB 3.46Å; K83-Q87 PolarHBondContact O-N 3.47Å; K83-L206 HydrophobicContact CG-CD1 4.47Å; K83-L206 HydrophobicContact CG-CD2 4.45Å
84	I	85.9	Confident	85.2	Confident	14 Å²	14	68.4 Å²	68.4	7%	0.072	35%	0.349	C	S	.	.	H	α-helix	trans	-64.7	-43.2	172.7	-66.8	167.9	0	0	0	110.3	F77 L80 Y81 Q87 F88 L149	F77-I84 HydrophobicContact CE2-CD1 3.81Å; F77-I84 HydrophobicContact CZ-CD1 3.7Å; L80-I84 HydrophobicContact CB-CD1 4.22Å; L80-I84 WeakPolarHBondContact O-CG1 3.39Å; L80-I84 PolarHBondContact O-N 2.64Å; Y81-I84 PolarHBondContact O-N 3.35Å; I84-Q87 PolarHBondContact O-N 2.96Å; I84-F88 HydrophobicContact CG2-CD2 3.96Å; I84-F88 HydrophobicContact CG2-CE2 4.46Å; I84-F88 WeakPolarHBondContact O-CD2 3.2Å; I84-F88 PolarHBondContact O-N 3.26Å; I84-L149 HydrophobicContact CD1-CD2 4.11Å; I84-L149 HydrophobicContact CG1-CD2 4.19Å; I84-L149 HydrophobicContact CG2-CD2 3.89Å
85	Q	85.8	Confident	84.8	Confident	40 Å²	40	68.1 Å²	68.1	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-48.5	177.3	-71.2	178.1	-18.2	0	0	112.2	Y81 P82 K89 A90 S95	Y81-Q85 PolarHBondContact O-N 2.82Å; Y81-Q85 PolarHBondContact OH-NE2 3.14Å; P82-Q85 PolarHBondContact O-N 3.17Å; Q85-K89 VanDerWaalsContact O-CA 3.27Å; Q85-K89 WeakPolarHBondContact O-CA 3.44Å; Q85-K89 PolarHBondContact O-N 3.5Å; Q85-A90 PolarHBondContact O-N 2.89Å; Q85-S95 VanDerWaalsContact CG-OG 3.27Å; Q85-S95 WeakPolarHBondContact CG-OG 3.37Å
86	E	87.5	Confident	84.5	Confident	133 Å²	133	64.3 Å²	64.3	62%	0.621	34%	0.336	S	S	*	.	H	α-helix	trans	-60	-47.8	179.7	-174.8	176	-164	0	0	111.2	P82 K83	P82-E86 WeakPolarHBondContact O-CB 3.15Å; P82-E86 PolarHBondContact O-N 3.41Å; P82-E86 VanDerWaalsContact O-N 3.07Å; K83-E86 IonicContact NZ-OE2 3.35Å; K83-E86 PolarHBondContact NZ-OE2 2.97Å
87	Q	86.5	Confident	84.4	Confident	98 Å²	98	68.5 Å²	68.5	46%	0.458	36%	0.357	S	S	.	.	H	α-helix	trans	-68	-42.6	-176.2	179.5	62.5	50.3	0	0	113.5	K83 I84 W211	K83-Q87 VanDerWaalsContact O-CB 3.3Å; K83-Q87 WeakPolarHBondContact O-CB 3.46Å; K83-Q87 PolarHBondContact O-N 3.47Å; I84-Q87 PolarHBondContact O-N 2.96Å; Q87-W211 HydrophobicContact CG-CZ2 3.76Å
88	F	88.3	Confident	84.5	Confident	40 Å²	40	67.9 Å²	67.9	18%	0.175	36%	0.355	C	S	.	.	H	α-helix	trans	-96.2	-1.5	-175.2	-68.2	-77.7	0	0	0	113.4	I84 A90 A143 I146 L149 W211	I84-F88 HydrophobicContact CG2-CD2 3.96Å; I84-F88 HydrophobicContact CG2-CE2 4.46Å; I84-F88 WeakPolarHBondContact O-CD2 3.2Å; I84-F88 PolarHBondContact O-N 3.26Å; F88-A90 HydrophobicContact CB-CB 4.12Å; F88-A90 PolarHBondContact O-N 3.26Å; F88-A90 VanDerWaalsContact O-N 3.13Å; F88-A143 WeakPolarHBondContact CE1-O 3.21Å; F88-A143 HydrophobicContact CZ-CB 4.35Å; F88-A143 WeakPolarHBondContact CZ-O 3.32Å; F88-I146 HydrophobicContact CB-CD1 4.42Å; F88-I146 HydrophobicContact CB-CG1 3.83Å; F88-I146 HydrophobicContact CD1-CG1 4.49Å; F88-I146 HydrophobicContact CG-CG1 4.13Å; F88-L149 HydrophobicContact CE2-CD2 3.89Å; F88-L149 HydrophobicContact CZ-CD2 4.48Å; F88-W211 HydrophobicContact CE2-CH2 4.36Å; F88-W211 HydrophobicContact CZ-CH2 4.07Å
89	K	87.7	Confident	84.7	Confident	195 Å²	195	65.3 Å²	65.3	85%	0.848	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	37.2	-170.4	-60.1	-176.7	179.5	-179.5	0	111.7	Q85	Q85-K89 VanDerWaalsContact O-CA 3.27Å; Q85-K89 WeakPolarHBondContact O-CA 3.44Å; Q85-K89 PolarHBondContact O-N 3.5Å
90	A	82.7	Confident	84.7	Confident	17 Å²	17	65.9 Å²	65.9	14%	0.14	33%	0.334	C	S	.	.			trans	-78.4	155	-172	0	0	0	0	0	111.5	Q85 F88 S95 I146	Q85-A90 PolarHBondContact O-N 2.89Å; F88-A90 HydrophobicContact CB-CB 4.12Å; F88-A90 PolarHBondContact O-N 3.26Å; F88-A90 VanDerWaalsContact O-N 3.13Å; A90-S95 WeakPolarHBondContact CB-OG 3.44Å; A90-I146 HydrophobicContact CB-CD1 3.21Å; A90-I146 HydrophobicContact CB-CG1 4.01Å
91	L	84.4	Confident	84.9	Confident	115 Å²	115	67.7 Å²	67.7	60%	0.602	34%	0.343	S	S	*	.			trans	-69.3	153.5	165.2	-69.3	165.5	0	0	0	110.6	S93 E94 S95	L91-S93 PolarHBondContact O-N 3.32Å; L91-E94 HydrophobicContact CB-CG 4.1Å; L91-E94 PolarHBondContact N-OE2 3.28Å; L91-E94 VanDerWaalsContact N-OE2 3.13Å; L91-E94 PolarHBondContact O-N 3.48Å; L91-E94 VanDerWaalsContact O-N 3.08Å; L91-S95 PolarHBondContact O-N 3.46Å; L91-S95 VanDerWaalsContact O-N 3.11Å
92	K	76.8	Confident	85.3	Confident	154 Å²	154	64.9 Å²	64.9	67%	0.67	33%	0.333	S	S	*	.	H	α-helix	trans	-54.3	-40.7	178.6	-66.7	-165.6	175.3	-178	0	113	Y81 A96	Y81-K92 WeakPolarHBondContact OH-CA 3.25Å; Y81-K92 WeakPolarHBondContact OH-CB 3.46Å; Y81-K92 PolarHBondContact OH-O 3.4Å; K92-A96 VanDerWaalsContact O-CB 3.31Å; K92-A96 WeakPolarHBondContact O-CB 3.19Å; K92-A96 PolarHBondContact O-N 3.23Å; K92-A96 VanDerWaalsContact O-N 3.11Å
93	S	75.9	Confident	85.5	Confident	85 Å²	85	65.4 Å²	65.4	59%	0.594	33%	0.33	S	S	*	.	H	α-helix	trans	-66.4	-40.6	178	50	0	0	0	0	112.5	L91 A96 L97	L91-S93 PolarHBondContact O-N 3.32Å; S93-A96 PolarHBondContact O-N 3.35Å; S93-L97 WeakPolarHBondContact O-CB 3.32Å; S93-L97 PolarHBondContact O-N 2.82Å; S93-L97 VanDerWaalsContact O-N 3.08Å
94	E	80.7	Confident	85.6	Confident	87 Å²	87	61.4 Å²	61.4	41%	0.407	31%	0.314	S	S	.	.	H	α-helix	trans	-68.3	-42.5	-179.3	-63.8	179	139.4	0	0	111.9	L91 A96 I146	L91-E94 HydrophobicContact CB-CG 4.1Å; L91-E94 PolarHBondContact N-OE2 3.28Å; L91-E94 VanDerWaalsContact N-OE2 3.13Å; L91-E94 PolarHBondContact O-N 3.48Å; L91-E94 VanDerWaalsContact O-N 3.08Å; E94-A96 VanDerWaalsContact C-N 3.32Å; E94-A96 PolarHBondContact O-N 3.01Å; E94-I146 HydrophobicContact CB-CD1 3.74Å; E94-I146 HydrophobicContact CB-CG2 4.34Å; E94-I146 HydrophobicContact CG-CD1 4.49Å; E94-I146 WeakPolarHBondContact OE2-CD1 3.41Å
95	S	83.8	Confident	86	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-32.7	174.6	-56.3	0	0	0	0	112.6	Q85 A90 L91 L97 V98	Q85-S95 VanDerWaalsContact CG-OG 3.27Å; Q85-S95 WeakPolarHBondContact CG-OG 3.37Å; A90-S95 WeakPolarHBondContact CB-OG 3.44Å; L91-S95 PolarHBondContact O-N 3.46Å; L91-S95 VanDerWaalsContact O-N 3.11Å; S95-L97 VanDerWaalsContact C-N 3.33Å; S95-V98 PolarHBondContact O-N 2.89Å
96	A	82.1	Confident	86.5	Confident	32 Å²	32	61.2 Å²	61.2	26%	0.264	32%	0.315	S	S	.	.	H	α-helix	trans	-69.8	-38.1	-178.6	0	0	0	0	0	110.3	Y81 K92 S93 E94 V98 G99 S100	Y81-A96 HydrophobicContact CE2-CB 3.76Å; K92-A96 VanDerWaalsContact O-CB 3.31Å; K92-A96 WeakPolarHBondContact O-CB 3.19Å; K92-A96 PolarHBondContact O-N 3.23Å; K92-A96 VanDerWaalsContact O-N 3.11Å; S93-A96 PolarHBondContact O-N 3.35Å; E94-A96 VanDerWaalsContact C-N 3.32Å; E94-A96 PolarHBondContact O-N 3.01Å; A96-V98 PolarHBondContact O-N 3.15Å; A96-G99 PolarHBondContact O-N 3.27Å; A96-S100 PolarHBondContact O-N 3.18Å; A96-S100 PolarHBondContact O-OG 3.37Å
97	L	86.1	Confident	86.8	Confident	89 Å²	89	56.2 Å²	56.2	47%	0.466	29%	0.292	S	S	.	.	H	α-helix	trans	-56.9	-34	178.7	-175.4	148.7	0	0	0	112.6	S93 S95 I101	S93-L97 WeakPolarHBondContact O-CB 3.32Å; S93-L97 PolarHBondContact O-N 2.82Å; S93-L97 VanDerWaalsContact O-N 3.08Å; S95-L97 VanDerWaalsContact C-N 3.33Å; L97-I101 HydrophobicContact CD2-CD1 3.39Å; L97-I101 HydrophobicContact CD2-CG1 4.18Å; L97-I101 HydrophobicContact CG-CD1 4.18Å; L97-I101 WeakPolarHBondContact O-CB 3.46Å; L97-I101 VanDerWaalsContact O-CG1 3.24Å; L97-I101 WeakPolarHBondContact O-CG1 3.29Å; L97-I101 PolarHBondContact O-N 3.15Å
98	V	89.3	Confident	87.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-49.8	174.3	178.5	0	0	0	0	111.1	F77 S95 A96 F102 I146 L149 S150 F153	F77-V98 HydrophobicContact CE2-CB 4.49Å; F77-V98 HydrophobicContact CE2-CG1 4.02Å; F77-V98 HydrophobicContact CZ-CB 4.02Å; F77-V98 HydrophobicContact CZ-CG1 4.05Å; S95-V98 PolarHBondContact O-N 2.89Å; A96-V98 PolarHBondContact O-N 3.15Å; V98-F102 PolarHBondContact O-N 2.96Å; V98-F102 VanDerWaalsContact O-N 3.08Å; V98-I146 HydrophobicContact CG2-CG2 3.88Å; V98-L149 HydrophobicContact CG1-CD2 4.17Å; V98-L149 HydrophobicContact CG1-CG 3.97Å; V98-L149 HydrophobicContact CG2-CD2 4.25Å; V98-L149 HydrophobicContact CG2-CG 4.4Å; V98-S150 WeakPolarHBondContact CG2-OG 3.39Å; V98-F153 HydrophobicContact CG1-CB 4.44Å; V98-F153 HydrophobicContact CG1-CD1 3.65Å; V98-F153 HydrophobicContact CG1-CE1 4.34Å; V98-F153 HydrophobicContact CG1-CG 4.38Å
99	G	87	Confident	87.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.2	-40.3	179.6	0	0	0	0	0	113	F77 A96 I101 F102 M103	F77-G99 VanDerWaalsContact CD1-CA 3.43Å; F77-G99 VanDerWaalsContact CZ-CA 3.4Å; F77-G99 VanDerWaalsContact CZ-N 3.25Å; A96-G99 PolarHBondContact O-N 3.27Å; G99-I101 PolarHBondContact O-N 3.31Å; G99-F102 PolarHBondContact O-N 3.43Å; G99-M103 WeakPolarHBondContact O-CG 3.2Å; G99-M103 PolarHBondContact O-N 2.93Å
100	S	86.7	Confident	88.2	Confident	56 Å²	56	42.8 Å²	42.8	39%	0.392	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-43	177.1	-57	0	0	0	0	111.8	A96 A104	A96-S100 PolarHBondContact O-N 3.18Å; A96-S100 PolarHBondContact O-OG 3.37Å; S100-A104 VanDerWaalsContact O-CB 3.24Å; S100-A104 WeakPolarHBondContact O-CB 3.2Å; S100-A104 PolarHBondContact O-N 2.96Å
101	I	89.6	Confident	88.8	Confident	45 Å²	45	42.9 Å²	42.9	23%	0.231	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-48.1	173.2	-69.1	175	0	0	0	109.6	L97 G99 M103 A104 M105	L97-I101 HydrophobicContact CD2-CD1 3.39Å; L97-I101 HydrophobicContact CD2-CG1 4.18Å; L97-I101 HydrophobicContact CG-CD1 4.18Å; L97-I101 WeakPolarHBondContact O-CB 3.46Å; L97-I101 VanDerWaalsContact O-CG1 3.24Å; L97-I101 WeakPolarHBondContact O-CG1 3.29Å; L97-I101 PolarHBondContact O-N 3.15Å; G99-I101 PolarHBondContact O-N 3.31Å; I101-M103 VanDerWaalsContact C-N 3.34Å; I101-M103 PolarHBondContact O-N 3.14Å; I101-A104 PolarHBondContact O-N 2.93Å; I101-M105 HydrophobicContact CG2-CE 4.07Å; I101-M105 HydrophobicContact CG2-CG 3.74Å; I101-M105 VanDerWaalsContact O-CB 3.29Å; I101-M105 WeakPolarHBondContact O-CB 3.39Å; I101-M105 WeakPolarHBondContact O-CG 3.05Å; I101-M105 PolarHBondContact O-N 3.24Å
102	F	92.6	Very high	89.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-42.9	-178.4	-176.4	-123.6	0	0	0	113.1	I73 S74 V98 G99 P106 F137 F153 A157 F161	I73-F102 HydrophobicContact CG2-CE1 4.25Å; I73-F102 HydrophobicContact CG2-CZ 4.39Å; S74-F102 WeakPolarHBondContact OG-CE1 3.36Å; V98-F102 PolarHBondContact O-N 2.96Å; V98-F102 VanDerWaalsContact O-N 3.08Å; G99-F102 PolarHBondContact O-N 3.43Å; F102-P106 WeakPolarHBondContact O-CD 3.2Å; F102-F137 HydrophobicContact CE1-CZ 4.32Å; F102-F137 HydrophobicContact CE2-CE2 4.1Å; F102-F137 HydrophobicContact CE2-CZ 4.28Å; F102-F137 AromaticContact CZ-CE2 3.87Å; F102-F137 HydrophobicContact CZ-CE2 3.87Å; F102-F137 AromaticContact CZ-CZ 3.71Å; F102-F137 HydrophobicContact CZ-CZ 3.71Å; F102-F153 HydrophobicContact CB-CD1 4.05Å; F102-F153 HydrophobicContact CB-CE1 3.72Å; F102-F153 AromaticContact CD1-CE1 3.61Å; F102-F153 HydrophobicContact CD1-CE1 3.61Å; F102-F153 AromaticContact CD1-CZ 3.84Å; F102-F153 HydrophobicContact CD1-CZ 3.84Å; F102-F153 HydrophobicContact CD2-CD1 4.37Å; F102-F153 HydrophobicContact CD2-CE1 4.13Å; F102-F153 VanDerWaalsContact CD2-O 3.32Å; F102-F153 WeakPolarHBondContact CD2-O 3.32Å; F102-F153 HydrophobicContact CE1-CE1 4.2Å; F102-F153 AromaticContact CE1-CZ 3.97Å; F102-F153 HydrophobicContact CE1-CZ 3.97Å; F102-F153 HydrophobicContact CG-CD1 4.1Å; F102-F153 AromaticContact CG-CE1 3.55Å; F102-F153 HydrophobicContact CG-CE1 3.55Å; F102-F153 HydrophobicContact CG-CZ 4.15Å; F102-F153 HydrophobicContact CZ-CZ 4.44Å; F102-A157 HydrophobicContact CD2-CB 4.31Å; F102-A157 HydrophobicContact CE2-CB 3.8Å; F102-F161 HydrophobicContact CE1-CE2 4.33Å; F102-F161 HydrophobicContact CE2-CD2 4.03Å; F102-F161 HydrophobicContact CE2-CE2 4.15Å; F102-F161 AromaticContact CZ-CD2 3.66Å; F102-F161 HydrophobicContact CZ-CD2 3.66Å; F102-F161 AromaticContact CZ-CE2 3.43Å; F102-F161 HydrophobicContact CZ-CE2 3.43Å; F102-F161 VanDerWaalsContact CZ-CE2 3.43Å; F102-F161 HydrophobicContact CZ-CZ 4.18Å
103	M	89.9	Confident	90.4	Very high	80 Å²	80	33.9 Å²	33.9	39%	0.394	20%	0.198	S	C	.	.	H	α-helix	trans	-74.8	-34.5	179.3	-68.7	-172.6	-68.6	0	0	113.2	F75 G99 I101	F75-M103 HydrophobicContact CD1-SD 4.36Å; G99-M103 WeakPolarHBondContact O-CG 3.2Å; G99-M103 PolarHBondContact O-N 2.93Å; I101-M103 VanDerWaalsContact C-N 3.34Å; I101-M103 PolarHBondContact O-N 3.14Å
104	A	89.3	Confident	91.4	Very high	9 Å²	9	29.9 Å²	29.9	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-79.6	-31.1	-178.8	0	0	0	0	0	113.1	S100 I101 L107 I108	S100-A104 VanDerWaalsContact O-CB 3.24Å; S100-A104 WeakPolarHBondContact O-CB 3.2Å; S100-A104 PolarHBondContact O-N 2.96Å; I101-A104 PolarHBondContact O-N 2.93Å; A104-L107 PolarHBondContact O-N 2.92Å; A104-I108 HydrophobicContact CB-CD1 3.97Å; A104-I108 WeakPolarHBondContact O-CG1 3.3Å; A104-I108 PolarHBondContact O-N 3.12Å
105	M	93.2	Very high	92	Very high	34 Å²	34	26.3 Å²	26.3	17%	0.167	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-42.8	-175.9	-81.2	-66.7	149.2	0	0	114.4	I101 L107 I108 A109 F155	I101-M105 HydrophobicContact CG2-CE 4.07Å; I101-M105 HydrophobicContact CG2-CG 3.74Å; I101-M105 VanDerWaalsContact O-CB 3.29Å; I101-M105 WeakPolarHBondContact O-CB 3.39Å; I101-M105 WeakPolarHBondContact O-CG 3.05Å; I101-M105 PolarHBondContact O-N 3.24Å; M105-L107 PolarHBondContact O-N 2.89Å; M105-L107 VanDerWaalsContact O-N 3.17Å; M105-I108 PolarHBondContact O-N 2.92Å; M105-A109 VanDerWaalsContact O-CB 3.22Å; M105-A109 WeakPolarHBondContact O-CB 3.2Å; M105-A109 PolarHBondContact O-N 3.37Å; M105-F155 HydrophobicContact CE-CD2 3.9Å; M105-F155 HydrophobicContact CE-CE2 4.27Å; M105-F155 HydrophobicContact SD-CD2 3.79Å; M105-F155 HydrophobicContact SD-CE2 4.03Å
106	P	95.9	Very high	92.4	Very high	16 Å²	16	28.5 Å²	28.5	10%	0.104	17%	0.167	C	C	.	.	H	α-helix	trans	-50.9	-38.4	175	-32.2	36.5	0	0	0	114.1	F102 S110 F161 S162	F102-P106 WeakPolarHBondContact O-CD 3.2Å; P106-S110 PolarHBondContact O-OG 2.95Å; P106-F161 HydrophobicContact CG-CB 4.06Å; P106-S162 WeakPolarHBondContact O-CB 3.2Å; P106-S162 PolarHBondContact O-OG 3.46Å
107	L	95.1	Very high	93	Very high	28 Å²	28	27.3 Å²	27.3	15%	0.147	16%	0.156	C	C	.	.	H	α-helix	trans	-83.9	-47.8	-178.9	-64	175.3	0	0	0	112.3	A104 M105 A109 S110 C596 M597	A104-L107 PolarHBondContact O-N 2.92Å; M105-L107 PolarHBondContact O-N 2.89Å; M105-L107 VanDerWaalsContact O-N 3.17Å; L107-A109 VanDerWaalsContact C-N 3.32Å; L107-A109 PolarHBondContact O-N 2.92Å; L107-S110 WeakPolarHBondContact O-CB 3.07Å; L107-S110 PolarHBondContact O-N 3.42Å; L107-S110 PolarHBondContact O-OG 3.31Å; L107-S110 VanDerWaalsContact O-OG 3.09Å; L107-C596 WeakPolarHBondContact CB-O 3.32Å; L107-C596 HydrophobicContact CD2-CB 4.26Å; L107-C596 CarbonylContact O-C 3.59Å; L107-C596 VanDerWaalsContact O-C 3.25Å; L107-M597 VanDerWaalsContact O-CA 3.29Å; L107-M597 WeakPolarHBondContact O-CA 3.45Å; L107-M597 PolarHBondContact O-N 3.29Å
108	I	95.5	Very high	93.1	Very high	40 Å²	40	27.3 Å²	27.3	21%	0.205	16%	0.156	C	C	.	.	H	α-helix	trans	-66.4	-36.4	-177.4	-66.3	172.9	0	0	0	111.3	A104 M105 S110 P111 L604	A104-I108 HydrophobicContact CB-CD1 3.97Å; A104-I108 WeakPolarHBondContact O-CG1 3.3Å; A104-I108 PolarHBondContact O-N 3.12Å; M105-I108 PolarHBondContact O-N 2.92Å; I108-S110 VanDerWaalsContact C-N 3.3Å; I108-S110 PolarHBondContact O-N 3.5Å; I108-P111 WeakPolarHBondContact O-CD 3.47Å; I108-L604 HydrophobicContact CD1-CD2 4.47Å
109	A	97	Very high	93	Very high	11 Å²	11	32.2 Å²	32.2	9%	0.091	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.5	-179.8	0	0	0	0	0	113.9	M105 L107 P111 V112 S113 L159 S162	M105-A109 VanDerWaalsContact O-CB 3.22Å; M105-A109 WeakPolarHBondContact O-CB 3.2Å; M105-A109 PolarHBondContact O-N 3.37Å; L107-A109 VanDerWaalsContact C-N 3.32Å; L107-A109 PolarHBondContact O-N 2.92Å; A109-P111 VanDerWaalsContact C-N 3.32Å; A109-V112 WeakPolarHBondContact O-CA 3.26Å; A109-V112 VanDerWaalsContact O-CB 3.32Å; A109-V112 WeakPolarHBondContact O-CB 3.37Å; A109-V112 PolarHBondContact O-N 3.21Å; A109-S113 PolarHBondContact O-N 3Å; A109-L159 HydrophobicContact CB-CD1 3.51Å; A109-S162 VanDerWaalsContact C-OG 3.26Å
110	S	97.6	Very high	93	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-54.7	-35.6	-178.9	-62.9	0	0	0	0	114.9	P106 L107 I108 V112 S113 S114 S162 C596	P106-S110 PolarHBondContact O-OG 2.95Å; L107-S110 WeakPolarHBondContact O-CB 3.07Å; L107-S110 PolarHBondContact O-N 3.42Å; L107-S110 PolarHBondContact O-OG 3.31Å; L107-S110 VanDerWaalsContact O-OG 3.09Å; I108-S110 VanDerWaalsContact C-N 3.3Å; I108-S110 PolarHBondContact O-N 3.5Å; S110-V112 VanDerWaalsContact C-N 3.25Å; S110-V112 PolarHBondContact O-N 2.86Å; S110-S113 WeakPolarHBondContact CA-OG 3.07Å; S110-S113 PolarHBondContact O-N 3.04Å; S110-S113 PolarHBondContact O-OG 2.89Å; S110-S114 WeakPolarHBondContact O-CB 3.23Å; S110-S114 PolarHBondContact O-N 3.15Å; S110-S114 PolarHBondContact O-OG 3.45Å; S110-S114 VanDerWaalsContact O-OG 3.08Å; S110-S162 PolarHBondContact N-OG 3.32Å; S110-C596 VanDerWaalsContact CB-CB 3.48Å; S110-C596 WeakPolarHBondContact OG-CB 3.46Å
111	P	97.2	Very high	93.2	Very high	20 Å²	20	42.4 Å²	42.4	13%	0.13	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-32.1	173.5	-23.6	33.9	0	0	0	113.3	I108 A109 A115 Y456 G593 M597	I108-P111 WeakPolarHBondContact O-CD 3.47Å; A109-P111 VanDerWaalsContact C-N 3.32Å; P111-A115 WeakPolarHBondContact O-CB 3.25Å; P111-A115 PolarHBondContact O-N 3.47Å; P111-A115 VanDerWaalsContact O-N 3.07Å; P111-Y456 VanDerWaalsContact C-OH 3.26Å; P111-Y456 WeakPolarHBondContact CA-OH 3.4Å; P111-Y456 HydrophobicContact CB-CE1 4.32Å; P111-Y456 HydrophobicContact CB-CE2 4.33Å; P111-Y456 PolarHBondContact O-OH 2.6Å; P111-G593 WeakPolarHBondContact CD-O 3.46Å; P111-G593 WeakPolarHBondContact CG-O 3.45Å; P111-M597 HydrophobicContact CG-CB 3.71Å; P111-M597 HydrophobicContact CG-CG 4.17Å; P111-M597 HydrophobicContact CG-SD 3.78Å
112	V	96.2	Very high	93.4	Very high	80 Å²	80	40.4 Å²	40.4	49%	0.485	20%	0.201	S	C	.	.	H	α-helix	trans	-70.3	-45.4	175.9	-178.2	0	0	0	0	109.6	A109 S110 S114 A115 L116 F163	A109-V112 WeakPolarHBondContact O-CA 3.26Å; A109-V112 VanDerWaalsContact O-CB 3.32Å; A109-V112 WeakPolarHBondContact O-CB 3.37Å; A109-V112 PolarHBondContact O-N 3.21Å; S110-V112 VanDerWaalsContact C-N 3.25Å; S110-V112 PolarHBondContact O-N 2.86Å; V112-S114 PolarHBondContact O-N 3Å; V112-A115 PolarHBondContact O-N 3.14Å; V112-L116 HydrophobicContact CG1-CD1 4.22Å; V112-L116 VanDerWaalsContact O-CG 3.3Å; V112-L116 WeakPolarHBondContact O-CG 3.05Å; V112-L116 PolarHBondContact O-N 3.32Å; V112-L116 VanDerWaalsContact O-N 3.08Å; V112-F163 HydrophobicContact CG1-CE1 4.25Å; V112-F163 HydrophobicContact CG1-CZ 4.47Å
113	S	97.3	Very high	93.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-42.5	174.8	47.5	0	0	0	0	112.4	A109 S110 A115 L116 I117 T166	A109-S113 PolarHBondContact O-N 3Å; S110-S113 WeakPolarHBondContact CA-OG 3.07Å; S110-S113 PolarHBondContact O-N 3.04Å; S110-S113 PolarHBondContact O-OG 2.89Å; S113-A115 PolarHBondContact O-N 2.98Å; S113-L116 CarbonylContact O-C 3.47Å; S113-L116 WeakPolarHBondContact O-CB 3.32Å; S113-L116 PolarHBondContact O-N 3.1Å; S113-L116 VanDerWaalsContact O-N 3.09Å; S113-I117 WeakPolarHBondContact O-CD1 3.01Å; S113-I117 VanDerWaalsContact O-CG1 3.25Å; S113-I117 WeakPolarHBondContact O-CG1 3.36Å; S113-I117 PolarHBondContact O-N 3.11Å; S113-T166 VanDerWaalsContact OG-CB 3.28Å; S113-T166 WeakPolarHBondContact OG-CB 3.49Å; S113-T166 PolarHBondContact OG-OG1 2.79Å
114	S	96.6	Very high	93.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-45.9	178.2	-72.6	0	0	0	0	111.8	S110 V112 L116 I117 D118 Y456 V589 G593	S110-S114 WeakPolarHBondContact O-CB 3.23Å; S110-S114 PolarHBondContact O-N 3.15Å; S110-S114 PolarHBondContact O-OG 3.45Å; S110-S114 VanDerWaalsContact O-OG 3.08Å; V112-S114 PolarHBondContact O-N 3Å; S114-L116 VanDerWaalsContact C-N 3.26Å; S114-L116 PolarHBondContact O-N 3.3Å; S114-I117 PolarHBondContact O-N 2.89Å; S114-D118 PolarHBondContact O-N 3.34Å; S114-D118 VanDerWaalsContact O-N 3.11Å; S114-Y456 WeakPolarHBondContact CB-OH 3.31Å; S114-V589 WeakPolarHBondContact CB-O 3.39Å; S114-V589 WeakPolarHBondContact O-CG1 3.45Å; S114-V589 PolarHBondContact OG-O 3.38Å; S114-G593 VanDerWaalsContact OG-CA 3.31Å; S114-G593 WeakPolarHBondContact OG-CA 3.28Å; S114-G593 PolarHBondContact OG-N 3.18Å
115	A	93.7	Very high	94.2	Very high	13 Å²	13	44.5 Å²	44.5	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-28	176.4	0	0	0	0	0	113.2	P111 V112 S113 R119 I452 Y590	P111-A115 WeakPolarHBondContact O-CB 3.25Å; P111-A115 PolarHBondContact O-N 3.47Å; P111-A115 VanDerWaalsContact O-N 3.07Å; V112-A115 PolarHBondContact O-N 3.14Å; S113-A115 PolarHBondContact O-N 2.98Å; A115-R119 VanDerWaalsContact O-CG 3.31Å; A115-R119 WeakPolarHBondContact O-CG 3.44Å; A115-I452 HydrophobicContact CB-CD1 4.02Å; A115-I452 HydrophobicContact CB-CG1 4.49Å; A115-I452 HydrophobicContact CB-CG2 3.91Å; A115-Y590 HydrophobicContact CB-CE1 4.43Å
116	L	93.3	Very high	94.5	Very high	46 Å²	46	42.9 Å²	42.9	24%	0.241	21%	0.213	C	C	.	.	H	α-helix	trans	-77.4	-39.4	174.1	-70.7	171.2	0	0	0	111.8	V112 S113 S114 D118 R119 Y120 V125 F163	V112-L116 HydrophobicContact CG1-CD1 4.22Å; V112-L116 VanDerWaalsContact O-CG 3.3Å; V112-L116 WeakPolarHBondContact O-CG 3.05Å; V112-L116 PolarHBondContact O-N 3.32Å; V112-L116 VanDerWaalsContact O-N 3.08Å; S113-L116 CarbonylContact O-C 3.47Å; S113-L116 WeakPolarHBondContact O-CB 3.32Å; S113-L116 PolarHBondContact O-N 3.1Å; S113-L116 VanDerWaalsContact O-N 3.09Å; S114-L116 VanDerWaalsContact C-N 3.26Å; S114-L116 PolarHBondContact O-N 3.3Å; L116-D118 VanDerWaalsContact C-N 3.34Å; L116-D118 PolarHBondContact O-N 3.04Å; L116-R119 PolarHBondContact O-N 2.97Å; L116-R119 VanDerWaalsContact O-N 3.1Å; L116-Y120 HydrophobicContact CB-CD2 4.47Å; L116-Y120 HydrophobicContact CD2-CD2 3.85Å; L116-Y120 HydrophobicContact CD2-CE2 3.74Å; L116-Y120 WeakPolarHBondContact O-CB 3.24Å; L116-Y120 PolarHBondContact O-N 3.2Å; L116-V125 HydrophobicContact CB-CG1 4.34Å; L116-V125 HydrophobicContact CB-CG2 3.82Å; L116-F163 HydrophobicContact CD1-CD2 4.35Å; L116-F163 HydrophobicContact CD1-CE1 3.79Å; L116-F163 HydrophobicContact CD1-CE2 3.61Å; L116-F163 HydrophobicContact CD1-CZ 3.27Å
117	I	93.6	Very high	94.6	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.036	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-43.8	179	-70.6	160.3	0	0	0	110.2	S113 S114 R119 E121 C122 V125 T166 A167 V170 V589	S113-I117 WeakPolarHBondContact O-CD1 3.01Å; S113-I117 VanDerWaalsContact O-CG1 3.25Å; S113-I117 WeakPolarHBondContact O-CG1 3.36Å; S113-I117 PolarHBondContact O-N 3.11Å; S114-I117 PolarHBondContact O-N 2.89Å; I117-R119 PolarHBondContact O-N 2.99Å; I117-E121 VanDerWaalsContact O-CA 3.24Å; I117-E121 WeakPolarHBondContact O-CA 3.44Å; I117-E121 PolarHBondContact O-N 3.31Å; I117-C122 VanDerWaalsContact CG2-SG 3.56Å; I117-V125 HydrophobicContact CG1-CB 4.06Å; I117-V125 HydrophobicContact CG1-CG1 3.92Å; I117-V125 HydrophobicContact CG1-CG2 4.15Å; I117-T166 HydrophobicContact CD1-CG2 3.69Å; I117-A167 HydrophobicContact CD1-CB 3.87Å; I117-A167 HydrophobicContact CG1-CB 4.18Å; I117-V170 HydrophobicContact CD1-CG2 4.46Å; I117-V170 HydrophobicContact CG2-CG1 4.09Å; I117-V589 HydrophobicContact CB-CG1 4.19Å; I117-V589 HydrophobicContact CG2-CG1 4.19Å
118	D	88.6	Confident	94.7	Very high	89 Å²	89	45.4 Å²	45.4	48%	0.476	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-28.4	175.8	-173.6	65.6	0	0	0	112.9	S114 L116 Y590	S114-D118 PolarHBondContact O-N 3.34Å; S114-D118 VanDerWaalsContact O-N 3.11Å; L116-D118 VanDerWaalsContact C-N 3.34Å; L116-D118 PolarHBondContact O-N 3.04Å; D118-Y590 HydrophobicContact CB-CE2 4.15Å; D118-Y590 WeakPolarHBondContact CB-OH 3.28Å; D118-Y590 PolarHBondContact OD2-OH 3.32Å
119	R	86.6	Confident	94.8	Very high	103 Å²	103	43.5 Å²	43.5	39%	0.389	22%	0.221	S	C	.	.	H	α-helix	trans	-95.4	-35.8	-176.5	-70.4	-178.1	179	-67	-14.7	115.1	A115 L116 I117 S448 I452	A115-R119 VanDerWaalsContact O-CG 3.31Å; A115-R119 WeakPolarHBondContact O-CG 3.44Å; L116-R119 PolarHBondContact O-N 2.97Å; L116-R119 VanDerWaalsContact O-N 3.1Å; I117-R119 PolarHBondContact O-N 2.99Å; R119-S448 PolarHBondContact NH1-OG 3.42Å; R119-S448 PolarHBondContact NH2-O 2.91Å; R119-S448 PolarHBondContact NH2-OG 3.1Å; R119-I452 VanDerWaalsContact NE-CD1 3.32Å
120	Y	88	Confident	94.9	Very high	145 Å²	145	43 Å²	43	57%	0.569	22%	0.217	S	C	*	.	H	α-helix	trans	-123.4	3.9	-168	-61.8	-67.6	0	0	0	113.1	L116 A124	L116-Y120 HydrophobicContact CB-CD2 4.47Å; L116-Y120 HydrophobicContact CD2-CD2 3.85Å; L116-Y120 HydrophobicContact CD2-CE2 3.74Å; L116-Y120 WeakPolarHBondContact O-CB 3.24Å; L116-Y120 PolarHBondContact O-N 3.2Å; Y120-A124 VanDerWaalsContact O-CB 3.26Å; Y120-A124 WeakPolarHBondContact O-CB 3.35Å
121	E	89.8	Confident	94.9	Very high	125 Å²	125	47.2 Å²	47.2	58%	0.584	24%	0.239	S	C	*	.	H	α-helix	trans	69.8	163.9	-178.9	-43.2	170	162.5	0	0	112.8	I117 R123 V125 D234	I117-E121 VanDerWaalsContact O-CA 3.24Å; I117-E121 WeakPolarHBondContact O-CA 3.44Å; I117-E121 PolarHBondContact O-N 3.31Å; E121-R123 PolarHBondContact O-N 3.47Å; E121-V125 VanDerWaalsContact O-CG2 3.28Å; E121-V125 WeakPolarHBondContact O-CG2 3.5Å; E121-V125 PolarHBondContact O-N 3.14Å; E121-D234 HydrophobicContact CB-CB 4.1Å; E121-D234 VanDerWaalsContact CB-CG 3.46Å; E121-D234 VanDerWaalsContact CB-OD2 3.28Å; E121-D234 WeakPolarHBondContact CB-OD2 3.1Å
122	C	94.1	Very high	95	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-37.1	-173	-53.7	0	0	0	0	111.4	I117 T126 A167 A171 I232 D234	I117-C122 VanDerWaalsContact CG2-SG 3.56Å; C122-T126 WeakPolarHBondContact O-CB 3.32Å; C122-T126 PolarHBondContact O-N 3.14Å; C122-T126 PolarHBondContact O-OG1 3.2Å; C122-A167 HydrophobicContact CB-CB 4.18Å; C122-A171 HydrophobicContact CB-CB 4.21Å; C122-I232 HydrophobicContact CB-CG2 3.96Å; C122-D234 WeakPolarHBondContact CA-OD1 3.29Å; C122-D234 WeakPolarHBondContact CB-OD1 3.46Å; C122-D234 PolarHBondContact N-OD1 2.9Å; C122-D234 PolarHBondContact N-OD2 3.37Å; C122-D234 PolarHBondContact SG-OD1 3.3Å
123	R	96.5	Very high	95	Very high	124 Å²	124	44.6 Å²	44.6	47%	0.468	22%	0.221	S	C	.	.	H	α-helix	trans	-58.6	-55	-178.9	179	173.7	-175.7	-165	0.6	112.2	E121 V125 T126 I127 G229 I232 D234	E121-R123 PolarHBondContact O-N 3.47Å; R123-V125 VanDerWaalsContact C-N 3.34Å; R123-V125 PolarHBondContact O-N 3.3Å; R123-T126 PolarHBondContact O-N 2.91Å; R123-I127 HydrophobicContact CG-CD1 4.01Å; R123-I127 VanDerWaalsContact O-CG1 3.31Å; R123-I127 WeakPolarHBondContact O-CG1 3.21Å; R123-I127 PolarHBondContact O-N 3.28Å; R123-I127 VanDerWaalsContact O-N 3.08Å; R123-G229 WeakPolarHBondContact CG-O 3.49Å; R123-I232 VanDerWaalsContact CB-O 3.32Å; R123-I232 WeakPolarHBondContact CB-O 2.97Å; R123-I232 WeakPolarHBondContact CD-O 3.44Å; R123-I232 WeakPolarHBondContact CG-O 3.41Å; R123-D234 WeakPolarHBondContact CB-OD2 3.36Å; R123-D234 PolarHBondContact N-OD2 3.45Å
124	A	95.7	Very high	95	Very high	47 Å²	47	47.5 Å²	47.5	39%	0.388	23%	0.234	S	C	.	.	H	α-helix	trans	-67.3	-38.4	-175.1	0	0	0	0	0	111.4	Y120 I127 A128	Y120-A124 VanDerWaalsContact O-CB 3.26Å; Y120-A124 WeakPolarHBondContact O-CB 3.35Å; A124-I127 PolarHBondContact O-N 3.43Å; A124-A128 WeakPolarHBondContact O-CB 3.18Å; A124-A128 PolarHBondContact O-N 3.03Å
125	V	97.3	Very high	95.1	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177.9	176.6	0	0	0	0	111.5	L116 I117 E121 R123 A128 G129 F163	L116-V125 HydrophobicContact CB-CG1 4.34Å; L116-V125 HydrophobicContact CB-CG2 3.82Å; I117-V125 HydrophobicContact CG1-CB 4.06Å; I117-V125 HydrophobicContact CG1-CG1 3.92Å; I117-V125 HydrophobicContact CG1-CG2 4.15Å; E121-V125 VanDerWaalsContact O-CG2 3.28Å; E121-V125 WeakPolarHBondContact O-CG2 3.5Å; E121-V125 PolarHBondContact O-N 3.14Å; R123-V125 VanDerWaalsContact C-N 3.34Å; R123-V125 PolarHBondContact O-N 3.3Å; V125-A128 PolarHBondContact O-N 2.92Å; V125-G129 PolarHBondContact O-N 2.92Å; V125-F163 HydrophobicContact CG1-CB 3.82Å; V125-F163 HydrophobicContact CG1-CD2 4.25Å; V125-F163 HydrophobicContact CG1-CG 4.06Å
126	T	98.1	Very high	95.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-42.2	176.4	-52.4	0	0	0	0	111.6	C122 R123 G129 G130 C164 A167 G229 I232	C122-T126 WeakPolarHBondContact O-CB 3.32Å; C122-T126 PolarHBondContact O-N 3.14Å; C122-T126 PolarHBondContact O-OG1 3.2Å; R123-T126 PolarHBondContact O-N 2.91Å; T126-G129 PolarHBondContact O-N 2.9Å; T126-G130 PolarHBondContact O-N 3.47Å; T126-C164 HydrophobicContact CG2-CB 4.31Å; T126-C164 PolarHBondContact O-SG 3.2Å; T126-A167 WeakPolarHBondContact OG1-CB 3.32Å; T126-G229 VanDerWaalsContact CG2-CA 3.42Å; T126-I232 HydrophobicContact CG2-CD1 4.19Å
127	I	98.3	Very high	95.4	Very high	50 Å²	50	46.3 Å²	46.3	26%	0.256	23%	0.231	S	C	.	.	H	α-helix	trans	-62.5	-46.3	176.3	-67.4	167.2	0	0	0	110.6	R123 A124 G129 G130 L131 A226	R123-I127 HydrophobicContact CG-CD1 4.01Å; R123-I127 VanDerWaalsContact O-CG1 3.31Å; R123-I127 WeakPolarHBondContact O-CG1 3.21Å; R123-I127 PolarHBondContact O-N 3.28Å; R123-I127 VanDerWaalsContact O-N 3.08Å; A124-I127 PolarHBondContact O-N 3.43Å; I127-G129 VanDerWaalsContact C-N 3.31Å; I127-G129 PolarHBondContact O-N 3.33Å; I127-G130 PolarHBondContact O-N 3.46Å; I127-L131 HydrophobicContact CG2-CD1 4.21Å; I127-L131 WeakPolarHBondContact O-CG 3.27Å; I127-L131 PolarHBondContact O-N 2.87Å; I127-A226 HydrophobicContact CG2-CB 4.41Å
128	A	98	Very high	95.5	Very high	46 Å²	46	49.3 Å²	49.3	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-41	176	0	0	0	0	0	111.7	A124 V125 L131 L132	A124-A128 WeakPolarHBondContact O-CB 3.18Å; A124-A128 PolarHBondContact O-N 3.03Å; V125-A128 PolarHBondContact O-N 2.92Å; A128-L131 PolarHBondContact O-N 2.94Å; A128-L132 WeakPolarHBondContact O-CB 3.41Å; A128-L132 PolarHBondContact O-N 2.96Å
129	G	98.3	Very high	95.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-45.9	175	0	0	0	0	0	113	V125 T126 I127 L132 G133 G160	V125-G129 PolarHBondContact O-N 2.92Å; T126-G129 PolarHBondContact O-N 2.9Å; I127-G129 VanDerWaalsContact C-N 3.31Å; I127-G129 PolarHBondContact O-N 3.33Å; G129-L132 PolarHBondContact O-N 2.95Å; G129-G133 PolarHBondContact O-N 3.29Å; G129-G160 CarbonylContact C-O 3.59Å; G129-G160 WeakPolarHBondContact CA-O 3.43Å; G129-G160 CarbonylContact O-C 3.49Å; G129-G160 VanDerWaalsContact O-CA 3.29Å; G129-G160 WeakPolarHBondContact O-CA 3.4Å
130	G	98.2	Very high	96.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-40.3	177.1	0	0	0	0	0	113.1	T126 I127 G133 F134 C164	T126-G130 PolarHBondContact O-N 3.47Å; I127-G130 PolarHBondContact O-N 3.46Å; G130-G133 PolarHBondContact O-N 3.01Å; G130-F134 WeakPolarHBondContact O-CB 3.37Å; G130-F134 PolarHBondContact O-N 3.43Å; G130-C164 PolarHBondContact N-SG 3.44Å; G130-C164 VanDerWaalsContact N-SG 3.43Å
131	L	98.3	Very high	96.5	Very high	89 Å²	89	39.3 Å²	39.3	47%	0.466	21%	0.206	S	C	.	.	H	α-helix	trans	-66.2	-39.5	174.4	-69.3	172.9	0	0	0	112.2	I127 A128 A135 L223	I127-L131 HydrophobicContact CG2-CD1 4.21Å; I127-L131 WeakPolarHBondContact O-CG 3.27Å; I127-L131 PolarHBondContact O-N 2.87Å; A128-L131 PolarHBondContact O-N 2.94Å; L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 2.89Å; L131-L223 HydrophobicContact CD2-CD1 3.76Å
132	L	97.7	Very high	96.7	Very high	45 Å²	45	40 Å²	40	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-68.3	-40.9	176.9	-173.1	62.4	0	0	0	111.5	A128 G129 A135 G136 F156 L159 F163	A128-L132 WeakPolarHBondContact O-CB 3.41Å; A128-L132 PolarHBondContact O-N 2.96Å; G129-L132 PolarHBondContact O-N 2.95Å; L132-A135 PolarHBondContact O-N 3.2Å; L132-G136 PolarHBondContact O-N 2.93Å; L132-F156 HydrophobicContact CD1-CD1 4.06Å; L132-L159 HydrophobicContact CD2-CB 4.17Å; L132-L159 HydrophobicContact CD2-CD2 3.97Å; L132-L159 HydrophobicContact CD2-CG 3.88Å; L132-F163 HydrophobicContact CD2-CE2 4.44Å
133	G	97.4	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.2	-53.3	171.1	0	0	0	0	0	111.6	G129 G130 A135 G136 F137	G129-G133 PolarHBondContact O-N 3.29Å; G130-G133 PolarHBondContact O-N 3.01Å; G133-A135 VanDerWaalsContact C-N 3.35Å; G133-A135 PolarHBondContact O-N 2.85Å; G133-G136 PolarHBondContact O-N 3.4Å; G133-F137 WeakPolarHBondContact O-CD2 3.17Å; G133-F137 PolarHBondContact O-N 3.2Å
134	F	97.9	Very high	96.3	Very high	61 Å²	61	37.9 Å²	37.9	27%	0.268	22%	0.224	S	C	.	.	H	α-helix	trans	-52.6	-50.9	174	165.7	-101.6	0	0	0	111.8	G130 G136 F137 F138 S219 L223	G130-F134 WeakPolarHBondContact O-CB 3.37Å; G130-F134 PolarHBondContact O-N 3.43Å; F134-G136 VanDerWaalsContact C-N 3.35Å; F134-G136 PolarHBondContact O-N 3.01Å; F134-F137 PolarHBondContact O-N 2.88Å; F134-F138 HydrophobicContact CE2-CB 4.32Å; F134-F138 HydrophobicContact CE2-CD2 4.33Å; F134-F138 HydrophobicContact CZ-CB 4.28Å; F134-F138 HydrophobicContact CZ-CD2 4.19Å; F134-F138 HydrophobicContact CZ-CG 4.22Å; F134-F138 WeakPolarHBondContact O-CB 3.3Å; F134-F138 PolarHBondContact O-N 2.9Å; F134-S219 WeakPolarHBondContact CD2-O 3.47Å; F134-L223 HydrophobicContact CB-CB 4.11Å; F134-L223 HydrophobicContact CB-CD1 4.01Å; F134-L223 HydrophobicContact CD2-CB 4.04Å; F134-L223 HydrophobicContact CD2-CD2 4.34Å; F134-L223 HydrophobicContact CG-CB 4.27Å; F134-L223 HydrophobicContact CG-CD1 4.1Å
135	A	97.6	Very high	96	Very high	34 Å²	34	37.8 Å²	37.8	28%	0.281	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-41.6	-179.8	0	0	0	0	0	112.1	L131 L132 G133 F138 L139	L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 2.89Å; L132-A135 PolarHBondContact O-N 3.2Å; G133-A135 VanDerWaalsContact C-N 3.35Å; G133-A135 PolarHBondContact O-N 2.85Å; A135-F138 PolarHBondContact O-N 3.07Å; A135-L139 VanDerWaalsContact O-CB 3.29Å; A135-L139 WeakPolarHBondContact O-CB 3.44Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.83Å
136	G	97.3	Very high	95.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-50.1	176.7	0	0	0	0	0	112.6	L132 G133 F134 S140 S152	L132-G136 PolarHBondContact O-N 2.93Å; G133-G136 PolarHBondContact O-N 3.4Å; F134-G136 VanDerWaalsContact C-N 3.35Å; F134-G136 PolarHBondContact O-N 3.01Å; G136-S140 PolarHBondContact O-N 3.43Å; G136-S140 PolarHBondContact O-OG 3.3Å; G136-S152 CarbonylContact C-O 3.48Å; G136-S152 VanDerWaalsContact CA-O 3.25Å; G136-S152 WeakPolarHBondContact CA-O 3.15Å
137	F	95.7	Very high	95.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-44.9	175.5	-85.5	-93.1	0	0	0	112.2	I73 F102 G133 F134 S140 F153 A157 F161 L215 L218 A222	I73-F137 HydrophobicContact CG2-CE1 3.84Å; I73-F137 HydrophobicContact CG2-CE2 4.47Å; I73-F137 HydrophobicContact CG2-CZ 3.44Å; I73-F137 VanDerWaalsContact CG2-CZ 3.44Å; F102-F137 HydrophobicContact CE1-CZ 4.32Å; F102-F137 HydrophobicContact CE2-CE2 4.1Å; F102-F137 HydrophobicContact CE2-CZ 4.28Å; F102-F137 AromaticContact CZ-CE2 3.87Å; F102-F137 HydrophobicContact CZ-CE2 3.87Å; F102-F137 AromaticContact CZ-CZ 3.71Å; F102-F137 HydrophobicContact CZ-CZ 3.71Å; G133-F137 WeakPolarHBondContact O-CD2 3.17Å; G133-F137 PolarHBondContact O-N 3.2Å; F134-F137 PolarHBondContact O-N 2.88Å; F137-S140 WeakPolarHBondContact O-CB 3.44Å; F137-S140 PolarHBondContact O-N 3.35Å; F137-F153 HydrophobicContact CD1-CD2 4.11Å; F137-F153 AromaticContact CD1-CE2 3.9Å; F137-F153 HydrophobicContact CD1-CE2 3.9Å; F137-F153 AromaticContact CE1-CD2 3.9Å; F137-F153 HydrophobicContact CE1-CD2 3.9Å; F137-F153 AromaticContact CE1-CE2 3.26Å; F137-F153 HydrophobicContact CE1-CE2 3.26Å; F137-F153 HydrophobicContact CE1-CZ 4.16Å; F137-F153 HydrophobicContact CE2-CE2 4.47Å; F137-F153 HydrophobicContact CZ-CD2 4.18Å; F137-F153 AromaticContact CZ-CE2 3.55Å; F137-F153 HydrophobicContact CZ-CE2 3.55Å; F137-F153 HydrophobicContact CZ-CZ 4.12Å; F137-A157 HydrophobicContact CD2-CB 3.66Å; F137-A157 HydrophobicContact CE2-CB 3.66Å; F137-F161 HydrophobicContact CE2-CE1 4.35Å; F137-F161 AromaticContact CE2-CZ 3.93Å; F137-F161 HydrophobicContact CE2-CZ 3.93Å; F137-F161 HydrophobicContact CZ-CZ 4.49Å; F137-L215 HydrophobicContact CD1-CD2 4.16Å; F137-L218 HydrophobicContact CD1-CB 3.85Å; F137-L218 HydrophobicContact CE1-CB 4Å; F137-L218 HydrophobicContact CE1-CD1 4.32Å; F137-A222 HydrophobicContact CD2-CB 4.28Å
138	F	96.9	Very high	95.1	Very high	70 Å²	70	46.8 Å²	46.8	31%	0.307	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-44.7	-177.6	-175.4	-96.3	0	0	0	111.8	F134 A135 S140 Q141 F142	F134-F138 HydrophobicContact CE2-CB 4.32Å; F134-F138 HydrophobicContact CE2-CD2 4.33Å; F134-F138 HydrophobicContact CZ-CB 4.28Å; F134-F138 HydrophobicContact CZ-CD2 4.19Å; F134-F138 HydrophobicContact CZ-CG 4.22Å; F134-F138 WeakPolarHBondContact O-CB 3.3Å; F134-F138 PolarHBondContact O-N 2.9Å; A135-F138 PolarHBondContact O-N 3.07Å; F138-S140 PolarHBondContact O-N 3.32Å; F138-Q141 WeakPolarHBondContact O-CG 3.39Å; F138-Q141 PolarHBondContact O-N 3.46Å; F138-Q141 PolarHBondContact O-NE2 2.87Å; F138-F142 HydrophobicContact CD1-CE2 4.32Å; F138-F142 AromaticContact CE1-CE2 3.83Å; F138-F142 HydrophobicContact CE1-CE2 3.83Å; F138-F142 HydrophobicContact CE1-CZ 4.48Å; F138-F142 HydrophobicContact CZ-CE2 4.25Å
139	L	96	Very high	94.9	Very high	97 Å²	97	44.8 Å²	44.8	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-66.1	-26.3	177.8	-70.6	173	0	0	0	112.6	A135 Q141 F142	A135-L139 VanDerWaalsContact O-CB 3.29Å; A135-L139 WeakPolarHBondContact O-CB 3.44Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.83Å; L139-Q141 PolarHBondContact O-N 3.39Å; L139-F142 PolarHBondContact O-N 3.29Å; L139-F142 VanDerWaalsContact O-N 3.1Å
140	S	95.1	Very high	94.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-23.5	-179.4	-62.2	0	0	0	0	113.8	G136 F137 F138 F142 A143 S152 F153	G136-S140 PolarHBondContact O-N 3.43Å; G136-S140 PolarHBondContact O-OG 3.3Å; F137-S140 WeakPolarHBondContact O-CB 3.44Å; F137-S140 PolarHBondContact O-N 3.35Å; F138-S140 PolarHBondContact O-N 3.32Å; S140-F142 PolarHBondContact O-N 2.98Å; S140-A143 VanDerWaalsContact O-CB 3.28Å; S140-A143 WeakPolarHBondContact O-CB 3.39Å; S140-A143 PolarHBondContact O-N 3.25Å; S140-A143 VanDerWaalsContact O-N 3.17Å; S140-S152 WeakPolarHBondContact CA-OG 3.46Å; S140-S152 WeakPolarHBondContact OG-CB 3.49Å; S140-S152 PolarHBondContact OG-OG 2.85Å; S140-F153 WeakPolarHBondContact OG-CA 3.22Å; S140-F153 VanDerWaalsContact OG-CB 3.32Å; S140-F153 WeakPolarHBondContact OG-CB 3.48Å; S140-F153 PolarHBondContact OG-N 3.37Å; S140-F153 VanDerWaalsContact OG-N 3.14Å
141	Q	92.6	Very high	94.5	Very high	29 Å²	29	49.2 Å²	49.2	14%	0.136	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.2	175.1	83.5	-170.9	-89.9	0	0	112.8	F138 L139	F138-Q141 WeakPolarHBondContact O-CG 3.39Å; F138-Q141 PolarHBondContact O-N 3.46Å; F138-Q141 PolarHBondContact O-NE2 2.87Å; L139-Q141 PolarHBondContact O-N 3.39Å
142	F	93.8	Very high	94.3	Very high	139 Å²	139	45.4 Å²	45.4	61%	0.61	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	3.2	-179.4	-54.3	-67.1	0	0	0	112.2	F138 L139 S140 G144	F138-F142 HydrophobicContact CD1-CE2 4.32Å; F138-F142 AromaticContact CE1-CE2 3.83Å; F138-F142 HydrophobicContact CE1-CE2 3.83Å; F138-F142 HydrophobicContact CE1-CZ 4.48Å; F138-F142 HydrophobicContact CZ-CE2 4.25Å; L139-F142 PolarHBondContact O-N 3.29Å; L139-F142 VanDerWaalsContact O-N 3.1Å; S140-F142 PolarHBondContact O-N 2.98Å; F142-G144 PolarHBondContact O-N 2.64Å; F142-G144 VanDerWaalsContact O-N 3.17Å
