G4VF91_SCHMA Loading...

Putative basic fgf-repressed zic binding protein homolog (Zic3-binding protein)

AlphaFold DB , UniProt , Accession G4VF91, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 247 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	34.6	Very low	36.5	Very low	235 Å²	235	163 Å²	163	100%	1.158	77%	0.769	S	S	*	*				0	101.4	0	-157.4	169.1	79.2	0	0	107.1
2	N	31.4	Very low	36.3	Very low	152 Å²	152	169.3 Å²	169.3	81%	0.813	78%	0.78	S	S	*	*			trans	-155.1	117.3	173.4	-114.7	-19.9	0	0	0	110.8	Q4	N2-Q4 PolarHBondContact O-N 2.68Å; N2-Q4 VanDerWaalsContact O-N 3.08Å
3	L	34.7	Very low	36.1	Very low	170 Å²	170	171 Å²	171	89%	0.89	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	21.4	-162.2	-80.6	157.5	0	0	0	115.3
4	Q	38.6	Very low	35.8	Very low	185 Å²	185	169.6 Å²	169.6	86%	0.864	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	4	-176.3	-75.3	-175.2	-33.6	0	0	115.2	N2	N2-Q4 PolarHBondContact O-N 2.68Å; N2-Q4 VanDerWaalsContact O-N 3.08Å
5	R	34.2	Very low	36.2	Very low	241 Å²	241	166.7 Å²	166.7	91%	0.909	78%	0.777	S	S	*	*	S	Bend	trans	-94.1	5	-175.5	-80.6	-172.2	179.3	-176	1.3	116.3
6	L	38.1	Very low	36	Very low	132 Å²	132	165.8 Å²	165.8	69%	0.691	78%	0.779	S	S	*	*	S	Bend	trans	-119	-0.3	-167.4	-93.3	156.2	0	0	0	116.9
7	W	37.5	Very low	35.8	Very low	213 Å²	213	167.6 Å²	167.6	81%	0.807	79%	0.787	S	S	*	*	S	Bend	trans	-104	-13.8	-165	-132.8	67.6	0	0	0	117.5
8	I	41.2	Very low	35.5	Very low	107 Å²	107	168.2 Å²	168.2	55%	0.549	79%	0.792	S	S	.	*	S	Bend	trans	-104.4	-16.6	-177.8	-62.6	177.2	0	0	0	112.9	L28	I8-L28 HydrophobicContact CD1-CD1 3.95Å
9	F	34.4	Very low	35.4	Very low	129 Å²	129	164.5 Å²	164.5	57%	0.566	79%	0.787	S	S	*	*	S	Bend	trans	-90.6	-12.9	-172.3	-127.7	-93	0	0	0	115.8	P25	F9-P25 VanDerWaalsContact CE2-CA 3.47Å; F9-P25 HydrophobicContact CE2-CB 3.49Å; F9-P25 VanDerWaalsContact CE2-CB 3.49Å; F9-P25 HydrophobicContact CE2-CG 4.43Å; F9-P25 VanDerWaalsContact CZ-CA 3.46Å; F9-P25 HydrophobicContact CZ-CB 3.39Å; F9-P25 HydrophobicContact CZ-CG 3.85Å
10	N	38.1	Very low	35	Very low	106 Å²	106	162.9 Å²	162.9	57%	0.567	79%	0.793	S	S	*	*	S	Bend	trans	-111.1	-1.8	-176.9	-86.2	-28.4	0	0	0	114.5
11	L	38.7	Very low	34.9	Very low	123 Å²	123	165.2 Å²	165.2	64%	0.644	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-9.7	-178.2	-110.1	120.3	0	0	0	114.5
12	W	34.5	Very low	35	Very low	239 Å²	239	161.8 Å²	161.8	91%	0.905	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	6.6	176.6	-89.3	86.4	0	0	0	114.2
13	R	33	Very low	34.9	Very low	191 Å²	191	160 Å²	160	72%	0.721	77%	0.769	S	S	*	*	S	Bend	trans	-103.9	0.6	-169	-145.1	-174.3	-93.2	-171.4	-5.4	115.5
14	N	32.7	Very low	35.1	Very low	151 Å²	151	160 Å²	160	81%	0.807	76%	0.764	S	S	*	*	S	Bend	trans	-156.2	82.5	177.5	-83.3	-41.5	0	0	0	110.8
15	V	40.9	Very low	34.9	Very low	126 Å²	126	155.2 Å²	155.2	76%	0.764	75%	0.749	S	S	*	*	S	Bend	trans	-171	110.1	144.1	175	0	0	0	0	107.9
16	N	34.4	Very low	35.1	Very low	152 Å²	152	148.9 Å²	148.9	81%	0.813	73%	0.729	S	S	*	*			trans	68.1	117.5	159.1	-59	-22.8	0	0	0	121	M18	N16-M18 PolarHBondContact O-N 3.16Å; N16-M18 VanDerWaalsContact O-N 3.09Å
17	H	31.1	Very low	34.9	Very low	198 Å²	198	150.5 Å²	150.5	92%	0.917	73%	0.731	S	S	*	*			trans	-49.3	99.4	169.2	-91.9	-104.6	0	0	0	113.4
18	M	30.3	Very low	34.7	Very low	178 Å²	178	146.5 Å²	146.5	88%	0.877	72%	0.724	S	S	*	*	S	Bend	trans	-164.7	129.5	140.8	-80.6	-146	80.5	0	0	108.6	N16	N16-M18 PolarHBondContact O-N 3.16Å; N16-M18 VanDerWaalsContact O-N 3.09Å
19	S	34.5	Very low	34.4	Very low	98 Å²	98	146 Å²	146	69%	0.685	72%	0.722	S	S	*	*			trans	80	79.7	-179.7	84.2	0	0	0	0	117.5	R21	S19-R21 PolarHBondContact O-N 2.99Å
20	S	27	Very low	34.6	Very low	132 Å²	132	146.7 Å²	146.7	92%	0.923	73%	0.726	S	S	*	*			trans	-76	42.6	170.3	67.6	0	0	0	0	113.7
21	R	33.7	Very low	34.8	Very low	212 Å²	212	148.2 Å²	148.2	80%	0.8	73%	0.733	S	S	*	*			trans	-136.7	20.9	-169.5	-140.6	-177	-79.1	-168.4	-1.9	116.8	S19	S19-R21 PolarHBondContact O-N 2.99Å
22	Y	35.8	Very low	35	Very low	162 Å²	162	146.6 Å²	146.6	64%	0.635	73%	0.729	S	S	*	*			trans	-141.5	90.1	174	-66.5	-77.5	0	0	0	111.7	K205	Y22-K205 WeakPolarHBondContact OH-CE 3.13Å
23	S	29.2	Very low	35.8	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	70%	0.699	S	S	*	*			trans	-130.5	70.5	167.3	61.9	0	0	0	0	109
24	H	39.8	Very low	37.1	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.787	69%	0.69	S	S	*	*			trans	-114.5	140.2	165.3	-73.7	-56.2	0	0	0	110	H26	H24-H26 PolarHBondContact O-N 3.09Å
25	P	33.8	Very low	38.8	Very low	85 Å²	85	128.6 Å²	128.6	55%	0.552	68%	0.682	S	S	*	*			trans	-68.9	100.4	-179.2	-10.6	25.9	0	0	0	110.9	F9 K27	F9-P25 VanDerWaalsContact CE2-CA 3.47Å; F9-P25 HydrophobicContact CE2-CB 3.49Å; F9-P25 VanDerWaalsContact CE2-CB 3.49Å; F9-P25 HydrophobicContact CE2-CG 4.43Å; F9-P25 VanDerWaalsContact CZ-CA 3.46Å; F9-P25 HydrophobicContact CZ-CB 3.39Å; F9-P25 HydrophobicContact CZ-CG 3.85Å; P25-K27 PolarHBondContact O-N 2.97Å; P25-K27 VanDerWaalsContact O-N 3.08Å
26	H	37.9	Very low	39.7	Very low	108 Å²	108	128.4 Å²	128.4	50%	0.5	68%	0.676	S	S	.	*			trans	-70.9	101.8	163.5	-113.3	-63.7	0	0	0	108.2	H24 L28 E204	H24-H26 PolarHBondContact O-N 3.09Å; H26-L28 PolarHBondContact O-N 3.28Å; H26-E204 IonicContact CD2-OE1 2.64Å; H26-E204 IonicContact NE2-OE1 3.24Å; H26-E204 PolarHBondContact NE2-OE1 3.08Å
27	K	34.3	Very low	40.9	Very low	166 Å²	166	122.8 Å²	122.8	72%	0.722	65%	0.647	S	S	*	*			trans	-76.6	111.7	164.1	-77.5	-178.7	179.8	173.5	0	107.2	P25 N29	P25-K27 PolarHBondContact O-N 2.97Å; P25-K27 VanDerWaalsContact O-N 3.08Å; K27-N29 PolarHBondContact O-N 2.93Å
28	L	33.6	Very low	42.2	Very low	128 Å²	128	119.5 Å²	119.5	67%	0.67	63%	0.631	S	S	*	*			trans	-57.8	101.8	163.3	-110.8	87.3	0	0	0	108.5	I8 H26 F30	I8-L28 HydrophobicContact CD1-CD1 3.95Å; H26-L28 PolarHBondContact O-N 3.28Å; L28-F30 PolarHBondContact O-N 3.37Å
29	N	34.6	Very low	43.6	Very low	96 Å²	96	114.3 Å²	114.3	51%	0.513	61%	0.609	S	S	.	*			trans	-90.2	32.9	169.6	-74.6	-23.1	0	0	0	111.3	K27 I31	K27-N29 PolarHBondContact O-N 2.93Å; N29-I31 PolarHBondContact O-N 3.44Å
30	F	38.4	Very low	44.8	Very low	145 Å²	145	114.4 Å²	114.4	64%	0.636	60%	0.597	S	S	*	*			trans	-83.6	91.2	169.6	-168.2	-97.5	0	0	0	109.4	L28 P32	L28-F30 PolarHBondContact O-N 3.37Å; F30-P32 HydrophobicContact CD1-CG 4.44Å; F30-P32 HydrophobicContact CE1-CG 3.97Å
31	I	42.5	Very low	46.2	Very low	138 Å²	138	111.6 Å²	111.6	71%	0.708	57%	0.567	S	S	*	*			trans	-107.7	112.1	166	-58.5	172.2	0	0	0	105.9	N29 S33	N29-I31 PolarHBondContact O-N 3.44Å; I31-S33 PolarHBondContact O-N 3.14Å
32	P	42.3	Very low	47.3	Very low	88 Å²	88	109.9 Å²	109.9	57%	0.571	57%	0.565	S	S	*	*			trans	-51.2	130	172.5	-20.6	29.1	0	0	0	109	F30 T34	F30-P32 HydrophobicContact CD1-CG 4.44Å; F30-P32 HydrophobicContact CE1-CG 3.97Å; P32-T34 PolarHBondContact O-N 3.26Å
33	S	52.2	Low	48.4	Very low	40 Å²	40	108.9 Å²	108.9	28%	0.28	56%	0.564	S	S	.	*			trans	-66	98	-179.9	57	0	0	0	0	109.8	I31 K38	I31-S33 PolarHBondContact O-N 3.14Å; S33-K38 WeakPolarHBondContact OG-CE 3.5Å
34	T	60	Low	49.7	Very low	86 Å²	86	106.2 Å²	106.2	53%	0.528	56%	0.556	S	S	.	*			trans	-56.9	154.5	170.5	27.1	0	0	0	0	110.4	P32 L36 T37 K38	P32-T34 PolarHBondContact O-N 3.26Å; T34-L36 PolarHBondContact O-N 2.98Å; T34-L36 VanDerWaalsContact O-N 3.12Å; T34-T37 PolarHBondContact N-OG1 3.44Å; T34-T37 WeakPolarHBondContact O-CA 3.48Å; T34-T37 WeakPolarHBondContact O-CB 3.41Å; T34-T37 PolarHBondContact O-N 3.34Å; T34-T37 PolarHBondContact O-OG1 2.91Å; T34-T37 PolarHBondContact OG1-OG1 3.34Å; T34-K38 PolarHBondContact O-N 2.96Å; T34-K38 VanDerWaalsContact O-N 3.17Å
35	A	67.8	Low	50.5	Low	78 Å²	78	104.2 Å²	104.2	65%	0.645	55%	0.55	S	S	*	*	H	α-helix	trans	-49.4	-41	175.3	0	0	0	0	0	111.5	T37 K38 T39	A35-T37 VanDerWaalsContact C-N 3.33Å; A35-T37 PolarHBondContact O-N 3.13Å; A35-K38 WeakPolarHBondContact O-CB 3.25Å; A35-K38 PolarHBondContact O-N 3.14Å; A35-K38 VanDerWaalsContact O-N 3.17Å; A35-T39 PolarHBondContact O-N 3.03Å; A35-T39 PolarHBondContact O-OG1 3.29Å
36	L	60.7	Low	51.6	Low	121 Å²	121	102 Å²	102	63%	0.634	54%	0.535	S	S	*	.	H	α-helix	trans	-56.2	-39.6	173.1	-114.1	153.2	0	0	0	113.9	T34 T39 K40	T34-L36 PolarHBondContact O-N 2.98Å; T34-L36 VanDerWaalsContact O-N 3.12Å; L36-T39 PolarHBondContact O-N 3.33Å; L36-K40 WeakPolarHBondContact O-CB 3.41Å; L36-K40 VanDerWaalsContact O-CG 3.26Å; L36-K40 WeakPolarHBondContact O-CG 3.33Å; L36-K40 PolarHBondContact O-N 3.22Å
37	T	59.3	Low	52.6	Low	34 Å²	34	100 Å²	100	21%	0.209	54%	0.544	C	S	.	.	H	α-helix	trans	-68.2	-44.1	177.2	-34.5	0	0	0	0	110.2	T34 A35 T39 K40 Y41	T34-T37 PolarHBondContact N-OG1 3.44Å; T34-T37 WeakPolarHBondContact O-CA 3.48Å; T34-T37 WeakPolarHBondContact O-CB 3.41Å; T34-T37 PolarHBondContact O-N 3.34Å; T34-T37 PolarHBondContact O-OG1 2.91Å; T34-T37 PolarHBondContact OG1-OG1 3.34Å; A35-T37 VanDerWaalsContact C-N 3.33Å; A35-T37 PolarHBondContact O-N 3.13Å; T37-T39 VanDerWaalsContact C-N 3.35Å; T37-T39 PolarHBondContact O-N 3.28Å; T37-K40 PolarHBondContact O-N 3.32Å; T37-Y41 HydrophobicContact CG2-CD2 4.36Å; T37-Y41 HydrophobicContact CG2-CE2 3.71Å; T37-Y41 WeakPolarHBondContact O-CD2 3.5Å; T37-Y41 PolarHBondContact O-N 3.42Å
38	K	58.9	Low	54.4	Low	130 Å²	130	102.3 Å²	102.3	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-61.4	-41.1	174.1	-65.8	-179.5	-178.2	175	0	112.3	S33 T34 A35 Y41 F42	S33-K38 WeakPolarHBondContact OG-CE 3.5Å; T34-K38 PolarHBondContact O-N 2.96Å; T34-K38 VanDerWaalsContact O-N 3.17Å; A35-K38 WeakPolarHBondContact O-CB 3.25Å; A35-K38 PolarHBondContact O-N 3.14Å; A35-K38 VanDerWaalsContact O-N 3.17Å; K38-Y41 WeakPolarHBondContact O-CB 3.42Å; K38-Y41 PolarHBondContact O-N 3.18Å; K38-F42 PolarHBondContact O-N 3.12Å
39	T	59.2	Low	56.7	Low	69 Å²	69	98.9 Å²	98.9	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-65.8	-42.9	175.2	-53.2	0	0	0	0	111	A35 L36 T37 Y41 F42 F43	A35-T39 PolarHBondContact O-N 3.03Å; A35-T39 PolarHBondContact O-OG1 3.29Å; L36-T39 PolarHBondContact O-N 3.33Å; T37-T39 VanDerWaalsContact C-N 3.35Å; T37-T39 PolarHBondContact O-N 3.28Å; T39-Y41 VanDerWaalsContact C-N 3.3Å; T39-Y41 PolarHBondContact O-N 2.72Å; T39-F42 WeakPolarHBondContact O-CB 3.35Å; T39-F42 PolarHBondContact O-N 2.78Å; T39-F42 VanDerWaalsContact O-N 3.13Å; T39-F43 HydrophobicContact CG2-CD2 3.61Å; T39-F43 HydrophobicContact CG2-CE2 3.54Å; T39-F43 WeakPolarHBondContact O-CD2 3.34Å; T39-F43 PolarHBondContact O-N 2.99Å
40	K	60.7	Low	59.1	Low	99 Å²	99	101.4 Å²	101.4	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-60	-38.5	173.3	-75.2	177.9	-179.2	-174.3	0	112.2	L36 T37 F43 G44 L45 T46	L36-K40 WeakPolarHBondContact O-CB 3.41Å; L36-K40 VanDerWaalsContact O-CG 3.26Å; L36-K40 WeakPolarHBondContact O-CG 3.33Å; L36-K40 PolarHBondContact O-N 3.22Å; T37-K40 PolarHBondContact O-N 3.32Å; K40-F43 CarbonylContact O-C 3.25Å; K40-F43 PolarHBondContact O-N 2.91Å; K40-G44 PolarHBondContact O-N 3.31Å; K40-L45 HydrophobicContact CB-CB 4.02Å; K40-L45 HydrophobicContact CG-CB 4.12Å; K40-L45 HydrophobicContact CG-CD1 4.49Å; K40-L45 PolarHBondContact O-N 3.27Å; K40-T46 HydrophobicContact CB-CG2 3.91Å
41	Y	56.1	Low	61.5	Low	74 Å²	74	96.8 Å²	96.8	29%	0.29	52%	0.524	S	S	.	.	H	α-helix	trans	-60.1	-47.9	171.3	-78.5	-65.3	0	0	0	112.3	T37 K38 T39 F43 G44 T46 E109	T37-Y41 HydrophobicContact CG2-CD2 4.36Å; T37-Y41 HydrophobicContact CG2-CE2 3.71Å; T37-Y41 WeakPolarHBondContact O-CD2 3.5Å; T37-Y41 PolarHBondContact O-N 3.42Å; K38-Y41 WeakPolarHBondContact O-CB 3.42Å; K38-Y41 PolarHBondContact O-N 3.18Å; T39-Y41 VanDerWaalsContact C-N 3.3Å; T39-Y41 PolarHBondContact O-N 2.72Å; Y41-F43 PolarHBondContact O-N 2.88Å; Y41-G44 PolarHBondContact O-N 2.9Å; Y41-G44 VanDerWaalsContact O-N 3.08Å; Y41-T46 HydrophobicContact CD1-CG2 4.24Å; Y41-T46 WeakPolarHBondContact CD1-OG1 3.43Å; Y41-T46 HydrophobicContact CD2-CG2 4.46Å; Y41-T46 VanDerWaalsContact CE1-CB 3.46Å; Y41-T46 HydrophobicContact CE1-CG2 3.8Å; Y41-T46 WeakPolarHBondContact CE1-OG1 3.37Å; Y41-T46 HydrophobicContact CE2-CG2 4.09Å; Y41-T46 HydrophobicContact CG-CG2 4.46Å; Y41-E109 HydrophobicContact CE1-CG 3.48Å; Y41-E109 VanDerWaalsContact CE1-CG 3.48Å; Y41-E109 HydrophobicContact CE2-CG 4.11Å; Y41-E109 WeakPolarHBondContact CE2-OE1 3.34Å; Y41-E109 VanDerWaalsContact CE2-OE2 3.26Å; Y41-E109 WeakPolarHBondContact CE2-OE2 3.19Å; Y41-E109 VanDerWaalsContact OH-CB 3.3Å; Y41-E109 WeakPolarHBondContact OH-CB 3.47Å; Y41-E109 WeakPolarHBondContact OH-CG 3.36Å; Y41-E109 PolarHBondContact OH-OE2 2.98Å
42	F	57.3	Low	63.8	Low	175 Å²	175	94.2 Å²	94.2	77%	0.768	52%	0.515	S	S	*	.	H	α-helix	trans	-59	-36.6	178.8	-175.2	-98.6	0	0	0	112.2	K38 T39	K38-F42 PolarHBondContact O-N 3.12Å; T39-F42 WeakPolarHBondContact O-CB 3.35Å; T39-F42 PolarHBondContact O-N 2.78Å; T39-F42 VanDerWaalsContact O-N 3.13Å
43	F	57.1	Low	66.1	Low	141 Å²	141	94.6 Å²	94.6	62%	0.618	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	3.4	177	-72.1	-71.6	0	0	0	114.8	T39 K40 Y41 L45	T39-F43 HydrophobicContact CG2-CD2 3.61Å; T39-F43 HydrophobicContact CG2-CE2 3.54Å; T39-F43 WeakPolarHBondContact O-CD2 3.34Å; T39-F43 PolarHBondContact O-N 2.99Å; K40-F43 CarbonylContact O-C 3.25Å; K40-F43 PolarHBondContact O-N 2.91Å; Y41-F43 PolarHBondContact O-N 2.88Å; F43-L45 VanDerWaalsContact C-N 3.3Å; F43-L45 HydrophobicContact CB-CD1 3.94Å; F43-L45 HydrophobicContact CB-CG 4.08Å; F43-L45 PolarHBondContact O-N 3.21Å
44	G	57	Low	67.9	Low	60 Å²	60	102 Å²	102	62%	0.619	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	22.5	179.5	0	0	0	0	0	115.3	K40 Y41	K40-G44 PolarHBondContact O-N 3.31Å; Y41-G44 PolarHBondContact O-N 2.9Å; Y41-G44 VanDerWaalsContact O-N 3.08Å
45	L	56.8	Low	69.5	Low	128 Å²	128	99.8 Å²	99.8	67%	0.67	52%	0.521	S	S	*	.			trans	-91.4	0.1	-175.8	-66.3	171.1	0	0	0	113.9	K40 F43	K40-L45 HydrophobicContact CB-CB 4.02Å; K40-L45 HydrophobicContact CG-CB 4.12Å; K40-L45 HydrophobicContact CG-CD1 4.49Å; K40-L45 PolarHBondContact O-N 3.27Å; F43-L45 VanDerWaalsContact C-N 3.3Å; F43-L45 HydrophobicContact CB-CD1 3.94Å; F43-L45 HydrophobicContact CB-CG 4.08Å; F43-L45 PolarHBondContact O-N 3.21Å
46	T	56.1	Low	70.7	Confident	37 Å²	37	96 Å²	96	23%	0.227	49%	0.49	C	S	.	.	S	Bend	trans	-94.5	142.7	172.4	37.5	0	0	0	0	109.6	K40 Y41	K40-T46 HydrophobicContact CB-CG2 3.91Å; Y41-T46 HydrophobicContact CD1-CG2 4.24Å; Y41-T46 WeakPolarHBondContact CD1-OG1 3.43Å; Y41-T46 HydrophobicContact CD2-CG2 4.46Å; Y41-T46 VanDerWaalsContact CE1-CB 3.46Å; Y41-T46 HydrophobicContact CE1-CG2 3.8Å; Y41-T46 WeakPolarHBondContact CE1-OG1 3.37Å; Y41-T46 HydrophobicContact CE2-CG2 4.09Å; Y41-T46 HydrophobicContact CG-CG2 4.46Å
47	G	60.8	Low	72.3	Confident	68 Å²	68	95.5 Å²	95.5	70%	0.701	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-48.8	151.2	-170.1	0	0	0	0	0	113.8	L49	G47-L49 PolarHBondContact O-N 2.81Å
48	K	71.5	Confident	73.9	Confident	213 Å²	213	97.5 Å²	97.5	93%	0.926	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-49.1	117.4	178.4	-66.2	-179	179.8	-179.9	0	109.1
49	L	81.8	Confident	75.7	Confident	57 Å²	57	91.3 Å²	91.3	30%	0.298	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-54.7	142.9	169.5	-60.5	171.4	0	0	0	108.5	G47 Y51 L56 E109 E110 I113	G47-L49 PolarHBondContact O-N 2.81Å; L49-Y51 VanDerWaalsContact C-N 3.3Å; L49-Y51 WeakPolarHBondContact CB-O 3.37Å; L49-L56 HydrophobicContact CD1-CD1 4.27Å; L49-E109 HydrophobicContact CD2-CG 4.47Å; L49-E110 HydrophobicContact CD2-CG 3.92Å; L49-I113 HydrophobicContact CD1-CD1 4.01Å; L49-I113 HydrophobicContact CD2-CD1 3.95Å
50	Q	84.7	Confident	77.4	Confident	149 Å²	149	88 Å²	88	70%	0.696	44%	0.441	S	S	*	.	S	Bend	trans	-68.6	-37.2	175.9	-60.4	176	77.4	0	0	110	E110	Q50-E110 WeakPolarHBondContact CA-OE1 3.31Å; Q50-E110 WeakPolarHBondContact CB-OE1 3.37Å; Q50-E110 WeakPolarHBondContact CB-OE2 3.14Å; Q50-E110 WeakPolarHBondContact CG-OE2 3.5Å; Q50-E110 PolarHBondContact N-OE1 3.38Å; Q50-E110 PolarHBondContact NE2-OE2 3.38Å
51	Y	88.6	Confident	79	Confident	48 Å²	48	85.7 Å²	85.7	19%	0.188	43%	0.432	C	S	.	.	S	Bend	trans	-113.2	145.8	179.1	-61.8	-83.7	0	0	0	112.3	L49 T55 L56 E110 N209 L212 E213	L49-Y51 VanDerWaalsContact C-N 3.3Å; L49-Y51 WeakPolarHBondContact CB-O 3.37Å; Y51-T55 HydrophobicContact CD1-CG2 4.21Å; Y51-L56 HydrophobicContact CD2-CD2 4.47Å; Y51-E110 PolarHBondContact N-OE1 3.29Å; Y51-N209 WeakPolarHBondContact OH-CB 3.49Å; Y51-L212 HydrophobicContact CD2-CB 3.7Å; Y51-L212 HydrophobicContact CD2-CD1 4.13Å; Y51-L212 HydrophobicContact CE2-CB 3.63Å; Y51-L212 HydrophobicContact CE2-CD1 3.97Å; Y51-L212 HydrophobicContact CE2-CG 4.47Å; Y51-E213 HydrophobicContact CD1-CB 4.22Å; Y51-E213 HydrophobicContact CD1-CG 4.28Å; Y51-E213 HydrophobicContact CE1-CB 3.67Å; Y51-E213 HydrophobicContact CE1-CG 3.84Å
52	P	90.5	Very high	80.9	Confident	83 Å²	83	83.9 Å²	83.9	54%	0.539	43%	0.427	S	S	.	.			trans	-58.8	146	171.2	-22.2	32.6	0	0	0	111.9	R54 T55 L56	P52-R54 PolarHBondContact O-N 2.73Å; P52-T55 WeakPolarHBondContact O-CA 3.38Å; P52-T55 WeakPolarHBondContact O-CB 3.15Å; P52-T55 PolarHBondContact O-N 2.69Å; P52-L56 PolarHBondContact O-N 2.96Å; P52-L56 VanDerWaalsContact O-N 3.13Å
53	N	90	Very high	82.7	Confident	97 Å²	97	75.5 Å²	75.5	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-53	-31.7	176.6	-82.8	-58.2	0	0	0	113.8	R57	N53-R57 WeakPolarHBondContact O-CB 3.25Å; N53-R57 PolarHBondContact O-N 2.77Å
54	R	91.7	Very high	84.6	Confident	195 Å²	195	69.2 Å²	69.2	74%	0.736	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-43.7	175	-178.2	-174.7	-69.4	-95.3	3.2	111.5	P52 R57 I58	P52-R54 PolarHBondContact O-N 2.73Å; R54-R57 WeakPolarHBondContact O-CB 3.48Å; R54-R57 PolarHBondContact O-N 3.45Å; R54-I58 HydrophobicContact CG-CD1 4.09Å; R54-I58 WeakPolarHBondContact O-CG1 3.42Å; R54-I58 PolarHBondContact O-N 3.32Å
55	T	92.2	Very high	86.3	Confident	39 Å²	39	68.6 Å²	68.6	24%	0.239	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-48.2	178.1	-54.5	0	0	0	0	110.4	Y51 P52 R57 I58 S59 E213	Y51-T55 HydrophobicContact CD1-CG2 4.21Å; P52-T55 WeakPolarHBondContact O-CA 3.38Å; P52-T55 WeakPolarHBondContact O-CB 3.15Å; P52-T55 PolarHBondContact O-N 2.69Å; T55-R57 PolarHBondContact O-N 2.97Å; T55-I58 PolarHBondContact O-N 3.46Å; T55-S59 WeakPolarHBondContact O-CB 3.4Å; T55-S59 PolarHBondContact O-N 3.46Å; T55-E213 HydrophobicContact CG2-CB 4.48Å; T55-E213 HydrophobicContact CG2-CG 4.15Å
56	L	94.1	Very high	88.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-35.2	177.1	-61.7	175.8	0	0	0	112.4	L49 Y51 P52 G60 E110 I113 V114 L212	L49-L56 HydrophobicContact CD1-CD1 4.27Å; Y51-L56 HydrophobicContact CD2-CD2 4.47Å; P52-L56 PolarHBondContact O-N 2.96Å; P52-L56 VanDerWaalsContact O-N 3.13Å; L56-G60 PolarHBondContact O-N 3.42Å; L56-E110 HydrophobicContact CD1-CB 4.25Å; L56-E110 HydrophobicContact CD1-CG 4.08Å; L56-E110 HydrophobicContact CD2-CB 3.97Å; L56-E110 HydrophobicContact CD2-CG 4.36Å; L56-I113 HydrophobicContact CB-CG2 3.81Å; L56-I113 HydrophobicContact CD1-CB 4.19Å; L56-I113 HydrophobicContact CD1-CD1 3.88Å; L56-I113 HydrophobicContact CD1-CG2 4Å; L56-V114 HydrophobicContact CB-CG2 4.11Å; L56-V114 HydrophobicContact CD2-CG2 3.88Å; L56-L212 HydrophobicContact CD2-CB 4.17Å; L56-L212 HydrophobicContact CD2-CD2 4.21Å
57	R	94.6	Very high	90.1	Very high	110 Å²	110	60.8 Å²	60.8	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-55	173.2	171.2	178.6	170.5	-168.1	-6.6	111.8	N53 R54 T55 S59 G60 E61 W117	N53-R57 WeakPolarHBondContact O-CB 3.25Å; N53-R57 PolarHBondContact O-N 2.77Å; R54-R57 WeakPolarHBondContact O-CB 3.48Å; R54-R57 PolarHBondContact O-N 3.45Å; T55-R57 PolarHBondContact O-N 2.97Å; R57-S59 PolarHBondContact O-N 3.44Å; R57-G60 PolarHBondContact O-N 3.39Å; R57-G60 VanDerWaalsContact O-N 3.15Å; R57-E61 IonicContact CZ-OE1 3.47Å; R57-E61 IonicContact NE-OE1 3.78Å; R57-E61 PolarHBondContact NE-OE1 2.89Å; R57-E61 IonicContact NH2-OE1 3.27Å; R57-E61 PolarHBondContact NH2-OE1 3.14Å; R57-E61 VanDerWaalsContact NH2-OE1 3.09Å; R57-E61 PolarHBondContact O-N 3.02Å; R57-W117 HydrophobicContact CB-CD2 3.93Å; R57-W117 HydrophobicContact CB-CG 4.02Å; R57-W117 HydrophobicContact CB-CZ2 4.35Å; R57-W117 HydrophobicContact CG-CD2 3.64Å; R57-W117 HydrophobicContact CG-CE3 3.75Å; R57-W117 HydrophobicContact CG-CG 4.05Å; R57-W117 HydrophobicContact CG-CH2 4.33Å; R57-W117 HydrophobicContact CG-CZ2 4.23Å; R57-W117 HydrophobicContact CG-CZ3 4.08Å
58	I	93.2	Very high	91.7	Very high	76 Å²	76	58 Å²	58	39%	0.39	27%	0.272	S	S	.	.	H	α-helix	trans	-59.4	-41.3	-179.7	-67.5	166.8	0	0	0	109.8	R54 T55 G60 E61 N62	R54-I58 HydrophobicContact CG-CD1 4.09Å; R54-I58 WeakPolarHBondContact O-CG1 3.42Å; R54-I58 PolarHBondContact O-N 3.32Å; T55-I58 PolarHBondContact O-N 3.46Å; I58-G60 PolarHBondContact O-N 2.63Å; I58-E61 PolarHBondContact O-N 3.04Å; I58-N62 WeakPolarHBondContact O-CB 3.19Å; I58-N62 VanDerWaalsContact O-CG 3.28Å; I58-N62 PolarHBondContact O-N 3.39Å
