G4V8W2_SCHMA Loading...

Copper transport protein

AlphaFold DB , UniProt , Accession G4V8W2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 200 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	52.6	Low	59.6	Low	225 Å²	225	144.2 Å²	144.2	100%	1.108	85%	0.846	S	S	*	*				0	127.7	0	-70.1	79.9	171.7	0	0	106.6
2	D	55.2	Low	59.1	Low	165 Å²	165	139.9 Å²	139.9	88%	0.882	84%	0.84	S	S	*	*			trans	156.2	116.4	151.9	-73.1	-15.3	0	0	0	108.7
3	H	58	Low	58.4	Low	182 Å²	182	141 Å²	141	84%	0.843	84%	0.839	S	S	*	*			trans	-82	139.1	-175	-65.9	-90.6	0	0	0	110.4
4	A	59.9	Low	58.1	Low	101 Å²	101	138 Å²	138	84%	0.835	84%	0.837	S	S	*	*			trans	-140.2	116.3	156.6	0	0	0	0	0	109.2
5	H	65.3	Low	57.4	Low	181 Å²	181	136.1 Å²	136.1	84%	0.838	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-65.2	135.1	-177.4	-78.5	-92.3	0	0	0	111.7
6	G	58.9	Low	57.2	Low	73 Å²	73	138.9 Å²	138.9	75%	0.753	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-64.2	131.3	172.6	0	0	0	0	0	111.8
7	S	63.3	Low	56.7	Low	118 Å²	118	141.3 Å²	141.3	83%	0.825	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-62.9	124.3	172.9	48	0	0	0	0	112
8	H	60.9	Low	56.3	Low	183 Å²	183	139.4 Å²	139.4	85%	0.847	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.8	138.3	161.3	-89.9	-88.9	0	0	0	110
9	P	65.1	Low	55.8	Low	121 Å²	121	136.8 Å²	136.8	79%	0.786	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76	136.7	179.3	30.1	-32.5	0	0	0	111.8
10	S	56.4	Low	55.2	Low	111 Å²	111	137.2 Å²	137.2	78%	0.776	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-62.9	148	173.5	-56.6	0	0	0	0	112.3	A12	S10-A12 PolarHBondContact O-N 3.06Å
11	P	60	Low	55	Low	126 Å²	126	138.3 Å²	138.3	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.3	121.8	171.3	31	-30.3	0	0	0	109.2	D13	P11-D13 PolarHBondContact O-N 3.48Å
12	A	53.4	Low	54.9	Low	93 Å²	93	132.6 Å²	132.6	77%	0.769	80%	0.797	S	S	*	*			trans	-64.9	114.4	171.4	0	0	0	0	0	110.2	S10 A14	S10-A12 PolarHBondContact O-N 3.06Å; A12-A14 PolarHBondContact O-N 3.02Å
13	D	50.6	Low	55	Low	154 Å²	154	130 Å²	130	82%	0.824	78%	0.781	S	S	*	*			trans	26.9	83.5	139.8	-58.2	-36.6	0	0	0	117.2	P11 S15	P11-D13 PolarHBondContact O-N 3.48Å; D13-S15 PolarHBondContact O-N 3.03Å
14	A	53.5	Low	55.1	Low	99 Å²	99	128 Å²	128	82%	0.818	78%	0.777	S	S	*	*			trans	-88.3	80	153.9	0	0	0	0	0	108.9	A12 M16	A12-A14 PolarHBondContact O-N 3.02Å; A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 2.9Å
15	S	47.9	Very low	55.3	Low	109 Å²	109	130.4 Å²	130.4	76%	0.762	77%	0.773	S	S	*	*			trans	-76.7	81.8	171.1	60.7	0	0	0	0	110.2	D13 Q17	D13-S15 PolarHBondContact O-N 3.03Å; S15-Q17 PolarHBondContact O-N 2.93Å
16	M	55	Low	55.5	Low	181 Å²	181	125.2 Å²	125.2	89%	0.892	75%	0.747	S	S	*	*			trans	-78.4	92.8	161.4	-73.7	178.4	79	0	0	108	A14 S18	A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 2.9Å; M16-S18 PolarHBondContact O-N 2.78Å
17	Q	48.1	Very low	56.4	Low	180 Å²	180	128.7 Å²	128.7	84%	0.841	75%	0.746	S	S	*	*			trans	-75	89.7	175.1	-156.1	160	55	0	0	108.3	S15 S19	S15-Q17 PolarHBondContact O-N 2.93Å; Q17-S19 PolarHBondContact O-N 3.26Å
18	S	48.7	Very low	57.4	Low	107 Å²	107	129.4 Å²	129.4	75%	0.748	73%	0.732	S	S	*	*			trans	-69.9	94.8	166.2	57	0	0	0	0	108.1	M16 D20	M16-S18 PolarHBondContact O-N 2.78Å; S18-D20 PolarHBondContact O-N 3Å
19	S	48	Very low	58.5	Low	90 Å²	90	126.7 Å²	126.7	63%	0.629	72%	0.717	S	S	*	*			trans	-66.3	84.4	166.2	-62.2	0	0	0	0	108.7	Q17 H21	Q17-S19 PolarHBondContact O-N 3.26Å; S19-H21 PolarHBondContact O-N 3.15Å; S19-H21 VanDerWaalsContact O-N 3.11Å
20	D	43.8	Very low	59.3	Low	145 Å²	145	121.8 Å²	121.8	78%	0.775	68%	0.684	S	S	*	*			trans	-70.9	97.6	172.6	-159.5	7.8	0	0	0	107.8	S18 S22	S18-D20 PolarHBondContact O-N 3Å; D20-S22 PolarHBondContact O-N 3.44Å
21	H	51.4	Low	60.7	Low	160 Å²	160	120.5 Å²	120.5	74%	0.741	67%	0.672	S	S	*	*			trans	-72.8	82.7	173.2	-72.6	-73.8	0	0	0	108.8	S19 M23	S19-H21 PolarHBondContact O-N 3.15Å; S19-H21 VanDerWaalsContact O-N 3.11Å; H21-M23 PolarHBondContact O-N 3.45Å
22	S	49.1	Very low	61.4	Low	106 Å²	106	117.6 Å²	117.6	74%	0.741	65%	0.65	S	S	*	*			trans	-64.9	96	170	61.5	0	0	0	0	109.4	D20 D24	D20-S22 PolarHBondContact O-N 3.44Å; S22-D24 PolarHBondContact O-N 3.05Å
23	M	58.8	Low	62.2	Low	109 Å²	109	116.6 Å²	116.6	54%	0.537	63%	0.63	S	S	.	*			trans	-72.9	92.3	170.7	-64.6	-72.1	-89	0	0	107.9	H21 M25 T36	H21-M23 PolarHBondContact O-N 3.45Å; M23-M25 PolarHBondContact O-N 3.35Å; M23-T36 HydrophobicContact CE-CG2 3.59Å
24	D	59.7	Low	63	Low	142 Å²	142	115 Å²	115	76%	0.759	62%	0.618	S	S	*	*			trans	-65.5	98.7	173.4	-170.6	27.2	0	0	0	109	S22 K26	S22-D24 PolarHBondContact O-N 3.05Å; D24-K26 PolarHBondContact O-N 2.93Å; D24-K26 VanDerWaalsContact O-N 3.14Å
25	M	63.4	Low	63.8	Low	151 Å²	151	111.4 Å²	111.4	74%	0.744	58%	0.583	S	S	*	*			trans	-75.9	102.1	178.7	-69.6	-160.5	179.2	0	0	109.2	M23 M27	M23-M25 PolarHBondContact O-N 3.35Å; M25-M27 PolarHBondContact O-N 3.47Å
26	K	70.4	Confident	65	Low	71 Å²	71	108.6 Å²	108.6	31%	0.309	56%	0.561	S	S	.	*			trans	-65.7	113.5	171.8	-68.1	170.8	177.7	177	0	109.6	D24 Y28 N30 D32	D24-K26 PolarHBondContact O-N 2.93Å; D24-K26 VanDerWaalsContact O-N 3.14Å; K26-Y28 HydrophobicContact CB-CD1 3.91Å; K26-Y28 HydrophobicContact CB-CE1 3.64Å; K26-Y28 HydrophobicContact CD-CE1 3.99Å; K26-Y28 HydrophobicContact CD-CE2 4.33Å; K26-Y28 VanDerWaalsContact CD-OH 3.32Å; K26-Y28 WeakPolarHBondContact CD-OH 3.48Å; K26-Y28 WeakPolarHBondContact CE-OH 3.46Å; K26-Y28 HydrophobicContact CG-CD1 4.4Å; K26-Y28 HydrophobicContact CG-CE1 3.63Å; K26-Y28 PolarHBondContact O-N 2.82Å; K26-Y28 VanDerWaalsContact O-N 3.14Å; K26-N30 HydrophobicContact CD-CB 4.45Å; K26-D32 IonicContact NZ-OD1 2.62Å; K26-D32 IonicContact NZ-OD2 3.15Å; K26-D32 PolarHBondContact NZ-OD2 3.06Å
27	M	77.7	Confident	65.7	Low	147 Å²	147	100.9 Å²	100.9	72%	0.724	52%	0.523	S	S	*	.			trans	-82.6	25.6	176	-59.7	-64.3	-118.7	0	0	112.8	M25 Y166	M25-M27 PolarHBondContact O-N 3.47Å; M27-Y166 HydrophobicContact SD-CE2 4.15Å
28	Y	84.1	Confident	66.8	Low	133 Å²	133	95.7 Å²	95.7	52%	0.522	50%	0.501	S	S	.	.	S	Bend	trans	-132.7	153.5	178.2	64.9	-92.5	0	0	0	109.9	K26 N30	K26-Y28 HydrophobicContact CB-CD1 3.91Å; K26-Y28 HydrophobicContact CB-CE1 3.64Å; K26-Y28 HydrophobicContact CD-CE1 3.99Å; K26-Y28 HydrophobicContact CD-CE2 4.33Å; K26-Y28 VanDerWaalsContact CD-OH 3.32Å; K26-Y28 WeakPolarHBondContact CD-OH 3.48Å; K26-Y28 WeakPolarHBondContact CE-OH 3.46Å; K26-Y28 HydrophobicContact CG-CD1 4.4Å; K26-Y28 HydrophobicContact CG-CE1 3.63Å; K26-Y28 PolarHBondContact O-N 2.82Å; K26-Y28 VanDerWaalsContact O-N 3.14Å; Y28-N30 HydrophobicContact CE2-CB 4.34Å; Y28-N30 PolarHBondContact O-N 2.83Å; Y28-N30 VanDerWaalsContact O-N 3.13Å; Y28-N30 PolarHBondContact O-ND2 3.24Å
29	F	82.8	Confident	68	Low	125 Å²	125	96.8 Å²	96.8	55%	0.548	49%	0.493	S	S	.	.			trans	-58.6	119.5	177.6	-70.7	-60.7	0	0	0	110.7	Y166 V168 L171	F29-Y166 WeakPolarHBondContact CA-O 3.47Å; F29-Y166 HydrophobicContact CD1-CD1 4.41Å; F29-Y166 HydrophobicContact CE1-CD1 4.32Å; F29-V168 HydrophobicContact CB-CG2 3.86Å; F29-L171 HydrophobicContact CD1-CD2 4.29Å; F29-L171 HydrophobicContact CE1-CD2 3.64Å; F29-L171 HydrophobicContact CZ-CD2 4.02Å
30	N	83.7	Confident	68.8	Low	18 Å²	18	97.5 Å²	97.5	10%	0.096	50%	0.498	C	S	.	.	B	Isolated β-bridge	trans	-120.7	156	-177.9	65.4	69.6	0	0	0	110.7	K26 Y28 D32 Y166 V168	K26-N30 HydrophobicContact CD-CB 4.45Å; Y28-N30 HydrophobicContact CE2-CB 4.34Å; Y28-N30 PolarHBondContact O-N 2.83Å; Y28-N30 VanDerWaalsContact O-N 3.13Å; Y28-N30 PolarHBondContact O-ND2 3.24Å; N30-D32 PolarHBondContact OD1-N 2.96Å; N30-Y166 PolarHBondContact N-O 3.16Å; N30-V168 PolarHBondContact O-N 2.91Å; N30-V168 VanDerWaalsContact O-N 3.13Å
31	T	84.2	Confident	70	Confident	85 Å²	85	95.8 Å²	95.8	52%	0.521	50%	0.497	S	S	.	.			trans	-109.8	22.3	174.6	56.7	0	0	0	0	110.5	V168	T31-V168 HydrophobicContact CG2-CB 4.45Å; T31-V168 HydrophobicContact CG2-CG2 4.34Å
32	D	75.8	Confident	70.9	Confident	64 Å²	64	95.6 Å²	95.6	34%	0.342	49%	0.49	S	S	.	.			trans	-72.6	137.3	-176.9	-66.9	-35.8	0	0	0	109.7	K26 N30 Y35 N167	K26-D32 IonicContact NZ-OD1 2.62Å; K26-D32 IonicContact NZ-OD2 3.15Å; K26-D32 PolarHBondContact NZ-OD2 3.06Å; N30-D32 PolarHBondContact OD1-N 2.96Å; D32-Y35 WeakPolarHBondContact O-CD1 3.44Å; D32-N167 PolarHBondContact O-ND2 2.62Å
33	M	69.1	Low	72.2	Confident	73 Å²	73	93.6 Å²	93.6	36%	0.36	47%	0.47	S	S	.	.	S	Bend	trans	-84.2	-19	-177.2	-63.8	-64.8	-102.9	0	0	112.6	V47 A50 Y169	M33-V47 HydrophobicContact CE-CB 4.16Å; M33-V47 HydrophobicContact CE-CG1 4.19Å; M33-V47 HydrophobicContact CE-CG2 3.74Å; M33-A50 HydrophobicContact CE-CB 4.41Å; M33-Y169 HydrophobicContact SD-CE2 4.49Å
34	H	68.2	Low	73.2	Confident	121 Å²	121	88.8 Å²	88.8	56%	0.56	45%	0.447	S	S	*	.			trans	-100.4	97	-176.8	-174.5	-87.6	0	0	0	111.2	I44 D45	H34-I44 WeakPolarHBondContact CA-O 2.81Å; H34-D45 IonicContact CD2-OD1 3.42Å; H34-D45 PolarHBondContact CD2-OD1 3.34Å; H34-D45 IonicContact NE2-OD1 2.8Å; H34-D45 PolarHBondContact NE2-OD1 3.42Å
35	Y	70.7	Confident	74.2	Confident	22 Å²	22	86.2 Å²	86.2	9%	0.086	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.7	175.6	61.6	-85.4	0	0	0	111	D32 L37 I44 T165 N167 L170	D32-Y35 WeakPolarHBondContact O-CD1 3.44Å; Y35-L37 HydrophobicContact CE2-CB 4.41Å; Y35-L37 HydrophobicContact CE2-CD1 4.11Å; Y35-I44 HydrophobicContact CD2-CD1 4.28Å; Y35-I44 HydrophobicContact CE1-CB 4.36Å; Y35-I44 HydrophobicContact CE1-CD1 4.33Å; Y35-I44 HydrophobicContact CE1-CG2 4.21Å; Y35-I44 HydrophobicContact CE2-CD1 3.44Å; Y35-I44 VanDerWaalsContact CE2-CD1 3.44Å; Y35-I44 HydrophobicContact CE2-CG1 4.45Å; Y35-I44 VanDerWaalsContact CZ-CD1 3.46Å; Y35-I44 PolarHBondContact O-N 3.11Å; Y35-I44 VanDerWaalsContact O-N 3.1Å; Y35-I44 WeakPolarHBondContact OH-CD1 3.08Å; Y35-T165 HydrophobicContact CD2-CG2 4.5Å; Y35-N167 HydrophobicContact CE1-CB 4.49Å; Y35-N167 WeakPolarHBondContact CE1-ND2 3.05Å; Y35-L170 HydrophobicContact CE2-CD1 3.46Å; Y35-L170 VanDerWaalsContact CE2-CD1 3.46Å; Y35-L170 WeakPolarHBondContact OH-CD1 3.24Å
36	T	73.4	Confident	75.3	Confident	51 Å²	51	82.5 Å²	82.5	31%	0.313	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.1	175.3	48.3	0	0	0	0	110.3	M23 I43	M23-T36 HydrophobicContact CE-CG2 3.59Å; T36-I43 HydrophobicContact CG2-CG1 4.09Å
37	L	69.1	Low	76.1	Confident	18 Å²	18	83.3 Å²	83.3	9%	0.094	43%	0.429	C	S	.	.			trans	-104.9	108.1	179.5	-168.4	141.6	0	0	0	111.3	Y35 F39 W42 I44 A53 L170	Y35-L37 HydrophobicContact CE2-CB 4.41Å; Y35-L37 HydrophobicContact CE2-CD1 4.11Å; L37-F39 PolarHBondContact O-N 3.48Å; L37-W42 HydrophobicContact CD2-CE3 4.29Å; L37-W42 PolarHBondContact N-O 3.29Å; L37-W42 WeakPolarHBondContact O-CB 3.38Å; L37-I44 HydrophobicContact CB-CD1 4.07Å; L37-I44 HydrophobicContact CD1-CD1 4.02Å; L37-A53 HydrophobicContact CD1-CB 4Å; L37-L170 HydrophobicContact CD1-CD1 3.87Å
38	L	71.7	Confident	76.7	Confident	71 Å²	71	78.1 Å²	78.1	37%	0.372	41%	0.414	S	S	.	.	S	Bend	trans	65.4	-39.6	170.3	-152.5	141.4	0	0	0	117.3	I158 L161	L38-I158 HydrophobicContact CD1-CB 4.24Å; L38-I158 HydrophobicContact CD1-CG1 4.13Å; L38-I158 HydrophobicContact CD1-CG2 3.64Å; L38-L161 HydrophobicContact CD1-CB 4.38Å; L38-L161 HydrophobicContact CD1-CD1 4.19Å; L38-L161 HydrophobicContact CG-CD1 4.22Å