143	A	91.7	Very high	94.1	Very high	8 Å²	8	43.4 Å²	43.4	7%	0.066	24%	0.241	C	C	.	.			trans	-64.4	117.8	-179.7	0	0	0	0	0	110.6	F88 S140 T148 L149	F88-A143 WeakPolarHBondContact CE1-O 3.21Å; F88-A143 HydrophobicContact CZ-CB 4.35Å; F88-A143 WeakPolarHBondContact CZ-O 3.32Å; S140-A143 VanDerWaalsContact O-CB 3.28Å; S140-A143 WeakPolarHBondContact O-CB 3.39Å; S140-A143 PolarHBondContact O-N 3.25Å; S140-A143 VanDerWaalsContact O-N 3.17Å; A143-T148 HydrophobicContact CB-CG2 4.09Å; A143-L149 HydrophobicContact CB-CB 3.98Å; A143-L149 HydrophobicContact CB-CD1 4.24Å
144	G	89.7	Confident	93.9	Very high	74 Å²	74	43.4 Å²	43.4	76%	0.763	24%	0.241	S	C	*	.			trans	-93.6	-4.6	174.6	0	0	0	0	0	114	F142	F142-G144 PolarHBondContact O-N 2.64Å; F142-G144 VanDerWaalsContact O-N 3.17Å
145	S	90.9	Very high	93.8	Very high	46 Å²	46	44.5 Å²	44.5	32%	0.322	25%	0.246	S	C	.	.	S	Bend	trans	-144.6	157.4	178.4	76	0	0	0	0	110.8	F147 T148 L149	S145-F147 PolarHBondContact O-N 2.93Å; S145-T148 PolarHBondContact O-N 2.71Å; S145-T148 PolarHBondContact OG-N 3.48Å; S145-T148 VanDerWaalsContact OG-N 3.08Å; S145-T148 PolarHBondContact OG-OG1 3.2Å; S145-L149 PolarHBondContact O-N 3.39Å
146	I	89.7	Confident	93.8	Very high	28 Å²	28	46.9 Å²	46.9	14%	0.144	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-40.3	174.5	-55.1	165.1	0	0	0	110.1	F88 A90 E94 V98 T148 L149 S150	F88-I146 HydrophobicContact CB-CD1 4.42Å; F88-I146 HydrophobicContact CB-CG1 3.83Å; F88-I146 HydrophobicContact CD1-CG1 4.49Å; F88-I146 HydrophobicContact CG-CG1 4.13Å; A90-I146 HydrophobicContact CB-CD1 3.21Å; A90-I146 HydrophobicContact CB-CG1 4.01Å; E94-I146 HydrophobicContact CB-CD1 3.74Å; E94-I146 HydrophobicContact CB-CG2 4.34Å; E94-I146 HydrophobicContact CG-CD1 4.49Å; E94-I146 WeakPolarHBondContact OE2-CD1 3.41Å; V98-I146 HydrophobicContact CG2-CG2 3.88Å; I146-T148 PolarHBondContact O-N 3.18Å; I146-L149 CarbonylContact O-C 3.56Å; I146-L149 WeakPolarHBondContact O-CB 3.01Å; I146-L149 PolarHBondContact O-N 3.3Å; I146-L149 VanDerWaalsContact O-N 3.11Å; I146-S150 PolarHBondContact O-N 3.07Å; I146-S150 PolarHBondContact O-OG 3.45Å; I146-S150 VanDerWaalsContact O-OG 3.07Å
147	F	90.9	Very high	93.8	Very high	155 Å²	155	46.8 Å²	46.8	68%	0.68	25%	0.25	S	C	*	.	H	α-helix	trans	-59	-45.7	177.5	178.5	-98.2	0	0	0	112.1	S145 L149 S150 L151	S145-F147 PolarHBondContact O-N 2.93Å; F147-L149 VanDerWaalsContact C-N 3.29Å; F147-L149 PolarHBondContact O-N 2.93Å; F147-S150 PolarHBondContact O-N 3Å; F147-L151 WeakPolarHBondContact O-CB 3.14Å; F147-L151 PolarHBondContact O-N 2.92Å
148	T	93.8	Very high	93.8	Very high	61 Å²	61	46.8 Å²	46.8	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-60.8	-41.1	175.6	-50.5	0	0	0	0	110.9	A143 S145 I146 L151 S152	A143-T148 HydrophobicContact CB-CG2 4.09Å; S145-T148 PolarHBondContact O-N 2.71Å; S145-T148 PolarHBondContact OG-N 3.48Å; S145-T148 VanDerWaalsContact OG-N 3.08Å; S145-T148 PolarHBondContact OG-OG1 3.2Å; I146-T148 PolarHBondContact O-N 3.18Å; T148-L151 PolarHBondContact O-N 2.82Å; T148-S152 PolarHBondContact O-N 3.28Å; T148-S152 PolarHBondContact O-OG 2.85Å
149	L	93	Very high	93.9	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-66.1	-44.3	177.1	-173.7	65.5	0	0	0	112	I84 F88 V98 A143 S145 I146 F147 L151 S152 F153 G154	I84-L149 HydrophobicContact CD1-CD2 4.11Å; I84-L149 HydrophobicContact CG1-CD2 4.19Å; I84-L149 HydrophobicContact CG2-CD2 3.89Å; F88-L149 HydrophobicContact CE2-CD2 3.89Å; F88-L149 HydrophobicContact CZ-CD2 4.48Å; V98-L149 HydrophobicContact CG1-CD2 4.17Å; V98-L149 HydrophobicContact CG1-CG 3.97Å; V98-L149 HydrophobicContact CG2-CD2 4.25Å; V98-L149 HydrophobicContact CG2-CG 4.4Å; A143-L149 HydrophobicContact CB-CB 3.98Å; A143-L149 HydrophobicContact CB-CD1 4.24Å; S145-L149 PolarHBondContact O-N 3.39Å; I146-L149 CarbonylContact O-C 3.56Å; I146-L149 WeakPolarHBondContact O-CB 3.01Å; I146-L149 PolarHBondContact O-N 3.3Å; I146-L149 VanDerWaalsContact O-N 3.11Å; F147-L149 VanDerWaalsContact C-N 3.29Å; F147-L149 PolarHBondContact O-N 2.93Å; L149-L151 PolarHBondContact O-N 2.75Å; L149-S152 PolarHBondContact O-N 2.97Å; L149-F153 HydrophobicContact CD1-CB 3.89Å; L149-F153 HydrophobicContact CG-CB 4.33Å; L149-F153 WeakPolarHBondContact O-CA 3.49Å; L149-F153 WeakPolarHBondContact O-CB 3.36Å; L149-F153 PolarHBondContact O-N 2.79Å; L149-G154 PolarHBondContact O-N 3.29Å
150	S	92.5	Very high	94	Very high	13 Å²	13	40.3 Å²	40.3	9%	0.091	22%	0.218	C	C	.	.	I	π-helix	trans	-58.5	-37.4	174.1	-60.1	0	0	0	0	111.6	V98 I146 F147 G154 F155	V98-S150 WeakPolarHBondContact CG2-OG 3.39Å; I146-S150 PolarHBondContact O-N 3.07Å; I146-S150 PolarHBondContact O-OG 3.45Å; I146-S150 VanDerWaalsContact O-OG 3.07Å; F147-S150 PolarHBondContact O-N 3Å; S150-G154 CarbonylContact O-C 3.25Å; S150-G154 WeakPolarHBondContact O-CA 3.5Å; S150-G154 PolarHBondContact O-N 2.99Å; S150-G154 VanDerWaalsContact O-N 3.15Å; S150-F155 PolarHBondContact O-N 3.04Å
151	L	95.3	Very high	94.1	Very high	80 Å²	80	40.3 Å²	40.3	42%	0.419	22%	0.219	S	C	.	.	I	π-helix	trans	-74.3	-47.3	178.7	-171.6	64.9	0	0	0	112.2	F147 T148 L149 F155 F156	F147-L151 WeakPolarHBondContact O-CB 3.14Å; F147-L151 PolarHBondContact O-N 2.92Å; T148-L151 PolarHBondContact O-N 2.82Å; L149-L151 PolarHBondContact O-N 2.75Å; L151-F155 HydrophobicContact CD1-CB 4.42Å; L151-F155 WeakPolarHBondContact O-CB 3.35Å; L151-F156 HydrophobicContact CD1-CE2 4.31Å; L151-F156 HydrophobicContact CG-CD2 4.4Å; L151-F156 HydrophobicContact CG-CE2 4.04Å; L151-F156 WeakPolarHBondContact O-CD2 3.46Å; L151-F156 PolarHBondContact O-N 3.49Å; L151-F156 VanDerWaalsContact O-N 3.07Å
152	S	95.3	Very high	94.3	Very high	8 Å²	8	39 Å²	39	6%	0.056	21%	0.212	C	C	.	.	I	π-helix	trans	-75.8	-55.4	-178.1	60.1	0	0	0	0	112.8	G136 S140 T148 L149 F156 A157	G136-S152 CarbonylContact C-O 3.48Å; G136-S152 VanDerWaalsContact CA-O 3.25Å; G136-S152 WeakPolarHBondContact CA-O 3.15Å; S140-S152 WeakPolarHBondContact CA-OG 3.46Å; S140-S152 WeakPolarHBondContact OG-CB 3.49Å; S140-S152 PolarHBondContact OG-OG 2.85Å; T148-S152 PolarHBondContact O-N 3.28Å; T148-S152 PolarHBondContact O-OG 2.85Å; L149-S152 PolarHBondContact O-N 2.97Å; S152-F156 WeakPolarHBondContact O-CB 3.08Å; S152-A157 PolarHBondContact O-N 3.48Å; S152-A157 VanDerWaalsContact O-N 3.17Å
153	F	93.7	Very high	94.6	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.018	19%	0.188	C	C	.	.	I	π-helix	trans	-77	-54.4	-178.2	-178.4	-89.1	0	0	0	110.5	F77 L80 V98 F102 F137 S140 L149 A157 L215	F77-F153 AromaticContact CD2-CE1 3.44Å; F77-F153 HydrophobicContact CD2-CE1 3.44Å; F77-F153 VanDerWaalsContact CD2-CE1 3.44Å; F77-F153 AromaticContact CD2-CZ 3.65Å; F77-F153 HydrophobicContact CD2-CZ 3.65Å; F77-F153 HydrophobicContact CE2-CD1 4.16Å; F77-F153 AromaticContact CE2-CE1 3.45Å; F77-F153 HydrophobicContact CE2-CE1 3.45Å; F77-F153 VanDerWaalsContact CE2-CE1 3.45Å; F77-F153 AromaticContact CE2-CZ 3.95Å; F77-F153 HydrophobicContact CE2-CZ 3.95Å; L80-F153 HydrophobicContact CD1-CZ 4.45Å; V98-F153 HydrophobicContact CG1-CB 4.44Å; V98-F153 HydrophobicContact CG1-CD1 3.65Å; V98-F153 HydrophobicContact CG1-CE1 4.34Å; V98-F153 HydrophobicContact CG1-CG 4.38Å; F102-F153 HydrophobicContact CB-CD1 4.05Å; F102-F153 HydrophobicContact CB-CE1 3.72Å; F102-F153 AromaticContact CD1-CE1 3.61Å; F102-F153 HydrophobicContact CD1-CE1 3.61Å; F102-F153 AromaticContact CD1-CZ 3.84Å; F102-F153 HydrophobicContact CD1-CZ 3.84Å; F102-F153 HydrophobicContact CD2-CD1 4.37Å; F102-F153 HydrophobicContact CD2-CE1 4.13Å; F102-F153 VanDerWaalsContact CD2-O 3.32Å; F102-F153 WeakPolarHBondContact CD2-O 3.32Å; F102-F153 HydrophobicContact CE1-CE1 4.2Å; F102-F153 AromaticContact CE1-CZ 3.97Å; F102-F153 HydrophobicContact CE1-CZ 3.97Å; F102-F153 HydrophobicContact CG-CD1 4.1Å; F102-F153 AromaticContact CG-CE1 3.55Å; F102-F153 HydrophobicContact CG-CE1 3.55Å; F102-F153 HydrophobicContact CG-CZ 4.15Å; F102-F153 HydrophobicContact CZ-CZ 4.44Å; F137-F153 HydrophobicContact CD1-CD2 4.11Å; F137-F153 AromaticContact CD1-CE2 3.9Å; F137-F153 HydrophobicContact CD1-CE2 3.9Å; F137-F153 AromaticContact CE1-CD2 3.9Å; F137-F153 HydrophobicContact CE1-CD2 3.9Å; F137-F153 AromaticContact CE1-CE2 3.26Å; F137-F153 HydrophobicContact CE1-CE2 3.26Å; F137-F153 HydrophobicContact CE1-CZ 4.16Å; F137-F153 HydrophobicContact CE2-CE2 4.47Å; F137-F153 HydrophobicContact CZ-CD2 4.18Å; F137-F153 AromaticContact CZ-CE2 3.55Å; F137-F153 HydrophobicContact CZ-CE2 3.55Å; F137-F153 HydrophobicContact CZ-CZ 4.12Å; S140-F153 WeakPolarHBondContact OG-CA 3.22Å; S140-F153 VanDerWaalsContact OG-CB 3.32Å; S140-F153 WeakPolarHBondContact OG-CB 3.48Å; S140-F153 PolarHBondContact OG-N 3.37Å; S140-F153 VanDerWaalsContact OG-N 3.14Å; L149-F153 HydrophobicContact CD1-CB 3.89Å; L149-F153 HydrophobicContact CG-CB 4.33Å; L149-F153 WeakPolarHBondContact O-CA 3.49Å; L149-F153 WeakPolarHBondContact O-CB 3.36Å; L149-F153 PolarHBondContact O-N 2.79Å; F153-A157 WeakPolarHBondContact O-CB 3.41Å; F153-L215 HydrophobicContact CD2-CD2 4.2Å; F153-L215 HydrophobicContact CE2-CD2 4.18Å
154	G	93.2	Very high	94.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-64	-62.8	-175.7	0	0	0	0	0	112	L149 S150 G158	L149-G154 PolarHBondContact O-N 3.29Å; S150-G154 CarbonylContact O-C 3.25Å; S150-G154 WeakPolarHBondContact O-CA 3.5Å; S150-G154 PolarHBondContact O-N 2.99Å; S150-G154 VanDerWaalsContact O-N 3.15Å; G154-G158 PolarHBondContact O-N 3.25Å
155	F	95.3	Very high	95.2	Very high	83 Å²	83	31 Å²	31	36%	0.364	16%	0.155	S	C	.	.	I	π-helix	trans	-77.6	-58.3	-171.9	-175.2	-89.3	0	0	0	113.1	M105 S150 L151 L159	M105-F155 HydrophobicContact CE-CD2 3.9Å; M105-F155 HydrophobicContact CE-CE2 4.27Å; M105-F155 HydrophobicContact SD-CD2 3.79Å; M105-F155 HydrophobicContact SD-CE2 4.03Å; S150-F155 PolarHBondContact O-N 3.04Å; L151-F155 HydrophobicContact CD1-CB 4.42Å; L151-F155 WeakPolarHBondContact O-CB 3.35Å; F155-L159 HydrophobicContact CE1-CD2 4.22Å; F155-L159 WeakPolarHBondContact O-CB 3.42Å; F155-L159 PolarHBondContact O-N 3.19Å
156	F	96.9	Very high	95.5	Very high	84 Å²	84	28.8 Å²	28.8	37%	0.368	14%	0.14	S	C	.	.	I	π-helix	trans	-69.6	-44	-173.9	-74.9	-63.6	0	0	0	113.1	L132 L151 S152 L159 G160	L132-F156 HydrophobicContact CD1-CD1 4.06Å; L151-F156 HydrophobicContact CD1-CE2 4.31Å; L151-F156 HydrophobicContact CG-CD2 4.4Å; L151-F156 HydrophobicContact CG-CE2 4.04Å; L151-F156 WeakPolarHBondContact O-CD2 3.46Å; L151-F156 PolarHBondContact O-N 3.49Å; L151-F156 VanDerWaalsContact O-N 3.07Å; S152-F156 WeakPolarHBondContact O-CB 3.08Å; F156-L159 PolarHBondContact O-N 3.17Å; F156-G160 PolarHBondContact O-N 3.42Å
157	A	96.8	Very high	95.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-68.3	-40.1	177.4	0	0	0	0	0	111.7	F102 F137 S152 F153 L159 G160 F161	F102-A157 HydrophobicContact CD2-CB 4.31Å; F102-A157 HydrophobicContact CE2-CB 3.8Å; F137-A157 HydrophobicContact CD2-CB 3.66Å; F137-A157 HydrophobicContact CE2-CB 3.66Å; S152-A157 PolarHBondContact O-N 3.48Å; S152-A157 VanDerWaalsContact O-N 3.17Å; F153-A157 WeakPolarHBondContact O-CB 3.41Å; A157-L159 PolarHBondContact O-N 3.37Å; A157-G160 PolarHBondContact O-N 3.09Å; A157-F161 PolarHBondContact O-N 3.03Å
158	G	96.9	Very high	96.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.6	-40	174.7	0	0	0	0	0	113.1	G154 F161 S162	G154-G158 PolarHBondContact O-N 3.25Å; G158-F161 PolarHBondContact O-N 2.89Å; G158-S162 PolarHBondContact O-N 3.38Å
159	L	97.8	Very high	96.3	Very high	30 Å²	30	17.3 Å²	17.3	16%	0.157	8%	0.083	C	C	.	.	H	α-helix	trans	-64	-41.2	173.5	-178.3	61.6	0	0	0	111.8	A109 L132 F155 F156 A157 F161 S162 F163	A109-L159 HydrophobicContact CB-CD1 3.51Å; L132-L159 HydrophobicContact CD2-CB 4.17Å; L132-L159 HydrophobicContact CD2-CD2 3.97Å; L132-L159 HydrophobicContact CD2-CG 3.88Å; F155-L159 HydrophobicContact CE1-CD2 4.22Å; F155-L159 WeakPolarHBondContact O-CB 3.42Å; F155-L159 PolarHBondContact O-N 3.19Å; F156-L159 PolarHBondContact O-N 3.17Å; A157-L159 PolarHBondContact O-N 3.37Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.33Å; L159-S162 VanDerWaalsContact O-CB 3.29Å; L159-S162 WeakPolarHBondContact O-CB 3.48Å; L159-S162 PolarHBondContact O-N 2.93Å; L159-F163 HydrophobicContact CD1-CD1 4.34Å; L159-F163 HydrophobicContact CD1-CE1 3.6Å; L159-F163 HydrophobicContact CD1-CZ 4.1Å; L159-F163 HydrophobicContact CG-CE1 4.04Å; L159-F163 HydrophobicContact CG-CZ 4.15Å; L159-F163 VanDerWaalsContact O-CD1 3.31Å; L159-F163 WeakPolarHBondContact O-CD1 3.34Å; L159-F163 PolarHBondContact O-N 3.09Å
160	G	98.2	Very high	96.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.7	-42.1	173.5	0	0	0	0	0	112.4	G129 F156 A157 F163 C164	G129-G160 CarbonylContact C-O 3.59Å; G129-G160 WeakPolarHBondContact CA-O 3.43Å; G129-G160 CarbonylContact O-C 3.49Å; G129-G160 VanDerWaalsContact O-CA 3.29Å; G129-G160 WeakPolarHBondContact O-CA 3.4Å; F156-G160 PolarHBondContact O-N 3.42Å; A157-G160 PolarHBondContact O-N 3.09Å; G160-F163 WeakPolarHBondContact O-CB 3.31Å; G160-F163 PolarHBondContact O-N 3.47Å; G160-C164 PolarHBondContact O-N 2.83Å; G160-C164 PolarHBondContact O-SG 3.39Å
161	F	97.6	Very high	96.6	Very high	1 Å²	1	16.6 Å²	16.6	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-68.6	-34.1	176.6	-78.6	16	0	0	0	112.5	A70 I73 F102 P106 F137 A157 G158 L159 F163 C164 F165 A222 L225	A70-F161 VanDerWaalsContact CA-CE2 3.45Å; A70-F161 HydrophobicContact CB-CD2 3.7Å; A70-F161 HydrophobicContact CB-CE2 3.95Å; A70-F161 HydrophobicContact CB-CG 4.03Å; A70-F161 HydrophobicContact CB-CZ 4.5Å; A70-F161 WeakPolarHBondContact O-CE2 3.42Å; I73-F161 HydrophobicContact CB-CE2 4.33Å; I73-F161 HydrophobicContact CD1-CZ 4.2Å; F102-F161 HydrophobicContact CE1-CE2 4.33Å; F102-F161 HydrophobicContact CE2-CD2 4.03Å; F102-F161 HydrophobicContact CE2-CE2 4.15Å; F102-F161 AromaticContact CZ-CD2 3.66Å; F102-F161 HydrophobicContact CZ-CD2 3.66Å; F102-F161 AromaticContact CZ-CE2 3.43Å; F102-F161 HydrophobicContact CZ-CE2 3.43Å; F102-F161 VanDerWaalsContact CZ-CE2 3.43Å; F102-F161 HydrophobicContact CZ-CZ 4.18Å; P106-F161 HydrophobicContact CG-CB 4.06Å; F137-F161 HydrophobicContact CE2-CE1 4.35Å; F137-F161 AromaticContact CE2-CZ 3.93Å; F137-F161 HydrophobicContact CE2-CZ 3.93Å; F137-F161 HydrophobicContact CZ-CZ 4.49Å; A157-F161 PolarHBondContact O-N 3.03Å; G158-F161 PolarHBondContact O-N 2.89Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.33Å; F161-F163 VanDerWaalsContact C-N 3.26Å; F161-F163 PolarHBondContact O-N 3.43Å; F161-C164 PolarHBondContact O-N 2.89Å; F161-F165 VanDerWaalsContact O-CB 3.27Å; F161-F165 WeakPolarHBondContact O-CB 3.23Å; F161-F165 PolarHBondContact O-N 2.95Å; F161-A222 HydrophobicContact CE1-CB 4.2Å; F161-A222 HydrophobicContact CZ-CB 4.47Å; F161-L225 HydrophobicContact CD1-CD1 3.73Å; F161-L225 HydrophobicContact CE1-CD1 3.43Å; F161-L225 VanDerWaalsContact CE1-CD1 3.43Å; F161-L225 HydrophobicContact CZ-CD1 4.25Å
162	S	98.1	Very high	96.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-54.9	-44	171.4	-167.4	0	0	0	0	112	P106 A109 S110 G158 L159 T166	P106-S162 WeakPolarHBondContact O-CB 3.2Å; P106-S162 PolarHBondContact O-OG 3.46Å; A109-S162 VanDerWaalsContact C-OG 3.26Å; S110-S162 PolarHBondContact N-OG 3.32Å; G158-S162 PolarHBondContact O-N 3.38Å; L159-S162 VanDerWaalsContact O-CB 3.29Å; L159-S162 WeakPolarHBondContact O-CB 3.48Å; L159-S162 PolarHBondContact O-N 2.93Å; S162-T166 VanDerWaalsContact O-CB 3.28Å; S162-T166 WeakPolarHBondContact O-CB 3.29Å; S162-T166 PolarHBondContact O-N 3.07Å; S162-T166 PolarHBondContact O-OG1 3.21Å
163	F	98.2	Very high	96.6	Very high	21 Å²	21	12.5 Å²	12.5	9%	0.092	6%	0.056	C	C	.	.	H	α-helix	trans	-65.7	-44	-178.8	-70	11.2	0	0	0	110.8	V112 L116 V125 L132 L159 G160 F161 A167	V112-F163 HydrophobicContact CG1-CE1 4.25Å; V112-F163 HydrophobicContact CG1-CZ 4.47Å; L116-F163 HydrophobicContact CD1-CD2 4.35Å; L116-F163 HydrophobicContact CD1-CE1 3.79Å; L116-F163 HydrophobicContact CD1-CE2 3.61Å; L116-F163 HydrophobicContact CD1-CZ 3.27Å; V125-F163 HydrophobicContact CG1-CB 3.82Å; V125-F163 HydrophobicContact CG1-CD2 4.25Å; V125-F163 HydrophobicContact CG1-CG 4.06Å; L132-F163 HydrophobicContact CD2-CE2 4.44Å; L159-F163 HydrophobicContact CD1-CD1 4.34Å; L159-F163 HydrophobicContact CD1-CE1 3.6Å; L159-F163 HydrophobicContact CD1-CZ 4.1Å; L159-F163 HydrophobicContact CG-CE1 4.04Å; L159-F163 HydrophobicContact CG-CZ 4.15Å; L159-F163 VanDerWaalsContact O-CD1 3.31Å; L159-F163 WeakPolarHBondContact O-CD1 3.34Å; L159-F163 PolarHBondContact O-N 3.09Å; G160-F163 WeakPolarHBondContact O-CB 3.31Å; G160-F163 PolarHBondContact O-N 3.47Å; F161-F163 VanDerWaalsContact C-N 3.26Å; F161-F163 PolarHBondContact O-N 3.43Å; F163-A167 WeakPolarHBondContact O-CB 3.18Å; F163-A167 PolarHBondContact O-N 3.29Å; F163-A167 VanDerWaalsContact O-N 3.15Å
164	C	98.2	Very high	96.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-68.4	-47.7	178.3	-61.2	0	0	0	0	112.2	V66 T126 G130 G160 F161 A167 A168 L225	V66-C164 HydrophobicContact CG1-CB 3.77Å; T126-C164 HydrophobicContact CG2-CB 4.31Å; T126-C164 PolarHBondContact O-SG 3.2Å; G130-C164 PolarHBondContact N-SG 3.44Å; G130-C164 VanDerWaalsContact N-SG 3.43Å; G160-C164 PolarHBondContact O-N 2.83Å; G160-C164 PolarHBondContact O-SG 3.39Å; F161-C164 PolarHBondContact O-N 2.89Å; C164-A167 PolarHBondContact O-N 3.27Å; C164-A168 VanDerWaalsContact O-CB 3.23Å; C164-A168 WeakPolarHBondContact O-CB 3.48Å; C164-A168 PolarHBondContact O-N 3.13Å; C164-L225 HydrophobicContact CB-CD1 4.46Å
165	F	96.6	Very high	96.6	Very high	33 Å²	33	14.3 Å²	14.3	15%	0.145	6%	0.064	C	C	.	.	H	α-helix	trans	-60	-52.4	-178.4	175.3	-95.6	0	0	0	111.4	H67 F161 A167 A168 I169 Y592	H67-F165 AromaticContact CD2-CD2 3.84Å; H67-F165 AromaticContact CD2-CE2 3.66Å; H67-F165 AromaticContact NE2-CD2 3.48Å; H67-F165 WeakPolarHBondContact NE2-CD2 3.43Å; H67-F165 AromaticContact NE2-CE2 3.25Å; H67-F165 WeakPolarHBondContact NE2-CE2 3.42Å; F161-F165 VanDerWaalsContact O-CB 3.27Å; F161-F165 WeakPolarHBondContact O-CB 3.23Å; F161-F165 PolarHBondContact O-N 2.95Å; F165-A167 PolarHBondContact O-N 3.46Å; F165-A168 PolarHBondContact O-N 2.9Å; F165-I169 PolarHBondContact O-N 3.28Å; F165-Y592 HydrophobicContact CE1-CE1 4.29Å; F165-Y592 WeakPolarHBondContact CE1-OH 3.49Å; F165-Y592 WeakPolarHBondContact CZ-OH 3.28Å
166	T	97.3	Very high	96.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63	-45.3	-178.6	-53.1	0	0	0	0	110.7	S113 I117 S162 A168 I169 V170 Y592	S113-T166 VanDerWaalsContact OG-CB 3.28Å; S113-T166 WeakPolarHBondContact OG-CB 3.49Å; S113-T166 PolarHBondContact OG-OG1 2.79Å; I117-T166 HydrophobicContact CD1-CG2 3.69Å; S162-T166 VanDerWaalsContact O-CB 3.28Å; S162-T166 WeakPolarHBondContact O-CB 3.29Å; S162-T166 PolarHBondContact O-N 3.07Å; S162-T166 PolarHBondContact O-OG1 3.21Å; T166-A168 VanDerWaalsContact C-N 3.35Å; T166-A168 PolarHBondContact O-N 2.95Å; T166-I169 PolarHBondContact O-N 2.9Å; T166-V170 HydrophobicContact CG2-CG2 4.37Å; T166-V170 WeakPolarHBondContact O-CB 3.39Å; T166-V170 WeakPolarHBondContact O-CG2 3.24Å; T166-V170 PolarHBondContact O-N 3.06Å; T166-Y592 HydrophobicContact CG2-CD1 4.02Å; T166-Y592 HydrophobicContact CG2-CE1 4.23Å
167	A	97.7	Very high	96.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-66.1	-35	179.3	0	0	0	0	0	112.9	I117 C122 T126 F163 C164 F165 A171	I117-A167 HydrophobicContact CD1-CB 3.87Å; I117-A167 HydrophobicContact CG1-CB 4.18Å; C122-A167 HydrophobicContact CB-CB 4.18Å; T126-A167 WeakPolarHBondContact OG1-CB 3.32Å; F163-A167 WeakPolarHBondContact O-CB 3.18Å; F163-A167 PolarHBondContact O-N 3.29Å; F163-A167 VanDerWaalsContact O-N 3.15Å; C164-A167 PolarHBondContact O-N 3.27Å; F165-A167 PolarHBondContact O-N 3.46Å; A167-A171 WeakPolarHBondContact O-CB 3.28Å; A167-A171 PolarHBondContact O-N 3.31Å
168	A	97.6	Very high	96.1	Very high	0 Å²	0	22 Å²	22	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-49	176.9	0	0	0	0	0	111.9	A63 V66 C164 F165 T166 V172	A63-A168 HydrophobicContact CB-CB 3.83Å; V66-A168 HydrophobicContact CB-CB 4.12Å; V66-A168 HydrophobicContact CG1-CB 3.96Å; V66-A168 HydrophobicContact CG2-CB 4.44Å; C164-A168 VanDerWaalsContact O-CB 3.23Å; C164-A168 WeakPolarHBondContact O-CB 3.48Å; C164-A168 PolarHBondContact O-N 3.13Å; F165-A168 PolarHBondContact O-N 2.9Å; T166-A168 VanDerWaalsContact C-N 3.35Å; T166-A168 PolarHBondContact O-N 2.95Å; A168-V172 WeakPolarHBondContact O-CG2 3.45Å; A168-V172 PolarHBondContact O-N 3.42Å; A168-V172 VanDerWaalsContact O-N 3.11Å
169	I	96.6	Very high	95.9	Very high	3 Å²	3	28 Å²	28	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-67	-41.5	178.1	-65.5	-64.1	0	0	0	111.3	F165 T166 V172 T173 T184 V188 F588 Y592	F165-I169 PolarHBondContact O-N 3.28Å; T166-I169 PolarHBondContact O-N 2.9Å; I169-V172 PolarHBondContact O-N 3.23Å; I169-T173 WeakPolarHBondContact O-CB 3.35Å; I169-T173 PolarHBondContact O-N 2.84Å; I169-T173 PolarHBondContact O-OG1 3.18Å; I169-T184 HydrophobicContact CD1-CG2 4.3Å; I169-V188 HydrophobicContact CD1-CG2 3.7Å; I169-F588 HydrophobicContact CG2-CZ 4.47Å; I169-Y592 HydrophobicContact CB-CE1 4.35Å; I169-Y592 HydrophobicContact CG2-CD2 4.47Å; I169-Y592 HydrophobicContact CG2-CE1 4.27Å; I169-Y592 HydrophobicContact CG2-CE2 3.77Å
170	V	96.2	Very high	95.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-47.8	177.1	171	0	0	0	0	111.7	I117 T166 V172 T173 Y174 F588 V589	I117-V170 HydrophobicContact CD1-CG2 4.46Å; I117-V170 HydrophobicContact CG2-CG1 4.09Å; T166-V170 HydrophobicContact CG2-CG2 4.37Å; T166-V170 WeakPolarHBondContact O-CB 3.39Å; T166-V170 WeakPolarHBondContact O-CG2 3.24Å; T166-V170 PolarHBondContact O-N 3.06Å; V170-V172 PolarHBondContact O-N 3.21Å; V170-T173 WeakPolarHBondContact O-CB 3.46Å; V170-T173 PolarHBondContact O-N 2.96Å; V170-T173 VanDerWaalsContact O-N 3.15Å; V170-Y174 HydrophobicContact CG1-CD2 3.86Å; V170-Y174 HydrophobicContact CG1-CE1 4.4Å; V170-Y174 HydrophobicContact CG1-CE2 3.49Å; V170-Y174 VanDerWaalsContact CG1-CE2 3.49Å; V170-Y174 HydrophobicContact CG1-CG 4.49Å; V170-Y174 PolarHBondContact O-N 3.38Å; V170-F588 HydrophobicContact CB-CE1 4.47Å; V170-F588 HydrophobicContact CG2-CD1 4.45Å; V170-F588 HydrophobicContact CG2-CE1 3.95Å; V170-V589 HydrophobicContact CG1-CG2 3.63Å; V170-V589 HydrophobicContact CG2-CG1 4.48Å; V170-V589 HydrophobicContact CG2-CG2 4.12Å
171	A	95.5	Very high	95.7	Very high	2 Å²	2	27.5 Å²	27.5	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-59.5	-47.4	178.8	0	0	0	0	0	111.5	V59 C122 A167 T173 Y174 Y175 I232	V59-A171 HydrophobicContact CG1-CB 3.74Å; C122-A171 HydrophobicContact CB-CB 4.21Å; A167-A171 WeakPolarHBondContact O-CB 3.28Å; A167-A171 PolarHBondContact O-N 3.31Å; A171-T173 VanDerWaalsContact C-N 3.28Å; A171-T173 PolarHBondContact O-N 3.46Å; A171-Y174 PolarHBondContact O-N 3.09Å; A171-Y175 WeakPolarHBondContact O-CD2 3.45Å; A171-Y175 PolarHBondContact O-N 3.26Å; A171-Y175 VanDerWaalsContact O-N 3.14Å; A171-I232 HydrophobicContact CB-CG2 3.74Å
172	V	96.5	Very high	95.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-41.4	176.7	171.8	0	0	0	0	111.4	V59 V60 A63 A168 I169 V170 Y174 Y175 F176 A183 A187	V59-V172 HydrophobicContact CG1-CG2 4.27Å; V60-V172 HydrophobicContact CG2-CG1 4.08Å; V60-V172 HydrophobicContact CG2-CG2 4.09Å; A63-V172 HydrophobicContact CB-CG2 3.51Å; A168-V172 WeakPolarHBondContact O-CG2 3.45Å; A168-V172 PolarHBondContact O-N 3.42Å; A168-V172 VanDerWaalsContact O-N 3.11Å; I169-V172 PolarHBondContact O-N 3.23Å; V170-V172 PolarHBondContact O-N 3.21Å; V172-Y174 VanDerWaalsContact C-N 3.31Å; V172-Y174 PolarHBondContact O-N 3.3Å; V172-Y175 PolarHBondContact O-N 3.21Å; V172-F176 HydrophobicContact CG1-CD2 4.44Å; V172-F176 WeakPolarHBondContact O-CD2 3.29Å; V172-F176 PolarHBondContact O-N 3.47Å; V172-A183 HydrophobicContact CG1-CB 3.76Å; V172-A187 HydrophobicContact CG2-CB 4.18Å
173	T	94.6	Very high	95.6	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-64.6	-34.5	-180	-57.8	0	0	0	0	112.6	I169 V170 A171 V580 L585 F588	I169-T173 WeakPolarHBondContact O-CB 3.35Å; I169-T173 PolarHBondContact O-N 2.84Å; I169-T173 PolarHBondContact O-OG1 3.18Å; V170-T173 WeakPolarHBondContact O-CB 3.46Å; V170-T173 PolarHBondContact O-N 2.96Å; V170-T173 VanDerWaalsContact O-N 3.15Å; A171-T173 VanDerWaalsContact C-N 3.28Å; A171-T173 PolarHBondContact O-N 3.46Å; T173-V580 HydrophobicContact CG2-CG2 3.48Å; T173-V580 VanDerWaalsContact CG2-CG2 3.48Å; T173-L585 HydrophobicContact CG2-CD1 4.25Å; T173-F588 HydrophobicContact CG2-CD1 3.86Å; T173-F588 HydrophobicContact CG2-CE1 3.55Å; T173-F588 HydrophobicContact CG2-CE2 4.24Å; T173-F588 HydrophobicContact CG2-CG 4.34Å; T173-F588 HydrophobicContact CG2-CZ 3.76Å
174	Y	92.1	Very high	95.5	Very high	28 Å²	28	29.3 Å²	29.3	11%	0.11	12%	0.121	C	C	.	.	H	α-helix	trans	-75.3	-27.8	175.9	-68.8	-20.3	0	0	0	113.8	V170 A171 V172 W237 L585 F588 V589	V170-Y174 HydrophobicContact CG1-CD2 3.86Å; V170-Y174 HydrophobicContact CG1-CE1 4.4Å; V170-Y174 HydrophobicContact CG1-CE2 3.49Å; V170-Y174 VanDerWaalsContact CG1-CE2 3.49Å; V170-Y174 HydrophobicContact CG1-CG 4.49Å; V170-Y174 PolarHBondContact O-N 3.38Å; A171-Y174 PolarHBondContact O-N 3.09Å; V172-Y174 VanDerWaalsContact C-N 3.31Å; V172-Y174 PolarHBondContact O-N 3.3Å; Y174-W237 HydrophobicContact CD2-CZ2 4.49Å; Y174-W237 HydrophobicContact CE1-CH2 4.41Å; Y174-W237 HydrophobicContact CE1-CZ2 4.36Å; Y174-W237 HydrophobicContact CE2-CZ2 4.03Å; Y174-W237 AromaticContact CZ-CZ2 3.92Å; Y174-L585 HydrophobicContact CD1-CD1 3.88Å; Y174-L585 HydrophobicContact CD1-CD2 4.39Å; Y174-L585 HydrophobicContact CD1-CG 4.05Å; Y174-L585 HydrophobicContact CE1-CD1 4.11Å; Y174-L585 HydrophobicContact CE1-CG 4.02Å; Y174-F588 HydrophobicContact CE1-CD1 4.47Å; Y174-V589 HydrophobicContact CE1-CG2 4.45Å; Y174-V589 HydrophobicContact CE2-CG2 4.35Å; Y174-V589 WeakPolarHBondContact OH-CG2 3.5Å
175	Y	93.7	Very high	95.4	Very high	14 Å²	14	29.3 Å²	29.3	6%	0.055	12%	0.122	C	C	.	.	H	α-helix	trans	-80.9	-19.4	-179.7	-94.1	-88.3	0	0	0	114.3	P51 D52 Y55 V59 A171 V172 R233 L235	P51-Y175 WeakPolarHBondContact CD-O 3.47Å; P51-Y175 HydrophobicContact CG-CD1 3.52Å; P51-Y175 HydrophobicContact CG-CE1 3.99Å; P51-Y175 HydrophobicContact CG-CG 4.49Å; D52-Y175 PolarHBondContact N-O 2.88Å; Y55-Y175 HydrophobicContact CD1-CE1 4.45Å; V59-Y175 HydrophobicContact CB-CD2 4.21Å; V59-Y175 HydrophobicContact CB-CE2 4.43Å; V59-Y175 HydrophobicContact CG1-CD2 4.04Å; V59-Y175 HydrophobicContact CG1-CE2 4.41Å; V59-Y175 HydrophobicContact CG2-CD2 3.93Å; V59-Y175 HydrophobicContact CG2-CE1 4.37Å; V59-Y175 HydrophobicContact CG2-CE2 3.65Å; V59-Y175 HydrophobicContact CG2-CG 4.4Å; A171-Y175 WeakPolarHBondContact O-CD2 3.45Å; A171-Y175 PolarHBondContact O-N 3.26Å; A171-Y175 VanDerWaalsContact O-N 3.14Å; V172-Y175 PolarHBondContact O-N 3.21Å; Y175-R233 WeakPolarHBondContact CE2-O 3.44Å; Y175-R233 PolarHBondContact OH-O 3.27Å; Y175-L235 HydrophobicContact CD1-CD1 4.15Å; Y175-L235 HydrophobicContact CD2-CD1 3.31Å; Y175-L235 HydrophobicContact CE1-CD1 4.08Å; Y175-L235 HydrophobicContact CE1-CG 4.42Å; Y175-L235 HydrophobicContact CE2-CD1 3.22Å; Y175-L235 HydrophobicContact CE2-CG 4.15Å; Y175-L235 HydrophobicContact CG-CD1 3.79Å
176	F	94.3	Very high	95.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.126	C	C	.	.			trans	-132.3	131.8	-173.4	-66.2	-89	0	0	0	111.9	D52 G56 W57 V60 V172 R179 R180 A183	D52-F176 WeakPolarHBondContact OD1-CA 3.21Å; G56-F176 WeakPolarHBondContact O-CE2 3.48Å; W57-F176 HydrophobicContact CD2-CZ 4.12Å; W57-F176 HydrophobicContact CE3-CZ 4.31Å; W57-F176 HydrophobicContact CH2-CE1 4.47Å; W57-F176 HydrophobicContact CZ2-CE1 4.15Å; W57-F176 HydrophobicContact CZ2-CZ 4.49Å; V60-F176 HydrophobicContact CG2-CD2 4.24Å; V60-F176 HydrophobicContact CG2-CE2 3.48Å; V60-F176 VanDerWaalsContact CG2-CE2 3.48Å; V60-F176 HydrophobicContact CG2-CZ 4.04Å; V172-F176 HydrophobicContact CG1-CD2 4.44Å; V172-F176 WeakPolarHBondContact O-CD2 3.29Å; V172-F176 PolarHBondContact O-N 3.47Å; F176-R179 HydrophobicContact CD1-CB 4.08Å; F176-R180 HydrophobicContact CB-CB 4.34Å; F176-R180 PolarHBondContact O-NE 2.89Å; F176-A183 HydrophobicContact CB-CB 4.12Å; F176-A183 HydrophobicContact CD1-CB 4.08Å; F176-A183 HydrophobicContact CD2-CB 3.52Å; F176-A183 HydrophobicContact CE1-CB 4.37Å; F176-A183 HydrophobicContact CE2-CB 3.88Å; F176-A183 HydrophobicContact CG-CB 3.63Å; F176-A183 HydrophobicContact CZ-CB 4.28Å
177	E	91.6	Very high	95.4	Very high	127 Å²	127	29.9 Å²	29.9	59%	0.593	13%	0.126	S	C	*	.	S	Bend	trans	-115	-57.5	172.9	-175	176.9	-169.9	0	0	110	A50 D52	A50-E177 HydrophobicContact CB-CB 3.85Å; D52-E177 PolarHBondContact OD1-N 3.28Å
178	R	92.1	Very high	95.3	Very high	203 Å²	203	30.4 Å²	30.4	77%	0.766	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-29	-178.3	-65.1	179.6	-179.4	-167.9	1.9	113.8	D52	D52-R178 PolarHBondContact OD1-N 2.74Å; D52-R178 WeakPolarHBondContact OD2-CB 3.45Å; D52-R178 VanDerWaalsContact OD2-CG 3.32Å; D52-R178 WeakPolarHBondContact OD2-CG 3.33Å; D52-R178 PolarHBondContact OD2-N 2.92Å
179	R	93.4	Very high	95.1	Very high	126 Å²	126	30.8 Å²	30.8	48%	0.475	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	27.1	-178.6	-60.8	-178.3	-178.3	178.3	1.8	112.6	D52 F176 A181 M182 A183 D524	D52-R179 PolarHBondContact OD1-N 3.17Å; F176-R179 HydrophobicContact CD1-CB 4.08Å; R179-A181 PolarHBondContact O-N 2.68Å; R179-M182 PolarHBondContact O-N 3.19Å; R179-A183 VanDerWaalsContact O-CB 3.31Å; R179-A183 WeakPolarHBondContact O-CB 3.15Å; R179-A183 PolarHBondContact O-N 3.05Å; R179-D524 WeakPolarHBondContact CA-OD2 3.23Å
180	R	95.1	Very high	95	Very high	18 Å²	18	30.6 Å²	30.6	7%	0.068	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-41.3	-170	-171.5	-174.3	-70.4	148.7	1.4	111.7	F176 A183 T184 D524 V577	F176-R180 HydrophobicContact CB-CB 4.34Å; F176-R180 PolarHBondContact O-NE 2.89Å; R180-A183 PolarHBondContact O-N 2.66Å; R180-T184 WeakPolarHBondContact O-CB 3.44Å; R180-T184 PolarHBondContact O-N 3.12Å; R180-T184 PolarHBondContact O-OG1 3.42Å; R180-D524 PolarHBondContact N-OD1 3.04Å; R180-V577 HydrophobicContact CG-CG2 4.15Å
181	A	96.4	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.5	-41.7	-178.7	0	0	0	0	0	111.1	R179 G185 G520 A523 D524 T573 L574 V577	R179-A181 PolarHBondContact O-N 2.68Å; A181-G185 PolarHBondContact O-N 3.39Å; A181-G520 WeakPolarHBondContact O-CA 3.32Å; A181-A523 HydrophobicContact CB-CB 3.62Å; A181-D524 WeakPolarHBondContact CB-OD1 3.32Å; A181-D524 PolarHBondContact N-OD1 3.03Å; A181-T573 HydrophobicContact CB-CG2 4.45Å; A181-T573 WeakPolarHBondContact O-CG2 3.4Å; A181-L574 HydrophobicContact CB-CD2 4.25Å; A181-V577 HydrophobicContact CB-CG2 3.91Å
182	M	96.1	Very high	94.3	Very high	59 Å²	59	32.2 Å²	32.2	29%	0.291	15%	0.145	S	C	.	.	H	α-helix	trans	-62.1	-46.4	173.9	-179.2	-177.8	174.8	0	0	111.6	W57 R179 G185 I186 G520 V521 D524	W57-M182 HydrophobicContact CH2-CE 4.16Å; W57-M182 HydrophobicContact CH2-SD 4.44Å; R179-M182 PolarHBondContact O-N 3.19Å; M182-G185 PolarHBondContact O-N 3.36Å; M182-I186 HydrophobicContact CE-CD1 3.81Å; M182-I186 HydrophobicContact CG-CD1 3.9Å; M182-I186 VanDerWaalsContact O-CG1 3.29Å; M182-I186 WeakPolarHBondContact O-CG1 3.22Å; M182-I186 PolarHBondContact O-N 3.41Å; M182-G520 PolarHBondContact N-O 2.88Å; M182-V521 HydrophobicContact CG-CG2 4.14Å; M182-V521 HydrophobicContact SD-CG2 4.15Å; M182-D524 WeakPolarHBondContact CB-OD2 3.34Å; M182-D524 PolarHBondContact N-OD2 3.4Å
183	A	97.5	Very high	94	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-44.3	179.9	0	0	0	0	0	112	V60 V172 F176 R179 R180 I186 A187	V60-A183 HydrophobicContact CG2-CB 3.83Å; V172-A183 HydrophobicContact CG1-CB 3.76Å; F176-A183 HydrophobicContact CB-CB 4.12Å; F176-A183 HydrophobicContact CD1-CB 4.08Å; F176-A183 HydrophobicContact CD2-CB 3.52Å; F176-A183 HydrophobicContact CE1-CB 4.37Å; F176-A183 HydrophobicContact CE2-CB 3.88Å; F176-A183 HydrophobicContact CG-CB 3.63Å; F176-A183 HydrophobicContact CZ-CB 4.28Å; R179-A183 VanDerWaalsContact O-CB 3.31Å; R179-A183 WeakPolarHBondContact O-CB 3.15Å; R179-A183 PolarHBondContact O-N 3.05Å; R180-A183 PolarHBondContact O-N 2.66Å; A183-I186 PolarHBondContact O-N 3.5Å; A183-A187 WeakPolarHBondContact O-CB 3.37Å; A183-A187 PolarHBondContact O-N 3.35Å
184	T	96.1	Very high	93.9	Very high	1 Å²	1	35 Å²	35	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-46.4	175	-54.9	0	0	0	0	110.9	I169 R180 I186 A187 V188 S576	I169-T184 HydrophobicContact CD1-CG2 4.3Å; R180-T184 WeakPolarHBondContact O-CB 3.44Å; R180-T184 PolarHBondContact O-N 3.12Å; R180-T184 PolarHBondContact O-OG1 3.42Å; T184-I186 VanDerWaalsContact C-N 3.33Å; T184-I186 PolarHBondContact O-N 2.77Å; T184-A187 PolarHBondContact O-N 3.26Å; T184-V188 HydrophobicContact CG2-CG2 4.21Å; T184-V188 WeakPolarHBondContact O-CG2 3.4Å; T184-V188 PolarHBondContact O-N 2.93Å; T184-S576 WeakPolarHBondContact CG2-OG 3.49Å
185	G	96.4	Very high	93.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-57.1	-45.9	177.7	0	0	0	0	0	112	A181 M182 V188 C189	A181-G185 PolarHBondContact O-N 3.39Å; M182-G185 PolarHBondContact O-N 3.36Å; G185-V188 PolarHBondContact O-N 3.33Å; G185-C189 PolarHBondContact O-N 3.49Å; G185-C189 PolarHBondContact O-SG 2.95Å
186	I	96.9	Very high	93.1	Very high	45 Å²	45	42.8 Å²	42.8	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-47	175.5	-68.2	165	0	0	0	110.7	W57 V60 F64 M182 A183 T184 V188 C189 L517	W57-I186 HydrophobicContact CH2-CD1 4.38Å; W57-I186 HydrophobicContact CZ3-CD1 3.84Å; V60-I186 HydrophobicContact CG1-CB 3.95Å; V60-I186 HydrophobicContact CG1-CG2 3.55Å; F64-I186 VanDerWaalsContact CD2-O 3.3Å; F64-I186 WeakPolarHBondContact CD2-O 3.2Å; M182-I186 HydrophobicContact CE-CD1 3.81Å; M182-I186 HydrophobicContact CG-CD1 3.9Å; M182-I186 VanDerWaalsContact O-CG1 3.29Å; M182-I186 WeakPolarHBondContact O-CG1 3.22Å; M182-I186 PolarHBondContact O-N 3.41Å; A183-I186 PolarHBondContact O-N 3.5Å; T184-I186 VanDerWaalsContact C-N 3.33Å; T184-I186 PolarHBondContact O-N 2.77Å; I186-V188 PolarHBondContact O-N 3.17Å; I186-C189 WeakPolarHBondContact O-CB 3.31Å; I186-C189 PolarHBondContact O-N 3.08Å; I186-L517 HydrophobicContact CG1-CD2 3.79Å
187	A	97.1	Very high	93	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-46	179.1	0	0	0	0	0	112.2	A63 F64 V172 A183 T184 C189 G190	A63-A187 HydrophobicContact CB-CB 3.76Å; F64-A187 WeakPolarHBondContact CA-O 3.32Å; V172-A187 HydrophobicContact CG2-CB 4.18Å; A183-A187 WeakPolarHBondContact O-CB 3.37Å; A183-A187 PolarHBondContact O-N 3.35Å; T184-A187 PolarHBondContact O-N 3.26Å; A187-C189 VanDerWaalsContact C-N 3.34Å; A187-C189 PolarHBondContact O-N 3.07Å; A187-G190 PolarHBondContact O-N 3.27Å
188	V	95.2	Very high	93	Very high	11 Å²	11	41.2 Å²	41.2	7%	0.067	19%	0.194	C	C	.	.	H	α-helix	trans	-73.9	-23.5	-177.3	-177	0	0	0	0	112.5	I169 T184 G185 I186 G190 S191 M516 Y572	I169-V188 HydrophobicContact CD1-CG2 3.7Å; T184-V188 HydrophobicContact CG2-CG2 4.21Å; T184-V188 WeakPolarHBondContact O-CG2 3.4Å; T184-V188 PolarHBondContact O-N 2.93Å; G185-V188 PolarHBondContact O-N 3.33Å; I186-V188 PolarHBondContact O-N 3.17Å; V188-G190 PolarHBondContact O-N 2.96Å; V188-S191 VanDerWaalsContact O-CB 3.31Å; V188-S191 WeakPolarHBondContact O-CB 3.37Å; V188-S191 PolarHBondContact O-N 3.35Å; V188-S191 PolarHBondContact O-OG 3.41Å; V188-M516 HydrophobicContact CB-SD 4.22Å; V188-M516 HydrophobicContact CG1-CE 4.12Å; V188-M516 HydrophobicContact CG1-SD 3.88Å; V188-Y572 HydrophobicContact CG1-CD1 4.37Å
189	C	94.7	Very high	92.9	Very high	7 Å²	7	33.2 Å²	33.2	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-56.3	-20.9	172.7	-75	0	0	0	0	113.4	F64 G185 I186 A187 S191 G192 L193 M513 L517	F64-C189 HydrophobicContact CE2-CB 4.28Å; G185-C189 PolarHBondContact O-N 3.49Å; G185-C189 PolarHBondContact O-SG 2.95Å; I186-C189 WeakPolarHBondContact O-CB 3.31Å; I186-C189 PolarHBondContact O-N 3.08Å; A187-C189 VanDerWaalsContact C-N 3.34Å; A187-C189 PolarHBondContact O-N 3.07Å; C189-S191 PolarHBondContact O-N 3.26Å; C189-G192 PolarHBondContact O-N 3.28Å; C189-L193 PolarHBondContact O-N 3.28Å; C189-M513 HydrophobicContact CB-CG 4.35Å; C189-L517 VanDerWaalsContact SG-CD2 3.59Å
190	G	93.9	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-53.3	-36.9	171.4	0	0	0	0	0	112.3	F64 L68 A187 V188 G192 L193 G194	F64-G190 VanDerWaalsContact CD2-CA 3.47Å; F64-G190 VanDerWaalsContact CD2-N 3.29Å; F64-G190 VanDerWaalsContact CE2-N 3.31Å; L68-G190 WeakPolarHBondContact CA-O 3.24Å; A187-G190 PolarHBondContact O-N 3.27Å; V188-G190 PolarHBondContact O-N 2.96Å; G190-G192 PolarHBondContact O-N 3.26Å; G190-L193 PolarHBondContact O-N 3.46Å; G190-G194 WeakPolarHBondContact O-CA 3.34Å; G190-G194 PolarHBondContact O-N 3.34Å
191	S	91.7	Very high	92.8	Very high	12 Å²	12	33.3 Å²	33.3	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-59.5	-46.6	179.7	65.2	0	0	0	0	113.5	D71 V188 C189 G194 T195	D71-S191 WeakPolarHBondContact OD2-CB 3.46Å; V188-S191 VanDerWaalsContact O-CB 3.31Å; V188-S191 WeakPolarHBondContact O-CB 3.37Å; V188-S191 PolarHBondContact O-N 3.35Å; V188-S191 PolarHBondContact O-OG 3.41Å; C189-S191 PolarHBondContact O-N 3.26Å; S191-G194 PolarHBondContact O-N 2.92Å; S191-T195 PolarHBondContact O-N 3.47Å; S191-T195 PolarHBondContact O-OG1 3.14Å
192	G	85	Confident	92.7	Very high	23 Å²	23	33.4 Å²	33.4	24%	0.237	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-46.9	179.2	0	0	0	0	0	112	C189 G190 G194 T195 F196	C189-G192 PolarHBondContact O-N 3.28Å; G190-G192 PolarHBondContact O-N 3.26Å; G192-G194 VanDerWaalsContact C-N 3.34Å; G192-T195 PolarHBondContact O-N 3.36Å; G192-F196 PolarHBondContact O-N 2.94Å
193	L	90.2	Very high	92.5	Very high	61 Å²	61	36.5 Å²	36.5	32%	0.319	20%	0.197	S	C	.	.	H	α-helix	trans	-65.4	-39.3	176	-175.2	61.6	0	0	0	111.7	F64 L68 C189 G190 F196 L197 M513	F64-L193 HydrophobicContact CE1-CD2 4.37Å; F64-L193 HydrophobicContact CZ-CD2 3.76Å; L68-L193 HydrophobicContact CD1-CB 4.37Å; L68-L193 HydrophobicContact CD1-CD2 3.84Å; L68-L193 HydrophobicContact CD1-CG 4.08Å; C189-L193 PolarHBondContact O-N 3.28Å; G190-L193 PolarHBondContact O-N 3.46Å; L193-F196 PolarHBondContact O-N 3.41Å; L193-L197 HydrophobicContact CD1-CD1 4.06Å; L193-L197 HydrophobicContact CD1-CG 4.12Å; L193-L197 HydrophobicContact CD2-CD1 4.32Å; L193-L197 HydrophobicContact CG-CD1 3.82Å; L193-L197 HydrophobicContact CG-CG 4.27Å; L193-L197 WeakPolarHBondContact O-CG 3.21Å; L193-L197 PolarHBondContact O-N 2.97Å; L193-M513 HydrophobicContact CB-SD 4.46Å
194	G	91.7	Very high	92.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-48.5	177.1	0	0	0	0	0	111.9	L68 G72 G190 S191 G192 F196 L197 F198	L68-G194 WeakPolarHBondContact O-CA 3.47Å; G72-G194 VanDerWaalsContact CA-C 3.43Å; G190-G194 WeakPolarHBondContact O-CA 3.34Å; G190-G194 PolarHBondContact O-N 3.34Å; S191-G194 PolarHBondContact O-N 2.92Å; G192-G194 VanDerWaalsContact C-N 3.34Å; G194-F196 VanDerWaalsContact C-N 3.28Å; G194-F196 PolarHBondContact O-N 3.3Å; G194-L197 PolarHBondContact O-N 3.18Å; G194-F198 VanDerWaalsContact O-CB 3.31Å; G194-F198 WeakPolarHBondContact O-CB 3.48Å; G194-F198 WeakPolarHBondContact O-CD2 3.3Å; G194-F198 PolarHBondContact O-N 3.43Å
195	T	85.8	Confident	92.4	Very high	51 Å²	51	42.2 Å²	42.2	31%	0.313	22%	0.222	S	C	.	.	H	α-helix	trans	-57.9	-43.3	177.7	-50.8	0	0	0	0	111.7	F75 S191 G192 A199	F75-T195 HydrophobicContact CB-CG2 4.04Å; F75-T195 WeakPolarHBondContact CD2-OG1 3.31Å; S191-T195 PolarHBondContact O-N 3.47Å; S191-T195 PolarHBondContact O-OG1 3.14Å; G192-T195 PolarHBondContact O-N 3.36Å; T195-A199 PolarHBondContact O-N 2.85Å