59	S	95	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-45.1	176.1	-169.9	0	0	0	0	112.2	T55 R57 N62 L63 F211 L212 G215	T55-S59 WeakPolarHBondContact O-CB 3.4Å; T55-S59 PolarHBondContact O-N 3.46Å; R57-S59 PolarHBondContact O-N 3.44Å; S59-N62 PolarHBondContact O-N 3.46Å; S59-L63 WeakPolarHBondContact O-CB 3.41Å; S59-L63 WeakPolarHBondContact O-CG 3.43Å; S59-L63 PolarHBondContact O-N 3.46Å; S59-F211 PolarHBondContact OG-O 3.02Å; S59-L212 WeakPolarHBondContact CB-O 3.32Å; S59-G215 WeakPolarHBondContact O-CA 3.44Å; S59-G215 WeakPolarHBondContact OG-CA 3.5Å; S59-G215 PolarHBondContact OG-N 3.3Å; S59-G215 VanDerWaalsContact OG-N 3.1Å
60	G	96	Very high	93.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-40.1	176.1	0	0	0	0	0	113.7	L56 R57 I58 F64 M118	L56-G60 PolarHBondContact O-N 3.42Å; R57-G60 PolarHBondContact O-N 3.39Å; R57-G60 VanDerWaalsContact O-N 3.15Å; I58-G60 PolarHBondContact O-N 2.63Å; G60-F64 PolarHBondContact O-N 2.89Å; G60-M118 VanDerWaalsContact O-CA 3.3Å; G60-M118 WeakPolarHBondContact O-CA 3.4Å; G60-M118 WeakPolarHBondContact O-CB 3.43Å
61	E	94.8	Very high	93.8	Very high	50 Å²	50	40.3 Å²	40.3	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-45.7	174.8	-69.6	169.3	-179.7	0	0	111	R57 I58 L63 F64 I65 A121	R57-E61 IonicContact CZ-OE1 3.47Å; R57-E61 IonicContact NE-OE1 3.78Å; R57-E61 PolarHBondContact NE-OE1 2.89Å; R57-E61 IonicContact NH2-OE1 3.27Å; R57-E61 PolarHBondContact NH2-OE1 3.14Å; R57-E61 VanDerWaalsContact NH2-OE1 3.09Å; R57-E61 PolarHBondContact O-N 3.02Å; I58-E61 PolarHBondContact O-N 3.04Å; E61-L63 PolarHBondContact O-N 2.97Å; E61-F64 PolarHBondContact O-N 2.82Å; E61-I65 WeakPolarHBondContact O-CG1 3.21Å; E61-I65 PolarHBondContact O-N 2.97Å; E61-A121 HydrophobicContact CG-CB 4.34Å
62	N	94.6	Very high	94	Very high	35 Å²	35	39.9 Å²	39.9	19%	0.187	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-42.8	176.3	-73.2	-10.1	0	0	0	112.3	I58 S59 F64 I65 I66 S214 G215	I58-N62 WeakPolarHBondContact O-CB 3.19Å; I58-N62 VanDerWaalsContact O-CG 3.28Å; I58-N62 PolarHBondContact O-N 3.39Å; S59-N62 PolarHBondContact O-N 3.46Å; N62-F64 VanDerWaalsContact C-N 3.26Å; N62-F64 PolarHBondContact O-N 2.74Å; N62-I65 PolarHBondContact O-N 2.85Å; N62-I65 VanDerWaalsContact O-N 3.12Å; N62-I66 WeakPolarHBondContact O-CB 3.18Å; N62-I66 VanDerWaalsContact O-CG1 3.22Å; N62-I66 WeakPolarHBondContact O-CG1 3.49Å; N62-I66 PolarHBondContact O-N 2.85Å; N62-S214 PolarHBondContact ND2-O 3.21Å; N62-G215 CarbonylContact C-O 3.5Å; N62-G215 VanDerWaalsContact C-O 3.25Å; N62-G215 WeakPolarHBondContact CB-O 3.42Å
63	L	96.1	Very high	94.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-39.7	178.6	-86.5	164.3	0	0	0	111.9	S59 E61 C67 L104 V114 M118 F211 G215 P217	S59-L63 WeakPolarHBondContact O-CB 3.41Å; S59-L63 WeakPolarHBondContact O-CG 3.43Å; S59-L63 PolarHBondContact O-N 3.46Å; E61-L63 PolarHBondContact O-N 2.97Å; L63-C67 WeakPolarHBondContact O-CB 3.37Å; L63-C67 PolarHBondContact O-N 3.02Å; L63-C67 PolarHBondContact O-SG 3.23Å; L63-L104 HydrophobicContact CD1-CD1 4.33Å; L63-V114 HydrophobicContact CD1-CG1 3.26Å; L63-M118 HydrophobicContact CB-CE 4.36Å; L63-M118 HydrophobicContact CB-CG 4.33Å; L63-M118 HydrophobicContact CB-SD 3.9Å; L63-F211 HydrophobicContact CD1-CD1 4.18Å; L63-F211 HydrophobicContact CD2-CD1 3.81Å; L63-F211 HydrophobicContact CD2-CE1 3.95Å; L63-G215 WeakPolarHBondContact CA-O 3.37Å; L63-G215 PolarHBondContact N-O 3.23Å; L63-G215 VanDerWaalsContact N-O 3.1Å; L63-P217 HydrophobicContact CD2-CG 3.44Å; L63-P217 VanDerWaalsContact CD2-CG 3.44Å
64	F	95.9	Very high	94.5	Very high	9 Å²	9	38.9 Å²	38.9	4%	0.039	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-51	174.2	164.8	-107.3	0	0	0	111.2	G60 E61 N62 I66 C67 A68 T93 I97 M118 A121 L122 D125	G60-F64 PolarHBondContact O-N 2.89Å; E61-F64 PolarHBondContact O-N 2.82Å; N62-F64 VanDerWaalsContact C-N 3.26Å; N62-F64 PolarHBondContact O-N 2.74Å; F64-I66 VanDerWaalsContact C-N 3.25Å; F64-I66 PolarHBondContact O-N 3.31Å; F64-C67 PolarHBondContact O-N 3.31Å; F64-C67 VanDerWaalsContact O-N 3.12Å; F64-A68 HydrophobicContact CE2-CB 4.17Å; F64-A68 HydrophobicContact CZ-CB 4.2Å; F64-A68 WeakPolarHBondContact O-CB 3.31Å; F64-A68 PolarHBondContact O-N 2.82Å; F64-T93 HydrophobicContact CE2-CG2 4.4Å; F64-I97 HydrophobicContact CD2-CD1 4.11Å; F64-M118 HydrophobicContact CB-CG 3.96Å; F64-A121 HydrophobicContact CB-CB 3.85Å; F64-A121 HydrophobicContact CD1-CB 3.71Å; F64-A121 HydrophobicContact CG-CB 3.9Å; F64-L122 HydrophobicContact CD2-CB 3.78Å; F64-L122 HydrophobicContact CD2-CD1 4.22Å; F64-L122 HydrophobicContact CE2-CB 3.8Å; F64-L122 HydrophobicContact CE2-CD1 3.53Å; F64-L122 HydrophobicContact CE2-CG 4.28Å; F64-L122 HydrophobicContact CZ-CD1 4.31Å; F64-D125 HydrophobicContact CE1-CB 3.53Å; F64-D125 HydrophobicContact CZ-CB 3.58Å
65	I	94.4	Very high	94.6	Very high	46 Å²	46	32.2 Å²	32.2	24%	0.236	16%	0.159	C	C	.	.	H	α-helix	trans	-57	-43.9	179.7	-63.7	166.8	0	0	0	110.3	E61 N62 A68 E69 C239	E61-I65 WeakPolarHBondContact O-CG1 3.21Å; E61-I65 PolarHBondContact O-N 2.97Å; N62-I65 PolarHBondContact O-N 2.85Å; N62-I65 VanDerWaalsContact O-N 3.12Å; I65-A68 PolarHBondContact O-N 3.38Å; I65-E69 WeakPolarHBondContact O-CB 3.28Å; I65-E69 PolarHBondContact O-N 3.27Å; I65-C239 HydrophobicContact CG2-CB 4.11Å; I65-C239 WeakPolarHBondContact CG2-O 3.33Å
66	I	95.4	Very high	94.9	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-44.7	178.1	-67.9	-75.6	0	0	0	111	N62 F64 A68 Y70 P71 A216 P217 F219 L236 C239	N62-I66 WeakPolarHBondContact O-CB 3.18Å; N62-I66 VanDerWaalsContact O-CG1 3.22Å; N62-I66 WeakPolarHBondContact O-CG1 3.49Å; N62-I66 PolarHBondContact O-N 2.85Å; F64-I66 VanDerWaalsContact C-N 3.25Å; F64-I66 PolarHBondContact O-N 3.31Å; I66-A68 VanDerWaalsContact C-N 3.28Å; I66-A68 PolarHBondContact O-N 3.02Å; I66-Y70 HydrophobicContact CD1-CD2 4.14Å; I66-Y70 HydrophobicContact CG2-CG 4.37Å; I66-Y70 WeakPolarHBondContact O-CA 3.36Å; I66-Y70 WeakPolarHBondContact O-CB 3.45Å; I66-Y70 PolarHBondContact O-N 3.14Å; I66-P71 VanDerWaalsContact O-CD 3.28Å; I66-P71 WeakPolarHBondContact O-CD 3.38Å; I66-A216 HydrophobicContact CD1-CB 4.41Å; I66-A216 HydrophobicContact CG1-CB 4.48Å; I66-P217 HydrophobicContact CG2-CG 4.4Å; I66-P217 WeakPolarHBondContact CG2-O 3.49Å; I66-F219 HydrophobicContact CG2-CD2 4.14Å; I66-F219 HydrophobicContact CG2-CE2 3.94Å; I66-L236 HydrophobicContact CD1-CD2 3.63Å; I66-C239 HydrophobicContact CD1-CB 3.74Å
67	C	96.4	Very high	95	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-63.6	-33.6	176.2	-68	0	0	0	0	113.4	L63 F64 H96 I97 M118	L63-C67 WeakPolarHBondContact O-CB 3.37Å; L63-C67 PolarHBondContact O-N 3.02Å; L63-C67 PolarHBondContact O-SG 3.23Å; F64-C67 PolarHBondContact O-N 3.31Å; F64-C67 VanDerWaalsContact O-N 3.12Å; C67-H96 HydrophobicContact CB-CB 3.93Å; C67-I97 HydrophobicContact CB-CG1 3.8Å; C67-M118 HydrophobicContact CB-CE 4.28Å; C67-M118 WeakPolarHBondContact SG-CE 3.13Å
68	A	94.3	Very high	95.1	Very high	8 Å²	8	32.5 Å²	32.5	7%	0.066	16%	0.164	C	C	.	.	H	α-helix	trans	-80.6	-35.3	-177.7	0	0	0	0	0	113.3	F64 I65 I66 W89 T93	F64-A68 HydrophobicContact CE2-CB 4.17Å; F64-A68 HydrophobicContact CZ-CB 4.2Å; F64-A68 WeakPolarHBondContact O-CB 3.31Å; F64-A68 PolarHBondContact O-N 2.82Å; I65-A68 PolarHBondContact O-N 3.38Å; I66-A68 VanDerWaalsContact C-N 3.28Å; I66-A68 PolarHBondContact O-N 3.02Å; A68-W89 HydrophobicContact CB-CZ2 4.03Å; A68-W89 PolarHBondContact O-NE1 3.21Å; A68-T93 HydrophobicContact CB-CG2 4.02Å
69	E	92.8	Very high	95.2	Very high	22 Å²	22	32.1 Å²	32.1	10%	0.103	16%	0.16	C	C	.	.	H	α-helix	trans	-125.5	-16.8	-164	-55.6	-62.1	155.9	0	0	113.9	I65 R129 R235 Y238 F242	I65-E69 WeakPolarHBondContact O-CB 3.28Å; I65-E69 PolarHBondContact O-N 3.27Å; E69-R129 IonicContact OE1-CZ 3.64Å; E69-R129 IonicContact OE1-NH1 3.79Å; E69-R129 PolarHBondContact OE1-NH1 3.19Å; E69-R129 IonicContact OE1-NH2 3.67Å; E69-R129 PolarHBondContact OE1-NH2 2.86Å; E69-R235 PolarHBondContact O-NH2 3.02Å; E69-Y238 HydrophobicContact CB-CE1 4.29Å; E69-F242 HydrophobicContact CB-CD1 4.4Å; E69-F242 VanDerWaalsContact CD-CZ 3.49Å; E69-F242 HydrophobicContact CG-CD1 3.43Å; E69-F242 VanDerWaalsContact CG-CD1 3.43Å; E69-F242 HydrophobicContact CG-CE1 3.56Å; E69-F242 HydrophobicContact CG-CG 4.09Å; E69-F242 HydrophobicContact CG-CZ 4.3Å; E69-F242 WeakPolarHBondContact OE1-CE1 3.49Å; E69-F242 WeakPolarHBondContact OE2-CE1 3.23Å; E69-F242 WeakPolarHBondContact OE2-CZ 3.34Å
70	Y	94.7	Very high	95.3	Very high	11 Å²	11	32.1 Å²	32.1	4%	0.043	16%	0.16	C	C	.	.	S	Bend	trans	-73.8	-50.2	-179.8	-172	-80.4	0	0	0	112.3	I66 V72 M218 F219 A232 R235 L236 C239	I66-Y70 HydrophobicContact CD1-CD2 4.14Å; I66-Y70 HydrophobicContact CG2-CG 4.37Å; I66-Y70 WeakPolarHBondContact O-CA 3.36Å; I66-Y70 WeakPolarHBondContact O-CB 3.45Å; I66-Y70 PolarHBondContact O-N 3.14Å; Y70-V72 PolarHBondContact O-N 3.05Å; Y70-M218 HydrophobicContact CE2-CG 4.41Å; Y70-M218 WeakPolarHBondContact OH-CB 3.48Å; Y70-F219 HydrophobicContact CD1-CB 3.84Å; Y70-F219 HydrophobicContact CD1-CD2 4.14Å; Y70-F219 HydrophobicContact CE1-CB 4Å; Y70-F219 VanDerWaalsContact CE1-N 3.3Å; Y70-F219 WeakPolarHBondContact CE1-O 3.33Å; Y70-A232 VanDerWaalsContact OH-CA 3.29Å; Y70-A232 WeakPolarHBondContact OH-CA 3.34Å; Y70-A232 VanDerWaalsContact OH-CB 3.27Å; Y70-A232 WeakPolarHBondContact OH-CB 3.5Å; Y70-R235 HydrophobicContact CD2-CB 3.73Å; Y70-R235 HydrophobicContact CE2-CB 3.5Å; Y70-R235 HydrophobicContact CG-CB 4.36Å; Y70-R235 VanDerWaalsContact O-CZ 3.31Å; Y70-R235 PolarHBondContact O-NE 3.26Å; Y70-R235 PolarHBondContact O-NH2 3.09Å; Y70-L236 HydrophobicContact CD2-CD2 4Å; Y70-L236 HydrophobicContact CD2-CG 4.44Å; Y70-L236 HydrophobicContact CE2-CD2 3.78Å; Y70-L236 HydrophobicContact CE2-CG 3.83Å; Y70-C239 VanDerWaalsContact CA-SG 3.56Å; Y70-C239 PolarHBondContact N-SG 3.32Å
71	P	94.2	Very high	95.3	Very high	15 Å²	15	38.9 Å²	38.9	10%	0.097	19%	0.189	C	C	.	.	S	Bend	trans	-56.7	135.7	172.8	-21.8	33.6	0	0	0	110.9	I66 F73 F76 H96 F219 R235	I66-P71 VanDerWaalsContact O-CD 3.28Å; I66-P71 WeakPolarHBondContact O-CD 3.38Å; P71-F73 PolarHBondContact O-N 2.96Å; P71-F76 HydrophobicContact CB-CE2 3.87Å; P71-F76 HydrophobicContact CB-CZ 4.37Å; P71-H96 WeakPolarHBondContact CG-NE2 3.5Å; P71-F219 HydrophobicContact CG-CD2 4.36Å; P71-R235 PolarHBondContact O-NH2 3.11Å; P71-R235 VanDerWaalsContact O-NH2 3.12Å
72	V	93.6	Very high	95.4	Very high	40 Å²	40	37 Å²	37	24%	0.242	18%	0.181	C	C	.	.			trans	-75.1	98	178.9	-178.9	0	0	0	0	108.3	Y70 E74 D75 F76	Y70-V72 PolarHBondContact O-N 3.05Å; V72-E74 VanDerWaalsContact C-N 3.26Å; V72-E74 PolarHBondContact O-N 2.59Å; V72-D75 HydrophobicContact CB-CB 4.32Å; V72-D75 HydrophobicContact CG1-CB 4.27Å; V72-D75 WeakPolarHBondContact O-CB 3.48Å; V72-D75 PolarHBondContact O-N 3.12Å; V72-D75 VanDerWaalsContact O-N 3.14Å; V72-F76 VanDerWaalsContact O-CD2 3.28Å; V72-F76 WeakPolarHBondContact O-CD2 3.44Å
73	F	94.8	Very high	95.4	Very high	37 Å²	37	39.2 Å²	39.2	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-39.8	-171.4	175.8	-107.6	0	0	0	112.9	P71 D75 F76 V77 D84 T88 W89 L92	P71-F73 PolarHBondContact O-N 2.96Å; F73-D75 VanDerWaalsContact C-N 3.27Å; F73-D75 PolarHBondContact O-N 2.86Å; F73-F76 WeakPolarHBondContact O-CB 3.35Å; F73-F76 PolarHBondContact O-N 3.13Å; F73-F76 VanDerWaalsContact O-N 3.11Å; F73-V77 HydrophobicContact CD1-CG2 4.04Å; F73-V77 HydrophobicContact CD2-CG2 4.48Å; F73-V77 HydrophobicContact CE1-CG2 3.54Å; F73-V77 HydrophobicContact CE2-CG2 4.02Å; F73-V77 HydrophobicContact CG-CG2 4.49Å; F73-V77 HydrophobicContact CZ-CG2 3.53Å; F73-V77 PolarHBondContact O-N 3.03Å; F73-V77 VanDerWaalsContact O-N 3.09Å; F73-D84 WeakPolarHBondContact CE1-OD1 3.23Å; F73-T88 HydrophobicContact CE2-CG2 3.89Å; F73-T88 HydrophobicContact CZ-CG2 4.01Å; F73-W89 HydrophobicContact CD2-CB 4.36Å; F73-W89 HydrophobicContact CE2-CB 3.78Å; F73-W89 HydrophobicContact CZ-CB 4.05Å; F73-L92 HydrophobicContact CD2-CD1 3.9Å; F73-L92 HydrophobicContact CE2-CD1 3.86Å
74	E	94.9	Very high	95.4	Very high	121 Å²	121	45.3 Å²	45.3	57%	0.565	23%	0.23	S	C	*	.	H	α-helix	trans	-60	-37.1	-179.7	-63.5	74.9	-165.6	0	0	112	V72 F76 V77 Q78	V72-E74 VanDerWaalsContact C-N 3.26Å; V72-E74 PolarHBondContact O-N 2.59Å; E74-F76 VanDerWaalsContact C-N 3.32Å; E74-F76 PolarHBondContact O-N 3.39Å; E74-V77 PolarHBondContact O-N 3.08Å; E74-Q78 WeakPolarHBondContact O-CB 3.46Å; E74-Q78 PolarHBondContact O-N 3.31Å
75	D	95.2	Very high	95.2	Very high	56 Å²	56	47.7 Å²	47.7	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-41.6	177.8	-72.2	-12.1	0	0	0	110.7	V72 F73 H79	V72-D75 HydrophobicContact CB-CB 4.32Å; V72-D75 HydrophobicContact CG1-CB 4.27Å; V72-D75 WeakPolarHBondContact O-CB 3.48Å; V72-D75 PolarHBondContact O-N 3.12Å; V72-D75 VanDerWaalsContact O-N 3.14Å; F73-D75 VanDerWaalsContact C-N 3.27Å; F73-D75 PolarHBondContact O-N 2.86Å; D75-H79 WeakPolarHBondContact O-CB 3.37Å; D75-H79 PolarHBondContact O-N 3.27Å; D75-H79 PolarHBondContact O-ND1 3.14Å
76	F	97.1	Very high	95	Very high	5 Å²	5	47.1 Å²	47.1	2%	0.022	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-47	177	-69.9	-100.4	0	0	0	111	P71 V72 F73 E74 Q78 L80 L92 H96 L192 Y195 L222	P71-F76 HydrophobicContact CB-CE2 3.87Å; P71-F76 HydrophobicContact CB-CZ 4.37Å; V72-F76 VanDerWaalsContact O-CD2 3.28Å; V72-F76 WeakPolarHBondContact O-CD2 3.44Å; F73-F76 WeakPolarHBondContact O-CB 3.35Å; F73-F76 PolarHBondContact O-N 3.13Å; F73-F76 VanDerWaalsContact O-N 3.11Å; E74-F76 VanDerWaalsContact C-N 3.32Å; E74-F76 PolarHBondContact O-N 3.39Å; F76-Q78 VanDerWaalsContact C-N 3.31Å; F76-Q78 PolarHBondContact O-N 3.36Å; F76-L80 HydrophobicContact CB-CD1 4.23Å; F76-L80 HydrophobicContact CD1-CD1 3.82Å; F76-L80 WeakPolarHBondContact O-CA 3.41Å; F76-L80 WeakPolarHBondContact O-CB 3.29Å; F76-L80 WeakPolarHBondContact O-CG 3.24Å; F76-L80 PolarHBondContact O-N 2.97Å; F76-L92 HydrophobicContact CB-CD1 3.44Å; F76-L92 VanDerWaalsContact CB-CD1 3.44Å; F76-L92 HydrophobicContact CB-CD2 4.39Å; F76-L92 HydrophobicContact CD1-CD1 4.14Å; F76-L92 HydrophobicContact CD1-CD2 3.69Å; F76-L92 HydrophobicContact CE1-CD2 4.33Å; F76-L92 HydrophobicContact CG-CD1 3.82Å; F76-L92 HydrophobicContact CG-CD2 4.24Å; F76-H96 AromaticContact CZ-CE1 3.95Å; F76-H96 AromaticContact CZ-NE2 3.86Å; F76-L192 HydrophobicContact CE1-CD1 4.39Å; F76-Y195 HydrophobicContact CE1-CD1 4.06Å; F76-Y195 AromaticContact CE1-CE1 3.74Å; F76-Y195 HydrophobicContact CE1-CE1 3.74Å; F76-Y195 HydrophobicContact CE1-CE2 4.5Å; F76-Y195 AromaticContact CE1-CZ 4Å; F76-Y195 HydrophobicContact CZ-CD1 4.41Å; F76-Y195 AromaticContact CZ-CE1 3.76Å; F76-Y195 HydrophobicContact CZ-CE1 3.76Å; F76-Y195 AromaticContact CZ-CE2 3.98Å; F76-Y195 HydrophobicContact CZ-CE2 3.98Å; F76-Y195 AromaticContact CZ-CZ 3.52Å; F76-L222 HydrophobicContact CD1-CD1 4.18Å; F76-L222 HydrophobicContact CD1-CD2 4.08Å; F76-L222 HydrophobicContact CD2-CD2 4.5Å; F76-L222 HydrophobicContact CE1-CD1 3.79Å; F76-L222 HydrophobicContact CE1-CD2 4.39Å; F76-L222 HydrophobicContact CE1-CG 4.49Å; F76-L222 HydrophobicContact CE2-CB 4.38Å; F76-L222 HydrophobicContact CG-CD2 4.13Å; F76-L222 HydrophobicContact CZ-CB 4.27Å; F76-L222 HydrophobicContact CZ-CD1 4.2Å
77	V	97	Very high	94.9	Very high	26 Å²	26	49.3 Å²	49.3	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-48.6	177.4	170.6	0	0	0	0	110.6	F73 E74 K81 L82 D84 T88	F73-V77 HydrophobicContact CD1-CG2 4.04Å; F73-V77 HydrophobicContact CD2-CG2 4.48Å; F73-V77 HydrophobicContact CE1-CG2 3.54Å; F73-V77 HydrophobicContact CE2-CG2 4.02Å; F73-V77 HydrophobicContact CG-CG2 4.49Å; F73-V77 HydrophobicContact CZ-CG2 3.53Å; F73-V77 PolarHBondContact O-N 3.03Å; F73-V77 VanDerWaalsContact O-N 3.09Å; E74-V77 PolarHBondContact O-N 3.08Å; V77-K81 WeakPolarHBondContact O-CA 3.37Å; V77-K81 PolarHBondContact O-N 3.14Å; V77-K81 VanDerWaalsContact O-N 3.12Å; V77-L82 WeakPolarHBondContact CG1-O 3.49Å; V77-L82 PolarHBondContact O-N 3.37Å; V77-L82 VanDerWaalsContact O-N 3.14Å; V77-D84 HydrophobicContact CG1-CB 4.22Å; V77-T88 HydrophobicContact CG2-CG2 4.39Å
78	Q	96.5	Very high	94.8	Very high	124 Å²	124	49.5 Å²	49.5	58%	0.579	25%	0.252	S	S	*	.	H	α-helix	trans	-69.4	-47.4	-176.3	-175.8	179.5	-0.3	0	0	113.7	E74 F76 K81	E74-Q78 WeakPolarHBondContact O-CB 3.46Å; E74-Q78 PolarHBondContact O-N 3.31Å; F76-Q78 VanDerWaalsContact C-N 3.31Å; F76-Q78 PolarHBondContact O-N 3.36Å; Q78-K81 WeakPolarHBondContact O-CD 3.27Å; Q78-K81 PolarHBondContact O-NZ 3.29Å
79	H	96.2	Very high	94.9	Very high	67 Å²	67	50.1 Å²	50.1	31%	0.31	25%	0.253	S	S	.	.	H	α-helix	trans	-79.8	-35.1	-174	-68	86.1	0	0	0	112.2	D75 L222	D75-H79 WeakPolarHBondContact O-CB 3.37Å; D75-H79 PolarHBondContact O-N 3.27Å; D75-H79 PolarHBondContact O-ND1 3.14Å; H79-L222 HydrophobicContact CB-CD2 3.93Å
80	L	96.9	Very high	95	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-91.9	-2.3	-179.1	-54.1	-178.6	0	0	0	113.3	F76 L82 W178 Q188 I191 L192	F76-L80 HydrophobicContact CB-CD1 4.23Å; F76-L80 HydrophobicContact CD1-CD1 3.82Å; F76-L80 WeakPolarHBondContact O-CA 3.41Å; F76-L80 WeakPolarHBondContact O-CB 3.29Å; F76-L80 WeakPolarHBondContact O-CG 3.24Å; F76-L80 PolarHBondContact O-N 2.97Å; L80-L82 HydrophobicContact CB-CD1 3.8Å; L80-L82 HydrophobicContact CB-CG 3.77Å; L80-L82 HydrophobicContact CD1-CD1 3.89Å; L80-L82 HydrophobicContact CG-CD1 4.47Å; L80-L82 PolarHBondContact O-N 3.07Å; L80-W178 HydrophobicContact CB-CZ2 3.87Å; L80-W178 HydrophobicContact CD1-CZ2 4.43Å; L80-W178 HydrophobicContact CD2-CH2 4.45Å; L80-W178 HydrophobicContact CD2-CZ2 4.15Å; L80-W178 HydrophobicContact CG-CZ2 4.38Å; L80-W178 PolarHBondContact O-NE1 2.52Å; L80-Q188 WeakPolarHBondContact CD2-O 3.29Å; L80-I191 HydrophobicContact CD2-CB 4.14Å; L80-I191 HydrophobicContact CD2-CG2 3.89Å; L80-L192 HydrophobicContact CD1-CD1 4.08Å; L80-L192 HydrophobicContact CD1-CD2 4.42Å; L80-L192 HydrophobicContact CD2-CB 4.35Å
81	K	96.3	Very high	95.1	Very high	143 Å²	143	48.6 Å²	48.6	62%	0.622	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	40.7	-176.4	-54.4	-58.4	178.2	-157.9	0	112.5	V77 Q78	V77-K81 WeakPolarHBondContact O-CA 3.37Å; V77-K81 PolarHBondContact O-N 3.14Å; V77-K81 VanDerWaalsContact O-N 3.12Å; Q78-K81 WeakPolarHBondContact O-CD 3.27Å; Q78-K81 PolarHBondContact O-NZ 3.29Å
82	L	96.2	Very high	95.3	Very high	11 Å²	11	48.2 Å²	48.2	6%	0.058	24%	0.243	C	C	.	.			trans	-84.1	150.9	176	-60.7	168.4	0	0	0	109.4	V77 L80 T88 L92 I177 W178	V77-L82 WeakPolarHBondContact CG1-O 3.49Å; V77-L82 PolarHBondContact O-N 3.37Å; V77-L82 VanDerWaalsContact O-N 3.14Å; L80-L82 HydrophobicContact CB-CD1 3.8Å; L80-L82 HydrophobicContact CB-CG 3.77Å; L80-L82 HydrophobicContact CD1-CD1 3.89Å; L80-L82 HydrophobicContact CG-CD1 4.47Å; L80-L82 PolarHBondContact O-N 3.07Å; L82-T88 HydrophobicContact CB-CG2 3.58Å; L82-T88 HydrophobicContact CD1-CG2 3.84Å; L82-T88 HydrophobicContact CG-CG2 4.26Å; L82-L92 HydrophobicContact CD1-CD1 4.33Å; L82-L92 HydrophobicContact CD1-CD2 4.4Å; L82-I177 HydrophobicContact CD1-CG2 3.7Å; L82-I177 HydrophobicContact CD2-CG2 3.8Å; L82-I177 HydrophobicContact CG-CG2 4.4Å; L82-W178 HydrophobicContact CD2-CD2 4.21Å; L82-W178 HydrophobicContact CD2-CG 4Å
83	P	95.5	Very high	95.5	Very high	80 Å²	80	46.5 Å²	46.5	52%	0.519	23%	0.233	S	C	.	.			trans	-72.6	141.7	173.7	32	-35	0	0	0	109.8	T85 T88	P83-T85 HydrophobicContact CB-CG2 4.01Å; P83-T85 HydrophobicContact CG-CG2 4.32Å; P83-T85 PolarHBondContact O-N 3.3Å; P83-T88 VanDerWaalsContact O-CB 3.23Å; P83-T88 WeakPolarHBondContact O-CB 3.27Å; P83-T88 PolarHBondContact O-OG1 2.92Å
84	D	94.4	Very high	95.6	Very high	129 Å²	129	44.7 Å²	44.7	69%	0.69	23%	0.225	S	C	*	.	S	Bend	trans	-74.1	90.2	174.3	-177	4.5	0	0	0	109.8	F73 V77	F73-D84 WeakPolarHBondContact CE1-OD1 3.23Å; V77-D84 HydrophobicContact CG1-CB 4.22Å
85	T	92.9	Very high	95.7	Very high	59 Å²	59	39 Å²	39	36%	0.362	20%	0.198	S	C	.	.	S	Bend	trans	-142.4	159.2	-177.4	70.6	0	0	0	0	111.8	P83 Q87 T88 W89	P83-T85 HydrophobicContact CB-CG2 4.01Å; P83-T85 HydrophobicContact CG-CG2 4.32Å; P83-T85 PolarHBondContact O-N 3.3Å; T85-Q87 PolarHBondContact O-N 3.34Å; T85-Q87 PolarHBondContact OG1-N 3.34Å; T85-T88 WeakPolarHBondContact O-CB 3.39Å; T85-T88 PolarHBondContact O-N 3.39Å; T85-T88 VanDerWaalsContact O-N 3.08Å; T85-T88 PolarHBondContact OG1-N 2.92Å; T85-T88 PolarHBondContact OG1-OG1 3.06Å; T85-T88 VanDerWaalsContact OG1-OG1 3.09Å; T85-W89 PolarHBondContact O-N 3.3Å