39	F	72.2	Confident	76.9	Confident	130 Å²	130	76.3 Å²	76.3	57%	0.57	41%	0.409	S	S	*	.	S	Bend	trans	-125.2	145.9	172.8	-61.6	-74.3	0	0	0	109.7	L37 S41 W42	L37-F39 PolarHBondContact O-N 3.48Å; F39-S41 PolarHBondContact O-N 3.25Å; F39-W42 PolarHBondContact O-N 3.18Å
40	S	66.1	Low	77.1	Confident	105 Å²	105	70.9 Å²	70.9	73%	0.734	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.1	176.4	167.2	0	0	0	0	113	I43	S40-I43 WeakPolarHBondContact O-CG1 3.35Å
41	S	69.5	Low	77.5	Confident	109 Å²	109	74.6 Å²	74.6	76%	0.762	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-15.8	177.7	-47.6	0	0	0	0	114.6	F39 I43	F39-S41 PolarHBondContact O-N 3.25Å; S41-I43 PolarHBondContact O-N 3.15Å
42	W	69.2	Low	77.9	Confident	157 Å²	157	75.3 Å²	75.3	60%	0.595	41%	0.41	S	S	*	.			trans	-97.8	71.5	-176.8	-79.6	57.7	0	0	0	110.1	L37 F39	L37-W42 HydrophobicContact CD2-CE3 4.29Å; L37-W42 PolarHBondContact N-O 3.29Å; L37-W42 WeakPolarHBondContact O-CB 3.38Å; F39-W42 PolarHBondContact O-N 3.18Å
43	I	77.1	Confident	78.7	Confident	64 Å²	64	73 Å²	73	33%	0.328	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.5	176.7	-51.1	161	0	0	0	108.6	T36 S40 S41 D45 K49	T36-I43 HydrophobicContact CG2-CG1 4.09Å; S40-I43 WeakPolarHBondContact O-CG1 3.35Å; S41-I43 PolarHBondContact O-N 3.15Å; I43-D45 WeakPolarHBondContact CG2-OD1 3.39Å; I43-K49 VanDerWaalsContact O-CD 3.3Å; I43-K49 WeakPolarHBondContact O-CD 3.49Å; I43-K49 PolarHBondContact O-NZ 3.32Å
44	I	79.7	Confident	79.8	Confident	8 Å²	8	70.8 Å²	70.8	4%	0.041	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	103.5	177.1	-65.3	173.7	0	0	0	107.2	H34 Y35 L37 K49 A50 A53	H34-I44 WeakPolarHBondContact CA-O 2.81Å; Y35-I44 HydrophobicContact CD2-CD1 4.28Å; Y35-I44 HydrophobicContact CE1-CB 4.36Å; Y35-I44 HydrophobicContact CE1-CD1 4.33Å; Y35-I44 HydrophobicContact CE1-CG2 4.21Å; Y35-I44 HydrophobicContact CE2-CD1 3.44Å; Y35-I44 VanDerWaalsContact CE2-CD1 3.44Å; Y35-I44 HydrophobicContact CE2-CG1 4.45Å; Y35-I44 VanDerWaalsContact CZ-CD1 3.46Å; Y35-I44 PolarHBondContact O-N 3.11Å; Y35-I44 VanDerWaalsContact O-N 3.1Å; Y35-I44 WeakPolarHBondContact OH-CD1 3.08Å; L37-I44 HydrophobicContact CB-CD1 4.07Å; L37-I44 HydrophobicContact CD1-CD1 4.02Å; I44-K49 HydrophobicContact CB-CB 4.43Å; I44-K49 HydrophobicContact CG1-CB 4.32Å; I44-K49 HydrophobicContact CG2-CB 3.99Å; I44-A50 HydrophobicContact CG2-CB 3.76Å; I44-A53 HydrophobicContact CD1-CB 3.52Å
45	D	80.8	Confident	81.1	Confident	88 Å²	88	69.8 Å²	69.8	47%	0.471	39%	0.389	S	S	.	.			trans	-109.5	-11.9	-179	-48.4	-64.2	0	0	0	113	H34 I43 K49	H34-D45 IonicContact CD2-OD1 3.42Å; H34-D45 PolarHBondContact CD2-OD1 3.34Å; H34-D45 IonicContact NE2-OD1 2.8Å; H34-D45 PolarHBondContact NE2-OD1 3.42Å; I43-D45 WeakPolarHBondContact CG2-OD1 3.39Å; D45-K49 IonicContact OD2-NZ 3.98Å; D45-K49 PolarHBondContact OD2-NZ 2.96Å
46	T	86.6	Confident	82.3	Confident	72 Å²	72	70.5 Å²	70.5	44%	0.442	40%	0.404	S	S	.	.	S	Bend	trans	-132.2	147.4	-172.3	170.4	0	0	0	0	110.5	G48 K49 A50	T46-G48 PolarHBondContact O-N 3.47Å; T46-G48 VanDerWaalsContact O-N 3.15Å; T46-G48 PolarHBondContact OG1-N 2.96Å; T46-K49 HydrophobicContact CG2-CB 3.78Å; T46-K49 HydrophobicContact CG2-CD 3.66Å; T46-K49 HydrophobicContact CG2-CG 3.42Å; T46-K49 VanDerWaalsContact CG2-CG 3.42Å; T46-K49 WeakPolarHBondContact O-CB 3.37Å; T46-K49 PolarHBondContact O-N 3.33Å; T46-A50 PolarHBondContact O-N 3.3Å
47	V	86.9	Confident	83.3	Confident	88 Å²	88	68.2 Å²	68.2	53%	0.533	39%	0.39	S	S	.	.	H	α-helix	trans	-50.5	-38.6	174.3	-172.9	0	0	0	0	110.9	M33 A50 I51	M33-V47 HydrophobicContact CE-CB 4.16Å; M33-V47 HydrophobicContact CE-CG1 4.19Å; M33-V47 HydrophobicContact CE-CG2 3.74Å; V47-A50 WeakPolarHBondContact O-CB 3.33Å; V47-A50 PolarHBondContact O-N 3.09Å; V47-I51 HydrophobicContact CG1-CD1 4.06Å; V47-I51 HydrophobicContact CG1-CG1 4.49Å; V47-I51 WeakPolarHBondContact O-CG1 3.04Å; V47-I51 PolarHBondContact O-N 3.41Å
48	G	89.7	Confident	84.6	Confident	39 Å²	39	70.1 Å²	70.1	40%	0.402	40%	0.397	S	S	.	.	H	α-helix	trans	-62.7	-44.6	178.1	0	0	0	0	0	113.1	T46 A50 I51 V52	T46-G48 PolarHBondContact O-N 3.47Å; T46-G48 VanDerWaalsContact O-N 3.15Å; T46-G48 PolarHBondContact OG1-N 2.96Å; G48-A50 VanDerWaalsContact C-N 3.3Å; G48-A50 PolarHBondContact O-N 3.35Å; G48-I51 PolarHBondContact O-N 3.48Å; G48-V52 WeakPolarHBondContact O-CG2 3.39Å; G48-V52 PolarHBondContact O-N 3.36Å; G48-V52 VanDerWaalsContact O-N 3.09Å
49	K	87.7	Confident	85.7	Confident	95 Å²	95	71 Å²	71	41%	0.413	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-38.5	175.2	-75.1	177.8	-172.9	-177.3	0	110.6	I43 I44 D45 T46 V52 A53	I43-K49 VanDerWaalsContact O-CD 3.3Å; I43-K49 WeakPolarHBondContact O-CD 3.49Å; I43-K49 PolarHBondContact O-NZ 3.32Å; I44-K49 HydrophobicContact CB-CB 4.43Å; I44-K49 HydrophobicContact CG1-CB 4.32Å; I44-K49 HydrophobicContact CG2-CB 3.99Å; D45-K49 IonicContact OD2-NZ 3.98Å; D45-K49 PolarHBondContact OD2-NZ 2.96Å; T46-K49 HydrophobicContact CG2-CB 3.78Å; T46-K49 HydrophobicContact CG2-CD 3.66Å; T46-K49 HydrophobicContact CG2-CG 3.42Å; T46-K49 VanDerWaalsContact CG2-CG 3.42Å; T46-K49 WeakPolarHBondContact O-CB 3.37Å; T46-K49 PolarHBondContact O-N 3.33Å; K49-V52 PolarHBondContact O-N 2.96Å; K49-A53 WeakPolarHBondContact O-CB 3.48Å; K49-A53 PolarHBondContact O-N 2.8Å
50	A	88.1	Confident	86.9	Confident	11 Å²	11	66.5 Å²	66.5	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-43.4	177.5	0	0	0	0	0	112	M33 I44 T46 V47 G48 V52 A53 C54	M33-A50 HydrophobicContact CE-CB 4.41Å; I44-A50 HydrophobicContact CG2-CB 3.76Å; T46-A50 PolarHBondContact O-N 3.3Å; V47-A50 WeakPolarHBondContact O-CB 3.33Å; V47-A50 PolarHBondContact O-N 3.09Å; G48-A50 VanDerWaalsContact C-N 3.3Å; G48-A50 PolarHBondContact O-N 3.35Å; A50-V52 PolarHBondContact O-N 3.46Å; A50-A53 WeakPolarHBondContact O-CB 3.41Å; A50-A53 PolarHBondContact O-N 2.91Å; A50-C54 PolarHBondContact O-N 2.95Å; A50-C54 PolarHBondContact O-SG 2.95Å; A50-C54 VanDerWaalsContact O-SG 3.33Å
51	I	92.4	Very high	88.3	Confident	96 Å²	96	61.5 Å²	61.5	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-44.9	175.8	-67.5	165	0	0	0	110.7	V47 G48 A53 C54 L55	V47-I51 HydrophobicContact CG1-CD1 4.06Å; V47-I51 HydrophobicContact CG1-CG1 4.49Å; V47-I51 WeakPolarHBondContact O-CG1 3.04Å; V47-I51 PolarHBondContact O-N 3.41Å; G48-I51 PolarHBondContact O-N 3.48Å; I51-A53 VanDerWaalsContact C-N 3.3Å; I51-A53 PolarHBondContact O-N 3.42Å; I51-C54 PolarHBondContact O-N 2.85Å; I51-L55 HydrophobicContact CG2-CD1 4.02Å; I51-L55 HydrophobicContact CG2-CG 4.38Å; I51-L55 WeakPolarHBondContact O-CG 3.2Å; I51-L55 PolarHBondContact O-N 3.37Å
52	V	92.4	Very high	89.6	Confident	99 Å²	99	57.9 Å²	57.9	60%	0.6	32%	0.32	S	S	*	.	H	α-helix	trans	-60.9	-41.6	176.8	171.9	0	0	0	0	111	G48 K49 A50 L55 G56	G48-V52 WeakPolarHBondContact O-CG2 3.39Å; G48-V52 PolarHBondContact O-N 3.36Å; G48-V52 VanDerWaalsContact O-N 3.09Å; K49-V52 PolarHBondContact O-N 2.96Å; A50-V52 PolarHBondContact O-N 3.46Å; V52-L55 PolarHBondContact O-N 3.35Å; V52-G56 PolarHBondContact O-N 2.88Å
53	A	91.8	Very high	90.8	Very high	16 Å²	16	54 Å²	54	13%	0.132	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-45.3	175.7	0	0	0	0	0	112.3	L37 I44 K49 A50 I51 G56 S57 L170	L37-A53 HydrophobicContact CD1-CB 4Å; I44-A53 HydrophobicContact CD1-CB 3.52Å; K49-A53 WeakPolarHBondContact O-CB 3.48Å; K49-A53 PolarHBondContact O-N 2.8Å; A50-A53 WeakPolarHBondContact O-CB 3.41Å; A50-A53 PolarHBondContact O-N 2.91Å; I51-A53 VanDerWaalsContact C-N 3.3Å; I51-A53 PolarHBondContact O-N 3.42Å; A53-G56 PolarHBondContact O-N 3.28Å; A53-S57 WeakPolarHBondContact O-CB 3.44Å; A53-S57 PolarHBondContact O-N 3.47Å; A53-S57 PolarHBondContact O-OG 3.33Å; A53-L170 HydrophobicContact CB-CD2 4.1Å
54	C	92.7	Very high	91.7	Very high	27 Å²	27	53.2 Å²	53.2	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-44.4	175.9	-70.5	0	0	0	0	112.4	A50 I51 S57 F58 A173	A50-C54 PolarHBondContact O-N 2.95Å; A50-C54 PolarHBondContact O-SG 2.95Å; A50-C54 VanDerWaalsContact O-SG 3.33Å; I51-C54 PolarHBondContact O-N 2.85Å; C54-S57 PolarHBondContact O-N 3.49Å; C54-S57 PolarHBondContact O-OG 2.92Å; C54-F58 WeakPolarHBondContact O-CB 3.27Å; C54-F58 PolarHBondContact O-N 3.33Å; C54-A173 HydrophobicContact CB-CB 4.07Å
55	L	95.5	Very high	92.4	Very high	99 Å²	99	53.9 Å²	53.9	52%	0.518	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-42	176.3	-72.1	175.6	0	0	0	111.1	I51 V52 F58 I59	I51-L55 HydrophobicContact CG2-CD1 4.02Å; I51-L55 HydrophobicContact CG2-CG 4.38Å; I51-L55 WeakPolarHBondContact O-CG 3.2Å; I51-L55 PolarHBondContact O-N 3.37Å; V52-L55 PolarHBondContact O-N 3.35Å; L55-F58 PolarHBondContact O-N 2.87Å; L55-I59 WeakPolarHBondContact O-CB 3.35Å; L55-I59 VanDerWaalsContact O-CG1 3.24Å; L55-I59 WeakPolarHBondContact O-CG1 3.5Å; L55-I59 PolarHBondContact O-N 3Å
56	G	94.6	Very high	92.9	Very high	38 Å²	38	51 Å²	51	39%	0.392	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-48.7	175.5	0	0	0	0	0	112	V52 A53 I59 L60	V52-G56 PolarHBondContact O-N 2.88Å; A53-G56 PolarHBondContact O-N 3.28Å; G56-I59 PolarHBondContact O-N 3.23Å; G56-L60 VanDerWaalsContact O-CB 3.25Å; G56-L60 WeakPolarHBondContact O-CB 3.23Å; G56-L60 PolarHBondContact O-N 2.97Å
57	S	94.5	Very high	93.3	Very high	3 Å²	3	49 Å²	49	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-67.6	-37.9	179	66.5	0	0	0	0	112.6	A53 C54 L60 A61	A53-S57 WeakPolarHBondContact O-CB 3.44Å; A53-S57 PolarHBondContact O-N 3.47Å; A53-S57 PolarHBondContact O-OG 3.33Å; C54-S57 PolarHBondContact O-N 3.49Å; C54-S57 PolarHBondContact O-OG 2.92Å; S57-L60 PolarHBondContact O-N 3.24Å; S57-A61 WeakPolarHBondContact O-CB 3.44Å; S57-A61 PolarHBondContact O-N 3Å
58	F	96.5	Very high	93.5	Very high	58 Å²	58	46.7 Å²	46.7	25%	0.254	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-49.1	173.7	174.1	-96.2	0	0	0	111.7	C54 L55 L60 A61 I62 A173 F176 G177 L180	C54-F58 WeakPolarHBondContact O-CB 3.27Å; C54-F58 PolarHBondContact O-N 3.33Å; L55-F58 PolarHBondContact O-N 2.87Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.44Å; F58-A61 PolarHBondContact O-N 2.92Å; F58-I62 HydrophobicContact CD1-CD1 3.91Å; F58-I62 HydrophobicContact CE1-CD1 3.39Å; F58-I62 HydrophobicContact CE2-CD1 4.4Å; F58-I62 HydrophobicContact CZ-CD1 3.69Å; F58-I62 WeakPolarHBondContact O-CG1 3.46Å; F58-I62 PolarHBondContact O-N 3.35Å; F58-I62 VanDerWaalsContact O-N 3.12Å; F58-A173 HydrophobicContact CB-CB 4.42Å; F58-A173 WeakPolarHBondContact CD2-O 3.37Å; F58-F176 HydrophobicContact CD2-CB 4.29Å; F58-F176 HydrophobicContact CE2-CB 4.12Å; F58-G177 VanDerWaalsContact CD2-CA 3.49Å; F58-L180 HydrophobicContact CE1-CD2 4.46Å; F58-L180 HydrophobicContact CE2-CD2 4.37Å; F58-L180 HydrophobicContact CZ-CD2 3.61Å
59	I	96.6	Very high	93.5	Very high	90 Å²	90	44.9 Å²	44.9	46%	0.462	25%	0.246	S	C	.	.	H	α-helix	trans	-63.8	-42.1	176.8	-68.4	167.4	0	0	0	110.4	L55 G56 A61 I62 I63	L55-I59 WeakPolarHBondContact O-CB 3.35Å; L55-I59 VanDerWaalsContact O-CG1 3.24Å; L55-I59 WeakPolarHBondContact O-CG1 3.5Å; L55-I59 PolarHBondContact O-N 3Å; G56-I59 PolarHBondContact O-N 3.23Å; I59-A61 VanDerWaalsContact C-N 3.3Å; I59-A61 PolarHBondContact O-N 2.92Å; I59-I62 PolarHBondContact O-N 2.94Å; I59-I62 VanDerWaalsContact O-N 3.17Å; I59-I63 HydrophobicContact CG2-CD1 3.73Å; I59-I63 HydrophobicContact CG2-CG1 4.28Å; I59-I63 WeakPolarHBondContact O-CG1 3.45Å; I59-I63 PolarHBondContact O-N 2.91Å