196	F	84	Confident	92.2	Very high	154 Å²	154	43 Å²	43	68%	0.675	23%	0.227	S	C	*	.	H	α-helix	trans	-66.7	-39.1	179.1	-179.9	-99.5	0	0	0	113.1	G192 L193 G194 P200	G192-F196 PolarHBondContact O-N 2.94Å; L193-F196 PolarHBondContact O-N 3.41Å; G194-F196 VanDerWaalsContact C-N 3.28Å; G194-F196 PolarHBondContact O-N 3.3Å; F196-P200 WeakPolarHBondContact O-CD 3.38Å
197	L	91.3	Very high	92.1	Very high	80 Å²	80	45.3 Å²	45.3	42%	0.419	25%	0.246	S	C	.	.	H	α-helix	trans	-81.9	-40	-178.1	-68.4	177.9	0	0	0	113.1	L68 L193 G194 P200 F201	L68-L197 HydrophobicContact CD1-CD1 4.48Å; L193-L197 HydrophobicContact CD1-CD1 4.06Å; L193-L197 HydrophobicContact CD1-CG 4.12Å; L193-L197 HydrophobicContact CD2-CD1 4.32Å; L193-L197 HydrophobicContact CG-CD1 3.82Å; L193-L197 HydrophobicContact CG-CG 4.27Å; L193-L197 WeakPolarHBondContact O-CG 3.21Å; L193-L197 PolarHBondContact O-N 2.97Å; G194-L197 PolarHBondContact O-N 3.18Å; L197-P200 WeakPolarHBondContact O-CD 3.31Å; L197-P200 WeakPolarHBondContact O-CG 3.3Å; L197-F201 VanDerWaalsContact O-CB 3.24Å; L197-F201 WeakPolarHBondContact O-CB 3.29Å; L197-F201 PolarHBondContact O-N 2.81Å
198	F	93.2	Very high	92	Very high	14 Å²	14	48.9 Å²	48.9	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-77.2	-30.9	-172.1	-87.2	-93.1	0	0	0	113.3	L68 I69 G72 I73 S76 G194 F201 V202 L218 V221	L68-F198 HydrophobicContact CD2-CE2 3.8Å; L68-F198 WeakPolarHBondContact O-CE2 3.27Å; I69-F198 HydrophobicContact CG1-CZ 4.32Å; G72-F198 VanDerWaalsContact O-CB 3.31Å; G72-F198 WeakPolarHBondContact O-CB 3.39Å; I73-F198 HydrophobicContact CD1-CE1 3.94Å; I73-F198 HydrophobicContact CD1-CZ 4.48Å; I73-F198 HydrophobicContact CG1-CD1 3.56Å; I73-F198 HydrophobicContact CG1-CE1 3.43Å; I73-F198 VanDerWaalsContact CG1-CE1 3.43Å; I73-F198 HydrophobicContact CG1-CG 4.37Å; I73-F198 HydrophobicContact CG1-CZ 4.15Å; S76-F198 VanDerWaalsContact OG-C 3.28Å; S76-F198 WeakPolarHBondContact OG-CB 3.24Å; G194-F198 VanDerWaalsContact O-CB 3.31Å; G194-F198 WeakPolarHBondContact O-CB 3.48Å; G194-F198 WeakPolarHBondContact O-CD2 3.3Å; G194-F198 PolarHBondContact O-N 3.43Å; F198-F201 AromaticContact CD1-CD1 3.94Å; F198-F201 HydrophobicContact CD1-CD1 3.94Å; F198-F201 HydrophobicContact CE1-CD1 4.11Å; F198-F201 HydrophobicContact CE1-CE1 4.31Å; F198-F201 PolarHBondContact O-N 2.91Å; F198-V202 WeakPolarHBondContact O-CB 3.48Å; F198-V202 WeakPolarHBondContact O-CG2 3.29Å; F198-V202 PolarHBondContact O-N 3.33Å; F198-L218 HydrophobicContact CD1-CD2 4.48Å; F198-L218 HydrophobicContact CE1-CD2 4.42Å; F198-V221 HydrophobicContact CE1-CG1 3.87Å; F198-V221 HydrophobicContact CZ-CG1 3.75Å
199	A	88.5	Confident	91.9	Very high	34 Å²	34	54.5 Å²	54.5	28%	0.281	29%	0.289	S	S	.	.	H	α-helix	trans	-57.7	-56.8	178.5	0	0	0	0	0	112.7	S76 T195 F201 V202 E203	S76-A199 PolarHBondContact OG-N 3.28Å; S76-A199 VanDerWaalsContact OG-N 3.12Å; T195-A199 PolarHBondContact O-N 2.85Å; A199-F201 VanDerWaalsContact C-N 3.28Å; A199-F201 PolarHBondContact O-N 3.29Å; A199-V202 PolarHBondContact O-N 3.45Å; A199-E203 PolarHBondContact O-N 3.23Å; A199-E203 VanDerWaalsContact O-N 3.14Å
200	P	92.6	Very high	91.7	Very high	75 Å²	75	61 Å²	61	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-67.6	-29.8	176.3	27.2	-34.9	0	0	0	112.3	F196 L197 F204	F196-P200 WeakPolarHBondContact O-CD 3.38Å; L197-P200 WeakPolarHBondContact O-CD 3.31Å; L197-P200 WeakPolarHBondContact O-CG 3.3Å; P200-F204 VanDerWaalsContact O-CB 3.3Å; P200-F204 WeakPolarHBondContact O-CB 3.48Å; P200-F204 PolarHBondContact O-N 2.94Å
201	F	94	Very high	91.5	Very high	72 Å²	72	62.1 Å²	62.1	32%	0.316	32%	0.323	S	S	.	.	H	α-helix	trans	-66.6	-44.6	177	177.7	-117.7	0	0	0	112.1	L197 F198 A199 E203 F204 L205 V217 L218 V221	L197-F201 VanDerWaalsContact O-CB 3.24Å; L197-F201 WeakPolarHBondContact O-CB 3.29Å; L197-F201 PolarHBondContact O-N 2.81Å; F198-F201 AromaticContact CD1-CD1 3.94Å; F198-F201 HydrophobicContact CD1-CD1 3.94Å; F198-F201 HydrophobicContact CE1-CD1 4.11Å; F198-F201 HydrophobicContact CE1-CE1 4.31Å; F198-F201 PolarHBondContact O-N 2.91Å; A199-F201 VanDerWaalsContact C-N 3.28Å; A199-F201 PolarHBondContact O-N 3.29Å; F201-E203 VanDerWaalsContact C-N 3.34Å; F201-F204 WeakPolarHBondContact O-CB 3.33Å; F201-F204 PolarHBondContact O-N 3.28Å; F201-L205 HydrophobicContact CD1-CD1 4.09Å; F201-L205 HydrophobicContact CD2-CG 4.44Å; F201-L205 HydrophobicContact CE1-CD1 3.59Å; F201-L205 HydrophobicContact CE1-CG 4.34Å; F201-L205 HydrophobicContact CE2-CD1 4.22Å; F201-L205 HydrophobicContact CE2-CD2 4.16Å; F201-L205 HydrophobicContact CE2-CG 4.12Å; F201-L205 HydrophobicContact CZ-CD1 3.67Å; F201-L205 HydrophobicContact CZ-CD2 4.19Å; F201-L205 HydrophobicContact CZ-CG 4.07Å; F201-L205 VanDerWaalsContact O-CG 3.3Å; F201-L205 WeakPolarHBondContact O-CG 3.18Å; F201-L205 PolarHBondContact O-N 3.21Å; F201-V217 HydrophobicContact CZ-CG1 4.27Å; F201-L218 HydrophobicContact CE1-CD2 4.43Å; F201-V221 HydrophobicContact CE1-CG2 4.29Å
202	V	94.2	Very high	91.6	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.006	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-40.8	176.6	172.1	0	0	0	0	110.3	V79 L80 F198 A199 L205 L206 L218	V79-V202 HydrophobicContact CB-CG1 4.01Å; V79-V202 HydrophobicContact CG1-CG1 4.07Å; L80-V202 HydrophobicContact CD2-CG1 4.26Å; L80-V202 HydrophobicContact CG-CG1 3.98Å; F198-V202 WeakPolarHBondContact O-CB 3.48Å; F198-V202 WeakPolarHBondContact O-CG2 3.29Å; F198-V202 PolarHBondContact O-N 3.33Å; A199-V202 PolarHBondContact O-N 3.45Å; V202-L205 PolarHBondContact O-N 2.82Å; V202-L206 HydrophobicContact CG1-CD1 3.93Å; V202-L206 HydrophobicContact CG1-CG 4.39Å; V202-L206 WeakPolarHBondContact O-CB 3.49Å; V202-L206 VanDerWaalsContact O-CG 3.27Å; V202-L206 WeakPolarHBondContact O-CG 2.97Å; V202-L206 PolarHBondContact O-N 3.02Å; V202-L218 HydrophobicContact CG2-CD1 4.34Å; V202-L218 HydrophobicContact CG2-CD2 4.12Å
203	E	93.2	Very high	92	Very high	125 Å²	125	66.5 Å²	66.5	58%	0.584	34%	0.34	S	S	*	.	H	α-helix	trans	-61.9	-44.1	174.6	-172.9	174.2	-174.3	0	0	112.1	V79 A199 F201 L205 L206 S207	V79-E203 HydrophobicContact CG1-CB 3.93Å; A199-E203 PolarHBondContact O-N 3.23Å; A199-E203 VanDerWaalsContact O-N 3.14Å; F201-E203 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 2.91Å; E203-L206 PolarHBondContact O-N 3.48Å; E203-S207 WeakPolarHBondContact O-CB 3.49Å; E203-S207 PolarHBondContact O-N 3.33Å; E203-S207 PolarHBondContact O-OG 3.44Å
204	F	95.4	Very high	92.2	Very high	116 Å²	116	63.6 Å²	63.6	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-43.3	173.6	171	-101.4	0	0	0	112.2	P200 F201 S207 T208	P200-F204 VanDerWaalsContact O-CB 3.3Å; P200-F204 WeakPolarHBondContact O-CB 3.48Å; P200-F204 PolarHBondContact O-N 2.94Å; F201-F204 WeakPolarHBondContact O-CB 3.33Å; F201-F204 PolarHBondContact O-N 3.28Å; F204-S207 WeakPolarHBondContact CA-OG 3.35Å; F204-S207 PolarHBondContact O-N 3.09Å; F204-S207 PolarHBondContact O-OG 3.3Å; F204-T208 WeakPolarHBondContact O-CB 3.2Å; F204-T208 PolarHBondContact O-N 2.97Å; F204-T208 VanDerWaalsContact O-N 3.07Å; F204-T208 PolarHBondContact O-OG1 3.35Å
205	L	95.1	Very high	92.3	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-41.4	176.8	-70.7	179.1	0	0	0	112	F201 V202 E203 T208 Y209 A214 V217 L218	F201-L205 HydrophobicContact CD1-CD1 4.09Å; F201-L205 HydrophobicContact CD2-CG 4.44Å; F201-L205 HydrophobicContact CE1-CD1 3.59Å; F201-L205 HydrophobicContact CE1-CG 4.34Å; F201-L205 HydrophobicContact CE2-CD1 4.22Å; F201-L205 HydrophobicContact CE2-CD2 4.16Å; F201-L205 HydrophobicContact CE2-CG 4.12Å; F201-L205 HydrophobicContact CZ-CD1 3.67Å; F201-L205 HydrophobicContact CZ-CD2 4.19Å; F201-L205 HydrophobicContact CZ-CG 4.07Å; F201-L205 VanDerWaalsContact O-CG 3.3Å; F201-L205 WeakPolarHBondContact O-CG 3.18Å; F201-L205 PolarHBondContact O-N 3.21Å; V202-L205 PolarHBondContact O-N 2.82Å; E203-L205 PolarHBondContact O-N 2.91Å; L205-T208 PolarHBondContact O-N 2.85Å; L205-Y209 HydrophobicContact CD2-CD2 3.91Å; L205-Y209 HydrophobicContact CD2-CE2 4.06Å; L205-Y209 WeakPolarHBondContact O-CB 3.45Å; L205-Y209 PolarHBondContact O-N 2.98Å; L205-A214 HydrophobicContact CB-CB 3.79Å; L205-V217 HydrophobicContact CD1-CB 4.02Å; L205-V217 HydrophobicContact CD1-CG1 3.92Å; L205-V217 HydrophobicContact CD2-CB 4.04Å; L205-V217 HydrophobicContact CD2-CG1 3.86Å; L205-V217 HydrophobicContact CD2-CG2 4.14Å; L205-L218 HydrophobicContact CD1-CD2 4.2Å; L205-L218 HydrophobicContact CD1-CG 4.18Å
206	L	93.2	Very high	92.8	Very high	19 Å²	19	66.4 Å²	66.4	10%	0.099	34%	0.336	C	S	.	.	H	α-helix	trans	-68.3	-37.9	180	-73.4	170.1	0	0	0	112.8	V79 L80 K83 V202 E203 E210 W211 A214	V79-L206 HydrophobicContact CG1-CD1 3.91Å; L80-L206 HydrophobicContact CD2-CD1 3.94Å; L80-L206 HydrophobicContact CD2-CD2 3.78Å; L80-L206 HydrophobicContact CD2-CG 4.22Å; L80-L206 HydrophobicContact CG-CD1 4.47Å; K83-L206 HydrophobicContact CG-CD1 4.47Å; K83-L206 HydrophobicContact CG-CD2 4.45Å; V202-L206 HydrophobicContact CG1-CD1 3.93Å; V202-L206 HydrophobicContact CG1-CG 4.39Å; V202-L206 WeakPolarHBondContact O-CB 3.49Å; V202-L206 VanDerWaalsContact O-CG 3.27Å; V202-L206 WeakPolarHBondContact O-CG 2.97Å; V202-L206 PolarHBondContact O-N 3.02Å; E203-L206 PolarHBondContact O-N 3.48Å; L206-E210 VanDerWaalsContact O-CA 3.32Å; L206-E210 WeakPolarHBondContact O-CA 3.25Å; L206-E210 PolarHBondContact O-N 2.84Å; L206-W211 HydrophobicContact CD2-CB 4.11Å; L206-A214 HydrophobicContact CD2-CB 3.73Å; L206-A214 HydrophobicContact CG-CB 4.13Å
207	S	93.7	Very high	93.4	Very high	93 Å²	93	61.3 Å²	61.3	65%	0.65	32%	0.317	S	S	*	.	H	α-helix	trans	-71.3	-31.7	176.7	52.7	0	0	0	0	112.9	E203 F204	E203-S207 WeakPolarHBondContact O-CB 3.49Å; E203-S207 PolarHBondContact O-N 3.33Å; E203-S207 PolarHBondContact O-OG 3.44Å; F204-S207 WeakPolarHBondContact CA-OG 3.35Å; F204-S207 PolarHBondContact O-N 3.09Å; F204-S207 PolarHBondContact O-OG 3.3Å
208	T	95.6	Very high	93.6	Very high	74 Å²	74	57.5 Å²	57.5	45%	0.454	30%	0.297	S	S	.	.	H	α-helix	trans	-92	-40.9	-176	-52.9	0	0	0	0	113.6	F204 L205	F204-T208 WeakPolarHBondContact O-CB 3.2Å; F204-T208 PolarHBondContact O-N 2.97Å; F204-T208 VanDerWaalsContact O-N 3.07Å; F204-T208 PolarHBondContact O-OG1 3.35Å; L205-T208 PolarHBondContact O-N 2.85Å
209	Y	93.4	Very high	93.7	Very high	129 Å²	129	57 Å²	57	51%	0.506	30%	0.296	S	S	.	.	H	α-helix	trans	-119.6	7	-169.3	-60.2	-73.8	0	0	0	114.1	L205 G213	L205-Y209 HydrophobicContact CD2-CD2 3.91Å; L205-Y209 HydrophobicContact CD2-CE2 4.06Å; L205-Y209 WeakPolarHBondContact O-CB 3.45Å; L205-Y209 PolarHBondContact O-N 2.98Å; Y209-G213 WeakPolarHBondContact O-CA 3.26Å; Y209-G213 PolarHBondContact O-N 3.04Å
210	E	91	Very high	94.2	Very high	144 Å²	144	57.9 Å²	57.9	67%	0.673	30%	0.303	S	S	*	.	H	α-helix	trans	57.2	-173.5	-170.3	-51	-179.4	171.3	0	0	112.6	L206 A214	L206-E210 VanDerWaalsContact O-CA 3.32Å; L206-E210 WeakPolarHBondContact O-CA 3.25Å; L206-E210 PolarHBondContact O-N 2.84Å; E210-A214 WeakPolarHBondContact O-CB 3.32Å; E210-A214 PolarHBondContact O-N 2.89Å
211	W	89.2	Confident	94.4	Very high	23 Å²	23	55.6 Å²	55.6	9%	0.087	29%	0.288	C	S	.	.	H	α-helix	trans	-68.3	-39.8	-174.6	79	-86.3	0	0	0	113.5	Q87 F88 L206 A214 L215	Q87-W211 HydrophobicContact CG-CZ2 3.76Å; F88-W211 HydrophobicContact CE2-CH2 4.36Å; F88-W211 HydrophobicContact CZ-CH2 4.07Å; L206-W211 HydrophobicContact CD2-CB 4.11Å; W211-A214 PolarHBondContact O-N 3.22Å; W211-L215 HydrophobicContact CE3-CD1 3.48Å; W211-L215 VanDerWaalsContact CE3-CD1 3.48Å; W211-L215 HydrophobicContact CE3-CG 4.35Å; W211-L215 HydrophobicContact CZ3-CD1 3.47Å; W211-L215 VanDerWaalsContact CZ3-CD1 3.47Å; W211-L215 WeakPolarHBondContact O-CG 3.42Å; W211-L215 PolarHBondContact O-N 2.92Å
212	K	92.7	Very high	94.5	Very high	106 Å²	106	52.2 Å²	52.2	46%	0.461	27%	0.272	S	S	.	.	H	α-helix	trans	-68.2	-45.5	-179.7	-66.8	-174.1	179.2	175.8	0	111.6	A214 L215 M216	K212-A214 VanDerWaalsContact C-N 3.35Å; K212-L215 PolarHBondContact O-N 3.1Å; K212-M216 PolarHBondContact O-N 3.41Å
213	G	93.7	Very high	94.6	Very high	21 Å²	21	55.2 Å²	55.2	22%	0.216	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-39.5	176.8	0	0	0	0	0	111.6	Y209 L215 M216 V217	Y209-G213 WeakPolarHBondContact O-CA 3.26Å; Y209-G213 PolarHBondContact O-N 3.04Å; G213-L215 PolarHBondContact O-N 3.28Å; G213-M216 WeakPolarHBondContact O-CB 3.2Å; G213-M216 PolarHBondContact O-N 3.45Å; G213-V217 WeakPolarHBondContact O-CG2 3.45Å; G213-V217 PolarHBondContact O-N 3.25Å
214	A	94.6	Very high	94.8	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-46.9	172.6	0	0	0	0	0	112.4	L205 L206 E210 W211 K212 M216 V217 L218	L205-A214 HydrophobicContact CB-CB 3.79Å; L206-A214 HydrophobicContact CD2-CB 3.73Å; L206-A214 HydrophobicContact CG-CB 4.13Å; E210-A214 WeakPolarHBondContact O-CB 3.32Å; E210-A214 PolarHBondContact O-N 2.89Å; W211-A214 PolarHBondContact O-N 3.22Å; K212-A214 VanDerWaalsContact C-N 3.35Å; A214-M216 VanDerWaalsContact C-N 3.3Å; A214-M216 PolarHBondContact O-N 3.2Å; A214-V217 PolarHBondContact O-N 3.13Å; A214-L218 WeakPolarHBondContact O-CB 3.42Å; A214-L218 VanDerWaalsContact O-CG 3.27Å; A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.38Å
215	L	94	Very high	94.9	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-37.4	175.7	-73.5	178.6	0	0	0	112.6	F137 F153 W211 K212 G213 L218 S219	F137-L215 HydrophobicContact CD1-CD2 4.16Å; F153-L215 HydrophobicContact CD2-CD2 4.2Å; F153-L215 HydrophobicContact CE2-CD2 4.18Å; W211-L215 HydrophobicContact CE3-CD1 3.48Å; W211-L215 VanDerWaalsContact CE3-CD1 3.48Å; W211-L215 HydrophobicContact CE3-CG 4.35Å; W211-L215 HydrophobicContact CZ3-CD1 3.47Å; W211-L215 VanDerWaalsContact CZ3-CD1 3.47Å; W211-L215 WeakPolarHBondContact O-CG 3.42Å; W211-L215 PolarHBondContact O-N 2.92Å; K212-L215 PolarHBondContact O-N 3.1Å; G213-L215 PolarHBondContact O-N 3.28Å; L215-L218 PolarHBondContact O-N 3.49Å; L215-S219 WeakPolarHBondContact O-CB 3.45Å; L215-S219 PolarHBondContact O-N 3.07Å
216	M	95.5	Very high	95.1	Very high	103 Å²	103	48 Å²	48	51%	0.507	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-45.4	176.5	-175.2	174.7	166.2	0	0	111.4	K212 G213 A214 S219 A220	K212-M216 PolarHBondContact O-N 3.41Å; G213-M216 WeakPolarHBondContact O-CB 3.2Å; G213-M216 PolarHBondContact O-N 3.45Å; A214-M216 VanDerWaalsContact C-N 3.3Å; A214-M216 PolarHBondContact O-N 3.2Å; M216-S219 PolarHBondContact O-N 3.18Å; M216-S219 PolarHBondContact O-OG 3.08Å; M216-A220 PolarHBondContact O-N 3.23Å
217	V	96.7	Very high	95.3	Very high	48 Å²	48	51.1 Å²	51.1	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175.3	-179.1	0	0	0	0	111	F201 L205 G213 A214 S219 A220 V221	F201-V217 HydrophobicContact CZ-CG1 4.27Å; L205-V217 HydrophobicContact CD1-CB 4.02Å; L205-V217 HydrophobicContact CD1-CG1 3.92Å; L205-V217 HydrophobicContact CD2-CB 4.04Å; L205-V217 HydrophobicContact CD2-CG1 3.86Å; L205-V217 HydrophobicContact CD2-CG2 4.14Å; G213-V217 WeakPolarHBondContact O-CG2 3.45Å; G213-V217 PolarHBondContact O-N 3.25Å; A214-V217 PolarHBondContact O-N 3.13Å; V217-S219 VanDerWaalsContact C-N 3.26Å; V217-S219 PolarHBondContact O-N 3.31Å; V217-A220 WeakPolarHBondContact O-CB 3.5Å; V217-A220 PolarHBondContact O-N 3.33Å; V217-A220 VanDerWaalsContact O-N 3.09Å; V217-V221 WeakPolarHBondContact O-CG2 3.46Å; V217-V221 PolarHBondContact O-N 3.34Å
218	L	95.5	Very high	95.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-33.8	176.4	-71	173.8	0	0	0	112.5	I73 L80 F137 F198 F201 V202 L205 A214 L215 V221 A222	I73-L218 HydrophobicContact CD1-CD2 4.33Å; I73-L218 HydrophobicContact CG1-CD2 4.2Å; L80-L218 HydrophobicContact CD1-CD1 4.4Å; F137-L218 HydrophobicContact CD1-CB 3.85Å; F137-L218 HydrophobicContact CE1-CB 4Å; F137-L218 HydrophobicContact CE1-CD1 4.32Å; F198-L218 HydrophobicContact CD1-CD2 4.48Å; F198-L218 HydrophobicContact CE1-CD2 4.42Å; F201-L218 HydrophobicContact CE1-CD2 4.43Å; V202-L218 HydrophobicContact CG2-CD1 4.34Å; V202-L218 HydrophobicContact CG2-CD2 4.12Å; L205-L218 HydrophobicContact CD1-CD2 4.2Å; L205-L218 HydrophobicContact CD1-CG 4.18Å; A214-L218 WeakPolarHBondContact O-CB 3.42Å; A214-L218 VanDerWaalsContact O-CG 3.27Å; A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.38Å; L215-L218 PolarHBondContact O-N 3.49Å; L218-V221 PolarHBondContact O-N 3.31Å; L218-A222 WeakPolarHBondContact O-CB 3.5Å; L218-A222 PolarHBondContact O-N 3.02Å
219	S	96.8	Very high	95.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-45	173	79.5	0	0	0	0	111.4	F134 L215 M216 V217 V221 A222 L223	F134-S219 WeakPolarHBondContact CD2-O 3.47Å; L215-S219 WeakPolarHBondContact O-CB 3.45Å; L215-S219 PolarHBondContact O-N 3.07Å; M216-S219 PolarHBondContact O-N 3.18Å; M216-S219 PolarHBondContact O-OG 3.08Å; V217-S219 VanDerWaalsContact C-N 3.26Å; V217-S219 PolarHBondContact O-N 3.31Å; S219-V221 VanDerWaalsContact C-N 3.32Å; S219-V221 PolarHBondContact O-N 3.12Å; S219-A222 WeakPolarHBondContact O-CB 3.4Å; S219-A222 PolarHBondContact O-N 3.27Å; S219-L223 PolarHBondContact O-N 3.35Å
220	A	97.5	Very high	95.6	Very high	52 Å²	52	39.8 Å²	39.8	43%	0.43	23%	0.226	S	C	.	.	H	α-helix	trans	-65.2	-36.5	177.2	0	0	0	0	0	111.8	M216 V217 L223 N224	M216-A220 PolarHBondContact O-N 3.23Å; V217-A220 WeakPolarHBondContact O-CB 3.5Å; V217-A220 PolarHBondContact O-N 3.33Å; V217-A220 VanDerWaalsContact O-N 3.09Å; A220-L223 WeakPolarHBondContact O-CB 3.32Å; A220-L223 PolarHBondContact O-N 2.9Å; A220-N224 PolarHBondContact O-ND2 3.11Å
221	V	97.1	Very high	95.9	Very high	28 Å²	28	35.8 Å²	35.8	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-47	172.3	177.3	0	0	0	0	110.6	I69 I73 F198 F201 V217 L218 S219 L223 N224	I69-V221 HydrophobicContact CG1-CG1 4.42Å; I69-V221 HydrophobicContact CG2-CG1 3.99Å; I73-V221 HydrophobicContact CD1-CG1 4.34Å; F198-V221 HydrophobicContact CE1-CG1 3.87Å; F198-V221 HydrophobicContact CZ-CG1 3.75Å; F201-V221 HydrophobicContact CE1-CG2 4.29Å; V217-V221 WeakPolarHBondContact O-CG2 3.46Å; V217-V221 PolarHBondContact O-N 3.34Å; L218-V221 PolarHBondContact O-N 3.31Å; S219-V221 VanDerWaalsContact C-N 3.32Å; S219-V221 PolarHBondContact O-N 3.12Å; V221-L223 PolarHBondContact O-N 3.23Å; V221-N224 VanDerWaalsContact O-CB 3.29Å; V221-N224 WeakPolarHBondContact O-CB 3.49Å; V221-N224 PolarHBondContact O-N 2.94Å; V221-N224 PolarHBondContact O-ND2 2.95Å
222	A	95.9	Very high	96.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-32.7	176	0	0	0	0	0	112.8	F137 F161 L218 S219 N224 L225	F137-A222 HydrophobicContact CD2-CB 4.28Å; F161-A222 HydrophobicContact CE1-CB 4.2Å; F161-A222 HydrophobicContact CZ-CB 4.47Å; L218-A222 WeakPolarHBondContact O-CB 3.5Å; L218-A222 PolarHBondContact O-N 3.02Å; S219-A222 WeakPolarHBondContact O-CB 3.4Å; S219-A222 PolarHBondContact O-N 3.27Å; A222-N224 PolarHBondContact O-N 2.88Å; A222-L225 WeakPolarHBondContact O-CB 3.38Å; A222-L225 VanDerWaalsContact O-CG 3.26Å; A222-L225 WeakPolarHBondContact O-CG 3.18Å; A222-L225 PolarHBondContact O-N 3.45Å
223	L	97.3	Very high	96	Very high	64 Å²	64	37.6 Å²	37.6	34%	0.335	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-25.6	175.1	-173	61.2	0	0	0	112.8	L131 F134 S219 A220 V221 L225 A226	L131-L223 HydrophobicContact CD2-CD1 3.76Å; F134-L223 HydrophobicContact CB-CB 4.11Å; F134-L223 HydrophobicContact CB-CD1 4.01Å; F134-L223 HydrophobicContact CD2-CB 4.04Å; F134-L223 HydrophobicContact CD2-CD2 4.34Å; F134-L223 HydrophobicContact CG-CB 4.27Å; F134-L223 HydrophobicContact CG-CD1 4.1Å; S219-L223 PolarHBondContact O-N 3.35Å; A220-L223 WeakPolarHBondContact O-CB 3.32Å; A220-L223 PolarHBondContact O-N 2.9Å; V221-L223 PolarHBondContact O-N 3.23Å; L223-L225 PolarHBondContact O-N 3.44Å; L223-A226 VanDerWaalsContact O-CB 3.31Å; L223-A226 WeakPolarHBondContact O-CB 3.47Å; L223-A226 PolarHBondContact O-N 3.31Å
224	N	97.5	Very high	95.6	Very high	79 Å²	79	38.2 Å²	38.2	42%	0.422	21%	0.211	S	C	.	.	H	α-helix	trans	-65.2	-16.7	174.5	-71.7	-85.4	0	0	0	113	I69 A220 V221 A222 A226 V227 C228	I69-N224 HydrophobicContact CD1-CB 4.16Å; A220-N224 PolarHBondContact O-ND2 3.11Å; V221-N224 VanDerWaalsContact O-CB 3.29Å; V221-N224 WeakPolarHBondContact O-CB 3.49Å; V221-N224 PolarHBondContact O-N 2.94Å; V221-N224 PolarHBondContact O-ND2 2.95Å; A222-N224 PolarHBondContact O-N 2.88Å; N224-A226 PolarHBondContact O-N 3.35Å; N224-V227 WeakPolarHBondContact O-CA 3.27Å; N224-V227 WeakPolarHBondContact O-CB 3.35Å; N224-V227 PolarHBondContact O-N 3.4Å; N224-C228 PolarHBondContact O-N 3.14Å; N224-C228 PolarHBondContact O-SG 3.32Å; N224-C228 VanDerWaalsContact O-SG 3.33Å
225	L	98	Very high	95.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-29.2	169.6	-62.9	175.1	0	0	0	111.8	V66 I69 F161 C164 A222 L223 V227 C228 G229	V66-L225 HydrophobicContact CB-CD2 4.2Å; V66-L225 HydrophobicContact CG1-CD2 4.26Å; V66-L225 HydrophobicContact CG2-CD2 4.02Å; I69-L225 HydrophobicContact CB-CD2 3.95Å; I69-L225 HydrophobicContact CD1-CD2 4.27Å; I69-L225 HydrophobicContact CG2-CD1 4.43Å; I69-L225 HydrophobicContact CG2-CD2 4.03Å; I69-L225 HydrophobicContact CG2-CG 4.13Å; F161-L225 HydrophobicContact CD1-CD1 3.73Å; F161-L225 HydrophobicContact CE1-CD1 3.43Å; F161-L225 VanDerWaalsContact CE1-CD1 3.43Å; F161-L225 HydrophobicContact CZ-CD1 4.25Å; C164-L225 HydrophobicContact CB-CD1 4.46Å; A222-L225 WeakPolarHBondContact O-CB 3.38Å; A222-L225 VanDerWaalsContact O-CG 3.26Å; A222-L225 WeakPolarHBondContact O-CG 3.18Å; A222-L225 PolarHBondContact O-N 3.45Å; L223-L225 PolarHBondContact O-N 3.44Å; L225-V227 VanDerWaalsContact C-N 3.33Å; L225-C228 WeakPolarHBondContact O-CB 3.07Å; L225-C228 PolarHBondContact O-N 3.4Å; L225-G229 PolarHBondContact O-N 2.91Å
226	A	97.6	Very high	94.1	Very high	16 Å²	16	46.5 Å²	46.5	13%	0.132	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-33.5	172.9	0	0	0	0	0	112	I127 L223 N224 G229 A230	I127-A226 HydrophobicContact CG2-CB 4.41Å; L223-A226 VanDerWaalsContact O-CB 3.31Å; L223-A226 WeakPolarHBondContact O-CB 3.47Å; L223-A226 PolarHBondContact O-N 3.31Å; N224-A226 PolarHBondContact O-N 3.35Å; A226-G229 PolarHBondContact O-N 2.8Å; A226-A230 PolarHBondContact O-N 3.05Å
227	V	97.4	Very high	93	Very high	84 Å²	84	45 Å²	45	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-67	-42.1	172.3	-177.4	0	0	0	0	110.2	N224 L225 G229 A230 L231	N224-V227 WeakPolarHBondContact O-CA 3.27Å; N224-V227 WeakPolarHBondContact O-CB 3.35Å; N224-V227 PolarHBondContact O-N 3.4Å; L225-V227 VanDerWaalsContact C-N 3.33Å; V227-G229 VanDerWaalsContact C-N 3.3Å; V227-G229 PolarHBondContact O-N 3.18Å; V227-A230 WeakPolarHBondContact O-CB 3.23Å; V227-A230 PolarHBondContact O-N 3.31Å; V227-A230 VanDerWaalsContact O-N 3.09Å; V227-L231 PolarHBondContact O-N 2.97Å; V227-L231 VanDerWaalsContact O-N 3.14Å
228	C	97.4	Very high	91.3	Very high	10 Å²	10	44.6 Å²	44.6	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-59	-43.5	172.5	-59.1	0	0	0	0	111	A62 V66 N224 L225 A230 L231 I232	A62-C228 HydrophobicContact CB-CB 4.44Å; V66-C228 HydrophobicContact CG2-CB 3.66Å; N224-C228 PolarHBondContact O-N 3.14Å; N224-C228 PolarHBondContact O-SG 3.32Å; N224-C228 VanDerWaalsContact O-SG 3.33Å; L225-C228 WeakPolarHBondContact O-CB 3.07Å; L225-C228 PolarHBondContact O-N 3.4Å; C228-A230 VanDerWaalsContact C-N 3.32Å; C228-A230 PolarHBondContact O-N 3.09Å; C228-L231 WeakPolarHBondContact O-CB 3.43Å; C228-L231 PolarHBondContact O-N 3.32Å; C228-L231 VanDerWaalsContact O-N 3.11Å; C228-I232 PolarHBondContact O-N 2.69Å
229	G	96.2	Very high	89.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.4	-40.9	172.6	0	0	0	0	0	112.8	R123 T126 L225 A226 V227 L231 I232	R123-G229 WeakPolarHBondContact CG-O 3.49Å; T126-G229 VanDerWaalsContact CG2-CA 3.42Å; L225-G229 PolarHBondContact O-N 2.91Å; A226-G229 PolarHBondContact O-N 2.8Å; V227-G229 VanDerWaalsContact C-N 3.3Å; V227-G229 PolarHBondContact O-N 3.18Å; G229-L231 PolarHBondContact O-N 3.06Å; G229-I232 PolarHBondContact O-N 3.39Å; G229-I232 VanDerWaalsContact O-N 3.09Å
230	A	96.4	Very high	88	Confident	47 Å²	47	51.5 Å²	51.5	39%	0.388	27%	0.273	S	S	.	.	H	α-helix	trans	-65.2	-25	176.8	0	0	0	0	0	113.9	A226 V227 C228	A226-A230 PolarHBondContact O-N 3.05Å; V227-A230 WeakPolarHBondContact O-CB 3.23Å; V227-A230 PolarHBondContact O-N 3.31Å; V227-A230 VanDerWaalsContact O-N 3.09Å; C228-A230 VanDerWaalsContact C-N 3.32Å; C228-A230 PolarHBondContact O-N 3.09Å
231	L	96.3	Very high	86.5	Confident	60 Å²	60	51.9 Å²	51.9	31%	0.314	27%	0.27	S	S	.	.	H	α-helix	trans	-80.9	-20.8	173.2	-67.3	169.3	0	0	0	113	Y55 V58 A62 V227 C228 G229 R233	Y55-L231 VanDerWaalsContact CE1-O 3.3Å; Y55-L231 WeakPolarHBondContact CE1-O 3.39Å; Y55-L231 PolarHBondContact OH-O 3.19Å; V58-L231 HydrophobicContact CG1-CB 4.49Å; V58-L231 HydrophobicContact CG1-CD2 4.32Å; A62-L231 HydrophobicContact CB-CB 3.98Å; A62-L231 HydrophobicContact CB-CD1 4.44Å; V227-L231 PolarHBondContact O-N 2.97Å; V227-L231 VanDerWaalsContact O-N 3.14Å; C228-L231 WeakPolarHBondContact O-CB 3.43Å; C228-L231 PolarHBondContact O-N 3.32Å; C228-L231 VanDerWaalsContact O-N 3.11Å; G229-L231 PolarHBondContact O-N 3.06Å; L231-R233 PolarHBondContact O-N 2.98Å
232	I	93.3	Very high	85.2	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.293	C	S	.	.			trans	-75.2	113.7	173	-62.9	171	0	0	0	107.3	A62 C122 R123 T126 A171 C228 G229	A62-I232 HydrophobicContact CB-CG1 4.21Å; C122-I232 HydrophobicContact CB-CG2 3.96Å; R123-I232 VanDerWaalsContact CB-O 3.32Å; R123-I232 WeakPolarHBondContact CB-O 2.97Å; R123-I232 WeakPolarHBondContact CD-O 3.44Å; R123-I232 WeakPolarHBondContact CG-O 3.41Å; T126-I232 HydrophobicContact CG2-CD1 4.19Å; A171-I232 HydrophobicContact CB-CG2 3.74Å; C228-I232 PolarHBondContact O-N 2.69Å; G229-I232 PolarHBondContact O-N 3.39Å; G229-I232 VanDerWaalsContact O-N 3.09Å
233	R	90.8	Very high	83.9	Confident	166 Å²	166	62.4 Å²	62.4	63%	0.626	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-100.4	126.6	170.2	-178.8	176.2	177.2	175.3	-1.2	107.2	Y55 Y175 L231	Y55-R233 HydrophobicContact CD1-CB 4.12Å; Y55-R233 HydrophobicContact CE1-CB 3.52Å; Y175-R233 WeakPolarHBondContact CE2-O 3.44Å; Y175-R233 PolarHBondContact OH-O 3.27Å; L231-R233 PolarHBondContact O-N 2.98Å
234	D	85.5	Confident	82.5	Confident	34 Å²	34	62 Å²	62	18%	0.182	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-75.2	142.7	177.2	-65.3	-71.7	0	0	0	110.9	E121 C122 R123	E121-D234 HydrophobicContact CB-CB 4.1Å; E121-D234 VanDerWaalsContact CB-CG 3.46Å; E121-D234 VanDerWaalsContact CB-OD2 3.28Å; E121-D234 WeakPolarHBondContact CB-OD2 3.1Å; C122-D234 WeakPolarHBondContact CA-OD1 3.29Å; C122-D234 WeakPolarHBondContact CB-OD1 3.46Å; C122-D234 PolarHBondContact N-OD1 2.9Å; C122-D234 PolarHBondContact N-OD2 3.37Å; C122-D234 PolarHBondContact SG-OD1 3.3Å; R123-D234 WeakPolarHBondContact CB-OD2 3.36Å; R123-D234 PolarHBondContact N-OD2 3.45Å
235	L	84.4	Confident	81.3	Confident	31 Å²	31	63.4 Å²	63.4	16%	0.162	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-70.8	140.3	173.2	-75.8	97.7	0	0	0	109.7	P48 Y175	P48-L235 HydrophobicContact CB-CB 4.38Å; P48-L235 HydrophobicContact CB-CD2 4.18Å; P48-L235 HydrophobicContact CG-CB 4.33Å; Y175-L235 HydrophobicContact CD1-CD1 4.15Å; Y175-L235 HydrophobicContact CD2-CD1 3.31Å; Y175-L235 HydrophobicContact CE1-CD1 4.08Å; Y175-L235 HydrophobicContact CE1-CG 4.42Å; Y175-L235 HydrophobicContact CE2-CD1 3.22Å; Y175-L235 HydrophobicContact CE2-CG 4.15Å; Y175-L235 HydrophobicContact CG-CD1 3.79Å
236	Q	73.8	Confident	80.1	Confident	151 Å²	151	67.2 Å²	67.2	71%	0.706	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-83.1	121.1	174.9	-170.3	153.8	18.3	0	0	109.7
237	W	70.9	Confident	78.8	Confident	70 Å²	70	72.3 Å²	72.3	27%	0.265	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-71.8	137.7	-178.9	-66.4	79.7	0	0	0	110.6	F47 P48 Y174 E239 D240	F47-W237 HydrophobicContact CD1-CH2 4.23Å; F47-W237 AromaticContact CD1-CZ3 3.58Å; F47-W237 HydrophobicContact CD1-CZ3 3.58Å; F47-W237 HydrophobicContact CE1-CZ3 4.11Å; P48-W237 VanDerWaalsContact CD-CZ3 3.46Å; P48-W237 HydrophobicContact CG-CD2 4.05Å; P48-W237 HydrophobicContact CG-CE3 4.06Å; P48-W237 HydrophobicContact CG-CH2 4.49Å; P48-W237 HydrophobicContact CG-CZ2 4.49Å; P48-W237 HydrophobicContact CG-CZ3 4.3Å; Y174-W237 HydrophobicContact CD2-CZ2 4.49Å; Y174-W237 HydrophobicContact CE1-CH2 4.41Å; Y174-W237 HydrophobicContact CE1-CZ2 4.36Å; Y174-W237 HydrophobicContact CE2-CZ2 4.03Å; Y174-W237 AromaticContact CZ-CZ2 3.92Å; W237-E239 PolarHBondContact O-N 2.85Å; W237-D240 WeakPolarHBondContact O-CB 3.38Å; W237-D240 PolarHBondContact O-N 2.94Å
238	P	61.5	Low	77.6	Confident	40 Å²	40	74.1 Å²	74.1	26%	0.26	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-55	-37.7	179.7	-25.7	33.7	0	0	0	112	P48 D240 T241 Y244	P48-P238 VanDerWaalsContact N-CD 3.34Å; P238-D240 PolarHBondContact O-N 3.46Å; P238-D240 VanDerWaalsContact O-N 3.13Å; P238-T241 VanDerWaalsContact O-CB 3.23Å; P238-T241 WeakPolarHBondContact O-CB 3.5Å; P238-T241 PolarHBondContact O-N 2.98Å; P238-T241 PolarHBondContact O-OG1 3.39Å; P238-Y244 WeakPolarHBondContact O-CB 3.39Å
239	E	62.9	Low	76.5	Confident	58 Å²	58	79.7 Å²	79.7	27%	0.271	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-56.3	-28.9	177.4	-62.3	-137.2	116.8	0	0	114	E46 W237 T241 Y244 K245	E46-E239 HydrophobicContact CG-CG 4.03Å; W237-E239 PolarHBondContact O-N 2.85Å; E239-T241 VanDerWaalsContact C-N 3.34Å; E239-Y244 VanDerWaalsContact CA-CD1 3.42Å; E239-Y244 HydrophobicContact CB-CD1 4.21Å; E239-Y244 HydrophobicContact CB-CE1 4Å; E239-Y244 HydrophobicContact CG-CE1 4.01Å; E239-Y244 WeakPolarHBondContact O-CD1 3.22Å; E239-Y244 VanDerWaalsContact OE1-CZ 3.29Å; E239-Y244 PolarHBondContact OE1-OH 3.28Å; E239-K245 WeakPolarHBondContact O-CE 3.38Å
240	D	61.2	Low	75.5	Confident	90 Å²	90	84.1 Å²	84.1	48%	0.481	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-81.1	-18	179.6	-79.4	-41.9	0	0	0	113.6	W237 P238 K245	W237-D240 WeakPolarHBondContact O-CB 3.38Å; W237-D240 PolarHBondContact O-N 2.94Å; P238-D240 PolarHBondContact O-N 3.46Å; P238-D240 VanDerWaalsContact O-N 3.13Å; D240-K245 PolarHBondContact O-NZ 3.45Å; D240-K245 IonicContact OD1-NZ 2.74Å; D240-K245 PolarHBondContact OD1-NZ 3.48Å
241	T	65.4	Low	74.3	Confident	60 Å²	60	87.1 Å²	87.1	37%	0.368	39%	0.389	S	S	.	.	S	Bend	trans	-69.8	140.6	-176.3	-51.1	0	0	0	0	111.1	P238 E239 E243 Y244 K245	P238-T241 VanDerWaalsContact O-CB 3.23Å; P238-T241 WeakPolarHBondContact O-CB 3.5Å; P238-T241 PolarHBondContact O-N 2.98Å; P238-T241 PolarHBondContact O-OG1 3.39Å; E239-T241 VanDerWaalsContact C-N 3.34Å; T241-E243 HydrophobicContact CG2-CB 4.34Å; T241-E243 PolarHBondContact O-N 2.88Å; T241-Y244 PolarHBondContact O-N 3.35Å; T241-Y244 VanDerWaalsContact O-N 3.16Å; T241-K245 PolarHBondContact O-N 3.41Å; T241-K245 VanDerWaalsContact O-N 3.11Å
242	Y	68.7	Low	73.4	Confident	166 Å²	166	87.1 Å²	87.1	65%	0.651	39%	0.394	S	S	*	.	H	α-helix	trans	-54.1	-41	177	172	-100.7	0	0	0	112.2	Y244 K245 K246	Y242-Y244 PolarHBondContact O-N 2.93Å; Y242-K245 PolarHBondContact O-N 3.22Å; Y242-K246 HydrophobicContact CD1-CD 4.45Å; Y242-K246 HydrophobicContact CE1-CB 4.37Å; Y242-K246 HydrophobicContact CE1-CD 3.7Å; Y242-K246 WeakPolarHBondContact O-CB 3.44Å; Y242-K246 PolarHBondContact O-N 2.9Å
243	E	69.2	Low	72.4	Confident	83 Å²	83	90.8 Å²	90.8	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-42.4	178.8	-73.8	-60.5	146.1	0	0	112.4	T241 K246 R247	T241-E243 HydrophobicContact CG2-CB 4.34Å; T241-E243 PolarHBondContact O-N 2.88Å; E243-K246 PolarHBondContact O-N 2.92Å; E243-K246 IonicContact OE1-NZ 3.46Å; E243-K246 IonicContact OE2-NZ 3.05Å; E243-R247 WeakPolarHBondContact O-CB 3.31Å; E243-R247 VanDerWaalsContact O-CG 3.27Å; E243-R247 WeakPolarHBondContact O-CG 3.33Å; E243-R247 PolarHBondContact O-N 2.96Å
244	Y	67.7	Low	71.6	Confident	55 Å²	55	87.5 Å²	87.5	22%	0.216	41%	0.408	C	S	.	.	H	α-helix	trans	-63.6	-47.3	174.3	178.6	-94.3	0	0	0	111.3	P238 E239 T241 Y242 K246 R247 K248	P238-Y244 WeakPolarHBondContact O-CB 3.39Å; E239-Y244 VanDerWaalsContact CA-CD1 3.42Å; E239-Y244 HydrophobicContact CB-CD1 4.21Å; E239-Y244 HydrophobicContact CB-CE1 4Å; E239-Y244 HydrophobicContact CG-CE1 4.01Å; E239-Y244 WeakPolarHBondContact O-CD1 3.22Å; E239-Y244 VanDerWaalsContact OE1-CZ 3.29Å; E239-Y244 PolarHBondContact OE1-OH 3.28Å; T241-Y244 PolarHBondContact O-N 3.35Å; T241-Y244 VanDerWaalsContact O-N 3.16Å; Y242-Y244 PolarHBondContact O-N 2.93Å; Y244-K246 VanDerWaalsContact C-N 3.3Å; Y244-K246 PolarHBondContact O-N 3.27Å; Y244-R247 PolarHBondContact O-N 3Å; Y244-K248 HydrophobicContact CE1-CD 3.81Å; Y244-K248 VanDerWaalsContact O-CB 3.28Å; Y244-K248 WeakPolarHBondContact O-CB 3.48Å; Y244-K248 PolarHBondContact O-N 3.04Å
245	K	72.5	Confident	70.9	Confident	109 Å²	109	90.6 Å²	90.6	47%	0.474	43%	0.425	S	S	.	.	H	α-helix	trans	-60.6	-38.8	177.5	-74.1	169.9	-179.8	149.4	0	112.1	E239 D240 T241 Y242 F249	E239-K245 WeakPolarHBondContact O-CE 3.38Å; D240-K245 PolarHBondContact O-NZ 3.45Å; D240-K245 IonicContact OD1-NZ 2.74Å; D240-K245 PolarHBondContact OD1-NZ 3.48Å; T241-K245 PolarHBondContact O-N 3.41Å; T241-K245 VanDerWaalsContact O-N 3.11Å; Y242-K245 PolarHBondContact O-N 3.22Å; K245-F249 VanDerWaalsContact O-CB 3.27Å; K245-F249 WeakPolarHBondContact O-CB 3.47Å; K245-F249 PolarHBondContact O-N 3.4Å
246	K	72.3	Confident	70	Confident	81 Å²	81	92.2 Å²	92.2	35%	0.352	44%	0.439	S	S	.	.	H	α-helix	trans	-66.4	-48	175	177.6	-175.9	169.6	-164.3	0	111.3	Y242 E243 Y244 F249 L250	Y242-K246 HydrophobicContact CD1-CD 4.45Å; Y242-K246 HydrophobicContact CE1-CB 4.37Å; Y242-K246 HydrophobicContact CE1-CD 3.7Å; Y242-K246 WeakPolarHBondContact O-CB 3.44Å; Y242-K246 PolarHBondContact O-N 2.9Å; E243-K246 PolarHBondContact O-N 2.92Å; E243-K246 IonicContact OE1-NZ 3.46Å; E243-K246 IonicContact OE2-NZ 3.05Å; Y244-K246 VanDerWaalsContact C-N 3.3Å; Y244-K246 PolarHBondContact O-N 3.27Å; K246-F249 WeakPolarHBondContact O-CB 3.37Å; K246-F249 PolarHBondContact O-N 2.88Å; K246-L250 HydrophobicContact CG-CD1 4.21Å; K246-L250 VanDerWaalsContact O-CG 3.28Å; K246-L250 WeakPolarHBondContact O-CG 3.42Å; K246-L250 PolarHBondContact O-N 2.83Å
247	R	70.3	Confident	69.3	Low	123 Å²	123	88.4 Å²	88.4	46%	0.464	43%	0.426	S	S	.	.	H	α-helix	trans	-62.9	-45.6	177	-73.4	178.4	-170.4	-166.3	2.7	111.8	E44 E243 Y244 F249 L250 R251	E44-R247 IonicContact OE1-CZ 3.72Å; E44-R247 IonicContact OE1-NH1 3.52Å; E44-R247 PolarHBondContact OE1-NH1 3.11Å; E243-R247 WeakPolarHBondContact O-CB 3.31Å; E243-R247 VanDerWaalsContact O-CG 3.27Å; E243-R247 WeakPolarHBondContact O-CG 3.33Å; E243-R247 PolarHBondContact O-N 2.96Å; Y244-R247 PolarHBondContact O-N 3Å; R247-F249 VanDerWaalsContact C-N 3.3Å; R247-F249 PolarHBondContact O-N 2.93Å; R247-L250 CarbonylContact O-C 3.59Å; R247-L250 PolarHBondContact O-N 3.32Å; R247-L250 VanDerWaalsContact O-N 3.15Å; R247-R251 PolarHBondContact O-N 3.2Å
248	K	72.6	Confident	68.5	Low	121 Å²	121	91 Å²	91	53%	0.526	44%	0.441	S	S	.	.	H	α-helix	trans	-59.3	-41.1	175	-170.5	168.1	-171.1	159.9	0	111.7	Y244 R251 S252	Y244-K248 HydrophobicContact CE1-CD 3.81Å; Y244-K248 VanDerWaalsContact O-CB 3.28Å; Y244-K248 WeakPolarHBondContact O-CB 3.48Å; Y244-K248 PolarHBondContact O-N 3.04Å; K248-R251 PolarHBondContact O-N 3.19Å; K248-S252 PolarHBondContact O-N 2.91Å
249	F	74.9	Confident	68	Low	127 Å²	127	95 Å²	95	56%	0.557	46%	0.459	S	S	*	.	H	α-helix	trans	-64.2	-45.9	173.2	179.5	-106.6	0	0	0	112.1	K245 K246 R247 R251 S252 L253	K245-F249 VanDerWaalsContact O-CB 3.27Å; K245-F249 WeakPolarHBondContact O-CB 3.47Å; K245-F249 PolarHBondContact O-N 3.4Å; K246-F249 WeakPolarHBondContact O-CB 3.37Å; K246-F249 PolarHBondContact O-N 2.88Å; R247-F249 VanDerWaalsContact C-N 3.3Å; R247-F249 PolarHBondContact O-N 2.93Å; F249-R251 PolarHBondContact O-N 3.43Å; F249-S252 PolarHBondContact O-N 3.5Å; F249-S252 PolarHBondContact O-OG 2.99Å; F249-L253 HydrophobicContact CD1-CD1 3.93Å; F249-L253 HydrophobicContact CE1-CD1 3.45Å; F249-L253 VanDerWaalsContact CE1-CD1 3.45Å; F249-L253 HydrophobicContact CE1-CG 4.2Å; F249-L253 HydrophobicContact CZ-CD1 3.85Å; F249-L253 HydrophobicContact CZ-CD2 4.35Å; F249-L253 HydrophobicContact CZ-CG 4.21Å; F249-L253 WeakPolarHBondContact O-CG 3.37Å; F249-L253 PolarHBondContact O-N 3.41Å
250	L	74.5	Confident	67.3	Low	93 Å²	93	98 Å²	98	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-63.2	-39.4	176.6	-69.4	172.6	0	0	0	112.4	K246 R247 L253 N254	K246-L250 HydrophobicContact CG-CD1 4.21Å; K246-L250 VanDerWaalsContact O-CG 3.28Å; K246-L250 WeakPolarHBondContact O-CG 3.42Å; K246-L250 PolarHBondContact O-N 2.83Å; R247-L250 CarbonylContact O-C 3.59Å; R247-L250 PolarHBondContact O-N 3.32Å; R247-L250 VanDerWaalsContact O-N 3.15Å; L250-L253 HydrophobicContact CD2-CD1 4.38Å; L250-L253 WeakPolarHBondContact O-CB 3.42Å; L250-L253 PolarHBondContact O-N 3.1Å; L250-N254 PolarHBondContact O-N 3.39Å
251	R	72.7	Confident	66.8	Low	110 Å²	110	98.9 Å²	98.9	42%	0.415	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-46.5	171.7	-77.9	-176.3	173.6	151.3	2.2	110.8	E41 E44 R247 K248 F249 L253 N254 D255	E41-R251 IonicContact OE2-NH2 3.28Å; E41-R251 PolarHBondContact OE2-NH2 3.46Å; E44-R251 IonicContact OE2-CZ 3.44Å; E44-R251 IonicContact OE2-NH1 3.8Å; E44-R251 PolarHBondContact OE2-NH1 3.35Å; E44-R251 IonicContact OE2-NH2 2.76Å; E44-R251 PolarHBondContact OE2-NH2 3.27Å; R247-R251 PolarHBondContact O-N 3.2Å; K248-R251 PolarHBondContact O-N 3.19Å; F249-R251 PolarHBondContact O-N 3.43Å; R251-L253 PolarHBondContact O-N 2.82Å; R251-N254 PolarHBondContact O-N 2.97Å; R251-D255 PolarHBondContact O-N 3.28Å
252	S	76.1	Confident	66	Low	60 Å²	60	99.4 Å²	99.4	42%	0.42	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-31.6	176.7	79.1	0	0	0	0	113.6	K248 F249 S256	K248-S252 PolarHBondContact O-N 2.91Å; F249-S252 PolarHBondContact O-N 3.5Å; F249-S252 PolarHBondContact O-OG 2.99Å; S252-S256 WeakPolarHBondContact O-CB 3.35Å; S252-S256 PolarHBondContact O-N 3.31Å; S252-S256 PolarHBondContact O-OG 3.27Å
253	L	72.9	Confident	65.1	Low	78 Å²	78	93.8 Å²	93.8	41%	0.408	47%	0.469	S	S	.	.	H	α-helix	trans	-70.9	-38.8	172.7	-72.4	174.1	0	0	0	111.6	F249 L250 R251 S256 T257	F249-L253 HydrophobicContact CD1-CD1 3.93Å; F249-L253 HydrophobicContact CE1-CD1 3.45Å; F249-L253 VanDerWaalsContact CE1-CD1 3.45Å; F249-L253 HydrophobicContact CE1-CG 4.2Å; F249-L253 HydrophobicContact CZ-CD1 3.85Å; F249-L253 HydrophobicContact CZ-CD2 4.35Å; F249-L253 HydrophobicContact CZ-CG 4.21Å; F249-L253 WeakPolarHBondContact O-CG 3.37Å; F249-L253 PolarHBondContact O-N 3.41Å; L250-L253 HydrophobicContact CD2-CD1 4.38Å; L250-L253 WeakPolarHBondContact O-CB 3.42Å; L250-L253 PolarHBondContact O-N 3.1Å; R251-L253 PolarHBondContact O-N 2.82Å; L253-S256 WeakPolarHBondContact CA-OG 3.33Å; L253-S256 PolarHBondContact O-OG 3.34Å; L253-T257 WeakPolarHBondContact O-CG2 3.43Å; L253-T257 PolarHBondContact O-N 3.43Å; L253-T257 PolarHBondContact O-OG1 3.29Å
254	N	74.1	Confident	64.1	Low	97 Å²	97	92.4 Å²	92.4	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-73	-35.3	179.4	-153.8	37.5	0	0	0	112.5	L250 R251 T257 H258	L250-N254 PolarHBondContact O-N 3.39Å; R251-N254 PolarHBondContact O-N 2.97Å; N254-T257 VanDerWaalsContact CA-OG1 3.31Å; N254-T257 WeakPolarHBondContact CA-OG1 3.47Å; N254-T257 PolarHBondContact O-N 3.47Å; N254-T257 PolarHBondContact O-OG1 2.98Å; N254-H258 WeakPolarHBondContact O-CB 3.48Å; N254-H258 PolarHBondContact O-N 3.08Å