86	F	90.8	Very high	95.9	Very high	33 Å²	33	36.4 Å²	36.4	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-55.3	-34.1	169.9	-178.9	-105.7	0	0	0	113.1	W89 F90 M126 R129 V130 F133 F146	F86-W89 AromaticContact CD2-CE3 3.69Å; F86-W89 HydrophobicContact CD2-CE3 3.69Å; F86-W89 HydrophobicContact CD2-CZ3 4.09Å; F86-W89 AromaticContact CE2-CE3 3.42Å; F86-W89 HydrophobicContact CE2-CE3 3.42Å; F86-W89 VanDerWaalsContact CE2-CE3 3.42Å; F86-W89 HydrophobicContact CE2-CH2 4.34Å; F86-W89 AromaticContact CE2-CZ3 3.31Å; F86-W89 HydrophobicContact CE2-CZ3 3.31Å; F86-W89 HydrophobicContact CZ-CE3 4.1Å; F86-W89 AromaticContact CZ-CZ3 3.75Å; F86-W89 HydrophobicContact CZ-CZ3 3.75Å; F86-W89 PolarHBondContact O-N 2.95Å; F86-F90 WeakPolarHBondContact O-CB 3.5Å; F86-F90 PolarHBondContact O-N 3.47Å; F86-M126 HydrophobicContact CE1-CE 3.87Å; F86-M126 HydrophobicContact CE1-SD 4.34Å; F86-M126 HydrophobicContact CZ-CE 3.72Å; F86-M126 HydrophobicContact CZ-SD 3.62Å; F86-R129 HydrophobicContact CE2-CB 3.63Å; F86-R129 HydrophobicContact CE2-CG 4.32Å; F86-R129 HydrophobicContact CZ-CB 4.04Å; F86-V130 HydrophobicContact CE1-CG2 4.39Å; F86-V130 HydrophobicContact CZ-CG2 4.47Å; F86-F133 HydrophobicContact CB-CD2 4.46Å; F86-F133 HydrophobicContact CB-CE2 3.9Å; F86-F133 HydrophobicContact CB-CZ 4.01Å; F86-F133 HydrophobicContact CD2-CD2 4.11Å; F86-F133 AromaticContact CD2-CE2 3.47Å; F86-F133 HydrophobicContact CD2-CE2 3.47Å; F86-F133 VanDerWaalsContact CD2-CE2 3.47Å; F86-F133 HydrophobicContact CD2-CZ 4.24Å; F86-F133 HydrophobicContact CE2-CE2 4.19Å; F86-F133 HydrophobicContact CG-CD2 4.23Å; F86-F133 AromaticContact CG-CE2 3.82Å; F86-F133 HydrophobicContact CG-CE2 3.82Å; F86-F133 HydrophobicContact CG-CZ 4.43Å; F86-F146 HydrophobicContact CD1-CE1 4.39Å; F86-F146 HydrophobicContact CD1-CE2 4.29Å; F86-F146 AromaticContact CD1-CZ 3.72Å; F86-F146 HydrophobicContact CD1-CZ 3.72Å; F86-F146 HydrophobicContact CE1-CE1 4.12Å; F86-F146 AromaticContact CE1-CE2 3.79Å; F86-F146 HydrophobicContact CE1-CE2 3.79Å; F86-F146 AromaticContact CE1-CZ 3.53Å; F86-F146 HydrophobicContact CE1-CZ 3.53Å
87	Q	92.3	Very high	95.9	Very high	48 Å²	48	36.2 Å²	36.2	22%	0.224	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-41.2	177.4	-178	65.5	67	0	0	111.3	T85 F90 S91 F179	T85-Q87 PolarHBondContact O-N 3.34Å; T85-Q87 PolarHBondContact OG1-N 3.34Å; Q87-F90 PolarHBondContact O-N 3.39Å; Q87-S91 WeakPolarHBondContact O-CB 3.25Å; Q87-S91 PolarHBondContact O-N 3.08Å; Q87-S91 PolarHBondContact O-OG 3.28Å; Q87-F179 HydrophobicContact CG-CE1 4.32Å; Q87-F179 HydrophobicContact CG-CE2 3.67Å; Q87-F179 HydrophobicContact CG-CZ 3.38Å
88	T	95.4	Very high	96	Very high	4 Å²	4	35 Å²	35	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-46.6	175.4	-55.3	0	0	0	0	111	F73 V77 L82 P83 T85 F90 S91 L92	F73-T88 HydrophobicContact CE2-CG2 3.89Å; F73-T88 HydrophobicContact CZ-CG2 4.01Å; V77-T88 HydrophobicContact CG2-CG2 4.39Å; L82-T88 HydrophobicContact CB-CG2 3.58Å; L82-T88 HydrophobicContact CD1-CG2 3.84Å; L82-T88 HydrophobicContact CG-CG2 4.26Å; P83-T88 VanDerWaalsContact O-CB 3.23Å; P83-T88 WeakPolarHBondContact O-CB 3.27Å; P83-T88 PolarHBondContact O-OG1 2.92Å; T85-T88 WeakPolarHBondContact O-CB 3.39Å; T85-T88 PolarHBondContact O-N 3.39Å; T85-T88 VanDerWaalsContact O-N 3.08Å; T85-T88 PolarHBondContact OG1-N 2.92Å; T85-T88 PolarHBondContact OG1-OG1 3.06Å; T85-T88 VanDerWaalsContact OG1-OG1 3.09Å; T88-F90 VanDerWaalsContact C-N 3.3Å; T88-F90 PolarHBondContact O-N 3.39Å; T88-S91 PolarHBondContact O-N 3.24Å; T88-L92 HydrophobicContact CG2-CD1 4.14Å; T88-L92 WeakPolarHBondContact O-CG 3.28Å; T88-L92 PolarHBondContact O-N 2.99Å
89	W	95.2	Very high	96	Very high	22 Å²	22	29.1 Å²	29.1	8%	0.083	15%	0.148	C	C	.	.	H	α-helix	trans	-56.2	-46	174.1	169.4	84.2	0	0	0	111.3	A68 F73 T85 F86 T93 M126 R129	A68-W89 HydrophobicContact CB-CZ2 4.03Å; A68-W89 PolarHBondContact O-NE1 3.21Å; F73-W89 HydrophobicContact CD2-CB 4.36Å; F73-W89 HydrophobicContact CE2-CB 3.78Å; F73-W89 HydrophobicContact CZ-CB 4.05Å; T85-W89 PolarHBondContact O-N 3.3Å; F86-W89 AromaticContact CD2-CE3 3.69Å; F86-W89 HydrophobicContact CD2-CE3 3.69Å; F86-W89 HydrophobicContact CD2-CZ3 4.09Å; F86-W89 AromaticContact CE2-CE3 3.42Å; F86-W89 HydrophobicContact CE2-CE3 3.42Å; F86-W89 VanDerWaalsContact CE2-CE3 3.42Å; F86-W89 HydrophobicContact CE2-CH2 4.34Å; F86-W89 AromaticContact CE2-CZ3 3.31Å; F86-W89 HydrophobicContact CE2-CZ3 3.31Å; F86-W89 HydrophobicContact CZ-CE3 4.1Å; F86-W89 AromaticContact CZ-CZ3 3.75Å; F86-W89 HydrophobicContact CZ-CZ3 3.75Å; F86-W89 PolarHBondContact O-N 2.95Å; W89-T93 VanDerWaalsContact O-CB 3.28Å; W89-T93 WeakPolarHBondContact O-CB 3.39Å; W89-T93 PolarHBondContact O-N 2.91Å; W89-T93 PolarHBondContact O-OG1 3.25Å; W89-M126 HydrophobicContact CH2-SD 4.42Å; W89-M126 HydrophobicContact CZ3-SD 3.92Å; W89-R129 VanDerWaalsContact CH2-CD 3.45Å
90	F	95.2	Very high	96.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-50.9	178.4	-179.8	-97.5	0	0	0	111.4	F86 Q87 T88 L92 T93 I94 W123 M126 F146 Q149	F86-F90 WeakPolarHBondContact O-CB 3.5Å; F86-F90 PolarHBondContact O-N 3.47Å; Q87-F90 PolarHBondContact O-N 3.39Å; T88-F90 VanDerWaalsContact C-N 3.3Å; T88-F90 PolarHBondContact O-N 3.39Å; F90-L92 VanDerWaalsContact C-N 3.35Å; F90-L92 PolarHBondContact O-N 3.27Å; F90-T93 PolarHBondContact O-N 3.18Å; F90-I94 HydrophobicContact CD1-CG1 4.04Å; F90-I94 HydrophobicContact CD2-CD1 4.38Å; F90-I94 HydrophobicContact CD2-CG1 4.29Å; F90-I94 HydrophobicContact CE1-CD1 4.44Å; F90-I94 HydrophobicContact CE1-CG1 3.65Å; F90-I94 HydrophobicContact CE2-CD1 3.86Å; F90-I94 HydrophobicContact CE2-CG1 3.94Å; F90-I94 HydrophobicContact CG-CG1 4.36Å; F90-I94 HydrophobicContact CZ-CD1 3.9Å; F90-I94 HydrophobicContact CZ-CG1 3.61Å; F90-I94 VanDerWaalsContact O-CG1 3.3Å; F90-I94 WeakPolarHBondContact O-CG1 3.4Å; F90-I94 PolarHBondContact O-N 2.86Å; F90-W123 HydrophobicContact CZ-CH2 4.47Å; F90-M126 HydrophobicContact CD2-CE 3.7Å; F90-M126 HydrophobicContact CD2-SD 3.55Å; F90-M126 VanDerWaalsContact CD2-SD 3.55Å; F90-M126 HydrophobicContact CE2-CE 3.71Å; F90-M126 HydrophobicContact CE2-CG 4.47Å; F90-M126 HydrophobicContact CE2-SD 3.76Å; F90-F146 HydrophobicContact CB-CD1 4.45Å; F90-F146 HydrophobicContact CB-CE1 4.15Å; F90-F146 AromaticContact CD1-CD1 3.51Å; F90-F146 HydrophobicContact CD1-CD1 3.51Å; F90-F146 AromaticContact CD1-CE1 3.89Å; F90-F146 HydrophobicContact CD1-CE1 3.89Å; F90-F146 AromaticContact CD2-CD1 3.97Å; F90-F146 HydrophobicContact CD2-CD1 3.97Å; F90-F146 HydrophobicContact CD2-CE1 4.43Å; F90-F146 HydrophobicContact CE1-CB 4.34Å; F90-F146 AromaticContact CE1-CD1 3.58Å; F90-F146 HydrophobicContact CE1-CD1 3.58Å; F90-F146 HydrophobicContact CE1-CE1 4.41Å; F90-F146 HydrophobicContact CE1-CG 4.44Å; F90-F146 HydrophobicContact CE2-CB 4.19Å; F90-F146 HydrophobicContact CE2-CD1 4.02Å; F90-F146 HydrophobicContact CE2-CG 4.41Å; F90-F146 AromaticContact CG-CD1 3.7Å; F90-F146 HydrophobicContact CG-CD1 3.7Å; F90-F146 AromaticContact CG-CE1 3.89Å; F90-F146 HydrophobicContact CG-CE1 3.89Å; F90-F146 HydrophobicContact CZ-CB 3.89Å; F90-F146 AromaticContact CZ-CD1 3.83Å; F90-F146 HydrophobicContact CZ-CD1 3.83Å; F90-F146 HydrophobicContact CZ-CG 4.3Å; F90-F146 WeakPolarHBondContact CZ-O 3.24Å; F90-Q149 HydrophobicContact CE1-CB 4.24Å
91	S	97	Very high	96.1	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-59.2	-43.2	-179.1	-74.5	0	0	0	0	112.6	Q87 T88 L95 N176 F179	Q87-S91 WeakPolarHBondContact O-CB 3.25Å; Q87-S91 PolarHBondContact O-N 3.08Å; Q87-S91 PolarHBondContact O-OG 3.28Å; T88-S91 PolarHBondContact O-N 3.24Å; S91-L95 PolarHBondContact O-N 3.17Å; S91-L95 VanDerWaalsContact O-N 3.13Å; S91-N176 PolarHBondContact OG-O 3.39Å; S91-N176 VanDerWaalsContact OG-O 3.11Å; S91-F179 WeakPolarHBondContact OG-CZ 3.27Å
92	L	97.7	Very high	96.1	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-68.3	-42.3	175.8	-69.7	174.8	0	0	0	111.8	F73 F76 L82 T88 F90 I94 L95 H96 I177	F73-L92 HydrophobicContact CD2-CD1 3.9Å; F73-L92 HydrophobicContact CE2-CD1 3.86Å; F76-L92 HydrophobicContact CB-CD1 3.44Å; F76-L92 VanDerWaalsContact CB-CD1 3.44Å; F76-L92 HydrophobicContact CB-CD2 4.39Å; F76-L92 HydrophobicContact CD1-CD1 4.14Å; F76-L92 HydrophobicContact CD1-CD2 3.69Å; F76-L92 HydrophobicContact CE1-CD2 4.33Å; F76-L92 HydrophobicContact CG-CD1 3.82Å; F76-L92 HydrophobicContact CG-CD2 4.24Å; L82-L92 HydrophobicContact CD1-CD1 4.33Å; L82-L92 HydrophobicContact CD1-CD2 4.4Å; T88-L92 HydrophobicContact CG2-CD1 4.14Å; T88-L92 WeakPolarHBondContact O-CG 3.28Å; T88-L92 PolarHBondContact O-N 2.99Å; F90-L92 VanDerWaalsContact C-N 3.35Å; F90-L92 PolarHBondContact O-N 3.27Å; L92-I94 VanDerWaalsContact C-N 3.33Å; L92-I94 PolarHBondContact O-N 3.11Å; L92-L95 WeakPolarHBondContact O-CB 3.46Å; L92-L95 PolarHBondContact O-N 3.33Å; L92-H96 PolarHBondContact O-N 2.86Å; L92-H96 VanDerWaalsContact O-N 3.11Å; L92-H96 PolarHBondContact O-ND1 3.34Å; L92-I177 HydrophobicContact CD2-CD1 4.34Å
93	T	97.3	Very high	96.1	Very high	4 Å²	4	21.1 Å²	21.1	3%	0.025	12%	0.115	C	C	.	.	H	α-helix	trans	-58.3	-47.8	175.8	-60.8	0	0	0	0	110.2	F64 A68 W89 F90 L95 H96 I97	F64-T93 HydrophobicContact CE2-CG2 4.4Å; A68-T93 HydrophobicContact CB-CG2 4.02Å; W89-T93 VanDerWaalsContact O-CB 3.28Å; W89-T93 WeakPolarHBondContact O-CB 3.39Å; W89-T93 PolarHBondContact O-N 2.91Å; W89-T93 PolarHBondContact O-OG1 3.25Å; F90-T93 PolarHBondContact O-N 3.18Å; T93-L95 VanDerWaalsContact C-N 3.27Å; T93-L95 PolarHBondContact O-N 2.82Å; T93-H96 PolarHBondContact O-N 2.69Å; T93-H96 VanDerWaalsContact O-N 3.1Å; T93-I97 HydrophobicContact CG2-CD1 3.93Å; T93-I97 HydrophobicContact CG2-CG1 4.22Å; T93-I97 VanDerWaalsContact O-CG1 3.27Å; T93-I97 WeakPolarHBondContact O-CG1 3.37Å; T93-I97 PolarHBondContact O-N 2.73Å
94	I	97.5	Very high	96	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.3	-36.4	178.3	-65.8	-33.3	0	0	0	112.3	F90 L92 I97 W98 L122 Y150 N153 M154	F90-I94 HydrophobicContact CD1-CG1 4.04Å; F90-I94 HydrophobicContact CD2-CD1 4.38Å; F90-I94 HydrophobicContact CD2-CG1 4.29Å; F90-I94 HydrophobicContact CE1-CD1 4.44Å; F90-I94 HydrophobicContact CE1-CG1 3.65Å; F90-I94 HydrophobicContact CE2-CD1 3.86Å; F90-I94 HydrophobicContact CE2-CG1 3.94Å; F90-I94 HydrophobicContact CG-CG1 4.36Å; F90-I94 HydrophobicContact CZ-CD1 3.9Å; F90-I94 HydrophobicContact CZ-CG1 3.61Å; F90-I94 VanDerWaalsContact O-CG1 3.3Å; F90-I94 WeakPolarHBondContact O-CG1 3.4Å; F90-I94 PolarHBondContact O-N 2.86Å; L92-I94 VanDerWaalsContact C-N 3.33Å; L92-I94 PolarHBondContact O-N 3.11Å; I94-I97 HydrophobicContact CD1-CD1 4.04Å; I94-I97 PolarHBondContact O-N 3.31Å; I94-W98 WeakPolarHBondContact O-CB 3.27Å; I94-W98 PolarHBondContact O-N 3.43Å; I94-L122 HydrophobicContact CD1-CD1 4.26Å; I94-L122 HydrophobicContact CD1-CD2 3.81Å; I94-Y150 HydrophobicContact CD1-CD2 3.6Å; I94-Y150 HydrophobicContact CD1-CE2 4.19Å; I94-Y150 HydrophobicContact CG1-CD2 4.21Å; I94-Y150 HydrophobicContact CG2-CD2 4.38Å; I94-N153 HydrophobicContact CG2-CB 3.82Å; I94-M154 HydrophobicContact CG2-CE 3.73Å
95	L	98.2	Very high	95.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.1	-45.6	174.2	-178.1	64	0	0	0	111.8	S91 L92 T93 W98 M99 Y157 L173 I177 L192 V196	S91-L95 PolarHBondContact O-N 3.17Å; S91-L95 VanDerWaalsContact O-N 3.13Å; L92-L95 WeakPolarHBondContact O-CB 3.46Å; L92-L95 PolarHBondContact O-N 3.33Å; T93-L95 VanDerWaalsContact C-N 3.27Å; T93-L95 PolarHBondContact O-N 2.82Å; L95-W98 HydrophobicContact CD1-CE3 4.16Å; L95-W98 PolarHBondContact O-N 3.11Å; L95-M99 HydrophobicContact CG-CE 4.48Å; L95-M99 WeakPolarHBondContact O-CG 3.5Å; L95-M99 PolarHBondContact O-N 2.87Å; L95-M99 VanDerWaalsContact O-N 3.08Å; L95-Y157 HydrophobicContact CB-CE2 4.46Å; L95-Y157 HydrophobicContact CD1-CD2 4.27Å; L95-Y157 HydrophobicContact CD1-CE1 4.36Å; L95-Y157 HydrophobicContact CD1-CE2 3.85Å; L95-L173 HydrophobicContact CD1-CD2 3.73Å; L95-L173 HydrophobicContact CD2-CD2 4.16Å; L95-I177 HydrophobicContact CD2-CD1 4.39Å; L95-L192 HydrophobicContact CD2-CD1 3.91Å; L95-L192 HydrophobicContact CD2-CD2 4.24Å; L95-L192 HydrophobicContact CD2-CG 4.34Å; L95-V196 HydrophobicContact CD1-CG2 4.07Å; L95-V196 HydrophobicContact CD2-CG2 4.02Å; L95-V196 HydrophobicContact CG-CG2 4.36Å
96	H	98.1	Very high	95.8	Very high	3 Å²	3	16.4 Å²	16.4	1%	0.014	7%	0.074	C	C	.	.	H	α-helix	trans	-65	-41.4	176.2	-64.8	96.9	0	0	0	112.4	C67 P71 F76 L92 T93 W98 M99 C100 Y195 F219	C67-H96 HydrophobicContact CB-CB 3.93Å; P71-H96 WeakPolarHBondContact CG-NE2 3.5Å; F76-H96 AromaticContact CZ-CE1 3.95Å; F76-H96 AromaticContact CZ-NE2 3.86Å; L92-H96 PolarHBondContact O-N 2.86Å; L92-H96 VanDerWaalsContact O-N 3.11Å; L92-H96 PolarHBondContact O-ND1 3.34Å; T93-H96 PolarHBondContact O-N 2.69Å; T93-H96 VanDerWaalsContact O-N 3.1Å; H96-W98 VanDerWaalsContact C-N 3.32Å; H96-W98 PolarHBondContact O-N 3.38Å; H96-M99 HydrophobicContact CB-CE 4.36Å; H96-M99 VanDerWaalsContact CD2-CE 3.5Å; H96-M99 WeakPolarHBondContact CD2-CE 3.29Å; H96-M99 PolarHBondContact O-N 2.91Å; H96-C100 PolarHBondContact O-N 3.02Å; H96-Y195 PolarHBondContact CD2-OH 2.89Å; H96-Y195 AromaticContact NE2-CE1 3.53Å; H96-Y195 AromaticContact NE2-CZ 3.5Å; H96-Y195 PolarHBondContact NE2-OH 3.02Å; H96-F219 HydrophobicContact CB-CE1 4.32Å; H96-F219 HydrophobicContact CB-CZ 3.97Å; H96-F219 AromaticContact CD2-CD1 3.9Å; H96-F219 AromaticContact CD2-CE1 3.72Å
97	I	98	Very high	95.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.7	-45.6	174.4	-66.6	-174.3	0	0	0	110.7	F64 C67 T93 I94 M99 C100 Y101 M118 L122 M154	F64-I97 HydrophobicContact CD2-CD1 4.11Å; C67-I97 HydrophobicContact CB-CG1 3.8Å; T93-I97 HydrophobicContact CG2-CD1 3.93Å; T93-I97 HydrophobicContact CG2-CG1 4.22Å; T93-I97 VanDerWaalsContact O-CG1 3.27Å; T93-I97 WeakPolarHBondContact O-CG1 3.37Å; T93-I97 PolarHBondContact O-N 2.73Å; I94-I97 HydrophobicContact CD1-CD1 4.04Å; I94-I97 PolarHBondContact O-N 3.31Å; I97-M99 PolarHBondContact O-N 3.42Å; I97-C100 WeakPolarHBondContact O-CB 3.46Å; I97-C100 PolarHBondContact O-N 3.46Å; I97-Y101 HydrophobicContact CG2-CD1 4.34Å; I97-Y101 HydrophobicContact CG2-CD2 4.17Å; I97-Y101 HydrophobicContact CG2-CE1 3.75Å; I97-Y101 HydrophobicContact CG2-CE2 3.52Å; I97-Y101 WeakPolarHBondContact CG2-OH 3.47Å; I97-Y101 PolarHBondContact O-N 3.4Å; I97-M118 HydrophobicContact CB-CE 3.82Å; I97-M118 HydrophobicContact CD1-CE 4.29Å; I97-M118 HydrophobicContact CG1-CE 3.54Å; I97-M118 HydrophobicContact CG2-CE 3.7Å; I97-L122 HydrophobicContact CD1-CD1 4.17Å; I97-L122 HydrophobicContact CD1-CD2 3.96Å; I97-L122 HydrophobicContact CD1-CG 4.44Å; I97-M154 HydrophobicContact CB-CE 4.32Å; I97-M154 HydrophobicContact CG2-CE 3.76Å
98	W	98.2	Very high	95.7	Very high	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-60.1	-45.8	177.7	169.7	79	0	0	0	111.7	I94 L95 H96 C100 Y101 V102 M154 Y157 D158 L161 V196 L200	I94-W98 WeakPolarHBondContact O-CB 3.27Å; I94-W98 PolarHBondContact O-N 3.43Å; L95-W98 HydrophobicContact CD1-CE3 4.16Å; L95-W98 PolarHBondContact O-N 3.11Å; H96-W98 VanDerWaalsContact C-N 3.32Å; H96-W98 PolarHBondContact O-N 3.38Å; W98-C100 VanDerWaalsContact C-N 3.3Å; W98-C100 PolarHBondContact O-N 3.09Å; W98-Y101 WeakPolarHBondContact O-CA 3.48Å; W98-Y101 WeakPolarHBondContact O-CB 3.4Å; W98-Y101 PolarHBondContact O-N 3.08Å; W98-V102 HydrophobicContact CD2-CG2 4.06Å; W98-V102 HydrophobicContact CH2-CG2 4.28Å; W98-V102 HydrophobicContact CZ2-CG2 3.69Å; W98-V102 WeakPolarHBondContact O-CG2 3.43Å; W98-V102 PolarHBondContact O-N 2.91Å; W98-M154 HydrophobicContact CB-CE 4.08Å; W98-M154 HydrophobicContact CB-SD 3.72Å; W98-M154 HydrophobicContact CG-SD 4.21Å; W98-Y157 HydrophobicContact CB-CD2 3.9Å; W98-Y157 AromaticContact CD2-CD2 3.9Å; W98-Y157 HydrophobicContact CD2-CD2 3.9Å; W98-Y157 HydrophobicContact CD2-CG 4.1Å; W98-Y157 HydrophobicContact CE3-CD2 4.27Å; W98-Y157 HydrophobicContact CE3-CG 4.43Å; W98-Y157 AromaticContact CG-CD2 3.7Å; W98-Y157 HydrophobicContact CG-CD2 3.7Å; W98-Y157 HydrophobicContact CG-CG 4.27Å; W98-Y157 WeakPolarHBondContact CZ2-O 3.4Å; W98-D158 PolarHBondContact NE1-OD1 2.99Å; W98-L161 HydrophobicContact CH2-CB 4.34Å; W98-L161 HydrophobicContact CH2-CD2 4.27Å; W98-L161 HydrophobicContact CZ2-CB 3.97Å; W98-L161 HydrophobicContact CZ2-CD2 3.86Å; W98-L161 HydrophobicContact CZ2-CG 4.45Å; W98-V196 HydrophobicContact CH2-CG1 4.4Å; W98-V196 HydrophobicContact CZ3-CG1 3.84Å; W98-L200 HydrophobicContact CH2-CD1 3.97Å; W98-L200 HydrophobicContact CH2-CD2 4.47Å; W98-L200 HydrophobicContact CZ3-CD1 4.2Å; W98-L200 HydrophobicContact CZ3-CD2 4.33Å
99	M	97.7	Very high	95.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.3	-41.7	176.7	-67	-173.2	-70	0	0	111.8	L95 H96 I97 Y101 V102 R103 Y195 V196 Q199 L200 L203 F219	L95-M99 HydrophobicContact CG-CE 4.48Å; L95-M99 WeakPolarHBondContact O-CG 3.5Å; L95-M99 PolarHBondContact O-N 2.87Å; L95-M99 VanDerWaalsContact O-N 3.08Å; H96-M99 HydrophobicContact CB-CE 4.36Å; H96-M99 VanDerWaalsContact CD2-CE 3.5Å; H96-M99 WeakPolarHBondContact CD2-CE 3.29Å; H96-M99 PolarHBondContact O-N 2.91Å; I97-M99 PolarHBondContact O-N 3.42Å; M99-Y101 VanDerWaalsContact C-N 3.32Å; M99-Y101 PolarHBondContact O-N 3.12Å; M99-V102 PolarHBondContact O-N 3.42Å; M99-R103 PolarHBondContact O-N 3.03Å; M99-Y195 HydrophobicContact CE-CE1 3.98Å; M99-V196 HydrophobicContact SD-CG1 4.35Å; M99-V196 HydrophobicContact SD-CG2 4.42Å; M99-Q199 HydrophobicContact CE-CB 4.17Å; M99-Q199 HydrophobicContact CE-CG 4.34Å; M99-Q199 HydrophobicContact SD-CB 3.55Å; M99-Q199 VanDerWaalsContact SD-CB 3.55Å; M99-Q199 HydrophobicContact SD-CG 4.26Å; M99-L200 HydrophobicContact CB-CD2 4.03Å; M99-L200 HydrophobicContact CG-CD2 3.94Å; M99-L200 HydrophobicContact CG-CG 4.36Å; M99-L203 HydrophobicContact CB-CD1 3.86Å; M99-F219 HydrophobicContact CE-CE1 4.16Å
100	C	97.5	Very high	95.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.1	-37.2	172	-76.1	0	0	0	0	112.5	H96 I97 W98 R103 L104 M118 F211	H96-C100 PolarHBondContact O-N 3.02Å; I97-C100 WeakPolarHBondContact O-CB 3.46Å; I97-C100 PolarHBondContact O-N 3.46Å; W98-C100 VanDerWaalsContact C-N 3.3Å; W98-C100 PolarHBondContact O-N 3.09Å; C100-R103 PolarHBondContact O-N 2.72Å; C100-L104 WeakPolarHBondContact O-CB 3.28Å; C100-L104 VanDerWaalsContact O-CG 3.28Å; C100-L104 WeakPolarHBondContact O-CG 3.42Å; C100-L104 PolarHBondContact O-N 2.94Å; C100-M118 HydrophobicContact CB-CE 4.16Å; C100-F211 HydrophobicContact CB-CE1 4.31Å
101	Y	97	Very high	95.2	Very high	7 Å²	7	16.8 Å²	16.8	3%	0.027	9%	0.087	C	C	.	.	H	α-helix	trans	-67.2	-42	175.1	-68.9	-10.5	0	0	0	113.2	I97 W98 M99 R103 L104 R105 K115 M118 D119 Y150 M154	I97-Y101 HydrophobicContact CG2-CD1 4.34Å; I97-Y101 HydrophobicContact CG2-CD2 4.17Å; I97-Y101 HydrophobicContact CG2-CE1 3.75Å; I97-Y101 HydrophobicContact CG2-CE2 3.52Å; I97-Y101 WeakPolarHBondContact CG2-OH 3.47Å; I97-Y101 PolarHBondContact O-N 3.4Å; W98-Y101 WeakPolarHBondContact O-CA 3.48Å; W98-Y101 WeakPolarHBondContact O-CB 3.4Å; W98-Y101 PolarHBondContact O-N 3.08Å; M99-Y101 VanDerWaalsContact C-N 3.32Å; M99-Y101 PolarHBondContact O-N 3.12Å; Y101-R103 PolarHBondContact O-N 2.94Å; Y101-L104 HydrophobicContact CD1-CD1 4.18Å; Y101-L104 PolarHBondContact O-N 3.18Å; Y101-L104 VanDerWaalsContact O-N 3.16Å; Y101-R105 WeakPolarHBondContact O-CG 3.48Å; Y101-R105 PolarHBondContact O-N 3.23Å; Y101-R105 VanDerWaalsContact O-N 3.08Å; Y101-K115 HydrophobicContact CD1-CB 4.4Å; Y101-K115 HydrophobicContact CD1-CD 4.3Å; Y101-K115 HydrophobicContact CD1-CG 4.01Å; Y101-K115 HydrophobicContact CE1-CB 4.16Å; Y101-K115 HydrophobicContact CE1-CD 4.29Å; Y101-K115 HydrophobicContact CE1-CG 3.62Å; Y101-K115 HydrophobicContact CE2-CD 4.5Å; Y101-K115 HydrophobicContact CE2-CG 4.42Å; Y101-K115 HydrophobicContact CG-CD 4.41Å; Y101-M118 HydrophobicContact CD1-SD 4.27Å; Y101-M118 HydrophobicContact CE1-CE 4.3Å; Y101-M118 HydrophobicContact CE1-CG 4.41Å; Y101-M118 HydrophobicContact CE1-SD 3.58Å; Y101-M118 VanDerWaalsContact CE1-SD 3.58Å; Y101-D119 VanDerWaalsContact OH-CG 3.22Å; Y101-D119 PolarHBondContact OH-OD1 3.38Å; Y101-Y150 WeakPolarHBondContact CE2-OH 3.11Å; Y101-Y150 PolarHBondContact OH-OH 2.83Å; Y101-M154 HydrophobicContact CD2-CE 4.1Å; Y101-M154 HydrophobicContact CD2-SD 3.71Å; Y101-M154 HydrophobicContact CE2-CE 3.81Å; Y101-M154 HydrophobicContact CE2-SD 3.92Å
102	V	95.9	Very high	95	Very high	37 Å²	37	20.9 Å²	20.9	22%	0.224	11%	0.105	C	C	.	.	H	α-helix	trans	-52.7	-45.8	173.7	-179.8	0	0	0	0	109.4	W98 M99 L161 L200	W98-V102 HydrophobicContact CD2-CG2 4.06Å; W98-V102 HydrophobicContact CH2-CG2 4.28Å; W98-V102 HydrophobicContact CZ2-CG2 3.69Å; W98-V102 WeakPolarHBondContact O-CG2 3.43Å; W98-V102 PolarHBondContact O-N 2.91Å; M99-V102 PolarHBondContact O-N 3.42Å; V102-L161 HydrophobicContact CG1-CD2 3.88Å; V102-L161 HydrophobicContact CG2-CD2 4.04Å; V102-L200 HydrophobicContact CB-CD2 4.01Å; V102-L200 HydrophobicContact CG1-CD2 4.09Å; V102-L200 HydrophobicContact CG2-CD2 4.23Å