60	L	95.8	Very high	93.5	Very high	34 Å²	34	44 Å²	44	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-41.1	178.1	-162.3	77.5	0	0	0	111.8	G56 S57 F58 I63 Y64 M155 I158 L159 I162	G56-L60 VanDerWaalsContact O-CB 3.25Å; G56-L60 WeakPolarHBondContact O-CB 3.23Å; G56-L60 PolarHBondContact O-N 2.97Å; S57-L60 PolarHBondContact O-N 3.24Å; F58-L60 VanDerWaalsContact C-N 3.34Å; F58-L60 PolarHBondContact O-N 3.44Å; L60-I63 PolarHBondContact O-N 3.36Å; L60-Y64 WeakPolarHBondContact O-CB 3.28Å; L60-Y64 PolarHBondContact O-N 3.48Å; L60-M155 HydrophobicContact CD1-CE 3.25Å; L60-M155 HydrophobicContact CD1-SD 3.63Å; L60-M155 HydrophobicContact CG-CE 3.82Å; L60-M155 HydrophobicContact CG-SD 4.37Å; L60-I158 HydrophobicContact CD2-CB 4.2Å; L60-I158 HydrophobicContact CD2-CG2 3.4Å; L60-L159 HydrophobicContact CB-CD2 4.22Å; L60-L159 HydrophobicContact CD2-CD2 3.83Å; L60-L159 HydrophobicContact CD2-CG 3.9Å; L60-L159 HydrophobicContact CG-CD2 4.23Å; L60-L159 HydrophobicContact CG-CG 4.32Å; L60-I162 HydrophobicContact CD2-CD1 3.97Å
61	A	96.6	Very high	93.6	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.9	-39.7	175.2	0	0	0	0	0	112.6	S57 F58 I59 Y64 E65 L159 V174 F178	S57-A61 WeakPolarHBondContact O-CB 3.44Å; S57-A61 PolarHBondContact O-N 3Å; F58-A61 PolarHBondContact O-N 2.92Å; I59-A61 VanDerWaalsContact C-N 3.3Å; I59-A61 PolarHBondContact O-N 2.92Å; A61-Y64 WeakPolarHBondContact O-CB 3.36Å; A61-Y64 PolarHBondContact O-N 3.14Å; A61-E65 PolarHBondContact O-N 3.33Å; A61-L159 HydrophobicContact CB-CD2 4.24Å; A61-V174 HydrophobicContact CB-CG1 4.5Å; A61-F178 HydrophobicContact CB-CD1 4.09Å; A61-F178 HydrophobicContact CB-CD2 4.44Å; A61-F178 HydrophobicContact CB-CE1 4.21Å; A61-F178 HydrophobicContact CB-CG 4.2Å; A61-F178 HydrophobicContact CB-CZ 4.48Å
62	I	95.5	Very high	93.3	Very high	34 Å²	34	45 Å²	45	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-42.3	173.3	-66.6	171.2	0	0	0	111	F58 I59 Y64 E65 A66 G177 L180	F58-I62 HydrophobicContact CD1-CD1 3.91Å; F58-I62 HydrophobicContact CE1-CD1 3.39Å; F58-I62 HydrophobicContact CE2-CD1 4.4Å; F58-I62 HydrophobicContact CZ-CD1 3.69Å; F58-I62 WeakPolarHBondContact O-CG1 3.46Å; F58-I62 PolarHBondContact O-N 3.35Å; F58-I62 VanDerWaalsContact O-N 3.12Å; I59-I62 PolarHBondContact O-N 2.94Å; I59-I62 VanDerWaalsContact O-N 3.17Å; I62-Y64 VanDerWaalsContact C-N 3.33Å; I62-E65 PolarHBondContact O-N 3.36Å; I62-A66 WeakPolarHBondContact O-CB 3.45Å; I62-A66 PolarHBondContact O-N 2.93Å; I62-G177 WeakPolarHBondContact CG1-O 3.2Å; I62-L180 HydrophobicContact CD1-CD2 4.15Å
63	I	95.5	Very high	92.9	Very high	75 Å²	75	42.8 Å²	42.8	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-65.5	-38.7	177.8	-66.7	169.5	0	0	0	110.7	I59 L60 E65 A66 L67 M155	I59-I63 HydrophobicContact CG2-CD1 3.73Å; I59-I63 HydrophobicContact CG2-CG1 4.28Å; I59-I63 WeakPolarHBondContact O-CG1 3.45Å; I59-I63 PolarHBondContact O-N 2.91Å; L60-I63 PolarHBondContact O-N 3.36Å; I63-E65 PolarHBondContact O-N 2.91Å; I63-A66 WeakPolarHBondContact O-CB 3.4Å; I63-A66 PolarHBondContact O-N 3.31Å; I63-L67 HydrophobicContact CG2-CD1 3.94Å; I63-L67 HydrophobicContact CG2-CG 4.18Å; I63-L67 WeakPolarHBondContact O-CG 3.46Å; I63-L67 PolarHBondContact O-N 2.97Å; I63-M155 HydrophobicContact CB-CE 4.04Å; I63-M155 HydrophobicContact CG2-CE 3.59Å
64	Y	95.7	Very high	92.6	Very high	48 Å²	48	44.3 Å²	44.3	19%	0.188	23%	0.231	C	C	.	.	H	α-helix	trans	-56.4	-50.2	175	179.6	-84.3	0	0	0	111.2	L60 A61 I62 A66 L67 E68 H152 M155 L159 F178	L60-Y64 WeakPolarHBondContact O-CB 3.28Å; L60-Y64 PolarHBondContact O-N 3.48Å; A61-Y64 WeakPolarHBondContact O-CB 3.36Å; A61-Y64 PolarHBondContact O-N 3.14Å; I62-Y64 VanDerWaalsContact C-N 3.33Å; Y64-A66 VanDerWaalsContact C-N 3.31Å; Y64-A66 PolarHBondContact O-N 3.42Å; Y64-L67 PolarHBondContact O-N 3.44Å; Y64-E68 PolarHBondContact O-N 2.89Å; Y64-H152 AromaticContact CE1-NE2 3.81Å; Y64-H152 AromaticContact CE2-CE1 3.55Å; Y64-H152 AromaticContact CE2-NE2 3.69Å; Y64-H152 AromaticContact CZ-CE1 3.34Å; Y64-H152 AromaticContact CZ-NE2 3.51Å; Y64-H152 PolarHBondContact OH-CE1 2.9Å; Y64-H152 VanDerWaalsContact OH-CE1 3.23Å; Y64-M155 HydrophobicContact CD2-CB 4.07Å; Y64-L159 HydrophobicContact CD2-CD1 3.98Å; Y64-L159 HydrophobicContact CG-CD1 3.9Å; Y64-F178 HydrophobicContact CD1-CD1 4.32Å; Y64-F178 AromaticContact CD1-CE1 3.53Å; Y64-F178 HydrophobicContact CD1-CE1 3.53Å; Y64-F178 HydrophobicContact CD1-CZ 4.45Å; Y64-F178 HydrophobicContact CE1-CE1 4.06Å; Y64-F178 HydrophobicContact CG-CE1 4.04Å
65	E	94.2	Very high	92.1	Very high	22 Å²	22	47.2 Å²	47.2	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-36.2	175.2	-75.8	-66	161.4	0	0	113.2	A61 I62 I63 T69 F178 F185	A61-E65 PolarHBondContact O-N 3.33Å; I62-E65 PolarHBondContact O-N 3.36Å; I63-E65 PolarHBondContact O-N 2.91Å; E65-T69 WeakPolarHBondContact O-CB 3.44Å; E65-T69 PolarHBondContact O-N 3.34Å; E65-T69 PolarHBondContact O-OG1 2.95Å; E65-F178 HydrophobicContact CG-CD1 4.1Å; E65-F185 HydrophobicContact CB-CD2 4.13Å
66	A	92.4	Very high	91.4	Very high	28 Å²	28	45.4 Å²	45.4	23%	0.231	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-46.8	176.1	0	0	0	0	0	111.9	I62 I63 Y64 T69 L70 F185	I62-A66 WeakPolarHBondContact O-CB 3.45Å; I62-A66 PolarHBondContact O-N 2.93Å; I63-A66 WeakPolarHBondContact O-CB 3.4Å; I63-A66 PolarHBondContact O-N 3.31Å; Y64-A66 VanDerWaalsContact C-N 3.31Å; Y64-A66 PolarHBondContact O-N 3.42Å; A66-T69 PolarHBondContact O-N 3.47Å; A66-L70 WeakPolarHBondContact O-CB 3.33Å; A66-L70 PolarHBondContact O-N 3.33Å; A66-F185 VanDerWaalsContact CA-CE2 3.41Å; A66-F185 VanDerWaalsContact CA-CZ 3.49Å; A66-F185 HydrophobicContact CB-CD2 4.35Å; A66-F185 HydrophobicContact CB-CE1 3.96Å; A66-F185 HydrophobicContact CB-CE2 3.43Å; A66-F185 VanDerWaalsContact CB-CE2 3.43Å; A66-F185 HydrophobicContact CB-CZ 3.2Å
67	L	93.5	Very high	90.6	Very high	28 Å²	28	52.3 Å²	52.3	15%	0.147	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-40.4	179.1	-71.5	172.3	0	0	0	111.3	I63 Y64 T69 L70 R71 L148 I151 M155	I63-L67 HydrophobicContact CG2-CD1 3.94Å; I63-L67 HydrophobicContact CG2-CG 4.18Å; I63-L67 WeakPolarHBondContact O-CG 3.46Å; I63-L67 PolarHBondContact O-N 2.97Å; Y64-L67 PolarHBondContact O-N 3.44Å; L67-T69 VanDerWaalsContact C-N 3.33Å; L67-T69 PolarHBondContact O-N 3.44Å; L67-L70 PolarHBondContact O-N 2.93Å; L67-R71 WeakPolarHBondContact O-CB 3.39Å; L67-R71 PolarHBondContact O-N 3.05Å; L67-L148 HydrophobicContact CD2-CD1 3.69Å; L67-I151 HydrophobicContact CD1-CG2 3.96Å; L67-M155 HydrophobicContact CD1-CG 4.27Å
68	E	91.4	Very high	89.8	Confident	40 Å²	40	53.6 Å²	53.6	19%	0.187	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-50	174.2	-161.3	-166.2	113.7	0	0	110.3	Y64 L70 R71 H72 H152 R189	Y64-E68 PolarHBondContact O-N 2.89Å; E68-L70 VanDerWaalsContact C-N 3.32Å; E68-L70 PolarHBondContact O-N 3.17Å; E68-R71 WeakPolarHBondContact O-CB 3.41Å; E68-R71 PolarHBondContact O-N 2.93Å; E68-H72 PolarHBondContact O-CD2 3Å; E68-H72 PolarHBondContact O-N 3.42Å; E68-H72 IonicContact OE1-CD2 3.97Å; E68-H72 IonicContact OE1-NE2 3.71Å; E68-H152 WeakPolarHBondContact CB-NE2 3.48Å; E68-R189 IonicContact OE1-CZ 3.54Å; E68-R189 IonicContact OE1-NH1 3.36Å; E68-R189 PolarHBondContact OE1-NH1 3.36Å; E68-R189 IonicContact OE1-NH2 2.76Å; E68-R189 PolarHBondContact OE1-NH2 3.13Å
69	T	89.2	Confident	88.7	Confident	1 Å²	1	53 Å²	53	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-40	179.1	-58	0	0	0	0	111.8	E65 A66 L67 H72 K73 F185 R189	E65-T69 WeakPolarHBondContact O-CB 3.44Å; E65-T69 PolarHBondContact O-N 3.34Å; E65-T69 PolarHBondContact O-OG1 2.95Å; A66-T69 PolarHBondContact O-N 3.47Å; L67-T69 VanDerWaalsContact C-N 3.33Å; L67-T69 PolarHBondContact O-N 3.44Å; T69-H72 PolarHBondContact O-N 3.28Å; T69-K73 HydrophobicContact CG2-CD 4.45Å; T69-K73 WeakPolarHBondContact O-CG 3.39Å; T69-K73 PolarHBondContact O-N 3.32Å; T69-F185 HydrophobicContact CG2-CB 4.06Å; T69-F185 HydrophobicContact CG2-CD1 4.13Å; T69-F185 HydrophobicContact CG2-CG 4.36Å; T69-F185 WeakPolarHBondContact OG1-CB 3.49Å; T69-R189 HydrophobicContact CG2-CG 4.32Å; T69-R189 PolarHBondContact OG1-NE 2.95Å; T69-R189 PolarHBondContact OG1-NH2 3.43Å
70	L	89.2	Confident	87.5	Confident	76 Å²	76	51 Å²	51	40%	0.398	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-44.3	175.6	178.9	61.5	0	0	0	111.5	A66 L67 E68 H72 K73 L74 L148	A66-L70 WeakPolarHBondContact O-CB 3.33Å; A66-L70 PolarHBondContact O-N 3.33Å; L67-L70 PolarHBondContact O-N 2.93Å; E68-L70 VanDerWaalsContact C-N 3.32Å; E68-L70 PolarHBondContact O-N 3.17Å; L70-H72 VanDerWaalsContact C-N 3.34Å; L70-H72 PolarHBondContact O-N 3.47Å; L70-K73 WeakPolarHBondContact O-CB 3.47Å; L70-K73 PolarHBondContact O-N 3.12Å; L70-K73 VanDerWaalsContact O-N 3.17Å; L70-L74 HydrophobicContact CD1-CD1 4.28Å; L70-L74 HydrophobicContact CD1-CG 4.21Å; L70-L74 HydrophobicContact CG-CD1 4.08Å; L70-L74 HydrophobicContact CG-CG 4.43Å; L70-L74 WeakPolarHBondContact O-CG 3.3Å; L70-L74 PolarHBondContact O-N 2.99Å; L70-L148 HydrophobicContact CB-CD2 4.48Å; L70-L148 HydrophobicContact CD2-CD1 4.16Å; L70-L148 HydrophobicContact CD2-CD2 4.17Å; L70-L148 HydrophobicContact CG-CD2 4.04Å
71	R	89.6	Confident	86.4	Confident	54 Å²	54	53.6 Å²	53.6	20%	0.204	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-45	177.3	-174.6	-175.2	67.8	-165.1	-0	111.3	L67 E68 K73 L74 L75 L148 H152	L67-R71 WeakPolarHBondContact O-CB 3.39Å; L67-R71 PolarHBondContact O-N 3.05Å; E68-R71 WeakPolarHBondContact O-CB 3.41Å; E68-R71 PolarHBondContact O-N 2.93Å; R71-K73 VanDerWaalsContact C-N 3.34Å; R71-K73 PolarHBondContact O-N 3.47Å; R71-L74 PolarHBondContact O-N 3.41Å; R71-L75 WeakPolarHBondContact O-CB 3.29Å; R71-L75 PolarHBondContact O-N 3.47Å; R71-L148 HydrophobicContact CB-CD2 3.86Å; R71-L148 HydrophobicContact CG-CD2 4.46Å; R71-H152 PolarHBondContact NH1-ND1 2.95Å
72	H	86.3	Confident	84.8	Confident	76 Å²	76	57.7 Å²	57.7	35%	0.352	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-43.5	175.1	-78	-72.6	0	0	0	112	E68 T69 L70 L75 L76	E68-H72 PolarHBondContact O-CD2 3Å; E68-H72 PolarHBondContact O-N 3.42Å; E68-H72 IonicContact OE1-CD2 3.97Å; E68-H72 IonicContact OE1-NE2 3.71Å; T69-H72 PolarHBondContact O-N 3.28Å; L70-H72 VanDerWaalsContact C-N 3.34Å; L70-H72 PolarHBondContact O-N 3.47Å; H72-L75 PolarHBondContact O-N 2.99Å; H72-L76 WeakPolarHBondContact O-CB 3.09Å; H72-L76 WeakPolarHBondContact O-CG 3.43Å; H72-L76 PolarHBondContact O-N 3.13Å
73	K	83.6	Confident	83.2	Confident	51 Å²	51	62.1 Å²	62.1	22%	0.222	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-45.1	175.8	-75.1	173.3	178.2	-178.8	0	112.6	T69 L70 R71 L76 R77 L192	T69-K73 HydrophobicContact CG2-CD 4.45Å; T69-K73 WeakPolarHBondContact O-CG 3.39Å; T69-K73 PolarHBondContact O-N 3.32Å; L70-K73 WeakPolarHBondContact O-CB 3.47Å; L70-K73 PolarHBondContact O-N 3.12Å; L70-K73 VanDerWaalsContact O-N 3.17Å; R71-K73 VanDerWaalsContact C-N 3.34Å; R71-K73 PolarHBondContact O-N 3.47Å; K73-L76 PolarHBondContact O-N 3.03Å; K73-R77 WeakPolarHBondContact O-CB 3.16Å; K73-R77 VanDerWaalsContact O-CG 3.3Å; K73-R77 WeakPolarHBondContact O-CG 3.47Å; K73-R77 PolarHBondContact O-N 3.44Å; K73-L192 HydrophobicContact CB-CD1 4.49Å; K73-L192 HydrophobicContact CD-CD1 4.17Å; K73-L192 HydrophobicContact CG-CD1 3.3Å; K73-L192 HydrophobicContact CG-CD2 4.02Å; K73-L192 HydrophobicContact CG-CG 4.23Å