255	D	70.7	Confident	63.2	Low	100 Å²	100	92.6 Å²	92.6	54%	0.535	48%	0.479	S	S	.	.	H	α-helix	trans	-66.4	-40.8	174.7	-67.4	-23.6	0	0	0	110.8	R251 H258 L259	R251-D255 PolarHBondContact O-N 3.28Å; D255-H258 PolarHBondContact O-N 3.44Å; D255-L259 VanDerWaalsContact O-CD1 3.27Å; D255-L259 WeakPolarHBondContact O-CD1 3.36Å; D255-L259 PolarHBondContact O-N 3.39Å
256	S	65.5	Low	61.9	Low	65 Å²	65	90.6 Å²	90.6	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-69.6	-33.8	177.2	47.4	0	0	0	0	113	S252 L253 H260	S252-S256 WeakPolarHBondContact O-CB 3.35Å; S252-S256 PolarHBondContact O-N 3.31Å; S252-S256 PolarHBondContact O-OG 3.27Å; L253-S256 WeakPolarHBondContact CA-OG 3.33Å; L253-S256 PolarHBondContact O-OG 3.34Å; S256-H260 WeakPolarHBondContact O-CB 3.04Å; S256-H260 PolarHBondContact O-N 3.04Å
257	T	58.3	Low	60.4	Low	70 Å²	70	91.4 Å²	91.4	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-70.5	-36.5	170.9	49.2	0	0	0	0	112.4	L253 N254 H260 N261	L253-T257 WeakPolarHBondContact O-CG2 3.43Å; L253-T257 PolarHBondContact O-N 3.43Å; L253-T257 PolarHBondContact O-OG1 3.29Å; N254-T257 VanDerWaalsContact CA-OG1 3.31Å; N254-T257 WeakPolarHBondContact CA-OG1 3.47Å; N254-T257 PolarHBondContact O-N 3.47Å; N254-T257 PolarHBondContact O-OG1 2.98Å; T257-H260 PolarHBondContact O-N 3.25Å; T257-N261 WeakPolarHBondContact O-CB 3.44Å; T257-N261 PolarHBondContact O-N 3.27Å
258	H	53.6	Low	59.2	Low	126 Å²	126	89.8 Å²	89.8	58%	0.583	49%	0.486	S	S	*	.	H	α-helix	trans	-64.4	-40.6	173.9	-104.6	-87.2	0	0	0	112.4	N254 D255 H260 N261 S262	N254-H258 WeakPolarHBondContact O-CB 3.48Å; N254-H258 PolarHBondContact O-N 3.08Å; D255-H258 PolarHBondContact O-N 3.44Å; H258-H260 VanDerWaalsContact C-N 3.31Å; H258-H260 PolarHBondContact O-N 2.92Å; H258-N261 PolarHBondContact O-N 2.63Å; H258-S262 PolarHBondContact O-N 3.48Å; H258-S262 PolarHBondContact O-OG 3.08Å
259	L	51.9	Low	57.9	Low	123 Å²	123	90.2 Å²	90.2	64%	0.644	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-36.8	171.8	-96.3	106.7	0	0	0	112.4	D255 S262 S263	D255-L259 VanDerWaalsContact O-CD1 3.27Å; D255-L259 WeakPolarHBondContact O-CD1 3.36Å; D255-L259 PolarHBondContact O-N 3.39Å; L259-S262 PolarHBondContact O-OG 2.7Å; L259-S262 VanDerWaalsContact O-OG 3.08Å; L259-S263 WeakPolarHBondContact O-CB 3.45Å; L259-S263 PolarHBondContact O-N 2.82Å; L259-S263 VanDerWaalsContact O-N 3.15Å; L259-S263 PolarHBondContact O-OG 3.26Å
260	H	48.7	Very low	56.5	Low	122 Å²	122	91.4 Å²	91.4	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-72.4	-36	177.7	-156.9	-58.5	0	0	0	112	S256 T257 H258 S263 V264	S256-H260 WeakPolarHBondContact O-CB 3.04Å; S256-H260 PolarHBondContact O-N 3.04Å; T257-H260 PolarHBondContact O-N 3.25Å; H258-H260 VanDerWaalsContact C-N 3.31Å; H258-H260 PolarHBondContact O-N 2.92Å; H260-S263 WeakPolarHBondContact CA-OG 3.32Å; H260-S263 PolarHBondContact O-OG 3.34Å; H260-V264 WeakPolarHBondContact O-CB 3.49Å; H260-V264 WeakPolarHBondContact O-CG2 3.44Å; H260-V264 PolarHBondContact O-N 2.73Å
261	N	50.4	Low	54.7	Low	108 Å²	108	96.7 Å²	96.7	58%	0.578	52%	0.515	S	S	*	.	H	α-helix	trans	-73	-36.2	177.7	-75.3	-15.7	0	0	0	112.2	T257 H258 A265	T257-N261 WeakPolarHBondContact O-CB 3.44Å; T257-N261 PolarHBondContact O-N 3.27Å; H258-N261 PolarHBondContact O-N 2.63Å; N261-A265 VanDerWaalsContact O-CB 3.29Å; N261-A265 WeakPolarHBondContact O-CB 3.22Å; N261-A265 PolarHBondContact O-N 2.84Å
262	S	49.6	Very low	53	Low	71 Å²	71	98.9 Å²	98.9	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-69.7	-39.8	176.1	64.2	0	0	0	0	112.4	H258 L259 A265 S266	H258-S262 PolarHBondContact O-N 3.48Å; H258-S262 PolarHBondContact O-OG 3.08Å; L259-S262 PolarHBondContact O-OG 2.7Å; L259-S262 VanDerWaalsContact O-OG 3.08Å; S262-A265 PolarHBondContact O-N 3.11Å; S262-S266 PolarHBondContact O-N 2.92Å
263	S	49.5	Very low	51.1	Low	48 Å²	48	100.1 Å²	100.1	34%	0.336	54%	0.543	S	S	.	.	H	α-helix	trans	-65.8	-41.3	173.9	48.1	0	0	0	0	111.9	L259 H260 S266 L267	L259-S263 WeakPolarHBondContact O-CB 3.45Å; L259-S263 PolarHBondContact O-N 2.82Å; L259-S263 VanDerWaalsContact O-N 3.15Å; L259-S263 PolarHBondContact O-OG 3.26Å; H260-S263 WeakPolarHBondContact CA-OG 3.32Å; H260-S263 PolarHBondContact O-OG 3.34Å; S263-S266 PolarHBondContact O-N 3.27Å; S263-S266 PolarHBondContact O-OG 3.23Å; S263-L267 WeakPolarHBondContact O-CG 3.37Å; S263-L267 PolarHBondContact O-N 2.98Å
264	V	48.4	Very low	49.1	Very low	54 Å²	54	103.9 Å²	103.9	33%	0.327	56%	0.559	S	S	.	*	H	α-helix	trans	-65	-40.6	173	173.3	0	0	0	0	111.5	H260 S266 L267 I268	H260-V264 WeakPolarHBondContact O-CB 3.49Å; H260-V264 WeakPolarHBondContact O-CG2 3.44Å; H260-V264 PolarHBondContact O-N 2.73Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 3.39Å; V264-L267 PolarHBondContact O-N 3.16Å; V264-I268 HydrophobicContact CG1-CD1 3.75Å; V264-I268 HydrophobicContact CG1-CG1 4.33Å; V264-I268 VanDerWaalsContact O-CG1 3.28Å; V264-I268 WeakPolarHBondContact O-CG1 3.4Å; V264-I268 PolarHBondContact O-N 3.44Å
265	A	47.7	Very low	46.9	Very low	58 Å²	58	104.3 Å²	104.3	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-61.1	-41.4	175	0	0	0	0	0	111.9	N261 S262 L267 I268 D269	N261-A265 VanDerWaalsContact O-CB 3.29Å; N261-A265 WeakPolarHBondContact O-CB 3.22Å; N261-A265 PolarHBondContact O-N 2.84Å; S262-A265 PolarHBondContact O-N 3.11Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 2.93Å; A265-I268 PolarHBondContact O-N 3.02Å; A265-D269 PolarHBondContact O-N 3.27Å
266	S	46.3	Very low	44.8	Very low	67 Å²	67	105.5 Å²	105.5	47%	0.469	59%	0.585	S	S	.	*	H	α-helix	trans	-66.6	-33	175.8	72.6	0	0	0	0	113.3	S262 S263 V264 Q270	S262-S266 PolarHBondContact O-N 2.92Å; S263-S266 PolarHBondContact O-N 3.27Å; S263-S266 PolarHBondContact O-OG 3.23Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 3.39Å; S266-Q270 PolarHBondContact O-N 2.81Å; S266-Q270 VanDerWaalsContact O-N 3.12Å
267	L	40.5	Very low	43	Very low	98 Å²	98	108.4 Å²	108.4	51%	0.513	60%	0.6	S	S	.	*	H	α-helix	trans	-73.7	-31.9	174.8	-76.6	165.6	0	0	0	112.3	S263 V264 A265 R271	S263-L267 WeakPolarHBondContact O-CG 3.37Å; S263-L267 PolarHBondContact O-N 2.98Å; V264-L267 PolarHBondContact O-N 3.16Å; A265-L267 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 2.93Å; L267-R271 PolarHBondContact O-N 2.64Å; L267-R271 VanDerWaalsContact O-N 3.16Å
268	I	44.8	Very low	41.3	Very low	89 Å²	89	112.8 Å²	112.8	46%	0.456	62%	0.62	S	S	.	*	H	α-helix	trans	-70.6	-40.5	174.2	-69.5	167.8	0	0	0	110	V264 A265 Q270 R271 H272	V264-I268 HydrophobicContact CG1-CD1 3.75Å; V264-I268 HydrophobicContact CG1-CG1 4.33Å; V264-I268 VanDerWaalsContact O-CG1 3.28Å; V264-I268 WeakPolarHBondContact O-CG1 3.4Å; V264-I268 PolarHBondContact O-N 3.44Å; A265-I268 PolarHBondContact O-N 3.02Å; I268-Q270 PolarHBondContact O-N 3.09Å; I268-R271 PolarHBondContact O-N 3.15Å; I268-H272 PolarHBondContact O-CD2 3.11Å; I268-H272 VanDerWaalsContact O-CD2 3.27Å; I268-H272 PolarHBondContact O-N 2.83Å; I268-H272 VanDerWaalsContact O-N 3.08Å
269	D	45.3	Very low	40	Very low	130 Å²	130	115 Å²	115	70%	0.695	64%	0.635	S	S	*	*	H	α-helix	trans	-64.9	-39.1	177.2	-159.7	32.4	0	0	0	111.9	A265 R271 H272	A265-D269 PolarHBondContact O-N 3.27Å; D269-R271 PolarHBondContact O-N 3.35Å; D269-H272 PolarHBondContact O-N 2.83Å
270	Q	44.6	Very low	38.7	Very low	153 Å²	153	114.5 Å²	114.5	72%	0.715	64%	0.641	S	S	*	*	H	α-helix	trans	-68	-29.8	173.2	-79.4	-167.7	-25.1	0	0	114	S266 I268	S266-Q270 PolarHBondContact O-N 2.81Å; S266-Q270 VanDerWaalsContact O-N 3.12Å; I268-Q270 PolarHBondContact O-N 3.09Å
271	R	38	Very low	37.6	Very low	204 Å²	204	118.9 Å²	118.9	77%	0.77	66%	0.658	S	S	*	*	H	α-helix	trans	-81.2	-22.4	178.3	-80.1	-172.4	-176.6	-175.9	2.4	113.7	L267 I268 D269 A273 Q274	L267-R271 PolarHBondContact O-N 2.64Å; L267-R271 VanDerWaalsContact O-N 3.16Å; I268-R271 PolarHBondContact O-N 3.15Å; D269-R271 PolarHBondContact O-N 3.35Å; R271-A273 PolarHBondContact O-N 2.89Å; R271-Q274 PolarHBondContact O-N 3.46Å; R271-Q274 VanDerWaalsContact O-N 3.1Å
272	H	35.8	Very low	36.5	Very low	156 Å²	156	118.3 Å²	118.3	72%	0.722	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-9.4	174.4	-83.5	-65.3	0	0	0	114.1	I268 D269 Q274	I268-H272 PolarHBondContact O-CD2 3.11Å; I268-H272 VanDerWaalsContact O-CD2 3.27Å; I268-H272 PolarHBondContact O-N 2.83Å; I268-H272 VanDerWaalsContact O-N 3.08Å; D269-H272 PolarHBondContact O-N 2.83Å; H272-Q274 VanDerWaalsContact C-N 3.31Å
273	A	37.6	Very low	35.4	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-9.6	168.9	0	0	0	0	0	114	R271	R271-A273 PolarHBondContact O-N 2.89Å
274	Q	30.2	Very low	34.4	Very low	157 Å²	157	126.7 Å²	126.7	73%	0.734	70%	0.703	S	S	*	*	S	Bend	trans	-135.1	111.5	178	-72.4	-173.2	-17.1	0	0	112.1	R271 H272	R271-Q274 PolarHBondContact O-N 3.46Å; R271-Q274 VanDerWaalsContact O-N 3.1Å; H272-Q274 VanDerWaalsContact C-N 3.31Å
275	S	28	Very low	33.4	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	72%	0.724	S	S	*	*			trans	67.1	100.6	158.7	31.4	0	0	0	0	116.9	V277	S275-V277 PolarHBondContact O-N 3.26Å
276	S	25.7	Very low	32.5	Very low	124 Å²	124	136.9 Å²	136.9	87%	0.867	74%	0.743	S	S	*	*			trans	-43.4	99.9	155.6	49.8	0	0	0	0	113.3
277	V	27.5	Very low	31.5	Very low	127 Å²	127	143 Å²	143	77%	0.77	76%	0.764	S	S	*	*			trans	-141.5	119.9	156.6	-177.3	0	0	0	0	108.5	S275 L279	S275-V277 PolarHBondContact O-N 3.26Å; V277-L279 PolarHBondContact O-N 2.83Å
278	L	23.9	Very low	30.9	Very low	161 Å²	161	143.3 Å²	143.3	84%	0.843	78%	0.78	S	S	*	*			trans	-45.8	128	173.6	-90.6	81.8	0	0	0	112.1
279	L	25.5	Very low	29.9	Very low	172 Å²	172	150.4 Å²	150.4	90%	0.901	80%	0.801	S	S	*	*			trans	-133.5	113.3	154.6	-99	158.7	0	0	0	109	V277	V277-L279 PolarHBondContact O-N 2.83Å
280	C	24.8	Very low	28.9	Very low	113 Å²	113	155.5 Å²	155.5	76%	0.764	81%	0.811	S	S	*	*			trans	-54.8	132.2	178.3	-82.6	0	0	0	0	112.1	S282	C280-S282 PolarHBondContact O-N 3.42Å
281	K	25.8	Very low	27.9	Very low	214 Å²	214	152.8 Å²	152.8	93%	0.93	81%	0.814	S	S	*	*			trans	-56.1	110.5	156	-92.1	172.6	168	170.7	0	108.9
282	S	26.9	Very low	27.3	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	82%	0.82	S	S	*	*			trans	-121	104.1	161	60.2	0	0	0	0	109.3	C280	C280-S282 PolarHBondContact O-N 3.42Å
283	D	27.4	Very low	26.8	Very low	154 Å²	154	149.1 Å²	149.1	82%	0.824	82%	0.823	S	S	*	*			trans	42.1	90.3	141.2	-60.4	-29.7	0	0	0	118.9
284	V	26.9	Very low	26.1	Very low	142 Å²	142	153.2 Å²	153.2	86%	0.861	83%	0.831	S	S	*	*			trans	-115.9	-3.9	158.1	177.9	0	0	0	0	112.2	K286	V284-K286 PolarHBondContact O-N 3.01Å
285	T	28.5	Very low	25.8	Very low	127 Å²	127	150.6 Å²	150.6	78%	0.779	83%	0.828	S	S	*	*	S	Bend	trans	-102.7	72	-177.4	55.8	0	0	0	0	111.9
286	K	29.2	Very low	25.7	Very low	198 Å²	198	155 Å²	155	86%	0.861	84%	0.837	S	S	*	*	S	Bend	trans	-162.5	-7.6	159.5	-112.4	161.7	-168.7	178.7	0	118.1	V284	V284-K286 PolarHBondContact O-N 3.01Å
287	E	25.6	Very low	25.6	Very low	196 Å²	196	156 Å²	156	92%	0.916	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-5.9	-175.6	-77	-179.2	154.7	0	0	116.2
288	A	27.6	Very low	25.3	Very low	104 Å²	104	159.6 Å²	159.6	86%	0.86	84%	0.837	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	6.3	-177.4	0	0	0	0	0	116.1
289	R	23.9	Very low	25.2	Very low	238 Å²	238	160.1 Å²	160.1	90%	0.898	83%	0.832	S	S	*	*			trans	-136.3	70.1	179.6	-89.7	-168.5	-91.3	-142.1	-4.7	112.8
290	R	23	Very low	25	Very low	238 Å²	238	160 Å²	160	90%	0.898	83%	0.833	S	S	*	*			trans	-141.5	117.3	160	-74.7	-167.5	178.3	167.1	-0.4	112.7
291	A	24.9	Very low	24.9	Very low	95 Å²	95	160.7 Å²	160.7	79%	0.785	83%	0.828	S	S	*	*			trans	70.2	97.5	146	0	0	0	0	0	119.1
292	I	25.5	Very low	24.8	Very low	174 Å²	174	159.6 Å²	159.6	89%	0.892	83%	0.825	S	S	*	*			trans	-130.6	98.6	143.7	-57.7	177.1	0	0	0	106.3
293	S	23.8	Very low	25	Very low	110 Å²	110	160.6 Å²	160.6	77%	0.769	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.4	128.2	173.5	49.4	0	0	0	0	109.8
294	L	22.7	Very low	25	Very low	171 Å²	171	158.9 Å²	158.9	90%	0.895	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-68	132.4	-179.5	-72.8	131.7	0	0	0	112
295	P	25.5	Very low	25.3	Very low	102 Å²	102	157.7 Å²	157.7	66%	0.662	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-94	129.5	156.4	24.3	-10.1	0	0	0	110.1	I297	P295-I297 PolarHBondContact O-N 2.72Å
296	E	25.2	Very low	25	Very low	199 Å²	199	161.7 Å²	161.7	93%	0.93	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-64.6	120.1	172.1	-66.2	177.8	164.3	0	0	110
297	I	24	Very low	24.7	Very low	145 Å²	145	158.1 Å²	158.1	74%	0.744	83%	0.832	S	S	*	*			trans	-136.5	124.6	174.1	-56.9	179.6	0	0	0	109.8	P295	P295-I297 PolarHBondContact O-N 2.72Å
298	F	21.3	Very low	24.5	Very low	203 Å²	203	156.3 Å²	156.3	89%	0.89	83%	0.828	S	S	*	*			trans	-63.9	143.8	-176.2	-125.5	-107.1	0	0	0	113.1
299	F	21.7	Very low	24.2	Very low	171 Å²	171	157.1 Å²	157.1	75%	0.75	83%	0.827	S	S	*	*			trans	-80.5	133.6	178.4	-78.1	-96.1	0	0	0	111.3	I301	F299-I301 HydrophobicContact CD1-CD1 4.39Å
300	D	21.4	Very low	24.1	Very low	171 Å²	171	153.2 Å²	153.2	91%	0.914	82%	0.823	S	S	*	*			trans	-137	122.8	151.3	-95.9	-35.7	0	0	0	110.1
301	I	22.7	Very low	24	Very low	127 Å²	127	148.4 Å²	148.4	65%	0.651	83%	0.825	S	S	*	*			trans	-111.6	125	-171.8	-66.1	166.6	0	0	0	107.3	F299	F299-I301 HydrophobicContact CD1-CD1 4.39Å
302	H	23.1	Very low	24.1	Very low	190 Å²	190	147.1 Å²	147.1	88%	0.88	82%	0.821	S	S	*	*			trans	-146.5	122.1	155.7	-104.5	-78	0	0	0	110.6
303	P	30.8	Very low	24.3	Very low	117 Å²	117	144.6 Å²	144.6	76%	0.76	82%	0.815	S	S	*	*			trans	-93.3	140.3	179.6	35.2	-29.4	0	0	0	110.8
304	S	27.2	Very low	24.8	Very low	118 Å²	118	145.2 Å²	145.2	83%	0.825	82%	0.817	S	S	*	*			trans	-126.3	146.5	171.2	60.8	0	0	0	0	111.9
305	P	32.9	Very low	25	Very low	117 Å²	117	147.2 Å²	147.2	76%	0.76	82%	0.819	S	S	*	*			trans	-102.1	142	-162.7	29.1	-14.1	0	0	0	114
306	F	23.2	Very low	24.8	Very low	211 Å²	211	148.9 Å²	148.9	93%	0.925	82%	0.822	S	S	*	*			trans	12	117.6	151.2	-76.2	-92.7	0	0	0	119.3
307	S	22.8	Very low	24.7	Very low	123 Å²	123	147 Å²	147	86%	0.86	81%	0.813	S	S	*	*			trans	-125.2	125.2	154.9	58.7	0	0	0	0	110.7
308	L	20.5	Very low	24.8	Very low	159 Å²	159	148.8 Å²	148.8	83%	0.832	82%	0.823	S	S	*	*			trans	-91.2	114.2	176.1	-96.8	147	0	0	0	108.4
309	S	22.9	Very low	25	Very low	121 Å²	121	146.3 Å²	146.3	85%	0.846	82%	0.819	S	S	*	*			trans	-98.1	122	173.4	172.7	0	0	0	0	110.2
310	L	20.5	Very low	25.2	Very low	156 Å²	156	141.7 Å²	141.7	82%	0.817	82%	0.82	S	S	*	*			trans	-97.5	135	176.2	-84.9	155.3	0	0	0	110.2
311	C	21	Very low	25.4	Very low	137 Å²	137	143.1 Å²	143.1	93%	0.926	82%	0.821	S	S	*	*			trans	63.6	120.1	144.2	-126.9	0	0	0	0	121.1
312	G	27.6	Very low	25.5	Very low	68 Å²	68	148.7 Å²	148.7	70%	0.701	83%	0.834	S	S	*	*			trans	-163.9	135.2	158.5	0	0	0	0	0	111.6
313	P	28.5	Very low	25.6	Very low	120 Å²	120	149.4 Å²	149.4	78%	0.779	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-88.4	173.7	-165.4	38.2	-36.7	0	0	0	114.5
314	P	35.3	Very low	25.4	Very low	124 Å²	124	151.1 Å²	151.1	81%	0.805	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-90.9	139.2	-148.5	35.9	-32.2	0	0	0	113.9
315	F	26.3	Very low	25.6	Very low	213 Å²	213	151 Å²	151	93%	0.934	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-87.9	126.8	174.5	-90.5	-90.8	0	0	0	111.6
316	D	22.7	Very low	25.6	Very low	137 Å²	137	151.3 Å²	151.3	73%	0.733	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.3	146.9	176.1	-84.7	-41.3	0	0	0	113.8
317	H	23	Very low	25.8	Very low	159 Å²	159	148.4 Å²	148.4	74%	0.736	83%	0.825	S	S	*	*			trans	37.5	103	144.9	-73.6	-82.3	0	0	0	119.9
318	L	25.8	Very low	26	Very low	182 Å²	182	146.8 Å²	146.8	95%	0.953	83%	0.827	S	S	*	*			trans	-118	103.6	152.3	-91	157.3	0	0	0	108.9
319	D	24.7	Very low	26.2	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	83%	0.827	S	S	*	*			trans	-69.2	152.6	176.9	-95.8	-41.9	0	0	0	112.8
320	G	25.8	Very low	26.3	Very low	75 Å²	75	148.3 Å²	148.3	77%	0.773	83%	0.826	S	S	*	*			trans	-70.5	136.8	-166.2	0	0	0	0	0	115.4
321	Q	26	Very low	26.4	Very low	201 Å²	201	152 Å²	152	94%	0.939	83%	0.829	S	S	*	*			trans	-100.3	110.8	156	-75.5	-169	-3.2	0	0	109.8
322	R	23.9	Very low	26.7	Very low	243 Å²	243	152.8 Å²	152.8	92%	0.917	82%	0.824	S	S	*	*			trans	-75.1	129.8	-178.2	-161.3	174.8	-173.4	172.2	0.4	109.1
323	W	25.3	Very low	26.5	Very low	205 Å²	205	155.1 Å²	155.1	78%	0.777	82%	0.824	S	S	*	*			trans	-91.8	111.8	-172.8	-143.6	5	0	0	0	109.8
324	D	27.2	Very low	26.3	Very low	153 Å²	153	155.3 Å²	155.3	82%	0.818	83%	0.826	S	S	*	*			trans	-82.9	115.4	176.6	-91.7	-24.1	0	0	0	111.3	V326	D324-V326 PolarHBondContact O-N 2.82Å
325	S	31.7	Very low	25.8	Very low	115 Å²	115	157.9 Å²	157.9	80%	0.804	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	68.7	-173.7	67.8	0	0	0	0	112
326	V	32	Very low	25.7	Very low	124 Å²	124	153.2 Å²	153.2	75%	0.752	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	-26.2	170.7	-176.1	0	0	0	0	115.6	D324	D324-V326 PolarHBondContact O-N 2.82Å
327	N	28	Very low	25.7	Very low	151 Å²	151	154 Å²	154	81%	0.807	83%	0.825	S	S	*	*			trans	-141.3	98	179.8	-83.3	-41.2	0	0	0	112.8	K329	N327-K329 VanDerWaalsContact C-N 3.32Å; N327-K329 PolarHBondContact O-N 3.5Å
328	G	26.5	Very low	25.8	Very low	88 Å²	88	151.3 Å²	151.3	91%	0.907	83%	0.829	S	S	*	*			trans	-70.1	76.5	177.8	0	0	0	0	0	113.6
329	K	25	Very low	25.7	Very low	191 Å²	191	148.6 Å²	148.6	83%	0.83	82%	0.82	S	S	*	*			trans	-130.1	108.7	163.4	-73.9	-173.9	176.9	-179.8	0	109.3	N327 R331	N327-K329 VanDerWaalsContact C-N 3.32Å; N327-K329 PolarHBondContact O-N 3.5Å; K329-R331 PolarHBondContact O-N 2.83Å
330	C	25.1	Very low	25.7	Very low	122 Å²	122	146.8 Å²	146.8	82%	0.824	82%	0.819	S	S	*	*			trans	-59.8	114.4	162.8	-82.6	0	0	0	0	107.7	D332	C330-D332 PolarHBondContact O-N 3.36Å
331	R	24	Very low	25.6	Very low	232 Å²	232	149.7 Å²	149.7	88%	0.875	82%	0.817	S	S	*	*			trans	-79.1	101.1	164	-102.1	179.4	170.8	164	-3.3	106.9	K329 T333	K329-R331 PolarHBondContact O-N 2.83Å; R331-T333 PolarHBondContact O-N 3.1Å
332	D	25.4	Very low	25.4	Very low	154 Å²	154	144.5 Å²	144.5	82%	0.824	80%	0.803	S	S	*	*			trans	-65.1	107.1	160.6	-64	-41	0	0	0	107.7	C330	C330-D332 PolarHBondContact O-N 3.36Å
333	T	23.9	Very low	25.3	Very low	117 Å²	117	138.9 Å²	138.9	72%	0.718	80%	0.796	S	S	*	*			trans	-123.7	115.7	160.2	38.5	0	0	0	0	107.5	R331	R331-T333 PolarHBondContact O-N 3.1Å
334	P	25.6	Very low	25.3	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.1	134.8	-170.6	17.1	-11.3	0	0	0	111.3
335	M	23.5	Very low	25.1	Very low	178 Å²	178	136 Å²	136	88%	0.877	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.8	136.3	171.4	-82.5	-119.6	-89.4	0	0	110.7
336	P	24.3	Very low	24.6	Very low	115 Å²	115	139 Å²	139	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.6	124.7	-178.7	31	-31.5	0	0	0	111.6	A338	P336-A338 PolarHBondContact O-N 3.4Å
337	N	23.7	Very low	24.2	Very low	155 Å²	155	139 Å²	139	83%	0.829	80%	0.801	S	S	*	*			trans	15.2	91.4	144.2	-58.7	-10.1	0	0	0	116.5
338	A	24.8	Very low	23.8	Very low	101 Å²	101	137.3 Å²	137.3	84%	0.835	80%	0.796	S	S	*	*			trans	-98.7	98.7	153.2	0	0	0	0	0	107.5	P336	P336-A338 PolarHBondContact O-N 3.4Å
339	V	23.8	Very low	23.6	Very low	125 Å²	125	141.5 Å²	141.5	76%	0.758	79%	0.792	S	S	*	*			trans	-69.3	125.2	170.8	174.4	0	0	0	0	107.9
340	S	24.3	Very low	23.4	Very low	113 Å²	113	141 Å²	141	79%	0.79	79%	0.79	S	S	*	*			trans	-142.9	102.4	160	60.9	0	0	0	0	108.6	S342	S340-S342 PolarHBondContact O-N 3.48Å
341	D	23.3	Very low	23.2	Very low	137 Å²	137	141.6 Å²	141.6	73%	0.733	79%	0.789	S	S	*	*			trans	-38.7	124.1	160.1	-67.3	-39.9	0	0	0	109.8
342	S	22.1	Very low	23.3	Very low	91 Å²	91	136.8 Å²	136.8	64%	0.636	79%	0.785	S	S	*	*				58.7	98	68	82.5	0	0	0	0	113.4	S340	S340-S342 PolarHBondContact O-N 3.48Å
343	T	22.9	Very low	23.1	Very low	126 Å²	126	132.5 Å²	132.5	77%	0.773	78%	0.778	S	S	*	*			trans	151.5	140.9	153.7	45.4	0	0	0	0	106.6
344	D	23.6	Very low	23	Very low	127 Å²	127	134.7 Å²	134.7	68%	0.679	79%	0.785	S	S	*	*			cis	-159.2	105.5	-5.5	-90.9	-36.1	0	0	0	103.9
345	D	23.4	Very low	23	Very low	169 Å²	169	137.8 Å²	137.8	90%	0.904	79%	0.789	S	S	*	*			trans	-104.3	104.7	171.5	-93.9	-23.1	0	0	0	109.6	C347	D345-C347 PolarHBondContact O-N 3.42Å
346	H	22.6	Very low	23	Very low	178 Å²	178	138.2 Å²	138.2	82%	0.824	79%	0.789	S	S	*	*			trans	-61.2	94.8	173.7	-78.5	-77.4	0	0	0	111.6	V348	H346-V348 PolarHBondContact O-N 2.95Å
347	C	22	Very low	22.8	Very low	125 Å²	125	142.3 Å²	142.3	85%	0.845	80%	0.798	S	S	*	*			trans	-78.4	105.9	161.5	-79.4	0	0	0	0	109.8	D345 E349	D345-C347 PolarHBondContact O-N 3.42Å; C347-E349 PolarHBondContact O-N 3.4Å
348	V	20.8	Very low	22.9	Very low	115 Å²	115	140.2 Å²	140.2	70%	0.697	80%	0.795	S	S	*	*			trans	-81	103.7	168	178.1	0	0	0	0	108	H346 F350	H346-V348 PolarHBondContact O-N 2.95Å; V348-F350 HydrophobicContact CG1-CE2 4.21Å
349	E	21.1	Very low	22.8	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.822	80%	0.795	S	S	*	*			trans	-93.1	116.6	179.4	-156.8	170.7	-155.9	0	0	109.3	C347 V351	C347-E349 PolarHBondContact O-N 3.4Å; E349-V351 PolarHBondContact O-N 2.98Å
350	F	20.7	Very low	22.7	Very low	182 Å²	182	146.1 Å²	146.1	80%	0.798	80%	0.803	S	S	*	*			trans	-79	100.5	177.8	-78	-90.9	0	0	0	109.7	V348 V352	V348-F350 HydrophobicContact CG1-CE2 4.21Å; F350-V352 PolarHBondContact O-N 3.32Å
351	V	22.3	Very low	22.7	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	81%	0.807	S	S	*	*			trans	-72.8	106.2	172.2	179.1	0	0	0	0	108.8	E349 G353	E349-V351 PolarHBondContact O-N 2.98Å; V351-G353 PolarHBondContact O-N 3.33Å
352	V	25.2	Very low	22.7	Very low	131 Å²	131	148.9 Å²	148.9	79%	0.794	81%	0.814	S	S	*	*			trans	-71.7	114.8	169.3	177.1	0	0	0	0	107.7	F350 N354	F350-V352 PolarHBondContact O-N 3.32Å; V352-N354 PolarHBondContact O-N 2.87Å
353	G	22.5	Very low	22.9	Very low	65 Å²	65	149.6 Å²	149.6	67%	0.67	82%	0.819	S	S	*	*			trans	-63.6	127.2	-177.2	0	0	0	0	0	112.5	V351	V351-G353 PolarHBondContact O-N 3.33Å
354	N	20.9	Very low	23.5	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	82%	0.821	S	S	*	*			trans	-75.3	113.4	162.7	-76	-29.1	0	0	0	108.4	V352	V352-N354 PolarHBondContact O-N 2.87Å
355	E	24.5	Very low	23.5	Very low	189 Å²	189	146.8 Å²	146.8	88%	0.883	82%	0.822	S	S	*	*			trans	-119.3	97.6	161.2	-79	-173.9	168.2	0	0	109.4
356	E	23.9	Very low	23.5	Very low	188 Å²	188	146.9 Å²	146.9	88%	0.879	82%	0.823	S	S	*	*			trans	45.1	121.6	135.6	-64.1	-174.2	161	0	0	121.3
357	E	21.2	Very low	23.5	Very low	200 Å²	200	141.7 Å²	141.7	94%	0.935	82%	0.817	S	S	*	*			trans	-46.9	131.5	162.7	-63.2	172.3	133.7	0	0	113.5
358	S	24.4	Very low	23.6	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	82%	0.822	S	S	*	*			trans	-149.8	95.8	152.9	-171.8	0	0	0	0	111.9
359	Q	22.8	Very low	23.8	Very low	179 Å²	179	147.9 Å²	147.9	84%	0.836	83%	0.826	S	S	*	*			trans	40.2	109.8	135.7	-61.1	-176.5	-1.1	0	0	120.5
360	N	21.9	Very low	23.8	Very low	172 Å²	172	143.8 Å²	143.8	92%	0.92	82%	0.823	S	S	*	*				27.8	107.8	125.1	-86.7	-22.1	0	0	0	118.6
361	A	25.6	Very low	24	Very low	105 Å²	105	143.4 Å²	143.4	87%	0.868	82%	0.823	S	S	*	*			trans	-152.1	121	145.3	0	0	0	0	0	112.7
362	K	22.9	Very low	24.1	Very low	202 Å²	202	142.9 Å²	142.9	88%	0.878	82%	0.823	S	S	*	*			trans	-34.6	143.7	171.9	-66.2	163.7	175.1	175.1	0	117.6
363	S	25.6	Very low	24.1	Very low	106 Å²	106	142 Å²	142	74%	0.741	82%	0.822	S	S	*	*			trans	-32.9	156.2	144.3	56.6	0	0	0	0	114.3
364	P	36.3	Very low	24.1	Very low	127 Å²	127	145 Å²	145	83%	0.825	83%	0.828	S	S	*	*			cis	-153	163.6	44.5	39.7	-18.2	0	0	0	118.9
365	G	22.7	Very low	24.3	Very low	68 Å²	68	143.1 Å²	143.1	70%	0.701	83%	0.827	S	S	*	*				100.2	138.2	122.9	0	0	0	0	0	120.2
366	N	24.1	Very low	24.3	Very low	171 Å²	171	141.6 Å²	141.6	91%	0.914	82%	0.823	S	S	*	*			trans	79.5	111.7	167.7	-61.7	-7.7	0	0	0	115.4
367	G	22.3	Very low	24.4	Very low	69 Å²	69	136.8 Å²	136.8	71%	0.711	82%	0.816	S	S	*	*			cis	119.7	94.1	31.4	0	0	0	0	0	106.5
368	Y	24.2	Very low	24.6	Very low	238 Å²	238	136 Å²	136	93%	0.933	81%	0.812	S	S	*	*			trans	-131.3	136.7	170.6	-100	-86.4	0	0	0	110.6
369	V	24.5	Very low	24.6	Very low	131 Å²	131	137.5 Å²	137.5	79%	0.794	81%	0.812	S	S	*	*			trans	-79.6	138	-156.3	170.2	0	0	0	0	111.9
370	A	22.4	Very low	24.7	Very low	91 Å²	91	136.5 Å²	136.5	75%	0.752	81%	0.812	S	S	*	*			trans	-74.8	139.7	176.8	0	0	0	0	0	112.5
371	H	24	Very low	24.8	Very low	173 Å²	173	134.4 Å²	134.4	80%	0.801	81%	0.805	S	S	*	*			trans	-115.6	148	156	-86.8	-73.7	0	0	0	109.2	S373	H371-S373 PolarHBondContact O-N 3.19Å
372	P	25.2	Very low	24.6	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	81%	0.805	S	S	*	*			trans	-84.2	117	-150.9	31.8	-32.7	0	0	0	112.1
373	S	24.2	Very low	24.7	Very low	111 Å²	111	135 Å²	135	78%	0.776	80%	0.799	S	S	*	*			trans	-80.3	125.1	165.7	49.2	0	0	0	0	110	H371 S375	H371-S373 PolarHBondContact O-N 3.19Å; S373-S375 PolarHBondContact O-N 3.41Å
374	T	23.6	Very low	24.6	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	80%	0.799	S	S	*	*			trans	-38.4	124.3	170	41.7	0	0	0	0	113.5	I376	T374-I376 PolarHBondContact O-N 3.33Å; T374-I376 VanDerWaalsContact O-N 3.14Å
375	S	24.1	Very low	24.1	Very low	123 Å²	123	135 Å²	135	86%	0.86	79%	0.793	S	S	*	*			trans	-51.9	106.7	173.4	52.8	0	0	0	0	112.1	S373	S373-S375 PolarHBondContact O-N 3.41Å
376	I	24.6	Very low	24.1	Very low	156 Å²	156	139.1 Å²	139.1	80%	0.8	80%	0.8	S	S	*	*			trans	-84.6	121.2	158.1	-64.8	172.5	0	0	0	105.3	T374 E378	T374-I376 PolarHBondContact O-N 3.33Å; T374-I376 VanDerWaalsContact O-N 3.14Å; I376-E378 PolarHBondContact O-N 3.04Å; I376-E378 VanDerWaalsContact O-N 3.16Å
377	A	25.4	Very low	24.2	Very low	88 Å²	88	140 Å²	140	73%	0.727	80%	0.798	S	S	*	*			trans	-64.2	110	-179.6	0	0	0	0	0	110	D379	A377-D379 PolarHBondContact O-N 2.99Å
378	E	25.8	Very low	24.3	Very low	183 Å²	183	147.6 Å²	147.6	86%	0.855	81%	0.805	S	S	*	*			trans	-83.7	93.3	165.2	-73.8	-178.3	152.2	0	0	108.4	I376	I376-E378 PolarHBondContact O-N 3.04Å; I376-E378 VanDerWaalsContact O-N 3.16Å
379	D	25.1	Very low	24.3	Very low	142 Å²	142	144 Å²	144	76%	0.759	80%	0.803	S	S	*	*			trans	-130.5	104.1	161.6	-78.6	-41.3	0	0	0	106.6	A377	A377-D379 PolarHBondContact O-N 2.99Å
380	D	24.5	Very low	24.3	Very low	158 Å²	158	149.7 Å²	149.7	85%	0.845	81%	0.81	S	S	*	*			trans	150.9	49.4	157.6	-76.4	-19.4	0	0	0	111.5
381	V	24.2	Very low	24.5	Very low	128 Å²	128	155 Å²	155	78%	0.776	82%	0.816	S	S	*	*			trans	-100.2	90.1	163.6	-176.6	0	0	0	0	108.4	V383	V381-V383 PolarHBondContact O-N 3.01Å; V381-V383 VanDerWaalsContact O-N 3.09Å
382	F	21.9	Very low	24.5	Very low	195 Å²	195	151.2 Å²	151.2	86%	0.855	81%	0.814	S	S	*	*			trans	-69	99.9	175.7	-134.3	-95.2	0	0	0	109.6	V384	F382-V384 PolarHBondContact O-N 2.93Å; F382-V384 VanDerWaalsContact O-N 3.17Å
383	V	23.5	Very low	24.5	Very low	125 Å²	125	156.7 Å²	156.7	76%	0.758	82%	0.819	S	S	*	*			trans	-72.3	104.5	176.7	179.2	0	0	0	0	109.4	V381	V381-V383 PolarHBondContact O-N 3.01Å; V381-V383 VanDerWaalsContact O-N 3.09Å
384	V	25	Very low	24.5	Very low	122 Å²	122	162.2 Å²	162.2	74%	0.739	82%	0.823	S	S	*	*			trans	-73.6	129.1	175.9	179.1	0	0	0	0	109.6	F382 D386	F382-V384 PolarHBondContact O-N 2.93Å; F382-V384 VanDerWaalsContact O-N 3.17Å; V384-D386 PolarHBondContact O-N 3.4Å
385	P	24.2	Very low	24.5	Very low	110 Å²	110	162.8 Å²	162.8	71%	0.714	82%	0.821	S	S	*	*			trans	-74.5	128.5	-173.8	-10.8	26.2	0	0	0	112.7	Q387	P385-Q387 PolarHBondContact O-N 3.08Å; P385-Q387 VanDerWaalsContact O-N 3.09Å
386	D	23.1	Very low	24.6	Very low	156 Å²	156	165.4 Å²	165.4	83%	0.834	82%	0.819	S	S	*	*			trans	-66	95.4	178.1	-174.6	21.6	0	0	0	112.1	V384 R388	V384-D386 PolarHBondContact O-N 3.4Å; D386-R388 PolarHBondContact O-N 3.32Å
387	Q	26.5	Very low	24.5	Very low	188 Å²	188	169.8 Å²	169.8	88%	0.879	83%	0.826	S	S	*	*			trans	-94.3	86.6	171.2	-74.5	-133.7	-19.6	0	0	111.7	P385 N389	P385-Q387 PolarHBondContact O-N 3.08Å; P385-Q387 VanDerWaalsContact O-N 3.09Å; Q387-N389 PolarHBondContact O-N 2.64Å
388	R	24	Very low	24.4	Very low	229 Å²	229	175.7 Å²	175.7	86%	0.864	83%	0.831	S	S	*	*			trans	-0.2	107.2	151.5	-101.3	175.2	171.1	176.2	-1.6	117.3	D386 R390	D386-R388 PolarHBondContact O-N 3.32Å; R388-R390 PolarHBondContact O-N 3.23Å
389	N	23.7	Very low	24.3	Very low	164 Å²	164	175.6 Å²	175.6	88%	0.877	83%	0.83	S	S	*	*			trans	-21.6	116.7	149	-82.8	-40.9	0	0	0	116.2	Q387	Q387-N389 PolarHBondContact O-N 2.64Å
390	R	26.2	Very low	24.3	Very low	249 Å²	249	173.2 Å²	173.2	94%	0.94	83%	0.83	S	S	*	*			trans	-128.2	101.9	152.8	-91.6	-173.5	172.4	175.5	-1.4	111.9	R388	R388-R390 PolarHBondContact O-N 3.23Å
391	K	25.6	Very low	24.3	Very low	204 Å²	204	172 Å²	172	89%	0.887	82%	0.824	S	S	*	*			trans	-7.8	125.3	153.5	-70.7	174.3	174.1	177.1	0	118.1
392	A	24.7	Very low	24.3	Very low	92 Å²	92	172.9 Å²	172.9	76%	0.76	83%	0.829	S	S	*	*				63.8	120.1	120.5	0	0	0	0	0	121
393	R	25	Very low	24.3	Very low	239 Å²	239	173.1 Å²	173.1	90%	0.902	83%	0.826	S	S	*	*				176.7	110	125.7	-99.4	170.9	171.7	-163	-2.3	109.3
394	R	23.6	Very low	24.3	Very low	227 Å²	227	170.8 Å²	170.8	86%	0.857	83%	0.827	S	S	*	*				73.1	112.1	99.2	-96.1	-171.1	-173.9	179.9	2.7	115.4
395	N	24	Very low	24.3	Very low	141 Å²	141	175.9 Å²	175.9	75%	0.754	84%	0.835	S	S	*	*			trans	54.3	107.7	142.3	-64.5	-2.5	0	0	0	119.5
396	H	26.2	Very low	24.5	Very low	178 Å²	178	175.3 Å²	175.3	82%	0.824	84%	0.839	S	S	*	*			trans	-139.2	113.9	135.8	-101.5	-71.5	0	0	0	110	Y398	H396-Y398 PolarHBondContact O-N 2.9Å
397	R	21.5	Very low	24.7	Very low	247 Å²	247	178.8 Å²	178.8	93%	0.932	84%	0.841	S	S	*	*			trans	-60	122.5	157.3	-83.1	177.3	178.8	169.6	-1.5	106.8
398	Y	24.6	Very low	24.9	Very low	213 Å²	213	173.6 Å²	173.6	84%	0.835	83%	0.825	S	S	*	*			trans	-123.6	122.3	161	-115.7	-93.7	0	0	0	108.1	H396	H396-Y398 PolarHBondContact O-N 2.9Å
399	Q	22.3	Very low	25.3	Very low	181 Å²	181	171.5 Å²	171.5	85%	0.846	83%	0.825	S	S	*	*			trans	-57.2	131.1	173.9	-87.2	157.4	-70.3	0	0	109.3	D401	Q399-D401 PolarHBondContact O-N 3.22Å
400	A	26.7	Very low	25.6	Very low	92 Å²	92	173.7 Å²	173.7	76%	0.76	82%	0.821	S	S	*	*			trans	-69.4	111.3	172.4	0	0	0	0	0	108.8	T402	A400-T402 PolarHBondContact O-N 3.31Å; A400-T402 VanDerWaalsContact O-N 3.14Å
401	D	24	Very low	25.5	Very low	133 Å²	133	171 Å²	171	71%	0.711	81%	0.811	S	S	*	*			trans	-56.4	117.1	168.2	-80.4	-32.1	0	0	0	109.2	Q399 Y403	Q399-D401 PolarHBondContact O-N 3.22Å; D401-Y403 VanDerWaalsContact C-N 3.3Å; D401-Y403 HydrophobicContact CB-CD2 4.25Å; D401-Y403 HydrophobicContact CB-CE2 4.17Å; D401-Y403 PolarHBondContact O-N 3.43Å
402	T	23.3	Very low	25.6	Very low	145 Å²	145	168.6 Å²	168.6	89%	0.89	80%	0.797	S	S	*	*			trans	-75.6	80.6	-179.3	17.5	0	0	0	0	108.6	A400 G404	A400-T402 PolarHBondContact O-N 3.31Å; A400-T402 VanDerWaalsContact O-N 3.14Å; T402-G404 PolarHBondContact O-N 3.4Å
403	Y	22.8	Very low	25.9	Very low	201 Å²	201	172.6 Å²	172.6	79%	0.788	80%	0.8	S	S	*	*			trans	-68.3	115.4	168.2	-86.6	-88.5	0	0	0	109.7	D401 Y405	D401-Y403 VanDerWaalsContact C-N 3.3Å; D401-Y403 HydrophobicContact CB-CD2 4.25Å; D401-Y403 HydrophobicContact CB-CE2 4.17Å; D401-Y403 PolarHBondContact O-N 3.43Å; Y403-Y405 PolarHBondContact O-N 2.89Å; Y403-Y405 VanDerWaalsContact O-N 3.16Å
404	G	24	Very low	26.2	Very low	75 Å²	75	166.2 Å²	166.2	77%	0.773	78%	0.782	S	S	*	*			trans	-57.7	111.3	-178.9	0	0	0	0	0	112.5	T402 A406	T402-G404 PolarHBondContact O-N 3.4Å; G404-A406 PolarHBondContact O-N 3.33Å; G404-A406 VanDerWaalsContact O-N 3.09Å
405	Y	24.9	Very low	26.5	Very low	229 Å²	229	159.1 Å²	159.1	90%	0.898	77%	0.773	S	S	*	*			trans	-70.3	98.7	171	-99.7	-100.3	0	0	0	110.1	Y403 R407	Y403-Y405 PolarHBondContact O-N 2.89Å; Y403-Y405 VanDerWaalsContact O-N 3.16Å; Y405-R407 PolarHBondContact O-N 3.38Å
406	A	26.8	Very low	26.6	Very low	99 Å²	99	159.6 Å²	159.6	82%	0.818	78%	0.775	S	S	*	*			trans	-65.2	111.9	169.2	0	0	0	0	0	110	G404 S408	G404-A406 PolarHBondContact O-N 3.33Å; G404-A406 VanDerWaalsContact O-N 3.09Å; A406-S408 PolarHBondContact O-N 2.88Å
407	R	28.3	Very low	26.8	Very low	229 Å²	229	158.7 Å²	158.7	86%	0.864	77%	0.769	S	S	*	*			trans	-77.1	94.8	-168.1	-154.5	-178.3	-154.1	-178	6.8	110.8	Y405	Y405-R407 PolarHBondContact O-N 3.38Å
408	S	30.8	Very low	27.1	Very low	78 Å²	78	152.7 Å²	152.7	55%	0.545	76%	0.762	S	S	.	*			trans	-83.6	126.9	169.4	66.6	0	0	0	0	110.6	A406 R410	A406-S408 PolarHBondContact O-N 2.88Å; S408-R410 PolarHBondContact O-N 3.33Å
409	Q	31.5	Very low	27.2	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-58	-6.2	-177.3	-86.7	179.7	-31.4	0	0	115.3	W411 R412	Q409-W411 PolarHBondContact O-N 3.24Å; Q409-R412 PolarHBondContact O-N 3.43Å
410	R	30.6	Very low	27.3	Very low	210 Å²	210	156.5 Å²	156.5	79%	0.792	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-67.9	-20.7	-174.8	-155.5	171.2	-174.6	175.3	1.3	113.8	S408	S408-R410 PolarHBondContact O-N 3.33Å
411	W	24.9	Very low	27.3	Very low	192 Å²	192	156.6 Å²	156.6	73%	0.727	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-81.5	-18	-177.3	-78.3	96.4	0	0	0	115	Q409 Q413 L414	Q409-W411 PolarHBondContact O-N 3.24Å; W411-Q413 VanDerWaalsContact C-N 3.32Å; W411-Q413 PolarHBondContact O-N 3.39Å; W411-L414 HydrophobicContact CE3-CD1 4.14Å; W411-L414 HydrophobicContact CZ3-CD1 4.31Å; W411-L414 PolarHBondContact O-N 2.93Å
412	R	26.2	Very low	27.6	Very low	155 Å²	155	154 Å²	154	59%	0.585	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-72.7	-21.7	-179.9	-79.7	-171.9	-177.8	-158.8	-1.9	114.4	Q409 L414	Q409-R412 PolarHBondContact O-N 3.43Å; R412-L414 VanDerWaalsContact C-N 3.26Å; R412-L414 PolarHBondContact O-N 3.44Å
413	Q	32.3	Very low	27.8	Very low	176 Å²	176	157.5 Å²	157.5	82%	0.822	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-80.7	-5.7	175.9	-73.7	-178.9	-12.8	0	0	113.5	W411	W411-Q413 VanDerWaalsContact C-N 3.32Å; W411-Q413 PolarHBondContact O-N 3.39Å
414	L	31.8	Very low	28.1	Very low	104 Å²	104	154 Å²	154	55%	0.545	75%	0.752	S	S	.	*	G	3₁₀ helix	trans	-102.1	-3.2	-177.1	-75.5	164.2	0	0	0	113.8	W411 R412	W411-L414 HydrophobicContact CE3-CD1 4.14Å; W411-L414 HydrophobicContact CZ3-CD1 4.31Å; W411-L414 PolarHBondContact O-N 2.93Å; R412-L414 VanDerWaalsContact C-N 3.26Å; R412-L414 PolarHBondContact O-N 3.44Å
415	A	28.9	Very low	28.6	Very low	79 Å²	79	157.7 Å²	157.7	65%	0.653	75%	0.753	S	S	*	*	S	Bend	trans	-87.4	-12.5	-172.3	0	0	0	0	0	115	F417	A415-F417 PolarHBondContact O-N 3.29Å
416	D	26.8	Very low	29	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	75%	0.749	S	S	*	*			trans	-99.1	74.7	179.1	-71.3	-24.8	0	0	0	111.3
417	F	30	Very low	29.3	Very low	159 Å²	159	150.5 Å²	150.5	70%	0.697	73%	0.734	S	S	*	*			trans	-129.8	124.8	166.6	-80	-76.6	0	0	0	110.9	A415 R419	A415-F417 PolarHBondContact O-N 3.29Å; F417-R419 PolarHBondContact O-N 2.99Å
418	P	27.6	Very low	29.6	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	73%	0.73	S	S	*	*			trans	-61.8	124.4	179.3	-18.3	29.8	0	0	0	110.9	Y420	P418-Y420 PolarHBondContact O-N 3.49Å; P418-Y420 VanDerWaalsContact O-N 3.08Å
419	R	27	Very low	29.8	Very low	238 Å²	238	145.9 Å²	145.9	90%	0.898	74%	0.74	S	S	*	*			trans	-68.6	95.9	-173	-65.2	174.4	176	175	-1.5	111.6	F417	F417-R419 PolarHBondContact O-N 2.99Å
420	Y	24.9	Very low	30	Very low	235 Å²	235	143.3 Å²	143.3	92%	0.922	74%	0.736	S	S	*	*			trans	-90.7	87.5	146.5	-93.8	-91.3	0	0	0	107.7	P418 A422	P418-Y420 PolarHBondContact O-N 3.49Å; P418-Y420 VanDerWaalsContact O-N 3.08Å; Y420-A422 VanDerWaalsContact C-N 3.32Å; Y420-A422 PolarHBondContact O-N 2.82Å
421	S	26.5	Very low	30.1	Very low	94 Å²	94	138.8 Å²	138.8	66%	0.657	73%	0.732	S	S	*	*			trans	-74.6	84.7	176.8	60.8	0	0	0	0	109.7	R423	S421-R423 VanDerWaalsContact C-N 3.26Å; S421-R423 PolarHBondContact O-N 3.38Å
422	A	28.7	Very low	30.6	Very low	80 Å²	80	136.9 Å²	136.9	66%	0.661	74%	0.735	S	S	*	*			trans	-63.2	99.8	151.7	0	0	0	0	0	106	Y420 I424	Y420-A422 VanDerWaalsContact C-N 3.32Å; Y420-A422 PolarHBondContact O-N 2.82Å; A422-I424 HydrophobicContact CB-CD1 4.48Å; A422-I424 HydrophobicContact CB-CG1 4.5Å; A422-I424 PolarHBondContact O-N 3.27Å
423	R	27.5	Very low	30.7	Very low	217 Å²	217	138.6 Å²	138.6	82%	0.819	75%	0.747	S	S	*	*			trans	-73	68	-174	-165.7	-176.7	-91.9	-173.2	-4.5	109.3	S421 L425	S421-R423 VanDerWaalsContact C-N 3.26Å; S421-R423 PolarHBondContact O-N 3.38Å; R423-L425 HydrophobicContact CG-CD1 3.87Å; R423-L425 PolarHBondContact O-N 3.49Å
424	I	30.3	Very low	30.8	Very low	127 Å²	127	136.1 Å²	136.1	65%	0.651	74%	0.743	S	S	*	*			trans	-86.4	95.3	171.1	-58.2	168.9	0	0	0	105.9	A422 A427	A422-I424 HydrophobicContact CB-CD1 4.48Å; A422-I424 HydrophobicContact CB-CG1 4.5Å; A422-I424 PolarHBondContact O-N 3.27Å; I424-A427 HydrophobicContact CG2-CB 4.37Å
425	L	34.2	Very low	30.8	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	76%	0.755	S	S	*	*			trans	-99.1	17.7	-175.3	-115.7	144.8	0	0	0	114	R423	R423-L425 HydrophobicContact CG-CD1 3.87Å; R423-L425 PolarHBondContact O-N 3.49Å
426	S	34.4	Very low	31.1	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	75%	0.752	S	S	*	*	S	Bend	trans	-140.6	43.8	177	55.7	0	0	0	0	113.1
427	A	33.1	Very low	31.8	Very low	60 Å²	60	143.3 Å²	143.3	50%	0.496	76%	0.758	S	S	.	*	S	Bend	trans	-154.5	136.1	161.2	0	0	0	0	0	109.2	I424 A429	I424-A427 HydrophobicContact CG2-CB 4.37Å; A427-A429 PolarHBondContact O-N 3.09Å
428	P	33	Very low	32.4	Very low	119 Å²	119	142 Å²	142	77%	0.773	75%	0.752	S	S	*	*			trans	-57.6	128.1	170.4	26.5	-30.9	0	0	0	106.8	V430	P428-V430 VanDerWaalsContact C-N 3.28Å; P428-V430 PolarHBondContact O-N 2.61Å
429	A	34.9	Very low	33.3	Very low	92 Å²	92	147 Å²	147	76%	0.76	76%	0.755	S	S	*	*			trans	-52.8	84.9	-171.1	0	0	0	0	0	112.4	A427 V431	A427-A429 PolarHBondContact O-N 3.09Å; A429-V431 PolarHBondContact O-N 3.12Å
430	V	35.6	Very low	34.8	Very low	130 Å²	130	142.7 Å²	142.7	79%	0.788	75%	0.749	S	S	*	*			trans	-74.4	93.3	160.6	179.5	0	0	0	0	103.8	P428 L432	P428-V430 VanDerWaalsContact C-N 3.28Å; P428-V430 PolarHBondContact O-N 2.61Å; V430-L432 VanDerWaalsContact C-N 3.28Å; V430-L432 PolarHBondContact O-N 3Å
431	V	34.1	Very low	36.9	Very low	116 Å²	116	136 Å²	136	70%	0.703	73%	0.729	S	S	*	*			trans	-52.3	98.6	172.2	178.9	0	0	0	0	106.7	A429 K433	A429-V431 PolarHBondContact O-N 3.12Å; V431-K433 VanDerWaalsContact C-N 3.26Å; V431-K433 PolarHBondContact O-N 2.87Å
432	L	34.3	Very low	39.1	Very low	151 Å²	151	137.1 Å²	137.1	79%	0.791	73%	0.727	S	S	*	*			trans	-56.2	102.4	162.4	-97.2	154	0	0	0	104.3	V430 V434	V430-L432 VanDerWaalsContact C-N 3.28Å; V430-L432 PolarHBondContact O-N 3Å; L432-V434 PolarHBondContact O-N 3.29Å
433	K	28.9	Very low	41.3	Very low	191 Å²	191	138.1 Å²	138.1	83%	0.83	73%	0.728	S	S	*	*			trans	-62.1	82.2	163.3	-86.6	-178.4	175.9	170.8	0	105.7	V431 K435	V431-K433 VanDerWaalsContact C-N 3.26Å; V431-K433 PolarHBondContact O-N 2.87Å; K433-K435 PolarHBondContact O-N 2.91Å
434	V	34.2	Very low	43.4	Very low	124 Å²	124	134.1 Å²	134.1	75%	0.752	71%	0.713	S	S	*	*			trans	-57.4	102.2	156.2	-179.2	0	0	0	0	102.7	L432 P436	L432-V434 PolarHBondContact O-N 3.29Å; V434-P436 WeakPolarHBondContact O-CD 3.27Å
435	K	31.9	Very low	45.5	Very low	180 Å²	180	132.1 Å²	132.1	78%	0.783	70%	0.702	S	S	*	*			trans	-52.8	115.5	176.4	-74.7	179.3	-178.6	172	0	104	K433 K437	K433-K435 PolarHBondContact O-N 2.91Å; K435-K437 PolarHBondContact O-N 3.29Å
