A0A087YFF3_POEFO Loading...

Centromere protein I

AlphaFold DB , UniProt , Accession A0A087YFF3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 750 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	37.8	Very low	28.9	Very low	241 Å²	241	138.5 Å²	138.5	100%	1.187	80%	0.795	S	S	*	*				0	78.9	0	-71.1	179	171.1	0	0	106.6
2	A	26.7	Very low	28.7	Very low	83 Å²	83	141.1 Å²	141.1	69%	0.686	80%	0.795	S	S	*	*				56.9	104.2	51	0	0	0	0	0	113
3	T	29.1	Very low	28.6	Very low	138 Å²	138	139.3 Å²	139.3	85%	0.847	80%	0.797	S	S	*	*			trans	-172.5	103.8	130.2	26.2	0	0	0	0	106.8
4	L	31.1	Very low	28.5	Very low	145 Å²	145	134.6 Å²	134.6	76%	0.759	80%	0.795	S	S	*	*				63.6	137.8	67.5	-85.4	159	0	0	0	114.9
5	L	30.1	Very low	28.6	Very low	151 Å²	151	137 Å²	137	79%	0.791	80%	0.801	S	S	*	*			trans	158.3	134.4	131.5	-77.4	163.5	0	0	0	106.6
6	N	26.8	Very low	28.5	Very low	115 Å²	115	135.2 Å²	135.2	62%	0.615	80%	0.798	S	S	*	*			cis	-170.1	135.6	-5.8	-101.7	-7.7	0	0	0	104.9
7	L	28.7	Very low	28.5	Very low	139 Å²	139	134.8 Å²	134.8	73%	0.728	79%	0.792	S	S	*	*				60.1	119.7	81.2	-87.5	165.7	0	0	0	116.7
8	S	25.7	Very low	28.7	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	79%	0.787	S	S	*	*				-162.7	119.9	128.1	61.4	0	0	0	0	112
9	D	26.7	Very low	29.3	Very low	138 Å²	138	134 Å²	134	74%	0.738	78%	0.783	S	S	*	*			trans	-71	163.5	170.1	-74.5	-50.5	0	0	0	114.1
10	S	27.2	Very low	29.9	Very low	122 Å²	122	134.6 Å²	134.6	85%	0.853	79%	0.788	S	S	*	*				-166.9	108.4	128.1	62.1	0	0	0	0	113.5
11	D	27.8	Very low	30.2	Very low	128 Å²	128	132 Å²	132	68%	0.684	78%	0.777	S	S	*	*			trans	-15.3	159.5	153.2	-82.8	-40.2	0	0	0	126.4
12	H	27.4	Very low	30.3	Very low	170 Å²	170	126.9 Å²	126.9	79%	0.787	76%	0.76	S	S	*	*			trans	71.6	142.6	146.9	-65.4	-33.7	0	0	0	119.4
13	S	27	Very low	31.2	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	77%	0.769	S	S	*	*			cis	-169.2	149.3	10	46.3	0	0	0	0	108
14	G	27.1	Very low	31.9	Very low	74 Å²	74	130.9 Å²	130.9	76%	0.763	75%	0.752	S	S	*	*				119.3	105.5	106.9	0	0	0	0	0	116.5
15	L	29.3	Very low	32.8	Very low	170 Å²	170	126.6 Å²	126.6	89%	0.89	74%	0.735	S	S	*	*			trans	47.8	137.1	141	-68.4	163.7	0	0	0	125.3
16	S	28.1	Very low	33.6	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	73%	0.725	S	S	*	*			trans	67.5	143.4	160.1	61.9	0	0	0	0	117.9
17	D	28.4	Very low	34.8	Very low	129 Å²	129	128.4 Å²	128.4	69%	0.69	73%	0.73	S	S	*	*			cis	-158.6	149.7	23.7	-133.4	-16.5	0	0	0	110.4
18	Q	32.3	Very low	36	Very low	153 Å²	153	124.9 Å²	124.9	72%	0.715	72%	0.718	S	S	*	*			trans	46.9	118.9	146.1	-75.3	168.9	47.1	0	0	124.3
19	S	39	Very low	37.4	Very low	101 Å²	101	123.9 Å²	123.9	71%	0.706	70%	0.702	S	S	*	*			trans	52.6	112.7	132.5	68.8	0	0	0	0	119.9
20	V	40.9	Very low	38.8	Very low	145 Å²	145	126.5 Å²	126.5	88%	0.879	70%	0.702	S	S	*	*				169.4	96.5	124.6	170.4	0	0	0	0	107.3