74	L	85.2	Confident	81.3	Confident	49 Å²	49	60.3 Å²	60.3	26%	0.257	31%	0.309	S	S	.	.	H	α-helix	trans	-66.7	-41	180	-70	173.9	0	0	0	111.4	L70 R71 R77 A78 V144 L148	L70-L74 HydrophobicContact CD1-CD1 4.28Å; L70-L74 HydrophobicContact CD1-CG 4.21Å; L70-L74 HydrophobicContact CG-CD1 4.08Å; L70-L74 HydrophobicContact CG-CG 4.43Å; L70-L74 WeakPolarHBondContact O-CG 3.3Å; L70-L74 PolarHBondContact O-N 2.99Å; R71-L74 PolarHBondContact O-N 3.41Å; L74-R77 PolarHBondContact O-N 3.17Å; L74-A78 WeakPolarHBondContact O-CB 3.45Å; L74-A78 PolarHBondContact O-N 3.19Å; L74-V144 HydrophobicContact CD1-CG1 4.31Å; L74-L148 HydrophobicContact CD1-CD2 3.72Å
75	L	83.7	Confident	79.5	Confident	87 Å²	87	65.5 Å²	65.5	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-44.7	175.5	-171.4	154.7	0	0	0	111.2	R71 H72 A78 A79	R71-L75 WeakPolarHBondContact O-CB 3.29Å; R71-L75 PolarHBondContact O-N 3.47Å; H72-L75 PolarHBondContact O-N 2.99Å; L75-A78 PolarHBondContact O-N 3.38Å; L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 3.01Å
76	L	79.5	Confident	77.6	Confident	62 Å²	62	74 Å²	74	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-43.1	175.9	-74.5	171.6	0	0	0	112.3	H72 K73 A79 C80 L192	H72-L76 WeakPolarHBondContact O-CB 3.09Å; H72-L76 WeakPolarHBondContact O-CG 3.43Å; H72-L76 PolarHBondContact O-N 3.13Å; K73-L76 PolarHBondContact O-N 3.03Å; L76-A79 PolarHBondContact O-N 3.43Å; L76-C80 WeakPolarHBondContact O-CB 3.45Å; L76-C80 PolarHBondContact O-N 3.45Å; L76-L192 HydrophobicContact CD1-CB 4.08Å; L76-L192 HydrophobicContact CD1-CD1 4.34Å; L76-L192 HydrophobicContact CD1-CD2 4.36Å; L76-L192 HydrophobicContact CD1-CG 4.49Å
77	R	78.2	Confident	75.7	Confident	183 Å²	183	75.5 Å²	75.5	69%	0.691	38%	0.379	S	S	*	.	H	α-helix	trans	-63	-41.8	175.7	-75	177.9	179.4	-170.2	-1.5	111.9	K73 L74 C80 N81	K73-R77 WeakPolarHBondContact O-CB 3.16Å; K73-R77 VanDerWaalsContact O-CG 3.3Å; K73-R77 WeakPolarHBondContact O-CG 3.47Å; K73-R77 PolarHBondContact O-N 3.44Å; L74-R77 PolarHBondContact O-N 3.17Å; R77-C80 PolarHBondContact O-N 3.08Å; R77-N81 WeakPolarHBondContact O-CB 3.3Å; R77-N81 PolarHBondContact O-N 3.09Å
78	A	76.8	Confident	73.7	Confident	29 Å²	29	77.4 Å²	77.4	24%	0.24	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-39	176.3	0	0	0	0	0	112.1	L74 L75 N82	L74-A78 WeakPolarHBondContact O-CB 3.45Å; L74-A78 PolarHBondContact O-N 3.19Å; L75-A78 PolarHBondContact O-N 3.38Å; A78-N82 PolarHBondContact O-N 3.44Å; A78-N82 PolarHBondContact O-ND2 3.3Å
79	A	75.2	Confident	71.9	Confident	46 Å²	46	83 Å²	83	38%	0.38	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-44.5	175.7	0	0	0	0	0	112.5	L75 L76 N82	L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 3.01Å; L76-A79 PolarHBondContact O-N 3.43Å; A79-N82 PolarHBondContact O-N 2.97Å
80	C	70.8	Confident	70.1	Confident	49 Å²	49	87.2 Å²	87.2	33%	0.331	47%	0.465	S	S	.	.	H	α-helix	trans	-66.9	-38.2	177.8	-174.7	0	0	0	0	112.4	L76 R77 N82 Q83 C84	L76-C80 WeakPolarHBondContact O-CB 3.45Å; L76-C80 PolarHBondContact O-N 3.45Å; R77-C80 PolarHBondContact O-N 3.08Å; C80-N82 VanDerWaalsContact C-N 3.31Å; C80-N82 PolarHBondContact O-N 2.88Å; C80-Q83 PolarHBondContact O-N 3.48Å; C80-Q83 VanDerWaalsContact O-N 3.09Å; C80-C84 PolarHBondContact O-N 2.97Å; C80-C84 PolarHBondContact O-SG 3.35Å
81	N	71.4	Confident	68.2	Low	88 Å²	88	95.2 Å²	95.2	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-41	177.9	-168.7	61	0	0	0	112.2	R77 Q83 C84	R77-N81 WeakPolarHBondContact O-CB 3.3Å; R77-N81 PolarHBondContact O-N 3.09Å; N81-Q83 PolarHBondContact O-N 3.28Å; N81-C84 PolarHBondContact O-N 3.16Å
82	N	63.4	Low	66.2	Low	85 Å²	85	96.7 Å²	96.7	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-69.5	-17.6	178.4	-69.3	-25.6	0	0	0	114	A78 A79 C80	A78-N82 PolarHBondContact O-N 3.44Å; A78-N82 PolarHBondContact O-ND2 3.3Å; A79-N82 PolarHBondContact O-N 2.97Å; C80-N82 VanDerWaalsContact C-N 3.31Å; C80-N82 PolarHBondContact O-N 2.88Å
83	Q	63.1	Low	64.4	Low	127 Å²	127	95.7 Å²	95.7	59%	0.593	53%	0.534	S	S	*	.	H	α-helix	trans	-83.3	-34.9	176.5	-76.4	168.1	-19.5	0	0	111.6	C80 N81 E85 R86 A87	C80-Q83 PolarHBondContact O-N 3.48Å; C80-Q83 VanDerWaalsContact O-N 3.09Å; N81-Q83 PolarHBondContact O-N 3.28Å; Q83-E85 VanDerWaalsContact C-N 3.31Å; Q83-E85 PolarHBondContact O-N 2.89Å; Q83-R86 PolarHBondContact O-N 2.87Å; Q83-R86 VanDerWaalsContact O-N 3.15Å; Q83-A87 PolarHBondContact O-N 3.04Å
84	C	55.3	Low	62.8	Low	38 Å²	38	98.3 Å²	98.3	26%	0.257	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-38.9	176	-60.3	0	0	0	0	111.7	C80 N81 R86 A87 C99	C80-C84 PolarHBondContact O-N 2.97Å; C80-C84 PolarHBondContact O-SG 3.35Å; N81-C84 PolarHBondContact O-N 3.16Å; C84-R86 PolarHBondContact O-N 3.36Å; C84-A87 PolarHBondContact O-N 3.02Å; C84-C99 PolarHBondContact SG-SG 3.29Å
85	E	57.7	Low	61.1	Low	157 Å²	157	101.6 Å²	101.6	73%	0.734	58%	0.583	S	S	*	*	H	α-helix	trans	-66	-24.4	177.9	-145.9	164.8	92.9	0	0	112.6	Q83	Q83-E85 VanDerWaalsContact C-N 3.31Å; Q83-E85 PolarHBondContact O-N 2.89Å
86	R	53.3	Low	59.4	Low	199 Å²	199	99.2 Å²	99.2	75%	0.751	57%	0.574	S	S	*	*	H	α-helix	trans	-85.6	-28	174.6	-77.2	-169.8	174.3	89.5	-3.7	114	Q83 C84 G88	Q83-R86 PolarHBondContact O-N 2.87Å; Q83-R86 VanDerWaalsContact O-N 3.15Å; C84-R86 PolarHBondContact O-N 3.36Å; R86-G88 VanDerWaalsContact C-N 3.31Å; R86-G88 PolarHBondContact O-N 3.11Å
87	A	52.5	Low	58.1	Low	61 Å²	61	102.8 Å²	102.8	50%	0.504	60%	0.601	S	S	.	*	H	α-helix	trans	-73.1	-22.8	-178.7	0	0	0	0	0	113	Q83 C84 N89 S90	Q83-A87 PolarHBondContact O-N 3.04Å; C84-A87 PolarHBondContact O-N 3.02Å; A87-N89 PolarHBondContact O-N 3.2Å; A87-S90 PolarHBondContact O-N 2.96Å; A87-S90 VanDerWaalsContact O-N 3.11Å
88	G	52.3	Low	57	Low	67 Å²	67	97.6 Å²	97.6	69%	0.691	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-14.2	179.7	0	0	0	0	0	116	R86	R86-G88 VanDerWaalsContact C-N 3.31Å; R86-G88 PolarHBondContact O-N 3.11Å
89	N	53.1	Low	55.6	Low	158 Å²	158	99.4 Å²	99.4	85%	0.845	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	3.1	177.5	-89.4	29.9	0	0	0	114.5	A87	A87-N89 PolarHBondContact O-N 3.2Å
90	S	51.7	Low	54.4	Low	89 Å²	89	103 Å²	103	62%	0.622	63%	0.634	S	S	*	*	S	Bend	trans	-116.7	102.8	176.3	-120.7	0	0	0	0	109.7	A87 G92	A87-S90 PolarHBondContact O-N 2.96Å; A87-S90 VanDerWaalsContact O-N 3.11Å; S90-G92 PolarHBondContact O-N 2.94Å
91	Y	48.6	Very low	53.3	Low	245 Å²	245	107.1 Å²	107.1	96%	0.961	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	106.5	166.7	-65.3	-90	0	0	0	109.1
92	G	48.1	Very low	52.2	Low	84 Å²	84	109 Å²	109	87%	0.866	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.6	21.7	165.4	0	0	0	0	0	119.5	S90	S90-G92 PolarHBondContact O-N 2.94Å
93	G	49.6	Very low	51.2	Low	55 Å²	55	108.4 Å²	108.4	57%	0.567	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-97	149.2	172.5	0	0	0	0	0	114.2
94	P	49	Very low	50.2	Low	106 Å²	106	109.8 Å²	109.8	69%	0.688	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-64.5	135.5	-175.3	25.6	-31.8	0	0	0	112.2
95	S	48.7	Very low	49.6	Very low	118 Å²	118	113.5 Å²	113.5	83%	0.825	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-73.3	121	-176.3	13.5	0	0	0	0	112.2
96	C	50	Low	48.6	Very low	38 Å²	38	113.8 Å²	113.8	26%	0.257	72%	0.716	S	S	.	*	P	Polyproline II helix	trans	-73.5	135	168.8	-67.4	0	0	0	0	110.9	G98	C96-G98 PolarHBondContact O-N 3.39Å
97	P	51.7	Low	48.1	Very low	136 Å²	136	108.3 Å²	108.3	88%	0.883	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	89.6	173.5	28.6	-30.9	0	0	0	109.5
98	G	55	Low	47.4	Very low	74 Å²	74	113.1 Å²	113.1	76%	0.763	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.4	-10.1	178.7	0	0	0	0	0	115.9	C96	C96-G98 PolarHBondContact O-N 3.39Å
99	C	46.6	Very low	46.9	Very low	67 Å²	67	118.6 Å²	118.6	45%	0.453	73%	0.731	S	S	.	*	S	Bend	trans	-86.6	136	174.8	-63.1	0	0	0	0	110.7	C84 N101	C84-C99 PolarHBondContact SG-SG 3.29Å; C99-N101 PolarHBondContact O-N 3.23Å
100	P	50.8	Low	45.8	Very low	123 Å²	123	114.1 Å²	114.1	80%	0.799	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-59.3	125.9	167.4	-1.9	11.3	0	0	0	108.5	P102	P100-P102 WeakPolarHBondContact O-CD 3.37Å
101	N	47	Very low	44.9	Very low	135 Å²	135	120.6 Å²	120.6	72%	0.722	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-63.7	126	177.5	-142.5	5.1	0	0	0	108.1	C99 S103	C99-N101 PolarHBondContact O-N 3.23Å; N101-S103 PolarHBondContact O-N 3.36Å
102	P	49.1	Very low	44.6	Very low	128 Å²	128	116.3 Å²	116.3	83%	0.831	73%	0.727	S	S	*	*			trans	-76.1	66.6	169.1	32.3	-31.1	0	0	0	108	P100	P100-P102 WeakPolarHBondContact O-CD 3.37Å
103	S	41.8	Very low	44.1	Very low	72 Å²	72	119 Å²	119	50%	0.503	72%	0.722	S	S	.	*			trans	-107.1	127.9	165.7	-59.4	0	0	0	0	106.4	N101	N101-S103 PolarHBondContact O-N 3.36Å
104	D	41.7	Very low	43.6	Very low	155 Å²	155	122.9 Å²	122.9	83%	0.829	74%	0.737	S	S	*	*	S	Bend	trans	88.8	62.6	171.4	-49.5	-26.4	0	0	0	117.2
105	S	43.7	Very low	43.2	Very low	116 Å²	116	123.6 Å²	123.6	81%	0.811	74%	0.739	S	S	*	*			trans	-149.7	97.3	140.7	-83.6	0	0	0	0	110.8	S107	S105-S107 PolarHBondContact O-N 2.97Å
106	N	37.2	Very low	42.5	Very low	163 Å²	163	126.5 Å²	126.5	87%	0.872	74%	0.74	S	S	*	*			trans	-42.3	99	162.8	-146.5	-10.8	0	0	0	110
107	S	42.1	Very low	41.9	Very low	85 Å²	85	130 Å²	130	59%	0.594	77%	0.765	S	S	*	*			trans	-146.1	90.8	167.5	-108.4	0	0	0	0	109.3	S105 K109	S105-S107 PolarHBondContact O-N 2.97Å; S107-K109 PolarHBondContact O-N 2.76Å
108	N	37.2	Very low	40.9	Very low	161 Å²	161	131.2 Å²	131.2	86%	0.861	76%	0.764	S	S	*	*			trans	-48.7	85.7	149.6	-77.5	-27.1	0	0	0	109.7
109	K	41.3	Very low	40.5	Very low	182 Å²	182	136.3 Å²	136.3	79%	0.791	77%	0.768	S	S	*	*			trans	-144.8	77.9	162.7	-69.9	-176.2	179.4	171.7	0	104	S107	S107-K109 PolarHBondContact O-N 2.76Å
110	G	31.5	Very low	40	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	79%	0.79	S	S	*	*				82.4	103.5	79.3	0	0	0	0	0	107.7
111	Y	32.8	Very low	39.7	Very low	224 Å²	224	141.9 Å²	141.9	88%	0.878	78%	0.784	S	S	*	*			trans	178.8	94.5	140.9	-98.8	-73.3	0	0	0	110.3
112	L	41.5	Very low	39.2	Very low	155 Å²	155	146.7 Å²	146.7	81%	0.812	79%	0.792	S	S	*	*			trans	33.8	116.6	142.1	-71.5	123.1	0	0	0	121.3
113	N	38.7	Very low	39.3	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	78%	0.784	S	S	*	*			trans	-57.7	144.1	152.3	-61.2	-56.9	0	0	0	110.7	V115	N113-V115 HydrophobicContact CB-CG2 4.44Å; N113-V115 PolarHBondContact O-N 3.34Å
114	P	38.8	Very low	38.9	Very low	137 Å²	137	149.9 Å²	149.9	89%	0.89	80%	0.8	S	S	*	*			trans	-78.5	92.4	169.5	31.7	-28.1	0	0	0	108.5
115	V	40.4	Very low	39.5	Very low	120 Å²	120	147.9 Å²	147.9	73%	0.727	79%	0.793	S	S	*	*			trans	-109.4	110.6	163.8	174.2	0	0	0	0	106.6	N113	N113-V115 HydrophobicContact CB-CG2 4.44Å; N113-V115 PolarHBondContact O-N 3.34Å
116	E	34.3	Very low	39.9	Very low	180 Å²	180	150.2 Å²	150.2	84%	0.841	79%	0.789	S	S	*	*			trans	45.9	132.4	140.9	-135.8	160.3	112.2	0	0	119.6