436	P	34.7	Very low	47.7	Very low	92 Å²	92	129.7 Å²	129.7	60%	0.597	69%	0.689	S	S	*	*			trans	-53.8	141.1	174.9	21.2	-30.6	0	0	0	106.6	V434 K438	V434-P436 WeakPolarHBondContact O-CD 3.27Å; P436-K438 HydrophobicContact CG-CG 4.31Å; P436-K438 WeakPolarHBondContact O-CG 3.47Å; P436-K438 PolarHBondContact O-N 2.91Å
437	K	41.2	Very low	50	Low	213 Å²	213	126.7 Å²	126.7	93%	0.926	67%	0.668	S	S	*	*			trans	-55.2	89.4	170.8	-86.3	-177.9	173.6	178.9	0	106.9	K435 R439	K435-K437 PolarHBondContact O-N 3.29Å; K437-R439 PolarHBondContact O-N 3.4Å
438	K	43.3	Very low	52.2	Low	131 Å²	131	125.3 Å²	125.3	57%	0.57	66%	0.655	S	S	*	*			trans	-71.4	129.5	-168.3	-86.1	176.1	-178	-179.8	0	107.1	P436 L440	P436-K438 HydrophobicContact CG-CG 4.31Å; P436-K438 WeakPolarHBondContact O-CG 3.47Å; P436-K438 PolarHBondContact O-N 2.91Å; K438-L440 PolarHBondContact O-N 2.94Å
439	R	46.9	Very low	54.6	Low	226 Å²	226	124.1 Å²	124.1	85%	0.853	64%	0.641	S	S	*	*			trans	-46	129.9	173	-79.3	-170.7	177.7	-139.9	2.2	109.9	K437 N441	K437-R439 PolarHBondContact O-N 3.4Å; R439-N441 PolarHBondContact O-N 3.17Å; R439-N441 VanDerWaalsContact O-N 3.1Å
440	L	57.9	Low	57	Low	149 Å²	149	121.2 Å²	121.2	78%	0.78	62%	0.621	S	S	*	*			trans	-70.2	99.7	-178.8	-162.3	79.7	0	0	0	108.3	K438	K438-L440 PolarHBondContact O-N 2.94Å
441	N	68.4	Low	59.4	Low	95 Å²	95	122.3 Å²	122.3	51%	0.508	61%	0.611	S	S	.	*			trans	-84.2	136.1	175.4	-71.2	0.7	0	0	0	109.6	R439 C443 R444 M445	R439-N441 PolarHBondContact O-N 3.17Å; R439-N441 VanDerWaalsContact O-N 3.1Å; N441-C443 VanDerWaalsContact C-N 3.26Å; N441-C443 PolarHBondContact O-N 3.09Å; N441-R444 WeakPolarHBondContact O-CA 3.45Å; N441-R444 WeakPolarHBondContact O-CB 3.36Å; N441-R444 PolarHBondContact O-N 3.43Å; N441-M445 PolarHBondContact O-N 3.2Å
442	L	74.7	Confident	61.9	Low	117 Å²	117	117.9 Å²	117.9	61%	0.613	58%	0.584	S	S	*	*	H	α-helix	trans	-50.9	-41.8	-179.9	-178.1	65.8	0	0	0	113.2	R444 M445 L446	L442-R444 VanDerWaalsContact C-N 3.27Å; L442-R444 PolarHBondContact O-N 3.28Å; L442-M445 HydrophobicContact CD1-CE 3.86Å; L442-M445 WeakPolarHBondContact O-CB 3.34Å; L442-M445 PolarHBondContact O-N 3.21Å; L442-M445 VanDerWaalsContact O-N 3.07Å; L442-L446 HydrophobicContact CG-CD1 4.27Å; L442-L446 PolarHBondContact O-N 2.97Å
443	C	74.1	Confident	64.6	Low	101 Å²	101	112.9 Å²	112.9	68%	0.682	56%	0.564	S	S	*	*	H	α-helix	trans	-59	-36.4	176.8	-67.2	0	0	0	0	112.8	N441 S447	N441-C443 VanDerWaalsContact C-N 3.26Å; N441-C443 PolarHBondContact O-N 3.09Å; C443-S447 WeakPolarHBondContact O-CB 3.4Å; C443-S447 PolarHBondContact O-N 2.73Å; C443-S447 PolarHBondContact O-OG 2.94Å
444	R	72	Confident	67.5	Low	132 Å²	132	108.9 Å²	108.9	50%	0.498	55%	0.551	S	S	.	*	H	α-helix	trans	-71.4	-37.1	175.1	-81.4	-165	-172.2	135.9	11	111.7	N441 L442 S447 S448	N441-R444 WeakPolarHBondContact O-CA 3.45Å; N441-R444 WeakPolarHBondContact O-CB 3.36Å; N441-R444 PolarHBondContact O-N 3.43Å; L442-R444 VanDerWaalsContact C-N 3.27Å; L442-R444 PolarHBondContact O-N 3.28Å; R444-S447 WeakPolarHBondContact CA-OG 3.18Å; R444-S447 PolarHBondContact O-N 3.21Å; R444-S447 PolarHBondContact O-OG 3.28Å; R444-S448 VanDerWaalsContact O-CB 3.25Å; R444-S448 WeakPolarHBondContact O-CB 3.48Å; R444-S448 PolarHBondContact O-N 3.35Å
445	M	74.9	Confident	70.1	Confident	85 Å²	85	106.1 Å²	106.1	42%	0.419	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-48	175.4	-168.4	-178	87.1	0	0	110.5	N441 L442 S448 I449	N441-M445 PolarHBondContact O-N 3.2Å; L442-M445 HydrophobicContact CD1-CE 3.86Å; L442-M445 WeakPolarHBondContact O-CB 3.34Å; L442-M445 PolarHBondContact O-N 3.21Å; L442-M445 VanDerWaalsContact O-N 3.07Å; M445-S448 WeakPolarHBondContact O-CB 3.08Å; M445-S448 PolarHBondContact O-N 2.86Å; M445-S448 VanDerWaalsContact O-N 3.14Å; M445-I449 HydrophobicContact CE-CD1 4.45Å; M445-I449 HydrophobicContact CG-CD1 4.3Å; M445-I449 WeakPolarHBondContact O-CG1 3.39Å; M445-I449 PolarHBondContact O-N 2.97Å
446	L	78.7	Confident	73	Confident	103 Å²	103	99 Å²	99	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-44.8	175.5	-72	170.7	0	0	0	112.2	L442 S448 I449 G450	L442-L446 HydrophobicContact CG-CD1 4.27Å; L442-L446 PolarHBondContact O-N 2.97Å; L446-S448 PolarHBondContact O-N 3.37Å; L446-I449 PolarHBondContact O-N 3.08Å; L446-G450 PolarHBondContact O-N 3.41Å
447	S	82.4	Confident	75.8	Confident	54 Å²	54	99.5 Å²	99.5	38%	0.378	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-38	175.1	66.2	0	0	0	0	111.5	C443 R444 G450 Y451	C443-S447 WeakPolarHBondContact O-CB 3.4Å; C443-S447 PolarHBondContact O-N 2.73Å; C443-S447 PolarHBondContact O-OG 2.94Å; R444-S447 WeakPolarHBondContact CA-OG 3.18Å; R444-S447 PolarHBondContact O-N 3.21Å; R444-S447 PolarHBondContact O-OG 3.28Å; S447-G450 WeakPolarHBondContact O-CA 3.38Å; S447-G450 PolarHBondContact O-N 3.02Å; S447-Y451 WeakPolarHBondContact O-CD2 3.42Å; S447-Y451 PolarHBondContact O-N 3.06Å
448	S	79.3	Confident	78.3	Confident	31 Å²	31	95 Å²	95	22%	0.217	48%	0.478	C	S	.	.	H	α-helix	trans	-62.1	-43.4	178.2	-137.9	0	0	0	0	112.6	R119 R444 M445 L446 G450 Y451 I452	R119-S448 PolarHBondContact NH1-OG 3.42Å; R119-S448 PolarHBondContact NH2-O 2.91Å; R119-S448 PolarHBondContact NH2-OG 3.1Å; R444-S448 VanDerWaalsContact O-CB 3.25Å; R444-S448 WeakPolarHBondContact O-CB 3.48Å; R444-S448 PolarHBondContact O-N 3.35Å; M445-S448 WeakPolarHBondContact O-CB 3.08Å; M445-S448 PolarHBondContact O-N 2.86Å; M445-S448 VanDerWaalsContact O-N 3.14Å; L446-S448 PolarHBondContact O-N 3.37Å; S448-G450 VanDerWaalsContact C-N 3.3Å; S448-Y451 PolarHBondContact O-N 3.43Å; S448-I452 WeakPolarHBondContact O-CG1 3.37Å; S448-I452 PolarHBondContact O-N 3.19Å; S448-I452 VanDerWaalsContact O-N 3.16Å
449	I	84.4	Confident	80.6	Confident	93 Å²	93	89 Å²	89	48%	0.477	45%	0.452	S	S	.	.	H	α-helix	trans	-64.2	-40.6	174.8	-66.1	162.7	0	0	0	109.6	M445 L446 Y451 I452 A453	M445-I449 HydrophobicContact CE-CD1 4.45Å; M445-I449 HydrophobicContact CG-CD1 4.3Å; M445-I449 WeakPolarHBondContact O-CG1 3.39Å; M445-I449 PolarHBondContact O-N 2.97Å; L446-I449 PolarHBondContact O-N 3.08Å; I449-Y451 PolarHBondContact O-N 2.83Å; I449-I452 PolarHBondContact O-N 2.83Å; I449-A453 WeakPolarHBondContact O-CB 3.43Å; I449-A453 PolarHBondContact O-N 3.19Å
450	G	85	Confident	82.9	Confident	32 Å²	32	81.9 Å²	81.9	33%	0.33	43%	0.431	S	S	.	.	H	α-helix	trans	-58.1	-45.8	174.8	0	0	0	0	0	113.2	L446 S447 S448 A453 L454	L446-G450 PolarHBondContact O-N 3.41Å; S447-G450 WeakPolarHBondContact O-CA 3.38Å; S447-G450 PolarHBondContact O-N 3.02Å; S448-G450 VanDerWaalsContact C-N 3.3Å; G450-A453 PolarHBondContact O-N 3.06Å; G450-L454 WeakPolarHBondContact O-CG 3.32Å; G450-L454 PolarHBondContact O-N 2.89Å
451	Y	85.4	Confident	84.6	Confident	152 Å²	152	83 Å²	83	60%	0.596	43%	0.429	S	S	*	.	H	α-helix	trans	-62.2	-46.9	176.1	-70.4	-66.6	0	0	0	112.1	S447 S448 I449 A453 L454 D455	S447-Y451 WeakPolarHBondContact O-CD2 3.42Å; S447-Y451 PolarHBondContact O-N 3.06Å; S448-Y451 PolarHBondContact O-N 3.43Å; I449-Y451 PolarHBondContact O-N 2.83Å; Y451-A453 VanDerWaalsContact C-N 3.3Å; Y451-A453 PolarHBondContact O-N 2.97Å; Y451-L454 WeakPolarHBondContact O-CB 3.41Å; Y451-L454 PolarHBondContact O-N 3.48Å; Y451-L454 VanDerWaalsContact O-N 3.08Å; Y451-D455 PolarHBondContact O-N 3.02Å
452	I	87.9	Confident	85.7	Confident	24 Å²	24	81.3 Å²	81.3	12%	0.123	42%	0.42	C	S	.	.	H	α-helix	trans	-56.5	-45.3	175.8	-68.4	162.1	0	0	0	111.4	A115 R119 S448 I449 L454 D455 Y456 Y590	A115-I452 HydrophobicContact CB-CD1 4.02Å; A115-I452 HydrophobicContact CB-CG1 4.49Å; A115-I452 HydrophobicContact CB-CG2 3.91Å; R119-I452 VanDerWaalsContact NE-CD1 3.32Å; S448-I452 WeakPolarHBondContact O-CG1 3.37Å; S448-I452 PolarHBondContact O-N 3.19Å; S448-I452 VanDerWaalsContact O-N 3.16Å; I449-I452 PolarHBondContact O-N 2.83Å; I452-L454 VanDerWaalsContact C-N 3.3Å; I452-L454 PolarHBondContact O-N 2.99Å; I452-D455 PolarHBondContact O-N 3.04Å; I452-Y456 HydrophobicContact CG2-CD2 3.71Å; I452-Y456 HydrophobicContact CG2-CE2 3.45Å; I452-Y456 VanDerWaalsContact CG2-CE2 3.45Å; I452-Y456 VanDerWaalsContact O-CD2 3.25Å; I452-Y456 WeakPolarHBondContact O-CD2 3.33Å; I452-Y456 PolarHBondContact O-N 3.37Å; I452-Y590 HydrophobicContact CG2-CE1 4.06Å
453	A	90.5	Very high	86.6	Confident	45 Å²	45	80 Å²	80	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-38.8	179	0	0	0	0	0	111.6	I449 G450 Y451 Y456 L457	I449-A453 WeakPolarHBondContact O-CB 3.43Å; I449-A453 PolarHBondContact O-N 3.19Å; G450-A453 PolarHBondContact O-N 3.06Å; Y451-A453 VanDerWaalsContact C-N 3.3Å; Y451-A453 PolarHBondContact O-N 2.97Å; A453-Y456 PolarHBondContact O-N 3.29Å; A453-L457 WeakPolarHBondContact O-CB 3.35Å; A453-L457 VanDerWaalsContact O-CG 3.24Å; A453-L457 WeakPolarHBondContact O-CG 3.2Å; A453-L457 PolarHBondContact O-N 3.15Å
454	L	89.8	Confident	87.5	Confident	107 Å²	107	75.8 Å²	75.8	56%	0.56	39%	0.39	S	S	*	.	H	α-helix	trans	-65	-39.3	174.9	-71.8	172.8	0	0	0	112.1	G450 Y451 I452 L457 K458	G450-L454 WeakPolarHBondContact O-CG 3.32Å; G450-L454 PolarHBondContact O-N 2.89Å; Y451-L454 WeakPolarHBondContact O-CB 3.41Å; Y451-L454 PolarHBondContact O-N 3.48Å; Y451-L454 VanDerWaalsContact O-N 3.08Å; I452-L454 VanDerWaalsContact C-N 3.3Å; I452-L454 PolarHBondContact O-N 2.99Å; L454-L457 PolarHBondContact O-N 3.41Å; L454-K458 WeakPolarHBondContact O-CB 3.25Å; L454-K458 PolarHBondContact O-N 3.05Å
455	D	88.8	Confident	88.6	Confident	66 Å²	66	69.5 Å²	69.5	35%	0.353	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-47.6	176.3	-66.6	-35.4	0	0	0	110.2	Y451 I452 L457 K458 L459	Y451-D455 PolarHBondContact O-N 3.02Å; I452-D455 PolarHBondContact O-N 3.04Å; D455-L457 PolarHBondContact O-N 3.06Å; D455-K458 WeakPolarHBondContact O-CB 3.44Å; D455-K458 PolarHBondContact O-N 3.37Å; D455-L459 WeakPolarHBondContact O-CG 3.28Å; D455-L459 PolarHBondContact O-N 2.85Å
456	Y	93.4	Very high	89.6	Confident	32 Å²	32	67.7 Å²	67.7	13%	0.125	36%	0.36	C	S	.	.	H	α-helix	trans	-57.9	-45.5	173	-76.6	-56.4	0	0	0	113.4	P111 S114 I452 A453 K458 L459 L460 Y590 I594	P111-Y456 VanDerWaalsContact C-OH 3.26Å; P111-Y456 WeakPolarHBondContact CA-OH 3.4Å; P111-Y456 HydrophobicContact CB-CE1 4.32Å; P111-Y456 HydrophobicContact CB-CE2 4.33Å; P111-Y456 PolarHBondContact O-OH 2.6Å; S114-Y456 WeakPolarHBondContact CB-OH 3.31Å; I452-Y456 HydrophobicContact CG2-CD2 3.71Å; I452-Y456 HydrophobicContact CG2-CE2 3.45Å; I452-Y456 VanDerWaalsContact CG2-CE2 3.45Å; I452-Y456 VanDerWaalsContact O-CD2 3.25Å; I452-Y456 WeakPolarHBondContact O-CD2 3.33Å; I452-Y456 PolarHBondContact O-N 3.37Å; A453-Y456 PolarHBondContact O-N 3.29Å; Y456-K458 VanDerWaalsContact C-N 3.3Å; Y456-K458 PolarHBondContact O-N 3.24Å; Y456-L459 PolarHBondContact O-N 3.04Å; Y456-L460 PolarHBondContact O-N 2.97Å; Y456-Y590 HydrophobicContact CD1-CD1 4.16Å; Y456-Y590 HydrophobicContact CD2-CD1 4.47Å; Y456-Y590 AromaticContact CE1-CD1 3.66Å; Y456-Y590 HydrophobicContact CE1-CD1 3.66Å; Y456-Y590 HydrophobicContact CE1-CG 4.31Å; Y456-Y590 VanDerWaalsContact CE1-O 3.32Å; Y456-Y590 WeakPolarHBondContact CE1-O 3.34Å; Y456-Y590 AromaticContact CE2-CD1 3.96Å; Y456-Y590 HydrophobicContact CE2-CD1 3.96Å; Y456-Y590 HydrophobicContact CE2-CE1 4.28Å; Y456-Y590 AromaticContact CZ-CD1 3.52Å; Y456-I594 HydrophobicContact CD1-CD1 3.5Å; Y456-I594 VanDerWaalsContact CD1-CD1 3.5Å; Y456-I594 HydrophobicContact CD1-CG1 3.43Å; Y456-I594 VanDerWaalsContact CD1-CG1 3.43Å; Y456-I594 HydrophobicContact CE1-CD1 4.3Å; Y456-I594 HydrophobicContact CE1-CG1 3.78Å; Y456-I594 HydrophobicContact CG-CD1 4.3Å; Y456-I594 HydrophobicContact CG-CG1 4.42Å
457	L	93.5	Very high	90.5	Very high	101 Å²	101	65 Å²	65	53%	0.529	35%	0.346	S	S	.	.	H	α-helix	trans	-67.1	-30.4	179.3	-71.7	173.3	0	0	0	112.8	A453 L454 D455 L459	A453-L457 WeakPolarHBondContact O-CB 3.35Å; A453-L457 VanDerWaalsContact O-CG 3.24Å; A453-L457 WeakPolarHBondContact O-CG 3.2Å; A453-L457 PolarHBondContact O-N 3.15Å; L454-L457 PolarHBondContact O-N 3.41Å; D455-L457 PolarHBondContact O-N 3.06Å; L457-L459 VanDerWaalsContact C-N 3.34Å
458	K	92.8	Very high	91.2	Very high	119 Å²	119	62.4 Å²	62.4	52%	0.517	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-42.3	174.6	179.4	-165.9	168.9	-148.4	0	110.3	L454 D455 Y456 L460 K461 D587	L454-K458 WeakPolarHBondContact O-CB 3.25Å; L454-K458 PolarHBondContact O-N 3.05Å; D455-K458 WeakPolarHBondContact O-CB 3.44Å; D455-K458 PolarHBondContact O-N 3.37Å; Y456-K458 VanDerWaalsContact C-N 3.3Å; Y456-K458 PolarHBondContact O-N 3.24Å; K458-L460 VanDerWaalsContact C-N 3.34Å; K458-L460 PolarHBondContact O-N 2.82Å; K458-K461 WeakPolarHBondContact O-CB 3.48Å; K458-K461 PolarHBondContact O-N 3.45Å; K458-D587 IonicContact NZ-OD2 3.05Å
459	L	92.1	Very high	92	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-40.6	179.7	-57.2	174.6	0	0	0	112	D455 Y456 L457 K461 D462 F465 M583 D587 I594	D455-L459 WeakPolarHBondContact O-CG 3.28Å; D455-L459 PolarHBondContact O-N 2.85Å; Y456-L459 PolarHBondContact O-N 3.04Å; L457-L459 VanDerWaalsContact C-N 3.34Å; L459-K461 PolarHBondContact O-N 3Å; L459-D462 PolarHBondContact O-N 2.66Å; L459-F465 HydrophobicContact CB-CD1 4.09Å; L459-F465 HydrophobicContact CB-CE1 3.86Å; L459-F465 WeakPolarHBondContact O-CD1 3.28Å; L459-M583 HydrophobicContact CB-CE 3.99Å; L459-M583 HydrophobicContact CD2-CE 3.29Å; L459-M583 HydrophobicContact CG-CE 4.18Å; L459-D587 HydrophobicContact CD2-CB 3.63Å; L459-D587 WeakPolarHBondContact CD2-OD2 3.25Å; L459-I594 HydrophobicContact CB-CD1 4.39Å; L459-I594 HydrophobicContact CD1-CD1 4.26Å
460	L	94.4	Very high	92.6	Very high	77 Å²	77	61.3 Å²	61.3	40%	0.403	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-5.6	178.7	-67.2	175.4	0	0	0	114.3	Y456 K458 F465 V466 L469 I594	Y456-L460 PolarHBondContact O-N 2.97Å; K458-L460 VanDerWaalsContact C-N 3.34Å; K458-L460 PolarHBondContact O-N 2.82Å; L460-F465 HydrophobicContact CD2-CE1 4.31Å; L460-V466 WeakPolarHBondContact O-CG2 3.38Å; L460-L469 HydrophobicContact CD2-CD1 3.68Å; L460-I594 HydrophobicContact CD2-CD1 4.32Å; L460-I594 HydrophobicContact CD2-CG2 4.36Å; L460-I594 HydrophobicContact CG-CD1 4.25Å
461	K	93.4	Very high	93.2	Very high	173 Å²	173	59.8 Å²	59.8	75%	0.752	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.1	172.3	-63.9	179	-178.8	178.8	0	112.8	K458 L459	K458-K461 WeakPolarHBondContact O-CB 3.48Å; K458-K461 PolarHBondContact O-N 3.45Å; L459-K461 PolarHBondContact O-N 3Å
462	D	92.8	Very high	93.7	Very high	58 Å²	58	52.6 Å²	52.6	31%	0.31	28%	0.276	S	S	.	.			trans	-77.2	119.8	178.4	-172	-72	0	0	0	110.6	L459 S464 F465 V466 M583	L459-D462 PolarHBondContact O-N 2.66Å; D462-S464 VanDerWaalsContact C-N 3.33Å; D462-S464 PolarHBondContact O-N 3.35Å; D462-S464 WeakPolarHBondContact OD1-CA 3.27Å; D462-S464 VanDerWaalsContact OD1-CB 3.26Å; D462-S464 WeakPolarHBondContact OD1-CB 3.24Å; D462-S464 PolarHBondContact OD1-N 3.43Å; D462-F465 HydrophobicContact CB-CB 4Å; D462-F465 PolarHBondContact O-N 2.93Å; D462-F465 PolarHBondContact OD1-N 3.47Å; D462-V466 WeakPolarHBondContact O-CG2 3.38Å; D462-V466 PolarHBondContact O-N 3.3Å; D462-M583 HydrophobicContact CB-CE 4.32Å; D462-M583 HydrophobicContact CB-SD 4.31Å
463	P	92.8	Very high	94.1	Very high	90 Å²	90	55.1 Å²	55.1	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-68.7	-30.2	-175.6	27.9	-34.8	0	0	0	113.1	L467	P463-L467 PolarHBondContact O-N 3.25Å
464	S	92.9	Very high	94.4	Very high	13 Å²	13	54.5 Å²	54.5	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-69.5	-41.3	178.1	-58.9	0	0	0	0	110.3	D462 F468	D462-S464 VanDerWaalsContact C-N 3.33Å; D462-S464 PolarHBondContact O-N 3.35Å; D462-S464 WeakPolarHBondContact OD1-CA 3.27Å; D462-S464 VanDerWaalsContact OD1-CB 3.26Å; D462-S464 WeakPolarHBondContact OD1-CB 3.24Å; D462-S464 PolarHBondContact OD1-N 3.43Å; S464-F468 WeakPolarHBondContact O-CB 3.16Å; S464-F468 PolarHBondContact O-N 2.99Å
465	F	95.6	Very high	94.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.4	-46.3	175	-176.6	-124.1	0	0	0	112	L459 L460 D462 L467 F468 L469 L579 M583 I594	L459-F465 HydrophobicContact CB-CD1 4.09Å; L459-F465 HydrophobicContact CB-CE1 3.86Å; L459-F465 WeakPolarHBondContact O-CD1 3.28Å; L460-F465 HydrophobicContact CD2-CE1 4.31Å; D462-F465 HydrophobicContact CB-CB 4Å; D462-F465 PolarHBondContact O-N 2.93Å; D462-F465 PolarHBondContact OD1-N 3.47Å; F465-L467 PolarHBondContact O-N 3.46Å; F465-F468 WeakPolarHBondContact O-CA 3.36Å; F465-F468 WeakPolarHBondContact O-CB 3.48Å; F465-F468 PolarHBondContact O-N 3.18Å; F465-L469 HydrophobicContact CD1-CD1 3.99Å; F465-L469 HydrophobicContact CD1-CG 4.47Å; F465-L469 HydrophobicContact CD2-CG 4.41Å; F465-L469 HydrophobicContact CE1-CD1 3.59Å; F465-L469 HydrophobicContact CE1-CD2 4.49Å; F465-L469 HydrophobicContact CE1-CG 4.18Å; F465-L469 HydrophobicContact CE2-CD1 4.36Å; F465-L469 HydrophobicContact CE2-CD2 3.93Å; F465-L469 HydrophobicContact CE2-CG 4.04Å; F465-L469 HydrophobicContact CZ-CD1 3.8Å; F465-L469 HydrophobicContact CZ-CD2 3.83Å; F465-L469 HydrophobicContact CZ-CG 3.95Å; F465-L469 WeakPolarHBondContact O-CG 3.4Å; F465-L469 PolarHBondContact O-N 3.28Å; F465-L579 HydrophobicContact CD2-CD1 3.88Å; F465-L579 HydrophobicContact CE2-CD1 3.62Å; F465-M583 HydrophobicContact CB-CE 4.37Å; F465-M583 HydrophobicContact CB-CG 4.48Å; F465-M583 HydrophobicContact CB-SD 3.55Å; F465-M583 VanDerWaalsContact CB-SD 3.55Å; F465-M583 HydrophobicContact CD1-CE 4.46Å; F465-M583 HydrophobicContact CD2-CG 3.9Å; F465-M583 HydrophobicContact CD2-SD 4.07Å; F465-M583 HydrophobicContact CE2-CG 4.46Å; F465-M583 HydrophobicContact CG-CE 4.31Å; F465-M583 HydrophobicContact CG-CG 4.23Å; F465-M583 HydrophobicContact CG-SD 3.79Å; F465-I594 HydrophobicContact CE1-CD1 4.07Å; F465-I594 HydrophobicContact CE1-CG2 4.4Å; F465-I594 HydrophobicContact CZ-CB 4.12Å; F465-I594 HydrophobicContact CZ-CD1 4.39Å; F465-I594 HydrophobicContact CZ-CG2 4.22Å
466	V	96.7	Very high	95	Very high	46 Å²	46	47.4 Å²	47.4	28%	0.279	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-42.5	178.3	173.6	0	0	0	0	111.7	L460 D462 F468 L469 I470	L460-V466 WeakPolarHBondContact O-CG2 3.38Å; D462-V466 WeakPolarHBondContact O-CG2 3.38Å; D462-V466 PolarHBondContact O-N 3.3Å; V466-F468 VanDerWaalsContact C-N 3.27Å; V466-F468 PolarHBondContact O-N 2.95Å; V466-L469 PolarHBondContact O-N 3.33Å; V466-I470 HydrophobicContact CG1-CD1 3.97Å; V466-I470 WeakPolarHBondContact O-CG1 3.44Å; V466-I470 PolarHBondContact O-N 3.4Å
467	L	95.9	Very high	95	Very high	46 Å²	46	46.2 Å²	46.2	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-39.5	173.2	-108.4	71.3	0	0	0	111.7	P463 F465 I470 S471 C640 I641 L644	P463-L467 PolarHBondContact O-N 3.25Å; F465-L467 PolarHBondContact O-N 3.46Å; L467-I470 PolarHBondContact O-N 3.45Å; L467-S471 WeakPolarHBondContact O-CB 3.34Å; L467-S471 PolarHBondContact O-N 2.81Å; L467-C640 HydrophobicContact CD2-CB 4.49Å; L467-I641 HydrophobicContact CB-CD1 3.84Å; L467-I641 HydrophobicContact CB-CG1 3.78Å; L467-I641 HydrophobicContact CD2-CG1 3.96Å; L467-L644 HydrophobicContact CD2-CD1 4.48Å
468	F	97	Very high	94.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-37.5	179.3	-170.8	-113.7	0	0	0	111.6	S464 F465 V466 S471 N472 T575 I578 L579 L582 M595 V638 I641	S464-F468 WeakPolarHBondContact O-CB 3.16Å; S464-F468 PolarHBondContact O-N 2.99Å; F465-F468 WeakPolarHBondContact O-CA 3.36Å; F465-F468 WeakPolarHBondContact O-CB 3.48Å; F465-F468 PolarHBondContact O-N 3.18Å; V466-F468 VanDerWaalsContact C-N 3.27Å; V466-F468 PolarHBondContact O-N 2.95Å; F468-S471 PolarHBondContact O-N 3Å; F468-N472 WeakPolarHBondContact CE1-ND2 3.49Å; F468-N472 WeakPolarHBondContact CE2-ND2 3.25Å; F468-N472 VanDerWaalsContact CZ-ND2 3.28Å; F468-N472 WeakPolarHBondContact CZ-ND2 3.11Å; F468-N472 WeakPolarHBondContact O-CB 3.34Å; F468-N472 PolarHBondContact O-N 2.76Å; F468-N472 PolarHBondContact O-ND2 3.47Å; F468-T575 HydrophobicContact CE1-CG2 4.24Å; F468-T575 HydrophobicContact CZ-CG2 4.1Å; F468-I578 HydrophobicContact CD2-CG2 4.48Å; F468-I578 HydrophobicContact CE2-CG2 3.97Å; F468-I578 HydrophobicContact CZ-CB 4.48Å; F468-I578 HydrophobicContact CZ-CG2 4.12Å; F468-L579 HydrophobicContact CD1-CD1 4.3Å; F468-L579 HydrophobicContact CE1-CD1 4.36Å; F468-L582 HydrophobicContact CB-CD1 3.73Å; F468-L582 HydrophobicContact CD1-CD1 4.02Å; F468-L582 HydrophobicContact CD2-CD1 4.19Å; F468-L582 HydrophobicContact CG-CD1 3.72Å; F468-M595 HydrophobicContact CE1-SD 3.85Å; F468-V638 HydrophobicContact CD2-CG2 4.27Å; F468-V638 HydrophobicContact CE2-CG2 4.45Å; F468-I641 HydrophobicContact CB-CD1 3.81Å; F468-I641 HydrophobicContact CD2-CD1 4.28Å
469	L	97.7	Very high	94.8	Very high	13 Å²	13	37.8 Å²	37.8	7%	0.068	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-45.2	172.9	-68	177.6	0	0	0	112.1	L460 F465 V466 S471 N472 F473 I594 M595 V598	L460-L469 HydrophobicContact CD2-CD1 3.68Å; F465-L469 HydrophobicContact CD1-CD1 3.99Å; F465-L469 HydrophobicContact CD1-CG 4.47Å; F465-L469 HydrophobicContact CD2-CG 4.41Å; F465-L469 HydrophobicContact CE1-CD1 3.59Å; F465-L469 HydrophobicContact CE1-CD2 4.49Å; F465-L469 HydrophobicContact CE1-CG 4.18Å; F465-L469 HydrophobicContact CE2-CD1 4.36Å; F465-L469 HydrophobicContact CE2-CD2 3.93Å; F465-L469 HydrophobicContact CE2-CG 4.04Å; F465-L469 HydrophobicContact CZ-CD1 3.8Å; F465-L469 HydrophobicContact CZ-CD2 3.83Å; F465-L469 HydrophobicContact CZ-CG 3.95Å; F465-L469 WeakPolarHBondContact O-CG 3.4Å; F465-L469 PolarHBondContact O-N 3.28Å; V466-L469 PolarHBondContact O-N 3.33Å; L469-S471 VanDerWaalsContact C-N 3.32Å; L469-S471 PolarHBondContact O-N 3.33Å; L469-N472 PolarHBondContact O-N 3.32Å; L469-F473 WeakPolarHBondContact O-CB 3.23Å; L469-F473 PolarHBondContact O-N 2.87Å; L469-I594 HydrophobicContact CD1-CG2 3.64Å; L469-I594 HydrophobicContact CD2-CG2 3.88Å; L469-I594 HydrophobicContact CG-CG2 4.43Å; L469-M595 HydrophobicContact CD2-CB 3.94Å; L469-M595 HydrophobicContact CD2-CG 4.42Å; L469-V598 HydrophobicContact CD2-CG2 4.32Å
470	I	97.2	Very high	94.6	Very high	89 Å²	89	38.5 Å²	38.5	46%	0.456	20%	0.197	S	C	.	.	H	α-helix	trans	-61.8	-42.9	177.8	-66.6	165.9	0	0	0	110.4	V466 L467 L474 L637	V466-I470 HydrophobicContact CG1-CD1 3.97Å; V466-I470 WeakPolarHBondContact O-CG1 3.44Å; V466-I470 PolarHBondContact O-N 3.4Å; L467-I470 PolarHBondContact O-N 3.45Å; I470-L474 WeakPolarHBondContact O-CB 3.35Å; I470-L474 PolarHBondContact O-N 3.5Å; I470-L474 VanDerWaalsContact O-N 3.09Å; I470-L637 HydrophobicContact CG2-CD1 4.04Å
471	S	97	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-48.5	174.6	164.4	0	0	0	0	111.9	L467 F468 L469 L474 L475 S634 V638	L467-S471 WeakPolarHBondContact O-CB 3.34Å; L467-S471 PolarHBondContact O-N 2.81Å; F468-S471 PolarHBondContact O-N 3Å; L469-S471 VanDerWaalsContact C-N 3.32Å; L469-S471 PolarHBondContact O-N 3.33Å; S471-L474 PolarHBondContact O-N 3.48Å; S471-L475 WeakPolarHBondContact O-CB 3.49Å; S471-L475 PolarHBondContact O-N 3.28Å; S471-S634 VanDerWaalsContact C-OG 3.32Å; S471-S634 PolarHBondContact O-OG 3.23Å; S471-S634 PolarHBondContact OG-O 2.86Å; S471-S634 VanDerWaalsContact OG-O 3.08Å; S471-S634 PolarHBondContact OG-OG 3.46Å; S471-V638 WeakPolarHBondContact OG-CG2 3.27Å
472	N	96.4	Very high	94.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.9	-40.7	179.4	-88.9	-91.2	0	0	0	112.4	F468 L469 L474 L475 Y476 Q599	F468-N472 WeakPolarHBondContact CE1-ND2 3.49Å; F468-N472 WeakPolarHBondContact CE2-ND2 3.25Å; F468-N472 VanDerWaalsContact CZ-ND2 3.28Å; F468-N472 WeakPolarHBondContact CZ-ND2 3.11Å; F468-N472 WeakPolarHBondContact O-CB 3.34Å; F468-N472 PolarHBondContact O-N 2.76Å; F468-N472 PolarHBondContact O-ND2 3.47Å; L469-N472 PolarHBondContact O-N 3.32Å; N472-L474 VanDerWaalsContact C-N 3.34Å; N472-L474 PolarHBondContact O-N 2.86Å; N472-L475 PolarHBondContact O-N 2.9Å; N472-Y476 WeakPolarHBondContact O-CB 3.44Å; N472-Y476 WeakPolarHBondContact O-CD2 3.48Å; N472-Y476 PolarHBondContact O-N 3.24Å; N472-Q599 HydrophobicContact CB-CG 4.22Å; N472-Q599 PolarHBondContact OD1-NE2 2.97Å
473	F	96.4	Very high	93.8	Very high	77 Å²	77	26.2 Å²	26.2	34%	0.338	14%	0.137	S	C	.	.	H	α-helix	trans	-55.5	-51.3	173.9	-179	-106	0	0	0	111.3	L469 L475 Y476 A477 V598 F601 I605	L469-F473 WeakPolarHBondContact O-CB 3.23Å; L469-F473 PolarHBondContact O-N 2.87Å; F473-L475 VanDerWaalsContact C-N 3.34Å; F473-L475 PolarHBondContact O-N 3.46Å; F473-Y476 PolarHBondContact O-N 2.97Å; F473-A477 VanDerWaalsContact O-CB 3.28Å; F473-A477 WeakPolarHBondContact O-CB 3.49Å; F473-A477 PolarHBondContact O-N 3.46Å; F473-V598 HydrophobicContact CB-CG1 3.44Å; F473-V598 VanDerWaalsContact CB-CG1 3.44Å; F473-V598 HydrophobicContact CD2-CG1 3.9Å; F473-V598 HydrophobicContact CG-CG1 4.11Å; F473-F601 HydrophobicContact CE2-CB 4.24Å; F473-I605 HydrophobicContact CE2-CD1 4.19Å; F473-I605 HydrophobicContact CZ-CD1 3.92Å
474	L	96.1	Very high	93.4	Very high	33 Å²	33	25.2 Å²	25.2	17%	0.173	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-40.1	-178.1	-177.9	67.1	0	0	0	111.9	I470 S471 N472 L478 G630 M633	I470-L474 WeakPolarHBondContact O-CB 3.35Å; I470-L474 PolarHBondContact O-N 3.5Å; I470-L474 VanDerWaalsContact O-N 3.09Å; S471-L474 PolarHBondContact O-N 3.48Å; N472-L474 VanDerWaalsContact C-N 3.34Å; N472-L474 PolarHBondContact O-N 2.86Å; L474-L478 HydrophobicContact CD1-CD1 3.76Å; L474-L478 HydrophobicContact CG-CD1 4.23Å; L474-L478 WeakPolarHBondContact O-CG 3.41Å; L474-L478 PolarHBondContact O-N 3.44Å; L474-G630 WeakPolarHBondContact CD2-O 3.27Å; L474-M633 HydrophobicContact CD1-CE 4.04Å; L474-M633 HydrophobicContact CD2-CB 4.05Å; L474-M633 HydrophobicContact CD2-CE 3.37Å; L474-M633 HydrophobicContact CD2-CG 3.99Å; L474-M633 HydrophobicContact CD2-SD 4.49Å; L474-M633 HydrophobicContact CG-CE 4.35Å
475	L	96.3	Very high	93.2	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-54.2	175.3	179.7	62.8	0	0	0	110.3	S471 N472 F473 A477 L478 Y479 Y534 T538 I568 N571 T631	S471-L475 WeakPolarHBondContact O-CB 3.49Å; S471-L475 PolarHBondContact O-N 3.28Å; N472-L475 PolarHBondContact O-N 2.9Å; F473-L475 VanDerWaalsContact C-N 3.34Å; F473-L475 PolarHBondContact O-N 3.46Å; L475-A477 VanDerWaalsContact C-N 3.28Å; L475-A477 PolarHBondContact O-N 2.98Å; L475-L478 CarbonylContact O-C 3.59Å; L475-L478 PolarHBondContact O-N 3.47Å; L475-Y479 VanDerWaalsContact O-CB 3.32Å; L475-Y479 WeakPolarHBondContact O-CB 3.31Å; L475-Y479 PolarHBondContact O-N 3.45Å; L475-Y534 WeakPolarHBondContact CD2-OH 3.49Å; L475-T538 HydrophobicContact CD1-CG2 4.15Å; L475-I568 HydrophobicContact CD1-CD1 4.24Å; L475-N571 HydrophobicContact CD2-CB 4.13Å; L475-N571 WeakPolarHBondContact CD2-OD1 3.28Å; L475-T631 HydrophobicContact CD1-CG2 3.79Å
476	Y	94.6	Very high	92.9	Very high	22 Å²	22	25 Å²	25	9%	0.086	12%	0.123	C	C	.	.	H	α-helix	trans	-70.7	-21.5	-176.1	-83.8	-108.1	0	0	0	113.8	N472 F473 L478 Y479 N571 Q599 G602 T603	N472-Y476 WeakPolarHBondContact O-CB 3.44Å; N472-Y476 WeakPolarHBondContact O-CD2 3.48Å; N472-Y476 PolarHBondContact O-N 3.24Å; F473-Y476 PolarHBondContact O-N 2.97Å; Y476-L478 VanDerWaalsContact C-N 3.32Å; Y476-Y479 HydrophobicContact CD1-CE1 4.31Å; Y476-Y479 VanDerWaalsContact O-CD1 3.29Å; Y476-Y479 WeakPolarHBondContact O-CD1 3.36Å; Y476-N571 VanDerWaalsContact CE2-ND2 3.34Å; Y476-N571 WeakPolarHBondContact CE2-ND2 3.35Å; Y476-N571 PolarHBondContact OH-ND2 2.89Å; Y476-Q599 HydrophobicContact CD1-CB 3.65Å; Y476-Q599 HydrophobicContact CD1-CG 4.03Å; Y476-Q599 HydrophobicContact CD2-CB 4.07Å; Y476-Q599 HydrophobicContact CD2-CG 3.54Å; Y476-Q599 HydrophobicContact CE1-CB 3.87Å; Y476-Q599 HydrophobicContact CE1-CG 4.06Å; Y476-Q599 HydrophobicContact CE2-CB 4.27Å; Y476-Q599 VanDerWaalsContact CE2-CD 3.43Å; Y476-Q599 HydrophobicContact CE2-CG 3.56Å; Y476-Q599 VanDerWaalsContact CE2-NE2 3.34Å; Y476-Q599 HydrophobicContact CG-CB 3.73Å; Y476-Q599 HydrophobicContact CG-CG 3.76Å; Y476-Q599 VanDerWaalsContact CZ-CD 3.41Å; Y476-G602 CarbonylContact O-C 3.57Å; Y476-T603 PolarHBondContact O-N 3.2Å
477	A	92.9	Very high	92.6	Very high	7 Å²	7	23.4 Å²	23.4	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-74	-21.5	170.4	0	0	0	0	0	113.3	F473 L475 G602 G606	F473-A477 VanDerWaalsContact O-CB 3.28Å; F473-A477 WeakPolarHBondContact O-CB 3.49Å; F473-A477 PolarHBondContact O-N 3.46Å; L475-A477 VanDerWaalsContact C-N 3.28Å; L475-A477 PolarHBondContact O-N 2.98Å; A477-G602 WeakPolarHBondContact CA-O 3.27Å; A477-G606 WeakPolarHBondContact O-CA 3.29Å
478	L	93.1	Very high	92.2	Very high	10 Å²	10	25 Å²	25	5%	0.052	12%	0.12	C	C	.	.	H	α-helix	trans	-119.5	-15.2	-172.3	-61.7	175.9	0	0	0	113.9	L474 L475 Y476 D480 I481 L609	L474-L478 HydrophobicContact CD1-CD1 3.76Å; L474-L478 HydrophobicContact CG-CD1 4.23Å; L474-L478 WeakPolarHBondContact O-CG 3.41Å; L474-L478 PolarHBondContact O-N 3.44Å; L475-L478 CarbonylContact O-C 3.59Å; L475-L478 PolarHBondContact O-N 3.47Å; Y476-L478 VanDerWaalsContact C-N 3.32Å; L478-D480 PolarHBondContact O-N 2.71Å; L478-I481 HydrophobicContact CB-CD1 4.32Å; L478-I481 HydrophobicContact CD2-CD1 3.79Å; L478-I481 WeakPolarHBondContact O-CB 3.31Å; L478-I481 PolarHBondContact O-N 2.85Å; L478-L609 HydrophobicContact CD2-CD2 4.06Å
479	Y	89.7	Confident	91.9	Very high	33 Å²	33	25.4 Å²	25.4	13%	0.129	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	-175.4	93.1	-63	0	0	0	113.6	L475 Y476 I481 P482 Y483	L475-Y479 VanDerWaalsContact O-CB 3.32Å; L475-Y479 WeakPolarHBondContact O-CB 3.31Å; L475-Y479 PolarHBondContact O-N 3.45Å; Y476-Y479 HydrophobicContact CD1-CE1 4.31Å; Y476-Y479 VanDerWaalsContact O-CD1 3.29Å; Y476-Y479 WeakPolarHBondContact O-CD1 3.36Å; Y479-I481 VanDerWaalsContact C-N 3.31Å; Y479-P482 VanDerWaalsContact O-CD 3.31Å; Y479-P482 WeakPolarHBondContact O-CD 3.25Å; Y479-Y483 HydrophobicContact CD2-CD2 4.45Å; Y479-Y483 AromaticContact CD2-CE2 3.89Å; Y479-Y483 HydrophobicContact CD2-CE2 3.89Å; Y479-Y483 HydrophobicContact CE2-CD2 4.46Å; Y479-Y483 AromaticContact CE2-CE2 3.97Å; Y479-Y483 HydrophobicContact CE2-CE2 3.97Å; Y479-Y483 VanDerWaalsContact O-CD2 3.28Å; Y479-Y483 WeakPolarHBondContact O-CD2 3.43Å
480	D	86.8	Confident	91.6	Very high	21 Å²	21	24.8 Å²	24.8	11%	0.112	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21	177.6	-73.7	-42.3	0	0	0	112.4	L478 Y483 I484	L478-D480 PolarHBondContact O-N 2.71Å; D480-Y483 WeakPolarHBondContact O-CB 3.35Å; D480-Y483 PolarHBondContact O-N 3.43Å; D480-I484 HydrophobicContact CB-CD1 4.28Å; D480-I484 PolarHBondContact O-N 3.33Å; D480-I484 VanDerWaalsContact O-N 3.09Å
481	I	89.3	Confident	91.3	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.015	11%	0.113	C	C	.	.	H	α-helix	trans	-54.8	-49.1	-176.1	-70.5	166.4	0	0	0	111.8	L478 Y479 Y483 I484 N485 A610 T623 F624	L478-I481 HydrophobicContact CB-CD1 4.32Å; L478-I481 HydrophobicContact CD2-CD1 3.79Å; L478-I481 WeakPolarHBondContact O-CB 3.31Å; L478-I481 PolarHBondContact O-N 2.85Å; Y479-I481 VanDerWaalsContact C-N 3.31Å; I481-Y483 VanDerWaalsContact C-N 3.33Å; I481-Y483 PolarHBondContact O-N 3.11Å; I481-I484 PolarHBondContact O-N 3.4Å; I481-N485 VanDerWaalsContact O-CB 3.26Å; I481-N485 WeakPolarHBondContact O-CB 3.42Å; I481-N485 PolarHBondContact O-N 3.21Å; I481-A610 HydrophobicContact CG1-CB 3.78Å; I481-T623 HydrophobicContact CG1-CG2 4.49Å; I481-T623 HydrophobicContact CG2-CG2 3.91Å; I481-F624 HydrophobicContact CG2-CD1 4.19Å; I481-F624 HydrophobicContact CG2-CE1 4.44Å
482	P	88.2	Confident	90.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-35.6	175.8	-26.4	38	0	0	0	114.3	Y479 M486 I545 F564	Y479-P482 VanDerWaalsContact O-CD 3.31Å; Y479-P482 WeakPolarHBondContact O-CD 3.25Å; P482-M486 HydrophobicContact CB-CE 3.78Å; P482-M486 HydrophobicContact CB-CG 4.25Å; P482-M486 HydrophobicContact CB-SD 4.43Å; P482-M486 HydrophobicContact CG-CE 4.49Å; P482-M486 WeakPolarHBondContact O-CB 3.47Å; P482-M486 WeakPolarHBondContact O-CG 3.46Å; P482-M486 PolarHBondContact O-N 3.09Å; P482-I545 HydrophobicContact CG-CB 4.48Å; P482-I545 HydrophobicContact CG-CD1 3.44Å; P482-I545 VanDerWaalsContact CG-CD1 3.44Å; P482-I545 HydrophobicContact CG-CG1 3.57Å; P482-I545 HydrophobicContact CG-CG2 4.12Å; P482-F564 HydrophobicContact CB-CD1 4.25Å; P482-F564 HydrophobicContact CB-CD2 4.5Å; P482-F564 HydrophobicContact CB-CE1 3.94Å; P482-F564 HydrophobicContact CB-CE2 4.22Å; P482-F564 HydrophobicContact CB-CZ 3.93Å; P482-F564 HydrophobicContact CG-CD2 4.24Å; P482-F564 HydrophobicContact CG-CE1 4.34Å; P482-F564 HydrophobicContact CG-CE2 3.77Å; P482-F564 HydrophobicContact CG-CZ 3.82Å
483	Y	87.4	Confident	90.6	Very high	47 Å²	47	33.3 Å²	33.3	18%	0.184	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-40.2	-178.6	-72.1	-83.1	0	0	0	111.9	Y479 D480 I481 P487 I508 F564	Y479-Y483 HydrophobicContact CD2-CD2 4.45Å; Y479-Y483 AromaticContact CD2-CE2 3.89Å; Y479-Y483 HydrophobicContact CD2-CE2 3.89Å; Y479-Y483 HydrophobicContact CE2-CD2 4.46Å; Y479-Y483 AromaticContact CE2-CE2 3.97Å; Y479-Y483 HydrophobicContact CE2-CE2 3.97Å; Y479-Y483 VanDerWaalsContact O-CD2 3.28Å; Y479-Y483 WeakPolarHBondContact O-CD2 3.43Å; D480-Y483 WeakPolarHBondContact O-CB 3.35Å; D480-Y483 PolarHBondContact O-N 3.43Å; I481-Y483 VanDerWaalsContact C-N 3.33Å; I481-Y483 PolarHBondContact O-N 3.11Å; Y483-P487 WeakPolarHBondContact O-CD 3.44Å; Y483-I508 HydrophobicContact CD1-CD1 4.44Å; Y483-I508 HydrophobicContact CE1-CB 4.34Å; Y483-I508 HydrophobicContact CE1-CD1 4.4Å; Y483-I508 HydrophobicContact CE1-CG2 3.56Å; Y483-I508 WeakPolarHBondContact OH-CG2 3.43Å; Y483-F564 HydrophobicContact CD2-CE1 4.21Å; Y483-F564 HydrophobicContact CD2-CZ 4.38Å; Y483-F564 AromaticContact CE2-CE1 3.61Å; Y483-F564 HydrophobicContact CE2-CE1 3.61Å; Y483-F564 AromaticContact CE2-CZ 3.82Å; Y483-F564 HydrophobicContact CE2-CZ 3.82Å; Y483-F564 AromaticContact CZ-CE1 3.83Å
484	I	84.4	Confident	90.4	Very high	68 Å²	68	32.4 Å²	32.4	35%	0.349	16%	0.155	S	C	.	.	H	α-helix	trans	-84.3	-50.8	-178.1	-57.9	170.9	0	0	0	110.3	D480 I481 P607	D480-I484 HydrophobicContact CB-CD1 4.28Å; D480-I484 PolarHBondContact O-N 3.33Å; D480-I484 VanDerWaalsContact O-N 3.09Å; I481-I484 PolarHBondContact O-N 3.4Å; I484-P607 HydrophobicContact CD1-CB 4.04Å; I484-P607 HydrophobicContact CD1-CG 4.35Å
485	N	88.4	Confident	90	Very high	7 Å²	7	36 Å²	36	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-89.4	-24.4	-165.4	-62.5	35.5	0	0	0	113.7	I481 F489 Y620 T623 F624	I481-N485 VanDerWaalsContact O-CB 3.26Å; I481-N485 WeakPolarHBondContact O-CB 3.42Å; I481-N485 PolarHBondContact O-N 3.21Å; N485-F489 WeakPolarHBondContact O-CB 3.47Å; N485-F489 PolarHBondContact O-N 3.3Å; N485-Y620 HydrophobicContact CB-CD1 4.03Å; N485-Y620 HydrophobicContact CB-CE1 4.14Å; N485-T623 VanDerWaalsContact ND2-CG2 3.3Å; N485-T623 WeakPolarHBondContact ND2-CG2 3.31Å; N485-F624 HydrophobicContact CB-CE1 3.91Å; N485-F624 HydrophobicContact CB-CZ 3.8Å
486	M	90.1	Very high	89.6	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-46.8	179.1	-74.9	-163.9	-168	0	0	112.8	P482 E488 F489 A490 V548 I560 S561 F624	P482-M486 HydrophobicContact CB-CE 3.78Å; P482-M486 HydrophobicContact CB-CG 4.25Å; P482-M486 HydrophobicContact CB-SD 4.43Å; P482-M486 HydrophobicContact CG-CE 4.49Å; P482-M486 WeakPolarHBondContact O-CB 3.47Å; P482-M486 WeakPolarHBondContact O-CG 3.46Å; P482-M486 PolarHBondContact O-N 3.09Å; M486-E488 VanDerWaalsContact C-N 3.35Å; M486-E488 PolarHBondContact O-N 2.92Å; M486-F489 PolarHBondContact O-N 3.49Å; M486-A490 WeakPolarHBondContact O-CB 3.32Å; M486-A490 PolarHBondContact O-N 3.42Å; M486-V548 HydrophobicContact CE-CG2 3.29Å; M486-V548 HydrophobicContact CG-CG1 4.36Å; M486-V548 HydrophobicContact CG-CG2 4.44Å; M486-V548 HydrophobicContact SD-CG2 4.23Å; M486-I560 HydrophobicContact CE-CG2 4.34Å; M486-I560 HydrophobicContact SD-CG2 4.34Å; M486-S561 PolarHBondContact SD-OG 3.14Å; M486-F624 HydrophobicContact CG-CE1 3.94Å; M486-F624 HydrophobicContact CG-CZ 4.23Å
487	P	89.1	Confident	89.5	Confident	14 Å²	14	39.2 Å²	39.2	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-44.3	176.6	-23.3	34.2	0	0	0	112.1	Y483 F489 A490 M491 I505	Y483-P487 WeakPolarHBondContact O-CD 3.44Å; P487-F489 PolarHBondContact O-N 3.25Å; P487-A490 PolarHBondContact O-N 3.31Å; P487-M491 WeakPolarHBondContact O-CG 3.31Å; P487-M491 PolarHBondContact O-N 2.85Å; P487-I505 HydrophobicContact CG-CD1 3.89Å; P487-I505 HydrophobicContact CG-CG1 3.85Å
488	E	88.1	Confident	89.1	Confident	79 Å²	79	46.3 Å²	46.3	37%	0.369	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-46.5	177	-66.5	-177	175.6	0	0	112	M486 A490 M491 E492 Y620	M486-E488 VanDerWaalsContact C-N 3.35Å; M486-E488 PolarHBondContact O-N 2.92Å; E488-A490 VanDerWaalsContact C-N 3.33Å; E488-A490 PolarHBondContact O-N 3.46Å; E488-M491 HydrophobicContact CG-CE 4.37Å; E488-M491 PolarHBondContact O-N 2.9Å; E488-E492 PolarHBondContact O-N 3.4Å; E488-Y620 HydrophobicContact CB-CE1 4.21Å; E488-Y620 PolarHBondContact OE2-OH 3Å
489	F	91.2	Very high	88.7	Confident	9 Å²	9	53.7 Å²	53.7	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-34.2	179	-175.1	-121.2	0	0	0	112.7	N485 M486 P487 K493 V548 F557 Y620 H621 F624	N485-F489 WeakPolarHBondContact O-CB 3.47Å; N485-F489 PolarHBondContact O-N 3.3Å; M486-F489 PolarHBondContact O-N 3.49Å; P487-F489 PolarHBondContact O-N 3.25Å; F489-K493 HydrophobicContact CE1-CD 3.97Å; F489-K493 HydrophobicContact CE2-CB 4.46Å; F489-K493 HydrophobicContact CE2-CD 4.24Å; F489-K493 HydrophobicContact CZ-CD 3.65Å; F489-K493 WeakPolarHBondContact O-CB 3.31Å; F489-K493 PolarHBondContact O-N 3.08Å; F489-V548 HydrophobicContact CD1-CG1 3.98Å; F489-V548 HydrophobicContact CE1-CG1 4.18Å; F489-F557 AromaticContact CD1-CE1 3.8Å; F489-F557 HydrophobicContact CD1-CE1 3.8Å; F489-F557 AromaticContact CD1-CZ 3.53Å; F489-F557 HydrophobicContact CD1-CZ 3.53Å; F489-F557 HydrophobicContact CE1-CE1 4.38Å; F489-F557 AromaticContact CE1-CZ 3.83Å; F489-F557 HydrophobicContact CE1-CZ 3.83Å; F489-Y620 HydrophobicContact CB-CG 4.35Å; F489-Y620 HydrophobicContact CD2-CD2 4.03Å; F489-Y620 AromaticContact CD2-CG 3.96Å; F489-Y620 HydrophobicContact CD2-CG 3.96Å; F489-H621 AromaticContact CE2-NE2 3.95Å; F489-H621 AromaticContact CZ-NE2 3.7Å; F489-F624 HydrophobicContact CB-CE2 3.85Å; F489-F624 HydrophobicContact CB-CZ 3.98Å; F489-F624 AromaticContact CD1-CE2 3.66Å; F489-F624 HydrophobicContact CD1-CE2 3.66Å; F489-F624 HydrophobicContact CD1-CZ 4.27Å; F489-F624 HydrophobicContact CD2-CE2 4.31Å; F489-F624 HydrophobicContact CE1-CE2 4.27Å; F489-F624 AromaticContact CG-CE2 3.69Å; F489-F624 HydrophobicContact CG-CE2 3.69Å; F489-F624 HydrophobicContact CG-CZ 4.29Å
490	A	92	Very high	88.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-39.8	173.7	0	0	0	0	0	111.9	M486 P487 E488 L494 L504 F557	M486-A490 WeakPolarHBondContact O-CB 3.32Å; M486-A490 PolarHBondContact O-N 3.42Å; P487-A490 PolarHBondContact O-N 3.31Å; E488-A490 VanDerWaalsContact C-N 3.33Å; E488-A490 PolarHBondContact O-N 3.46Å; A490-L494 WeakPolarHBondContact O-CB 3.27Å; A490-L494 PolarHBondContact O-N 3.18Å; A490-L494 VanDerWaalsContact O-N 3.12Å; A490-L504 HydrophobicContact CB-CD1 3.96Å; A490-F557 HydrophobicContact CB-CD1 4.25Å; A490-F557 HydrophobicContact CB-CD2 4.43Å; A490-F557 HydrophobicContact CB-CE1 4.24Å; A490-F557 HydrophobicContact CB-CE2 4.45Å; A490-F557 HydrophobicContact CB-CG 4.35Å; A490-F557 HydrophobicContact CB-CZ 4.34Å