103	R	95.3	Very high	94.8	Very high	9 Å²	9	21.5 Å²	21.5	3%	0.034	11%	0.109	C	C	.	.	H	α-helix	trans	-69.2	-39.5	177	177	54.6	-176	74.5	0.1	114.1	M99 C100 Y101 R105 Q106 E107 L203 T206 F211	M99-R103 PolarHBondContact O-N 3.03Å; C100-R103 PolarHBondContact O-N 2.72Å; Y101-R103 PolarHBondContact O-N 2.94Å; R103-R105 VanDerWaalsContact C-N 3.26Å; R103-R105 PolarHBondContact O-N 3.31Å; R103-Q106 WeakPolarHBondContact O-CG 3.36Å; R103-Q106 PolarHBondContact O-N 3.01Å; R103-E107 IonicContact CZ-OE1 2.63Å; R103-E107 VanDerWaalsContact CZ-OE1 3.24Å; R103-E107 IonicContact NH1-OE1 2.89Å; R103-E107 PolarHBondContact NH1-OE1 3.45Å; R103-E107 IonicContact NH2-OE1 3.42Å; R103-E107 PolarHBondContact NH2-OE1 3.36Å; R103-L203 HydrophobicContact CB-CB 4.26Å; R103-L203 WeakPolarHBondContact CD-O 3.46Å; R103-L203 HydrophobicContact CG-CB 4.24Å; R103-L203 PolarHBondContact NE-O 2.91Å; R103-T206 PolarHBondContact NE-O 3.47Å; R103-T206 PolarHBondContact NH2-O 3.21Å; R103-F211 HydrophobicContact CB-CE1 4.28Å; R103-F211 HydrophobicContact CB-CZ 4.06Å; R103-F211 HydrophobicContact CG-CD1 4.38Å; R103-F211 HydrophobicContact CG-CD2 4.09Å; R103-F211 HydrophobicContact CG-CE1 3.83Å; R103-F211 HydrophobicContact CG-CE2 3.49Å; R103-F211 VanDerWaalsContact CG-CE2 3.49Å; R103-F211 HydrophobicContact CG-CG 4.48Å; R103-F211 HydrophobicContact CG-CZ 3.35Å
104	L	94.7	Very high	94.8	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-69	-21.6	-179.9	-77.5	168.6	0	0	0	113.2	L63 C100 Y101 Q106 E107 V114 F211	L63-L104 HydrophobicContact CD1-CD1 4.33Å; C100-L104 WeakPolarHBondContact O-CB 3.28Å; C100-L104 VanDerWaalsContact O-CG 3.28Å; C100-L104 WeakPolarHBondContact O-CG 3.42Å; C100-L104 PolarHBondContact O-N 2.94Å; Y101-L104 HydrophobicContact CD1-CD1 4.18Å; Y101-L104 PolarHBondContact O-N 3.18Å; Y101-L104 VanDerWaalsContact O-N 3.16Å; L104-Q106 PolarHBondContact O-N 2.75Å; L104-Q106 VanDerWaalsContact O-N 3.14Å; L104-E107 HydrophobicContact CD2-CG 4.43Å; L104-E107 WeakPolarHBondContact O-CB 3.38Å; L104-E107 PolarHBondContact O-N 3.49Å; L104-V114 HydrophobicContact CD1-CG1 3.94Å; L104-V114 HydrophobicContact CD2-CB 4.23Å; L104-V114 HydrophobicContact CD2-CG1 3.88Å; L104-F211 HydrophobicContact CD2-CB 4.01Å; L104-F211 HydrophobicContact CD2-CD1 3.87Å; L104-F211 HydrophobicContact CD2-CG 4.33Å; L104-F211 HydrophobicContact CG-CD1 4.05Å
105	R	92.7	Very high	94.8	Very high	94 Å²	94	24.4 Å²	24.4	36%	0.355	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-58.2	-25.6	177	-73.9	165.4	-167.5	158.9	6.5	113.2	Y101 R103 E107 D158	Y101-R105 WeakPolarHBondContact O-CG 3.48Å; Y101-R105 PolarHBondContact O-N 3.23Å; Y101-R105 VanDerWaalsContact O-N 3.08Å; R103-R105 VanDerWaalsContact C-N 3.26Å; R103-R105 PolarHBondContact O-N 3.31Å; R105-E107 VanDerWaalsContact C-N 3.33Å; R105-D158 IonicContact CZ-OD1 2.76Å; R105-D158 IonicContact CZ-OD2 3.38Å; R105-D158 IonicContact NH1-OD1 2.79Å; R105-D158 PolarHBondContact NH1-OD1 3.4Å; R105-D158 IonicContact NH1-OD2 3.06Å; R105-D158 IonicContact NH2-OD1 3.09Å; R105-D158 PolarHBondContact NH2-OD1 3.04Å; R105-D158 IonicContact NH2-OD2 2.71Å; R105-D158 PolarHBondContact NH2-OD2 3.24Å
106	Q	90.3	Very high	94.7	Very high	71 Å²	71	30.9 Å²	30.9	33%	0.332	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-78.6	-16.1	177.7	85.1	-172.9	22.9	0	0	113.6	R103 L104 G108	R103-Q106 WeakPolarHBondContact O-CG 3.36Å; R103-Q106 PolarHBondContact O-N 3.01Å; L104-Q106 PolarHBondContact O-N 2.75Å; L104-Q106 VanDerWaalsContact O-N 3.14Å; Q106-G108 VanDerWaalsContact C-N 3.26Å; Q106-G108 PolarHBondContact O-N 3.36Å
107	E	90.9	Very high	94.6	Very high	21 Å²	21	33 Å²	33	10%	0.098	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-86.2	6.5	-176.7	-55.9	-59.3	159.8	0	0	113.3	R103 L104 R105 E109 E110 G111 S208 L212	R103-E107 IonicContact CZ-OE1 2.63Å; R103-E107 VanDerWaalsContact CZ-OE1 3.24Å; R103-E107 IonicContact NH1-OE1 2.89Å; R103-E107 PolarHBondContact NH1-OE1 3.45Å; R103-E107 IonicContact NH2-OE1 3.42Å; R103-E107 PolarHBondContact NH2-OE1 3.36Å; L104-E107 HydrophobicContact CD2-CG 4.43Å; L104-E107 WeakPolarHBondContact O-CB 3.38Å; L104-E107 PolarHBondContact O-N 3.49Å; R105-E107 VanDerWaalsContact C-N 3.33Å; E107-E109 PolarHBondContact O-N 3.49Å; E107-E110 PolarHBondContact O-N 2.89Å; E107-G111 PolarHBondContact O-N 2.92Å; E107-S208 VanDerWaalsContact CD-OG 3.26Å; E107-S208 VanDerWaalsContact OE1-CB 3.27Å; E107-S208 WeakPolarHBondContact OE1-CB 3.44Å; E107-S208 PolarHBondContact OE1-OG 2.79Å; E107-S208 VanDerWaalsContact OE2-CB 3.29Å; E107-S208 WeakPolarHBondContact OE2-CB 3.31Å; E107-S208 PolarHBondContact OE2-OG 2.84Å; E107-S208 VanDerWaalsContact OE2-OG 3.04Å; E107-L212 HydrophobicContact CB-CD1 4.33Å; E107-L212 HydrophobicContact CB-CD2 4.03Å; E107-L212 HydrophobicContact CG-CD1 4.4Å; E107-L212 HydrophobicContact CG-CD2 4.11Å; E107-L212 HydrophobicContact CG-CG 4.32Å
108	G	89.7	Confident	94.5	Very high	33 Å²	33	33 Å²	33	34%	0.34	16%	0.157	S	C	.	.	H	α-helix	trans	58.2	-128.1	178	0	0	0	0	0	112.7	Q106 G111 H112	Q106-G108 VanDerWaalsContact C-N 3.26Å; Q106-G108 PolarHBondContact O-N 3.36Å; G108-G111 PolarHBondContact O-N 3.33Å; G108-H112 PolarHBondContact O-N 2.94Å
109	E	89.1	Confident	94.5	Very high	48 Å²	48	34.3 Å²	34.3	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-40.6	-176.5	-171.9	67.2	-163.9	0	0	113.2	Y41 L49 E107 G111 H112 I113	Y41-E109 HydrophobicContact CE1-CG 3.48Å; Y41-E109 VanDerWaalsContact CE1-CG 3.48Å; Y41-E109 HydrophobicContact CE2-CG 4.11Å; Y41-E109 WeakPolarHBondContact CE2-OE1 3.34Å; Y41-E109 VanDerWaalsContact CE2-OE2 3.26Å; Y41-E109 WeakPolarHBondContact CE2-OE2 3.19Å; Y41-E109 VanDerWaalsContact OH-CB 3.3Å; Y41-E109 WeakPolarHBondContact OH-CB 3.47Å; Y41-E109 WeakPolarHBondContact OH-CG 3.36Å; Y41-E109 PolarHBondContact OH-OE2 2.98Å; L49-E109 HydrophobicContact CD2-CG 4.47Å; E107-E109 PolarHBondContact O-N 3.49Å; E109-G111 PolarHBondContact O-N 2.95Å; E109-H112 WeakPolarHBondContact O-CA 3.4Å; E109-H112 VanDerWaalsContact O-CB 3.32Å; E109-H112 WeakPolarHBondContact O-CB 3.35Å; E109-H112 PolarHBondContact O-N 3.44Å; E109-H112 IonicContact OE1-CD2 3.71Å; E109-I113 HydrophobicContact CG-CD1 4.13Å; E109-I113 HydrophobicContact CG-CG1 4.39Å; E109-I113 WeakPolarHBondContact O-CG1 3.37Å; E109-I113 PolarHBondContact O-N 3.02Å
110	E	92.1	Very high	94.4	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-39	-179.2	-65.3	-175.2	120.1	0	0	109.9	L49 Q50 Y51 L56 E107 H112 I113 V114 L212	L49-E110 HydrophobicContact CD2-CG 3.92Å; Q50-E110 WeakPolarHBondContact CA-OE1 3.31Å; Q50-E110 WeakPolarHBondContact CB-OE1 3.37Å; Q50-E110 WeakPolarHBondContact CB-OE2 3.14Å; Q50-E110 WeakPolarHBondContact CG-OE2 3.5Å; Q50-E110 PolarHBondContact N-OE1 3.38Å; Q50-E110 PolarHBondContact NE2-OE2 3.38Å; Y51-E110 PolarHBondContact N-OE1 3.29Å; L56-E110 HydrophobicContact CD1-CB 4.25Å; L56-E110 HydrophobicContact CD1-CG 4.08Å; L56-E110 HydrophobicContact CD2-CB 3.97Å; L56-E110 HydrophobicContact CD2-CG 4.36Å; E107-E110 PolarHBondContact O-N 2.89Å; E110-H112 VanDerWaalsContact C-N 3.32Å; E110-H112 PolarHBondContact O-N 2.9Å; E110-I113 PolarHBondContact O-N 3.26Å; E110-V114 WeakPolarHBondContact O-CB 3.12Å; E110-V114 VanDerWaalsContact O-CG2 3.28Å; E110-V114 WeakPolarHBondContact O-CG2 3.4Å; E110-V114 PolarHBondContact O-N 3.12Å; E110-L212 HydrophobicContact CB-CD1 3.96Å; E110-L212 HydrophobicContact CB-CD2 3.81Å; E110-L212 HydrophobicContact CB-CG 4.5Å
111	G	93.9	Very high	94.2	Very high	3 Å²	3	40.9 Å²	40.9	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-38.5	170.3	0	0	0	0	0	113.8	E107 G108 E109 K115	E107-G111 PolarHBondContact O-N 2.92Å; G108-G111 PolarHBondContact O-N 3.33Å; E109-G111 PolarHBondContact O-N 2.95Å; G111-K115 VanDerWaalsContact O-CB 3.25Å; G111-K115 WeakPolarHBondContact O-CB 3.27Å; G111-K115 PolarHBondContact O-N 2.87Å
112	H	93.7	Very high	94.1	Very high	87 Å²	87	40.6 Å²	40.6	40%	0.403	19%	0.19	S	C	.	.	H	α-helix	trans	-66.7	-41.6	175.4	-173.3	62.9	0	0	0	112.5	G108 E109 E110 K116	G108-H112 PolarHBondContact O-N 2.94Å; E109-H112 WeakPolarHBondContact O-CA 3.4Å; E109-H112 VanDerWaalsContact O-CB 3.32Å; E109-H112 WeakPolarHBondContact O-CB 3.35Å; E109-H112 PolarHBondContact O-N 3.44Å; E109-H112 IonicContact OE1-CD2 3.71Å; E110-H112 VanDerWaalsContact C-N 3.32Å; E110-H112 PolarHBondContact O-N 2.9Å; H112-K116 WeakPolarHBondContact O-CB 3.07Å; H112-K116 PolarHBondContact O-N 2.9Å
113	I	94	Very high	94	Very high	19 Å²	19	40.8 Å²	40.8	10%	0.097	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-48.7	176.4	-64.9	168.5	0	0	0	109.9	L49 L56 E109 E110 K116 W117	L49-I113 HydrophobicContact CD1-CD1 4.01Å; L49-I113 HydrophobicContact CD2-CD1 3.95Å; L56-I113 HydrophobicContact CB-CG2 3.81Å; L56-I113 HydrophobicContact CD1-CB 4.19Å; L56-I113 HydrophobicContact CD1-CD1 3.88Å; L56-I113 HydrophobicContact CD1-CG2 4Å; E109-I113 HydrophobicContact CG-CD1 4.13Å; E109-I113 HydrophobicContact CG-CG1 4.39Å; E109-I113 WeakPolarHBondContact O-CG1 3.37Å; E109-I113 PolarHBondContact O-N 3.02Å; E110-I113 PolarHBondContact O-N 3.26Å; I113-K116 WeakPolarHBondContact O-CB 3.44Å; I113-K116 PolarHBondContact O-N 3.39Å; I113-W117 PolarHBondContact O-N 3.34Å; I113-W117 VanDerWaalsContact O-N 3.12Å
114	V	96.2	Very high	93.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-49.1	177.4	170.3	0	0	0	0	110.8	L56 L63 L104 E110 K116 W117 M118 L212	L56-V114 HydrophobicContact CB-CG2 4.11Å; L56-V114 HydrophobicContact CD2-CG2 3.88Å; L63-V114 HydrophobicContact CD1-CG1 3.26Å; L104-V114 HydrophobicContact CD1-CG1 3.94Å; L104-V114 HydrophobicContact CD2-CB 4.23Å; L104-V114 HydrophobicContact CD2-CG1 3.88Å; E110-V114 WeakPolarHBondContact O-CB 3.12Å; E110-V114 VanDerWaalsContact O-CG2 3.28Å; E110-V114 WeakPolarHBondContact O-CG2 3.4Å; E110-V114 PolarHBondContact O-N 3.12Å; V114-K116 VanDerWaalsContact C-N 3.29Å; V114-K116 PolarHBondContact O-N 3.32Å; V114-W117 PolarHBondContact O-N 3.3Å; V114-W117 VanDerWaalsContact O-N 3.13Å; V114-M118 WeakPolarHBondContact O-CB 3.43Å; V114-M118 PolarHBondContact O-N 3.12Å; V114-L212 HydrophobicContact CG2-CD2 3.9Å
115	K	96.6	Very high	93.6	Very high	65 Å²	65	44.3 Å²	44.3	28%	0.283	20%	0.204	S	C	.	.	H	α-helix	trans	-53.1	-46.2	174.8	171.5	178.5	-169.6	-57.7	0	111.9	Y101 G111 W117 M118 D119	Y101-K115 HydrophobicContact CD1-CB 4.4Å; Y101-K115 HydrophobicContact CD1-CD 4.3Å; Y101-K115 HydrophobicContact CD1-CG 4.01Å; Y101-K115 HydrophobicContact CE1-CB 4.16Å; Y101-K115 HydrophobicContact CE1-CD 4.29Å; Y101-K115 HydrophobicContact CE1-CG 3.62Å; Y101-K115 HydrophobicContact CE2-CD 4.5Å; Y101-K115 HydrophobicContact CE2-CG 4.42Å; Y101-K115 HydrophobicContact CG-CD 4.41Å; G111-K115 VanDerWaalsContact O-CB 3.25Å; G111-K115 WeakPolarHBondContact O-CB 3.27Å; G111-K115 PolarHBondContact O-N 2.87Å; K115-W117 VanDerWaalsContact C-N 3.33Å; K115-W117 PolarHBondContact O-N 2.91Å; K115-M118 WeakPolarHBondContact O-CB 3.29Å; K115-M118 PolarHBondContact O-N 3.37Å; K115-D119 IonicContact NZ-OD2 3.4Å; K115-D119 PolarHBondContact NZ-OD2 3.08Å; K115-D119 WeakPolarHBondContact O-CB 3.27Å; K115-D119 PolarHBondContact O-N 3.03Å
116	K	96.2	Very high	93.5	Very high	136 Å²	136	39.9 Å²	39.9	59%	0.591	19%	0.187	S	C	*	.	H	α-helix	trans	-60.4	-41.8	180	176	-173.7	174.7	-175	0	111.9	H112 I113 V114 R120	H112-K116 WeakPolarHBondContact O-CB 3.07Å; H112-K116 PolarHBondContact O-N 2.9Å; I113-K116 WeakPolarHBondContact O-CB 3.44Å; I113-K116 PolarHBondContact O-N 3.39Å; V114-K116 VanDerWaalsContact C-N 3.29Å; V114-K116 PolarHBondContact O-N 3.32Å; K116-R120 PolarHBondContact O-N 3.49Å; K116-R120 VanDerWaalsContact O-N 3.1Å
117	W	97.1	Very high	93.3	Very high	48 Å²	48	36.9 Å²	36.9	18%	0.182	18%	0.175	C	C	.	.	H	α-helix	trans	-72.1	-36.8	178.1	-72.1	113.3	0	0	0	112.2	R57 I113 V114 K115 R120 A121	R57-W117 HydrophobicContact CB-CD2 3.93Å; R57-W117 HydrophobicContact CB-CG 4.02Å; R57-W117 HydrophobicContact CB-CZ2 4.35Å; R57-W117 HydrophobicContact CG-CD2 3.64Å; R57-W117 HydrophobicContact CG-CE3 3.75Å; R57-W117 HydrophobicContact CG-CG 4.05Å; R57-W117 HydrophobicContact CG-CH2 4.33Å; R57-W117 HydrophobicContact CG-CZ2 4.23Å; R57-W117 HydrophobicContact CG-CZ3 4.08Å; I113-W117 PolarHBondContact O-N 3.34Å; I113-W117 VanDerWaalsContact O-N 3.12Å; V114-W117 PolarHBondContact O-N 3.3Å; V114-W117 VanDerWaalsContact O-N 3.13Å; K115-W117 VanDerWaalsContact C-N 3.33Å; K115-W117 PolarHBondContact O-N 2.91Å; W117-R120 VanDerWaalsContact CZ3-NH1 3.32Å; W117-R120 WeakPolarHBondContact O-CB 3.46Å; W117-R120 PolarHBondContact O-N 3.28Å; W117-A121 WeakPolarHBondContact O-CB 2.99Å; W117-A121 PolarHBondContact O-N 3.43Å
118	M	96.7	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-45.1	172.6	-170.3	179.3	173.3	0	0	112.2	G60 L63 F64 C67 I97 C100 Y101 V114 K115 R120 A121 L122	G60-M118 VanDerWaalsContact O-CA 3.3Å; G60-M118 WeakPolarHBondContact O-CA 3.4Å; G60-M118 WeakPolarHBondContact O-CB 3.43Å; L63-M118 HydrophobicContact CB-CE 4.36Å; L63-M118 HydrophobicContact CB-CG 4.33Å; L63-M118 HydrophobicContact CB-SD 3.9Å; F64-M118 HydrophobicContact CB-CG 3.96Å; C67-M118 HydrophobicContact CB-CE 4.28Å; C67-M118 WeakPolarHBondContact SG-CE 3.13Å; I97-M118 HydrophobicContact CB-CE 3.82Å; I97-M118 HydrophobicContact CD1-CE 4.29Å; I97-M118 HydrophobicContact CG1-CE 3.54Å; I97-M118 HydrophobicContact CG2-CE 3.7Å; C100-M118 HydrophobicContact CB-CE 4.16Å; Y101-M118 HydrophobicContact CD1-SD 4.27Å; Y101-M118 HydrophobicContact CE1-CE 4.3Å; Y101-M118 HydrophobicContact CE1-CG 4.41Å; Y101-M118 HydrophobicContact CE1-SD 3.58Å; Y101-M118 VanDerWaalsContact CE1-SD 3.58Å; V114-M118 WeakPolarHBondContact O-CB 3.43Å; V114-M118 PolarHBondContact O-N 3.12Å; K115-M118 WeakPolarHBondContact O-CB 3.29Å; K115-M118 PolarHBondContact O-N 3.37Å; M118-R120 VanDerWaalsContact C-N 3.31Å; M118-R120 PolarHBondContact O-N 3.32Å; M118-A121 PolarHBondContact O-N 3.27Å; M118-L122 PolarHBondContact O-N 3.25Å
119	D	96.3	Very high	92.8	Very high	27 Å²	27	39.9 Å²	39.9	14%	0.144	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-43.8	172.8	-86.3	-40	0	0	0	111.7	Y101 K115 W123 Y150	Y101-D119 VanDerWaalsContact OH-CG 3.22Å; Y101-D119 PolarHBondContact OH-OD1 3.38Å; K115-D119 IonicContact NZ-OD2 3.4Å; K115-D119 PolarHBondContact NZ-OD2 3.08Å; K115-D119 WeakPolarHBondContact O-CB 3.27Å; K115-D119 PolarHBondContact O-N 3.03Å; D119-W123 PolarHBondContact O-N 3.45Å; D119-Y150 VanDerWaalsContact OD1-CZ 3.29Å; D119-Y150 PolarHBondContact OD1-OH 3.33Å
120	R	95.9	Very high	92.5	Very high	128 Å²	128	37.7 Å²	37.7	48%	0.483	17%	0.168	S	C	.	.	H	α-helix	trans	-64.4	-46.9	178.7	-178.5	176.8	174.8	170	1	111.7	K116 W117 M118 L122 W123 E124	K116-R120 PolarHBondContact O-N 3.49Å; K116-R120 VanDerWaalsContact O-N 3.1Å; W117-R120 VanDerWaalsContact CZ3-NH1 3.32Å; W117-R120 WeakPolarHBondContact O-CB 3.46Å; W117-R120 PolarHBondContact O-N 3.28Å; M118-R120 VanDerWaalsContact C-N 3.31Å; M118-R120 PolarHBondContact O-N 3.32Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3.1Å; R120-W123 PolarHBondContact O-N 3.18Å; R120-E124 HydrophobicContact CG-CG 4.41Å; R120-E124 WeakPolarHBondContact CG-OE1 3.19Å; R120-E124 IonicContact CZ-OE1 3.22Å; R120-E124 IonicContact NE-OE1 2.71Å; R120-E124 PolarHBondContact NE-OE1 2.89Å; R120-E124 IonicContact NH2-OE1 2.75Å; R120-E124 PolarHBondContact NH2-OE1 3.49Å; R120-E124 WeakPolarHBondContact O-CG 3.3Å; R120-E124 PolarHBondContact O-N 2.87Å
121	A	94.6	Very high	91.9	Very high	11 Å²	11	44.2 Å²	44.2	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-58.7	-44.6	178.3	0	0	0	0	0	111.5	E61 F64 W117 M118 W123 E124 D125	E61-A121 HydrophobicContact CG-CB 4.34Å; F64-A121 HydrophobicContact CB-CB 3.85Å; F64-A121 HydrophobicContact CD1-CB 3.71Å; F64-A121 HydrophobicContact CG-CB 3.9Å; W117-A121 WeakPolarHBondContact O-CB 2.99Å; W117-A121 PolarHBondContact O-N 3.43Å; M118-A121 PolarHBondContact O-N 3.27Å; A121-W123 PolarHBondContact O-N 3.13Å; A121-E124 PolarHBondContact O-N 3.21Å; A121-D125 WeakPolarHBondContact O-CB 3.44Å; A121-D125 PolarHBondContact O-N 2.89Å
122	L	94.9	Very high	91.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-54.3	-52	173.3	170.5	67.4	0	0	0	111.9	F64 I94 I97 M118 R120 E124 D125 M126 Y150	F64-L122 HydrophobicContact CD2-CB 3.78Å; F64-L122 HydrophobicContact CD2-CD1 4.22Å; F64-L122 HydrophobicContact CE2-CB 3.8Å; F64-L122 HydrophobicContact CE2-CD1 3.53Å; F64-L122 HydrophobicContact CE2-CG 4.28Å; F64-L122 HydrophobicContact CZ-CD1 4.31Å; I94-L122 HydrophobicContact CD1-CD1 4.26Å; I94-L122 HydrophobicContact CD1-CD2 3.81Å; I97-L122 HydrophobicContact CD1-CD1 4.17Å; I97-L122 HydrophobicContact CD1-CD2 3.96Å; I97-L122 HydrophobicContact CD1-CG 4.44Å; M118-L122 PolarHBondContact O-N 3.25Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3.1Å; L122-E124 PolarHBondContact O-N 2.87Å; L122-D125 PolarHBondContact O-N 3.11Å; L122-M126 HydrophobicContact CD1-CG 3.97Å; L122-M126 HydrophobicContact CG-CG 4.35Å; L122-M126 WeakPolarHBondContact O-CB 3.43Å; L122-M126 WeakPolarHBondContact O-CG 3.3Å; L122-M126 PolarHBondContact O-N 3.29Å; L122-Y150 HydrophobicContact CD2-CD2 3.79Å; L122-Y150 HydrophobicContact CD2-CE2 3.71Å
123	W	94	Very high	90.2	Very high	41 Å²	41	48.4 Å²	48.4	16%	0.155	22%	0.222	C	C	.	.	H	α-helix	trans	-72.8	-28.4	-175.4	-65.9	117.5	0	0	0	113.7	F90 D119 R120 A121 M126 G127 I143 F146 R147 Y150	F90-W123 HydrophobicContact CZ-CH2 4.47Å; D119-W123 PolarHBondContact O-N 3.45Å; R120-W123 PolarHBondContact O-N 3.18Å; A121-W123 PolarHBondContact O-N 3.13Å; W123-M126 HydrophobicContact CE3-CB 4.24Å; W123-M126 HydrophobicContact CE3-CG 4.17Å; W123-M126 HydrophobicContact CZ3-CG 4.29Å; W123-G127 PolarHBondContact O-N 3.43Å; W123-I143 HydrophobicContact CE3-CG2 4.34Å; W123-F146 HydrophobicContact CZ3-CB 4.31Å; W123-R147 HydrophobicContact CD2-CG 4.2Å; W123-R147 HydrophobicContact CE3-CG 3.93Å; W123-R147 VanDerWaalsContact CH2-CA 3.47Å; W123-R147 HydrophobicContact CH2-CB 4.01Å; W123-R147 HydrophobicContact CH2-CG 3.31Å; W123-R147 HydrophobicContact CZ2-CB 4.35Å; W123-R147 HydrophobicContact CZ2-CG 3.56Å; W123-R147 HydrophobicContact CZ3-CB 4.47Å; W123-R147 HydrophobicContact CZ3-CG 3.48Å; W123-R147 VanDerWaalsContact CZ3-CG 3.48Å; W123-Y150 HydrophobicContact CH2-CG 4.2Å; W123-Y150 AromaticContact CZ2-CD1 3.95Å; W123-Y150 HydrophobicContact CZ2-CD1 3.95Å; W123-Y150 HydrophobicContact CZ2-CD2 4.1Å; W123-Y150 AromaticContact CZ2-CG 3.7Å; W123-Y150 HydrophobicContact CZ2-CG 3.7Å
124	E	91.3	Very high	88.8	Confident	74 Å²	74	56.6 Å²	56.6	35%	0.346	26%	0.257	S	S	.	.	H	α-helix	trans	-67.1	-48.4	171.3	-73.4	178.2	-174.8	0	0	110.6	R120 A121 L122 G127 H128	R120-E124 HydrophobicContact CG-CG 4.41Å; R120-E124 WeakPolarHBondContact CG-OE1 3.19Å; R120-E124 IonicContact CZ-OE1 3.22Å; R120-E124 IonicContact NE-OE1 2.71Å; R120-E124 PolarHBondContact NE-OE1 2.89Å; R120-E124 IonicContact NH2-OE1 2.75Å; R120-E124 PolarHBondContact NH2-OE1 3.49Å; R120-E124 WeakPolarHBondContact O-CG 3.3Å; R120-E124 PolarHBondContact O-N 2.87Å; A121-E124 PolarHBondContact O-N 3.21Å; L122-E124 PolarHBondContact O-N 2.87Å; E124-G127 PolarHBondContact O-N 3.32Å; E124-H128 PolarHBondContact O-CE1 2.9Å; E124-H128 PolarHBondContact O-N 2.91Å; E124-H128 PolarHBondContact O-ND1 3.33Å
125	D	90.1	Very high	87	Confident	15 Å²	15	63.3 Å²	63.3	8%	0.08	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-45.4	176	174.4	82.9	0	0	0	112.4	F64 A121 L122 G127 H128 R129	F64-D125 HydrophobicContact CE1-CB 3.53Å; F64-D125 HydrophobicContact CZ-CB 3.58Å; A121-D125 WeakPolarHBondContact O-CB 3.44Å; A121-D125 PolarHBondContact O-N 2.89Å; L122-D125 PolarHBondContact O-N 3.11Å; D125-G127 PolarHBondContact O-N 2.93Å; D125-G127 VanDerWaalsContact O-N 3.17Å; D125-H128 WeakPolarHBondContact O-CA 3.28Å; D125-H128 WeakPolarHBondContact O-CB 3.35Å; D125-H128 PolarHBondContact O-N 3.12Å; D125-R129 VanDerWaalsContact CG-NE 3.26Å; D125-R129 PolarHBondContact O-N 2.88Å; D125-R129 IonicContact OD1-CZ 3.54Å; D125-R129 IonicContact OD1-NE 2.67Å; D125-R129 PolarHBondContact OD1-NE 3.2Å; D125-R129 IonicContact OD1-NH2 3.46Å; D125-R129 PolarHBondContact OD1-NH2 2.93Å; D125-R129 VanDerWaalsContact OD2-CD 3.23Å; D125-R129 WeakPolarHBondContact OD2-CD 3.38Å; D125-R129 IonicContact OD2-CZ 3.62Å; D125-R129 IonicContact OD2-NE 3.47Å; D125-R129 PolarHBondContact OD2-NE 3.42Å; D125-R129 IonicContact OD2-NH2 2.75Å