117	S	37.8	Very low	40.4	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	78%	0.78	S	S	*	*			trans	90.6	100.6	167.1	75.2	0	0	0	0	118.5
118	N	30.8	Very low	40.6	Very low	161 Å²	161	149 Å²	149	86%	0.861	78%	0.784	S	S	*	*			trans	34.6	85.6	132.4	-55.3	-19.4	0	0	0	119.1
119	E	46.2	Very low	41.4	Very low	182 Å²	182	144.7 Å²	144.7	85%	0.85	77%	0.766	S	S	*	*			trans	-162.9	126.9	141	-141.6	160.5	112.3	0	0	111.4	V121	E119-V121 PolarHBondContact O-N 3.36Å
120	E	34.7	Very low	41.8	Very low	194 Å²	194	143.5 Å²	143.5	91%	0.907	76%	0.758	S	S	*	*			trans	-69	92.3	179.3	-74.2	-177.7	127.4	0	0	111.6	R122	E120-R122 PolarHBondContact O-N 3.41Å
121	V	45.4	Very low	42.5	Very low	113 Å²	113	150.2 Å²	150.2	69%	0.685	76%	0.763	S	S	*	*			trans	-96	94	170.3	-173.6	0	0	0	0	110	E119 V123	E119-V121 PolarHBondContact O-N 3.36Å; V121-V123 HydrophobicContact CG1-CG1 4.15Å; V121-V123 PolarHBondContact O-N 3.16Å
122	R	36.4	Very low	43.4	Very low	235 Å²	235	146.6 Å²	146.6	89%	0.887	75%	0.754	S	S	*	*			trans	-71.6	90.6	168.6	-73.4	-153.9	-78.9	-149.1	-4.5	110.7	E120	E120-R122 PolarHBondContact O-N 3.41Å
123	V	50.8	Low	43.8	Very low	110 Å²	110	144.8 Å²	144.8	67%	0.667	74%	0.74	S	S	*	*			trans	-81.1	126.5	168	-82.9	0	0	0	0	111.1	V121 V125	V121-V123 HydrophobicContact CG1-CG1 4.15Å; V121-V123 PolarHBondContact O-N 3.16Å; V123-V125 VanDerWaalsContact C-N 3.33Å; V123-V125 HydrophobicContact CB-CG2 4.15Å; V123-V125 HydrophobicContact CG2-CG2 3.96Å; V123-V125 PolarHBondContact O-N 3.39Å
124	N	33.7	Very low	44.4	Very low	157 Å²	157	143.8 Å²	143.8	84%	0.84	73%	0.734	S	S	*	*			trans	-71.9	75.6	-178.8	-63.6	-28.9	0	0	0	111.7
125	V	54.5	Low	44.8	Very low	113 Å²	113	147.7 Å²	147.7	69%	0.685	73%	0.731	S	S	*	*			trans	-89.8	-4	-175.6	-175.3	0	0	0	0	113.5	V123	V123-V125 VanDerWaalsContact C-N 3.33Å; V123-V125 HydrophobicContact CB-CG2 4.15Å; V123-V125 HydrophobicContact CG2-CG2 3.96Å; V123-V125 PolarHBondContact O-N 3.39Å
126	F	50.9	Low	45.3	Very low	166 Å²	166	145.7 Å²	145.7	73%	0.728	72%	0.722	S	S	*	*	S	Bend	trans	-92.4	-18.9	-170.4	-131.6	-99.6	0	0	0	115.9
127	S	48.6	Very low	46.1	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	70%	0.704	S	S	*	*	S	Bend	trans	-96.5	-25.6	-170.4	-170.5	0	0	0	0	115.6
128	N	46.9	Very low	46.8	Very low	125 Å²	125	142.3 Å²	142.3	67%	0.668	70%	0.7	S	S	*	*	H	α-helix	trans	-85.4	-15.4	179.3	-83.8	-13.2	0	0	0	113.3	Y130 E132	N128-Y130 PolarHBondContact O-N 2.89Å; N128-E132 PolarHBondContact O-N 3.17Å
129	S	53.3	Low	48.7	Very low	71 Å²	71	136.7 Å²	136.7	50%	0.497	67%	0.673	S	S	.	*	H	α-helix	trans	-67.9	-33.8	-178.3	-155.4	0	0	0	0	112.6	K133	S129-K133 VanDerWaalsContact O-CB 3.24Å; S129-K133 WeakPolarHBondContact O-CB 3.34Å; S129-K133 PolarHBondContact O-N 2.77Å; S129-K133 VanDerWaalsContact O-N 3.15Å
130	Y	49.2	Very low	50.2	Low	157 Å²	157	132.3 Å²	132.3	62%	0.616	66%	0.663	S	S	*	*	H	α-helix	trans	-73	-37.9	-179.6	-72.9	-89.4	0	0	0	113.7	N128 L134	N128-Y130 PolarHBondContact O-N 2.89Å; Y130-L134 WeakPolarHBondContact O-CB 3.4Å; Y130-L134 WeakPolarHBondContact O-CD1 3.32Å; Y130-L134 WeakPolarHBondContact O-CG 3.36Å; Y130-L134 PolarHBondContact O-N 3.34Å
131	R	46.5	Very low	52.3	Low	205 Å²	205	130.9 Å²	130.9	77%	0.774	65%	0.65	S	S	*	*	H	α-helix	trans	-76.3	-34.5	-178.7	-93	-174.1	145.9	-157.8	-5.1	113.1	R135	R131-R135 PolarHBondContact O-N 2.84Å
132	E	52.3	Low	54	Low	148 Å²	148	129.1 Å²	129.1	69%	0.692	63%	0.634	S	S	*	*	H	α-helix	trans	-74.8	-32.6	173.3	-63.2	-140.9	143	0	0	112.1	N128 R135 S136	N128-E132 PolarHBondContact O-N 3.17Å; E132-R135 PolarHBondContact O-N 3.39Å; E132-S136 WeakPolarHBondContact O-CB 3.35Å; E132-S136 PolarHBondContact O-N 3.48Å
133	K	49.4	Very low	56.4	Low	117 Å²	117	122 Å²	122	51%	0.509	61%	0.614	S	S	.	*	H	α-helix	trans	-64.1	-44.3	170.8	-133.6	171.8	-177.6	176.5	0	111.2	S129 R135 S136 Y137	S129-K133 VanDerWaalsContact O-CB 3.24Å; S129-K133 WeakPolarHBondContact O-CB 3.34Å; S129-K133 PolarHBondContact O-N 2.77Å; S129-K133 VanDerWaalsContact O-N 3.15Å; K133-R135 PolarHBondContact O-N 3.18Å; K133-S136 CarbonylContact O-C 3.56Å; K133-S136 PolarHBondContact O-N 3.35Å; K133-Y137 HydrophobicContact CB-CD2 4.37Å; K133-Y137 HydrophobicContact CB-CE2 3.78Å; K133-Y137 HydrophobicContact CD-CE2 4.15Å; K133-Y137 WeakPolarHBondContact CE-OH 3.46Å; K133-Y137 HydrophobicContact CG-CD2 4.44Å; K133-Y137 HydrophobicContact CG-CE2 3.52Å; K133-Y137 WeakPolarHBondContact O-CD2 3.49Å; K133-Y137 WeakPolarHBondContact O-CE2 3.49Å; K133-Y137 VanDerWaalsContact O-CG 3.24Å; K133-Y137 PolarHBondContact O-N 3.38Å
134	L	51.7	Low	58.1	Low	121 Å²	121	120.6 Å²	120.6	63%	0.634	61%	0.605	S	S	*	*	H	α-helix	trans	-62.3	-35.8	173.8	-81.4	159.3	0	0	0	114	Y130 Y137	Y130-L134 WeakPolarHBondContact O-CB 3.4Å; Y130-L134 WeakPolarHBondContact O-CD1 3.32Å; Y130-L134 WeakPolarHBondContact O-CG 3.36Å; Y130-L134 PolarHBondContact O-N 3.34Å; L134-Y137 PolarHBondContact O-N 2.98Å
135	R	48.1	Very low	60.7	Low	218 Å²	218	115.7 Å²	115.7	82%	0.823	58%	0.577	S	S	*	*	H	α-helix	trans	-73.9	-30.7	175.3	-158	173.8	-160.4	176	4	112.7	R131 E132 K133	R131-R135 PolarHBondContact O-N 2.84Å; E132-R135 PolarHBondContact O-N 3.39Å; K133-R135 PolarHBondContact O-N 3.18Å
136	S	49.5	Very low	62.4	Low	78 Å²	78	114.4 Å²	114.4	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-79.6	-22.9	173.3	-165.1	0	0	0	0	113	E132 K133 C138 S139	E132-S136 WeakPolarHBondContact O-CB 3.35Å; E132-S136 PolarHBondContact O-N 3.48Å; K133-S136 CarbonylContact O-C 3.56Å; K133-S136 PolarHBondContact O-N 3.35Å; S136-C138 PolarHBondContact O-N 3.03Å; S136-S139 WeakPolarHBondContact O-CB 3.35Å; S136-S139 PolarHBondContact O-N 3.07Å
137	Y	51.4	Low	64.4	Low	119 Å²	119	110.6 Å²	110.6	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-69.4	-18.8	171	-72.6	-56.8	0	0	0	113	K133 L134 S139 H142	K133-Y137 HydrophobicContact CB-CD2 4.37Å; K133-Y137 HydrophobicContact CB-CE2 3.78Å; K133-Y137 HydrophobicContact CD-CE2 4.15Å; K133-Y137 WeakPolarHBondContact CE-OH 3.46Å; K133-Y137 HydrophobicContact CG-CD2 4.44Å; K133-Y137 HydrophobicContact CG-CE2 3.52Å; K133-Y137 WeakPolarHBondContact O-CD2 3.49Å; K133-Y137 WeakPolarHBondContact O-CE2 3.49Å; K133-Y137 VanDerWaalsContact O-CG 3.24Å; K133-Y137 PolarHBondContact O-N 3.38Å; L134-Y137 PolarHBondContact O-N 2.98Å; Y137-S139 VanDerWaalsContact C-N 3.28Å; Y137-H142 AromaticContact CD1-NE2 3.74Å; Y137-H142 WeakPolarHBondContact O-CB 3.44Å
138	C	53.6	Low	66.4	Low	102 Å²	102	106.8 Å²	106.8	69%	0.689	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	24.2	167.4	-135.3	0	0	0	0	112.2	S136	S136-C138 PolarHBondContact O-N 3.03Å
139	S	69.5	Low	68.6	Low	42 Å²	42	106 Å²	106	29%	0.294	52%	0.519	S	S	.	.	S	Bend	trans	-59.2	138.1	166.1	-177	0	0	0	0	109	S136 Y137 Y141 H142 L143	S136-S139 WeakPolarHBondContact O-CB 3.35Å; S136-S139 PolarHBondContact O-N 3.07Å; Y137-S139 VanDerWaalsContact C-N 3.28Å; S139-Y141 PolarHBondContact O-N 2.99Å; S139-Y141 WeakPolarHBondContact OG-CD2 3.4Å; S139-H142 PolarHBondContact O-N 3.26Å; S139-L143 PolarHBondContact O-N 2.96Å
140	S	78.4	Confident	70.5	Confident	91 Å²	91	108.4 Å²	108.4	64%	0.636	53%	0.526	S	S	*	.	H	α-helix	trans	-48.5	-28.1	179.6	-56.6	0	0	0	0	112.4	L143 V144	S140-L143 PolarHBondContact O-N 2.9Å; S140-V144 WeakPolarHBondContact O-CB 3.49Å; S140-V144 WeakPolarHBondContact O-CG2 3.08Å; S140-V144 PolarHBondContact O-N 3.48Å
141	Y	77.5	Confident	72.7	Confident	163 Å²	163	104.4 Å²	104.4	64%	0.639	52%	0.515	S	S	*	.	H	α-helix	trans	-61.4	-45.2	172.8	-64.5	-74	0	0	0	113.9	S139 Q145	S139-Y141 PolarHBondContact O-N 2.99Å; S139-Y141 WeakPolarHBondContact OG-CD2 3.4Å; Y141-Q145 VanDerWaalsContact O-CB 3.27Å; Y141-Q145 WeakPolarHBondContact O-CB 3.33Å; Y141-Q145 PolarHBondContact O-N 3.34Å
142	H	81.4	Confident	75	Confident	76 Å²	76	95.3 Å²	95.3	35%	0.352	48%	0.481	S	S	.	.	H	α-helix	trans	-68.3	-38.2	177.3	-88.1	-70.1	0	0	0	111.9	Y137 S139 Q145 T146	Y137-H142 AromaticContact CD1-NE2 3.74Å; Y137-H142 WeakPolarHBondContact O-CB 3.44Å; S139-H142 PolarHBondContact O-N 3.26Å; H142-Q145 PolarHBondContact O-N 3.33Å; H142-T146 WeakPolarHBondContact O-CG2 3.33Å; H142-T146 PolarHBondContact O-N 3.36Å; H142-T146 PolarHBondContact O-OG1 3.42Å
143	L	86.5	Confident	77	Confident	87 Å²	87	89.9 Å²	89.9	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-49.7	175	-156.4	-173.3	0	0	0	110.4	S139 S140 Q145 T146 I147	S139-L143 PolarHBondContact O-N 2.96Å; S140-L143 PolarHBondContact O-N 2.9Å; L143-Q145 VanDerWaalsContact C-N 3.3Å; L143-Q145 PolarHBondContact O-N 3.24Å; L143-T146 WeakPolarHBondContact CA-OG1 3.48Å; L143-T146 PolarHBondContact O-N 3.04Å; L143-T146 PolarHBondContact O-OG1 2.95Å; L143-I147 HydrophobicContact CD2-CD1 3.17Å; L143-I147 HydrophobicContact CD2-CG1 3.62Å; L143-I147 PolarHBondContact O-N 3.14Å
144	V	87.5	Confident	79.2	Confident	79 Å²	79	90.6 Å²	90.6	48%	0.479	47%	0.465	S	S	.	.	H	α-helix	trans	-59.8	-42	176.9	169.8	0	0	0	0	111.1	L74 S140 T146 L148	L74-V144 HydrophobicContact CD1-CG1 4.31Å; S140-V144 WeakPolarHBondContact O-CB 3.49Å; S140-V144 WeakPolarHBondContact O-CG2 3.08Å; S140-V144 PolarHBondContact O-N 3.48Å; V144-T146 PolarHBondContact O-N 3.21Å; V144-L148 VanDerWaalsContact O-CB 3.23Å; V144-L148 WeakPolarHBondContact O-CB 3.37Å; V144-L148 PolarHBondContact O-N 3.42Å
145	Q	87.5	Confident	81.2	Confident	55 Å²	55	85.9 Å²	85.9	26%	0.257	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-41.4	178.4	-177.9	174.2	-0.6	0	0	112.6	Y141 H142 L143 H149	Y141-Q145 VanDerWaalsContact O-CB 3.27Å; Y141-Q145 WeakPolarHBondContact O-CB 3.33Å; Y141-Q145 PolarHBondContact O-N 3.34Å; H142-Q145 PolarHBondContact O-N 3.33Å; L143-Q145 VanDerWaalsContact C-N 3.3Å; L143-Q145 PolarHBondContact O-N 3.24Å; Q145-H149 WeakPolarHBondContact O-CB 3.23Å; Q145-H149 PolarHBondContact O-N 3.43Å
146	T	90.7	Very high	83.5	Confident	86 Å²	86	76.5 Å²	76.5	53%	0.528	41%	0.411	S	S	.	.	H	α-helix	trans	-71.4	-42.9	179.3	49.7	0	0	0	0	112	H142 L143 V144 L148 H149 L150	H142-T146 WeakPolarHBondContact O-CG2 3.33Å; H142-T146 PolarHBondContact O-N 3.36Å; H142-T146 PolarHBondContact O-OG1 3.42Å; L143-T146 WeakPolarHBondContact CA-OG1 3.48Å; L143-T146 PolarHBondContact O-N 3.04Å; L143-T146 PolarHBondContact O-OG1 2.95Å; V144-T146 PolarHBondContact O-N 3.21Å; T146-L148 VanDerWaalsContact C-N 3.33Å; T146-L148 PolarHBondContact O-N 3.03Å; T146-H149 WeakPolarHBondContact O-CB 3.33Å; T146-H149 PolarHBondContact O-N 3.19Å; T146-L150 PolarHBondContact O-N 2.88Å
147	I	92.1	Very high	85.6	Confident	85 Å²	85	80.5 Å²	80.5	44%	0.436	42%	0.416	S	S	.	.	H	α-helix	trans	-60.1	-45.4	172.9	-72.4	-179.9	0	0	0	110.6	L143 H149 L150 I151	L143-I147 HydrophobicContact CD2-CD1 3.17Å; L143-I147 HydrophobicContact CD2-CG1 3.62Å; L143-I147 PolarHBondContact O-N 3.14Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.07Å; I147-L150 WeakPolarHBondContact O-CB 3.41Å; I147-L150 PolarHBondContact O-N 3.43Å; I147-L150 VanDerWaalsContact O-N 3.14Å; I147-I151 HydrophobicContact CG2-CD1 3.72Å; I147-I151 HydrophobicContact CG2-CG1 4.3Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 2.94Å