491	M	89.8	Confident	88.7	Confident	67 Å²	67	53.3 Å²	53.3	33%	0.33	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-45.7	173.8	-69.2	-171.9	-67.5	0	0	111.6	P487 E488 S495 E498 S501	P487-M491 WeakPolarHBondContact O-CG 3.31Å; P487-M491 PolarHBondContact O-N 2.85Å; E488-M491 HydrophobicContact CG-CE 4.37Å; E488-M491 PolarHBondContact O-N 2.9Å; M491-S495 WeakPolarHBondContact O-CA 3.33Å; M491-S495 PolarHBondContact O-N 3.46Å; M491-E498 HydrophobicContact SD-CB 4.23Å; M491-E498 HydrophobicContact SD-CG 4.41Å; M491-S501 WeakPolarHBondContact CG-OG 3.29Å
492	E	89	Confident	88.5	Confident	123 Å²	123	55.9 Å²	55.9	58%	0.575	30%	0.299	S	S	*	.	H	α-helix	trans	-68.2	-50.1	-179.3	-171.3	-174.2	178.9	0	0	112	E488 Y620	E488-E492 PolarHBondContact O-N 3.4Å; E492-Y620 WeakPolarHBondContact OE2-CD2 3.35Å; E492-Y620 WeakPolarHBondContact OE2-CE2 3.35Å
493	K	89.9	Confident	88.6	Confident	78 Å²	78	59.6 Å²	59.6	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-74.9	-35.5	-171.7	-170.5	174.5	-178	-174	0	113.5	F489 P549 V551 N552	F489-K493 HydrophobicContact CE1-CD 3.97Å; F489-K493 HydrophobicContact CE2-CB 4.46Å; F489-K493 HydrophobicContact CE2-CD 4.24Å; F489-K493 HydrophobicContact CZ-CD 3.65Å; F489-K493 WeakPolarHBondContact O-CB 3.31Å; F489-K493 PolarHBondContact O-N 3.08Å; K493-P549 PolarHBondContact NZ-O 2.99Å; K493-V551 WeakPolarHBondContact CE-O 3.49Å; K493-V551 PolarHBondContact NZ-O 3.28Å; K493-N552 PolarHBondContact NZ-OD1 2.99Å
494	L	91.2	Very high	88.8	Confident	57 Å²	57	57.4 Å²	57.4	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-113.5	-2.3	-176.4	-75.2	123.4	0	0	0	113.9	A490 V496 F557	A490-L494 WeakPolarHBondContact O-CB 3.27Å; A490-L494 PolarHBondContact O-N 3.18Å; A490-L494 VanDerWaalsContact O-N 3.12Å; L494-V496 HydrophobicContact CB-CG2 3.52Å; L494-V496 PolarHBondContact O-N 3.3Å; L494-F557 HydrophobicContact CD1-CD2 3.61Å; L494-F557 HydrophobicContact CD1-CE2 3.31Å; L494-F557 HydrophobicContact CD1-CZ 4.44Å
495	S	87.8	Confident	88.9	Confident	110 Å²	110	57.7 Å²	57.7	77%	0.769	31%	0.311	S	S	*	.			trans	53.7	37.2	-175.2	-57.8	0	0	0	0	112.7	M491	M491-S495 WeakPolarHBondContact O-CA 3.33Å; M491-S495 PolarHBondContact O-N 3.46Å
496	V	89.2	Confident	88.9	Confident	29 Å²	29	60.6 Å²	60.6	18%	0.176	33%	0.331	C	S	.	.			trans	-75.3	148.1	179.2	176	0	0	0	0	109.6	L494 Y554	L494-V496 HydrophobicContact CB-CG2 3.52Å; L494-V496 PolarHBondContact O-N 3.3Å; V496-Y554 HydrophobicContact CG1-CD2 4.19Å; V496-Y554 HydrophobicContact CG1-CE2 4.18Å; V496-Y554 HydrophobicContact CG2-CD2 4.3Å
497	A	91.5	Very high	89	Confident	61 Å²	61	62.1 Å²	62.1	50%	0.504	34%	0.339	S	S	.	.			trans	-62.9	152.9	175.8	0	0	0	0	0	112.2	E499 S500 S501	A497-E499 VanDerWaalsContact C-N 3.27Å; A497-E499 PolarHBondContact O-N 2.96Å; A497-S500 PolarHBondContact O-N 3.25Å; A497-S500 VanDerWaalsContact O-N 3.14Å; A497-S501 PolarHBondContact O-N 3.43Å; A497-S501 PolarHBondContact O-OG 2.9Å; A497-S501 VanDerWaalsContact O-OG 3.04Å
498	E	85.3	Confident	89.1	Confident	156 Å²	156	61.5 Å²	61.5	73%	0.729	34%	0.335	S	S	*	.	H	α-helix	trans	-57.5	-39.9	177.8	-171.9	177.6	176.7	0	0	112	M491 S500 S501 S502	M491-E498 HydrophobicContact SD-CB 4.23Å; M491-E498 HydrophobicContact SD-CG 4.41Å; E498-S500 PolarHBondContact O-N 3.4Å; E498-S501 PolarHBondContact O-N 3.3Å; E498-S501 VanDerWaalsContact O-N 3.15Å; E498-S502 PolarHBondContact O-N 3.02Å
499	E	84.7	Confident	89.1	Confident	164 Å²	164	59.3 Å²	59.3	77%	0.766	33%	0.334	S	S	*	.	H	α-helix	trans	-61.9	-41.8	176.2	-174.6	-175.2	175.9	0	0	112.8	A497 S501 S502 M503	A497-E499 VanDerWaalsContact C-N 3.27Å; A497-E499 PolarHBondContact O-N 2.96Å; E499-S501 VanDerWaalsContact C-N 3.31Å; E499-S502 PolarHBondContact O-OG 2.98Å; E499-M503 PolarHBondContact O-N 3.47Å
500	S	88	Confident	89.1	Confident	45 Å²	45	63.6 Å²	63.6	32%	0.315	36%	0.356	S	S	.	.	H	α-helix	trans	-71.1	-30.6	175.9	-66.9	0	0	0	0	111.4	A497 E498 M503 Y554	A497-S500 PolarHBondContact O-N 3.25Å; A497-S500 VanDerWaalsContact O-N 3.14Å; E498-S500 PolarHBondContact O-N 3.4Å; S500-M503 VanDerWaalsContact O-CB 3.23Å; S500-M503 WeakPolarHBondContact O-CB 3.33Å; S500-M503 PolarHBondContact O-N 3.27Å; S500-Y554 WeakPolarHBondContact O-CE2 3.36Å; S500-Y554 PolarHBondContact O-OH 3.39Å
501	S	88.6	Confident	89.2	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	37%	0.366	C	S	.	.	H	α-helix	trans	-74.1	-36.3	177.9	-55.7	0	0	0	0	112.1	M491 A497 E498 E499 M503 L504	M491-S501 WeakPolarHBondContact CG-OG 3.29Å; A497-S501 PolarHBondContact O-N 3.43Å; A497-S501 PolarHBondContact O-OG 2.9Å; A497-S501 VanDerWaalsContact O-OG 3.04Å; E498-S501 PolarHBondContact O-N 3.3Å; E498-S501 VanDerWaalsContact O-N 3.15Å; E499-S501 VanDerWaalsContact C-N 3.31Å; S501-M503 PolarHBondContact O-N 2.94Å; S501-L504 WeakPolarHBondContact O-CB 3.38Å; S501-L504 PolarHBondContact O-N 3.15Å; S501-L504 VanDerWaalsContact O-N 3.17Å
502	S	85.7	Confident	89.4	Confident	57 Å²	57	62.9 Å²	62.9	40%	0.399	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-26.2	173.1	72.1	0	0	0	0	112.6	E498 E499 L504 I505 S506	E498-S502 PolarHBondContact O-N 3.02Å; E499-S502 PolarHBondContact O-OG 2.98Å; S502-L504 PolarHBondContact O-N 2.96Å; S502-I505 PolarHBondContact O-N 3.14Å; S502-I505 VanDerWaalsContact O-N 3.13Å; S502-S506 PolarHBondContact O-N 3.38Å
503	M	89	Confident	89.5	Confident	78 Å²	78	59.7 Å²	59.7	38%	0.384	34%	0.34	S	S	.	.	H	α-helix	trans	-57.1	-29.6	172.2	-160.7	178.9	95.2	0	0	112.6	E499 S500 S501 S506 I507 Y554	E499-M503 PolarHBondContact O-N 3.47Å; S500-M503 VanDerWaalsContact O-CB 3.23Å; S500-M503 WeakPolarHBondContact O-CB 3.33Å; S500-M503 PolarHBondContact O-N 3.27Å; S501-M503 PolarHBondContact O-N 2.94Å; M503-S506 WeakPolarHBondContact O-CB 3.27Å; M503-S506 PolarHBondContact O-N 3.27Å; M503-I507 HydrophobicContact CE-CD1 3.83Å; M503-I507 HydrophobicContact CG-CD1 4.33Å; M503-I507 VanDerWaalsContact O-CG1 3.27Å; M503-I507 WeakPolarHBondContact O-CG1 3.39Å; M503-I507 PolarHBondContact O-N 2.91Å; M503-Y554 HydrophobicContact CE-CE1 3.93Å; M503-Y554 WeakPolarHBondContact CE-OH 3.43Å
504	L	91.6	Very high	89.7	Confident	1 Å²	1	61 Å²	61	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-63.6	-43.1	176.8	-61.6	175.6	0	0	0	111.9	A490 S501 S502 S506 I507 I508 Y554 F557	A490-L504 HydrophobicContact CB-CD1 3.96Å; S501-L504 WeakPolarHBondContact O-CB 3.38Å; S501-L504 PolarHBondContact O-N 3.15Å; S501-L504 VanDerWaalsContact O-N 3.17Å; S502-L504 PolarHBondContact O-N 2.96Å; L504-S506 VanDerWaalsContact C-N 3.33Å; L504-I507 PolarHBondContact O-N 3.41Å; L504-I508 WeakPolarHBondContact O-CG1 3.47Å; L504-I508 PolarHBondContact O-N 3.02Å; L504-Y554 HydrophobicContact CD2-CE2 4.37Å; L504-F557 HydrophobicContact CD1-CB 4.22Å; L504-F557 HydrophobicContact CD1-CD1 4.35Å; L504-F557 HydrophobicContact CD2-CB 3.9Å
505	I	87.2	Confident	89.9	Confident	75 Å²	75	58.3 Å²	58.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.4	-60.2	171.2	0	0	0	109.7	P487 S502 I507 I508 G509	P487-I505 HydrophobicContact CG-CD1 3.89Å; P487-I505 HydrophobicContact CG-CG1 3.85Å; S502-I505 PolarHBondContact O-N 3.14Å; S502-I505 VanDerWaalsContact O-N 3.13Å; I505-I507 VanDerWaalsContact C-N 3.35Å; I505-I507 PolarHBondContact O-N 2.91Å; I505-I508 WeakPolarHBondContact O-CB 3.17Å; I505-I508 PolarHBondContact O-N 3.12Å; I505-G509 PolarHBondContact O-N 2.94Å
506	S	87.6	Confident	90.3	Very high	67 Å²	67	53.2 Å²	53.2	47%	0.469	30%	0.301	S	S	.	.	H	α-helix	trans	-61.1	-41.5	176.7	-61.8	0	0	0	0	112.3	S502 M503 L504 G509 I510	S502-S506 PolarHBondContact O-N 3.38Å; M503-S506 WeakPolarHBondContact O-CB 3.27Å; M503-S506 PolarHBondContact O-N 3.27Å; L504-S506 VanDerWaalsContact C-N 3.33Å; S506-G509 PolarHBondContact O-N 2.94Å; S506-I510 WeakPolarHBondContact O-CG1 3.43Å; S506-I510 PolarHBondContact O-N 3.48Å
507	I	91.6	Very high	90.6	Very high	33 Å²	33	55.5 Å²	55.5	17%	0.169	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.1	-70.9	164.1	0	0	0	110.7	M503 L504 I505 G509 I510 V511 C558 A562	M503-I507 HydrophobicContact CE-CD1 3.83Å; M503-I507 HydrophobicContact CG-CD1 4.33Å; M503-I507 VanDerWaalsContact O-CG1 3.27Å; M503-I507 WeakPolarHBondContact O-CG1 3.39Å; M503-I507 PolarHBondContact O-N 2.91Å; L504-I507 PolarHBondContact O-N 3.41Å; I505-I507 VanDerWaalsContact C-N 3.35Å; I505-I507 PolarHBondContact O-N 2.91Å; I507-G509 VanDerWaalsContact C-N 3.3Å; I507-G509 PolarHBondContact O-N 3.39Å; I507-I510 PolarHBondContact O-N 3.45Å; I507-V511 HydrophobicContact CG2-CG2 4.26Å; I507-V511 WeakPolarHBondContact O-CB 3.36Å; I507-V511 VanDerWaalsContact O-CG2 3.32Å; I507-V511 WeakPolarHBondContact O-CG2 3.47Å; I507-V511 PolarHBondContact O-N 2.63Å; I507-C558 HydrophobicContact CD1-CB 3.89Å; I507-A562 HydrophobicContact CG2-CB 3.81Å
508	I	91.7	Very high	90.8	Very high	2 Å²	2	57 Å²	57	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-48.4	175.9	-65.9	165.6	0	0	0	109.8	Y483 L504 I505 N512 S561 F564	Y483-I508 HydrophobicContact CD1-CD1 4.44Å; Y483-I508 HydrophobicContact CE1-CB 4.34Å; Y483-I508 HydrophobicContact CE1-CD1 4.4Å; Y483-I508 HydrophobicContact CE1-CG2 3.56Å; Y483-I508 WeakPolarHBondContact OH-CG2 3.43Å; L504-I508 WeakPolarHBondContact O-CG1 3.47Å; L504-I508 PolarHBondContact O-N 3.02Å; I505-I508 WeakPolarHBondContact O-CB 3.17Å; I505-I508 PolarHBondContact O-N 3.12Å; I508-N512 WeakPolarHBondContact O-CB 3.4Å; I508-N512 PolarHBondContact O-N 3.32Å; I508-S561 WeakPolarHBondContact CG1-O 3.28Å; I508-F564 HydrophobicContact CD1-CD1 3.93Å; I508-F564 HydrophobicContact CD1-CE1 4.28Å; I508-F564 HydrophobicContact CG1-CD1 4.12Å; I508-F564 HydrophobicContact CG2-CD1 4.01Å; I508-F564 HydrophobicContact CG2-CE1 4.1Å
509	G	89.3	Confident	91.3	Very high	33 Å²	33	49.9 Å²	49.9	34%	0.34	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-48.2	-179.9	0	0	0	0	0	113.7	I505 S506 I507 N512 M513	I505-G509 PolarHBondContact O-N 2.94Å; S506-G509 PolarHBondContact O-N 2.94Å; I507-G509 VanDerWaalsContact C-N 3.3Å; I507-G509 PolarHBondContact O-N 3.39Å; G509-N512 PolarHBondContact O-N 3.45Å; G509-M513 PolarHBondContact O-N 3.32Å
510	I	90.2	Very high	91.8	Very high	99 Å²	99	42.1 Å²	42.1	51%	0.508	24%	0.241	S	C	.	.	H	α-helix	trans	-64.1	-47.3	-179.3	-66.4	165.4	0	0	0	110.9	S506 I507 M513 L514	S506-I510 WeakPolarHBondContact O-CG1 3.43Å; S506-I510 PolarHBondContact O-N 3.48Å; I507-I510 PolarHBondContact O-N 3.45Å; I510-M513 PolarHBondContact O-N 3.25Å; I510-L514 HydrophobicContact CG2-CD1 4.42Å; I510-L514 PolarHBondContact O-N 2.81Å
511	V	94.5	Very high	92.2	Very high	35 Å²	35	43 Å²	43	21%	0.212	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-40.4	-178.9	177.1	0	0	0	0	110.9	I507 M513 L514 A515 A562 F566	I507-V511 HydrophobicContact CG2-CG2 4.26Å; I507-V511 WeakPolarHBondContact O-CB 3.36Å; I507-V511 VanDerWaalsContact O-CG2 3.32Å; I507-V511 WeakPolarHBondContact O-CG2 3.47Å; I507-V511 PolarHBondContact O-N 2.63Å; V511-M513 VanDerWaalsContact C-N 3.35Å; V511-M513 PolarHBondContact O-N 2.85Å; V511-L514 PolarHBondContact O-N 3.19Å; V511-A515 WeakPolarHBondContact O-CB 3.49Å; V511-A515 PolarHBondContact O-N 3.3Å; V511-A562 WeakPolarHBondContact CG1-O 3.42Å; V511-A562 HydrophobicContact CG2-CB 3.96Å; V511-F566 HydrophobicContact CG1-CB 3.74Å; V511-F566 HydrophobicContact CG1-CD2 4.15Å; V511-F566 HydrophobicContact CG1-CG 4.47Å
512	N	93.3	Very high	92.6	Very high	16 Å²	16	46 Å²	46	9%	0.086	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-48.1	174.6	-177.8	24.4	0	0	0	111.2	I508 G509 L514 A515 M516 G565 S569	I508-N512 WeakPolarHBondContact O-CB 3.4Å; I508-N512 PolarHBondContact O-N 3.32Å; G509-N512 PolarHBondContact O-N 3.45Å; N512-L514 PolarHBondContact O-N 3.34Å; N512-A515 PolarHBondContact O-N 2.97Å; N512-M516 VanDerWaalsContact ND2-CE 3.34Å; N512-M516 WeakPolarHBondContact ND2-CE 3.31Å; N512-M516 WeakPolarHBondContact O-CG 3.44Å; N512-M516 PolarHBondContact O-N 2.82Å; N512-M516 VanDerWaalsContact OD1-CE 3.23Å; N512-M516 WeakPolarHBondContact OD1-CE 3.44Å; N512-G565 WeakPolarHBondContact CA-O 3.47Å; N512-S569 WeakPolarHBondContact OD1-CA 3.21Å; N512-S569 WeakPolarHBondContact OD1-CB 3.29Å
513	M	91.4	Very high	93.1	Very high	56 Å²	56	43.5 Å²	43.5	28%	0.276	24%	0.242	S	C	.	.	H	α-helix	trans	-59.5	-44.5	178.9	-170.4	-177.3	72.7	0	0	112.7	C189 L193 G509 I510 V511	C189-M513 HydrophobicContact CB-CG 4.35Å; L193-M513 HydrophobicContact CB-SD 4.46Å; G509-M513 PolarHBondContact O-N 3.32Å; I510-M513 PolarHBondContact O-N 3.25Å; V511-M513 VanDerWaalsContact C-N 3.35Å; V511-M513 PolarHBondContact O-N 2.85Å
514	L	94.2	Very high	93.4	Very high	106 Å²	106	41.4 Å²	41.4	56%	0.555	23%	0.233	S	C	*	.	H	α-helix	trans	-67.5	-39	176.6	-66.1	175	0	0	0	112.1	I510 V511 N512 L517 L518	I510-L514 HydrophobicContact CG2-CD1 4.42Å; I510-L514 PolarHBondContact O-N 2.81Å; V511-L514 PolarHBondContact O-N 3.19Å; N512-L514 PolarHBondContact O-N 3.34Å; L514-L517 PolarHBondContact O-N 3.48Å; L514-L518 PolarHBondContact O-N 3.46Å
515	A	96.5	Very high	93.5	Very high	1 Å²	1	48 Å²	48	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-34.9	-179.9	0	0	0	0	0	112.2	V511 N512 L517 L518 F519 F566 S569	V511-A515 WeakPolarHBondContact O-CB 3.49Å; V511-A515 PolarHBondContact O-N 3.3Å; N512-A515 PolarHBondContact O-N 2.97Å; A515-L517 VanDerWaalsContact C-N 3.32Å; A515-L517 PolarHBondContact O-N 3.08Å; A515-L518 PolarHBondContact O-N 3.45Å; A515-F519 WeakPolarHBondContact O-CB 3.07Å; A515-F519 WeakPolarHBondContact O-CG 3.44Å; A515-F519 PolarHBondContact O-N 3.17Å; A515-F566 HydrophobicContact CB-CD2 3.61Å; A515-F566 HydrophobicContact CB-CE2 4Å; A515-F566 HydrophobicContact CB-CG 4.17Å; A515-S569 WeakPolarHBondContact CB-OG 3.33Å
516	M	95.5	Very high	93.6	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-43.2	173.7	-74.6	-173	-164.6	0	0	112.2	V188 N512 G520 Y572	V188-M516 HydrophobicContact CB-SD 4.22Å; V188-M516 HydrophobicContact CG1-CE 4.12Å; V188-M516 HydrophobicContact CG1-SD 3.88Å; N512-M516 VanDerWaalsContact ND2-CE 3.34Å; N512-M516 WeakPolarHBondContact ND2-CE 3.31Å; N512-M516 WeakPolarHBondContact O-CG 3.44Å; N512-M516 PolarHBondContact O-N 2.82Å; N512-M516 VanDerWaalsContact OD1-CE 3.23Å; N512-M516 WeakPolarHBondContact OD1-CE 3.44Å; M516-G520 PolarHBondContact O-N 3.4Å; M516-Y572 HydrophobicContact CE-CD1 4.28Å; M516-Y572 HydrophobicContact CE-CD2 3.54Å; M516-Y572 HydrophobicContact CE-CE2 4.32Å; M516-Y572 HydrophobicContact CE-CG 3.51Å
517	L	94.8	Very high	93.8	Very high	78 Å²	78	57.5 Å²	57.5	41%	0.408	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-45.4	176.2	-64.4	175.1	0	0	0	111.2	I186 C189 L514 A515 G520 V521	I186-L517 HydrophobicContact CG1-CD2 3.79Å; C189-L517 VanDerWaalsContact SG-CD2 3.59Å; L514-L517 PolarHBondContact O-N 3.48Å; A515-L517 VanDerWaalsContact C-N 3.32Å; A515-L517 PolarHBondContact O-N 3.08Å; L517-G520 PolarHBondContact O-N 3.18Å; L517-V521 WeakPolarHBondContact O-CG2 3.36Å; L517-V521 PolarHBondContact O-N 3.2Å
518	L	96.3	Very high	93.8	Very high	93 Å²	93	57.4 Å²	57.4	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-47.5	179.2	179.7	66.7	0	0	0	111.8	L514 A515 V521 L522 F566	L514-L518 PolarHBondContact O-N 3.46Å; A515-L518 PolarHBondContact O-N 3.45Å; L518-V521 PolarHBondContact O-N 2.92Å; L518-L522 WeakPolarHBondContact O-CB 3.39Å; L518-L522 PolarHBondContact O-N 3.48Å; L518-F566 HydrophobicContact CD2-CE2 3.85Å; L518-F566 HydrophobicContact CD2-CZ 3.79Å
519	F	96.7	Very high	94	Very high	6 Å²	6	60.7 Å²	60.7	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-70.2	-34.3	-178.1	-76.7	9	0	0	0	111.7	A515 L522 A523 F533 F566 S569 A570	A515-F519 WeakPolarHBondContact O-CB 3.07Å; A515-F519 WeakPolarHBondContact O-CG 3.44Å; A515-F519 PolarHBondContact O-N 3.17Å; F519-L522 PolarHBondContact O-N 3.33Å; F519-A523 WeakPolarHBondContact O-CB 3.18Å; F519-A523 PolarHBondContact O-N 2.86Å; F519-F533 HydrophobicContact CB-CE1 4.27Å; F519-F533 HydrophobicContact CB-CZ 4.34Å; F519-F533 HydrophobicContact CD1-CE1 4.38Å; F519-F533 AromaticContact CD1-CZ 3.66Å; F519-F533 HydrophobicContact CD1-CZ 3.66Å; F519-F533 HydrophobicContact CD2-CE1 4.46Å; F519-F533 AromaticContact CD2-CZ 3.95Å; F519-F533 HydrophobicContact CD2-CZ 3.95Å; F519-F533 HydrophobicContact CE1-CE2 4.4Å; F519-F533 AromaticContact CE1-CZ 3.82Å; F519-F533 HydrophobicContact CE1-CZ 3.82Å; F519-F533 HydrophobicContact CE2-CZ 4.11Å; F519-F533 HydrophobicContact CG-CE1 4.13Å; F519-F533 AromaticContact CG-CZ 3.72Å; F519-F533 HydrophobicContact CG-CZ 3.72Å; F519-F533 HydrophobicContact CZ-CE2 4.33Å; F519-F533 HydrophobicContact CZ-CZ 4.05Å; F519-F566 HydrophobicContact CE1-CD1 4.35Å; F519-F566 AromaticContact CE1-CE1 3.56Å; F519-F566 HydrophobicContact CE1-CE1 3.56Å; F519-F566 HydrophobicContact CE1-CE2 4.39Å; F519-F566 AromaticContact CE1-CZ 3.58Å; F519-F566 HydrophobicContact CE1-CZ 3.58Å; F519-F566 WeakPolarHBondContact CE2-O 3.4Å; F519-F566 AromaticContact CZ-CD1 3.9Å; F519-F566 HydrophobicContact CZ-CD1 3.9Å; F519-F566 AromaticContact CZ-CE1 3.49Å; F519-F566 HydrophobicContact CZ-CE1 3.49Å; F519-F566 VanDerWaalsContact CZ-CE1 3.49Å; F519-F566 AromaticContact CZ-CZ 3.98Å; F519-F566 HydrophobicContact CZ-CZ 3.98Å; F519-S569 WeakPolarHBondContact CD2-OG 3.33Å; F519-S569 VanDerWaalsContact CE2-OG 3.24Å; F519-S569 WeakPolarHBondContact CE2-OG 3.46Å; F519-A570 HydrophobicContact CD2-CB 3.7Å; F519-A570 HydrophobicContact CE2-CB 3.76Å
520	G	95.4	Very high	94.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.7	-49	172	0	0	0	0	0	111.6	A181 M182 M516 L517 L522 D524	A181-G520 WeakPolarHBondContact O-CA 3.32Å; M182-G520 PolarHBondContact N-O 2.88Å; M516-G520 PolarHBondContact O-N 3.4Å; L517-G520 PolarHBondContact O-N 3.18Å; G520-L522 PolarHBondContact O-N 2.9Å; G520-D524 PolarHBondContact O-N 2.79Å
521	V	96.4	Very high	94.5	Very high	64 Å²	64	55.9 Å²	55.9	39%	0.388	28%	0.283	S	S	.	.	H	α-helix	trans	-67.6	-34.7	177.6	175.6	0	0	0	0	112.5	M182 L517 L518	M182-V521 HydrophobicContact CG-CG2 4.14Å; M182-V521 HydrophobicContact SD-CG2 4.15Å; L517-V521 WeakPolarHBondContact O-CG2 3.36Å; L517-V521 PolarHBondContact O-N 3.2Å; L518-V521 PolarHBondContact O-N 2.92Å
522	L	96.2	Very high	94.6	Very high	65 Å²	65	57.4 Å²	57.4	34%	0.34	29%	0.29	S	S	.	.	H	α-helix	trans	-73.2	-38.8	179.9	-176.7	59.5	0	0	0	112.3	L518 F519 G520 D524 R525 V528 F533	L518-L522 WeakPolarHBondContact O-CB 3.39Å; L518-L522 PolarHBondContact O-N 3.48Å; F519-L522 PolarHBondContact O-N 3.33Å; G520-L522 PolarHBondContact O-N 2.9Å; L522-D524 VanDerWaalsContact C-N 3.35Å; L522-R525 VanDerWaalsContact O-CB 3.31Å; L522-R525 WeakPolarHBondContact O-CB 3.37Å; L522-R525 WeakPolarHBondContact O-CG 3.11Å; L522-R525 PolarHBondContact O-N 3.25Å; L522-V528 HydrophobicContact CD1-CG2 4.29Å; L522-V528 HydrophobicContact CG-CG2 4.49Å; L522-V528 WeakPolarHBondContact O-CG2 3.46Å; L522-F533 HydrophobicContact CB-CE1 4.49Å; L522-F533 HydrophobicContact CD2-CE1 4.07Å; L522-F533 HydrophobicContact CD2-CE2 4.37Å; L522-F533 HydrophobicContact CD2-CZ 3.75Å; L522-F533 HydrophobicContact CG-CE1 4.3Å; L522-F533 HydrophobicContact CG-CZ 4.47Å
523	A	95.2	Very high	94.8	Very high	3 Å²	3	58.5 Å²	58.5	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-73.3	-24	-177.4	0	0	0	0	0	114.1	A181 F519 R525 N530 F533 L574	A181-A523 HydrophobicContact CB-CB 3.62Å; F519-A523 WeakPolarHBondContact O-CB 3.18Å; F519-A523 PolarHBondContact O-N 2.86Å; A523-R525 PolarHBondContact O-N 3.07Å; A523-N530 WeakPolarHBondContact CA-OD1 3.37Å; A523-N530 WeakPolarHBondContact CB-OD1 3.31Å; A523-N530 PolarHBondContact O-ND2 3.46Å; A523-N530 PolarHBondContact O-OD1 2.91Å; A523-F533 HydrophobicContact CB-CD1 4.39Å; A523-F533 HydrophobicContact CB-CE1 4.46Å; A523-L574 HydrophobicContact CB-CD2 3.22Å
524	D	95	Very high	95.1	Very high	35 Å²	35	55.9 Å²	55.9	19%	0.187	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	3	172.8	-70.4	-28.5	0	0	0	112.9	R179 R180 A181 M182 G520 L522	R179-D524 WeakPolarHBondContact CA-OD2 3.23Å; R180-D524 PolarHBondContact N-OD1 3.04Å; A181-D524 WeakPolarHBondContact CB-OD1 3.32Å; A181-D524 PolarHBondContact N-OD1 3.03Å; M182-D524 WeakPolarHBondContact CB-OD2 3.34Å; M182-D524 PolarHBondContact N-OD2 3.4Å; G520-D524 PolarHBondContact O-N 2.79Å; L522-D524 VanDerWaalsContact C-N 3.35Å
525	R	94.7	Very high	95.2	Very high	138 Å²	138	50.8 Å²	50.8	52%	0.521	25%	0.254	S	S	.	.	S	Bend	trans	-81.3	130.2	176.4	-63	-63.5	-176.9	170.3	0.1	111	L522 A523 F527 V528	L522-R525 VanDerWaalsContact O-CB 3.31Å; L522-R525 WeakPolarHBondContact O-CB 3.37Å; L522-R525 WeakPolarHBondContact O-CG 3.11Å; L522-R525 PolarHBondContact O-N 3.25Å; A523-R525 PolarHBondContact O-N 3.07Å; R525-F527 HydrophobicContact CB-CD1 3.94Å; R525-F527 HydrophobicContact CB-CE1 3.55Å; R525-F527 HydrophobicContact CB-CE2 4.49Å; R525-F527 HydrophobicContact CB-CZ 3.85Å; R525-F527 HydrophobicContact CG-CE1 3.95Å; R525-F527 HydrophobicContact CG-CZ 4.1Å; R525-F527 PolarHBondContact O-N 3.44Å; R525-V528 HydrophobicContact CB-CG2 4.06Å; R525-V528 PolarHBondContact O-N 3.32Å
526	D	89.1	Confident	95.3	Very high	174 Å²	174	53.8 Å²	53.8	93%	0.93	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.2	-176.8	-55.4	-41.5	0	0	0	115.5
527	F	91.2	Very high	95.4	Very high	168 Å²	168	53.8 Å²	53.8	74%	0.737	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.9	179.3	63.6	-96.7	0	0	0	113.9	R525	R525-F527 HydrophobicContact CB-CD1 3.94Å; R525-F527 HydrophobicContact CB-CE1 3.55Å; R525-F527 HydrophobicContact CB-CE2 4.49Å; R525-F527 HydrophobicContact CB-CZ 3.85Å; R525-F527 HydrophobicContact CG-CE1 3.95Å; R525-F527 HydrophobicContact CG-CZ 4.1Å; R525-F527 PolarHBondContact O-N 3.44Å
528	V	93.1	Very high	95.5	Very high	31 Å²	31	50.4 Å²	50.4	19%	0.188	26%	0.255	C	S	.	.			trans	-95.2	128.3	-178	179	0	0	0	0	109.4	L522 R525 F533	L522-V528 HydrophobicContact CD1-CG2 4.29Å; L522-V528 HydrophobicContact CG-CG2 4.49Å; L522-V528 WeakPolarHBondContact O-CG2 3.46Å; R525-V528 HydrophobicContact CB-CG2 4.06Å; R525-V528 PolarHBondContact O-N 3.32Å; V528-F533 HydrophobicContact CG1-CB 3.98Å; V528-F533 HydrophobicContact CG1-CD1 3.99Å; V528-F533 HydrophobicContact CG1-CG 4.2Å
529	N	94.6	Very high	95.6	Very high	72 Å²	72	47 Å²	47	39%	0.385	24%	0.239	S	C	.	.			trans	-91.9	112.8	168.1	-175.9	-68	0	0	0	109	T531 L532 F533 F642	N529-T531 VanDerWaalsContact C-N 3.33Å; N529-T531 PolarHBondContact O-N 3.43Å; N529-T531 WeakPolarHBondContact OD1-CB 3.31Å; N529-T531 PolarHBondContact OD1-N 3.05Å; N529-T531 VanDerWaalsContact OD1-N 3.16Å; N529-L532 HydrophobicContact CB-CB 4Å; N529-L532 PolarHBondContact O-N 3.37Å; N529-L532 PolarHBondContact OD1-N 2.83Å; N529-F533 WeakPolarHBondContact O-CB 3.19Å; N529-F533 PolarHBondContact O-N 3.4Å; N529-F642 HydrophobicContact CB-CE2 4.19Å; N529-F642 WeakPolarHBondContact ND2-CE2 3.43Å; N529-F642 WeakPolarHBondContact OD1-CD2 3.49Å
530	N	95.4	Very high	95.6	Very high	21 Å²	21	50 Å²	50	11%	0.112	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-37.8	-173.9	-67.8	-25.5	0	0	0	113.3	A523 F533 Y534 I578	A523-N530 WeakPolarHBondContact CA-OD1 3.37Å; A523-N530 WeakPolarHBondContact CB-OD1 3.31Å; A523-N530 PolarHBondContact O-ND2 3.46Å; A523-N530 PolarHBondContact O-OD1 2.91Å; N530-F533 PolarHBondContact O-N 3.17Å; N530-Y534 WeakPolarHBondContact O-CB 3.35Å; N530-Y534 PolarHBondContact O-N 3.21Å; N530-I578 HydrophobicContact CB-CG1 4.15Å
531	T	95.9	Very high	95.7	Very high	10 Å²	10	50 Å²	50	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-44.1	176	-44.9	0	0	0	0	111.8	N529 G535 V638 F642	N529-T531 VanDerWaalsContact C-N 3.33Å; N529-T531 PolarHBondContact O-N 3.43Å; N529-T531 WeakPolarHBondContact OD1-CB 3.31Å; N529-T531 PolarHBondContact OD1-N 3.05Å; N529-T531 VanDerWaalsContact OD1-N 3.16Å; T531-G535 PolarHBondContact O-N 3.15Å; T531-V638 HydrophobicContact CG2-CG1 3.69Å; T531-F642 HydrophobicContact CG2-CB 4.04Å
532	L	96.4	Very high	95.7	Very high	67 Å²	67	47 Å²	47	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-44.4	175.1	177.6	63.9	0	0	0	111.1	N529 G535 V536 L639 F642	N529-L532 HydrophobicContact CB-CB 4Å; N529-L532 PolarHBondContact O-N 3.37Å; N529-L532 PolarHBondContact OD1-N 2.83Å; L532-G535 PolarHBondContact O-N 3.46Å; L532-V536 HydrophobicContact CD1-CG2 4.07Å; L532-V536 HydrophobicContact CG-CG2 4.47Å; L532-V536 WeakPolarHBondContact O-CG2 3.2Å; L532-V536 PolarHBondContact O-N 3.14Å; L532-L639 HydrophobicContact CD1-CD2 3.64Å; L532-F642 HydrophobicContact CB-CD1 4.46Å; L532-F642 HydrophobicContact CB-CD2 4.03Å; L532-F642 HydrophobicContact CB-CE1 4.47Å; L532-F642 HydrophobicContact CB-CE2 4.06Å; L532-F642 HydrophobicContact CB-CG 4.24Å; L532-F642 HydrophobicContact CB-CZ 4.27Å; L532-F642 HydrophobicContact CD1-CD1 4.08Å; L532-F642 HydrophobicContact CD1-CE1 4.06Å; L532-F642 HydrophobicContact CD2-CE1 4.36Å; L532-F642 HydrophobicContact CD2-CZ 4.15Å
533	F	96.8	Very high	95.8	Very high	39 Å²	39	48 Å²	48	17%	0.171	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-49.2	-178.7	-178.3	-153.6	0	0	0	111.1	F519 L522 A523 V528 N529 N530 G535 V536 S537 L574	F519-F533 HydrophobicContact CB-CE1 4.27Å; F519-F533 HydrophobicContact CB-CZ 4.34Å; F519-F533 HydrophobicContact CD1-CE1 4.38Å; F519-F533 AromaticContact CD1-CZ 3.66Å; F519-F533 HydrophobicContact CD1-CZ 3.66Å; F519-F533 HydrophobicContact CD2-CE1 4.46Å; F519-F533 AromaticContact CD2-CZ 3.95Å; F519-F533 HydrophobicContact CD2-CZ 3.95Å; F519-F533 HydrophobicContact CE1-CE2 4.4Å; F519-F533 AromaticContact CE1-CZ 3.82Å; F519-F533 HydrophobicContact CE1-CZ 3.82Å; F519-F533 HydrophobicContact CE2-CZ 4.11Å; F519-F533 HydrophobicContact CG-CE1 4.13Å; F519-F533 AromaticContact CG-CZ 3.72Å; F519-F533 HydrophobicContact CG-CZ 3.72Å; F519-F533 HydrophobicContact CZ-CE2 4.33Å; F519-F533 HydrophobicContact CZ-CZ 4.05Å; L522-F533 HydrophobicContact CB-CE1 4.49Å; L522-F533 HydrophobicContact CD2-CE1 4.07Å; L522-F533 HydrophobicContact CD2-CE2 4.37Å; L522-F533 HydrophobicContact CD2-CZ 3.75Å; L522-F533 HydrophobicContact CG-CE1 4.3Å; L522-F533 HydrophobicContact CG-CZ 4.47Å; A523-F533 HydrophobicContact CB-CD1 4.39Å; A523-F533 HydrophobicContact CB-CE1 4.46Å; V528-F533 HydrophobicContact CG1-CB 3.98Å; V528-F533 HydrophobicContact CG1-CD1 3.99Å; V528-F533 HydrophobicContact CG1-CG 4.2Å; N529-F533 WeakPolarHBondContact O-CB 3.19Å; N529-F533 PolarHBondContact O-N 3.4Å; N530-F533 PolarHBondContact O-N 3.17Å; F533-G535 PolarHBondContact O-N 2.99Å; F533-V536 PolarHBondContact O-N 3.23Å; F533-S537 WeakPolarHBondContact O-CB 3.21Å; F533-S537 PolarHBondContact O-N 3.11Å; F533-S537 PolarHBondContact O-OG 2.81Å; F533-S537 VanDerWaalsContact O-OG 3.12Å; F533-L574 HydrophobicContact CB-CD1 4.46Å; F533-L574 HydrophobicContact CD1-CD1 3.58Å; F533-L574 HydrophobicContact CE1-CD1 4.02Å; F533-L574 HydrophobicContact CG-CD1 4.16Å
534	Y	97.5	Very high	95.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-44.8	174.1	179	-75.3	0	0	0	112.6	L475 N530 V536 S537 T538 N571 L574 T575 I578 V638	L475-Y534 WeakPolarHBondContact CD2-OH 3.49Å; N530-Y534 WeakPolarHBondContact O-CB 3.35Å; N530-Y534 PolarHBondContact O-N 3.21Å; Y534-V536 PolarHBondContact O-N 3Å; Y534-S537 WeakPolarHBondContact CA-OG 3.2Å; Y534-S537 PolarHBondContact O-N 3.25Å; Y534-S537 PolarHBondContact O-OG 2.73Å; Y534-T538 WeakPolarHBondContact CE1-OG1 2.97Å; Y534-T538 VanDerWaalsContact O-CB 3.29Å; Y534-T538 WeakPolarHBondContact O-CB 3.35Å; Y534-T538 PolarHBondContact O-N 2.97Å; Y534-T538 PolarHBondContact O-OG1 3.34Å; Y534-N571 HydrophobicContact CE2-CB 4.09Å; Y534-N571 PolarHBondContact OH-OD1 3.35Å; Y534-L574 HydrophobicContact CD2-CB 4.14Å; Y534-T575 WeakPolarHBondContact CE2-OG1 3.31Å; Y534-I578 HydrophobicContact CD1-CD1 4.5Å; Y534-I578 HydrophobicContact CD2-CD1 3.8Å; Y534-I578 HydrophobicContact CG-CD1 3.67Å; Y534-V638 HydrophobicContact CD1-CB 4.14Å; Y534-V638 HydrophobicContact CD1-CG1 3.81Å; Y534-V638 HydrophobicContact CD1-CG2 3.93Å; Y534-V638 HydrophobicContact CE1-CB 4.43Å; Y534-V638 HydrophobicContact CE1-CG1 4.45Å; Y534-V638 HydrophobicContact CE1-CG2 3.73Å
535	G	97.3	Very high	95.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-44.6	-179.3	0	0	0	0	0	111.9	T531 L532 F533 C539	T531-G535 PolarHBondContact O-N 3.15Å; L532-G535 PolarHBondContact O-N 3.46Å; F533-G535 PolarHBondContact O-N 2.99Å; G535-C539 PolarHBondContact O-N 3.36Å; G535-C539 VanDerWaalsContact O-N 3.09Å; G535-C539 PolarHBondContact O-SG 2.88Å; G535-C539 VanDerWaalsContact O-SG 3.33Å
536	V	97.9	Very high	95.9	Very high	64 Å²	64	41 Å²	41	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-66.8	-46.3	177.3	173.2	0	0	0	0	111.4	L532 F533 Y534 T538 C539 L540 L639	L532-V536 HydrophobicContact CD1-CG2 4.07Å; L532-V536 HydrophobicContact CG-CG2 4.47Å; L532-V536 WeakPolarHBondContact O-CG2 3.2Å; L532-V536 PolarHBondContact O-N 3.14Å; F533-V536 PolarHBondContact O-N 3.23Å; Y534-V536 PolarHBondContact O-N 3Å; V536-T538 VanDerWaalsContact C-N 3.32Å; V536-T538 PolarHBondContact O-N 3.44Å; V536-C539 PolarHBondContact O-N 2.83Å; V536-L540 HydrophobicContact CG1-CD1 3.93Å; V536-L540 HydrophobicContact CG1-CG 4.41Å; V536-L540 WeakPolarHBondContact O-CG 3.39Å; V536-L540 PolarHBondContact O-N 3.47Å; V536-L639 HydrophobicContact CG2-CD2 4.18Å
537	S	97.3	Very high	96.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-40.5	178.8	61	0	0	0	0	111.7	F533 Y534 C539 L540 C541 A570	F533-S537 WeakPolarHBondContact O-CB 3.21Å; F533-S537 PolarHBondContact O-N 3.11Å; F533-S537 PolarHBondContact O-OG 2.81Å; F533-S537 VanDerWaalsContact O-OG 3.12Å; Y534-S537 WeakPolarHBondContact CA-OG 3.2Å; Y534-S537 PolarHBondContact O-N 3.25Å; Y534-S537 PolarHBondContact O-OG 2.73Å; S537-C539 PolarHBondContact O-N 3.26Å; S537-L540 PolarHBondContact O-N 2.96Å; S537-C541 WeakPolarHBondContact O-CB 3.19Å; S537-C541 PolarHBondContact O-N 3.31Å; S537-A570 WeakPolarHBondContact OG-CB 3.26Å
538	T	97.4	Very high	96.4	Very high	6 Å²	6	29.5 Å²	29.5	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-39.5	177.5	-54.7	0	0	0	0	111.6	L475 Y534 V536 C541 G542 T631	L475-T538 HydrophobicContact CD1-CG2 4.15Å; Y534-T538 WeakPolarHBondContact CE1-OG1 2.97Å; Y534-T538 VanDerWaalsContact O-CB 3.29Å; Y534-T538 WeakPolarHBondContact O-CB 3.35Å; Y534-T538 PolarHBondContact O-N 2.97Å; Y534-T538 PolarHBondContact O-OG1 3.34Å; V536-T538 VanDerWaalsContact C-N 3.32Å; V536-T538 PolarHBondContact O-N 3.44Å; T538-C541 WeakPolarHBondContact O-CB 3.11Å; T538-C541 PolarHBondContact O-N 3.27Å; T538-G542 PolarHBondContact O-N 2.94Å; T538-T631 HydrophobicContact CG2-CG2 4.28Å
539	C	97.9	Very high	96.4	Very high	22 Å²	22	28.2 Å²	28.2	15%	0.149	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-43.7	172.1	-72.6	0	0	0	0	112.5	G535 V536 S537 C541 G542 L543 G635	G535-C539 PolarHBondContact O-N 3.36Å; G535-C539 VanDerWaalsContact O-N 3.09Å; G535-C539 PolarHBondContact O-SG 2.88Å; G535-C539 VanDerWaalsContact O-SG 3.33Å; V536-C539 PolarHBondContact O-N 2.83Å; S537-C539 PolarHBondContact O-N 3.26Å; C539-C541 VanDerWaalsContact C-N 3.31Å; C539-C541 PolarHBondContact O-N 3.09Å; C539-G542 PolarHBondContact O-N 3.49Å; C539-L543 WeakPolarHBondContact O-CG 3.48Å; C539-L543 PolarHBondContact O-N 2.99Å; C539-G635 VanDerWaalsContact SG-C 3.58Å
540	L	97.8	Very high	96.4	Very high	68 Å²	68	32.1 Å²	32.1	36%	0.356	16%	0.163	S	C	.	.	H	α-helix	trans	-65.5	-35.9	177	-68.8	172	0	0	0	111.9	V536 S537 L543 S544 F567	V536-L540 HydrophobicContact CG1-CD1 3.93Å; V536-L540 HydrophobicContact CG1-CG 4.41Å; V536-L540 WeakPolarHBondContact O-CG 3.39Å; V536-L540 PolarHBondContact O-N 3.47Å; S537-L540 PolarHBondContact O-N 2.96Å; L540-L543 HydrophobicContact CD2-CD1 4.27Å; L540-L543 PolarHBondContact O-N 3.19Å; L540-S544 PolarHBondContact O-N 2.76Å; L540-F567 HydrophobicContact CB-CD1 4Å; L540-F567 HydrophobicContact CB-CD2 3.8Å; L540-F567 HydrophobicContact CB-CE1 4.01Å; L540-F567 HydrophobicContact CB-CE2 3.79Å; L540-F567 HydrophobicContact CB-CG 3.92Å; L540-F567 HydrophobicContact CB-CZ 3.92Å; L540-F567 HydrophobicContact CD1-CD1 4.2Å; L540-F567 HydrophobicContact CD1-CE1 3.5Å; L540-F567 HydrophobicContact CD1-CE2 4.28Å; L540-F567 HydrophobicContact CD1-CZ 3.56Å; L540-F567 HydrophobicContact CG-CE1 4.41Å; L540-F567 HydrophobicContact CG-CZ 4.31Å
541	C	96.6	Very high	96.3	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-52.7	170.6	-177.5	0	0	0	0	110.7	S537 T538 C539 L543 S544 I545 F564 F567 T631	S537-C541 WeakPolarHBondContact O-CB 3.19Å; S537-C541 PolarHBondContact O-N 3.31Å; T538-C541 WeakPolarHBondContact O-CB 3.11Å; T538-C541 PolarHBondContact O-N 3.27Å; C539-C541 VanDerWaalsContact C-N 3.31Å; C539-C541 PolarHBondContact O-N 3.09Å; C541-L543 PolarHBondContact O-N 3.22Å; C541-S544 WeakPolarHBondContact O-CB 3.41Å; C541-S544 PolarHBondContact O-N 2.96Å; C541-S544 VanDerWaalsContact O-N 3.12Å; C541-S544 PolarHBondContact O-OG 3.46Å; C541-I545 PolarHBondContact O-N 3.13Å; C541-F564 WeakPolarHBondContact SG-CD2 3.3Å; C541-F564 WeakPolarHBondContact SG-CE2 3.42Å; C541-F567 HydrophobicContact CB-CB 3.81Å; C541-T631 HydrophobicContact CB-CG2 4.49Å
542	G	97.1	Very high	96.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.7	-40	177.8	0	0	0	0	0	113.7	T538 C539 S544 I545 V546 G628	T538-G542 PolarHBondContact O-N 2.94Å; C539-G542 PolarHBondContact O-N 3.49Å; G542-S544 VanDerWaalsContact C-N 3.29Å; G542-S544 PolarHBondContact O-N 2.82Å; G542-I545 WeakPolarHBondContact O-CB 3.35Å; G542-I545 PolarHBondContact O-N 2.71Å; G542-I545 VanDerWaalsContact O-N 3.14Å; G542-V546 WeakPolarHBondContact O-CG2 3.44Å; G542-V546 PolarHBondContact O-N 3.36Å; G542-G628 WeakPolarHBondContact O-CA 3.39Å
543	L	97	Very high	96	Very high	86 Å²	86	35.9 Å²	35.9	45%	0.45	19%	0.186	S	C	.	.	H	α-helix	trans	-61.2	-37	174.5	-75.4	166.3	0	0	0	112.3	C539 L540 C541 I545 V546 L547 V632	C539-L543 WeakPolarHBondContact O-CG 3.48Å; C539-L543 PolarHBondContact O-N 2.99Å; L540-L543 HydrophobicContact CD2-CD1 4.27Å; L540-L543 PolarHBondContact O-N 3.19Å; C541-L543 PolarHBondContact O-N 3.22Å; L543-I545 VanDerWaalsContact C-N 3.29Å; L543-I545 PolarHBondContact O-N 3.28Å; L543-V546 PolarHBondContact O-N 3.45Å; L543-L547 WeakPolarHBondContact O-CG 3.42Å; L543-L547 PolarHBondContact O-N 3.02Å; L543-L547 VanDerWaalsContact O-N 3.13Å; L543-V632 HydrophobicContact CG-CG2 4.14Å
544	S	95.9	Very high	95.8	Very high	6 Å²	6	36 Å²	36	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-38	175.2	78.2	0	0	0	0	111.9	L540 C541 G542 L547 I560	L540-S544 PolarHBondContact O-N 2.76Å; C541-S544 WeakPolarHBondContact O-CB 3.41Å; C541-S544 PolarHBondContact O-N 2.96Å; C541-S544 VanDerWaalsContact O-N 3.12Å; C541-S544 PolarHBondContact O-OG 3.46Å; G542-S544 VanDerWaalsContact C-N 3.29Å; G542-S544 PolarHBondContact O-N 2.82Å; S544-L547 PolarHBondContact O-N 3.18Å; S544-I560 WeakPolarHBondContact O-CD1 3.14Å; S544-I560 WeakPolarHBondContact O-CG1 3.24Å
545	I	95.9	Very high	95.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-42.9	177	-54.9	171.4	0	0	0	110.7	P482 C541 G542 L543 L547 V548 F564 F624	P482-I545 HydrophobicContact CG-CB 4.48Å; P482-I545 HydrophobicContact CG-CD1 3.44Å; P482-I545 VanDerWaalsContact CG-CD1 3.44Å; P482-I545 HydrophobicContact CG-CG1 3.57Å; P482-I545 HydrophobicContact CG-CG2 4.12Å; C541-I545 PolarHBondContact O-N 3.13Å; G542-I545 WeakPolarHBondContact O-CB 3.35Å; G542-I545 PolarHBondContact O-N 2.71Å; G542-I545 VanDerWaalsContact O-N 3.14Å; L543-I545 VanDerWaalsContact C-N 3.29Å; L543-I545 PolarHBondContact O-N 3.28Å; I545-L547 PolarHBondContact O-N 3.39Å; I545-V548 WeakPolarHBondContact O-CB 3.38Å; I545-V548 VanDerWaalsContact O-CG2 3.27Å; I545-V548 WeakPolarHBondContact O-CG2 3.12Å; I545-V548 PolarHBondContact O-N 2.96Å; I545-F564 HydrophobicContact CD1-CD2 4.14Å; I545-F564 HydrophobicContact CD1-CE2 3.87Å; I545-F564 HydrophobicContact CG1-CD2 3.93Å; I545-F564 HydrophobicContact CG1-CE2 4.15Å; I545-F624 HydrophobicContact CG2-CB 4.38Å; I545-F624 HydrophobicContact CG2-CD1 4.03Å
546	V	96.5	Very high	95.6	Very high	25 Å²	25	49.5 Å²	49.5	15%	0.152	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-34.9	177.4	173.4	0	0	0	0	111.4	G542 L543 V548 P549 W550 F625	G542-V546 WeakPolarHBondContact O-CG2 3.44Å; G542-V546 PolarHBondContact O-N 3.36Å; L543-V546 PolarHBondContact O-N 3.45Å; V546-V548 VanDerWaalsContact C-N 3.34Å; V546-V548 PolarHBondContact O-N 2.92Å; V546-P549 WeakPolarHBondContact O-CD 3.04Å; V546-W550 HydrophobicContact CG1-CZ3 4.31Å; V546-W550 WeakPolarHBondContact O-CZ3 3.32Å; V546-F625 HydrophobicContact CG1-CD1 3.9Å; V546-F625 HydrophobicContact CG1-CE1 3.8Å
547	L	95.8	Very high	95.4	Very high	100 Å²	100	46.5 Å²	46.5	52%	0.524	22%	0.222	S	C	.	.	H	α-helix	trans	-78.1	-13.7	-177.7	-70.6	172.4	0	0	0	114.3	L543 S544 I545 W550 I560	L543-L547 WeakPolarHBondContact O-CG 3.42Å; L543-L547 PolarHBondContact O-N 3.02Å; L543-L547 VanDerWaalsContact O-N 3.13Å; S544-L547 PolarHBondContact O-N 3.18Å; I545-L547 PolarHBondContact O-N 3.39Å; L547-W550 PolarHBondContact O-N 3.16Å; L547-I560 HydrophobicContact CB-CD1 3.86Å
548	V	95.1	Very high	95.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-51	-45.8	-179.2	175	0	0	0	0	113.8	M486 F489 I545 V546 W550 V551 F557 I560 F624	M486-V548 HydrophobicContact CE-CG2 3.29Å; M486-V548 HydrophobicContact CG-CG1 4.36Å; M486-V548 HydrophobicContact CG-CG2 4.44Å; M486-V548 HydrophobicContact SD-CG2 4.23Å; F489-V548 HydrophobicContact CD1-CG1 3.98Å; F489-V548 HydrophobicContact CE1-CG1 4.18Å; I545-V548 WeakPolarHBondContact O-CB 3.38Å; I545-V548 VanDerWaalsContact O-CG2 3.27Å; I545-V548 WeakPolarHBondContact O-CG2 3.12Å; I545-V548 PolarHBondContact O-N 2.96Å; V546-V548 VanDerWaalsContact C-N 3.34Å; V546-V548 PolarHBondContact O-N 2.92Å; V548-W550 PolarHBondContact O-N 3.34Å; V548-W550 VanDerWaalsContact O-N 3.08Å; V548-V551 VanDerWaalsContact O-CB 3.22Å; V548-V551 WeakPolarHBondContact O-CB 3.28Å; V548-V551 WeakPolarHBondContact O-CG2 3.26Å; V548-V551 PolarHBondContact O-N 2.85Å; V548-F557 HydrophobicContact CG1-CE1 4.04Å; V548-I560 HydrophobicContact CB-CD1 4.48Å; V548-I560 HydrophobicContact CG2-CD1 3.88Å; V548-I560 HydrophobicContact CG2-CG1 4.49Å; V548-I560 HydrophobicContact CG2-CG2 4.32Å; V548-F624 HydrophobicContact CB-CD1 4.32Å; V548-F624 HydrophobicContact CB-CD2 4.41Å; V548-F624 HydrophobicContact CB-CG 4.24Å; V548-F624 HydrophobicContact CG1-CD1 4.25Å; V548-F624 HydrophobicContact CG1-CD2 4.01Å; V548-F624 HydrophobicContact CG1-CE1 4.07Å; V548-F624 HydrophobicContact CG1-CE2 3.81Å; V548-F624 HydrophobicContact CG1-CG 4.23Å; V548-F624 HydrophobicContact CG1-CZ 3.85Å
549	P	93.2	Very high	95.3	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.026	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-66.7	-19.1	-173.3	-16.4	30.5	0	0	0	114.1	K493 V546 H621 F624	K493-P549 PolarHBondContact NZ-O 2.99Å; V546-P549 WeakPolarHBondContact O-CD 3.04Å; P549-H621 HydrophobicContact CB-CB 4.25Å; P549-H621 WeakPolarHBondContact CB-CE1 3.43Å; P549-H621 WeakPolarHBondContact CB-ND1 3.31Å; P549-H621 HydrophobicContact CG-CB 4.41Å; P549-F624 HydrophobicContact CG-CB 3.95Å; P549-F624 HydrophobicContact CG-CD2 4.16Å; P549-F624 HydrophobicContact CG-CG 4.44Å