126	M	90.1	Very high	85.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-54.4	-38	174.2	-77	-66	-66.6	0	0	112.1	F86 W89 F90 L122 W123 H128 V130 F146	F86-M126 HydrophobicContact CE1-CE 3.87Å; F86-M126 HydrophobicContact CE1-SD 4.34Å; F86-M126 HydrophobicContact CZ-CE 3.72Å; F86-M126 HydrophobicContact CZ-SD 3.62Å; W89-M126 HydrophobicContact CH2-SD 4.42Å; W89-M126 HydrophobicContact CZ3-SD 3.92Å; F90-M126 HydrophobicContact CD2-CE 3.7Å; F90-M126 HydrophobicContact CD2-SD 3.55Å; F90-M126 VanDerWaalsContact CD2-SD 3.55Å; F90-M126 HydrophobicContact CE2-CE 3.71Å; F90-M126 HydrophobicContact CE2-CG 4.47Å; F90-M126 HydrophobicContact CE2-SD 3.76Å; L122-M126 HydrophobicContact CD1-CG 3.97Å; L122-M126 HydrophobicContact CG-CG 4.35Å; L122-M126 WeakPolarHBondContact O-CB 3.43Å; L122-M126 WeakPolarHBondContact O-CG 3.3Å; L122-M126 PolarHBondContact O-N 3.29Å; W123-M126 HydrophobicContact CE3-CB 4.24Å; W123-M126 HydrophobicContact CE3-CG 4.17Å; W123-M126 HydrophobicContact CZ3-CG 4.29Å; M126-H128 VanDerWaalsContact C-N 3.35Å; M126-V130 HydrophobicContact CE-CG2 4.47Å; M126-V130 VanDerWaalsContact O-CB 3.27Å; M126-V130 WeakPolarHBondContact O-CB 3.36Å; M126-V130 WeakPolarHBondContact O-CG2 3.45Å; M126-V130 PolarHBondContact O-N 3.24Å; M126-F146 HydrophobicContact CE-CB 3.79Å; M126-F146 HydrophobicContact CE-CD1 3.99Å; M126-F146 HydrophobicContact CE-CD2 3.63Å; M126-F146 HydrophobicContact CE-CE1 4.5Å; M126-F146 HydrophobicContact CE-CE2 4.21Å; M126-F146 HydrophobicContact CE-CG 3.52Å
127	G	85.6	Confident	83.6	Confident	8 Å²	8	62.8 Å²	62.8	8%	0.082	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-42.8	174.6	0	0	0	0	0	112.5	W123 E124 D125 R131	W123-G127 PolarHBondContact O-N 3.43Å; E124-G127 PolarHBondContact O-N 3.32Å; D125-G127 PolarHBondContact O-N 2.93Å; D125-G127 VanDerWaalsContact O-N 3.17Å; G127-R131 VanDerWaalsContact O-CG 3.31Å; G127-R131 WeakPolarHBondContact O-CG 3.49Å; G127-R131 PolarHBondContact O-N 3.36Å; G127-R131 PolarHBondContact O-NE 2.89Å; G127-R131 PolarHBondContact O-NH1 3.4Å; G127-R131 VanDerWaalsContact O-NH1 3.07Å
128	H	84.8	Confident	82.3	Confident	67 Å²	67	67 Å²	67	31%	0.31	32%	0.323	S	S	.	.	H	α-helix	trans	-68.2	-49.2	177.3	-63	98.6	0	0	0	111.7	E124 D125 M126 V130 R131 A132 Y246	E124-H128 PolarHBondContact O-CE1 2.9Å; E124-H128 PolarHBondContact O-N 2.91Å; E124-H128 PolarHBondContact O-ND1 3.33Å; D125-H128 WeakPolarHBondContact O-CA 3.28Å; D125-H128 WeakPolarHBondContact O-CB 3.35Å; D125-H128 PolarHBondContact O-N 3.12Å; M126-H128 VanDerWaalsContact C-N 3.35Å; H128-V130 PolarHBondContact O-N 2.75Å; H128-R131 PolarHBondContact CD2-NH2 2.76Å; H128-R131 PolarHBondContact NE2-NH2 3.36Å; H128-R131 PolarHBondContact O-N 2.94Å; H128-A132 PolarHBondContact O-N 3.28Å; H128-Y246 AromaticContact CE1-CZ 3.88Å; H128-Y246 PolarHBondContact CE1-OH 3.3Å
129	R	86.7	Confident	81.3	Confident	50 Å²	50	69.4 Å²	69.4	19%	0.189	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-45.5	-177.9	-64.2	-173.3	-172.4	-121.2	2.9	112.3	E69 F86 W89 D125 R131 A132 F133	E69-R129 IonicContact OE1-CZ 3.64Å; E69-R129 IonicContact OE1-NH1 3.79Å; E69-R129 PolarHBondContact OE1-NH1 3.19Å; E69-R129 IonicContact OE1-NH2 3.67Å; E69-R129 PolarHBondContact OE1-NH2 2.86Å; F86-R129 HydrophobicContact CE2-CB 3.63Å; F86-R129 HydrophobicContact CE2-CG 4.32Å; F86-R129 HydrophobicContact CZ-CB 4.04Å; W89-R129 VanDerWaalsContact CH2-CD 3.45Å; D125-R129 VanDerWaalsContact CG-NE 3.26Å; D125-R129 PolarHBondContact O-N 2.88Å; D125-R129 IonicContact OD1-CZ 3.54Å; D125-R129 IonicContact OD1-NE 2.67Å; D125-R129 PolarHBondContact OD1-NE 3.2Å; D125-R129 IonicContact OD1-NH2 3.46Å; D125-R129 PolarHBondContact OD1-NH2 2.93Å; D125-R129 VanDerWaalsContact OD2-CD 3.23Å; D125-R129 WeakPolarHBondContact OD2-CD 3.38Å; D125-R129 IonicContact OD2-CZ 3.62Å; D125-R129 IonicContact OD2-NE 3.47Å; D125-R129 PolarHBondContact OD2-NE 3.42Å; D125-R129 IonicContact OD2-NH2 2.75Å; R129-R131 VanDerWaalsContact C-N 3.25Å; R129-R131 PolarHBondContact O-N 3.46Å; R129-A132 WeakPolarHBondContact O-CB 3.08Å; R129-A132 PolarHBondContact O-N 2.97Å; R129-A132 VanDerWaalsContact O-N 3.1Å; R129-F133 VanDerWaalsContact O-CD2 3.24Å; R129-F133 WeakPolarHBondContact O-CD2 3.39Å; R129-F133 PolarHBondContact O-N 3.34Å
130	V	81.7	Confident	80.6	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-59.8	-36.4	177.1	166.3	0	0	0	0	111.9	F86 M126 H128 L136 I143	F86-V130 HydrophobicContact CE1-CG2 4.39Å; F86-V130 HydrophobicContact CZ-CG2 4.47Å; M126-V130 HydrophobicContact CE-CG2 4.47Å; M126-V130 VanDerWaalsContact O-CB 3.27Å; M126-V130 WeakPolarHBondContact O-CB 3.36Å; M126-V130 WeakPolarHBondContact O-CG2 3.45Å; M126-V130 PolarHBondContact O-N 3.24Å; H128-V130 PolarHBondContact O-N 2.75Å; V130-L136 HydrophobicContact CG1-CB 4.26Å; V130-L136 HydrophobicContact CG1-CD1 3.82Å; V130-L136 HydrophobicContact CG2-CD1 4.44Å; V130-I143 HydrophobicContact CG2-CG1 4.31Å
131	R	80.4	Confident	80.1	Confident	146 Å²	146	71.8 Å²	71.8	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-69.8	-41.9	174.4	-74	-172.7	-62.2	-93.3	7.2	111.9	G127 H128 R129 F133 K134	G127-R131 VanDerWaalsContact O-CG 3.31Å; G127-R131 WeakPolarHBondContact O-CG 3.49Å; G127-R131 PolarHBondContact O-N 3.36Å; G127-R131 PolarHBondContact O-NE 2.89Å; G127-R131 PolarHBondContact O-NH1 3.4Å; G127-R131 VanDerWaalsContact O-NH1 3.07Å; H128-R131 PolarHBondContact CD2-NH2 2.76Å; H128-R131 PolarHBondContact NE2-NH2 3.36Å; H128-R131 PolarHBondContact O-N 2.94Å; R129-R131 VanDerWaalsContact C-N 3.25Å; R129-R131 PolarHBondContact O-N 3.46Å; R131-F133 VanDerWaalsContact C-N 3.25Å; R131-F133 PolarHBondContact O-N 3.46Å; R131-K134 PolarHBondContact O-N 3Å
132	A	80.2	Confident	79.6	Confident	71 Å²	71	74.4 Å²	74.4	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-60.8	-34.7	179.3	0	0	0	0	0	112.5	H128 R129 K134	H128-A132 PolarHBondContact O-N 3.28Å; R129-A132 WeakPolarHBondContact O-CB 3.08Å; R129-A132 PolarHBondContact O-N 2.97Å; R129-A132 VanDerWaalsContact O-N 3.1Å; A132-K134 PolarHBondContact O-N 3.35Å; A132-K134 VanDerWaalsContact O-N 3.09Å
133	F	71.4	Confident	79.3	Confident	107 Å²	107	76.1 Å²	76.1	47%	0.469	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-1.4	179.9	-85.1	-71.5	0	0	0	115.4	F86 R129 R131 I135	F86-F133 HydrophobicContact CB-CD2 4.46Å; F86-F133 HydrophobicContact CB-CE2 3.9Å; F86-F133 HydrophobicContact CB-CZ 4.01Å; F86-F133 HydrophobicContact CD2-CD2 4.11Å; F86-F133 AromaticContact CD2-CE2 3.47Å; F86-F133 HydrophobicContact CD2-CE2 3.47Å; F86-F133 VanDerWaalsContact CD2-CE2 3.47Å; F86-F133 HydrophobicContact CD2-CZ 4.24Å; F86-F133 HydrophobicContact CE2-CE2 4.19Å; F86-F133 HydrophobicContact CG-CD2 4.23Å; F86-F133 AromaticContact CG-CE2 3.82Å; F86-F133 HydrophobicContact CG-CE2 3.82Å; F86-F133 HydrophobicContact CG-CZ 4.43Å; R129-F133 VanDerWaalsContact O-CD2 3.24Å; R129-F133 WeakPolarHBondContact O-CD2 3.39Å; R129-F133 PolarHBondContact O-N 3.34Å; R131-F133 VanDerWaalsContact C-N 3.25Å; R131-F133 PolarHBondContact O-N 3.46Å; F133-I135 WeakPolarHBondContact O-CB 3.33Å; F133-I135 VanDerWaalsContact O-CG1 3.24Å; F133-I135 WeakPolarHBondContact O-CG1 3.24Å; F133-I135 PolarHBondContact O-N 3.03Å
134	K	64	Low	79.1	Confident	192 Å²	192	82.3 Å²	82.3	84%	0.835	41%	0.405	S	S	*	.	S	Bend	trans	48.3	-12.1	172.6	-69.9	-175.9	-176.7	178.7	0	118.9	R131 A132	R131-K134 PolarHBondContact O-N 3Å; A132-K134 PolarHBondContact O-N 3.35Å; A132-K134 VanDerWaalsContact O-N 3.09Å
135	I	57.8	Low	79.2	Confident	140 Å²	140	82.1 Å²	82.1	72%	0.718	41%	0.409	S	S	*	.			trans	-91.3	-21	-171.6	-66.6	161.3	0	0	0	110.3	F133 T137	F133-I135 WeakPolarHBondContact O-CB 3.33Å; F133-I135 VanDerWaalsContact O-CG1 3.24Å; F133-I135 WeakPolarHBondContact O-CG1 3.24Å; F133-I135 PolarHBondContact O-N 3.03Å; I135-T137 PolarHBondContact O-N 2.75Å; I135-T137 VanDerWaalsContact O-N 3.12Å
136	L	60.5	Low	79.3	Confident	52 Å²	52	82 Å²	82	27%	0.272	41%	0.408	S	S	.	.			trans	-92.3	78.4	-173	-58	179.9	0	0	0	110.8	V130 K138 S139 Q142	V130-L136 HydrophobicContact CG1-CB 4.26Å; V130-L136 HydrophobicContact CG1-CD1 3.82Å; V130-L136 HydrophobicContact CG2-CD1 4.44Å; L136-K138 PolarHBondContact O-N 3.36Å; L136-S139 PolarHBondContact O-N 2.98Å; L136-Q142 HydrophobicContact CB-CG 4.14Å; L136-Q142 HydrophobicContact CD1-CB 4.04Å; L136-Q142 HydrophobicContact CD1-CG 3.87Å; L136-Q142 HydrophobicContact CD2-CG 3.85Å; L136-Q142 HydrophobicContact CG-CG 4.14Å
137	T	60.5	Low	79.6	Confident	138 Å²	138	87.8 Å²	87.8	85%	0.847	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-19.5	175	54	0	0	0	0	114.3	I135	I135-T137 PolarHBondContact O-N 2.75Å; I135-T137 VanDerWaalsContact O-N 3.12Å
138	K	71.1	Confident	80.1	Confident	138 Å²	138	89.6 Å²	89.6	60%	0.6	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	69.4	175.6	-61.4	-175.1	-178.8	-178.8	0	111.2	L136 S140 K141 Q142	L136-K138 PolarHBondContact O-N 3.36Å; K138-S140 PolarHBondContact O-N 3.08Å; K138-K141 HydrophobicContact CB-CB 4.08Å; K138-K141 PolarHBondContact O-N 3.43Å; K138-Q142 PolarHBondContact O-N 3.41Å
139	S	75.7	Confident	80.6	Confident	50 Å²	50	88.7 Å²	88.7	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-48.9	-41.1	180	59.6	0	0	0	0	113.4	L136 K141 Q142 I143	L136-S139 PolarHBondContact O-N 2.98Å; S139-K141 PolarHBondContact O-N 3.04Å; S139-Q142 PolarHBondContact O-N 2.63Å; S139-I143 VanDerWaalsContact O-CG1 3.32Å; S139-I143 WeakPolarHBondContact O-CG1 3.35Å; S139-I143 PolarHBondContact O-N 3.47Å
140	S	81.1	Confident	81.1	Confident	89 Å²	89	86.4 Å²	86.4	62%	0.622	44%	0.436	S	S	*	.	H	α-helix	trans	-63	-39.5	179	61.4	0	0	0	0	113.5	K138 Q142 R144	K138-S140 PolarHBondContact O-N 3.08Å; S140-Q142 VanDerWaalsContact C-N 3.32Å; S140-R144 PolarHBondContact O-N 3.36Å; S140-R144 VanDerWaalsContact O-N 3.12Å
141	K	84.5	Confident	81.7	Confident	116 Å²	116	92.2 Å²	92.2	50%	0.504	46%	0.461	S	S	.	.	H	α-helix	trans	-65.3	-40.1	177.1	-173.7	-179.9	177.2	-175	0	110.4	K138 S139 R144 V145	K138-K141 HydrophobicContact CB-CB 4.08Å; K138-K141 PolarHBondContact O-N 3.43Å; S139-K141 PolarHBondContact O-N 3.04Å; K141-R144 WeakPolarHBondContact O-CB 3.39Å; K141-R144 PolarHBondContact O-N 3.29Å; K141-V145 PolarHBondContact O-N 3.18Å
142	Q	84.8	Confident	82.5	Confident	66 Å²	66	87.2 Å²	87.2	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-71.5	-45.3	-179.1	-64.1	-66.9	-2.5	0	0	112	L136 K138 S139 S140 R144 V145 F146	L136-Q142 HydrophobicContact CB-CG 4.14Å; L136-Q142 HydrophobicContact CD1-CB 4.04Å; L136-Q142 HydrophobicContact CD1-CG 3.87Å; L136-Q142 HydrophobicContact CD2-CG 3.85Å; L136-Q142 HydrophobicContact CG-CG 4.14Å; K138-Q142 PolarHBondContact O-N 3.41Å; S139-Q142 PolarHBondContact O-N 2.63Å; S140-Q142 VanDerWaalsContact C-N 3.32Å; Q142-R144 PolarHBondContact O-N 3.33Å; Q142-V145 WeakPolarHBondContact O-CB 3.46Å; Q142-V145 PolarHBondContact O-N 3.35Å; Q142-F146 VanDerWaalsContact O-CD2 3.26Å; Q142-F146 WeakPolarHBondContact O-CD2 3.45Å; Q142-F146 PolarHBondContact O-N 3.08Å
143	I	88.6	Confident	83.2	Confident	35 Å²	35	84.3 Å²	84.3	18%	0.179	43%	0.43	C	S	.	.	H	α-helix	trans	-56.2	-37.4	173.6	-68.3	167.4	0	0	0	110.7	W123 V130 S139 F146 R147	W123-I143 HydrophobicContact CE3-CG2 4.34Å; V130-I143 HydrophobicContact CG2-CG1 4.31Å; S139-I143 VanDerWaalsContact O-CG1 3.32Å; S139-I143 WeakPolarHBondContact O-CG1 3.35Å; S139-I143 PolarHBondContact O-N 3.47Å; I143-F146 PolarHBondContact O-N 3.16Å; I143-R147 WeakPolarHBondContact O-CB 3.2Å; I143-R147 WeakPolarHBondContact O-CG 3.35Å; I143-R147 PolarHBondContact O-N 2.67Å
144	R	91.1	Very high	84.4	Confident	171 Å²	171	80.1 Å²	80.1	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-64.5	-38.2	175.5	-173.3	172.8	64.5	-151.1	3.7	112.9	S140 K141 Q142 R147 G148	S140-R144 PolarHBondContact O-N 3.36Å; S140-R144 VanDerWaalsContact O-N 3.12Å; K141-R144 WeakPolarHBondContact O-CB 3.39Å; K141-R144 PolarHBondContact O-N 3.29Å; Q142-R144 PolarHBondContact O-N 3.33Å; R144-R147 PolarHBondContact O-N 2.71Å; R144-G148 PolarHBondContact O-N 2.84Å; R144-G148 VanDerWaalsContact O-N 3.12Å
145	V	92	Very high	85.8	Confident	71 Å²	71	75.5 Å²	75.5	43%	0.43	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-48.2	174.6	174.3	0	0	0	0	110.3	K141 Q142 R147 G148 Q149	K141-V145 PolarHBondContact O-N 3.18Å; Q142-V145 WeakPolarHBondContact O-CB 3.46Å; Q142-V145 PolarHBondContact O-N 3.35Å; V145-R147 VanDerWaalsContact C-N 3.29Å; V145-R147 PolarHBondContact O-N 2.91Å; V145-G148 PolarHBondContact O-N 3.43Å; V145-Q149 PolarHBondContact O-N 3.11Å
146	F	93.6	Very high	87.6	Confident	12 Å²	12	69.7 Å²	69.7	5%	0.053	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-37	176.2	-76.5	-66.3	0	0	0	112.9	F86 F90 W123 M126 Q142 I143 Q149 Y150	F86-F146 HydrophobicContact CD1-CE1 4.39Å; F86-F146 HydrophobicContact CD1-CE2 4.29Å; F86-F146 AromaticContact CD1-CZ 3.72Å; F86-F146 HydrophobicContact CD1-CZ 3.72Å; F86-F146 HydrophobicContact CE1-CE1 4.12Å; F86-F146 AromaticContact CE1-CE2 3.79Å; F86-F146 HydrophobicContact CE1-CE2 3.79Å; F86-F146 AromaticContact CE1-CZ 3.53Å; F86-F146 HydrophobicContact CE1-CZ 3.53Å; F90-F146 HydrophobicContact CB-CD1 4.45Å; F90-F146 HydrophobicContact CB-CE1 4.15Å; F90-F146 AromaticContact CD1-CD1 3.51Å; F90-F146 HydrophobicContact CD1-CD1 3.51Å; F90-F146 AromaticContact CD1-CE1 3.89Å; F90-F146 HydrophobicContact CD1-CE1 3.89Å; F90-F146 AromaticContact CD2-CD1 3.97Å; F90-F146 HydrophobicContact CD2-CD1 3.97Å; F90-F146 HydrophobicContact CD2-CE1 4.43Å; F90-F146 HydrophobicContact CE1-CB 4.34Å; F90-F146 AromaticContact CE1-CD1 3.58Å; F90-F146 HydrophobicContact CE1-CD1 3.58Å; F90-F146 HydrophobicContact CE1-CE1 4.41Å; F90-F146 HydrophobicContact CE1-CG 4.44Å; F90-F146 HydrophobicContact CE2-CB 4.19Å; F90-F146 HydrophobicContact CE2-CD1 4.02Å; F90-F146 HydrophobicContact CE2-CG 4.41Å; F90-F146 AromaticContact CG-CD1 3.7Å; F90-F146 HydrophobicContact CG-CD1 3.7Å; F90-F146 AromaticContact CG-CE1 3.89Å; F90-F146 HydrophobicContact CG-CE1 3.89Å; F90-F146 HydrophobicContact CZ-CB 3.89Å; F90-F146 AromaticContact CZ-CD1 3.83Å; F90-F146 HydrophobicContact CZ-CD1 3.83Å; F90-F146 HydrophobicContact CZ-CG 4.3Å; F90-F146 WeakPolarHBondContact CZ-O 3.24Å; W123-F146 HydrophobicContact CZ3-CB 4.31Å; M126-F146 HydrophobicContact CE-CB 3.79Å; M126-F146 HydrophobicContact CE-CD1 3.99Å; M126-F146 HydrophobicContact CE-CD2 3.63Å; M126-F146 HydrophobicContact CE-CE1 4.5Å; M126-F146 HydrophobicContact CE-CE2 4.21Å; M126-F146 HydrophobicContact CE-CG 3.52Å; Q142-F146 VanDerWaalsContact O-CD2 3.26Å; Q142-F146 WeakPolarHBondContact O-CD2 3.45Å; Q142-F146 PolarHBondContact O-N 3.08Å; I143-F146 PolarHBondContact O-N 3.16Å; F146-Q149 PolarHBondContact O-N 3.07Å; F146-Y150 VanDerWaalsContact O-CB 3.3Å; F146-Y150 WeakPolarHBondContact O-CB 3.33Å; F146-Y150 PolarHBondContact O-N 3.36Å
147	R	95	Very high	89.3	Confident	121 Å²	121	67.2 Å²	67.2	46%	0.457	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-44.1	171.8	-79.5	-179.4	177.4	-167	1.2	112.4	W123 I143 R144 V145 Y150 F151	W123-R147 HydrophobicContact CD2-CG 4.2Å; W123-R147 HydrophobicContact CE3-CG 3.93Å; W123-R147 VanDerWaalsContact CH2-CA 3.47Å; W123-R147 HydrophobicContact CH2-CB 4.01Å; W123-R147 HydrophobicContact CH2-CG 3.31Å; W123-R147 HydrophobicContact CZ2-CB 4.35Å; W123-R147 HydrophobicContact CZ2-CG 3.56Å; W123-R147 HydrophobicContact CZ3-CB 4.47Å; W123-R147 HydrophobicContact CZ3-CG 3.48Å; W123-R147 VanDerWaalsContact CZ3-CG 3.48Å; I143-R147 WeakPolarHBondContact O-CB 3.2Å; I143-R147 WeakPolarHBondContact O-CG 3.35Å; I143-R147 PolarHBondContact O-N 2.67Å; R144-R147 PolarHBondContact O-N 2.71Å; V145-R147 VanDerWaalsContact C-N 3.29Å; V145-R147 PolarHBondContact O-N 2.91Å; R147-Y150 WeakPolarHBondContact O-CB 3.45Å; R147-Y150 PolarHBondContact O-N 2.9Å; R147-F151 WeakPolarHBondContact O-CD2 3.44Å; R147-F151 PolarHBondContact O-N 2.98Å; R147-F151 VanDerWaalsContact O-N 3.1Å
148	G	95.9	Very high	91	Very high	46 Å²	46	62.5 Å²	62.5	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-59.4	-48.4	175.6	0	0	0	0	0	112	R144 V145 Y150 F151 G152	R144-G148 PolarHBondContact O-N 2.84Å; R144-G148 VanDerWaalsContact O-N 3.12Å; V145-G148 PolarHBondContact O-N 3.43Å; G148-Y150 PolarHBondContact O-N 3.42Å; G148-F151 PolarHBondContact O-N 3.25Å; G148-G152 PolarHBondContact O-N 2.77Å
149	Q	95.6	Very high	92.1	Very high	48 Å²	48	61.9 Å²	61.9	22%	0.224	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-44.9	175.5	-69.5	177.2	-8.6	0	0	111.9	F90 V145 F146 F151 G152 N153	F90-Q149 HydrophobicContact CE1-CB 4.24Å; V145-Q149 PolarHBondContact O-N 3.11Å; F146-Q149 PolarHBondContact O-N 3.07Å; Q149-F151 PolarHBondContact O-N 3.09Å; Q149-G152 PolarHBondContact O-N 3.47Å; Q149-N153 VanDerWaalsContact O-CB 3.29Å; Q149-N153 WeakPolarHBondContact O-CB 3.28Å; Q149-N153 PolarHBondContact O-N 2.95Å; Q149-N153 PolarHBondContact O-OD1 2.9Å
150	Y	96.9	Very high	93	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-54.7	-53	178	168.1	-88	0	0	0	111.7	I94 Y101 D119 L122 W123 F146 R147 G148 N153 M154	I94-Y150 HydrophobicContact CD1-CD2 3.6Å; I94-Y150 HydrophobicContact CD1-CE2 4.19Å; I94-Y150 HydrophobicContact CG1-CD2 4.21Å; I94-Y150 HydrophobicContact CG2-CD2 4.38Å; Y101-Y150 WeakPolarHBondContact CE2-OH 3.11Å; Y101-Y150 PolarHBondContact OH-OH 2.83Å; D119-Y150 VanDerWaalsContact OD1-CZ 3.29Å; D119-Y150 PolarHBondContact OD1-OH 3.33Å; L122-Y150 HydrophobicContact CD2-CD2 3.79Å; L122-Y150 HydrophobicContact CD2-CE2 3.71Å; W123-Y150 HydrophobicContact CH2-CG 4.2Å; W123-Y150 AromaticContact CZ2-CD1 3.95Å; W123-Y150 HydrophobicContact CZ2-CD1 3.95Å; W123-Y150 HydrophobicContact CZ2-CD2 4.1Å; W123-Y150 AromaticContact CZ2-CG 3.7Å; W123-Y150 HydrophobicContact CZ2-CG 3.7Å; F146-Y150 VanDerWaalsContact O-CB 3.3Å; F146-Y150 WeakPolarHBondContact O-CB 3.33Å; F146-Y150 PolarHBondContact O-N 3.36Å; R147-Y150 WeakPolarHBondContact O-CB 3.45Å; R147-Y150 PolarHBondContact O-N 2.9Å; G148-Y150 PolarHBondContact O-N 3.42Å; Y150-N153 PolarHBondContact O-N 2.64Å; Y150-M154 HydrophobicContact CD2-CE 3.99Å; Y150-M154 HydrophobicContact CE1-CG 4.2Å; Y150-M154 HydrophobicContact CE2-CE 3.43Å; Y150-M154 VanDerWaalsContact CE2-CE 3.43Å; Y150-M154 HydrophobicContact CE2-CG 4.48Å; Y150-M154 VanDerWaalsContact O-CG 3.27Å; Y150-M154 WeakPolarHBondContact O-CG 3.48Å; Y150-M154 PolarHBondContact O-N 3.44Å
151	F	96.1	Very high	93.6	Very high	125 Å²	125	58.6 Å²	58.6	55%	0.548	30%	0.303	S	S	.	.	H	α-helix	trans	-68.8	-38.8	-178.9	-71	-66	0	0	0	112.2	R147 G148 Q149 N153 M154 V155	R147-F151 WeakPolarHBondContact O-CD2 3.44Å; R147-F151 PolarHBondContact O-N 2.98Å; R147-F151 VanDerWaalsContact O-N 3.1Å; G148-F151 PolarHBondContact O-N 3.25Å; Q149-F151 PolarHBondContact O-N 3.09Å; F151-N153 VanDerWaalsContact C-N 3.35Å; F151-M154 PolarHBondContact O-N 3.44Å; F151-V155 WeakPolarHBondContact O-CG2 3.44Å; F151-V155 PolarHBondContact O-N 3.1Å; F151-V155 VanDerWaalsContact O-N 3.11Å
152	G	95.8	Very high	93.9	Very high	42 Å²	42	60 Å²	60	43%	0.433	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-44.9	175	0	0	0	0	0	112.2	G148 Q149 V155 G156	G148-G152 PolarHBondContact O-N 2.77Å; Q149-G152 PolarHBondContact O-N 3.47Å; G152-V155 PolarHBondContact O-N 3.42Å; G152-G156 PolarHBondContact O-N 2.83Å
153	N	96.1	Very high	94.1	Very high	10 Å²	10	59.2 Å²	59.2	5%	0.053	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-46.9	176.8	-71.9	0.5	0	0	0	111.4	I94 Q149 Y150 F151 V155 G156 Y157 N176	I94-N153 HydrophobicContact CG2-CB 3.82Å; Q149-N153 VanDerWaalsContact O-CB 3.29Å; Q149-N153 WeakPolarHBondContact O-CB 3.28Å; Q149-N153 PolarHBondContact O-N 2.95Å; Q149-N153 PolarHBondContact O-OD1 2.9Å; Y150-N153 PolarHBondContact O-N 2.64Å; F151-N153 VanDerWaalsContact C-N 3.35Å; N153-V155 VanDerWaalsContact C-N 3.34Å; N153-V155 PolarHBondContact O-N 2.8Å; N153-G156 PolarHBondContact O-N 2.98Å; N153-Y157 HydrophobicContact CB-CD2 4.31Å; N153-Y157 HydrophobicContact CB-CE2 3.81Å; N153-Y157 WeakPolarHBondContact O-CB 3.28Å; N153-Y157 WeakPolarHBondContact O-CD2 3.43Å; N153-Y157 PolarHBondContact O-N 3.48Å; N153-N176 WeakPolarHBondContact OD1-CB 3.26Å; N153-N176 PolarHBondContact OD1-ND2 3.14Å; N153-N176 PolarHBondContact OD1-OD1 3.04Å
154	M	95.4	Very high	93.9	Very high	18 Å²	18	63.1 Å²	63.1	9%	0.089	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-46.3	179	-68.3	-62.6	160	0	0	112.1	I94 I97 W98 Y101 Y150 F151 D158	I94-M154 HydrophobicContact CG2-CE 3.73Å; I97-M154 HydrophobicContact CB-CE 4.32Å; I97-M154 HydrophobicContact CG2-CE 3.76Å; W98-M154 HydrophobicContact CB-CE 4.08Å; W98-M154 HydrophobicContact CB-SD 3.72Å; W98-M154 HydrophobicContact CG-SD 4.21Å; Y101-M154 HydrophobicContact CD2-CE 4.1Å; Y101-M154 HydrophobicContact CD2-SD 3.71Å; Y101-M154 HydrophobicContact CE2-CE 3.81Å; Y101-M154 HydrophobicContact CE2-SD 3.92Å; Y150-M154 HydrophobicContact CD2-CE 3.99Å; Y150-M154 HydrophobicContact CE1-CG 4.2Å; Y150-M154 HydrophobicContact CE2-CE 3.43Å; Y150-M154 VanDerWaalsContact CE2-CE 3.43Å; Y150-M154 HydrophobicContact CE2-CG 4.48Å; Y150-M154 VanDerWaalsContact O-CG 3.27Å; Y150-M154 WeakPolarHBondContact O-CG 3.48Å; Y150-M154 PolarHBondContact O-N 3.44Å; F151-M154 PolarHBondContact O-N 3.44Å; M154-D158 WeakPolarHBondContact O-CB 3.33Å; M154-D158 PolarHBondContact O-N 3Å; M154-D158 VanDerWaalsContact O-N 3.12Å