148	L	91.8	Very high	87.6	Confident	17 Å²	17	76.2 Å²	76.2	9%	0.089	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-36.8	179.3	-166.9	71.7	0	0	0	111.6	L67 L70 R71 L74 V144 T146 H152	L67-L148 HydrophobicContact CD2-CD1 3.69Å; L70-L148 HydrophobicContact CB-CD2 4.48Å; L70-L148 HydrophobicContact CD2-CD1 4.16Å; L70-L148 HydrophobicContact CD2-CD2 4.17Å; L70-L148 HydrophobicContact CG-CD2 4.04Å; R71-L148 HydrophobicContact CB-CD2 3.86Å; R71-L148 HydrophobicContact CG-CD2 4.46Å; L74-L148 HydrophobicContact CD1-CD2 3.72Å; V144-L148 VanDerWaalsContact O-CB 3.23Å; V144-L148 WeakPolarHBondContact O-CB 3.37Å; V144-L148 PolarHBondContact O-N 3.42Å; T146-L148 VanDerWaalsContact C-N 3.33Å; T146-L148 PolarHBondContact O-N 3.03Å; L148-H152 VanDerWaalsContact O-CB 3.28Å; L148-H152 WeakPolarHBondContact O-CB 3.48Å; L148-H152 PolarHBondContact O-N 3.32Å
149	H	92.3	Very high	89.5	Confident	108 Å²	108	71.7 Å²	71.7	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173	179.6	80.9	0	0	0	112	Q145 T146 I147 H152 A153	Q145-H149 WeakPolarHBondContact O-CB 3.23Å; Q145-H149 PolarHBondContact O-N 3.43Å; T146-H149 WeakPolarHBondContact O-CB 3.33Å; T146-H149 PolarHBondContact O-N 3.19Å; I147-H149 VanDerWaalsContact C-N 3.26Å; I147-H149 PolarHBondContact O-N 3.07Å; H149-H152 PolarHBondContact O-N 2.9Å; H149-A153 WeakPolarHBondContact O-CB 3.17Å; H149-A153 PolarHBondContact O-N 3.27Å
150	L	94	Very high	90.7	Very high	122 Å²	122	75.1 Å²	75.1	64%	0.639	38%	0.382	S	S	*	.	H	α-helix	trans	-60.5	-47.1	176.3	-179.4	66.5	0	0	0	111.7	T146 I147 H152 A153 F154	T146-L150 PolarHBondContact O-N 2.88Å; I147-L150 WeakPolarHBondContact O-CB 3.41Å; I147-L150 PolarHBondContact O-N 3.43Å; I147-L150 VanDerWaalsContact O-N 3.14Å; L150-H152 VanDerWaalsContact C-N 3.34Å; L150-H152 PolarHBondContact O-N 2.98Å; L150-A153 PolarHBondContact O-N 3.32Å; L150-F154 WeakPolarHBondContact O-CB 3.28Å; L150-F154 PolarHBondContact O-N 2.89Å
151	I	95.1	Very high	91.3	Very high	74 Å²	74	75.5 Å²	75.5	38%	0.379	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-45.3	177.4	-66.1	169.3	0	0	0	110.3	L67 I147 A153 F154 M155	L67-I151 HydrophobicContact CD1-CG2 3.96Å; I147-I151 HydrophobicContact CG2-CD1 3.72Å; I147-I151 HydrophobicContact CG2-CG1 4.3Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 2.94Å; I151-A153 PolarHBondContact O-N 3.02Å; I151-F154 PolarHBondContact O-N 3.12Å; I151-M155 HydrophobicContact CG2-CG 4.34Å; I151-M155 WeakPolarHBondContact O-CG 3.3Å; I151-M155 PolarHBondContact O-N 2.82Å
152	H	94.4	Very high	91.9	Very high	13 Å²	13	68.2 Å²	68.2	6%	0.06	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-42.8	178	-177.4	-84.9	0	0	0	112.2	Y64 E68 R71 L148 H149 L150 M155 G156	Y64-H152 AromaticContact CE1-NE2 3.81Å; Y64-H152 AromaticContact CE2-CE1 3.55Å; Y64-H152 AromaticContact CE2-NE2 3.69Å; Y64-H152 AromaticContact CZ-CE1 3.34Å; Y64-H152 AromaticContact CZ-NE2 3.51Å; Y64-H152 PolarHBondContact OH-CE1 2.9Å; Y64-H152 VanDerWaalsContact OH-CE1 3.23Å; E68-H152 WeakPolarHBondContact CB-NE2 3.48Å; R71-H152 PolarHBondContact NH1-ND1 2.95Å; L148-H152 VanDerWaalsContact O-CB 3.28Å; L148-H152 WeakPolarHBondContact O-CB 3.48Å; L148-H152 PolarHBondContact O-N 3.32Å; H149-H152 PolarHBondContact O-N 2.9Å; L150-H152 VanDerWaalsContact C-N 3.34Å; L150-H152 PolarHBondContact O-N 2.98Å; H152-M155 PolarHBondContact O-N 3.36Å; H152-G156 PolarHBondContact O-N 3.38Å
153	A	95	Very high	92.4	Very high	34 Å²	34	67 Å²	67	28%	0.281	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-45.9	175.8	0	0	0	0	0	111.4	H149 L150 I151 M155 G156 Y157	H149-A153 WeakPolarHBondContact O-CB 3.17Å; H149-A153 PolarHBondContact O-N 3.27Å; L150-A153 PolarHBondContact O-N 3.32Å; I151-A153 PolarHBondContact O-N 3.02Å; A153-M155 VanDerWaalsContact C-N 3.34Å; A153-M155 PolarHBondContact O-N 3.02Å; A153-G156 PolarHBondContact O-N 2.96Å; A153-Y157 WeakPolarHBondContact O-CD2 3.18Å; A153-Y157 PolarHBondContact O-N 3.17Å
154	F	94.8	Very high	92.5	Very high	132 Å²	132	67.7 Å²	67.7	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-57.2	-45.9	176.5	-179	-107.6	0	0	0	112.2	L150 I151 G156 Y157 I158	L150-F154 WeakPolarHBondContact O-CB 3.28Å; L150-F154 PolarHBondContact O-N 2.89Å; I151-F154 PolarHBondContact O-N 3.12Å; F154-G156 PolarHBondContact O-N 3.38Å; F154-Y157 PolarHBondContact O-N 3.33Å; F154-I158 HydrophobicContact CD1-CD1 3.74Å; F154-I158 HydrophobicContact CE1-CD1 3.31Å; F154-I158 HydrophobicContact CE1-CG1 4.37Å; F154-I158 HydrophobicContact CE2-CD1 4.38Å; F154-I158 HydrophobicContact CG-CD1 4.45Å; F154-I158 HydrophobicContact CZ-CD1 3.67Å; F154-I158 HydrophobicContact CZ-CG1 4.4Å; F154-I158 WeakPolarHBondContact O-CG1 3.25Å; F154-I158 PolarHBondContact O-N 3.39Å
155	M	94.1	Very high	92.5	Very high	22 Å²	22	65.3 Å²	65.3	11%	0.108	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-39.8	176.7	-65.3	-77.8	-79.9	0	0	112.2	L60 I63 Y64 L67 I151 H152 A153 I158 L159	L60-M155 HydrophobicContact CD1-CE 3.25Å; L60-M155 HydrophobicContact CD1-SD 3.63Å; L60-M155 HydrophobicContact CG-CE 3.82Å; L60-M155 HydrophobicContact CG-SD 4.37Å; I63-M155 HydrophobicContact CB-CE 4.04Å; I63-M155 HydrophobicContact CG2-CE 3.59Å; Y64-M155 HydrophobicContact CD2-CB 4.07Å; L67-M155 HydrophobicContact CD1-CG 4.27Å; I151-M155 HydrophobicContact CG2-CG 4.34Å; I151-M155 WeakPolarHBondContact O-CG 3.3Å; I151-M155 PolarHBondContact O-N 2.82Å; H152-M155 PolarHBondContact O-N 3.36Å; A153-M155 VanDerWaalsContact C-N 3.34Å; A153-M155 PolarHBondContact O-N 3.02Å; M155-I158 PolarHBondContact O-N 2.84Å; M155-L159 PolarHBondContact O-N 3.2Å
156	G	95.5	Very high	92.4	Very high	22 Å²	22	65.8 Å²	65.8	23%	0.227	33%	0.334	C	S	.	.	H	α-helix	trans	-60.7	-43	174.8	0	0	0	0	0	112.6	H152 A153 F154 L159 M160	H152-G156 PolarHBondContact O-N 3.38Å; A153-G156 PolarHBondContact O-N 2.96Å; F154-G156 PolarHBondContact O-N 3.38Å; G156-L159 PolarHBondContact O-N 3.46Å; G156-M160 WeakPolarHBondContact O-CB 3.47Å; G156-M160 PolarHBondContact O-N 3.47Å
157	Y	95	Very high	92.3	Very high	161 Å²	161	61.8 Å²	61.8	63%	0.631	31%	0.31	S	S	*	.	H	α-helix	trans	-66.7	-38.1	175.3	-73.4	-63.1	0	0	0	112.7	A153 F154 M160 L161	A153-Y157 WeakPolarHBondContact O-CD2 3.18Å; A153-Y157 PolarHBondContact O-N 3.17Å; F154-Y157 PolarHBondContact O-N 3.33Å; Y157-M160 PolarHBondContact O-N 2.77Å; Y157-L161 VanDerWaalsContact O-CG 3.32Å; Y157-L161 WeakPolarHBondContact O-CG 3.24Å; Y157-L161 PolarHBondContact O-N 2.85Å
158	I	93.2	Very high	92.2	Very high	29 Å²	29	59.9 Å²	59.9	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-47.5	173.8	-69.3	170.9	0	0	0	110.8	L38 L60 F154 M155 M160 L161 I162	L38-I158 HydrophobicContact CD1-CB 4.24Å; L38-I158 HydrophobicContact CD1-CG1 4.13Å; L38-I158 HydrophobicContact CD1-CG2 3.64Å; L60-I158 HydrophobicContact CD2-CB 4.2Å; L60-I158 HydrophobicContact CD2-CG2 3.4Å; F154-I158 HydrophobicContact CD1-CD1 3.74Å; F154-I158 HydrophobicContact CE1-CD1 3.31Å; F154-I158 HydrophobicContact CE1-CG1 4.37Å; F154-I158 HydrophobicContact CE2-CD1 4.38Å; F154-I158 HydrophobicContact CG-CD1 4.45Å; F154-I158 HydrophobicContact CZ-CD1 3.67Å; F154-I158 HydrophobicContact CZ-CG1 4.4Å; F154-I158 WeakPolarHBondContact O-CG1 3.25Å; F154-I158 PolarHBondContact O-N 3.39Å; M155-I158 PolarHBondContact O-N 2.84Å; I158-M160 VanDerWaalsContact C-N 3.31Å; I158-M160 PolarHBondContact O-N 3.32Å; I158-L161 WeakPolarHBondContact O-CB 3.44Å; I158-L161 PolarHBondContact O-N 3.42Å; I158-I162 HydrophobicContact CG2-CD1 3.88Å; I158-I162 HydrophobicContact CG2-CG1 4.45Å; I158-I162 WeakPolarHBondContact O-CG1 3.18Å; I158-I162 PolarHBondContact O-N 2.94Å
159	L	93.5	Very high	92.2	Very high	7 Å²	7	64.9 Å²	64.9	4%	0.037	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-38.8	178.8	-75.5	166.8	0	0	0	111.8	L60 A61 Y64 M155 G156 I162 V163 V174 F178	L60-L159 HydrophobicContact CB-CD2 4.22Å; L60-L159 HydrophobicContact CD2-CD2 3.83Å; L60-L159 HydrophobicContact CD2-CG 3.9Å; L60-L159 HydrophobicContact CG-CD2 4.23Å; L60-L159 HydrophobicContact CG-CG 4.32Å; A61-L159 HydrophobicContact CB-CD2 4.24Å; Y64-L159 HydrophobicContact CD2-CD1 3.98Å; Y64-L159 HydrophobicContact CG-CD1 3.9Å; M155-L159 PolarHBondContact O-N 3.2Å; G156-L159 PolarHBondContact O-N 3.46Å; L159-I162 HydrophobicContact CD2-CD1 4.47Å; L159-I162 WeakPolarHBondContact O-CB 3.49Å; L159-I162 PolarHBondContact O-N 2.86Å; L159-V163 WeakPolarHBondContact O-CG2 3.48Å; L159-V163 PolarHBondContact O-N 3.49Å; L159-V174 HydrophobicContact CD2-CG1 4.24Å; L159-V174 HydrophobicContact CD2-CG2 4.12Å; L159-F178 HydrophobicContact CD1-CE1 3.96Å; L159-F178 HydrophobicContact CD1-CZ 3.66Å
160	M	94	Very high	92.2	Very high	114 Å²	114	59.8 Å²	59.8	56%	0.562	30%	0.297	S	S	*	.	H	α-helix	trans	-60.5	-48.1	172.2	-176.5	-179.5	177.1	0	0	111.3	G156 Y157 I158 I162 V163 M164	G156-M160 WeakPolarHBondContact O-CB 3.47Å; G156-M160 PolarHBondContact O-N 3.47Å; Y157-M160 PolarHBondContact O-N 2.77Å; I158-M160 VanDerWaalsContact C-N 3.31Å; I158-M160 PolarHBondContact O-N 3.32Å; M160-I162 VanDerWaalsContact C-N 3.26Å; M160-I162 PolarHBondContact O-N 2.87Å; M160-V163 PolarHBondContact O-N 3.5Å; M160-V163 VanDerWaalsContact O-N 3.14Å; M160-M164 HydrophobicContact CG-CG 4.48Å; M160-M164 VanDerWaalsContact O-CG 3.23Å; M160-M164 WeakPolarHBondContact O-CG 3.37Å; M160-M164 PolarHBondContact O-N 3.49Å
161	L	91.3	Very high	92.2	Very high	99 Å²	99	55.9 Å²	55.9	52%	0.518	28%	0.276	S	S	.	.	H	α-helix	trans	-58.3	-38.2	175.7	-72.4	175.9	0	0	0	112	L38 Y157 I158 M164	L38-L161 HydrophobicContact CD1-CB 4.38Å; L38-L161 HydrophobicContact CD1-CD1 4.19Å; L38-L161 HydrophobicContact CG-CD1 4.22Å; Y157-L161 VanDerWaalsContact O-CG 3.32Å; Y157-L161 WeakPolarHBondContact O-CG 3.24Å; Y157-L161 PolarHBondContact O-N 2.85Å; I158-L161 WeakPolarHBondContact O-CB 3.44Å; I158-L161 PolarHBondContact O-N 3.42Å; L161-M164 PolarHBondContact O-N 2.94Å
162	I	91	Very high	92.1	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.051	28%	0.278	C	S	.	.	H	α-helix	trans	-64.1	-45.3	175.5	-70.3	167.5	0	0	0	110.9	L60 I158 L159 M160 M164 T165 L170 V174	L60-I162 HydrophobicContact CD2-CD1 3.97Å; I158-I162 HydrophobicContact CG2-CD1 3.88Å; I158-I162 HydrophobicContact CG2-CG1 4.45Å; I158-I162 WeakPolarHBondContact O-CG1 3.18Å; I158-I162 PolarHBondContact O-N 2.94Å; L159-I162 HydrophobicContact CD2-CD1 4.47Å; L159-I162 WeakPolarHBondContact O-CB 3.49Å; L159-I162 PolarHBondContact O-N 2.86Å; M160-I162 VanDerWaalsContact C-N 3.26Å; M160-I162 PolarHBondContact O-N 2.87Å; I162-M164 VanDerWaalsContact C-N 3.29Å; I162-M164 PolarHBondContact O-N 2.95Å; I162-T165 WeakPolarHBondContact O-CB 3.37Å; I162-T165 WeakPolarHBondContact O-CG2 3.31Å; I162-T165 PolarHBondContact O-N 2.97Å; I162-T165 VanDerWaalsContact O-N 3.16Å; I162-T165 PolarHBondContact O-OG1 3.09Å; I162-L170 HydrophobicContact CG2-CB 4.22Å; I162-L170 HydrophobicContact CG2-CD1 4.23Å; I162-V174 HydrophobicContact CG2-CG2 4.09Å
163	V	90.3	Very high	92.2	Very high	52 Å²	52	56.2 Å²	56.2	32%	0.315	28%	0.281	S	S	.	.	H	α-helix	trans	-67.1	-32.1	179.6	171.1	0	0	0	0	111.7	L159 M160 T165 Y166 L171 V174	L159-V163 WeakPolarHBondContact O-CG2 3.48Å; L159-V163 PolarHBondContact O-N 3.49Å; M160-V163 PolarHBondContact O-N 3.5Å; M160-V163 VanDerWaalsContact O-N 3.14Å; V163-T165 PolarHBondContact O-N 2.99Å; V163-T165 VanDerWaalsContact O-N 3.12Å; V163-Y166 PolarHBondContact O-N 3.12Å; V163-Y166 VanDerWaalsContact O-N 3.09Å; V163-L171 HydrophobicContact CG1-CD1 3.98Å; V163-L171 HydrophobicContact CG2-CD1 4.33Å; V163-V174 HydrophobicContact CG2-CG1 4.26Å