550	W	94.2	Very high	95.2	Very high	154 Å²	154	52 Å²	52	58%	0.583	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-85.9	-5.3	175.7	-73.9	-84.2	0	0	0	114.2	V546 L547 V548 N552 F625	V546-W550 HydrophobicContact CG1-CZ3 4.31Å; V546-W550 WeakPolarHBondContact O-CZ3 3.32Å; L547-W550 PolarHBondContact O-N 3.16Å; V548-W550 PolarHBondContact O-N 3.34Å; V548-W550 VanDerWaalsContact O-N 3.08Å; W550-N552 PolarHBondContact O-ND2 2.8Å; W550-F625 AromaticContact CH2-CE1 3.55Å; W550-F625 HydrophobicContact CH2-CE1 3.55Å; W550-F625 AromaticContact CH2-CZ 3.26Å; W550-F625 HydrophobicContact CH2-CZ 3.26Å; W550-F625 HydrophobicContact CZ2-CZ 4.16Å; W550-F625 AromaticContact CZ3-CE1 3.64Å; W550-F625 HydrophobicContact CZ3-CE1 3.64Å; W550-F625 AromaticContact CZ3-CZ 3.51Å; W550-F625 HydrophobicContact CZ3-CZ 3.51Å
551	V	93.1	Very high	95.1	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.067	23%	0.232	C	C	.	.			trans	-71.5	128.6	176.3	171.3	0	0	0	0	110.3	K493 V548 T553 Q556 F557 I560	K493-V551 WeakPolarHBondContact CE-O 3.49Å; K493-V551 PolarHBondContact NZ-O 3.28Å; V548-V551 VanDerWaalsContact O-CB 3.22Å; V548-V551 WeakPolarHBondContact O-CB 3.28Å; V548-V551 WeakPolarHBondContact O-CG2 3.26Å; V548-V551 PolarHBondContact O-N 2.85Å; V551-T553 WeakPolarHBondContact CG1-O 3.41Å; V551-Q556 HydrophobicContact CB-CB 4.37Å; V551-Q556 HydrophobicContact CG1-CB 3.43Å; V551-Q556 VanDerWaalsContact CG1-CB 3.43Å; V551-Q556 HydrophobicContact CG2-CB 4.34Å; V551-F557 HydrophobicContact CB-CD2 4.33Å; V551-F557 HydrophobicContact CB-CE2 4.12Å; V551-F557 HydrophobicContact CB-CZ 4.31Å; V551-F557 HydrophobicContact CG1-CB 4.33Å; V551-F557 HydrophobicContact CG1-CD1 4.27Å; V551-F557 HydrophobicContact CG1-CD2 3.29Å; V551-F557 HydrophobicContact CG1-CE1 4.45Å; V551-F557 HydrophobicContact CG1-CE2 3.48Å; V551-F557 VanDerWaalsContact CG1-CE2 3.48Å; V551-F557 HydrophobicContact CG1-CG 3.71Å; V551-F557 HydrophobicContact CG1-CZ 4.08Å; V551-I560 HydrophobicContact CG2-CD1 3.88Å; V551-I560 HydrophobicContact CG2-CG2 4.3Å
552	N	92.7	Very high	95	Very high	104 Å²	104	49.8 Å²	49.8	56%	0.556	24%	0.241	S	C	*	.			trans	-121.6	-5.2	-174.7	-61.7	-44.4	0	0	0	113.9	K493 W550	K493-N552 PolarHBondContact NZ-OD1 2.99Å; W550-N552 PolarHBondContact O-ND2 2.8Å
553	T	93.4	Very high	95.1	Very high	62 Å²	62	52.2 Å²	52.2	38%	0.38	26%	0.256	S	S	.	.	S	Bend	trans	-129.1	151.9	177.5	69.5	0	0	0	0	111	V551 W555 Q556 F557	V551-T553 WeakPolarHBondContact CG1-O 3.41Å; T553-W555 VanDerWaalsContact C-N 3.27Å; T553-W555 PolarHBondContact O-N 3.45Å; T553-Q556 WeakPolarHBondContact O-CB 3.19Å; T553-Q556 PolarHBondContact O-N 2.84Å; T553-Q556 VanDerWaalsContact O-N 3.12Å; T553-Q556 WeakPolarHBondContact OG1-CB 3.39Å; T553-Q556 VanDerWaalsContact OG1-CG 3.23Å; T553-Q556 WeakPolarHBondContact OG1-CG 3.31Å; T553-Q556 PolarHBondContact OG1-N 3.5Å; T553-F557 WeakPolarHBondContact O-CD2 3.4Å; T553-F557 PolarHBondContact O-N 3.32Å; T553-F557 VanDerWaalsContact O-N 3.11Å
554	Y	93	Very high	95	Very high	42 Å²	42	48.1 Å²	48.1	17%	0.165	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-37.6	177	177.8	-107.6	0	0	0	112.9	V496 S500 M503 L504 Q556 F557 C558	V496-Y554 HydrophobicContact CG1-CD2 4.19Å; V496-Y554 HydrophobicContact CG1-CE2 4.18Å; V496-Y554 HydrophobicContact CG2-CD2 4.3Å; S500-Y554 WeakPolarHBondContact O-CE2 3.36Å; S500-Y554 PolarHBondContact O-OH 3.39Å; M503-Y554 HydrophobicContact CE-CE1 3.93Å; M503-Y554 WeakPolarHBondContact CE-OH 3.43Å; L504-Y554 HydrophobicContact CD2-CE2 4.37Å; Y554-Q556 VanDerWaalsContact C-N 3.3Å; Y554-Q556 PolarHBondContact O-N 2.96Å; Y554-F557 WeakPolarHBondContact O-CA 3.37Å; Y554-F557 WeakPolarHBondContact O-CB 3.34Å; Y554-F557 PolarHBondContact O-N 2.78Å; Y554-F557 VanDerWaalsContact O-N 3.09Å; Y554-C558 VanDerWaalsContact CE1-SG 3.55Å; Y554-C558 PolarHBondContact O-N 3.2Å; Y554-C558 PolarHBondContact O-SG 3.2Å
555	W	93.7	Very high	95	Very high	198 Å²	198	47.9 Å²	47.9	75%	0.75	23%	0.232	S	C	*	.	H	α-helix	trans	-64.5	-34.1	176.2	-65.1	112.2	0	0	0	113	T553 C558 L559	T553-W555 VanDerWaalsContact C-N 3.27Å; T553-W555 PolarHBondContact O-N 3.45Å; W555-C558 PolarHBondContact O-N 3.39Å; W555-L559 WeakPolarHBondContact O-CB 3.03Å; W555-L559 PolarHBondContact O-N 3.42Å
556	Q	95.7	Very high	95	Very high	85 Å²	85	51 Å²	51	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-69.7	-34	172.7	-75.6	171	-8.8	0	0	111.5	V551 T553 Y554 L559 I560	V551-Q556 HydrophobicContact CB-CB 4.37Å; V551-Q556 HydrophobicContact CG1-CB 3.43Å; V551-Q556 VanDerWaalsContact CG1-CB 3.43Å; V551-Q556 HydrophobicContact CG2-CB 4.34Å; T553-Q556 WeakPolarHBondContact O-CB 3.19Å; T553-Q556 PolarHBondContact O-N 2.84Å; T553-Q556 VanDerWaalsContact O-N 3.12Å; T553-Q556 WeakPolarHBondContact OG1-CB 3.39Å; T553-Q556 VanDerWaalsContact OG1-CG 3.23Å; T553-Q556 WeakPolarHBondContact OG1-CG 3.31Å; T553-Q556 PolarHBondContact OG1-N 3.5Å; Y554-Q556 VanDerWaalsContact C-N 3.3Å; Y554-Q556 PolarHBondContact O-N 2.96Å; Q556-L559 PolarHBondContact O-N 3.09Å; Q556-I560 WeakPolarHBondContact O-CB 3.26Å; Q556-I560 PolarHBondContact O-N 2.94Å
557	F	94.7	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-46.9	170.1	-87.7	-78.2	0	0	0	110.8	F489 A490 L494 L504 V548 V551 T553 Y554 L559 I560 S561	F489-F557 AromaticContact CD1-CE1 3.8Å; F489-F557 HydrophobicContact CD1-CE1 3.8Å; F489-F557 AromaticContact CD1-CZ 3.53Å; F489-F557 HydrophobicContact CD1-CZ 3.53Å; F489-F557 HydrophobicContact CE1-CE1 4.38Å; F489-F557 AromaticContact CE1-CZ 3.83Å; F489-F557 HydrophobicContact CE1-CZ 3.83Å; A490-F557 HydrophobicContact CB-CD1 4.25Å; A490-F557 HydrophobicContact CB-CD2 4.43Å; A490-F557 HydrophobicContact CB-CE1 4.24Å; A490-F557 HydrophobicContact CB-CE2 4.45Å; A490-F557 HydrophobicContact CB-CG 4.35Å; A490-F557 HydrophobicContact CB-CZ 4.34Å; L494-F557 HydrophobicContact CD1-CD2 3.61Å; L494-F557 HydrophobicContact CD1-CE2 3.31Å; L494-F557 HydrophobicContact CD1-CZ 4.44Å; L504-F557 HydrophobicContact CD1-CB 4.22Å; L504-F557 HydrophobicContact CD1-CD1 4.35Å; L504-F557 HydrophobicContact CD2-CB 3.9Å; V548-F557 HydrophobicContact CG1-CE1 4.04Å; V551-F557 HydrophobicContact CB-CD2 4.33Å; V551-F557 HydrophobicContact CB-CE2 4.12Å; V551-F557 HydrophobicContact CB-CZ 4.31Å; V551-F557 HydrophobicContact CG1-CB 4.33Å; V551-F557 HydrophobicContact CG1-CD1 4.27Å; V551-F557 HydrophobicContact CG1-CD2 3.29Å; V551-F557 HydrophobicContact CG1-CE1 4.45Å; V551-F557 HydrophobicContact CG1-CE2 3.48Å; V551-F557 VanDerWaalsContact CG1-CE2 3.48Å; V551-F557 HydrophobicContact CG1-CG 3.71Å; V551-F557 HydrophobicContact CG1-CZ 4.08Å; T553-F557 WeakPolarHBondContact O-CD2 3.4Å; T553-F557 PolarHBondContact O-N 3.32Å; T553-F557 VanDerWaalsContact O-N 3.11Å; Y554-F557 WeakPolarHBondContact O-CA 3.37Å; Y554-F557 WeakPolarHBondContact O-CB 3.34Å; Y554-F557 PolarHBondContact O-N 2.78Å; Y554-F557 VanDerWaalsContact O-N 3.09Å; F557-L559 VanDerWaalsContact C-N 3.3Å; F557-L559 PolarHBondContact O-N 2.92Å; F557-I560 WeakPolarHBondContact O-CG2 3.24Å; F557-I560 PolarHBondContact O-N 3.37Å; F557-S561 VanDerWaalsContact O-CB 3.31Å; F557-S561 WeakPolarHBondContact O-CB 3.47Å; F557-S561 PolarHBondContact O-N 2.9Å; F557-S561 PolarHBondContact O-OG 3.19Å
558	C	95	Very high	95	Very high	13 Å²	13	47.5 Å²	47.5	9%	0.088	23%	0.225	C	C	.	.	H	α-helix	trans	-57.8	-44.4	175.9	-64.8	0	0	0	0	111.8	I507 Y554 W555 A562	I507-C558 HydrophobicContact CD1-CB 3.89Å; Y554-C558 VanDerWaalsContact CE1-SG 3.55Å; Y554-C558 PolarHBondContact O-N 3.2Å; Y554-C558 PolarHBondContact O-SG 3.2Å; W555-C558 PolarHBondContact O-N 3.39Å; C558-A562 WeakPolarHBondContact O-CB 3.21Å; C558-A562 PolarHBondContact O-N 3.47Å
559	L	96.9	Very high	95	Very high	116 Å²	116	47.5 Å²	47.5	61%	0.607	23%	0.225	S	C	*	.	H	α-helix	trans	-64.9	-45.8	179.2	-178.9	63.6	0	0	0	112	W555 Q556 F557 A562 V563	W555-L559 WeakPolarHBondContact O-CB 3.03Å; W555-L559 PolarHBondContact O-N 3.42Å; Q556-L559 PolarHBondContact O-N 3.09Å; F557-L559 VanDerWaalsContact C-N 3.3Å; F557-L559 PolarHBondContact O-N 2.92Å; L559-A562 WeakPolarHBondContact O-CB 3.36Å; L559-A562 PolarHBondContact O-N 2.92Å; L559-V563 VanDerWaalsContact O-CG2 3.31Å; L559-V563 WeakPolarHBondContact O-CG2 3.47Å; L559-V563 PolarHBondContact O-N 3.47Å
560	I	96.3	Very high	95.1	Very high	17 Å²	17	47.3 Å²	47.3	9%	0.087	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-36.4	-177.8	-152.7	166.9	0	0	0	111.8	M486 S544 L547 V548 V551 Q556 F557 V563 F564	M486-I560 HydrophobicContact CE-CG2 4.34Å; M486-I560 HydrophobicContact SD-CG2 4.34Å; S544-I560 WeakPolarHBondContact O-CD1 3.14Å; S544-I560 WeakPolarHBondContact O-CG1 3.24Å; L547-I560 HydrophobicContact CB-CD1 3.86Å; V548-I560 HydrophobicContact CB-CD1 4.48Å; V548-I560 HydrophobicContact CG2-CD1 3.88Å; V548-I560 HydrophobicContact CG2-CG1 4.49Å; V548-I560 HydrophobicContact CG2-CG2 4.32Å; V551-I560 HydrophobicContact CG2-CD1 3.88Å; V551-I560 HydrophobicContact CG2-CG2 4.3Å; Q556-I560 WeakPolarHBondContact O-CB 3.26Å; Q556-I560 PolarHBondContact O-N 2.94Å; F557-I560 WeakPolarHBondContact O-CG2 3.24Å; F557-I560 PolarHBondContact O-N 3.37Å; I560-V563 PolarHBondContact O-N 2.82Å; I560-F564 WeakPolarHBondContact O-CB 3.39Å; I560-F564 PolarHBondContact O-N 3.46Å
561	S	94.7	Very high	95.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-42.4	171.3	-63.2	0	0	0	0	111.3	M486 I508 F557 F564 G565	M486-S561 PolarHBondContact SD-OG 3.14Å; I508-S561 WeakPolarHBondContact CG1-O 3.28Å; F557-S561 VanDerWaalsContact O-CB 3.31Å; F557-S561 WeakPolarHBondContact O-CB 3.47Å; F557-S561 PolarHBondContact O-N 2.9Å; F557-S561 PolarHBondContact O-OG 3.19Å; S561-F564 PolarHBondContact O-N 3.47Å; S561-G565 PolarHBondContact O-N 3.4Å
562	A	96.3	Very high	95.2	Very high	23 Å²	23	42.5 Å²	42.5	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-44.4	173.2	0	0	0	0	0	112.1	I507 V511 C558 L559 G565 F566	I507-A562 HydrophobicContact CG2-CB 3.81Å; V511-A562 WeakPolarHBondContact CG1-O 3.42Å; V511-A562 HydrophobicContact CG2-CB 3.96Å; C558-A562 WeakPolarHBondContact O-CB 3.21Å; C558-A562 PolarHBondContact O-N 3.47Å; L559-A562 WeakPolarHBondContact O-CB 3.36Å; L559-A562 PolarHBondContact O-N 2.92Å; A562-G565 PolarHBondContact O-N 3.22Å; A562-F566 WeakPolarHBondContact O-CB 3.12Å; A562-F566 PolarHBondContact O-N 3.48Å
563	V	97.5	Very high	95.3	Very high	51 Å²	51	37.6 Å²	37.6	31%	0.309	18%	0.179	S	C	.	.	H	α-helix	trans	-62.5	-43.9	177.5	170.4	0	0	0	0	111.5	L559 I560 F566 F567	L559-V563 VanDerWaalsContact O-CG2 3.31Å; L559-V563 WeakPolarHBondContact O-CG2 3.47Å; L559-V563 PolarHBondContact O-N 3.47Å; I560-V563 PolarHBondContact O-N 2.82Å; V563-F566 PolarHBondContact O-N 2.88Å; V563-F567 HydrophobicContact CG1-CD2 3.73Å; V563-F567 HydrophobicContact CG1-CE2 3.71Å; V563-F567 VanDerWaalsContact O-CD2 3.27Å; V563-F567 WeakPolarHBondContact O-CD2 3.2Å; V563-F567 PolarHBondContact O-N 2.92Å; V563-F567 VanDerWaalsContact O-N 3.1Å
564	F	96	Very high	95.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-52.8	174.2	170.2	-103.5	0	0	0	111.1	P482 Y483 I508 C541 I545 I560 S561 F566 F567 I568	P482-F564 HydrophobicContact CB-CD1 4.25Å; P482-F564 HydrophobicContact CB-CD2 4.5Å; P482-F564 HydrophobicContact CB-CE1 3.94Å; P482-F564 HydrophobicContact CB-CE2 4.22Å; P482-F564 HydrophobicContact CB-CZ 3.93Å; P482-F564 HydrophobicContact CG-CD2 4.24Å; P482-F564 HydrophobicContact CG-CE1 4.34Å; P482-F564 HydrophobicContact CG-CE2 3.77Å; P482-F564 HydrophobicContact CG-CZ 3.82Å; Y483-F564 HydrophobicContact CD2-CE1 4.21Å; Y483-F564 HydrophobicContact CD2-CZ 4.38Å; Y483-F564 AromaticContact CE2-CE1 3.61Å; Y483-F564 HydrophobicContact CE2-CE1 3.61Å; Y483-F564 AromaticContact CE2-CZ 3.82Å; Y483-F564 HydrophobicContact CE2-CZ 3.82Å; Y483-F564 AromaticContact CZ-CE1 3.83Å; I508-F564 HydrophobicContact CD1-CD1 3.93Å; I508-F564 HydrophobicContact CD1-CE1 4.28Å; I508-F564 HydrophobicContact CG1-CD1 4.12Å; I508-F564 HydrophobicContact CG2-CD1 4.01Å; I508-F564 HydrophobicContact CG2-CE1 4.1Å; C541-F564 WeakPolarHBondContact SG-CD2 3.3Å; C541-F564 WeakPolarHBondContact SG-CE2 3.42Å; I545-F564 HydrophobicContact CD1-CD2 4.14Å; I545-F564 HydrophobicContact CD1-CE2 3.87Å; I545-F564 HydrophobicContact CG1-CD2 3.93Å; I545-F564 HydrophobicContact CG1-CE2 4.15Å; I560-F564 WeakPolarHBondContact O-CB 3.39Å; I560-F564 PolarHBondContact O-N 3.46Å; S561-F564 PolarHBondContact O-N 3.47Å; F564-F566 VanDerWaalsContact C-N 3.26Å; F564-F566 PolarHBondContact O-N 2.98Å; F564-F567 PolarHBondContact O-N 3.31Å; F564-I568 HydrophobicContact CZ-CB 4.48Å; F564-I568 HydrophobicContact CZ-CG1 4.49Å; F564-I568 WeakPolarHBondContact O-CB 3.42Å; F564-I568 VanDerWaalsContact O-CG2 3.31Å; F564-I568 WeakPolarHBondContact O-CG2 3.19Å; F564-I568 PolarHBondContact O-N 3.24Å
565	G	94.8	Very high	95.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58	-35.9	177.4	0	0	0	0	0	113.5	N512 S561 A562 I568	N512-G565 WeakPolarHBondContact CA-O 3.47Å; S561-G565 PolarHBondContact O-N 3.4Å; A562-G565 PolarHBondContact O-N 3.22Å; G565-I568 WeakPolarHBondContact O-CG2 3.26Å
566	F	96.8	Very high	95.7	Very high	67 Å²	67	23.7 Å²	23.7	29%	0.294	12%	0.12	S	C	.	.	H	α-helix	trans	-66.5	-46.8	176.8	-173	-94.6	0	0	0	112.1	V511 A515 L518 F519 A562 V563 F564 S569	V511-F566 HydrophobicContact CG1-CB 3.74Å; V511-F566 HydrophobicContact CG1-CD2 4.15Å; V511-F566 HydrophobicContact CG1-CG 4.47Å; A515-F566 HydrophobicContact CB-CD2 3.61Å; A515-F566 HydrophobicContact CB-CE2 4Å; A515-F566 HydrophobicContact CB-CG 4.17Å; L518-F566 HydrophobicContact CD2-CE2 3.85Å; L518-F566 HydrophobicContact CD2-CZ 3.79Å; F519-F566 HydrophobicContact CE1-CD1 4.35Å; F519-F566 AromaticContact CE1-CE1 3.56Å; F519-F566 HydrophobicContact CE1-CE1 3.56Å; F519-F566 HydrophobicContact CE1-CE2 4.39Å; F519-F566 AromaticContact CE1-CZ 3.58Å; F519-F566 HydrophobicContact CE1-CZ 3.58Å; F519-F566 WeakPolarHBondContact CE2-O 3.4Å; F519-F566 AromaticContact CZ-CD1 3.9Å; F519-F566 HydrophobicContact CZ-CD1 3.9Å; F519-F566 AromaticContact CZ-CE1 3.49Å; F519-F566 HydrophobicContact CZ-CE1 3.49Å; F519-F566 VanDerWaalsContact CZ-CE1 3.49Å; F519-F566 AromaticContact CZ-CZ 3.98Å; F519-F566 HydrophobicContact CZ-CZ 3.98Å; A562-F566 WeakPolarHBondContact O-CB 3.12Å; A562-F566 PolarHBondContact O-N 3.48Å; V563-F566 PolarHBondContact O-N 2.88Å; F564-F566 VanDerWaalsContact C-N 3.26Å; F564-F566 PolarHBondContact O-N 2.98Å; F566-S569 WeakPolarHBondContact O-CB 3.41Å; F566-S569 PolarHBondContact O-OG 3.18Å
567	F	97.7	Very high	95.7	Very high	45 Å²	45	19.9 Å²	19.9	20%	0.197	10%	0.103	C	C	.	.	H	α-helix	trans	-81.4	-31.6	-175.5	-74.1	-58.5	0	0	0	114.3	L540 C541 V563 F564 S569 A570	L540-F567 HydrophobicContact CB-CD1 4Å; L540-F567 HydrophobicContact CB-CD2 3.8Å; L540-F567 HydrophobicContact CB-CE1 4.01Å; L540-F567 HydrophobicContact CB-CE2 3.79Å; L540-F567 HydrophobicContact CB-CG 3.92Å; L540-F567 HydrophobicContact CB-CZ 3.92Å; L540-F567 HydrophobicContact CD1-CD1 4.2Å; L540-F567 HydrophobicContact CD1-CE1 3.5Å; L540-F567 HydrophobicContact CD1-CE2 4.28Å; L540-F567 HydrophobicContact CD1-CZ 3.56Å; L540-F567 HydrophobicContact CG-CE1 4.41Å; L540-F567 HydrophobicContact CG-CZ 4.31Å; C541-F567 HydrophobicContact CB-CB 3.81Å; V563-F567 HydrophobicContact CG1-CD2 3.73Å; V563-F567 HydrophobicContact CG1-CE2 3.71Å; V563-F567 VanDerWaalsContact O-CD2 3.27Å; V563-F567 WeakPolarHBondContact O-CD2 3.2Å; V563-F567 PolarHBondContact O-N 2.92Å; V563-F567 VanDerWaalsContact O-N 3.1Å; F564-F567 PolarHBondContact O-N 3.31Å; F567-S569 PolarHBondContact O-N 3.14Å; F567-A570 PolarHBondContact O-N 2.66Å
568	I	95.1	Very high	95.7	Very high	6 Å²	6	19.9 Å²	19.9	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-65	-23.6	174.9	-165.8	60.4	0	0	0	111.9	L475 F564 G565 A570 N571 Y572	L475-I568 HydrophobicContact CD1-CD1 4.24Å; F564-I568 HydrophobicContact CZ-CB 4.48Å; F564-I568 HydrophobicContact CZ-CG1 4.49Å; F564-I568 WeakPolarHBondContact O-CB 3.42Å; F564-I568 VanDerWaalsContact O-CG2 3.31Å; F564-I568 WeakPolarHBondContact O-CG2 3.19Å; F564-I568 PolarHBondContact O-N 3.24Å; G565-I568 WeakPolarHBondContact O-CG2 3.26Å; I568-A570 PolarHBondContact O-N 3.49Å; I568-A570 VanDerWaalsContact O-N 3.15Å; I568-N571 HydrophobicContact CD1-CB 4.38Å; I568-N571 VanDerWaalsContact O-CB 3.31Å; I568-N571 WeakPolarHBondContact O-CB 3.45Å; I568-N571 PolarHBondContact O-N 3.18Å; I568-Y572 HydrophobicContact CG1-CE2 4.28Å
569	S	94.6	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.2	-31.2	177.6	75.8	0	0	0	0	113.9	N512 A515 F519 F566 F567 N571 Y572 T573	N512-S569 WeakPolarHBondContact OD1-CA 3.21Å; N512-S569 WeakPolarHBondContact OD1-CB 3.29Å; A515-S569 WeakPolarHBondContact CB-OG 3.33Å; F519-S569 WeakPolarHBondContact CD2-OG 3.33Å; F519-S569 VanDerWaalsContact CE2-OG 3.24Å; F519-S569 WeakPolarHBondContact CE2-OG 3.46Å; F566-S569 WeakPolarHBondContact O-CB 3.41Å; F566-S569 PolarHBondContact O-OG 3.18Å; F567-S569 PolarHBondContact O-N 3.14Å; S569-N571 PolarHBondContact O-N 2.75Å; S569-Y572 PolarHBondContact O-N 2.92Å; S569-T573 PolarHBondContact O-N 2.96Å; S569-T573 PolarHBondContact O-OG1 2.98Å
570	A	96.2	Very high	95.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.2	-32.8	176.1	0	0	0	0	0	112.4	F519 S537 F567 I568 Y572 T573 L574	F519-A570 HydrophobicContact CD2-CB 3.7Å; F519-A570 HydrophobicContact CE2-CB 3.76Å; S537-A570 WeakPolarHBondContact OG-CB 3.26Å; F567-A570 PolarHBondContact O-N 2.66Å; I568-A570 PolarHBondContact O-N 3.49Å; I568-A570 VanDerWaalsContact O-N 3.15Å; A570-Y572 VanDerWaalsContact C-N 3.35Å; A570-T573 PolarHBondContact O-N 3.13Å; A570-L574 HydrophobicContact CB-CD1 4.14Å; A570-L574 VanDerWaalsContact O-CB 3.29Å; A570-L574 WeakPolarHBondContact O-CB 3.34Å; A570-L574 WeakPolarHBondContact O-CG 3.43Å; A570-L574 PolarHBondContact O-N 2.77Å
571	N	95.3	Very high	95.5	Very high	5 Å²	5	17.1 Å²	17.1	3%	0.027	9%	0.088	C	C	.	.	H	α-helix	trans	-64.9	-40.5	177.6	178.5	68.6	0	0	0	112.2	L475 Y476 Y534 I568 S569 T575	L475-N571 HydrophobicContact CD2-CB 4.13Å; L475-N571 WeakPolarHBondContact CD2-OD1 3.28Å; Y476-N571 VanDerWaalsContact CE2-ND2 3.34Å; Y476-N571 WeakPolarHBondContact CE2-ND2 3.35Å; Y476-N571 PolarHBondContact OH-ND2 2.89Å; Y534-N571 HydrophobicContact CE2-CB 4.09Å; Y534-N571 PolarHBondContact OH-OD1 3.35Å; I568-N571 HydrophobicContact CD1-CB 4.38Å; I568-N571 VanDerWaalsContact O-CB 3.31Å; I568-N571 WeakPolarHBondContact O-CB 3.45Å; I568-N571 PolarHBondContact O-N 3.18Å; S569-N571 PolarHBondContact O-N 2.75Å; N571-T575 WeakPolarHBondContact O-CB 3.45Å; N571-T575 PolarHBondContact O-OG1 3.09Å; N571-T575 PolarHBondContact OD1-OG1 3.11Å
572	Y	93.2	Very high	95.3	Very high	59 Å²	59	18 Å²	18	23%	0.231	9%	0.093	C	C	.	.	H	α-helix	trans	-72.4	-35.5	179.8	-65.7	-73.7	0	0	0	112.7	V188 M516 I568 S569 A570	V188-Y572 HydrophobicContact CG1-CD1 4.37Å; M516-Y572 HydrophobicContact CE-CD1 4.28Å; M516-Y572 HydrophobicContact CE-CD2 3.54Å; M516-Y572 HydrophobicContact CE-CE2 4.32Å; M516-Y572 HydrophobicContact CE-CG 3.51Å; I568-Y572 HydrophobicContact CG1-CE2 4.28Å; S569-Y572 PolarHBondContact O-N 2.92Å; A570-Y572 VanDerWaalsContact C-N 3.35Å
573	T	95.1	Very high	95	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-86.9	-38.4	-174.9	-50.2	0	0	0	0	113.8	A181 S569 A570	A181-T573 HydrophobicContact CB-CG2 4.45Å; A181-T573 WeakPolarHBondContact O-CG2 3.4Å; S569-T573 PolarHBondContact O-N 2.96Å; S569-T573 PolarHBondContact O-OG1 2.98Å; A570-T573 PolarHBondContact O-N 3.13Å
574	L	96.6	Very high	94.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-101.9	-14.7	-166.8	-52.3	179.2	0	0	0	114	A181 A523 F533 Y534 A570 S576 V577 I578	A181-L574 HydrophobicContact CB-CD2 4.25Å; A523-L574 HydrophobicContact CB-CD2 3.22Å; F533-L574 HydrophobicContact CB-CD1 4.46Å; F533-L574 HydrophobicContact CD1-CD1 3.58Å; F533-L574 HydrophobicContact CE1-CD1 4.02Å; F533-L574 HydrophobicContact CG-CD1 4.16Å; Y534-L574 HydrophobicContact CD2-CB 4.14Å; A570-L574 HydrophobicContact CB-CD1 4.14Å; A570-L574 VanDerWaalsContact O-CB 3.29Å; A570-L574 WeakPolarHBondContact O-CB 3.34Å; A570-L574 WeakPolarHBondContact O-CG 3.43Å; A570-L574 PolarHBondContact O-N 2.77Å; L574-S576 PolarHBondContact O-N 2.97Å; L574-V577 PolarHBondContact O-N 2.79Å; L574-I578 HydrophobicContact CB-CD1 3.94Å; L574-I578 HydrophobicContact CB-CG1 4.43Å; L574-I578 WeakPolarHBondContact O-CB 3.35Å; L574-I578 VanDerWaalsContact O-CG1 3.26Å; L574-I578 WeakPolarHBondContact O-CG1 3.45Å; L574-I578 PolarHBondContact O-N 3.05Å
575	T	96.7	Very high	94	Very high	7 Å²	7	19.5 Å²	19.5	4%	0.043	10%	0.1	C	C	.	.	H	α-helix	trans	-60.4	-48.2	-175.3	-69.5	0	0	0	0	112.3	F468 Y534 N571 V577 L579 M595	F468-T575 HydrophobicContact CE1-CG2 4.24Å; F468-T575 HydrophobicContact CZ-CG2 4.1Å; Y534-T575 WeakPolarHBondContact CE2-OG1 3.31Å; N571-T575 WeakPolarHBondContact O-CB 3.45Å; N571-T575 PolarHBondContact O-OG1 3.09Å; N571-T575 PolarHBondContact OD1-OG1 3.11Å; T575-V577 VanDerWaalsContact C-N 3.34Å; T575-V577 PolarHBondContact O-N 2.99Å; T575-L579 WeakPolarHBondContact O-CB 3.35Å; T575-L579 PolarHBondContact O-N 3.48Å; T575-M595 HydrophobicContact CG2-CE 3.43Å; T575-M595 VanDerWaalsContact CG2-CE 3.43Å; T575-M595 HydrophobicContact CG2-SD 3.11Å; T575-M595 WeakPolarHBondContact CG2-SD 3.4Å
576	S	94.9	Very high	93.5	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.028	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-38.5	176.1	57.3	0	0	0	0	112	T184 L574 L579 V580 F588	T184-S576 WeakPolarHBondContact CG2-OG 3.49Å; L574-S576 PolarHBondContact O-N 2.97Å; S576-L579 PolarHBondContact O-N 3.03Å; S576-V580 WeakPolarHBondContact O-CG2 3.34Å; S576-V580 PolarHBondContact O-N 3.18Å; S576-V580 VanDerWaalsContact O-N 3.07Å; S576-F588 WeakPolarHBondContact O-CE2 3.3Å
577	V	95.2	Very high	93.1	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.03	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-52.5	179.6	-178	0	0	0	0	110.7	R180 A181 L574 T575 L579 V580 D581	R180-V577 HydrophobicContact CG-CG2 4.15Å; A181-V577 HydrophobicContact CB-CG2 3.91Å; L574-V577 PolarHBondContact O-N 2.79Å; T575-V577 VanDerWaalsContact C-N 3.34Å; T575-V577 PolarHBondContact O-N 2.99Å; V577-L579 PolarHBondContact O-N 3.43Å; V577-V580 PolarHBondContact O-N 3.29Å; V577-D581 PolarHBondContact O-N 2.89Å; V577-D581 VanDerWaalsContact O-N 3.09Å
578	I	95.9	Very high	92.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.4	-39	177.3	-68.3	164.6	0	0	0	109.9	F468 N530 Y534 L574 V580 D581 L582	F468-I578 HydrophobicContact CD2-CG2 4.48Å; F468-I578 HydrophobicContact CE2-CG2 3.97Å; F468-I578 HydrophobicContact CZ-CB 4.48Å; F468-I578 HydrophobicContact CZ-CG2 4.12Å; N530-I578 HydrophobicContact CB-CG1 4.15Å; Y534-I578 HydrophobicContact CD1-CD1 4.5Å; Y534-I578 HydrophobicContact CD2-CD1 3.8Å; Y534-I578 HydrophobicContact CG-CD1 3.67Å; L574-I578 HydrophobicContact CB-CD1 3.94Å; L574-I578 HydrophobicContact CB-CG1 4.43Å; L574-I578 WeakPolarHBondContact O-CB 3.35Å; L574-I578 VanDerWaalsContact O-CG1 3.26Å; L574-I578 WeakPolarHBondContact O-CG1 3.45Å; L574-I578 PolarHBondContact O-N 3.05Å; I578-V580 VanDerWaalsContact C-N 3.34Å; I578-V580 PolarHBondContact O-N 3.38Å; I578-D581 CarbonylContact O-C 3.6Å; I578-D581 WeakPolarHBondContact O-CA 3.48Å; I578-D581 WeakPolarHBondContact O-CB 3.3Å; I578-D581 PolarHBondContact O-N 3.4Å; I578-D581 VanDerWaalsContact O-N 3.08Å; I578-L582 HydrophobicContact CG2-CD1 4.08Å; I578-L582 HydrophobicContact CG2-CG 4.02Å; I578-L582 VanDerWaalsContact O-CG 3.3Å; I578-L582 WeakPolarHBondContact O-CG 3.33Å; I578-L582 PolarHBondContact O-N 3.25Å
579	L	96.1	Very high	92.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.7	-40.2	-179	-171.9	62.6	0	0	0	112.6	F465 F468 T575 S576 V577 D581 L582 M583 F588 Y592 M595	F465-L579 HydrophobicContact CD2-CD1 3.88Å; F465-L579 HydrophobicContact CE2-CD1 3.62Å; F468-L579 HydrophobicContact CD1-CD1 4.3Å; F468-L579 HydrophobicContact CE1-CD1 4.36Å; T575-L579 WeakPolarHBondContact O-CB 3.35Å; T575-L579 PolarHBondContact O-N 3.48Å; S576-L579 PolarHBondContact O-N 3.03Å; V577-L579 PolarHBondContact O-N 3.43Å; L579-D581 VanDerWaalsContact C-N 3.33Å; L579-L582 PolarHBondContact O-N 3.49Å; L579-M583 HydrophobicContact CD1-CG 4.22Å; L579-M583 PolarHBondContact O-N 3.12Å; L579-F588 HydrophobicContact CB-CD2 4.36Å; L579-F588 HydrophobicContact CB-CE2 4.2Å; L579-F588 HydrophobicContact CD2-CD2 4.13Å; L579-F588 HydrophobicContact CD2-CE2 3.97Å; L579-F588 HydrophobicContact CG-CD2 4.17Å; L579-F588 HydrophobicContact CG-CE2 4.3Å; L579-Y592 HydrophobicContact CD2-CD2 4.01Å; L579-Y592 HydrophobicContact CD2-CG 4.38Å; L579-M595 HydrophobicContact CD2-CE 4.38Å; L579-M595 HydrophobicContact CD2-SD 3.92Å
580	V	94.2	Very high	92.8	Very high	10 Å²	10	18.7 Å²	18.7	6%	0.061	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-41.7	170.8	-179.1	0	0	0	0	110.8	T173 S576 V577 I578 L582 S584 L585 F588	T173-V580 HydrophobicContact CG2-CG2 3.48Å; T173-V580 VanDerWaalsContact CG2-CG2 3.48Å; S576-V580 WeakPolarHBondContact O-CG2 3.34Å; S576-V580 PolarHBondContact O-N 3.18Å; S576-V580 VanDerWaalsContact O-N 3.07Å; V577-V580 PolarHBondContact O-N 3.29Å; I578-V580 VanDerWaalsContact C-N 3.34Å; I578-V580 PolarHBondContact O-N 3.38Å; V580-L582 PolarHBondContact O-N 2.93Å; V580-S584 VanDerWaalsContact O-CA 3.27Å; V580-S584 WeakPolarHBondContact O-CA 3.35Å; V580-S584 PolarHBondContact O-N 3.36Å; V580-L585 HydrophobicContact CG1-CB 4.43Å; V580-L585 HydrophobicContact CG1-CD1 3.98Å; V580-L585 HydrophobicContact CG2-CD1 4.31Å; V580-F588 HydrophobicContact CB-CD2 4.38Å; V580-F588 HydrophobicContact CG2-CB 4.22Å; V580-F588 HydrophobicContact CG2-CD1 4.42Å; V580-F588 HydrophobicContact CG2-CD2 3.28Å; V580-F588 HydrophobicContact CG2-CE2 3.67Å; V580-F588 HydrophobicContact CG2-CG 3.71Å; V580-F588 HydrophobicContact CG2-CZ 4.4Å
581	D	92	Very high	92.9	Very high	77 Å²	77	18.7 Å²	18.7	41%	0.412	10%	0.104	S	C	.	.	H	α-helix	trans	-65.7	-25.6	177.2	-64.4	-17.1	0	0	0	112.9	V577 I578 L579 K645	V577-D581 PolarHBondContact O-N 2.89Å; V577-D581 VanDerWaalsContact O-N 3.09Å; I578-D581 CarbonylContact O-C 3.6Å; I578-D581 WeakPolarHBondContact O-CA 3.48Å; I578-D581 WeakPolarHBondContact O-CB 3.3Å; I578-D581 PolarHBondContact O-N 3.4Å; I578-D581 VanDerWaalsContact O-N 3.08Å; L579-D581 VanDerWaalsContact C-N 3.33Å; D581-K645 PolarHBondContact O-NZ 3.42Å
582	L	92.3	Very high	92.9	Very high	19 Å²	19	19.1 Å²	19.1	10%	0.099	11%	0.105	C	C	.	.	H	α-helix	trans	-81.2	-51.2	175.8	-68.9	-174	0	0	0	112	F468 I578 L579 V580 I641 K645	F468-L582 HydrophobicContact CB-CD1 3.73Å; F468-L582 HydrophobicContact CD1-CD1 4.02Å; F468-L582 HydrophobicContact CD2-CD1 4.19Å; F468-L582 HydrophobicContact CG-CD1 3.72Å; I578-L582 HydrophobicContact CG2-CD1 4.08Å; I578-L582 HydrophobicContact CG2-CG 4.02Å; I578-L582 VanDerWaalsContact O-CG 3.3Å; I578-L582 WeakPolarHBondContact O-CG 3.33Å; I578-L582 PolarHBondContact O-N 3.25Å; L579-L582 PolarHBondContact O-N 3.49Å; V580-L582 PolarHBondContact O-N 2.93Å; L582-I641 HydrophobicContact CD2-CG2 3.97Å; L582-K645 HydrophobicContact CD2-CD 4.17Å; L582-K645 VanDerWaalsContact CD2-NZ 3.26Å
583	M	89.9	Confident	93.1	Very high	20 Å²	20	16.3 Å²	16.3	10%	0.099	9%	0.094	C	C	.	.	H	α-helix	trans	-107.4	-8.1	-165.8	-63.6	-52.9	-70.7	0	0	115.4	L459 D462 F465 L579 D587	L459-M583 HydrophobicContact CB-CE 3.99Å; L459-M583 HydrophobicContact CD2-CE 3.29Å; L459-M583 HydrophobicContact CG-CE 4.18Å; D462-M583 HydrophobicContact CB-CE 4.32Å; D462-M583 HydrophobicContact CB-SD 4.31Å; F465-M583 HydrophobicContact CB-CE 4.37Å; F465-M583 HydrophobicContact CB-CG 4.48Å; F465-M583 HydrophobicContact CB-SD 3.55Å; F465-M583 VanDerWaalsContact CB-SD 3.55Å; F465-M583 HydrophobicContact CD1-CE 4.46Å; F465-M583 HydrophobicContact CD2-CG 3.9Å; F465-M583 HydrophobicContact CD2-SD 4.07Å; F465-M583 HydrophobicContact CE2-CG 4.46Å; F465-M583 HydrophobicContact CG-CE 4.31Å; F465-M583 HydrophobicContact CG-CG 4.23Å; F465-M583 HydrophobicContact CG-SD 3.79Å; L579-M583 HydrophobicContact CD1-CG 4.22Å; L579-M583 PolarHBondContact O-N 3.12Å; M583-D587 HydrophobicContact CB-CB 4.35Å
584	S	85.8	Confident	93.2	Very high	55 Å²	55	16.7 Å²	16.7	39%	0.385	10%	0.096	S	C	.	.			trans	73.4	166.3	-167	84	0	0	0	0	114.4	V580 S586 F588	V580-S584 VanDerWaalsContact O-CA 3.27Å; V580-S584 WeakPolarHBondContact O-CA 3.35Å; V580-S584 PolarHBondContact O-N 3.36Å; S584-S586 PolarHBondContact OG-OG 2.99Å; S584-F588 PolarHBondContact O-N 3.27Å
585	L	86.2	Confident	93.2	Very high	31 Å²	31	16.8 Å²	16.8	16%	0.162	10%	0.096	C	C	.	.	S	Bend	trans	-70.5	-28.9	-175	-161	69.8	0	0	0	112.9	F47 T173 Y174 V580 F588	F47-L585 HydrophobicContact CD1-CB 4.12Å; F47-L585 HydrophobicContact CD1-CD2 4.24Å; F47-L585 HydrophobicContact CE1-CB 4.31Å; T173-L585 HydrophobicContact CG2-CD1 4.25Å; Y174-L585 HydrophobicContact CD1-CD1 3.88Å; Y174-L585 HydrophobicContact CD1-CD2 4.39Å; Y174-L585 HydrophobicContact CD1-CG 4.05Å; Y174-L585 HydrophobicContact CE1-CD1 4.11Å; Y174-L585 HydrophobicContact CE1-CG 4.02Å; V580-L585 HydrophobicContact CG1-CB 4.43Å; V580-L585 HydrophobicContact CG1-CD1 3.98Å; V580-L585 HydrophobicContact CG2-CD1 4.31Å; L585-F588 WeakPolarHBondContact O-CB 3.35Å
586	S	82.9	Confident	93.3	Very high	49 Å²	49	16.4 Å²	16.4	34%	0.343	9%	0.094	S	C	.	.	S	Bend	trans	-65.3	-44.1	178.5	57.8	0	0	0	0	111.9	S584 F588	S584-S586 PolarHBondContact OG-OG 2.99Å; S586-F588 VanDerWaalsContact C-N 3.32Å
587	D	89	Confident	93.3	Very high	36 Å²	36	19.1 Å²	19.1	19%	0.193	11%	0.107	C	C	.	.	S	Bend	trans	-93.9	0.8	-171.7	-68.6	13	0	0	0	110.7	K458 L459 M583 V589 S591	K458-D587 IonicContact NZ-OD2 3.05Å; L459-D587 HydrophobicContact CD2-CB 3.63Å; L459-D587 WeakPolarHBondContact CD2-OD2 3.25Å; M583-D587 HydrophobicContact CB-CB 4.35Å; D587-V589 PolarHBondContact O-N 3.36Å; D587-S591 VanDerWaalsContact O-CB 3.31Å; D587-S591 WeakPolarHBondContact O-CB 3.37Å; D587-S591 PolarHBondContact O-N 3.39Å; D587-S591 PolarHBondContact O-OG 3.48Å
588	F	92.9	Very high	93.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-46.6	-177	173.8	-109.4	0	0	0	112.7	I169 V170 T173 Y174 S576 L579 V580 S584 L585 S586 Y590 S591 Y592	I169-F588 HydrophobicContact CG2-CZ 4.47Å; V170-F588 HydrophobicContact CB-CE1 4.47Å; V170-F588 HydrophobicContact CG2-CD1 4.45Å; V170-F588 HydrophobicContact CG2-CE1 3.95Å; T173-F588 HydrophobicContact CG2-CD1 3.86Å; T173-F588 HydrophobicContact CG2-CE1 3.55Å; T173-F588 HydrophobicContact CG2-CE2 4.24Å; T173-F588 HydrophobicContact CG2-CG 4.34Å; T173-F588 HydrophobicContact CG2-CZ 3.76Å; Y174-F588 HydrophobicContact CE1-CD1 4.47Å; S576-F588 WeakPolarHBondContact O-CE2 3.3Å; L579-F588 HydrophobicContact CB-CD2 4.36Å; L579-F588 HydrophobicContact CB-CE2 4.2Å; L579-F588 HydrophobicContact CD2-CD2 4.13Å; L579-F588 HydrophobicContact CD2-CE2 3.97Å; L579-F588 HydrophobicContact CG-CD2 4.17Å; L579-F588 HydrophobicContact CG-CE2 4.3Å; V580-F588 HydrophobicContact CB-CD2 4.38Å; V580-F588 HydrophobicContact CG2-CB 4.22Å; V580-F588 HydrophobicContact CG2-CD1 4.42Å; V580-F588 HydrophobicContact CG2-CD2 3.28Å; V580-F588 HydrophobicContact CG2-CE2 3.67Å; V580-F588 HydrophobicContact CG2-CG 3.71Å; V580-F588 HydrophobicContact CG2-CZ 4.4Å; S584-F588 PolarHBondContact O-N 3.27Å; L585-F588 WeakPolarHBondContact O-CB 3.35Å; S586-F588 VanDerWaalsContact C-N 3.32Å; F588-Y590 PolarHBondContact O-N 2.89Å; F588-S591 VanDerWaalsContact CA-OG 3.31Å; F588-S591 WeakPolarHBondContact CA-OG 3.47Å; F588-S591 PolarHBondContact O-N 3.35Å; F588-S591 PolarHBondContact O-OG 3.34Å; F588-Y592 HydrophobicContact CE2-CD2 4.13Å; F588-Y592 HydrophobicContact CE2-CG 4.49Å; F588-Y592 AromaticContact CZ-CD2 3.96Å; F588-Y592 HydrophobicContact CZ-CD2 3.96Å; F588-Y592 HydrophobicContact CZ-CG 4.2Å; F588-Y592 WeakPolarHBondContact O-CB 3.4Å; F588-Y592 PolarHBondContact O-N 3.48Å
589	V	93.8	Very high	93.3	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	11%	0.114	C	C	.	.	H	α-helix	trans	-61.7	-46.1	-175.4	179.1	0	0	0	0	111.4	S114 I117 V170 Y174 D587 G593	S114-V589 WeakPolarHBondContact CB-O 3.39Å; S114-V589 WeakPolarHBondContact O-CG1 3.45Å; S114-V589 PolarHBondContact OG-O 3.38Å; I117-V589 HydrophobicContact CB-CG1 4.19Å; I117-V589 HydrophobicContact CG2-CG1 4.19Å; V170-V589 HydrophobicContact CG1-CG2 3.63Å; V170-V589 HydrophobicContact CG2-CG1 4.48Å; V170-V589 HydrophobicContact CG2-CG2 4.12Å; Y174-V589 HydrophobicContact CE1-CG2 4.45Å; Y174-V589 HydrophobicContact CE2-CG2 4.35Å; Y174-V589 WeakPolarHBondContact OH-CG2 3.5Å; D587-V589 PolarHBondContact O-N 3.36Å; V589-G593 PolarHBondContact O-N 2.82Å; V589-G593 VanDerWaalsContact O-N 3.11Å
590	Y	95.6	Very high	93.2	Very high	14 Å²	14	20.4 Å²	20.4	6%	0.055	11%	0.114	C	C	.	.	H	α-helix	trans	-69.6	-43.1	178.5	-70.5	-68.7	0	0	0	111.8	A115 D118 I452 Y456 F588 Y592 G593 I594	A115-Y590 HydrophobicContact CB-CE1 4.43Å; D118-Y590 HydrophobicContact CB-CE2 4.15Å; D118-Y590 WeakPolarHBondContact CB-OH 3.28Å; D118-Y590 PolarHBondContact OD2-OH 3.32Å; I452-Y590 HydrophobicContact CG2-CE1 4.06Å; Y456-Y590 HydrophobicContact CD1-CD1 4.16Å; Y456-Y590 HydrophobicContact CD2-CD1 4.47Å; Y456-Y590 AromaticContact CE1-CD1 3.66Å; Y456-Y590 HydrophobicContact CE1-CD1 3.66Å; Y456-Y590 HydrophobicContact CE1-CG 4.31Å; Y456-Y590 VanDerWaalsContact CE1-O 3.32Å; Y456-Y590 WeakPolarHBondContact CE1-O 3.34Å; Y456-Y590 AromaticContact CE2-CD1 3.96Å; Y456-Y590 HydrophobicContact CE2-CD1 3.96Å; Y456-Y590 HydrophobicContact CE2-CE1 4.28Å; Y456-Y590 AromaticContact CZ-CD1 3.52Å; F588-Y590 PolarHBondContact O-N 2.89Å; Y590-Y592 VanDerWaalsContact C-N 3.34Å; Y590-Y592 PolarHBondContact O-N 3Å; Y590-G593 PolarHBondContact O-N 3.25Å; Y590-I594 PolarHBondContact O-N 3.24Å; Y590-I594 VanDerWaalsContact O-N 3.1Å
591	S	96.4	Very high	93.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-38.1	178.2	60.1	0	0	0	0	112.3	D587 F588 G593 I594 M595	D587-S591 VanDerWaalsContact O-CB 3.31Å; D587-S591 WeakPolarHBondContact O-CB 3.37Å; D587-S591 PolarHBondContact O-N 3.39Å; D587-S591 PolarHBondContact O-OG 3.48Å; F588-S591 VanDerWaalsContact CA-OG 3.31Å; F588-S591 WeakPolarHBondContact CA-OG 3.47Å; F588-S591 PolarHBondContact O-N 3.35Å; F588-S591 PolarHBondContact O-OG 3.34Å; S591-G593 VanDerWaalsContact C-N 3.35Å; S591-I594 PolarHBondContact O-N 2.95Å; S591-M595 WeakPolarHBondContact O-CB 3.44Å; S591-M595 PolarHBondContact O-N 3.45Å
592	Y	96.6	Very high	93	Very high	13 Å²	13	20.4 Å²	20.4	5%	0.051	11%	0.11	C	C	.	.	H	α-helix	trans	-64.7	-40.7	175.5	-172.4	-96.8	0	0	0	111.1	F165 T166 I169 L579 F588 Y590 M595 C596	F165-Y592 HydrophobicContact CE1-CE1 4.29Å; F165-Y592 WeakPolarHBondContact CE1-OH 3.49Å; F165-Y592 WeakPolarHBondContact CZ-OH 3.28Å; T166-Y592 HydrophobicContact CG2-CD1 4.02Å; T166-Y592 HydrophobicContact CG2-CE1 4.23Å; I169-Y592 HydrophobicContact CB-CE1 4.35Å; I169-Y592 HydrophobicContact CG2-CD2 4.47Å; I169-Y592 HydrophobicContact CG2-CE1 4.27Å; I169-Y592 HydrophobicContact CG2-CE2 3.77Å; L579-Y592 HydrophobicContact CD2-CD2 4.01Å; L579-Y592 HydrophobicContact CD2-CG 4.38Å; F588-Y592 HydrophobicContact CE2-CD2 4.13Å; F588-Y592 HydrophobicContact CE2-CG 4.49Å; F588-Y592 AromaticContact CZ-CD2 3.96Å; F588-Y592 HydrophobicContact CZ-CD2 3.96Å; F588-Y592 HydrophobicContact CZ-CG 4.2Å; F588-Y592 WeakPolarHBondContact O-CB 3.4Å; F588-Y592 PolarHBondContact O-N 3.48Å; Y590-Y592 VanDerWaalsContact C-N 3.34Å; Y590-Y592 PolarHBondContact O-N 3Å; Y592-M595 HydrophobicContact CD2-CE 3.42Å; Y592-M595 VanDerWaalsContact CD2-CE 3.42Å; Y592-M595 HydrophobicContact CE2-CE 3.44Å; Y592-M595 VanDerWaalsContact CE2-CE 3.44Å; Y592-M595 HydrophobicContact CG-CE 4.25Å; Y592-M595 PolarHBondContact O-N 3.27Å; Y592-C596 VanDerWaalsContact CE1-SG 3.5Å; Y592-C596 VanDerWaalsContact CZ-SG 3.56Å; Y592-C596 PolarHBondContact O-N 2.99Å
593	G	97.4	Very high	92.8	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.6	-48.7	174.7	0	0	0	0	0	113.2	P111 S114 V589 Y590 S591 M595 M597	P111-G593 WeakPolarHBondContact CD-O 3.46Å; P111-G593 WeakPolarHBondContact CG-O 3.45Å; S114-G593 VanDerWaalsContact OG-CA 3.31Å; S114-G593 WeakPolarHBondContact OG-CA 3.28Å; S114-G593 PolarHBondContact OG-N 3.18Å; V589-G593 PolarHBondContact O-N 2.82Å; V589-G593 VanDerWaalsContact O-N 3.11Å; Y590-G593 PolarHBondContact O-N 3.25Å; S591-G593 VanDerWaalsContact C-N 3.35Å; G593-M595 VanDerWaalsContact C-N 3.34Å; G593-M595 PolarHBondContact O-N 3.19Å; G593-M597 PolarHBondContact O-N 3Å
594	I	97.4	Very high	92.5	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.046	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-44.8	175.9	-66.5	174.1	0	0	0	110.5	Y456 L459 L460 F465 L469 Y590 S591 M597 V598	Y456-I594 HydrophobicContact CD1-CD1 3.5Å; Y456-I594 VanDerWaalsContact CD1-CD1 3.5Å; Y456-I594 HydrophobicContact CD1-CG1 3.43Å; Y456-I594 VanDerWaalsContact CD1-CG1 3.43Å; Y456-I594 HydrophobicContact CE1-CD1 4.3Å; Y456-I594 HydrophobicContact CE1-CG1 3.78Å; Y456-I594 HydrophobicContact CG-CD1 4.3Å; Y456-I594 HydrophobicContact CG-CG1 4.42Å; L459-I594 HydrophobicContact CB-CD1 4.39Å; L459-I594 HydrophobicContact CD1-CD1 4.26Å; L460-I594 HydrophobicContact CD2-CD1 4.32Å; L460-I594 HydrophobicContact CD2-CG2 4.36Å; L460-I594 HydrophobicContact CG-CD1 4.25Å; F465-I594 HydrophobicContact CE1-CD1 4.07Å; F465-I594 HydrophobicContact CE1-CG2 4.4Å; F465-I594 HydrophobicContact CZ-CB 4.12Å; F465-I594 HydrophobicContact CZ-CD1 4.39Å; F465-I594 HydrophobicContact CZ-CG2 4.22Å; L469-I594 HydrophobicContact CD1-CG2 3.64Å; L469-I594 HydrophobicContact CD2-CG2 3.88Å; L469-I594 HydrophobicContact CG-CG2 4.43Å; Y590-I594 PolarHBondContact O-N 3.24Å; Y590-I594 VanDerWaalsContact O-N 3.1Å; S591-I594 PolarHBondContact O-N 2.95Å; I594-M597 WeakPolarHBondContact O-CB 3.32Å; I594-M597 PolarHBondContact O-N 3.18Å; I594-V598 HydrophobicContact CG2-CG2 4.3Å; I594-V598 WeakPolarHBondContact O-CG2 3.13Å; I594-V598 PolarHBondContact O-N 3.2Å
595	M	97.2	Very high	92.6	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-60.3	-49.9	-178.1	-180	-163.2	76.4	0	0	111.6	F468 L469 T575 L579 S591 Y592 G593 M597 V598 Q599	F468-M595 HydrophobicContact CE1-SD 3.85Å; L469-M595 HydrophobicContact CD2-CB 3.94Å; L469-M595 HydrophobicContact CD2-CG 4.42Å; T575-M595 HydrophobicContact CG2-CE 3.43Å; T575-M595 VanDerWaalsContact CG2-CE 3.43Å; T575-M595 HydrophobicContact CG2-SD 3.11Å; T575-M595 WeakPolarHBondContact CG2-SD 3.4Å; L579-M595 HydrophobicContact CD2-CE 4.38Å; L579-M595 HydrophobicContact CD2-SD 3.92Å; S591-M595 WeakPolarHBondContact O-CB 3.44Å; S591-M595 PolarHBondContact O-N 3.45Å; Y592-M595 HydrophobicContact CD2-CE 3.42Å; Y592-M595 VanDerWaalsContact CD2-CE 3.42Å; Y592-M595 HydrophobicContact CE2-CE 3.44Å; Y592-M595 VanDerWaalsContact CE2-CE 3.44Å; Y592-M595 HydrophobicContact CG-CE 4.25Å; Y592-M595 PolarHBondContact O-N 3.27Å; G593-M595 VanDerWaalsContact C-N 3.34Å; G593-M595 PolarHBondContact O-N 3.19Å; M595-M597 VanDerWaalsContact C-N 3.3Å; M595-M597 PolarHBondContact O-N 3.21Å; M595-V598 PolarHBondContact O-N 3.24Å; M595-Q599 VanDerWaalsContact O-CG 3.27Å; M595-Q599 WeakPolarHBondContact O-CG 3.47Å; M595-Q599 PolarHBondContact O-N 2.99Å