155	V	94.7	Very high	93.9	Very high	95 Å²	95	56.9 Å²	56.9	58%	0.576	33%	0.328	S	S	*	.	H	α-helix	trans	-67.5	-47.4	179.1	174.5	0	0	0	0	111	F151 G152 N153 Y157 D158 E159	F151-V155 WeakPolarHBondContact O-CG2 3.44Å; F151-V155 PolarHBondContact O-N 3.1Å; F151-V155 VanDerWaalsContact O-N 3.11Å; G152-V155 PolarHBondContact O-N 3.42Å; N153-V155 VanDerWaalsContact C-N 3.34Å; N153-V155 PolarHBondContact O-N 2.8Å; V155-Y157 VanDerWaalsContact C-N 3.34Å; V155-Y157 PolarHBondContact O-N 3.34Å; V155-D158 PolarHBondContact O-N 3.4Å; V155-E159 WeakPolarHBondContact O-CB 3.44Å; V155-E159 PolarHBondContact O-N 3.25Å
156	G	94.6	Very high	93.8	Very high	19 Å²	19	56.5 Å²	56.5	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-38.3	-178.5	0	0	0	0	0	113.1	G152 N153 A160	G152-G156 PolarHBondContact O-N 2.83Å; N153-G156 PolarHBondContact O-N 2.98Å; G156-A160 WeakPolarHBondContact O-CB 3.48Å; G156-A160 PolarHBondContact O-N 3.11Å
157	Y	96.9	Very high	93.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-71	-38.5	175.7	-59.4	-31.9	0	0	0	112.5	L95 W98 N153 V155 A160 L161 A172 L173 N176	L95-Y157 HydrophobicContact CB-CE2 4.46Å; L95-Y157 HydrophobicContact CD1-CD2 4.27Å; L95-Y157 HydrophobicContact CD1-CE1 4.36Å; L95-Y157 HydrophobicContact CD1-CE2 3.85Å; W98-Y157 HydrophobicContact CB-CD2 3.9Å; W98-Y157 AromaticContact CD2-CD2 3.9Å; W98-Y157 HydrophobicContact CD2-CD2 3.9Å; W98-Y157 HydrophobicContact CD2-CG 4.1Å; W98-Y157 HydrophobicContact CE3-CD2 4.27Å; W98-Y157 HydrophobicContact CE3-CG 4.43Å; W98-Y157 AromaticContact CG-CD2 3.7Å; W98-Y157 HydrophobicContact CG-CD2 3.7Å; W98-Y157 HydrophobicContact CG-CG 4.27Å; W98-Y157 WeakPolarHBondContact CZ2-O 3.4Å; N153-Y157 HydrophobicContact CB-CD2 4.31Å; N153-Y157 HydrophobicContact CB-CE2 3.81Å; N153-Y157 WeakPolarHBondContact O-CB 3.28Å; N153-Y157 WeakPolarHBondContact O-CD2 3.43Å; N153-Y157 PolarHBondContact O-N 3.48Å; V155-Y157 VanDerWaalsContact C-N 3.34Å; V155-Y157 PolarHBondContact O-N 3.34Å; Y157-A160 PolarHBondContact O-N 3.4Å; Y157-L161 WeakPolarHBondContact O-CB 3.3Å; Y157-L161 PolarHBondContact O-N 3.35Å; Y157-A172 HydrophobicContact CD1-CB 4.13Å; Y157-L173 HydrophobicContact CE1-CD2 4.01Å; Y157-N176 HydrophobicContact CE1-CB 3.98Å; Y157-N176 WeakPolarHBondContact CE1-ND2 3.37Å; Y157-N176 VanDerWaalsContact OH-CB 3.27Å; Y157-N176 WeakPolarHBondContact OH-CB 3.27Å
158	D	95.4	Very high	93.8	Very high	39 Å²	39	58.6 Å²	58.6	21%	0.209	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-44.1	173.7	-82.2	-13.1	0	0	0	111.7	W98 R105 M154 V155 A160 L161 L162	W98-D158 PolarHBondContact NE1-OD1 2.99Å; R105-D158 IonicContact CZ-OD1 2.76Å; R105-D158 IonicContact CZ-OD2 3.38Å; R105-D158 IonicContact NH1-OD1 2.79Å; R105-D158 PolarHBondContact NH1-OD1 3.4Å; R105-D158 IonicContact NH1-OD2 3.06Å; R105-D158 IonicContact NH2-OD1 3.09Å; R105-D158 PolarHBondContact NH2-OD1 3.04Å; R105-D158 IonicContact NH2-OD2 2.71Å; R105-D158 PolarHBondContact NH2-OD2 3.24Å; M154-D158 WeakPolarHBondContact O-CB 3.33Å; M154-D158 PolarHBondContact O-N 3Å; M154-D158 VanDerWaalsContact O-N 3.12Å; V155-D158 PolarHBondContact O-N 3.4Å; D158-A160 PolarHBondContact O-N 2.99Å; D158-L161 PolarHBondContact O-N 3.4Å; D158-L162 WeakPolarHBondContact O-CB 3.48Å; D158-L162 WeakPolarHBondContact O-CG 3.38Å; D158-L162 PolarHBondContact O-N 3.46Å
159	E	94.3	Very high	93.8	Very high	125 Å²	125	57.1 Å²	57.1	58%	0.584	33%	0.328	S	S	*	.	H	α-helix	trans	-60.5	-45	176	-177.3	176.8	-173.4	0	0	111.7	V155 L161 L162 S163	V155-E159 WeakPolarHBondContact O-CB 3.44Å; V155-E159 PolarHBondContact O-N 3.25Å; E159-L161 PolarHBondContact O-N 2.89Å; E159-L162 PolarHBondContact O-N 3.06Å; E159-S163 WeakPolarHBondContact O-CB 3.4Å; E159-S163 PolarHBondContact O-N 3.1Å; E159-S163 PolarHBondContact O-OG 3.31Å
160	A	94.4	Very high	93.8	Very high	5 Å²	5	55.6 Å²	55.6	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-42.9	176.5	0	0	0	0	0	112.8	G156 Y157 D158 S163 H168 L169 A172	G156-A160 WeakPolarHBondContact O-CB 3.48Å; G156-A160 PolarHBondContact O-N 3.11Å; Y157-A160 PolarHBondContact O-N 3.4Å; D158-A160 PolarHBondContact O-N 2.99Å; A160-S163 PolarHBondContact O-N 2.87Å; A160-H168 HydrophobicContact CB-CB 4.43Å; A160-L169 HydrophobicContact CB-CB 4.32Å; A160-L169 HydrophobicContact CB-CD1 4.15Å; A160-A172 HydrophobicContact CB-CB 3.89Å
161	L	93.2	Very high	93.8	Very high	65 Å²	65	57.1 Å²	57.1	34%	0.34	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-43.2	177.2	-177.8	64.8	0	0	0	111.4	W98 V102 Y157 D158 E159 S163 C164 L200	W98-L161 HydrophobicContact CH2-CB 4.34Å; W98-L161 HydrophobicContact CH2-CD2 4.27Å; W98-L161 HydrophobicContact CZ2-CB 3.97Å; W98-L161 HydrophobicContact CZ2-CD2 3.86Å; W98-L161 HydrophobicContact CZ2-CG 4.45Å; V102-L161 HydrophobicContact CG1-CD2 3.88Å; V102-L161 HydrophobicContact CG2-CD2 4.04Å; Y157-L161 WeakPolarHBondContact O-CB 3.3Å; Y157-L161 PolarHBondContact O-N 3.35Å; D158-L161 PolarHBondContact O-N 3.4Å; E159-L161 PolarHBondContact O-N 2.89Å; L161-S163 VanDerWaalsContact C-N 3.3Å; L161-S163 PolarHBondContact O-N 2.87Å; L161-C164 PolarHBondContact O-N 3.31Å; L161-L200 HydrophobicContact CD1-CD1 4.02Å
162	L	91.5	Very high	93.8	Very high	145 Å²	145	51.8 Å²	51.8	76%	0.759	32%	0.319	S	S	*	.	H	α-helix	trans	-68.3	-28	178.2	-70.6	171.8	0	0	0	113.1	D158 E159 C164	D158-L162 WeakPolarHBondContact O-CB 3.48Å; D158-L162 WeakPolarHBondContact O-CG 3.38Å; D158-L162 PolarHBondContact O-N 3.46Å; E159-L162 PolarHBondContact O-N 3.06Å; L162-C164 PolarHBondContact O-N 3.32Å
163	S	89.4	Confident	93.9	Very high	49 Å²	49	49.8 Å²	49.8	34%	0.343	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.9	176.8	-59.6	0	0	0	0	113.2	E159 A160 L161 S165	E159-S163 WeakPolarHBondContact O-CB 3.4Å; E159-S163 PolarHBondContact O-N 3.1Å; E159-S163 PolarHBondContact O-OG 3.31Å; A160-S163 PolarHBondContact O-N 2.87Å; L161-S163 VanDerWaalsContact C-N 3.3Å; L161-S163 PolarHBondContact O-N 2.87Å; S163-S165 WeakPolarHBondContact O-CB 3.36Å; S163-S165 PolarHBondContact O-N 3.27Å
164	C	84.7	Confident	93.9	Very high	117 Å²	117	53.6 Å²	53.6	79%	0.791	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	31.9	-179.3	-60.9	0	0	0	0	113.8	L161 L162	L161-C164 PolarHBondContact O-N 3.31Å; L162-C164 PolarHBondContact O-N 3.32Å
165	S	89.5	Confident	94	Very high	40 Å²	40	54.7 Å²	54.7	28%	0.28	32%	0.322	S	S	.	.			trans	-133.2	126.2	-170.9	174.6	0	0	0	0	110.7	S163 S167 H168 L169	S163-S165 WeakPolarHBondContact O-CB 3.36Å; S163-S165 PolarHBondContact O-N 3.27Å; S165-S167 PolarHBondContact O-N 3.12Å; S165-S167 PolarHBondContact OG-OG 3.22Å; S165-H168 VanDerWaalsContact CB-ND1 3.35Å; S165-H168 WeakPolarHBondContact CB-ND1 3.48Å; S165-H168 PolarHBondContact O-N 3.38Å; S165-H168 VanDerWaalsContact O-N 3.14Å; S165-H168 PolarHBondContact OG-ND1 3.49Å; S165-L169 PolarHBondContact O-N 3.06Å; S165-L169 VanDerWaalsContact O-N 3.14Å
166	D	91.7	Very high	94	Very high	63 Å²	63	51.3 Å²	51.3	34%	0.337	30%	0.301	S	S	.	.	H	α-helix	trans	-61.9	-29.4	178.6	-84.8	-37.6	0	0	0	113.3	H168 L169 A170 I193 R197	D166-H168 VanDerWaalsContact C-N 3.33Å; D166-L169 PolarHBondContact O-N 2.87Å; D166-A170 WeakPolarHBondContact O-CB 3.44Å; D166-A170 PolarHBondContact O-N 2.91Å; D166-I193 WeakPolarHBondContact OD1-CG2 3.3Å; D166-R197 IonicContact OD1-CZ 3.1Å; D166-R197 IonicContact OD1-NE 2.96Å; D166-R197 PolarHBondContact OD1-NE 3.21Å; D166-R197 IonicContact OD1-NH1 2.69Å; D166-R197 PolarHBondContact OD1-NH1 2.86Å; D166-R197 IonicContact OD1-NH2 2.81Å; D166-R197 PolarHBondContact OD1-NH2 3.46Å; D166-R197 IonicContact OD2-CZ 3.44Å; D166-R197 IonicContact OD2-NH1 2.73Å; D166-R197 PolarHBondContact OD2-NH1 3.41Å; D166-R197 IonicContact OD2-NH2 2.77Å; D166-R197 PolarHBondContact OD2-NH2 2.94Å
167	S	94.5	Very high	94.1	Very high	80 Å²	80	50.6 Å²	50.6	56%	0.559	29%	0.292	S	S	*	.	H	α-helix	trans	-67	-37.2	177.3	60.8	0	0	0	0	111.7	S165 G171	S165-S167 PolarHBondContact O-N 3.12Å; S165-S167 PolarHBondContact OG-OG 3.22Å; S167-G171 PolarHBondContact O-N 3.31Å
168	H	94.3	Very high	94.1	Very high	97 Å²	97	51.4 Å²	51.4	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-71.1	-42	177	-67.9	75.6	0	0	0	110.9	A160 S165 D166 G171 A172	A160-H168 HydrophobicContact CB-CB 4.43Å; S165-H168 VanDerWaalsContact CB-ND1 3.35Å; S165-H168 WeakPolarHBondContact CB-ND1 3.48Å; S165-H168 PolarHBondContact O-N 3.38Å; S165-H168 VanDerWaalsContact O-N 3.14Å; S165-H168 PolarHBondContact OG-ND1 3.49Å; D166-H168 VanDerWaalsContact C-N 3.33Å; H168-G171 PolarHBondContact O-N 2.79Å; H168-A172 PolarHBondContact O-N 2.71Å
169	L	95.1	Very high	94.1	Very high	15 Å²	15	54.2 Å²	54.2	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-42.2	174.1	-174.1	60.1	0	0	0	112	A160 S165 D166 G171 A172 L173 I193 V196	A160-L169 HydrophobicContact CB-CB 4.32Å; A160-L169 HydrophobicContact CB-CD1 4.15Å; S165-L169 PolarHBondContact O-N 3.06Å; S165-L169 VanDerWaalsContact O-N 3.14Å; D166-L169 PolarHBondContact O-N 2.87Å; L169-G171 VanDerWaalsContact C-N 3.34Å; L169-G171 PolarHBondContact O-N 3.28Å; L169-A172 PolarHBondContact O-N 2.98Å; L169-L173 HydrophobicContact CD1-CD1 4.07Å; L169-L173 HydrophobicContact CD1-CG 4.1Å; L169-L173 HydrophobicContact CG-CD1 3.88Å; L169-L173 HydrophobicContact CG-CG 4.34Å; L169-L173 WeakPolarHBondContact O-CB 3.45Å; L169-L173 VanDerWaalsContact O-CG 3.24Å; L169-L173 WeakPolarHBondContact O-CG 3.41Å; L169-L173 PolarHBondContact O-N 3.49Å; L169-I193 HydrophobicContact CD2-CG2 4.24Å; L169-I193 HydrophobicContact CG-CG1 4.43Å; L169-V196 HydrophobicContact CD2-CG1 4.38Å
170	A	96.1	Very high	94	Very high	17 Å²	17	50.9 Å²	50.9	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-56.5	-48.4	173.1	0	0	0	0	0	111.2	D166 L173 W174 I189 I193	D166-A170 WeakPolarHBondContact O-CB 3.44Å; D166-A170 PolarHBondContact O-N 2.91Å; A170-L173 PolarHBondContact O-N 3.12Å; A170-W174 WeakPolarHBondContact O-CB 3.22Å; A170-W174 PolarHBondContact O-N 3.05Å; A170-I189 HydrophobicContact CB-CG2 3.84Å; A170-I193 HydrophobicContact CB-CD1 3.72Å
171	G	96.1	Very high	94	Very high	34 Å²	34	52.8 Å²	52.8	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-49.2	178.6	0	0	0	0	0	112.5	S167 H168 L169 W174 S175	S167-G171 PolarHBondContact O-N 3.31Å; H168-G171 PolarHBondContact O-N 2.79Å; L169-G171 VanDerWaalsContact C-N 3.34Å; L169-G171 PolarHBondContact O-N 3.28Å; G171-W174 PolarHBondContact O-N 3.21Å; G171-S175 WeakPolarHBondContact O-CB 3.4Å; G171-S175 PolarHBondContact O-N 3.09Å; G171-S175 PolarHBondContact O-OG 3.34Å
172	A	96.7	Very high	94	Very high	12 Å²	12	55.6 Å²	55.6	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-65.3	-40.2	179.8	0	0	0	0	0	112.7	Y157 A160 H168 L169 S175 N176	Y157-A172 HydrophobicContact CD1-CB 4.13Å; A160-A172 HydrophobicContact CB-CB 3.89Å; H168-A172 PolarHBondContact O-N 2.71Å; L169-A172 PolarHBondContact O-N 2.98Å; A172-S175 PolarHBondContact O-OG 3.41Å; A172-S175 VanDerWaalsContact O-OG 3.06Å; A172-N176 VanDerWaalsContact O-CB 3.27Å; A172-N176 WeakPolarHBondContact O-CB 3.36Å; A172-N176 PolarHBondContact O-N 3.07Å; A172-N176 PolarHBondContact O-ND2 3.1Å; A172-N176 VanDerWaalsContact O-ND2 3.08Å
173	L	97.4	Very high	94.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68	-43.9	175.8	-69	173.5	0	0	0	111.2	L95 Y157 L169 A170 S175 N176 I177 L192 I193 V196	L95-L173 HydrophobicContact CD1-CD2 3.73Å; L95-L173 HydrophobicContact CD2-CD2 4.16Å; Y157-L173 HydrophobicContact CE1-CD2 4.01Å; L169-L173 HydrophobicContact CD1-CD1 4.07Å; L169-L173 HydrophobicContact CD1-CG 4.1Å; L169-L173 HydrophobicContact CG-CD1 3.88Å; L169-L173 HydrophobicContact CG-CG 4.34Å; L169-L173 WeakPolarHBondContact O-CB 3.45Å; L169-L173 VanDerWaalsContact O-CG 3.24Å; L169-L173 WeakPolarHBondContact O-CG 3.41Å; L169-L173 PolarHBondContact O-N 3.49Å; A170-L173 PolarHBondContact O-N 3.12Å; L173-S175 PolarHBondContact O-N 3.25Å; L173-N176 PolarHBondContact O-N 2.91Å; L173-I177 VanDerWaalsContact O-CB 3.25Å; L173-I177 WeakPolarHBondContact O-CB 3.37Å; L173-I177 WeakPolarHBondContact O-CG1 3.23Å; L173-I177 PolarHBondContact O-N 2.7Å; L173-L192 HydrophobicContact CB-CD2 4.25Å; L173-L192 HydrophobicContact CD1-CB 4.49Å; L173-L192 HydrophobicContact CD1-CD2 4.28Å; L173-L192 HydrophobicContact CD1-CG 4.11Å; L173-L192 HydrophobicContact CD2-CD2 4.01Å; L173-L192 HydrophobicContact CD2-CG 4.39Å; L173-L192 HydrophobicContact CG-CD2 4.41Å; L173-I193 HydrophobicContact CD1-CG1 3.81Å; L173-V196 HydrophobicContact CD1-CG2 4.28Å; L173-V196 HydrophobicContact CD2-CG2 4.23Å
174	W	97	Very high	94.3	Very high	90 Å²	90	53.1 Å²	53.1	34%	0.341	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-44.6	178.3	176.9	60	0	0	0	112.4	A170 G171 N176 W178 F179 S180 C181 I189	A170-W174 WeakPolarHBondContact O-CB 3.22Å; A170-W174 PolarHBondContact O-N 3.05Å; G171-W174 PolarHBondContact O-N 3.21Å; W174-N176 VanDerWaalsContact C-N 3.32Å; W174-N176 PolarHBondContact O-N 3Å; W174-W178 CarbonylContact O-C 3.5Å; W174-W178 PolarHBondContact O-N 2.89Å; W174-F179 PolarHBondContact O-N 3.22Å; W174-S180 VanDerWaalsContact CE2-CA 3.47Å; W174-S180 VanDerWaalsContact CZ2-O 3.25Å; W174-S180 WeakPolarHBondContact CZ2-O 3.15Å; W174-S180 PolarHBondContact O-N 3.12Å; W174-C181 PolarHBondContact NE1-O 2.94Å; W174-I189 HydrophobicContact CB-CD1 4.01Å; W174-I189 HydrophobicContact CG-CD1 4.07Å
175	S	95.8	Very high	94.9	Very high	42 Å²	42	49.2 Å²	49.2	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-66.8	-32.8	179.1	67	0	0	0	0	113.1	G171 A172 L173 F179	G171-S175 WeakPolarHBondContact O-CB 3.4Å; G171-S175 PolarHBondContact O-N 3.09Å; G171-S175 PolarHBondContact O-OG 3.34Å; A172-S175 PolarHBondContact O-OG 3.41Å; A172-S175 VanDerWaalsContact O-OG 3.06Å; L173-S175 PolarHBondContact O-N 3.25Å; S175-F179 VanDerWaalsContact O-CA 3.28Å; S175-F179 WeakPolarHBondContact O-CA 3.22Å
176	N	95.3	Very high	95.1	Very high	24 Å²	24	53.8 Å²	53.8	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-100.1	-28.6	-169	-62.5	-13.1	0	0	0	113.7	S91 N153 Y157 A172 L173 W174	S91-N176 PolarHBondContact OG-O 3.39Å; S91-N176 VanDerWaalsContact OG-O 3.11Å; N153-N176 WeakPolarHBondContact OD1-CB 3.26Å; N153-N176 PolarHBondContact OD1-ND2 3.14Å; N153-N176 PolarHBondContact OD1-OD1 3.04Å; Y157-N176 HydrophobicContact CE1-CB 3.98Å; Y157-N176 WeakPolarHBondContact CE1-ND2 3.37Å; Y157-N176 VanDerWaalsContact OH-CB 3.27Å; Y157-N176 WeakPolarHBondContact OH-CB 3.27Å; A172-N176 VanDerWaalsContact O-CB 3.27Å; A172-N176 WeakPolarHBondContact O-CB 3.36Å; A172-N176 PolarHBondContact O-N 3.07Å; A172-N176 PolarHBondContact O-ND2 3.1Å; A172-N176 VanDerWaalsContact O-ND2 3.08Å; L173-N176 PolarHBondContact O-N 2.91Å; W174-N176 VanDerWaalsContact C-N 3.32Å; W174-N176 PolarHBondContact O-N 3Å
177	I	97.2	Very high	95.3	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.015	32%	0.322	C	S	.	.	H	α-helix	trans	-97.3	-44.4	-178.8	-57.2	-59.3	0	0	0	111.4	L82 L92 L95 L173 L192	L82-I177 HydrophobicContact CD1-CG2 3.7Å; L82-I177 HydrophobicContact CD2-CG2 3.8Å; L82-I177 HydrophobicContact CG-CG2 4.4Å; L92-I177 HydrophobicContact CD2-CD1 4.34Å; L95-I177 HydrophobicContact CD2-CD1 4.39Å; L173-I177 VanDerWaalsContact O-CB 3.25Å; L173-I177 WeakPolarHBondContact O-CB 3.37Å; L173-I177 WeakPolarHBondContact O-CG1 3.23Å; L173-I177 PolarHBondContact O-N 2.7Å; I177-L192 HydrophobicContact CB-CD2 4.31Å; I177-L192 HydrophobicContact CG1-CD2 3.81Å; I177-L192 HydrophobicContact CG2-CD2 4.2Å
178	W	96.5	Very high	95.4	Very high	18 Å²	18	54.1 Å²	54.1	7%	0.068	30%	0.302	C	S	.	.	S	Bend	trans	-100.3	3.3	178.5	-67.1	-92.3	0	0	0	113.4	L80 L82 W174 S180 C181 T184 Q188 I189 L192	L80-W178 HydrophobicContact CB-CZ2 3.87Å; L80-W178 HydrophobicContact CD1-CZ2 4.43Å; L80-W178 HydrophobicContact CD2-CH2 4.45Å; L80-W178 HydrophobicContact CD2-CZ2 4.15Å; L80-W178 HydrophobicContact CG-CZ2 4.38Å; L80-W178 PolarHBondContact O-NE1 2.52Å; L82-W178 HydrophobicContact CD2-CD2 4.21Å; L82-W178 HydrophobicContact CD2-CG 4Å; W174-W178 CarbonylContact O-C 3.5Å; W174-W178 PolarHBondContact O-N 2.89Å; W178-S180 PolarHBondContact O-N 2.76Å; W178-C181 HydrophobicContact CB-CB 4.28Å; W178-C181 WeakPolarHBondContact O-CB 3.46Å; W178-C181 PolarHBondContact O-N 3.06Å; W178-T184 HydrophobicContact CB-CG2 4.35Å; W178-T184 WeakPolarHBondContact CB-OG1 3.45Å; W178-T184 HydrophobicContact CD2-CG2 3.72Å; W178-T184 HydrophobicContact CE3-CG2 4.43Å; W178-T184 HydrophobicContact CG-CG2 3.67Å; W178-T184 VanDerWaalsContact CG-OG1 3.28Å; W178-T184 HydrophobicContact CZ2-CG2 4.42Å; W178-Q188 HydrophobicContact CZ2-CB 3.71Å; W178-I189 HydrophobicContact CE3-CG1 4.36Å; W178-I189 HydrophobicContact CH2-CG1 4.14Å; W178-I189 HydrophobicContact CZ3-CG1 3.99Å; W178-L192 HydrophobicContact CH2-CB 3.99Å; W178-L192 HydrophobicContact CH2-CD2 3.73Å; W178-L192 HydrophobicContact CZ3-CD2 3.75Å
179	F	94.7	Very high	95.5	Very high	97 Å²	97	50.3 Å²	50.3	43%	0.425	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	38.3	-178.9	-59.7	-81.6	0	0	0	113.2	Q87 S91 W174 S175 C181	Q87-F179 HydrophobicContact CG-CE1 4.32Å; Q87-F179 HydrophobicContact CG-CE2 3.67Å; Q87-F179 HydrophobicContact CG-CZ 3.38Å; S91-F179 WeakPolarHBondContact OG-CZ 3.27Å; W174-F179 PolarHBondContact O-N 3.22Å; S175-F179 VanDerWaalsContact O-CA 3.28Å; S175-F179 WeakPolarHBondContact O-CA 3.22Å; F179-C181 PolarHBondContact O-N 2.84Å
180	S	94.1	Very high	95.5	Very high	56 Å²	56	53 Å²	53	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	31.1	-177	-44.3	0	0	0	0	113.7	W174 W178	W174-S180 VanDerWaalsContact CE2-CA 3.47Å; W174-S180 VanDerWaalsContact CZ2-O 3.25Å; W174-S180 WeakPolarHBondContact CZ2-O 3.15Å; W174-S180 PolarHBondContact O-N 3.12Å; W178-S180 PolarHBondContact O-N 2.76Å
181	C	94.1	Very high	95.6	Very high	45 Å²	45	54.4 Å²	54.4	30%	0.304	30%	0.302	S	S	.	.			trans	-61.3	125.6	179.5	-173.3	0	0	0	0	110.7	W174 W178 F179 T183 T184	W174-C181 PolarHBondContact NE1-O 2.94Å; W178-C181 HydrophobicContact CB-CB 4.28Å; W178-C181 WeakPolarHBondContact O-CB 3.46Å; W178-C181 PolarHBondContact O-N 3.06Å; F179-C181 PolarHBondContact O-N 2.84Å; C181-T183 PolarHBondContact O-N 3.24Å; C181-T183 PolarHBondContact SG-OG1 2.89Å; C181-T184 PolarHBondContact O-N 2.63Å; C181-T184 PolarHBondContact O-OG1 3.1Å
182	P	93	Very high	95.6	Very high	123 Å²	123	52.8 Å²	52.8	80%	0.799	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-15.3	-177.9	28.2	-35.4	0	0	0	113.5
183	T	93.7	Very high	95.6	Very high	122 Å²	122	52.9 Å²	52.9	75%	0.748	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.4	179.4	63.8	0	0	0	0	113.6	C181 A185	C181-T183 PolarHBondContact O-N 3.24Å; C181-T183 PolarHBondContact SG-OG1 2.89Å; T183-A185 PolarHBondContact O-N 3.13Å
184	T	94	Very high	95.5	Very high	21 Å²	21	58.6 Å²	58.6	13%	0.129	31%	0.308	C	S	.	.			trans	-63.9	124.6	176.9	-61.4	0	0	0	0	110.3	W178 C181 Q188 I189	W178-T184 HydrophobicContact CB-CG2 4.35Å; W178-T184 WeakPolarHBondContact CB-OG1 3.45Å; W178-T184 HydrophobicContact CD2-CG2 3.72Å; W178-T184 HydrophobicContact CE3-CG2 4.43Å; W178-T184 HydrophobicContact CG-CG2 3.67Å; W178-T184 VanDerWaalsContact CG-OG1 3.28Å; W178-T184 HydrophobicContact CZ2-CG2 4.42Å; C181-T184 PolarHBondContact O-N 2.63Å; C181-T184 PolarHBondContact O-OG1 3.1Å; T184-Q188 HydrophobicContact CG2-CB 4.5Å; T184-I189 HydrophobicContact CG2-CD1 3.91Å; T184-I189 HydrophobicContact CG2-CG1 3.79Å
185	A	95.7	Very high	95.6	Very high	35 Å²	35	54.4 Å²	54.4	29%	0.289	29%	0.293	S	S	.	.			trans	-78.1	140.4	177.9	0	0	0	0	0	110.3	T183 Q187 Q188	T183-A185 PolarHBondContact O-N 3.13Å; A185-Q187 PolarHBondContact O-N 2.86Å; A185-Q187 VanDerWaalsContact O-N 3.16Å; A185-Q188 HydrophobicContact CB-CG 4.18Å; A185-Q188 WeakPolarHBondContact O-CB 3.41Å; A185-Q188 PolarHBondContact O-N 3.3Å
186	F	94.6	Very high	95.6	Very high	135 Å²	135	52.4 Å²	52.4	59%	0.592	28%	0.279	S	S	*	.	H	α-helix	trans	-56.9	-34.7	-179.3	-179.1	-99.8	0	0	0	112.7	Q188 I189 E190	F186-Q188 PolarHBondContact O-N 3.31Å; F186-I189 PolarHBondContact O-N 2.9Å; F186-I189 VanDerWaalsContact O-N 3.14Å; F186-E190 HydrophobicContact CE1-CB 4.43Å; F186-E190 PolarHBondContact O-N 3.45Å
187	Q	95.6	Very high	95.6	Very high	122 Å²	122	57.1 Å²	57.1	57%	0.57	30%	0.295	S	S	*	.	H	α-helix	trans	-59.1	-34.3	177.1	-61.8	85.3	-8.3	0	0	112.4	A185 E190 I191	A185-Q187 PolarHBondContact O-N 2.86Å; A185-Q187 VanDerWaalsContact O-N 3.16Å; Q187-E190 PolarHBondContact O-N 2.88Å; Q187-I191 WeakPolarHBondContact O-CD1 3.12Å; Q187-I191 VanDerWaalsContact O-CG1 3.25Å; Q187-I191 WeakPolarHBondContact O-CG1 3.21Å; Q187-I191 PolarHBondContact O-N 3.4Å