164	M	89.5	Confident	92.2	Very high	100 Å²	100	54.7 Å²	54.7	49%	0.493	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4	175.2	-67.9	-65.9	-70.1	0	0	113.8	M160 L161 I162 Y166	M160-M164 HydrophobicContact CG-CG 4.48Å; M160-M164 VanDerWaalsContact O-CG 3.23Å; M160-M164 WeakPolarHBondContact O-CG 3.37Å; M160-M164 PolarHBondContact O-N 3.49Å; L161-M164 PolarHBondContact O-N 2.94Å; I162-M164 VanDerWaalsContact C-N 3.29Å; I162-M164 PolarHBondContact O-N 2.95Å; M164-Y166 WeakPolarHBondContact O-CD2 3.39Å; M164-Y166 PolarHBondContact O-N 3.11Å
165	T	86.7	Confident	92.3	Very high	30 Å²	30	52.6 Å²	52.6	18%	0.184	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-9.6	168.8	65.6	0	0	0	0	112.8	Y35 I162 V163 N167	Y35-T165 HydrophobicContact CD2-CG2 4.5Å; I162-T165 WeakPolarHBondContact O-CB 3.37Å; I162-T165 WeakPolarHBondContact O-CG2 3.31Å; I162-T165 PolarHBondContact O-N 2.97Å; I162-T165 VanDerWaalsContact O-N 3.16Å; I162-T165 PolarHBondContact O-OG1 3.09Å; V163-T165 PolarHBondContact O-N 2.99Å; V163-T165 VanDerWaalsContact O-N 3.12Å; T165-N167 PolarHBondContact O-N 3.41Å
166	Y	85.3	Confident	92.4	Very high	64 Å²	64	57.9 Å²	57.9	25%	0.251	29%	0.285	S	S	.	.			trans	54	18.9	-177.8	-66.3	-84.6	0	0	0	114.4	M27 F29 N30 V163 M164	M27-Y166 HydrophobicContact SD-CE2 4.15Å; F29-Y166 WeakPolarHBondContact CA-O 3.47Å; F29-Y166 HydrophobicContact CD1-CD1 4.41Å; F29-Y166 HydrophobicContact CE1-CD1 4.32Å; N30-Y166 PolarHBondContact N-O 3.16Å; V163-Y166 PolarHBondContact O-N 3.12Å; V163-Y166 VanDerWaalsContact O-N 3.09Å; M164-Y166 WeakPolarHBondContact O-CD2 3.39Å; M164-Y166 PolarHBondContact O-N 3.11Å
167	N	88.7	Confident	92.5	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.016	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-82.9	123.8	177.2	-171.1	-68.2	0	0	0	110.7	D32 Y35 T165 Y169 L170 L171	D32-N167 PolarHBondContact O-ND2 2.62Å; Y35-N167 HydrophobicContact CE1-CB 4.49Å; Y35-N167 WeakPolarHBondContact CE1-ND2 3.05Å; T165-N167 PolarHBondContact O-N 3.41Å; N167-Y169 VanDerWaalsContact C-N 3.33Å; N167-Y169 PolarHBondContact O-N 2.76Å; N167-Y169 WeakPolarHBondContact OD1-CB 3.35Å; N167-Y169 WeakPolarHBondContact OD1-CD2 3.35Å; N167-Y169 PolarHBondContact OD1-N 2.96Å; N167-L170 HydrophobicContact CB-CB 4.3Å; N167-L170 HydrophobicContact CB-CD1 4.16Å; N167-L170 HydrophobicContact CB-CG 4.29Å; N167-L170 PolarHBondContact O-N 3.42Å; N167-L170 PolarHBondContact OD1-N 3.26Å; N167-L171 PolarHBondContact O-N 3.42Å
168	V	91.2	Very high	92.5	Very high	44 Å²	44	51.9 Å²	51.9	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-38.4	-176.4	177.9	0	0	0	0	112.4	F29 N30 T31 L171 L172	F29-V168 HydrophobicContact CB-CG2 3.86Å; N30-V168 PolarHBondContact O-N 2.91Å; N30-V168 VanDerWaalsContact O-N 3.13Å; T31-V168 HydrophobicContact CG2-CB 4.45Å; T31-V168 HydrophobicContact CG2-CG2 4.34Å; V168-L171 PolarHBondContact O-N 3.1Å; V168-L172 HydrophobicContact CG1-CD1 4.02Å; V168-L172 HydrophobicContact CG1-CG 4.32Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 WeakPolarHBondContact O-CG 3.47Å; V168-L172 PolarHBondContact O-N 3.29Å
169	Y	91.8	Very high	92.6	Very high	123 Å²	123	55 Å²	55	48%	0.482	28%	0.277	S	S	.	.	H	α-helix	trans	-66.6	-41.8	-178.6	-58.4	-71.1	0	0	0	111.8	M33 N167 A173	M33-Y169 HydrophobicContact SD-CE2 4.49Å; N167-Y169 VanDerWaalsContact C-N 3.33Å; N167-Y169 PolarHBondContact O-N 2.76Å; N167-Y169 WeakPolarHBondContact OD1-CB 3.35Å; N167-Y169 WeakPolarHBondContact OD1-CD2 3.35Å; N167-Y169 PolarHBondContact OD1-N 2.96Å; Y169-A173 WeakPolarHBondContact O-CB 3.31Å; Y169-A173 PolarHBondContact O-N 2.92Å
170	L	91.7	Very high	92.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-42.6	175.9	-70.1	179.4	0	0	0	111.7	Y35 L37 A53 I162 N167 L172 A173 V174	Y35-L170 HydrophobicContact CE2-CD1 3.46Å; Y35-L170 VanDerWaalsContact CE2-CD1 3.46Å; Y35-L170 WeakPolarHBondContact OH-CD1 3.24Å; L37-L170 HydrophobicContact CD1-CD1 3.87Å; A53-L170 HydrophobicContact CB-CD2 4.1Å; I162-L170 HydrophobicContact CG2-CB 4.22Å; I162-L170 HydrophobicContact CG2-CD1 4.23Å; N167-L170 HydrophobicContact CB-CB 4.3Å; N167-L170 HydrophobicContact CB-CD1 4.16Å; N167-L170 HydrophobicContact CB-CG 4.29Å; N167-L170 PolarHBondContact O-N 3.42Å; N167-L170 PolarHBondContact OD1-N 3.26Å; L170-L172 PolarHBondContact O-N 3.44Å; L170-A173 PolarHBondContact O-N 3.48Å; L170-V174 WeakPolarHBondContact O-CB 3.3Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.3Å; L170-V174 PolarHBondContact O-N 3.01Å
171	L	93.1	Very high	92.7	Very high	41 Å²	41	52.6 Å²	52.6	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-57.6	-50.1	175.9	-179.1	72	0	0	0	110.8	F29 V163 N167 V168 A173 V174 L175	F29-L171 HydrophobicContact CD1-CD2 4.29Å; F29-L171 HydrophobicContact CE1-CD2 3.64Å; F29-L171 HydrophobicContact CZ-CD2 4.02Å; V163-L171 HydrophobicContact CG1-CD1 3.98Å; V163-L171 HydrophobicContact CG2-CD1 4.33Å; N167-L171 PolarHBondContact O-N 3.42Å; V168-L171 PolarHBondContact O-N 3.1Å; L171-A173 PolarHBondContact O-N 2.88Å; L171-V174 PolarHBondContact O-N 3.38Å; L171-L175 HydrophobicContact CD1-CD1 4.45Å; L171-L175 HydrophobicContact CG-CD1 4.07Å; L171-L175 HydrophobicContact CG-CG 4.47Å; L171-L175 WeakPolarHBondContact O-CB 3.39Å; L171-L175 VanDerWaalsContact O-CG 3.3Å; L171-L175 WeakPolarHBondContact O-CG 3.43Å; L171-L175 PolarHBondContact O-N 2.89Å
172	L	94.6	Very high	92.7	Very high	80 Å²	80	54.5 Å²	54.5	42%	0.419	27%	0.267	S	S	.	.	H	α-helix	trans	-60.2	-46.5	177.7	-71.7	175.8	0	0	0	111.1	V168 L170 V174 L175 F176	V168-L172 HydrophobicContact CG1-CD1 4.02Å; V168-L172 HydrophobicContact CG1-CG 4.32Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 WeakPolarHBondContact O-CG 3.47Å; V168-L172 PolarHBondContact O-N 3.29Å; L170-L172 PolarHBondContact O-N 3.44Å; L172-V174 VanDerWaalsContact C-N 3.32Å; L172-V174 PolarHBondContact O-N 3.24Å; L172-L175 PolarHBondContact O-N 3.21Å; L172-F176 HydrophobicContact CB-CD2 4.39Å; L172-F176 HydrophobicContact CB-CE2 4.45Å; L172-F176 WeakPolarHBondContact O-CB 3.5Å; L172-F176 WeakPolarHBondContact O-CD2 3.4Å; L172-F176 PolarHBondContact O-N 2.88Å
173	A	95.4	Very high	92.8	Very high	13 Å²	13	61.2 Å²	61.2	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-43.1	177.7	0	0	0	0	0	112.3	C54 F58 Y169 L170 L171 G177	C54-A173 HydrophobicContact CB-CB 4.07Å; F58-A173 HydrophobicContact CB-CB 4.42Å; F58-A173 WeakPolarHBondContact CD2-O 3.37Å; Y169-A173 WeakPolarHBondContact O-CB 3.31Å; Y169-A173 PolarHBondContact O-N 2.92Å; L170-A173 PolarHBondContact O-N 3.48Å; L171-A173 PolarHBondContact O-N 2.88Å; A173-G177 PolarHBondContact O-N 3.4Å
174	V	96.1	Very high	92.8	Very high	3 Å²	3	63 Å²	63	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-44.9	176.7	170.4	0	0	0	0	111.4	A61 L159 I162 V163 L170 L171 L172 G177 F178	A61-V174 HydrophobicContact CB-CG1 4.5Å; L159-V174 HydrophobicContact CD2-CG1 4.24Å; L159-V174 HydrophobicContact CD2-CG2 4.12Å; I162-V174 HydrophobicContact CG2-CG2 4.09Å; V163-V174 HydrophobicContact CG2-CG1 4.26Å; L170-V174 WeakPolarHBondContact O-CB 3.3Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.3Å; L170-V174 PolarHBondContact O-N 3.01Å; L171-V174 PolarHBondContact O-N 3.38Å; L172-V174 VanDerWaalsContact C-N 3.32Å; L172-V174 PolarHBondContact O-N 3.24Å; V174-G177 PolarHBondContact O-N 3.27Å; V174-F178 HydrophobicContact CG1-CD2 3.6Å; V174-F178 HydrophobicContact CG1-CE2 3.27Å; V174-F178 HydrophobicContact CG1-CZ 4.2Å; V174-F178 VanDerWaalsContact O-CD2 3.28Å; V174-F178 WeakPolarHBondContact O-CD2 3.38Å; V174-F178 PolarHBondContact O-N 2.97Å
175	L	96.4	Very high	92.8	Very high	87 Å²	87	60.2 Å²	60.2	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-44.2	178.1	-71.2	175.8	0	0	0	112.5	L171 L172 G177 F178 T179	L171-L175 HydrophobicContact CD1-CD1 4.45Å; L171-L175 HydrophobicContact CG-CD1 4.07Å; L171-L175 HydrophobicContact CG-CG 4.47Å; L171-L175 WeakPolarHBondContact O-CB 3.39Å; L171-L175 VanDerWaalsContact O-CG 3.3Å; L171-L175 WeakPolarHBondContact O-CG 3.43Å; L171-L175 PolarHBondContact O-N 2.89Å; L172-L175 PolarHBondContact O-N 3.21Å; L175-G177 VanDerWaalsContact C-N 3.32Å; L175-F178 PolarHBondContact O-N 2.93Å; L175-T179 WeakPolarHBondContact O-CB 3.45Å; L175-T179 PolarHBondContact O-N 3.5Å; L175-T179 PolarHBondContact O-OG1 2.8Å
176	F	96.9	Very high	92.6	Very high	133 Å²	133	60.3 Å²	60.3	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-63.6	-39.8	174.1	-81.6	-65.5	0	0	0	111.4	F58 L172 T179 L180	F58-F176 HydrophobicContact CD2-CB 4.29Å; F58-F176 HydrophobicContact CE2-CB 4.12Å; L172-F176 HydrophobicContact CB-CD2 4.39Å; L172-F176 HydrophobicContact CB-CE2 4.45Å; L172-F176 WeakPolarHBondContact O-CB 3.5Å; L172-F176 WeakPolarHBondContact O-CD2 3.4Å; L172-F176 PolarHBondContact O-N 2.88Å; F176-T179 PolarHBondContact O-N 2.9Å; F176-L180 VanDerWaalsContact O-CB 3.31Å; F176-L180 WeakPolarHBondContact O-CB 3.48Å; F176-L180 PolarHBondContact O-N 2.91Å
177	G	96.5	Very high	92.1	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-46	176.5	0	0	0	0	0	112.7	F58 I62 A173 V174 L175 G181	F58-G177 VanDerWaalsContact CD2-CA 3.49Å; I62-G177 WeakPolarHBondContact CG1-O 3.2Å; A173-G177 PolarHBondContact O-N 3.4Å; V174-G177 PolarHBondContact O-N 3.27Å; L175-G177 VanDerWaalsContact C-N 3.32Å; G177-G181 PolarHBondContact O-N 3.27Å
178	F	95.5	Very high	91.3	Very high	58 Å²	58	68.5 Å²	68.5	25%	0.254	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-45.3	173.9	-76.7	-53	0	0	0	112	A61 Y64 E65 L159 V174 L175 L180 G181 Y182	A61-F178 HydrophobicContact CB-CD1 4.09Å; A61-F178 HydrophobicContact CB-CD2 4.44Å; A61-F178 HydrophobicContact CB-CE1 4.21Å; A61-F178 HydrophobicContact CB-CG 4.2Å; A61-F178 HydrophobicContact CB-CZ 4.48Å; Y64-F178 HydrophobicContact CD1-CD1 4.32Å; Y64-F178 AromaticContact CD1-CE1 3.53Å; Y64-F178 HydrophobicContact CD1-CE1 3.53Å; Y64-F178 HydrophobicContact CD1-CZ 4.45Å; Y64-F178 HydrophobicContact CE1-CE1 4.06Å; Y64-F178 HydrophobicContact CG-CE1 4.04Å; E65-F178 HydrophobicContact CG-CD1 4.1Å; L159-F178 HydrophobicContact CD1-CE1 3.96Å; L159-F178 HydrophobicContact CD1-CZ 3.66Å; V174-F178 HydrophobicContact CG1-CD2 3.6Å; V174-F178 HydrophobicContact CG1-CE2 3.27Å; V174-F178 HydrophobicContact CG1-CZ 4.2Å; V174-F178 VanDerWaalsContact O-CD2 3.28Å; V174-F178 WeakPolarHBondContact O-CD2 3.38Å; V174-F178 PolarHBondContact O-N 2.97Å; L175-F178 PolarHBondContact O-N 2.93Å; F178-L180 PolarHBondContact O-N 2.93Å; F178-G181 PolarHBondContact O-N 2.91Å; F178-Y182 VanDerWaalsContact O-CB 3.3Å; F178-Y182 WeakPolarHBondContact O-CB 3.19Å; F178-Y182 PolarHBondContact O-N 3.24Å
179	T	94.8	Very high	90.4	Very high	95 Å²	95	69.1 Å²	69.1	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-61.8	-47.8	-180	-55.4	0	0	0	0	111.2	L175 F176 F183	L175-T179 WeakPolarHBondContact O-CB 3.45Å; L175-T179 PolarHBondContact O-N 3.5Å; L175-T179 PolarHBondContact O-OG1 2.8Å; F176-T179 PolarHBondContact O-N 2.9Å; T179-F183 WeakPolarHBondContact O-CB 3.3Å; T179-F183 PolarHBondContact O-N 3.48Å