596	C	96.7	Very high	92.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-37.2	176	-71.8	0	0	0	0	112.2	L107 S110 Y592 V598 Q599 G600	L107-C596 WeakPolarHBondContact CB-O 3.32Å; L107-C596 HydrophobicContact CD2-CB 4.26Å; L107-C596 CarbonylContact O-C 3.59Å; L107-C596 VanDerWaalsContact O-C 3.25Å; S110-C596 VanDerWaalsContact CB-CB 3.48Å; S110-C596 WeakPolarHBondContact OG-CB 3.46Å; Y592-C596 VanDerWaalsContact CE1-SG 3.5Å; Y592-C596 VanDerWaalsContact CZ-SG 3.56Å; Y592-C596 PolarHBondContact O-N 2.99Å; C596-V598 PolarHBondContact O-N 3.25Å; C596-Q599 WeakPolarHBondContact O-CB 3.19Å; C596-Q599 PolarHBondContact O-N 2.74Å; C596-G600 PolarHBondContact O-N 3.21Å
597	M	96.5	Very high	92.5	Very high	60 Å²	60	24 Å²	24	30%	0.296	13%	0.125	S	C	.	.	H	α-helix	trans	-60.6	-46.3	174.5	-177.8	-176.1	66.2	0	0	111.8	L107 P111 G593 I594 M595 Q599 G600 F601	L107-M597 VanDerWaalsContact O-CA 3.29Å; L107-M597 WeakPolarHBondContact O-CA 3.45Å; L107-M597 PolarHBondContact O-N 3.29Å; P111-M597 HydrophobicContact CG-CB 3.71Å; P111-M597 HydrophobicContact CG-CG 4.17Å; P111-M597 HydrophobicContact CG-SD 3.78Å; G593-M597 PolarHBondContact O-N 3Å; I594-M597 WeakPolarHBondContact O-CB 3.32Å; I594-M597 PolarHBondContact O-N 3.18Å; M595-M597 VanDerWaalsContact C-N 3.3Å; M595-M597 PolarHBondContact O-N 3.21Å; M597-Q599 VanDerWaalsContact C-N 3.34Å; M597-G600 PolarHBondContact O-N 3.41Å; M597-F601 HydrophobicContact CG-CD2 3.96Å; M597-F601 HydrophobicContact CG-CE2 3.68Å; M597-F601 VanDerWaalsContact O-CD2 3.23Å; M597-F601 WeakPolarHBondContact O-CD2 3.48Å; M597-F601 PolarHBondContact O-N 2.99Å; M597-F601 HydrophobicContact SD-CE2 4.19Å
598	V	96.2	Very high	92.3	Very high	27 Å²	27	26.4 Å²	26.4	16%	0.164	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-42.2	177.3	169.8	0	0	0	0	110.9	L469 F473 I594 M595 C596 G600 F601 G602	L469-V598 HydrophobicContact CD2-CG2 4.32Å; F473-V598 HydrophobicContact CB-CG1 3.44Å; F473-V598 VanDerWaalsContact CB-CG1 3.44Å; F473-V598 HydrophobicContact CD2-CG1 3.9Å; F473-V598 HydrophobicContact CG-CG1 4.11Å; I594-V598 HydrophobicContact CG2-CG2 4.3Å; I594-V598 WeakPolarHBondContact O-CG2 3.13Å; I594-V598 PolarHBondContact O-N 3.2Å; M595-V598 PolarHBondContact O-N 3.24Å; C596-V598 PolarHBondContact O-N 3.25Å; V598-G600 VanDerWaalsContact C-N 3.35Å; V598-F601 PolarHBondContact O-N 3.5Å; V598-G602 PolarHBondContact O-N 3.34Å
599	Q	94.8	Very high	92	Very high	5 Å²	5	30.2 Å²	30.2	2%	0.023	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-43.5	173	-69.4	173.4	-12.2	0	0	111.6	N472 Y476 M595 C596 M597 F601 G602 T603	N472-Q599 HydrophobicContact CB-CG 4.22Å; N472-Q599 PolarHBondContact OD1-NE2 2.97Å; Y476-Q599 HydrophobicContact CD1-CB 3.65Å; Y476-Q599 HydrophobicContact CD1-CG 4.03Å; Y476-Q599 HydrophobicContact CD2-CB 4.07Å; Y476-Q599 HydrophobicContact CD2-CG 3.54Å; Y476-Q599 HydrophobicContact CE1-CB 3.87Å; Y476-Q599 HydrophobicContact CE1-CG 4.06Å; Y476-Q599 HydrophobicContact CE2-CB 4.27Å; Y476-Q599 VanDerWaalsContact CE2-CD 3.43Å; Y476-Q599 HydrophobicContact CE2-CG 3.56Å; Y476-Q599 VanDerWaalsContact CE2-NE2 3.34Å; Y476-Q599 HydrophobicContact CG-CB 3.73Å; Y476-Q599 HydrophobicContact CG-CG 3.76Å; Y476-Q599 VanDerWaalsContact CZ-CD 3.41Å; M595-Q599 VanDerWaalsContact O-CG 3.27Å; M595-Q599 WeakPolarHBondContact O-CG 3.47Å; M595-Q599 PolarHBondContact O-N 2.99Å; C596-Q599 WeakPolarHBondContact O-CB 3.19Å; C596-Q599 PolarHBondContact O-N 2.74Å; M597-Q599 VanDerWaalsContact C-N 3.34Å; Q599-F601 PolarHBondContact O-N 2.8Å; Q599-G602 WeakPolarHBondContact O-CA 3.43Å; Q599-G602 PolarHBondContact O-N 3.29Å; Q599-G602 VanDerWaalsContact O-N 3.07Å; Q599-T603 PolarHBondContact O-N 3.16Å; Q599-T603 PolarHBondContact O-OG1 2.7Å
600	G	92.7	Very high	91.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-41.4	177	0	0	0	0	0	113.2	C596 M597 V598 L604	C596-G600 PolarHBondContact O-N 3.21Å; M597-G600 PolarHBondContact O-N 3.41Å; V598-G600 VanDerWaalsContact C-N 3.35Å; G600-L604 WeakPolarHBondContact O-CB 3.29Å; G600-L604 PolarHBondContact O-N 3.31Å
601	F	92	Very high	90.6	Very high	87 Å²	87	31.1 Å²	31.1	38%	0.382	18%	0.176	S	C	.	.	H	α-helix	trans	-66.7	-38.1	171.2	-78.2	-67.2	0	0	0	112.5	F473 M597 V598 Q599 L604 I605	F473-F601 HydrophobicContact CE2-CB 4.24Å; M597-F601 HydrophobicContact CG-CD2 3.96Å; M597-F601 HydrophobicContact CG-CE2 3.68Å; M597-F601 VanDerWaalsContact O-CD2 3.23Å; M597-F601 WeakPolarHBondContact O-CD2 3.48Å; M597-F601 PolarHBondContact O-N 2.99Å; M597-F601 HydrophobicContact SD-CE2 4.19Å; V598-F601 PolarHBondContact O-N 3.5Å; Q599-F601 PolarHBondContact O-N 2.8Å; F601-L604 PolarHBondContact O-N 3.24Å; F601-I605 WeakPolarHBondContact O-CG1 3.49Å; F601-I605 PolarHBondContact O-N 3.24Å; F601-I605 VanDerWaalsContact O-N 3.11Å
602	G	91.7	Very high	90	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56	-56.4	174	0	0	0	0	0	111.4	Y476 A477 V598 Q599 L604 I605 G606	Y476-G602 CarbonylContact O-C 3.57Å; A477-G602 WeakPolarHBondContact CA-O 3.27Å; V598-G602 PolarHBondContact O-N 3.34Å; Q599-G602 WeakPolarHBondContact O-CA 3.43Å; Q599-G602 PolarHBondContact O-N 3.29Å; Q599-G602 VanDerWaalsContact O-N 3.07Å; G602-L604 VanDerWaalsContact C-N 3.27Å; G602-L604 PolarHBondContact O-N 3.11Å; G602-I605 PolarHBondContact O-N 2.95Å; G602-I605 VanDerWaalsContact O-N 3.1Å; G602-G606 PolarHBondContact O-N 3.5Å
603	T	88	Confident	89.5	Confident	33 Å²	33	34.4 Å²	34.4	20%	0.202	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-30	178.7	-58.4	0	0	0	0	113.1	Y476 Q599 P607	Y476-T603 PolarHBondContact O-N 3.2Å; Q599-T603 PolarHBondContact O-N 3.16Å; Q599-T603 PolarHBondContact O-OG1 2.7Å; T603-P607 WeakPolarHBondContact O-CD 3.42Å
604	L	83.2	Confident	88.8	Confident	87 Å²	87	37 Å²	37	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-69.2	-35.8	174.7	-172.8	65.6	0	0	0	112.4	I108 G600 F601 G602 P608	I108-L604 HydrophobicContact CD1-CD2 4.47Å; G600-L604 WeakPolarHBondContact O-CB 3.29Å; G600-L604 PolarHBondContact O-N 3.31Å; F601-L604 PolarHBondContact O-N 3.24Å; G602-L604 VanDerWaalsContact C-N 3.27Å; G602-L604 PolarHBondContact O-N 3.11Å; L604-P608 WeakPolarHBondContact O-CD 3.46Å
605	I	87.2	Confident	88.3	Confident	80 Å²	80	41.8 Å²	41.8	41%	0.41	24%	0.236	S	C	.	.	H	α-helix	trans	-83.6	-30.2	-179	-67	166.4	0	0	0	111.7	F473 F601 G602 P608 L609	F473-I605 HydrophobicContact CE2-CD1 4.19Å; F473-I605 HydrophobicContact CZ-CD1 3.92Å; F601-I605 WeakPolarHBondContact O-CG1 3.49Å; F601-I605 PolarHBondContact O-N 3.24Å; F601-I605 VanDerWaalsContact O-N 3.11Å; G602-I605 PolarHBondContact O-N 2.95Å; G602-I605 VanDerWaalsContact O-N 3.1Å; I605-P608 WeakPolarHBondContact O-CD 3.47Å; I605-L609 HydrophobicContact CG2-CB 4.42Å; I605-L609 VanDerWaalsContact O-CB 3.25Å; I605-L609 WeakPolarHBondContact O-CB 3.13Å; I605-L609 PolarHBondContact O-N 3.26Å
606	G	85.4	Confident	87.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-57.3	-170.3	0	0	0	0	0	115.1	A477 G602 L609 A610	A477-G606 WeakPolarHBondContact O-CA 3.29Å; G602-G606 PolarHBondContact O-N 3.5Å; G606-L609 WeakPolarHBondContact O-CB 3.32Å; G606-L609 PolarHBondContact O-N 2.67Å; G606-L609 VanDerWaalsContact O-N 3.13Å; G606-A610 WeakPolarHBondContact O-CB 3.38Å; G606-A610 PolarHBondContact O-N 3.41Å
607	P	82.8	Confident	87.3	Confident	50 Å²	50	52.2 Å²	52.2	33%	0.325	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-44.7	-178.8	-20.6	30.3	0	0	0	113.6	I484 T603 L609 A610 G611	I484-P607 HydrophobicContact CD1-CB 4.04Å; I484-P607 HydrophobicContact CD1-CG 4.35Å; T603-P607 WeakPolarHBondContact O-CD 3.42Å; P607-L609 VanDerWaalsContact C-N 3.32Å; P607-L609 PolarHBondContact O-N 3.18Å; P607-A610 PolarHBondContact O-N 3.16Å; P607-G611 PolarHBondContact O-N 2.98Å
608	P	84.3	Confident	86.7	Confident	86 Å²	86	55.5 Å²	55.5	56%	0.558	31%	0.306	S	S	*	.	H	α-helix	trans	-59	-39.8	171.1	-25.9	34.7	0	0	0	113.7	L604 I605 G611 A612	L604-P608 WeakPolarHBondContact O-CD 3.46Å; I605-P608 WeakPolarHBondContact O-CD 3.47Å; P608-G611 PolarHBondContact O-N 2.79Å; P608-A612 VanDerWaalsContact O-CB 3.31Å; P608-A612 WeakPolarHBondContact O-CB 3.45Å; P608-A612 PolarHBondContact O-N 3.24Å
609	L	85.3	Confident	86.3	Confident	80 Å²	80	57.7 Å²	57.7	42%	0.419	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-44	176.8	177.6	67.2	0	0	0	111.4	L478 I605 G606 P607 A612 L613	L478-L609 HydrophobicContact CD2-CD2 4.06Å; I605-L609 HydrophobicContact CG2-CB 4.42Å; I605-L609 VanDerWaalsContact O-CB 3.25Å; I605-L609 WeakPolarHBondContact O-CB 3.13Å; I605-L609 PolarHBondContact O-N 3.26Å; G606-L609 WeakPolarHBondContact O-CB 3.32Å; G606-L609 PolarHBondContact O-N 2.67Å; G606-L609 VanDerWaalsContact O-N 3.13Å; P607-L609 VanDerWaalsContact C-N 3.32Å; P607-L609 PolarHBondContact O-N 3.18Å; L609-A612 PolarHBondContact O-N 3.22Å; L609-L613 VanDerWaalsContact O-CB 3.26Å; L609-L613 WeakPolarHBondContact O-CB 3.44Å; L609-L613 PolarHBondContact O-N 3.18Å
610	A	82.1	Confident	85.9	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.033	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-44.2	177.9	0	0	0	0	0	111.8	I481 G606 P607 L613 Y614	I481-A610 HydrophobicContact CG1-CB 3.78Å; G606-A610 WeakPolarHBondContact O-CB 3.38Å; G606-A610 PolarHBondContact O-N 3.41Å; P607-A610 PolarHBondContact O-N 3.16Å; A610-L613 PolarHBondContact O-N 2.94Å; A610-Y614 PolarHBondContact O-N 3Å
611	G	79.3	Confident	85.8	Confident	31 Å²	31	61.8 Å²	61.8	32%	0.32	34%	0.335	S	S	.	.	H	α-helix	trans	-61.9	-50.1	175.2	0	0	0	0	0	112.1	P607 P608 L613 Y614 D615	P607-G611 PolarHBondContact O-N 2.98Å; P608-G611 PolarHBondContact O-N 2.79Å; G611-L613 VanDerWaalsContact C-N 3.27Å; G611-L613 PolarHBondContact O-N 3.1Å; G611-Y614 PolarHBondContact O-N 2.68Å; G611-Y614 VanDerWaalsContact O-N 3.15Å; G611-D615 VanDerWaalsContact O-CG 3.31Å; G611-D615 PolarHBondContact O-N 3.12Å
612	A	83.2	Confident	85.8	Confident	46 Å²	46	59 Å²	59	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-37.4	177.6	0	0	0	0	0	112.4	P608 L609 D615 M616	P608-A612 VanDerWaalsContact O-CB 3.31Å; P608-A612 WeakPolarHBondContact O-CB 3.45Å; P608-A612 PolarHBondContact O-N 3.24Å; L609-A612 PolarHBondContact O-N 3.22Å; A612-D615 PolarHBondContact O-N 3.11Å; A612-M616 WeakPolarHBondContact O-CB 3.36Å; A612-M616 WeakPolarHBondContact O-CG 3.45Å; A612-M616 PolarHBondContact O-N 2.74Å
613	L	85.2	Confident	85.7	Confident	36 Å²	36	59 Å²	59	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-66.7	-40.1	177.7	-168.7	66.8	0	0	0	111.6	L609 A610 G611 T617 T623 V626	L609-L613 VanDerWaalsContact O-CB 3.26Å; L609-L613 WeakPolarHBondContact O-CB 3.44Å; L609-L613 PolarHBondContact O-N 3.18Å; A610-L613 PolarHBondContact O-N 2.94Å; G611-L613 VanDerWaalsContact C-N 3.27Å; G611-L613 PolarHBondContact O-N 3.1Å; L613-T617 WeakPolarHBondContact O-CB 3.45Å; L613-T617 VanDerWaalsContact O-CG2 3.32Å; L613-T617 WeakPolarHBondContact O-CG2 3.42Å; L613-T617 PolarHBondContact O-N 3.45Å; L613-T617 VanDerWaalsContact O-N 3.14Å; L613-T617 PolarHBondContact O-OG1 3.33Å; L613-T623 HydrophobicContact CD2-CG2 4.15Å; L613-V626 HydrophobicContact CD1-CG2 4.37Å; L613-V626 HydrophobicContact CD2-CB 3.54Å; L613-V626 HydrophobicContact CD2-CG1 3.76Å; L613-V626 HydrophobicContact CD2-CG2 3.77Å
614	Y	82.7	Confident	86	Confident	54 Å²	54	57.5 Å²	57.5	21%	0.212	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-47	172	-178.6	-100	0	0	0	111.4	A610 G611 M616 T617 Q618 Y620	A610-Y614 PolarHBondContact O-N 3Å; G611-Y614 PolarHBondContact O-N 2.68Å; G611-Y614 VanDerWaalsContact O-N 3.15Å; Y614-M616 VanDerWaalsContact C-N 3.28Å; Y614-M616 PolarHBondContact O-N 2.92Å; Y614-T617 PolarHBondContact O-N 3.32Å; Y614-Q618 VanDerWaalsContact O-CA 3.28Å; Y614-Q618 WeakPolarHBondContact O-CA 3.44Å; Y614-Q618 PolarHBondContact O-N 3.22Å; Y614-Y620 AromaticContact CD2-CD1 3.91Å; Y614-Y620 HydrophobicContact CD2-CD1 3.91Å; Y614-Y620 HydrophobicContact CD2-CD2 4.2Å; Y614-Y620 AromaticContact CD2-CE1 3.9Å; Y614-Y620 HydrophobicContact CD2-CE1 3.9Å; Y614-Y620 HydrophobicContact CD2-CE2 4.16Å; Y614-Y620 HydrophobicContact CD2-CG 4.06Å; Y614-Y620 AromaticContact CE2-CD1 3.96Å; Y614-Y620 HydrophobicContact CE2-CD1 3.96Å; Y614-Y620 AromaticContact CE2-CD2 3.44Å; Y614-Y620 HydrophobicContact CE2-CD2 3.44Å; Y614-Y620 VanDerWaalsContact CE2-CD2 3.44Å; Y614-Y620 AromaticContact CE2-CE1 3.85Å; Y614-Y620 HydrophobicContact CE2-CE1 3.85Å; Y614-Y620 AromaticContact CE2-CE2 3.28Å; Y614-Y620 HydrophobicContact CE2-CE2 3.28Å; Y614-Y620 AromaticContact CE2-CG 3.77Å; Y614-Y620 HydrophobicContact CE2-CG 3.77Å; Y614-Y620 AromaticContact CE2-CZ 3.51Å; Y614-Y620 AromaticContact CZ-CE2 3.62Å; Y614-Y620 AromaticContact CZ-CZ 3.79Å; Y614-Y620 WeakPolarHBondContact OH-CE2 3.49Å
615	D	87.1	Confident	86.6	Confident	109 Å²	109	56.9 Å²	56.9	58%	0.583	31%	0.312	S	S	*	.	H	α-helix	trans	-58.4	-40.9	-179.5	-72	-20.4	0	0	0	112.1	G611 A612 Q618	G611-D615 VanDerWaalsContact O-CG 3.31Å; G611-D615 PolarHBondContact O-N 3.12Å; A612-D615 PolarHBondContact O-N 3.11Å; D615-Q618 PolarHBondContact O-NE2 3.05Å
616	M	85	Confident	86.8	Confident	164 Å²	164	56.4 Å²	56.4	81%	0.808	31%	0.313	S	S	*	.	H	α-helix	trans	-72.5	-35.5	178.7	-71.6	178.5	74.2	0	0	113.5	A612 Y614	A612-M616 WeakPolarHBondContact O-CB 3.36Å; A612-M616 WeakPolarHBondContact O-CG 3.45Å; A612-M616 PolarHBondContact O-N 2.74Å; Y614-M616 VanDerWaalsContact C-N 3.28Å; Y614-M616 PolarHBondContact O-N 2.92Å
617	T	88.6	Confident	87.2	Confident	57 Å²	57	56.4 Å²	56.4	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-98.8	-20.5	-173.1	60.9	0	0	0	0	113.6	L613 Y614 N619 A622	L613-T617 WeakPolarHBondContact O-CB 3.45Å; L613-T617 VanDerWaalsContact O-CG2 3.32Å; L613-T617 WeakPolarHBondContact O-CG2 3.42Å; L613-T617 PolarHBondContact O-N 3.45Å; L613-T617 VanDerWaalsContact O-N 3.14Å; L613-T617 PolarHBondContact O-OG1 3.33Å; Y614-T617 PolarHBondContact O-N 3.32Å; T617-N619 PolarHBondContact O-N 3.46Å; T617-N619 VanDerWaalsContact O-N 3.1Å; T617-N619 PolarHBondContact OG1-N 3.35Å; T617-N619 PolarHBondContact OG1-O 3.08Å; T617-A622 HydrophobicContact CG2-CB 3.85Å
618	Q	84.6	Confident	87.8	Confident	128 Å²	128	54 Å²	54	60%	0.598	30%	0.297	S	S	*	.			trans	46.1	32.8	-169.2	-64	-67.3	-53.9	0	0	112.3	Y614 D615	Y614-Q618 VanDerWaalsContact O-CA 3.28Å; Y614-Q618 WeakPolarHBondContact O-CA 3.44Å; Y614-Q618 PolarHBondContact O-N 3.22Å; D615-Q618 PolarHBondContact O-NE2 3.05Å
619	N	86.3	Confident	88.4	Confident	73 Å²	73	53.3 Å²	53.3	39%	0.39	29%	0.293	S	S	.	.			trans	-150	112.8	-174	-171.6	-13.6	0	0	0	111.7	T617 H621 A622	T617-N619 PolarHBondContact O-N 3.46Å; T617-N619 VanDerWaalsContact O-N 3.1Å; T617-N619 PolarHBondContact OG1-N 3.35Å; T617-N619 PolarHBondContact OG1-O 3.08Å; N619-H621 PolarHBondContact O-N 3.03Å; N619-H621 VanDerWaalsContact O-N 3.14Å; N619-H621 WeakPolarHBondContact OD1-CB 3.47Å; N619-H621 PolarHBondContact OD1-CD2 3.16Å; N619-H621 PolarHBondContact OD1-N 2.74Å; N619-A622 PolarHBondContact O-N 2.72Å; N619-A622 VanDerWaalsContact O-N 3.15Å
620	Y	87.3	Confident	88.9	Confident	24 Å²	24	49.9 Å²	49.9	9%	0.094	28%	0.278	C	S	.	.	H	α-helix	trans	-56.2	-30.2	175.9	-75	-75	0	0	0	113.7	N485 E488 F489 E492 Y614 A622 T623 F624	N485-Y620 HydrophobicContact CB-CD1 4.03Å; N485-Y620 HydrophobicContact CB-CE1 4.14Å; E488-Y620 HydrophobicContact CB-CE1 4.21Å; E488-Y620 PolarHBondContact OE2-OH 3Å; F489-Y620 HydrophobicContact CB-CG 4.35Å; F489-Y620 HydrophobicContact CD2-CD2 4.03Å; F489-Y620 AromaticContact CD2-CG 3.96Å; F489-Y620 HydrophobicContact CD2-CG 3.96Å; E492-Y620 WeakPolarHBondContact OE2-CD2 3.35Å; E492-Y620 WeakPolarHBondContact OE2-CE2 3.35Å; Y614-Y620 AromaticContact CD2-CD1 3.91Å; Y614-Y620 HydrophobicContact CD2-CD1 3.91Å; Y614-Y620 HydrophobicContact CD2-CD2 4.2Å; Y614-Y620 AromaticContact CD2-CE1 3.9Å; Y614-Y620 HydrophobicContact CD2-CE1 3.9Å; Y614-Y620 HydrophobicContact CD2-CE2 4.16Å; Y614-Y620 HydrophobicContact CD2-CG 4.06Å; Y614-Y620 AromaticContact CE2-CD1 3.96Å; Y614-Y620 HydrophobicContact CE2-CD1 3.96Å; Y614-Y620 AromaticContact CE2-CD2 3.44Å; Y614-Y620 HydrophobicContact CE2-CD2 3.44Å; Y614-Y620 VanDerWaalsContact CE2-CD2 3.44Å; Y614-Y620 AromaticContact CE2-CE1 3.85Å; Y614-Y620 HydrophobicContact CE2-CE1 3.85Å; Y614-Y620 AromaticContact CE2-CE2 3.28Å; Y614-Y620 HydrophobicContact CE2-CE2 3.28Å; Y614-Y620 AromaticContact CE2-CG 3.77Å; Y614-Y620 HydrophobicContact CE2-CG 3.77Å; Y614-Y620 AromaticContact CE2-CZ 3.51Å; Y614-Y620 AromaticContact CZ-CE2 3.62Å; Y614-Y620 AromaticContact CZ-CZ 3.79Å; Y614-Y620 WeakPolarHBondContact OH-CE2 3.49Å; Y620-A622 VanDerWaalsContact C-N 3.32Å; Y620-A622 PolarHBondContact O-N 2.99Å; Y620-T623 PolarHBondContact O-N 3.48Å; Y620-F624 WeakPolarHBondContact O-CD2 3.44Å; Y620-F624 PolarHBondContact O-N 3.21Å
621	H	90.9	Very high	89.5	Confident	68 Å²	68	49.8 Å²	49.8	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-46.7	178.1	-69.8	-122.5	0	0	0	111.1	F489 P549 N619 T623 F624 F625	F489-H621 AromaticContact CE2-NE2 3.95Å; F489-H621 AromaticContact CZ-NE2 3.7Å; P549-H621 HydrophobicContact CB-CB 4.25Å; P549-H621 WeakPolarHBondContact CB-CE1 3.43Å; P549-H621 WeakPolarHBondContact CB-ND1 3.31Å; P549-H621 HydrophobicContact CG-CB 4.41Å; N619-H621 PolarHBondContact O-N 3.03Å; N619-H621 VanDerWaalsContact O-N 3.14Å; N619-H621 WeakPolarHBondContact OD1-CB 3.47Å; N619-H621 PolarHBondContact OD1-CD2 3.16Å; N619-H621 PolarHBondContact OD1-N 2.74Å; H621-T623 VanDerWaalsContact C-N 3.31Å; H621-T623 PolarHBondContact O-N 3.22Å; H621-F624 PolarHBondContact O-N 3.15Å; H621-F625 HydrophobicContact CB-CD2 4.48Å; H621-F625 HydrophobicContact CB-CE2 4.35Å; H621-F625 WeakPolarHBondContact O-CD2 3.21Å; H621-F625 PolarHBondContact O-N 3.02Å
622	A	91.1	Very high	90.4	Very high	29 Å²	29	50.2 Å²	50.2	24%	0.24	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-41.2	-179.8	0	0	0	0	0	111	T617 N619 Y620 F625 V626	T617-A622 HydrophobicContact CG2-CB 3.85Å; N619-A622 PolarHBondContact O-N 2.72Å; N619-A622 VanDerWaalsContact O-N 3.15Å; Y620-A622 VanDerWaalsContact C-N 3.32Å; Y620-A622 PolarHBondContact O-N 2.99Å; A622-F625 PolarHBondContact O-N 3.38Å; A622-V626 WeakPolarHBondContact O-CG2 3.06Å; A622-V626 PolarHBondContact O-N 2.86Å
623	T	91	Very high	91.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-43.8	177	-51.9	0	0	0	0	112.4	I481 N485 L613 Y620 H621 V626 G627	I481-T623 HydrophobicContact CG1-CG2 4.49Å; I481-T623 HydrophobicContact CG2-CG2 3.91Å; N485-T623 VanDerWaalsContact ND2-CG2 3.3Å; N485-T623 WeakPolarHBondContact ND2-CG2 3.31Å; L613-T623 HydrophobicContact CD2-CG2 4.15Å; Y620-T623 PolarHBondContact O-N 3.48Å; H621-T623 VanDerWaalsContact C-N 3.31Å; H621-T623 PolarHBondContact O-N 3.22Å; T623-V626 PolarHBondContact O-N 2.95Å; T623-G627 PolarHBondContact O-N 3.06Å
624	F	93.9	Very high	91.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-38	174.5	-68.8	-57.3	0	0	0	112.8	I481 N485 M486 F489 I545 V548 P549 Y620 H621 G628	I481-F624 HydrophobicContact CG2-CD1 4.19Å; I481-F624 HydrophobicContact CG2-CE1 4.44Å; N485-F624 HydrophobicContact CB-CE1 3.91Å; N485-F624 HydrophobicContact CB-CZ 3.8Å; M486-F624 HydrophobicContact CG-CE1 3.94Å; M486-F624 HydrophobicContact CG-CZ 4.23Å; F489-F624 HydrophobicContact CB-CE2 3.85Å; F489-F624 HydrophobicContact CB-CZ 3.98Å; F489-F624 AromaticContact CD1-CE2 3.66Å; F489-F624 HydrophobicContact CD1-CE2 3.66Å; F489-F624 HydrophobicContact CD1-CZ 4.27Å; F489-F624 HydrophobicContact CD2-CE2 4.31Å; F489-F624 HydrophobicContact CE1-CE2 4.27Å; F489-F624 AromaticContact CG-CE2 3.69Å; F489-F624 HydrophobicContact CG-CE2 3.69Å; F489-F624 HydrophobicContact CG-CZ 4.29Å; I545-F624 HydrophobicContact CG2-CB 4.38Å; I545-F624 HydrophobicContact CG2-CD1 4.03Å; V548-F624 HydrophobicContact CB-CD1 4.32Å; V548-F624 HydrophobicContact CB-CD2 4.41Å; V548-F624 HydrophobicContact CB-CG 4.24Å; V548-F624 HydrophobicContact CG1-CD1 4.25Å; V548-F624 HydrophobicContact CG1-CD2 4.01Å; V548-F624 HydrophobicContact CG1-CE1 4.07Å; V548-F624 HydrophobicContact CG1-CE2 3.81Å; V548-F624 HydrophobicContact CG1-CG 4.23Å; V548-F624 HydrophobicContact CG1-CZ 3.85Å; P549-F624 HydrophobicContact CG-CB 3.95Å; P549-F624 HydrophobicContact CG-CD2 4.16Å; P549-F624 HydrophobicContact CG-CG 4.44Å; Y620-F624 WeakPolarHBondContact O-CD2 3.44Å; Y620-F624 PolarHBondContact O-N 3.21Å; H621-F624 PolarHBondContact O-N 3.15Å; F624-G628 WeakPolarHBondContact O-CA 3.35Å; F624-G628 PolarHBondContact O-N 3.05Å
625	F	94.7	Very high	92.4	Very high	75 Å²	75	48.8 Å²	48.8	33%	0.329	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-46.2	175.6	-80.4	-64.1	0	0	0	112.2	V546 W550 H621 A622 C629	V546-F625 HydrophobicContact CG1-CD1 3.9Å; V546-F625 HydrophobicContact CG1-CE1 3.8Å; W550-F625 AromaticContact CH2-CE1 3.55Å; W550-F625 HydrophobicContact CH2-CE1 3.55Å; W550-F625 AromaticContact CH2-CZ 3.26Å; W550-F625 HydrophobicContact CH2-CZ 3.26Å; W550-F625 HydrophobicContact CZ2-CZ 4.16Å; W550-F625 AromaticContact CZ3-CE1 3.64Å; W550-F625 HydrophobicContact CZ3-CE1 3.64Å; W550-F625 AromaticContact CZ3-CZ 3.51Å; W550-F625 HydrophobicContact CZ3-CZ 3.51Å; H621-F625 HydrophobicContact CB-CD2 4.48Å; H621-F625 HydrophobicContact CB-CE2 4.35Å; H621-F625 WeakPolarHBondContact O-CD2 3.21Å; H621-F625 PolarHBondContact O-N 3.02Å; A622-F625 PolarHBondContact O-N 3.38Å; F625-C629 WeakPolarHBondContact O-CB 3.34Å; F625-C629 PolarHBondContact O-N 2.97Å; F625-C629 PolarHBondContact O-SG 3.34Å
626	V	92.9	Very high	92.9	Very high	70 Å²	70	45.9 Å²	45.9	42%	0.424	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-46.3	178.7	173.5	0	0	0	0	110.7	L613 A622 T623 G630	L613-V626 HydrophobicContact CD1-CG2 4.37Å; L613-V626 HydrophobicContact CD2-CB 3.54Å; L613-V626 HydrophobicContact CD2-CG1 3.76Å; L613-V626 HydrophobicContact CD2-CG2 3.77Å; A622-V626 WeakPolarHBondContact O-CG2 3.06Å; A622-V626 PolarHBondContact O-N 2.86Å; T623-V626 PolarHBondContact O-N 2.95Å; V626-G630 PolarHBondContact O-N 3.45Å
627	G	92.7	Very high	93.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-46.3	177.3	0	0	0	0	0	112.7	T623 T631	T623-G627 PolarHBondContact O-N 3.06Å; G627-T631 WeakPolarHBondContact O-CB 3.31Å; G627-T631 PolarHBondContact O-N 3.15Å; G627-T631 PolarHBondContact O-OG1 2.85Å
628	G	95.8	Very high	93.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-49.7	179.7	0	0	0	0	0	113.2	G542 F624 G630 T631 V632	G542-G628 WeakPolarHBondContact O-CA 3.39Å; F624-G628 WeakPolarHBondContact O-CA 3.35Å; F624-G628 PolarHBondContact O-N 3.05Å; G628-G630 VanDerWaalsContact C-N 3.35Å; G628-G630 PolarHBondContact O-N 2.85Å; G628-T631 PolarHBondContact O-N 2.96Å; G628-V632 WeakPolarHBondContact O-CG2 3.35Å; G628-V632 PolarHBondContact O-N 2.78Å
629	C	96.4	Very high	94.5	Very high	71 Å²	71	33.7 Å²	33.7	48%	0.48	19%	0.191	S	C	.	.	H	α-helix	trans	-63	-39.4	177.1	-71.5	0	0	0	0	112.2	F625 V632 M633	F625-C629 WeakPolarHBondContact O-CB 3.34Å; F625-C629 PolarHBondContact O-N 2.97Å; F625-C629 PolarHBondContact O-SG 3.34Å; C629-V632 PolarHBondContact O-N 3.15Å; C629-M633 WeakPolarHBondContact O-CB 3.46Å; C629-M633 PolarHBondContact O-N 2.87Å
630	G	95.8	Very high	94.9	Very high	9 Å²	9	32.9 Å²	32.9	9%	0.093	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-37.1	175.3	0	0	0	0	0	112.6	L474 V626 G628 M633 S634	L474-G630 WeakPolarHBondContact CD2-O 3.27Å; V626-G630 PolarHBondContact O-N 3.45Å; G628-G630 VanDerWaalsContact C-N 3.35Å; G628-G630 PolarHBondContact O-N 2.85Å; G630-M633 WeakPolarHBondContact O-CB 3.28Å; G630-M633 PolarHBondContact O-N 2.96Å; G630-S634 PolarHBondContact O-N 3Å
631	T	96.2	Very high	95.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-41.7	172.5	-58	0	0	0	0	111.7	L475 T538 C541 G627 G628 M633 S634 G635	L475-T631 HydrophobicContact CD1-CG2 3.79Å; T538-T631 HydrophobicContact CG2-CG2 4.28Å; C541-T631 HydrophobicContact CB-CG2 4.49Å; G627-T631 WeakPolarHBondContact O-CB 3.31Å; G627-T631 PolarHBondContact O-N 3.15Å; G627-T631 PolarHBondContact O-OG1 2.85Å; G628-T631 PolarHBondContact O-N 2.96Å; T631-M633 VanDerWaalsContact C-N 3.31Å; T631-M633 PolarHBondContact O-N 3.14Å; T631-S634 WeakPolarHBondContact O-CB 3.23Å; T631-S634 PolarHBondContact O-N 2.71Å; T631-G635 PolarHBondContact O-N 3.49Å
632	V	97.9	Very high	95.4	Very high	41 Å²	41	29.9 Å²	29.9	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-41.5	172.7	173.8	0	0	0	0	111	L543 G628 C629 S634 G635 A636	L543-V632 HydrophobicContact CG-CG2 4.14Å; G628-V632 WeakPolarHBondContact O-CG2 3.35Å; G628-V632 PolarHBondContact O-N 2.78Å; C629-V632 PolarHBondContact O-N 3.15Å; V632-S634 VanDerWaalsContact C-N 3.3Å; V632-S634 PolarHBondContact O-N 2.82Å; V632-G635 PolarHBondContact O-N 3.38Å; V632-A636 WeakPolarHBondContact O-CB 3.37Å; V632-A636 PolarHBondContact O-N 3.48Å
633	M	97.5	Very high	95.5	Very high	105 Å²	105	34.1 Å²	34.1	52%	0.517	19%	0.194	S	C	.	.	H	α-helix	trans	-61.5	-39	175.6	-178.9	168.7	69.3	0	0	111.6	L474 C629 G630 T631 A636 L637	L474-M633 HydrophobicContact CD1-CE 4.04Å; L474-M633 HydrophobicContact CD2-CB 4.05Å; L474-M633 HydrophobicContact CD2-CE 3.37Å; L474-M633 HydrophobicContact CD2-CG 3.99Å; L474-M633 HydrophobicContact CD2-SD 4.49Å; L474-M633 HydrophobicContact CG-CE 4.35Å; C629-M633 WeakPolarHBondContact O-CB 3.46Å; C629-M633 PolarHBondContact O-N 2.87Å; G630-M633 WeakPolarHBondContact O-CB 3.28Å; G630-M633 PolarHBondContact O-N 2.96Å; T631-M633 VanDerWaalsContact C-N 3.31Å; T631-M633 PolarHBondContact O-N 3.14Å; M633-A636 PolarHBondContact O-N 3.23Å; M633-L637 WeakPolarHBondContact O-CG 3.16Å; M633-L637 PolarHBondContact O-N 2.78Å
634	S	97.5	Very high	95.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-48.9	172.9	179.2	0	0	0	0	111.9	S471 G630 T631 V632 A636 L637 V638	S471-S634 VanDerWaalsContact C-OG 3.32Å; S471-S634 PolarHBondContact O-OG 3.23Å; S471-S634 PolarHBondContact OG-O 2.86Å; S471-S634 VanDerWaalsContact OG-O 3.08Å; S471-S634 PolarHBondContact OG-OG 3.46Å; G630-S634 PolarHBondContact O-N 3Å; T631-S634 WeakPolarHBondContact O-CB 3.23Å; T631-S634 PolarHBondContact O-N 2.71Å; V632-S634 VanDerWaalsContact C-N 3.3Å; V632-S634 PolarHBondContact O-N 2.82Å; S634-A636 VanDerWaalsContact C-N 3.32Å; S634-A636 PolarHBondContact O-N 2.96Å; S634-L637 WeakPolarHBondContact O-CB 3.48Å; S634-L637 PolarHBondContact O-N 3.1Å; S634-V638 PolarHBondContact O-N 2.91Å
635	G	97.6	Very high	95.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-39.9	176.1	0	0	0	0	0	112.9	C539 T631 V632 L637 V638 L639	C539-G635 VanDerWaalsContact SG-C 3.58Å; T631-G635 PolarHBondContact O-N 3.49Å; V632-G635 PolarHBondContact O-N 3.38Å; G635-L637 VanDerWaalsContact C-N 3.34Å; G635-L637 PolarHBondContact O-N 3.08Å; G635-V638 PolarHBondContact O-N 2.86Å; G635-L639 WeakPolarHBondContact O-CG 3.34Å; G635-L639 PolarHBondContact O-N 3.43Å
636	A	97.4	Very high	95	Very high	48 Å²	48	44.4 Å²	44.4	40%	0.397	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-35.9	176.9	0	0	0	0	0	112.9	V632 M633 S634 V638 L639 C640	V632-A636 WeakPolarHBondContact O-CB 3.37Å; V632-A636 PolarHBondContact O-N 3.48Å; M633-A636 PolarHBondContact O-N 3.23Å; S634-A636 VanDerWaalsContact C-N 3.32Å; S634-A636 PolarHBondContact O-N 2.96Å; A636-V638 VanDerWaalsContact C-N 3.35Å; A636-L639 PolarHBondContact O-N 3.27Å; A636-C640 PolarHBondContact O-N 3.46Å
637	L	97.3	Very high	94.8	Very high	48 Å²	48	50.4 Å²	50.4	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-39.8	173.4	-72.7	171.6	0	0	0	111.7	I470 M633 S634 G635 C640 I641	I470-L637 HydrophobicContact CG2-CD1 4.04Å; M633-L637 WeakPolarHBondContact O-CG 3.16Å; M633-L637 PolarHBondContact O-N 2.78Å; S634-L637 WeakPolarHBondContact O-CB 3.48Å; S634-L637 PolarHBondContact O-N 3.1Å; G635-L637 VanDerWaalsContact C-N 3.34Å; G635-L637 PolarHBondContact O-N 3.08Å; L637-C640 VanDerWaalsContact O-CB 3.25Å; L637-C640 WeakPolarHBondContact O-CB 3.38Å; L637-C640 PolarHBondContact O-N 3.18Å; L637-I641 PolarHBondContact O-N 3.27Å; L637-I641 VanDerWaalsContact O-N 3.09Å
638	V	97	Very high	94.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-38.7	175	-176.9	0	0	0	0	112	F468 S471 T531 Y534 S634 G635 A636 C640 I641 F642	F468-V638 HydrophobicContact CD2-CG2 4.27Å; F468-V638 HydrophobicContact CE2-CG2 4.45Å; S471-V638 WeakPolarHBondContact OG-CG2 3.27Å; T531-V638 HydrophobicContact CG2-CG1 3.69Å; Y534-V638 HydrophobicContact CD1-CB 4.14Å; Y534-V638 HydrophobicContact CD1-CG1 3.81Å; Y534-V638 HydrophobicContact CD1-CG2 3.93Å; Y534-V638 HydrophobicContact CE1-CB 4.43Å; Y534-V638 HydrophobicContact CE1-CG1 4.45Å; Y534-V638 HydrophobicContact CE1-CG2 3.73Å; S634-V638 PolarHBondContact O-N 2.91Å; G635-V638 PolarHBondContact O-N 2.86Å; A636-V638 VanDerWaalsContact C-N 3.35Å; V638-C640 PolarHBondContact O-N 3.36Å; V638-I641 WeakPolarHBondContact O-CB 3.48Å; V638-I641 PolarHBondContact O-N 3.39Å; V638-I641 VanDerWaalsContact O-N 3.15Å; V638-F642 PolarHBondContact O-N 2.92Å
639	L	96.7	Very high	93.9	Very high	45 Å²	45	63.8 Å²	63.8	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-35	172.2	-66.5	175.7	0	0	0	111.7	L532 V536 G635 A636 F642 M643	L532-L639 HydrophobicContact CD1-CD2 3.64Å; V536-L639 HydrophobicContact CG2-CD2 4.18Å; G635-L639 WeakPolarHBondContact O-CG 3.34Å; G635-L639 PolarHBondContact O-N 3.43Å; A636-L639 PolarHBondContact O-N 3.27Å; L639-F642 WeakPolarHBondContact O-CB 3.19Å; L639-F642 PolarHBondContact O-N 2.81Å; L639-M643 VanDerWaalsContact O-CG 3.28Å; L639-M643 WeakPolarHBondContact O-CG 3.4Å; L639-M643 PolarHBondContact O-N 3.23Å
640	C	95.8	Very high	93.4	Very high	57 Å²	57	64 Å²	64	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-45.2	172.3	-169.4	0	0	0	0	111.4	L467 A636 L637 V638 F642 M643 L644	L467-C640 HydrophobicContact CD2-CB 4.49Å; A636-C640 PolarHBondContact O-N 3.46Å; L637-C640 VanDerWaalsContact O-CB 3.25Å; L637-C640 WeakPolarHBondContact O-CB 3.38Å; L637-C640 PolarHBondContact O-N 3.18Å; V638-C640 PolarHBondContact O-N 3.36Å; C640-F642 VanDerWaalsContact C-N 3.32Å; C640-F642 PolarHBondContact O-N 3.06Å; C640-M643 PolarHBondContact O-N 3.46Å; C640-M643 VanDerWaalsContact O-N 3.14Å; C640-L644 WeakPolarHBondContact O-CG 3.37Å; C640-L644 PolarHBondContact O-N 3.41Å
641	I	94.8	Very high	92.9	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-56.6	-46.8	174.1	-62.9	164.8	0	0	0	110.8	L467 F468 L582 L637 V638 M643 L644 K645	L467-I641 HydrophobicContact CB-CD1 3.84Å; L467-I641 HydrophobicContact CB-CG1 3.78Å; L467-I641 HydrophobicContact CD2-CG1 3.96Å; F468-I641 HydrophobicContact CB-CD1 3.81Å; F468-I641 HydrophobicContact CD2-CD1 4.28Å; L582-I641 HydrophobicContact CD2-CG2 3.97Å; L637-I641 PolarHBondContact O-N 3.27Å; L637-I641 VanDerWaalsContact O-N 3.09Å; V638-I641 WeakPolarHBondContact O-CB 3.48Å; V638-I641 PolarHBondContact O-N 3.39Å; V638-I641 VanDerWaalsContact O-N 3.15Å; I641-M643 VanDerWaalsContact C-N 3.31Å; I641-M643 PolarHBondContact O-N 3.27Å; I641-L644 PolarHBondContact O-N 3.28Å; I641-K645 PolarHBondContact O-N 2.83Å
642	F	93.5	Very high	92.4	Very high	28 Å²	28	80.2 Å²	80.2	12%	0.123	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-44.7	176.9	168.9	-102.1	0	0	0	111.9	N529 T531 L532 V638 L639 C640 R646	N529-F642 HydrophobicContact CB-CE2 4.19Å; N529-F642 WeakPolarHBondContact ND2-CE2 3.43Å; N529-F642 WeakPolarHBondContact OD1-CD2 3.49Å; T531-F642 HydrophobicContact CG2-CB 4.04Å; L532-F642 HydrophobicContact CB-CD1 4.46Å; L532-F642 HydrophobicContact CB-CD2 4.03Å; L532-F642 HydrophobicContact CB-CE1 4.47Å; L532-F642 HydrophobicContact CB-CE2 4.06Å; L532-F642 HydrophobicContact CB-CG 4.24Å; L532-F642 HydrophobicContact CB-CZ 4.27Å; L532-F642 HydrophobicContact CD1-CD1 4.08Å; L532-F642 HydrophobicContact CD1-CE1 4.06Å; L532-F642 HydrophobicContact CD2-CE1 4.36Å; L532-F642 HydrophobicContact CD2-CZ 4.15Å; V638-F642 PolarHBondContact O-N 2.92Å; L639-F642 WeakPolarHBondContact O-CB 3.19Å; L639-F642 PolarHBondContact O-N 2.81Å; C640-F642 VanDerWaalsContact C-N 3.32Å; C640-F642 PolarHBondContact O-N 3.06Å; F642-R646 VanDerWaalsContact O-CB 3.28Å; F642-R646 WeakPolarHBondContact O-CB 3.32Å; F642-R646 PolarHBondContact O-N 3.43Å
643	M	93.1	Very high	91.7	Very high	117 Å²	117	84.3 Å²	84.3	58%	0.576	38%	0.384	S	S	*	.	H	α-helix	trans	-65.9	-40.3	179.1	-68.1	-63.2	-74.3	0	0	112.4	L639 C640 I641 R646 R647	L639-M643 VanDerWaalsContact O-CG 3.28Å; L639-M643 WeakPolarHBondContact O-CG 3.4Å; L639-M643 PolarHBondContact O-N 3.23Å; C640-M643 PolarHBondContact O-N 3.46Å; C640-M643 VanDerWaalsContact O-N 3.14Å; I641-M643 VanDerWaalsContact C-N 3.31Å; I641-M643 PolarHBondContact O-N 3.27Å; M643-R646 PolarHBondContact O-N 3.31Å; M643-R647 WeakPolarHBondContact O-CB 3.31Å; M643-R647 PolarHBondContact O-N 3.27Å
644	L	90.9	Very high	91	Very high	74 Å²	74	85.2 Å²	85.2	39%	0.387	40%	0.395	S	S	.	.	H	α-helix	trans	-63	-51	176	-69.8	173.4	0	0	0	111.2	L467 C640 I641 R646 R647 E648	L467-L644 HydrophobicContact CD2-CD1 4.48Å; C640-L644 WeakPolarHBondContact O-CG 3.37Å; C640-L644 PolarHBondContact O-N 3.41Å; I641-L644 PolarHBondContact O-N 3.28Å; L644-R646 VanDerWaalsContact C-N 3.31Å; L644-R646 PolarHBondContact O-N 3.44Å; L644-R647 WeakPolarHBondContact O-CB 3.48Å; L644-R647 PolarHBondContact O-N 3.37Å; L644-R647 VanDerWaalsContact O-N 3.13Å; L644-E648 WeakPolarHBondContact O-CG 3.44Å; L644-E648 PolarHBondContact O-N 2.86Å
645	K	88.7	Confident	89.9	Confident	64 Å²	64	93 Å²	93	28%	0.278	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-40.8	176.5	-81.3	-165.2	165.1	-161.7	0	112.4	D581 L582 I641 R647 E648 R649	D581-K645 PolarHBondContact O-NZ 3.42Å; L582-K645 HydrophobicContact CD2-CD 4.17Å; L582-K645 VanDerWaalsContact CD2-NZ 3.26Å; I641-K645 PolarHBondContact O-N 2.83Å; K645-R647 VanDerWaalsContact C-N 3.35Å; K645-E648 PolarHBondContact O-N 2.84Å; K645-R649 WeakPolarHBondContact O-CB 3.17Å; K645-R649 PolarHBondContact O-N 3.41Å
646	R	89.2	Confident	89.5	Confident	153 Å²	153	97.7 Å²	97.7	58%	0.577	45%	0.453	S	S	*	.	H	α-helix	trans	-62	-44.1	176.3	-175.2	174.6	-178.7	166.6	1.4	111.2	F642 M643 L644 R649 T650	F642-R646 VanDerWaalsContact O-CB 3.28Å; F642-R646 WeakPolarHBondContact O-CB 3.32Å; F642-R646 PolarHBondContact O-N 3.43Å; M643-R646 PolarHBondContact O-N 3.31Å; L644-R646 VanDerWaalsContact C-N 3.31Å; L644-R646 PolarHBondContact O-N 3.44Å; R646-R649 PolarHBondContact O-N 3.48Å; R646-T650 PolarHBondContact O-N 2.9Å; R646-T650 PolarHBondContact O-OG1 3.46Å; R646-T650 VanDerWaalsContact O-OG1 3.12Å
647	R	89.1	Confident	89.1	Confident	196 Å²	196	100.3 Å²	100.3	74%	0.74	46%	0.456	S	S	*	.	H	α-helix	trans	-63.5	-44.3	178.7	-174.6	179.3	-179.8	179.8	-0.1	111.9	M643 L644 K645 R649 T650 R651	M643-R647 WeakPolarHBondContact O-CB 3.31Å; M643-R647 PolarHBondContact O-N 3.27Å; L644-R647 WeakPolarHBondContact O-CB 3.48Å; L644-R647 PolarHBondContact O-N 3.37Å; L644-R647 VanDerWaalsContact O-N 3.13Å; K645-R647 VanDerWaalsContact C-N 3.35Å; R647-R649 VanDerWaalsContact C-N 3.34Å; R647-T650 PolarHBondContact O-N 3.17Å; R647-R651 WeakPolarHBondContact O-CB 3.27Å; R647-R651 PolarHBondContact O-N 3.47Å
648	E	86.8	Confident	88.6	Confident	94 Å²	94	103.2 Å²	103.2	44%	0.439	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-43	176	-72.3	177.5	-174.1	0	0	112	L644 K645 R651 R652	L644-E648 WeakPolarHBondContact O-CG 3.44Å; L644-E648 PolarHBondContact O-N 2.86Å; K645-E648 PolarHBondContact O-N 2.84Å; E648-R651 PolarHBondContact O-N 3.16Å; E648-R652 WeakPolarHBondContact O-CG 3.49Å; E648-R652 PolarHBondContact O-N 3.05Å
649	R	83.8	Confident	88.2	Confident	187 Å²	187	109.3 Å²	109.3	71%	0.706	50%	0.495	S	S	*	.	H	α-helix	trans	-62.6	-43.9	176.8	-171.2	176.7	-176.9	176.4	2.4	111.8	K645 R646 R647 R651 R652 I653	K645-R649 WeakPolarHBondContact O-CB 3.17Å; K645-R649 PolarHBondContact O-N 3.41Å; R646-R649 PolarHBondContact O-N 3.48Å; R647-R649 VanDerWaalsContact C-N 3.34Å; R649-R651 VanDerWaalsContact C-N 3.32Å; R649-R651 PolarHBondContact O-N 3.42Å; R649-R652 PolarHBondContact O-N 3.41Å; R649-I653 HydrophobicContact CG-CD1 4.21Å; R649-I653 WeakPolarHBondContact O-CD1 3.47Å; R649-I653 VanDerWaalsContact O-CG1 3.31Å; R649-I653 WeakPolarHBondContact O-CG1 3.5Å; R649-I653 PolarHBondContact O-N 3.2Å
650	T	85.9	Confident	87.6	Confident	76 Å²	76	113.3 Å²	113.3	47%	0.466	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-40.5	175.5	-57.8	0	0	0	0	111.4	R646 R647 R652 I653 V654	R646-T650 PolarHBondContact O-N 2.9Å; R646-T650 PolarHBondContact O-OG1 3.46Å; R646-T650 VanDerWaalsContact O-OG1 3.12Å; R647-T650 PolarHBondContact O-N 3.17Å; T650-R652 PolarHBondContact O-N 3.43Å; T650-I653 PolarHBondContact O-N 3.14Å; T650-V654 HydrophobicContact CG2-CG2 4.41Å; T650-V654 WeakPolarHBondContact O-CG2 3.28Å; T650-V654 PolarHBondContact O-N 3.44Å; T650-V654 VanDerWaalsContact O-N 3.11Å
651	R	85.2	Confident	87.1	Confident	168 Å²	168	117.1 Å²	117.1	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-60.3	-45.3	177.8	-173.7	177.6	175.4	-178.4	-0.2	112	R647 E648 R649 I653 V654 E655	R647-R651 WeakPolarHBondContact O-CB 3.27Å; R647-R651 PolarHBondContact O-N 3.47Å; E648-R651 PolarHBondContact O-N 3.16Å; R649-R651 VanDerWaalsContact C-N 3.32Å; R649-R651 PolarHBondContact O-N 3.42Å; R651-I653 PolarHBondContact O-N 3.09Å; R651-V654 PolarHBondContact O-N 3.17Å; R651-E655 HydrophobicContact CG-CG 4.38Å; R651-E655 WeakPolarHBondContact CG-OE1 3.28Å; R651-E655 IonicContact CZ-OE1 3.57Å; R651-E655 IonicContact NE-OE1 3.49Å; R651-E655 PolarHBondContact NE-OE1 3.48Å; R651-E655 IonicContact NH2-OE1 3.51Å; R651-E655 PolarHBondContact NH2-OE1 3.06Å; R651-E655 WeakPolarHBondContact O-CB 3.38Å; R651-E655 WeakPolarHBondContact O-CG 3.29Å; R651-E655 PolarHBondContact O-N 3.09Å
652	R	84.2	Confident	86.5	Confident	182 Å²	182	125.4 Å²	125.4	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-67.5	-17.1	176.5	-67.3	-172.1	-135.5	176.3	1.9	115.2	E648 R649 T650 E655	E648-R652 WeakPolarHBondContact O-CG 3.49Å; E648-R652 PolarHBondContact O-N 3.05Å; R649-R652 PolarHBondContact O-N 3.41Å; T650-R652 PolarHBondContact O-N 3.43Å; R652-E655 VanDerWaalsContact O-OXT 3.1Å
653	I	83.8	Confident	86	Confident	128 Å²	128	132.8 Å²	132.8	66%	0.656	59%	0.59	S	S	*	*	H	α-helix	trans	-88	-27.8	175.4	-67.6	165.6	0	0	0	110.5	R649 T650 R651	R649-I653 HydrophobicContact CG-CD1 4.21Å; R649-I653 WeakPolarHBondContact O-CD1 3.47Å; R649-I653 VanDerWaalsContact O-CG1 3.31Å; R649-I653 WeakPolarHBondContact O-CG1 3.5Å; R649-I653 PolarHBondContact O-N 3.2Å; T650-I653 PolarHBondContact O-N 3.14Å; R651-I653 PolarHBondContact O-N 3.09Å
654	V	83.1	Confident	85.4	Confident	123 Å²	123	134.2 Å²	134.2	75%	0.745	59%	0.591	S	S	*	*	H	α-helix	trans	-83.3	-39.3	178.2	172.4	0	0	0	0	111.3	T650 R651	T650-V654 HydrophobicContact CG2-CG2 4.41Å; T650-V654 WeakPolarHBondContact O-CG2 3.28Å; T650-V654 PolarHBondContact O-N 3.44Å; T650-V654 VanDerWaalsContact O-N 3.11Å; R651-V654 PolarHBondContact O-N 3.17Å
655	E	74	Confident	84.9	Confident	165 Å²	165	139.6 Å²	139.6	77%	0.771	61%	0.609	S	S	*	*			trans	-66.6	0	164.5	-68.7	173.3	-179.8	0	0	110.2	R651 R652	R651-E655 HydrophobicContact CG-CG 4.38Å; R651-E655 WeakPolarHBondContact CG-OE1 3.28Å; R651-E655 IonicContact CZ-OE1 3.57Å; R651-E655 IonicContact NE-OE1 3.49Å; R651-E655 PolarHBondContact NE-OE1 3.48Å; R651-E655 IonicContact NH2-OE1 3.51Å; R651-E655 PolarHBondContact NH2-OE1 3.06Å; R651-E655 WeakPolarHBondContact O-CB 3.38Å; R651-E655 WeakPolarHBondContact O-CG 3.29Å; R651-E655 PolarHBondContact O-N 3.09Å; R652-E655 VanDerWaalsContact O-OXT 3.1Å

Retrieved 655 of 655 residues in 460.6 ms (Link to these results)

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