188	Q	96.2	Very high	95.5	Very high	29 Å²	29	58.3 Å²	58.3	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-68.3	-41.4	178.7	-61.1	162.8	-11.7	0	0	110.7	L80 W178 T184 A185 F186 L192	L80-Q188 WeakPolarHBondContact CD2-O 3.29Å; W178-Q188 HydrophobicContact CZ2-CB 3.71Å; T184-Q188 HydrophobicContact CG2-CB 4.5Å; A185-Q188 HydrophobicContact CB-CG 4.18Å; A185-Q188 WeakPolarHBondContact O-CB 3.41Å; A185-Q188 PolarHBondContact O-N 3.3Å; F186-Q188 PolarHBondContact O-N 3.31Å; Q188-L192 PolarHBondContact O-N 3.43Å
189	I	96.7	Very high	95.5	Very high	16 Å²	16	57.4 Å²	57.4	8%	0.082	30%	0.296	C	S	.	.	H	α-helix	trans	-66	-43.1	176.3	-60.8	167.5	0	0	0	109.9	A170 W174 W178 T184 F186 I191 L192 I193	A170-I189 HydrophobicContact CB-CG2 3.84Å; W174-I189 HydrophobicContact CB-CD1 4.01Å; W174-I189 HydrophobicContact CG-CD1 4.07Å; W178-I189 HydrophobicContact CE3-CG1 4.36Å; W178-I189 HydrophobicContact CH2-CG1 4.14Å; W178-I189 HydrophobicContact CZ3-CG1 3.99Å; T184-I189 HydrophobicContact CG2-CD1 3.91Å; T184-I189 HydrophobicContact CG2-CG1 3.79Å; F186-I189 PolarHBondContact O-N 2.9Å; F186-I189 VanDerWaalsContact O-N 3.14Å; I189-I191 PolarHBondContact O-N 2.74Å; I189-L192 PolarHBondContact O-N 3.17Å; I189-L192 VanDerWaalsContact O-N 3.14Å; I189-I193 HydrophobicContact CG2-CD1 3.86Å; I189-I193 HydrophobicContact CG2-CG1 4.33Å; I189-I193 WeakPolarHBondContact O-CG1 3.41Å; I189-I193 PolarHBondContact O-N 2.84Å
190	E	95.8	Very high	95.5	Very high	73 Å²	73	54.3 Å²	54.3	34%	0.341	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-43.6	178.5	-168.4	-169.4	171.4	0	0	112.3	F186 Q187 L192 I193 K194	F186-E190 HydrophobicContact CE1-CB 4.43Å; F186-E190 PolarHBondContact O-N 3.45Å; Q187-E190 PolarHBondContact O-N 2.88Å; E190-L192 VanDerWaalsContact C-N 3.26Å; E190-L192 PolarHBondContact O-N 2.97Å; E190-I193 PolarHBondContact O-N 3.23Å; E190-K194 HydrophobicContact CG-CD 4.47Å; E190-K194 WeakPolarHBondContact O-CG 3.46Å; E190-K194 PolarHBondContact O-N 3.2Å; E190-K194 WeakPolarHBondContact OE1-CE 3.27Å; E190-K194 IonicContact OE1-NZ 2.68Å; E190-K194 PolarHBondContact OE1-NZ 3.01Å
191	I	96.8	Very high	95.5	Very high	46 Å²	46	56.3 Å²	56.3	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-55.4	-45.8	174.4	-71.1	163.6	0	0	0	110.1	L80 Q187 I189 K194 Y195 L222 M223	L80-I191 HydrophobicContact CD2-CB 4.14Å; L80-I191 HydrophobicContact CD2-CG2 3.89Å; Q187-I191 WeakPolarHBondContact O-CD1 3.12Å; Q187-I191 VanDerWaalsContact O-CG1 3.25Å; Q187-I191 WeakPolarHBondContact O-CG1 3.21Å; Q187-I191 PolarHBondContact O-N 3.4Å; I189-I191 PolarHBondContact O-N 2.74Å; I191-K194 PolarHBondContact O-N 3.45Å; I191-Y195 WeakPolarHBondContact O-CB 3.25Å; I191-Y195 PolarHBondContact O-N 3.12Å; I191-L222 HydrophobicContact CG2-CD1 4.01Å; I191-L222 HydrophobicContact CG2-CG 4.27Å; I191-M223 HydrophobicContact CG2-SD 4.08Å
192	L	97.2	Very high	95.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.6	-35.6	-178.2	-169	61.6	0	0	0	112.9	F76 L80 L95 L173 I177 W178 Q188 I189 E190 Y195 V196	F76-L192 HydrophobicContact CE1-CD1 4.39Å; L80-L192 HydrophobicContact CD1-CD1 4.08Å; L80-L192 HydrophobicContact CD1-CD2 4.42Å; L80-L192 HydrophobicContact CD2-CB 4.35Å; L95-L192 HydrophobicContact CD2-CD1 3.91Å; L95-L192 HydrophobicContact CD2-CD2 4.24Å; L95-L192 HydrophobicContact CD2-CG 4.34Å; L173-L192 HydrophobicContact CB-CD2 4.25Å; L173-L192 HydrophobicContact CD1-CB 4.49Å; L173-L192 HydrophobicContact CD1-CD2 4.28Å; L173-L192 HydrophobicContact CD1-CG 4.11Å; L173-L192 HydrophobicContact CD2-CD2 4.01Å; L173-L192 HydrophobicContact CD2-CG 4.39Å; L173-L192 HydrophobicContact CG-CD2 4.41Å; I177-L192 HydrophobicContact CB-CD2 4.31Å; I177-L192 HydrophobicContact CG1-CD2 3.81Å; I177-L192 HydrophobicContact CG2-CD2 4.2Å; W178-L192 HydrophobicContact CH2-CB 3.99Å; W178-L192 HydrophobicContact CH2-CD2 3.73Å; W178-L192 HydrophobicContact CZ3-CD2 3.75Å; Q188-L192 PolarHBondContact O-N 3.43Å; I189-L192 PolarHBondContact O-N 3.17Å; I189-L192 VanDerWaalsContact O-N 3.14Å; E190-L192 VanDerWaalsContact C-N 3.26Å; E190-L192 PolarHBondContact O-N 2.97Å; L192-Y195 HydrophobicContact CD1-CD1 3.94Å; L192-Y195 WeakPolarHBondContact O-CB 3.11Å; L192-Y195 PolarHBondContact O-N 3.15Å; L192-V196 WeakPolarHBondContact O-CG2 3.48Å; L192-V196 PolarHBondContact O-N 3.49Å
193	I	96.5	Very high	95.7	Very high	13 Å²	13	50.7 Å²	50.7	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-48.7	173	-71.2	167.4	0	0	0	110.4	D166 L169 A170 L173 I189 E190 Y195 V196 R197	D166-I193 WeakPolarHBondContact OD1-CG2 3.3Å; L169-I193 HydrophobicContact CD2-CG2 4.24Å; L169-I193 HydrophobicContact CG-CG1 4.43Å; A170-I193 HydrophobicContact CB-CD1 3.72Å; L173-I193 HydrophobicContact CD1-CG1 3.81Å; I189-I193 HydrophobicContact CG2-CD1 3.86Å; I189-I193 HydrophobicContact CG2-CG1 4.33Å; I189-I193 WeakPolarHBondContact O-CG1 3.41Å; I189-I193 PolarHBondContact O-N 2.84Å; E190-I193 PolarHBondContact O-N 3.23Å; I193-Y195 VanDerWaalsContact C-N 3.27Å; I193-Y195 PolarHBondContact O-N 3.37Å; I193-V196 PolarHBondContact O-N 2.86Å; I193-R197 WeakPolarHBondContact O-CG 3.41Å; I193-R197 PolarHBondContact O-N 3.28Å
194	K	95.9	Very high	95.7	Very high	120 Å²	120	49.6 Å²	49.6	52%	0.522	23%	0.232	S	C	.	.	H	α-helix	trans	-57.4	-44.5	176.5	-73.2	175.3	-177.3	167.3	0	110.6	E190 I191 R197 K198	E190-K194 HydrophobicContact CG-CD 4.47Å; E190-K194 WeakPolarHBondContact O-CG 3.46Å; E190-K194 PolarHBondContact O-N 3.2Å; E190-K194 WeakPolarHBondContact OE1-CE 3.27Å; E190-K194 IonicContact OE1-NZ 2.68Å; E190-K194 PolarHBondContact OE1-NZ 3.01Å; I191-K194 PolarHBondContact O-N 3.45Å; K194-R197 PolarHBondContact O-N 3.38Å; K194-K198 WeakPolarHBondContact O-CG 3.38Å; K194-K198 PolarHBondContact O-N 3.25Å
195	Y	97.4	Very high	95.6	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-52.4	175.5	177.6	-102.9	0	0	0	113.2	F76 H96 M99 I191 L192 I193 R197 K198 Q199 L220 L222	F76-Y195 HydrophobicContact CE1-CD1 4.06Å; F76-Y195 AromaticContact CE1-CE1 3.74Å; F76-Y195 HydrophobicContact CE1-CE1 3.74Å; F76-Y195 HydrophobicContact CE1-CE2 4.5Å; F76-Y195 AromaticContact CE1-CZ 4Å; F76-Y195 HydrophobicContact CZ-CD1 4.41Å; F76-Y195 AromaticContact CZ-CE1 3.76Å; F76-Y195 HydrophobicContact CZ-CE1 3.76Å; F76-Y195 AromaticContact CZ-CE2 3.98Å; F76-Y195 HydrophobicContact CZ-CE2 3.98Å; F76-Y195 AromaticContact CZ-CZ 3.52Å; H96-Y195 PolarHBondContact CD2-OH 2.89Å; H96-Y195 AromaticContact NE2-CE1 3.53Å; H96-Y195 AromaticContact NE2-CZ 3.5Å; H96-Y195 PolarHBondContact NE2-OH 3.02Å; M99-Y195 HydrophobicContact CE-CE1 3.98Å; I191-Y195 WeakPolarHBondContact O-CB 3.25Å; I191-Y195 PolarHBondContact O-N 3.12Å; L192-Y195 HydrophobicContact CD1-CD1 3.94Å; L192-Y195 WeakPolarHBondContact O-CB 3.11Å; L192-Y195 PolarHBondContact O-N 3.15Å; I193-Y195 VanDerWaalsContact C-N 3.27Å; I193-Y195 PolarHBondContact O-N 3.37Å; Y195-R197 VanDerWaalsContact C-N 3.29Å; Y195-R197 PolarHBondContact O-N 2.96Å; Y195-K198 WeakPolarHBondContact O-CG 3.46Å; Y195-K198 PolarHBondContact O-N 2.92Å; Y195-Q199 HydrophobicContact CD1-CG 4.28Å; Y195-Q199 HydrophobicContact CD2-CG 4Å; Y195-Q199 HydrophobicContact CE1-CG 3.92Å; Y195-Q199 HydrophobicContact CE2-CG 3.6Å; Y195-Q199 HydrophobicContact CG-CG 4.33Å; Y195-Q199 WeakPolarHBondContact O-CB 3.35Å; Y195-Q199 WeakPolarHBondContact O-CG 3.06Å; Y195-Q199 PolarHBondContact O-N 3.35Å; Y195-Q199 PolarHBondContact OH-NE2 3.48Å; Y195-L220 WeakPolarHBondContact CE2-O 3.43Å; Y195-L222 HydrophobicContact CD1-CD1 4.42Å; Y195-L222 HydrophobicContact CD2-CD1 3.73Å; Y195-L222 HydrophobicContact CE2-CD1 4.44Å; Y195-L222 HydrophobicContact CG-CD1 3.7Å
196	V	96.9	Very high	95.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-43.6	-179.1	168.6	0	0	0	0	110.8	L95 W98 M99 L169 L173 L192 I193 Q199 L200	L95-V196 HydrophobicContact CD1-CG2 4.07Å; L95-V196 HydrophobicContact CD2-CG2 4.02Å; L95-V196 HydrophobicContact CG-CG2 4.36Å; W98-V196 HydrophobicContact CH2-CG1 4.4Å; W98-V196 HydrophobicContact CZ3-CG1 3.84Å; M99-V196 HydrophobicContact SD-CG1 4.35Å; M99-V196 HydrophobicContact SD-CG2 4.42Å; L169-V196 HydrophobicContact CD2-CG1 4.38Å; L173-V196 HydrophobicContact CD1-CG2 4.28Å; L173-V196 HydrophobicContact CD2-CG2 4.23Å; L192-V196 WeakPolarHBondContact O-CG2 3.48Å; L192-V196 PolarHBondContact O-N 3.49Å; I193-V196 PolarHBondContact O-N 2.86Å; V196-Q199 PolarHBondContact O-N 3.37Å; V196-L200 HydrophobicContact CG1-CD1 3.89Å; V196-L200 HydrophobicContact CG1-CG 4.34Å; V196-L200 VanDerWaalsContact O-CG 3.29Å; V196-L200 WeakPolarHBondContact O-CG 3.5Å; V196-L200 PolarHBondContact O-N 2.91Å
197	R	94.9	Very high	95.5	Very high	123 Å²	123	50.7 Å²	50.7	46%	0.464	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-50.6	179.4	-76.9	178.9	156.2	169.5	-5.4	113	D166 I193 K194 Y195 Q199 L200 E201	D166-R197 IonicContact OD1-CZ 3.1Å; D166-R197 IonicContact OD1-NE 2.96Å; D166-R197 PolarHBondContact OD1-NE 3.21Å; D166-R197 IonicContact OD1-NH1 2.69Å; D166-R197 PolarHBondContact OD1-NH1 2.86Å; D166-R197 IonicContact OD1-NH2 2.81Å; D166-R197 PolarHBondContact OD1-NH2 3.46Å; D166-R197 IonicContact OD2-CZ 3.44Å; D166-R197 IonicContact OD2-NH1 2.73Å; D166-R197 PolarHBondContact OD2-NH1 3.41Å; D166-R197 IonicContact OD2-NH2 2.77Å; D166-R197 PolarHBondContact OD2-NH2 2.94Å; I193-R197 WeakPolarHBondContact O-CG 3.41Å; I193-R197 PolarHBondContact O-N 3.28Å; K194-R197 PolarHBondContact O-N 3.38Å; Y195-R197 VanDerWaalsContact C-N 3.29Å; Y195-R197 PolarHBondContact O-N 2.96Å; R197-Q199 PolarHBondContact O-N 3.44Å; R197-L200 PolarHBondContact O-N 3.17Å; R197-E201 PolarHBondContact O-N 3.5Å
198	K	95.1	Very high	95.4	Very high	28 Å²	28	47.2 Å²	47.2	12%	0.122	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-35.2	179.2	70.7	177.5	175.7	179.8	0	111.6	K194 Y195 H202 L220 P221 L222 Q224 D225	K194-K198 WeakPolarHBondContact O-CG 3.38Å; K194-K198 PolarHBondContact O-N 3.25Å; Y195-K198 WeakPolarHBondContact O-CG 3.46Å; Y195-K198 PolarHBondContact O-N 2.92Å; K198-H202 VanDerWaalsContact O-CB 3.27Å; K198-H202 WeakPolarHBondContact O-CB 3.37Å; K198-H202 PolarHBondContact O-N 3.07Å; K198-L220 HydrophobicContact CB-CD1 4.33Å; K198-L220 HydrophobicContact CD-CD1 4.27Å; K198-L220 HydrophobicContact CG-CD1 4.21Å; K198-P221 WeakPolarHBondContact CE-O 3.47Å; K198-P221 PolarHBondContact NZ-O 3.24Å; K198-L222 WeakPolarHBondContact CE-O 3.41Å; K198-L222 PolarHBondContact NZ-O 3.44Å; K198-Q224 PolarHBondContact NZ-O 3.3Å; K198-D225 WeakPolarHBondContact CD-OD1 3.48Å; K198-D225 IonicContact NZ-OD1 2.84Å; K198-D225 PolarHBondContact NZ-OD1 3.38Å
199	Q	96.3	Very high	95.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.6	-44.9	177	-68.4	-66.1	37.8	0	0	112.3	M99 Y195 V196 R197 E201 H202 L203 L220	M99-Q199 HydrophobicContact CE-CB 4.17Å; M99-Q199 HydrophobicContact CE-CG 4.34Å; M99-Q199 HydrophobicContact SD-CB 3.55Å; M99-Q199 VanDerWaalsContact SD-CB 3.55Å; M99-Q199 HydrophobicContact SD-CG 4.26Å; Y195-Q199 HydrophobicContact CD1-CG 4.28Å; Y195-Q199 HydrophobicContact CD2-CG 4Å; Y195-Q199 HydrophobicContact CE1-CG 3.92Å; Y195-Q199 HydrophobicContact CE2-CG 3.6Å; Y195-Q199 HydrophobicContact CG-CG 4.33Å; Y195-Q199 WeakPolarHBondContact O-CB 3.35Å; Y195-Q199 WeakPolarHBondContact O-CG 3.06Å; Y195-Q199 PolarHBondContact O-N 3.35Å; Y195-Q199 PolarHBondContact OH-NE2 3.48Å; V196-Q199 PolarHBondContact O-N 3.37Å; R197-Q199 PolarHBondContact O-N 3.44Å; Q199-E201 VanDerWaalsContact C-N 3.28Å; Q199-E201 PolarHBondContact O-N 2.82Å; Q199-H202 PolarHBondContact O-N 3.41Å; Q199-L203 WeakPolarHBondContact O-CB 3.3Å; Q199-L203 VanDerWaalsContact O-CG 3.23Å; Q199-L203 WeakPolarHBondContact O-CG 3.38Å; Q199-L203 PolarHBondContact O-N 3.04Å; Q199-L220 PolarHBondContact NE2-O 3.04Å
200	L	95.4	Very high	95.1	Very high	32 Å²	32	49.8 Å²	49.8	17%	0.168	24%	0.243	C	C	.	.	H	α-helix	trans	-58	-43.3	176.1	-72.2	173.2	0	0	0	111.2	W98 M99 V102 L161 V196 R197 E204	W98-L200 HydrophobicContact CH2-CD1 3.97Å; W98-L200 HydrophobicContact CH2-CD2 4.47Å; W98-L200 HydrophobicContact CZ3-CD1 4.2Å; W98-L200 HydrophobicContact CZ3-CD2 4.33Å; M99-L200 HydrophobicContact CB-CD2 4.03Å; M99-L200 HydrophobicContact CG-CD2 3.94Å; M99-L200 HydrophobicContact CG-CG 4.36Å; V102-L200 HydrophobicContact CB-CD2 4.01Å; V102-L200 HydrophobicContact CG1-CD2 4.09Å; V102-L200 HydrophobicContact CG2-CD2 4.23Å; L161-L200 HydrophobicContact CD1-CD1 4.02Å; V196-L200 HydrophobicContact CG1-CD1 3.89Å; V196-L200 HydrophobicContact CG1-CG 4.34Å; V196-L200 VanDerWaalsContact O-CG 3.29Å; V196-L200 WeakPolarHBondContact O-CG 3.5Å; V196-L200 PolarHBondContact O-N 2.91Å; R197-L200 PolarHBondContact O-N 3.17Å; L200-E204 WeakPolarHBondContact O-CB 3.47Å; L200-E204 PolarHBondContact O-N 3.24Å
201	E	94.1	Very high	95.1	Very high	97 Å²	97	46.3 Å²	46.3	45%	0.453	23%	0.226	S	C	.	.	H	α-helix	trans	-64.4	-42.3	175.6	-174.5	-178.6	175.5	0	0	112.4	R197 Q199 K205	R197-E201 PolarHBondContact O-N 3.5Å; Q199-E201 VanDerWaalsContact C-N 3.28Å; Q199-E201 PolarHBondContact O-N 2.82Å; E201-K205 WeakPolarHBondContact O-CG 3.34Å; E201-K205 PolarHBondContact O-N 3.34Å; E201-K205 WeakPolarHBondContact OE1-CE 3.48Å; E201-K205 IonicContact OE1-NZ 2.95Å; E201-K205 PolarHBondContact OE1-NZ 3.18Å
202	H	94.8	Very high	94.9	Very high	50 Å²	50	44.1 Å²	44.1	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-46.6	178.1	-178.9	72.4	0	0	0	112.2	K198 Q199 K205 T206 M218 L220	K198-H202 VanDerWaalsContact O-CB 3.27Å; K198-H202 WeakPolarHBondContact O-CB 3.37Å; K198-H202 PolarHBondContact O-N 3.07Å; Q199-H202 PolarHBondContact O-N 3.41Å; H202-K205 PolarHBondContact O-N 3.24Å; H202-T206 PolarHBondContact O-N 3.39Å; H202-T206 PolarHBondContact O-OG1 3.17Å; H202-M218 PolarHBondContact CD2-O 3.29Å; H202-M218 VanDerWaalsContact CD2-O 3.28Å; H202-M218 PolarHBondContact NE2-O 3.19Å; H202-M218 VanDerWaalsContact NE2-O 3.11Å; H202-L220 HydrophobicContact CB-CD1 3.81Å; H202-L220 HydrophobicContact CB-CG 4.13Å
203	L	95.3	Very high	94.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-36.8	179.4	-64.2	179.3	0	0	0	111.4	M99 R103 Q199 K205 T206 F211 P217 F219	M99-L203 HydrophobicContact CB-CD1 3.86Å; R103-L203 HydrophobicContact CB-CB 4.26Å; R103-L203 WeakPolarHBondContact CD-O 3.46Å; R103-L203 HydrophobicContact CG-CB 4.24Å; R103-L203 PolarHBondContact NE-O 2.91Å; Q199-L203 WeakPolarHBondContact O-CB 3.3Å; Q199-L203 VanDerWaalsContact O-CG 3.23Å; Q199-L203 WeakPolarHBondContact O-CG 3.38Å; Q199-L203 PolarHBondContact O-N 3.04Å; L203-K205 VanDerWaalsContact C-N 3.29Å; L203-K205 PolarHBondContact O-N 3.17Å; L203-T206 VanDerWaalsContact O-CB 3.31Å; L203-T206 WeakPolarHBondContact O-CB 3.36Å; L203-T206 PolarHBondContact O-N 3.33Å; L203-T206 VanDerWaalsContact O-N 3.12Å; L203-F211 HydrophobicContact CB-CZ 4.36Å; L203-F211 HydrophobicContact CD2-CZ 4.05Å; L203-P217 HydrophobicContact CD2-CB 4.09Å; L203-F219 HydrophobicContact CD1-CE1 3.94Å; L203-F219 HydrophobicContact CD2-CE1 4.34Å
204	E	93.6	Very high	94.4	Very high	99 Å²	99	50.9 Å²	50.9	46%	0.463	25%	0.252	S	S	.	.	H	α-helix	trans	-56.5	-42.7	173.4	-174.5	173.6	-162.1	0	0	112	H26 L200 T206	H26-E204 IonicContact CD2-OE1 2.64Å; H26-E204 IonicContact NE2-OE1 3.24Å; H26-E204 PolarHBondContact NE2-OE1 3.08Å; L200-E204 WeakPolarHBondContact O-CB 3.47Å; L200-E204 PolarHBondContact O-N 3.24Å; E204-T206 VanDerWaalsContact C-N 3.26Å; E204-T206 PolarHBondContact O-N 3.06Å
205	K	92.6	Very high	94.2	Very high	120 Å²	120	45.1 Å²	45.1	52%	0.522	23%	0.227	S	C	.	.	H	α-helix	trans	-74.9	-12.4	179.2	-67	171.5	-171.2	172.3	0	113.9	Y22 E201 H202 L203	Y22-K205 WeakPolarHBondContact OH-CE 3.13Å; E201-K205 WeakPolarHBondContact O-CG 3.34Å; E201-K205 PolarHBondContact O-N 3.34Å; E201-K205 WeakPolarHBondContact OE1-CE 3.48Å; E201-K205 IonicContact OE1-NZ 2.95Å; E201-K205 PolarHBondContact OE1-NZ 3.18Å; H202-K205 PolarHBondContact O-N 3.24Å; L203-K205 VanDerWaalsContact C-N 3.29Å; L203-K205 PolarHBondContact O-N 3.17Å
206	T	93.6	Very high	94	Very high	18 Å²	18	46 Å²	46	11%	0.11	23%	0.234	C	C	.	.	S	Bend	trans	-74	133.1	-178.6	-62.7	0	0	0	0	110	R103 H202 L203 E204 V210 F211	R103-T206 PolarHBondContact NE-O 3.47Å; R103-T206 PolarHBondContact NH2-O 3.21Å; H202-T206 PolarHBondContact O-N 3.39Å; H202-T206 PolarHBondContact O-OG1 3.17Å; L203-T206 VanDerWaalsContact O-CB 3.31Å; L203-T206 WeakPolarHBondContact O-CB 3.36Å; L203-T206 PolarHBondContact O-N 3.33Å; L203-T206 VanDerWaalsContact O-N 3.12Å; E204-T206 VanDerWaalsContact C-N 3.26Å; E204-T206 PolarHBondContact O-N 3.06Å; T206-V210 HydrophobicContact CG2-CB 3.76Å; T206-V210 HydrophobicContact CG2-CG1 3.74Å; T206-V210 HydrophobicContact CG2-CG2 4.24Å; T206-F211 HydrophobicContact CG2-CD2 4.04Å; T206-F211 HydrophobicContact CG2-CE2 3.67Å
207	P	94.6	Very high	93.9	Very high	75 Å²	75	46 Å²	46	49%	0.487	23%	0.234	S	C	.	.			trans	-69	151.7	-175.6	29.2	-36.5	0	0	0	112.6	N209 V210	P207-N209 VanDerWaalsContact C-N 3.28Å; P207-N209 VanDerWaalsContact CB-OD1 3.28Å; P207-N209 WeakPolarHBondContact CB-OD1 3.32Å; P207-N209 WeakPolarHBondContact CG-OD1 3.38Å; P207-N209 PolarHBondContact O-N 3.43Å; P207-V210 HydrophobicContact CG-CG2 3.85Å; P207-V210 WeakPolarHBondContact O-CB 3.42Å; P207-V210 PolarHBondContact O-N 3.41Å; P207-V210 VanDerWaalsContact O-N 3.09Å
208	S	93.3	Very high	93.8	Very high	49 Å²	49	43.3 Å²	43.3	34%	0.343	23%	0.228	S	C	.	.	H	α-helix	trans	-58.5	-34.6	-174.7	-60.9	0	0	0	0	114.1	E107 V210 F211 L212	E107-S208 VanDerWaalsContact CD-OG 3.26Å; E107-S208 VanDerWaalsContact OE1-CB 3.27Å; E107-S208 WeakPolarHBondContact OE1-CB 3.44Å; E107-S208 PolarHBondContact OE1-OG 2.79Å; E107-S208 VanDerWaalsContact OE2-CB 3.29Å; E107-S208 WeakPolarHBondContact OE2-CB 3.31Å; E107-S208 PolarHBondContact OE2-OG 2.84Å; E107-S208 VanDerWaalsContact OE2-OG 3.04Å; S208-V210 PolarHBondContact O-N 2.91Å; S208-F211 PolarHBondContact O-N 2.93Å; S208-L212 WeakPolarHBondContact O-CB 3.5Å; S208-L212 WeakPolarHBondContact O-CG 3.4Å; S208-L212 PolarHBondContact O-N 2.83Å
209	N	93.3	Very high	93.8	Very high	70 Å²	70	42.1 Å²	42.1	37%	0.374	22%	0.223	S	C	.	.	H	α-helix	trans	-61	-30.6	178.1	68.3	-41.3	0	0	0	112.5	Y51 P207 F211 E213 S214	Y51-N209 WeakPolarHBondContact OH-CB 3.49Å; P207-N209 VanDerWaalsContact C-N 3.28Å; P207-N209 VanDerWaalsContact CB-OD1 3.28Å; P207-N209 WeakPolarHBondContact CB-OD1 3.32Å; P207-N209 WeakPolarHBondContact CG-OD1 3.38Å; P207-N209 PolarHBondContact O-N 3.43Å; N209-F211 VanDerWaalsContact C-N 3.28Å; N209-F211 PolarHBondContact O-N 2.99Å; N209-E213 HydrophobicContact CB-CB 4.48Å; N209-E213 WeakPolarHBondContact O-CA 3.47Å; N209-E213 WeakPolarHBondContact O-CB 3.38Å; N209-E213 PolarHBondContact O-N 3.12Å; N209-S214 PolarHBondContact O-N 3.32Å
210	V	94.7	Very high	93.7	Very high	30 Å²	30	42.8 Å²	42.8	18%	0.182	23%	0.226	C	C	.	.	I	π-helix	trans	-67.8	-30.8	176.8	174.6	0	0	0	0	111.7	T206 P207 S208 S214 G215 A216 P217	T206-V210 HydrophobicContact CG2-CB 3.76Å; T206-V210 HydrophobicContact CG2-CG1 3.74Å; T206-V210 HydrophobicContact CG2-CG2 4.24Å; P207-V210 HydrophobicContact CG-CG2 3.85Å; P207-V210 WeakPolarHBondContact O-CB 3.42Å; P207-V210 PolarHBondContact O-N 3.41Å; P207-V210 VanDerWaalsContact O-N 3.09Å; S208-V210 PolarHBondContact O-N 2.91Å; V210-S214 WeakPolarHBondContact CA-OG 3.28Å; V210-S214 PolarHBondContact O-OG 3.25Å; V210-S214 VanDerWaalsContact O-OG 3.06Å; V210-G215 VanDerWaalsContact O-CA 3.3Å; V210-G215 WeakPolarHBondContact O-CA 3.47Å; V210-G215 PolarHBondContact O-N 3.42Å; V210-A216 PolarHBondContact O-N 2.92Å; V210-P217 HydrophobicContact CG1-CB 4.07Å
211	F	94.7	Very high	93.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-90.3	-29	177.5	-81.9	-89.8	0	0	0	114	S59 L63 C100 R103 L104 L203 T206 S208 N209 P217	S59-F211 PolarHBondContact OG-O 3.02Å; L63-F211 HydrophobicContact CD1-CD1 4.18Å; L63-F211 HydrophobicContact CD2-CD1 3.81Å; L63-F211 HydrophobicContact CD2-CE1 3.95Å; C100-F211 HydrophobicContact CB-CE1 4.31Å; R103-F211 HydrophobicContact CB-CE1 4.28Å; R103-F211 HydrophobicContact CB-CZ 4.06Å; R103-F211 HydrophobicContact CG-CD1 4.38Å; R103-F211 HydrophobicContact CG-CD2 4.09Å; R103-F211 HydrophobicContact CG-CE1 3.83Å; R103-F211 HydrophobicContact CG-CE2 3.49Å; R103-F211 VanDerWaalsContact CG-CE2 3.49Å; R103-F211 HydrophobicContact CG-CG 4.48Å; R103-F211 HydrophobicContact CG-CZ 3.35Å; L104-F211 HydrophobicContact CD2-CB 4.01Å; L104-F211 HydrophobicContact CD2-CD1 3.87Å; L104-F211 HydrophobicContact CD2-CG 4.33Å; L104-F211 HydrophobicContact CG-CD1 4.05Å; L203-F211 HydrophobicContact CB-CZ 4.36Å; L203-F211 HydrophobicContact CD2-CZ 4.05Å; T206-F211 HydrophobicContact CG2-CD2 4.04Å; T206-F211 HydrophobicContact CG2-CE2 3.67Å; S208-F211 PolarHBondContact O-N 2.93Å; N209-F211 VanDerWaalsContact C-N 3.28Å; N209-F211 PolarHBondContact O-N 2.99Å; F211-P217 HydrophobicContact CE1-CB 4.35Å; F211-P217 HydrophobicContact CE1-CG 4.03Å; F211-P217 HydrophobicContact CE2-CB 4.02Å; F211-P217 HydrophobicContact CZ-CB 3.83Å; F211-P217 HydrophobicContact CZ-CG 4Å