180	L	95.3	Very high	89.4	Confident	70 Å²	70	66.4 Å²	66.4	37%	0.366	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-41	179.1	-175	64.6	0	0	0	111.5	F58 I62 F176 F178 F183 L184	F58-L180 HydrophobicContact CE1-CD2 4.46Å; F58-L180 HydrophobicContact CE2-CD2 4.37Å; F58-L180 HydrophobicContact CZ-CD2 3.61Å; I62-L180 HydrophobicContact CD1-CD2 4.15Å; F176-L180 VanDerWaalsContact O-CB 3.31Å; F176-L180 WeakPolarHBondContact O-CB 3.48Å; F176-L180 PolarHBondContact O-N 2.91Å; F178-L180 PolarHBondContact O-N 2.93Å; L180-F183 PolarHBondContact O-N 3.09Å; L180-L184 HydrophobicContact CD1-CG 4.43Å; L180-L184 HydrophobicContact CG-CD1 4.18Å; L180-L184 HydrophobicContact CG-CG 4.4Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.39Å
181	G	94.5	Very high	88.3	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-57	-53.6	174.7	0	0	0	0	0	110.9	G177 F178 F183 L184 F185	G177-G181 PolarHBondContact O-N 3.27Å; F178-G181 PolarHBondContact O-N 2.91Å; G181-F183 VanDerWaalsContact C-N 3.3Å; G181-F183 PolarHBondContact O-N 3.31Å; G181-L184 PolarHBondContact O-N 3.44Å; G181-F185 WeakPolarHBondContact O-CD2 3.48Å; G181-F185 PolarHBondContact O-N 2.88Å
182	Y	92	Very high	87.1	Confident	139 Å²	139	71.8 Å²	71.8	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-55	-46.4	175.7	-177.4	-96.2	0	0	0	111.5	F178 L184 F185 A186	F178-Y182 VanDerWaalsContact O-CB 3.3Å; F178-Y182 WeakPolarHBondContact O-CB 3.19Å; F178-Y182 PolarHBondContact O-N 3.24Å; Y182-L184 PolarHBondContact O-N 2.84Å; Y182-F185 PolarHBondContact O-N 3.18Å; Y182-A186 HydrophobicContact CE1-CB 4.45Å; Y182-A186 WeakPolarHBondContact O-CA 3.46Å; Y182-A186 WeakPolarHBondContact O-CB 3.38Å; Y182-A186 PolarHBondContact O-N 3.45Å
183	F	92.2	Very high	85.8	Confident	151 Å²	151	73.1 Å²	73.1	66%	0.662	37%	0.366	S	S	*	.	H	α-helix	trans	-59.7	-46.4	178.2	179.9	-101.5	0	0	0	113	T179 L180 G181 F185 A186	T179-F183 WeakPolarHBondContact O-CB 3.3Å; T179-F183 PolarHBondContact O-N 3.48Å; L180-F183 PolarHBondContact O-N 3.09Å; G181-F183 VanDerWaalsContact C-N 3.3Å; G181-F183 PolarHBondContact O-N 3.31Å; F183-F185 PolarHBondContact O-N 3.14Å; F183-A186 PolarHBondContact O-N 3.14Å
184	L	91.6	Very high	84.2	Confident	88 Å²	88	81.8 Å²	81.8	46%	0.461	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-39.6	179.2	-71.1	173.7	0	0	0	112.3	L180 G181 Y182	L180-L184 HydrophobicContact CD1-CG 4.43Å; L180-L184 HydrophobicContact CG-CD1 4.18Å; L180-L184 HydrophobicContact CG-CG 4.4Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.39Å; G181-L184 PolarHBondContact O-N 3.44Å; Y182-L184 PolarHBondContact O-N 2.84Å
185	F	88.2	Confident	82.4	Confident	43 Å²	43	84.8 Å²	84.8	19%	0.189	42%	0.417	C	S	.	.	H	α-helix	trans	-88.6	-16.6	-177.9	-66.3	-68.9	0	0	0	113.9	E65 A66 T69 G181 Y182 F183 R187 N188 R189	E65-F185 HydrophobicContact CB-CD2 4.13Å; A66-F185 VanDerWaalsContact CA-CE2 3.41Å; A66-F185 VanDerWaalsContact CA-CZ 3.49Å; A66-F185 HydrophobicContact CB-CD2 4.35Å; A66-F185 HydrophobicContact CB-CE1 3.96Å; A66-F185 HydrophobicContact CB-CE2 3.43Å; A66-F185 VanDerWaalsContact CB-CE2 3.43Å; A66-F185 HydrophobicContact CB-CZ 3.2Å; T69-F185 HydrophobicContact CG2-CB 4.06Å; T69-F185 HydrophobicContact CG2-CD1 4.13Å; T69-F185 HydrophobicContact CG2-CG 4.36Å; T69-F185 WeakPolarHBondContact OG1-CB 3.49Å; G181-F185 WeakPolarHBondContact O-CD2 3.48Å; G181-F185 PolarHBondContact O-N 2.88Å; Y182-F185 PolarHBondContact O-N 3.18Å; F183-F185 PolarHBondContact O-N 3.14Å; F185-R187 VanDerWaalsContact C-N 3.3Å; F185-R187 PolarHBondContact O-N 3.04Å; F185-N188 WeakPolarHBondContact O-CA 3.37Å; F185-N188 WeakPolarHBondContact O-CB 3.32Å; F185-N188 PolarHBondContact O-N 3.44Å; F185-R189 PolarHBondContact O-N 3.05Å
186	A	82.8	Confident	80.4	Confident	32 Å²	32	87.7 Å²	87.7	26%	0.264	43%	0.428	S	S	.	.	H	α-helix	trans	-57.3	-40.7	176.6	0	0	0	0	0	112.3	Y182 F183 N188 R189 A190	Y182-A186 HydrophobicContact CE1-CB 4.45Å; Y182-A186 WeakPolarHBondContact O-CA 3.46Å; Y182-A186 WeakPolarHBondContact O-CB 3.38Å; Y182-A186 PolarHBondContact O-N 3.45Å; F183-A186 PolarHBondContact O-N 3.14Å; A186-N188 PolarHBondContact O-N 3.13Å; A186-R189 PolarHBondContact O-N 3.46Å; A186-R189 VanDerWaalsContact O-N 3.07Å; A186-A190 PolarHBondContact O-N 3.35Å
187	R	74.6	Confident	78.2	Confident	192 Å²	192	86.7 Å²	86.7	73%	0.725	43%	0.428	S	S	*	.	H	α-helix	trans	-56.7	-39.1	174.6	-175.1	174.3	67.3	-178.7	-0.6	111.9	F185 L191	F185-R187 VanDerWaalsContact C-N 3.3Å; F185-R187 PolarHBondContact O-N 3.04Å; R187-L191 PolarHBondContact O-N 3.01Å
188	N	72.1	Confident	76.2	Confident	47 Å²	47	89.9 Å²	89.9	25%	0.251	45%	0.45	S	S	.	.	H	α-helix	trans	-74	-34.1	178.4	-65.6	-28.9	0	0	0	112	F185 A186 L191 L192	F185-N188 WeakPolarHBondContact O-CA 3.37Å; F185-N188 WeakPolarHBondContact O-CB 3.32Å; F185-N188 PolarHBondContact O-N 3.44Å; A186-N188 PolarHBondContact O-N 3.13Å; N188-L191 PolarHBondContact O-N 2.96Å; N188-L192 WeakPolarHBondContact O-CG 3.46Å; N188-L192 PolarHBondContact O-N 3.48Å
189	R	72.1	Confident	74	Confident	57 Å²	57	91 Å²	91	22%	0.215	46%	0.464	C	S	.	.	H	α-helix	trans	-67.7	-41	176.3	-67.5	-176	-175.7	-125.8	12.6	111.5	E68 T69 F185 A186 L191 L192 V193	E68-R189 IonicContact OE1-CZ 3.54Å; E68-R189 IonicContact OE1-NH1 3.36Å; E68-R189 PolarHBondContact OE1-NH1 3.36Å; E68-R189 IonicContact OE1-NH2 2.76Å; E68-R189 PolarHBondContact OE1-NH2 3.13Å; T69-R189 HydrophobicContact CG2-CG 4.32Å; T69-R189 PolarHBondContact OG1-NE 2.95Å; T69-R189 PolarHBondContact OG1-NH2 3.43Å; F185-R189 PolarHBondContact O-N 3.05Å; A186-R189 PolarHBondContact O-N 3.46Å; A186-R189 VanDerWaalsContact O-N 3.07Å; R189-L191 VanDerWaalsContact C-N 3.3Å; R189-L191 PolarHBondContact O-N 2.95Å; R189-L192 PolarHBondContact O-N 3.29Å; R189-L192 VanDerWaalsContact O-N 3.11Å; R189-V193 WeakPolarHBondContact O-CG2 3.46Å; R189-V193 PolarHBondContact O-N 3.33Å
190	A	71.7	Confident	71.4	Confident	65 Å²	65	97.9 Å²	97.9	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-58.8	-40.1	175.2	0	0	0	0	0	112.6	A186 R194	A186-A190 PolarHBondContact O-N 3.35Å; A190-R194 PolarHBondContact O-N 2.88Å; A190-R194 VanDerWaalsContact O-N 3.16Å
191	L	68.9	Low	70.2	Confident	114 Å²	114	99.3 Å²	99.3	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-66.1	-37.2	174.8	-69.6	176.1	0	0	0	112.7	R187 N188 R189 R194 S195	R187-L191 PolarHBondContact O-N 3.01Å; N188-L191 PolarHBondContact O-N 2.96Å; R189-L191 VanDerWaalsContact C-N 3.3Å; R189-L191 PolarHBondContact O-N 2.95Å; L191-R194 PolarHBondContact O-N 3.23Å; L191-S195 PolarHBondContact O-N 3.48Å
192	L	66	Low	68.9	Low	41 Å²	41	104.5 Å²	104.5	22%	0.215	52%	0.521	C	S	.	.	H	α-helix	trans	-69.2	-40.9	178	-69	166.1	0	0	0	112.6	K73 L76 N188 R189 R194 S195 H196	K73-L192 HydrophobicContact CB-CD1 4.49Å; K73-L192 HydrophobicContact CD-CD1 4.17Å; K73-L192 HydrophobicContact CG-CD1 3.3Å; K73-L192 HydrophobicContact CG-CD2 4.02Å; K73-L192 HydrophobicContact CG-CG 4.23Å; L76-L192 HydrophobicContact CD1-CB 4.08Å; L76-L192 HydrophobicContact CD1-CD1 4.34Å; L76-L192 HydrophobicContact CD1-CD2 4.36Å; L76-L192 HydrophobicContact CD1-CG 4.49Å; N188-L192 WeakPolarHBondContact O-CG 3.46Å; N188-L192 PolarHBondContact O-N 3.48Å; R189-L192 PolarHBondContact O-N 3.29Å; R189-L192 VanDerWaalsContact O-N 3.11Å; L192-R194 VanDerWaalsContact C-N 3.26Å; L192-R194 PolarHBondContact O-N 3.41Å; L192-S195 CarbonylContact O-C 3.5Å; L192-S195 WeakPolarHBondContact O-CA 3.49Å; L192-S195 WeakPolarHBondContact O-CB 3.13Å; L192-S195 PolarHBondContact O-N 3.42Å; L192-S195 VanDerWaalsContact O-N 3.08Å; L192-H196 PolarHBondContact O-N 3.15Å
193	V	68.2	Low	67.6	Low	108 Å²	108	102.6 Å²	102.6	66%	0.655	52%	0.52	S	S	*	.	H	α-helix	trans	-61.5	-39.9	174.6	174.6	0	0	0	0	110.1	R189 S195 H196	R189-V193 WeakPolarHBondContact O-CG2 3.46Å; R189-V193 PolarHBondContact O-N 3.33Å; V193-S195 VanDerWaalsContact C-N 3.31Å; V193-S195 PolarHBondContact O-N 2.96Å; V193-H196 VanDerWaalsContact O-CB 3.3Å; V193-H196 WeakPolarHBondContact O-CB 3.34Å; V193-H196 PolarHBondContact O-N 3.04Å; V193-H196 VanDerWaalsContact O-N 3.16Å
194	R	61.7	Low	66.2	Low	195 Å²	195	99.8 Å²	99.8	74%	0.736	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-32.2	174	-166.3	173.7	178.8	93.6	0	112.7	A190 L191 L192 H196 N197	A190-R194 PolarHBondContact O-N 2.88Å; A190-R194 VanDerWaalsContact O-N 3.16Å; L191-R194 PolarHBondContact O-N 3.23Å; L192-R194 VanDerWaalsContact C-N 3.26Å; L192-R194 PolarHBondContact O-N 3.41Å; R194-H196 VanDerWaalsContact C-N 3.32Å; R194-N197 WeakPolarHBondContact O-CB 3.38Å; R194-N197 PolarHBondContact O-N 3.47Å
195	S	58.5	Low	64.6	Low	65 Å²	65	100.5 Å²	100.5	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-75.5	-15.8	173.6	-167.4	0	0	0	0	113.5	L191 L192 V193 N197 C198	L191-S195 PolarHBondContact O-N 3.48Å; L192-S195 CarbonylContact O-C 3.5Å; L192-S195 WeakPolarHBondContact O-CA 3.49Å; L192-S195 WeakPolarHBondContact O-CB 3.13Å; L192-S195 PolarHBondContact O-N 3.42Å; L192-S195 VanDerWaalsContact O-N 3.08Å; V193-S195 VanDerWaalsContact C-N 3.31Å; V193-S195 PolarHBondContact O-N 2.96Å; S195-N197 PolarHBondContact O-N 2.93Å; S195-N197 VanDerWaalsContact O-N 3.09Å; S195-C198 VanDerWaalsContact O-CB 3.29Å; S195-C198 WeakPolarHBondContact O-CB 3.32Å; S195-C198 PolarHBondContact O-N 3.02Å; S195-C198 PolarHBondContact O-SG 3.37Å; S195-C198 PolarHBondContact OG-SG 3.36Å; S195-C198 VanDerWaalsContact OG-SG 3.34Å
196	H	55.4	Low	63	Low	149 Å²	149	104.3 Å²	104.3	69%	0.69	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.6	169.8	-158.2	-113.4	0	0	0	111.9	L192 V193 R194 C198	L192-H196 PolarHBondContact O-N 3.15Å; V193-H196 VanDerWaalsContact O-CB 3.3Å; V193-H196 WeakPolarHBondContact O-CB 3.34Å; V193-H196 PolarHBondContact O-N 3.04Å; V193-H196 VanDerWaalsContact O-N 3.16Å; R194-H196 VanDerWaalsContact C-N 3.32Å; H196-C198 PolarHBondContact O-N 3.15Å
197	N	50.1	Low	61.6	Low	111 Å²	111	109.5 Å²	109.5	59%	0.594	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	20.4	167	-57.1	-25.4	0	0	0	113.3	R194 S195 C199	R194-N197 WeakPolarHBondContact O-CB 3.38Å; R194-N197 PolarHBondContact O-N 3.47Å; S195-N197 PolarHBondContact O-N 2.93Å; S195-N197 VanDerWaalsContact O-N 3.09Å; N197-C199 PolarHBondContact O-N 2.62Å
198	C	53.1	Low	60.6	Low	67 Å²	67	103.2 Å²	103.2	45%	0.453	54%	0.543	S	S	.	.	S	Bend	trans	-64.3	-3.5	176.2	-85.8	0	0	0	0	114.5	S195 H196	S195-C198 VanDerWaalsContact O-CB 3.29Å; S195-C198 WeakPolarHBondContact O-CB 3.32Å; S195-C198 PolarHBondContact O-N 3.02Å; S195-C198 PolarHBondContact O-SG 3.37Å; S195-C198 PolarHBondContact OG-SG 3.36Å; S195-C198 VanDerWaalsContact OG-SG 3.34Å; H196-C198 PolarHBondContact O-N 3.15Å
199	C	49.8	Very low	59.6	Low	82 Å²	82	107.8 Å²	107.8	55%	0.554	57%	0.568	S	S	*	*			trans	-148.7	99.1	165.3	-63.5	0	0	0	0	109.9	N197	N197-C199 PolarHBondContact O-N 2.62Å
200	H	40	Very low	58.5	Low	240 Å²	240	112.5 Å²	112.5	100%	1.111	60%	0.6	S	S	*	*			trans	-135.9	0	153.3	-136.9	-55.3	0	0	0	109

Retrieved 200 of 200 residues in 247.4 ms (Link to these results)

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