212	L	93.1	Very high	93.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-100.9	-30.2	-174	-61.1	-175.3	0	0	0	113.3	Y51 L56 S59 E107 E110 V114 S208	Y51-L212 HydrophobicContact CD2-CB 3.7Å; Y51-L212 HydrophobicContact CD2-CD1 4.13Å; Y51-L212 HydrophobicContact CE2-CB 3.63Å; Y51-L212 HydrophobicContact CE2-CD1 3.97Å; Y51-L212 HydrophobicContact CE2-CG 4.47Å; L56-L212 HydrophobicContact CD2-CB 4.17Å; L56-L212 HydrophobicContact CD2-CD2 4.21Å; S59-L212 WeakPolarHBondContact CB-O 3.32Å; E107-L212 HydrophobicContact CB-CD1 4.33Å; E107-L212 HydrophobicContact CB-CD2 4.03Å; E107-L212 HydrophobicContact CG-CD1 4.4Å; E107-L212 HydrophobicContact CG-CD2 4.11Å; E107-L212 HydrophobicContact CG-CG 4.32Å; E110-L212 HydrophobicContact CB-CD1 3.96Å; E110-L212 HydrophobicContact CB-CD2 3.81Å; E110-L212 HydrophobicContact CB-CG 4.5Å; V114-L212 HydrophobicContact CG2-CD2 3.9Å; S208-L212 WeakPolarHBondContact O-CB 3.5Å; S208-L212 WeakPolarHBondContact O-CG 3.4Å; S208-L212 PolarHBondContact O-N 2.83Å
213	E	90.7	Very high	93.6	Very high	103 Å²	103	41 Å²	41	48%	0.481	22%	0.221	S	C	.	.	I	π-helix	trans	-102.2	-60.1	-176.4	-166.1	177.9	-177.3	0	0	112.2	Y51 T55 N209	Y51-E213 HydrophobicContact CD1-CB 4.22Å; Y51-E213 HydrophobicContact CD1-CG 4.28Å; Y51-E213 HydrophobicContact CE1-CB 3.67Å; Y51-E213 HydrophobicContact CE1-CG 3.84Å; T55-E213 HydrophobicContact CG2-CB 4.48Å; T55-E213 HydrophobicContact CG2-CG 4.15Å; N209-E213 HydrophobicContact CB-CB 4.48Å; N209-E213 WeakPolarHBondContact O-CA 3.47Å; N209-E213 WeakPolarHBondContact O-CB 3.38Å; N209-E213 PolarHBondContact O-N 3.12Å
214	S	91.9	Very high	93.4	Very high	51 Å²	51	46 Å²	46	36%	0.357	24%	0.244	S	C	.	.	I	π-helix	trans	-85.8	-35.1	-175.4	67.8	0	0	0	0	113.4	N62 N209 V210 A216	N62-S214 PolarHBondContact ND2-O 3.21Å; N209-S214 PolarHBondContact O-N 3.32Å; V210-S214 WeakPolarHBondContact CA-OG 3.28Å; V210-S214 PolarHBondContact O-OG 3.25Å; V210-S214 VanDerWaalsContact O-OG 3.06Å; S214-A216 PolarHBondContact O-N 3.43Å; S214-A216 PolarHBondContact OG-N 3.1Å
215	G	92.2	Very high	93.1	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.			trans	67.1	26.1	-174	0	0	0	0	0	113.3	S59 N62 L63 V210 P217	S59-G215 WeakPolarHBondContact O-CA 3.44Å; S59-G215 WeakPolarHBondContact OG-CA 3.5Å; S59-G215 PolarHBondContact OG-N 3.3Å; S59-G215 VanDerWaalsContact OG-N 3.1Å; N62-G215 CarbonylContact C-O 3.5Å; N62-G215 VanDerWaalsContact C-O 3.25Å; N62-G215 WeakPolarHBondContact CB-O 3.42Å; L63-G215 WeakPolarHBondContact CA-O 3.37Å; L63-G215 PolarHBondContact N-O 3.23Å; L63-G215 VanDerWaalsContact N-O 3.1Å; V210-G215 VanDerWaalsContact O-CA 3.3Å; V210-G215 WeakPolarHBondContact O-CA 3.47Å; V210-G215 PolarHBondContact O-N 3.42Å; G215-P217 WeakPolarHBondContact O-CD 3.38Å
216	A	93	Very high	92.8	Very high	19 Å²	19	49 Å²	49	16%	0.157	26%	0.264	C	S	.	.			trans	-126.9	57.6	-171.8	0	0	0	0	0	113.2	I66 V210 S214 L236	I66-A216 HydrophobicContact CD1-CB 4.41Å; I66-A216 HydrophobicContact CG1-CB 4.48Å; V210-A216 PolarHBondContact O-N 2.92Å; S214-A216 PolarHBondContact O-N 3.43Å; S214-A216 PolarHBondContact OG-N 3.1Å; A216-L236 HydrophobicContact CB-CD2 4.11Å
217	P	93.6	Very high	92.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-64.7	139.3	171.4	31	-35	0	0	0	110	L63 I66 L203 V210 F211 G215	L63-P217 HydrophobicContact CD2-CG 3.44Å; L63-P217 VanDerWaalsContact CD2-CG 3.44Å; I66-P217 HydrophobicContact CG2-CG 4.4Å; I66-P217 WeakPolarHBondContact CG2-O 3.49Å; L203-P217 HydrophobicContact CD2-CB 4.09Å; V210-P217 HydrophobicContact CG1-CB 4.07Å; F211-P217 HydrophobicContact CE1-CB 4.35Å; F211-P217 HydrophobicContact CE1-CG 4.03Å; F211-P217 HydrophobicContact CE2-CB 4.02Å; F211-P217 HydrophobicContact CZ-CB 3.83Å; F211-P217 HydrophobicContact CZ-CG 4Å; G215-P217 WeakPolarHBondContact O-CD 3.38Å
218	M	93.4	Very high	92.1	Very high	67 Å²	67	51 Å²	51	33%	0.33	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-87.6	137.6	175.3	-63.7	179.8	-64.9	0	0	108.7	Y70 H202 L227 A232 L236	Y70-M218 HydrophobicContact CE2-CG 4.41Å; Y70-M218 WeakPolarHBondContact OH-CB 3.48Å; H202-M218 PolarHBondContact CD2-O 3.29Å; H202-M218 VanDerWaalsContact CD2-O 3.28Å; H202-M218 PolarHBondContact NE2-O 3.19Å; H202-M218 VanDerWaalsContact NE2-O 3.11Å; M218-L227 HydrophobicContact CB-CD1 3.91Å; M218-L227 HydrophobicContact CB-CD2 4.37Å; M218-L227 HydrophobicContact CE-CD2 3.64Å; M218-L227 HydrophobicContact SD-CD2 3.72Å; M218-A232 HydrophobicContact SD-CB 3.77Å; M218-L236 HydrophobicContact CG-CD1 4.07Å; M218-L236 HydrophobicContact CG-CD2 4.38Å; M218-L236 HydrophobicContact CG-CG 4.32Å; M218-L236 HydrophobicContact SD-CD1 3.96Å
219	F	94.4	Very high	91.8	Very high	3 Å²	3	52.3 Å²	52.3	1%	0.013	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-96	141.6	174.3	-76.6	-81.4	0	0	0	109.7	I66 Y70 P71 H96 M99 L203	I66-F219 HydrophobicContact CG2-CD2 4.14Å; I66-F219 HydrophobicContact CG2-CE2 3.94Å; Y70-F219 HydrophobicContact CD1-CB 3.84Å; Y70-F219 HydrophobicContact CD1-CD2 4.14Å; Y70-F219 HydrophobicContact CE1-CB 4Å; Y70-F219 VanDerWaalsContact CE1-N 3.3Å; Y70-F219 WeakPolarHBondContact CE1-O 3.33Å; P71-F219 HydrophobicContact CG-CD2 4.36Å; H96-F219 HydrophobicContact CB-CE1 4.32Å; H96-F219 HydrophobicContact CB-CZ 3.97Å; H96-F219 AromaticContact CD2-CD1 3.9Å; H96-F219 AromaticContact CD2-CE1 3.72Å; M99-F219 HydrophobicContact CE-CE1 4.16Å; L203-F219 HydrophobicContact CD1-CE1 3.94Å; L203-F219 HydrophobicContact CD2-CE1 4.34Å
220	L	95.1	Very high	91.6	Very high	15 Å²	15	52.8 Å²	52.8	8%	0.079	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-65.3	146.5	168.7	-60.2	175.7	0	0	0	110.7	Y195 K198 Q199 H202 L227	Y195-L220 WeakPolarHBondContact CE2-O 3.43Å; K198-L220 HydrophobicContact CB-CD1 4.33Å; K198-L220 HydrophobicContact CD-CD1 4.27Å; K198-L220 HydrophobicContact CG-CD1 4.21Å; Q199-L220 PolarHBondContact NE2-O 3.04Å; H202-L220 HydrophobicContact CB-CD1 3.81Å; H202-L220 HydrophobicContact CB-CG 4.13Å; L220-L227 HydrophobicContact CD2-CB 4.25Å
221	P	94.2	Very high	91.3	Very high	28 Å²	28	54.3 Å²	54.3	18%	0.182	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-61.5	156.7	173.3	-20.7	32.6	0	0	0	112.2	K198 M223 Q224	K198-P221 WeakPolarHBondContact CE-O 3.47Å; K198-P221 PolarHBondContact NZ-O 3.24Å; P221-M223 VanDerWaalsContact C-N 3.34Å; P221-M223 PolarHBondContact O-N 3.27Å; P221-Q224 HydrophobicContact CB-CB 4Å; P221-Q224 HydrophobicContact CB-CG 4.33Å; P221-Q224 HydrophobicContact CG-CB 4.09Å
222	L	94.8	Very high	91	Very high	8 Å²	8	54.5 Å²	54.5	4%	0.042	30%	0.3	C	S	.	.	S	Bend	trans	-55.8	-48.3	-177.4	178.7	58.3	0	0	0	112.1	F76 H79 I191 Y195 K198	F76-L222 HydrophobicContact CD1-CD1 4.18Å; F76-L222 HydrophobicContact CD1-CD2 4.08Å; F76-L222 HydrophobicContact CD2-CD2 4.5Å; F76-L222 HydrophobicContact CE1-CD1 3.79Å; F76-L222 HydrophobicContact CE1-CD2 4.39Å; F76-L222 HydrophobicContact CE1-CG 4.49Å; F76-L222 HydrophobicContact CE2-CB 4.38Å; F76-L222 HydrophobicContact CG-CD2 4.13Å; F76-L222 HydrophobicContact CZ-CB 4.27Å; F76-L222 HydrophobicContact CZ-CD1 4.2Å; H79-L222 HydrophobicContact CB-CD2 3.93Å; I191-L222 HydrophobicContact CG2-CD1 4.01Å; I191-L222 HydrophobicContact CG2-CG 4.27Å; Y195-L222 HydrophobicContact CD1-CD1 4.42Å; Y195-L222 HydrophobicContact CD2-CD1 3.73Å; Y195-L222 HydrophobicContact CE2-CD1 4.44Å; Y195-L222 HydrophobicContact CG-CD1 3.7Å; K198-L222 WeakPolarHBondContact CE-O 3.41Å; K198-L222 PolarHBondContact NZ-O 3.44Å
223	M	92.7	Very high	90.9	Very high	106 Å²	106	61.2 Å²	61.2	52%	0.522	33%	0.33	S	S	.	.	S	Bend	trans	-97.4	-11.2	-172.9	-60.5	-57	-66.9	0	0	114.5	I191 P221	I191-M223 HydrophobicContact CG2-SD 4.08Å; P221-M223 VanDerWaalsContact C-N 3.34Å; P221-M223 PolarHBondContact O-N 3.27Å
224	Q	90.9	Very high	90.8	Very high	104 Å²	104	62.7 Å²	62.7	49%	0.486	34%	0.337	S	S	.	.			trans	-111.9	144.1	-175.7	-57.3	174.6	3.7	0	0	110.7	K198 P221	K198-Q224 PolarHBondContact NZ-O 3.3Å; P221-Q224 HydrophobicContact CB-CB 4Å; P221-Q224 HydrophobicContact CB-CG 4.33Å; P221-Q224 HydrophobicContact CG-CB 4.09Å
225	D	87.7	Confident	90.8	Very high	122 Å²	122	62.4 Å²	62.4	65%	0.652	33%	0.328	S	S	*	.	S	Bend	trans	-93.2	-14	-179.6	-62.9	-30.2	0	0	0	112.8	K198	K198-D225 WeakPolarHBondContact CD-OD1 3.48Å; K198-D225 IonicContact NZ-OD1 2.84Å; K198-D225 PolarHBondContact NZ-OD1 3.38Å
226	E	87.4	Confident	90.7	Very high	162 Å²	162	64.2 Å²	64.2	76%	0.757	34%	0.337	S	S	*	.	S	Bend	trans	-112.6	154.2	179	-64	-172.8	171.4	0	0	111.5
227	L	85.2	Confident	90.4	Very high	55 Å²	55	71.3 Å²	71.3	29%	0.288	36%	0.36	S	S	.	.			trans	-94.1	114.6	178.9	-168	98.8	0	0	0	109.6	M218 L220 A229 A232	M218-L227 HydrophobicContact CB-CD1 3.91Å; M218-L227 HydrophobicContact CB-CD2 4.37Å; M218-L227 HydrophobicContact CE-CD2 3.64Å; M218-L227 HydrophobicContact SD-CD2 3.72Å; L220-L227 HydrophobicContact CD2-CB 4.25Å; L227-A229 PolarHBondContact O-N 2.81Å; L227-A232 HydrophobicContact CD1-CB 4.03Å; L227-A232 HydrophobicContact CD2-CB 3.51Å; L227-A232 HydrophobicContact CG-CB 3.75Å
228	D	87.6	Confident	90.1	Very high	80 Å²	80	76 Å²	76	43%	0.428	38%	0.378	S	S	.	.			trans	-70	112.6	165.2	-179	-12.6	0	0	0	109.1	S230 L231 A232	D228-S230 VanDerWaalsContact CG-OG 3.26Å; D228-S230 PolarHBondContact O-N 2.96Å; D228-S230 WeakPolarHBondContact OD1-CB 3.3Å; D228-S230 PolarHBondContact OD1-N 3.09Å; D228-S230 PolarHBondContact OD1-OG 2.79Å; D228-S230 PolarHBondContact OD2-OG 3.27Å; D228-L231 HydrophobicContact CB-CB 4.04Å; D228-L231 PolarHBondContact O-N 3.13Å; D228-A232 VanDerWaalsContact O-CB 3.31Å; D228-A232 WeakPolarHBondContact O-CB 3.41Å; D228-A232 PolarHBondContact O-N 2.89Å
229	A	87.4	Confident	89.9	Confident	76 Å²	76	72.8 Å²	72.8	63%	0.628	36%	0.363	S	S	*	.	H	α-helix	trans	-57.9	-31.6	-178.2	0	0	0	0	0	113	L227 K233	L227-A229 PolarHBondContact O-N 2.81Å; A229-K233 WeakPolarHBondContact O-CB 2.94Å; A229-K233 PolarHBondContact O-N 3.37Å; A229-K233 VanDerWaalsContact O-N 3.12Å
230	S	89.4	Confident	88.9	Confident	79 Å²	79	78 Å²	78	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-69.7	-50.5	179.6	73.8	0	0	0	0	110.9	D228 K233 Q234	D228-S230 VanDerWaalsContact CG-OG 3.26Å; D228-S230 PolarHBondContact O-N 2.96Å; D228-S230 WeakPolarHBondContact OD1-CB 3.3Å; D228-S230 PolarHBondContact OD1-N 3.09Å; D228-S230 PolarHBondContact OD1-OG 2.79Å; D228-S230 PolarHBondContact OD2-OG 3.27Å; S230-K233 PolarHBondContact O-N 2.63Å; S230-Q234 PolarHBondContact O-N 3.05Å; S230-Q234 VanDerWaalsContact O-N 3.08Å
231	L	88.1	Confident	88.1	Confident	63 Å²	63	82.1 Å²	82.1	33%	0.33	42%	0.416	S	S	.	.	H	α-helix	trans	-61.8	-45.5	176.7	-179.1	62	0	0	0	110.6	D228 K233 Q234 R235	D228-L231 HydrophobicContact CB-CB 4.04Å; D228-L231 PolarHBondContact O-N 3.13Å; L231-K233 VanDerWaalsContact C-N 3.33Å; L231-K233 PolarHBondContact O-N 3.04Å; L231-Q234 WeakPolarHBondContact O-CB 3.26Å; L231-Q234 PolarHBondContact O-N 2.75Å; L231-Q234 VanDerWaalsContact O-N 3.13Å; L231-R235 HydrophobicContact CD1-CG 4.19Å; L231-R235 HydrophobicContact CG-CG 4.33Å; L231-R235 WeakPolarHBondContact O-CG 3.19Å; L231-R235 PolarHBondContact O-N 2.8Å
232	A	88.9	Confident	86.6	Confident	3 Å²	3	83.3 Å²	83.3	3%	0.025	42%	0.418	C	S	.	.	H	α-helix	trans	-60	-42.8	-179.4	0	0	0	0	0	112.5	Y70 M218 L227 D228 R235 L236	Y70-A232 VanDerWaalsContact OH-CA 3.29Å; Y70-A232 WeakPolarHBondContact OH-CA 3.34Å; Y70-A232 VanDerWaalsContact OH-CB 3.27Å; Y70-A232 WeakPolarHBondContact OH-CB 3.5Å; M218-A232 HydrophobicContact SD-CB 3.77Å; L227-A232 HydrophobicContact CD1-CB 4.03Å; L227-A232 HydrophobicContact CD2-CB 3.51Å; L227-A232 HydrophobicContact CG-CB 3.75Å; D228-A232 VanDerWaalsContact O-CB 3.31Å; D228-A232 WeakPolarHBondContact O-CB 3.41Å; D228-A232 PolarHBondContact O-N 2.89Å; A232-R235 PolarHBondContact O-N 3.12Å; A232-L236 WeakPolarHBondContact O-CB 3.34Å; A232-L236 WeakPolarHBondContact O-CG 3.37Å; A232-L236 PolarHBondContact O-N 3.17Å
233	K	89.3	Confident	84.8	Confident	142 Å²	142	84.7 Å²	84.7	62%	0.617	43%	0.428	S	S	*	.	H	α-helix	trans	-65.8	-38.8	176	-173.1	176.6	-177.5	176.7	0	112	A229 S230 L231 R237	A229-K233 WeakPolarHBondContact O-CB 2.94Å; A229-K233 PolarHBondContact O-N 3.37Å; A229-K233 VanDerWaalsContact O-N 3.12Å; S230-K233 PolarHBondContact O-N 2.63Å; L231-K233 VanDerWaalsContact C-N 3.33Å; L231-K233 PolarHBondContact O-N 3.04Å; K233-R237 WeakPolarHBondContact O-CB 3.44Å; K233-R237 PolarHBondContact O-N 3.38Å
234	Q	89.9	Confident	82.7	Confident	134 Å²	134	87.2 Å²	87.2	63%	0.626	44%	0.438	S	S	*	.	H	α-helix	trans	-64.3	-46	175.6	-177	-178.4	-2.6	0	0	111.3	S230 L231 R237 Y238	S230-Q234 PolarHBondContact O-N 3.05Å; S230-Q234 VanDerWaalsContact O-N 3.08Å; L231-Q234 WeakPolarHBondContact O-CB 3.26Å; L231-Q234 PolarHBondContact O-N 2.75Å; L231-Q234 VanDerWaalsContact O-N 3.13Å; Q234-R237 PolarHBondContact O-N 3.35Å; Q234-Y238 PolarHBondContact O-N 2.82Å
235	R	91.1	Very high	80.3	Confident	45 Å²	45	89.3 Å²	89.3	17%	0.17	45%	0.448	C	S	.	.	H	α-helix	trans	-63.8	-43.9	177.3	-65.7	-61.3	-68.6	174.8	-7	111.8	E69 Y70 P71 L231 A232 R237 Y238 C239	E69-R235 PolarHBondContact O-NH2 3.02Å; Y70-R235 HydrophobicContact CD2-CB 3.73Å; Y70-R235 HydrophobicContact CE2-CB 3.5Å; Y70-R235 HydrophobicContact CG-CB 4.36Å; Y70-R235 VanDerWaalsContact O-CZ 3.31Å; Y70-R235 PolarHBondContact O-NE 3.26Å; Y70-R235 PolarHBondContact O-NH2 3.09Å; P71-R235 PolarHBondContact O-NH2 3.11Å; P71-R235 VanDerWaalsContact O-NH2 3.12Å; L231-R235 HydrophobicContact CD1-CG 4.19Å; L231-R235 HydrophobicContact CG-CG 4.33Å; L231-R235 WeakPolarHBondContact O-CG 3.19Å; L231-R235 PolarHBondContact O-N 2.8Å; A232-R235 PolarHBondContact O-N 3.12Å; R235-R237 VanDerWaalsContact C-N 3.34Å; R235-R237 PolarHBondContact O-N 3.17Å; R235-Y238 WeakPolarHBondContact O-CB 2.91Å; R235-Y238 PolarHBondContact O-N 3.32Å; R235-C239 PolarHBondContact O-N 2.94Å; R235-C239 PolarHBondContact O-SG 3.38Å
236	L	89.7	Confident	78.1	Confident	38 Å²	38	90.3 Å²	90.3	20%	0.199	44%	0.443	C	S	.	.	H	α-helix	trans	-58.2	-45.8	174	-77.9	-178.7	0	0	0	111.9	I66 Y70 A216 M218 A232 Y238 C239 L240	I66-L236 HydrophobicContact CD1-CD2 3.63Å; Y70-L236 HydrophobicContact CD2-CD2 4Å; Y70-L236 HydrophobicContact CD2-CG 4.44Å; Y70-L236 HydrophobicContact CE2-CD2 3.78Å; Y70-L236 HydrophobicContact CE2-CG 3.83Å; A216-L236 HydrophobicContact CB-CD2 4.11Å; M218-L236 HydrophobicContact CG-CD1 4.07Å; M218-L236 HydrophobicContact CG-CD2 4.38Å; M218-L236 HydrophobicContact CG-CG 4.32Å; M218-L236 HydrophobicContact SD-CD1 3.96Å; A232-L236 WeakPolarHBondContact O-CB 3.34Å; A232-L236 WeakPolarHBondContact O-CG 3.37Å; A232-L236 PolarHBondContact O-N 3.17Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.25Å; L236-C239 PolarHBondContact O-N 3.46Å; L236-L240 WeakPolarHBondContact O-CB 2.93Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 2.98Å; L236-L240 PolarHBondContact O-N 2.93Å
237	R	88.2	Confident	75.5	Confident	168 Å²	168	94.2 Å²	94.2	63%	0.634	46%	0.458	S	S	*	.	H	α-helix	trans	-60.2	-45.1	177	-176.5	-178	-69.4	172.5	-4.5	111	K233 Q234 R235 L240 T241	K233-R237 WeakPolarHBondContact O-CB 3.44Å; K233-R237 PolarHBondContact O-N 3.38Å; Q234-R237 PolarHBondContact O-N 3.35Å; R235-R237 VanDerWaalsContact C-N 3.34Å; R235-R237 PolarHBondContact O-N 3.17Å; R237-L240 PolarHBondContact O-N 2.84Å; R237-T241 WeakPolarHBondContact O-CG2 3.41Å; R237-T241 PolarHBondContact O-N 2.85Å; R237-T241 PolarHBondContact O-OG1 3.47Å
238	Y	87.6	Confident	75	Confident	97 Å²	97	96.2 Å²	96.2	38%	0.38	47%	0.466	S	S	.	.	H	α-helix	trans	-55.2	-53.8	176	174	-99.8	0	0	0	111.1	E69 Q234 R235 L236 L240 T241 F242	E69-Y238 HydrophobicContact CB-CE1 4.29Å; Q234-Y238 PolarHBondContact O-N 2.82Å; R235-Y238 WeakPolarHBondContact O-CB 2.91Å; R235-Y238 PolarHBondContact O-N 3.32Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.25Å; Y238-L240 VanDerWaalsContact C-N 3.35Å; Y238-L240 PolarHBondContact O-N 2.97Å; Y238-T241 WeakPolarHBondContact CA-OG1 3.43Å; Y238-T241 CarbonylContact O-C 3.57Å; Y238-T241 PolarHBondContact O-N 2.82Å; Y238-T241 PolarHBondContact O-OG1 2.96Å; Y238-F242 AromaticContact CE1-CD2 3.79Å; Y238-F242 HydrophobicContact CE1-CD2 3.79Å; Y238-F242 HydrophobicContact CE1-CE2 4.2Å; Y238-F242 HydrophobicContact CE1-CG 4.4Å; Y238-F242 HydrophobicContact CE2-CD2 4Å; Y238-F242 HydrophobicContact CE2-CE2 4.43Å; Y238-F242 AromaticContact CZ-CD2 3.46Å; Y238-F242 VanDerWaalsContact CZ-CD2 3.46Å; Y238-F242 AromaticContact CZ-CE2 3.68Å; Y238-F242 WeakPolarHBondContact O-CB 3.22Å; Y238-F242 PolarHBondContact O-N 3.38Å; Y238-F242 WeakPolarHBondContact OH-CD2 3.47Å; Y238-F242 WeakPolarHBondContact OH-CE2 3.26Å
239	C	87.6	Confident	74.4	Confident	1 Å²	1	97 Å²	97	1%	0.007	47%	0.468	C	S	.	.	H	α-helix	trans	-57.7	-44	179	-64.1	0	0	0	0	112.7	I65 I66 Y70 R235 L236 T241 F242	I65-C239 HydrophobicContact CG2-CB 4.11Å; I65-C239 WeakPolarHBondContact CG2-O 3.33Å; I66-C239 HydrophobicContact CD1-CB 3.74Å; Y70-C239 VanDerWaalsContact CA-SG 3.56Å; Y70-C239 PolarHBondContact N-SG 3.32Å; R235-C239 PolarHBondContact O-N 2.94Å; R235-C239 PolarHBondContact O-SG 3.38Å; L236-C239 PolarHBondContact O-N 3.46Å; C239-T241 PolarHBondContact O-N 3.35Å; C239-F242 WeakPolarHBondContact O-CB 3.44Å; C239-F242 PolarHBondContact O-N 3.13Å
240	L	75	Confident	73.6	Confident	111 Å²	111	98.2 Å²	98.2	58%	0.581	46%	0.459	S	S	*	.	H	α-helix	trans	-72.1	-15.5	179.7	-65.3	174.6	0	0	0	113.4	L236 R237 Y238	L236-L240 WeakPolarHBondContact O-CB 2.93Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 2.98Å; L236-L240 PolarHBondContact O-N 2.93Å; R237-L240 PolarHBondContact O-N 2.84Å; Y238-L240 VanDerWaalsContact C-N 3.35Å; Y238-L240 PolarHBondContact O-N 2.97Å
241	T	77.4	Confident	72.7	Confident	102 Å²	102	99.3 Å²	99.3	63%	0.626	45%	0.454	S	S	*	.	H	α-helix	trans	-94.9	-8.2	169.5	55.2	0	0	0	0	113.3	R237 Y238 C239	R237-T241 WeakPolarHBondContact O-CG2 3.41Å; R237-T241 PolarHBondContact O-N 2.85Å; R237-T241 PolarHBondContact O-OG1 3.47Å; Y238-T241 WeakPolarHBondContact CA-OG1 3.43Å; Y238-T241 CarbonylContact O-C 3.57Å; Y238-T241 PolarHBondContact O-N 2.82Å; Y238-T241 PolarHBondContact O-OG1 2.96Å; C239-T241 PolarHBondContact O-N 3.35Å
242	F	63.2	Low	71.7	Confident	54 Å²	54	101.6 Å²	101.6	24%	0.237	46%	0.462	C	S	.	.			trans	-92.1	136	-172.5	-161.4	-92.3	0	0	0	112	E69 Y238 C239	E69-F242 HydrophobicContact CB-CD1 4.4Å; E69-F242 VanDerWaalsContact CD-CZ 3.49Å; E69-F242 HydrophobicContact CG-CD1 3.43Å; E69-F242 VanDerWaalsContact CG-CD1 3.43Å; E69-F242 HydrophobicContact CG-CE1 3.56Å; E69-F242 HydrophobicContact CG-CG 4.09Å; E69-F242 HydrophobicContact CG-CZ 4.3Å; E69-F242 WeakPolarHBondContact OE1-CE1 3.49Å; E69-F242 WeakPolarHBondContact OE2-CE1 3.23Å; E69-F242 WeakPolarHBondContact OE2-CZ 3.34Å; Y238-F242 AromaticContact CE1-CD2 3.79Å; Y238-F242 HydrophobicContact CE1-CD2 3.79Å; Y238-F242 HydrophobicContact CE1-CE2 4.2Å; Y238-F242 HydrophobicContact CE1-CG 4.4Å; Y238-F242 HydrophobicContact CE2-CD2 4Å; Y238-F242 HydrophobicContact CE2-CE2 4.43Å; Y238-F242 AromaticContact CZ-CD2 3.46Å; Y238-F242 VanDerWaalsContact CZ-CD2 3.46Å; Y238-F242 AromaticContact CZ-CE2 3.68Å; Y238-F242 WeakPolarHBondContact O-CB 3.22Å; Y238-F242 PolarHBondContact O-N 3.38Å; Y238-F242 WeakPolarHBondContact OH-CD2 3.47Å; Y238-F242 WeakPolarHBondContact OH-CE2 3.26Å; C239-F242 WeakPolarHBondContact O-CB 3.44Å; C239-F242 PolarHBondContact O-N 3.13Å
243	P	56.9	Low	70.6	Confident	37 Å²	37	108.1 Å²	108.1	24%	0.24	49%	0.491	C	S	.	.			cis	-126.6	164.2	-25.2	38.6	-24.6	0	0	0	112.6	H245	P243-H245 PolarHBondContact O-N 3.08Å
244	E	47.7	Very low	69.3	Low	159 Å²	159	105.7 Å²	105.7	74%	0.743	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-55.3	8.1	-179.5	-57.3	177	147.1	0	0	116.5	Y246	E244-Y246 VanDerWaalsContact C-N 3.33Å
245	H	41.8	Very low	67.7	Low	148 Å²	148	103.5 Å²	103.5	69%	0.685	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-82.8	-5.4	176.3	-62	-45	0	0	0	114.4	P243	P243-H245 PolarHBondContact O-N 3.08Å
246	Y	40.2	Very low	65.7	Low	142 Å²	142	108.4 Å²	108.4	56%	0.557	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-108	6.9	175.2	-78.7	-84.5	0	0	0	114	H128 E244	H128-Y246 AromaticContact CE1-CZ 3.88Å; H128-Y246 PolarHBondContact CE1-OH 3.3Å; E244-Y246 VanDerWaalsContact C-N 3.33Å
247	K	33.4	Very low	63.5	Low	244 Å²	244	114.8 Å²	114.8	100%	1.061	52%	0.523	S	S	*	.			trans	-97.4	0	163.8	-70.3	-177.7	-177.6	173.1	0	109.3

Retrieved 247 of 247 residues in 85.3 ms (Link to these results)

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