21	S	36.6	Very low	40.3	Very low	81 Å²	81	124.6 Å²	124.6	57%	0.566	68%	0.681	S	S	*	*			trans	-164.9	14.9	160.6	118	0	0	0	0	118	R23 S24	S21-R23 PolarHBondContact O-N 2.87Å; S21-S24 PolarHBondContact O-N 2.73Å; S21-S24 VanDerWaalsContact O-N 3.09Å; S21-S24 PolarHBondContact O-OG 3.12Å; S21-S24 PolarHBondContact OG-OG 2.87Å
22	T	40.5	Very low	41.6	Very low	133 Å²	133	120.7 Å²	120.7	82%	0.816	67%	0.666	S	S	*	*	H	α-helix	trans	-67.5	-3.8	179	33.6	0	0	0	0	115.1
23	R	44.5	Very low	42.9	Very low	236 Å²	236	118.4 Å²	118.4	89%	0.891	66%	0.656	S	S	*	*	H	α-helix	trans	-87.5	-17.1	169.9	-94.9	-178.1	171.4	177.9	-1.8	115	S21	S21-R23 PolarHBondContact O-N 2.87Å
24	S	45.4	Very low	44.2	Very low	69 Å²	69	119.3 Å²	119.3	48%	0.483	65%	0.647	S	S	.	*	H	α-helix	trans	-84.5	-28.2	179.7	72.1	0	0	0	0	113	S21 R27 S28	S21-S24 PolarHBondContact O-N 2.73Å; S21-S24 VanDerWaalsContact O-N 3.09Å; S21-S24 PolarHBondContact O-OG 3.12Å; S21-S24 PolarHBondContact OG-OG 2.87Å; S24-R27 PolarHBondContact O-N 3.42Å; S24-S28 PolarHBondContact O-N 2.98Å; S24-S28 VanDerWaalsContact O-N 3.14Å; S24-S28 PolarHBondContact O-OG 3.12Å
25	S	48.5	Very low	45.3	Very low	56 Å²	56	121 Å²	121	39%	0.392	64%	0.635	S	S	.	*	H	α-helix	trans	-66.4	-43.6	-177.8	169.2	0	0	0	0	113.3	R27 S28 L29	S25-R27 VanDerWaalsContact C-N 3.3Å; S25-R27 PolarHBondContact O-N 3.33Å; S25-S28 VanDerWaalsContact CA-OG 3.3Å; S25-S28 WeakPolarHBondContact CA-OG 3.46Å; S25-S28 PolarHBondContact O-N 3.29Å; S25-S28 PolarHBondContact O-OG 3.09Å; S25-L29 PolarHBondContact O-N 3.08Å
26	N	47.2	Very low	46.3	Very low	110 Å²	110	121.7 Å²	121.7	59%	0.588	63%	0.626	S	S	*	*	H	α-helix	trans	-72.5	-23.6	-180	-72.1	-20.7	0	0	0	113.4	R30	N26-R30 WeakPolarHBondContact O-CG 3.24Å; N26-R30 PolarHBondContact O-N 3.11Å
27	R	51.6	Low	47.5	Very low	193 Å²	193	125.6 Å²	125.6	73%	0.728	62%	0.624	S	S	*	*	H	α-helix	trans	-76.9	-39.2	174.4	-152.8	178.7	-170.2	-174.2	2.7	110.6	S24 S25 I31	S24-R27 PolarHBondContact O-N 3.42Å; S25-R27 VanDerWaalsContact C-N 3.3Å; S25-R27 PolarHBondContact O-N 3.33Å; R27-I31 HydrophobicContact CG-CD1 4.22Å; R27-I31 WeakPolarHBondContact O-CB 3.06Å; R27-I31 VanDerWaalsContact O-CD1 3.29Å; R27-I31 WeakPolarHBondContact O-CD1 3.42Å; R27-I31 WeakPolarHBondContact O-CG1 3.01Å; R27-I31 PolarHBondContact O-N 3.2Å
28	S	55.9	Low	48.5	Very low	66 Å²	66	127.2 Å²	127.2	46%	0.462	63%	0.625	S	S	.	*	H	α-helix	trans	-71.7	-36.1	177.6	36.5	0	0	0	0	112.5	S24 S25 I31 A32	S24-S28 PolarHBondContact O-N 2.98Å; S24-S28 VanDerWaalsContact O-N 3.14Å; S24-S28 PolarHBondContact O-OG 3.12Å; S25-S28 VanDerWaalsContact CA-OG 3.3Å; S25-S28 WeakPolarHBondContact CA-OG 3.46Å; S25-S28 PolarHBondContact O-N 3.29Å; S25-S28 PolarHBondContact O-OG 3.09Å; S28-I31 PolarHBondContact O-N 2.69Å; S28-A32 VanDerWaalsContact O-CB 3.24Å; S28-A32 WeakPolarHBondContact O-CB 3.13Å; S28-A32 PolarHBondContact O-N 3.38Å
29	L	54.4	Low	49.1	Very low	102 Å²	102	126.6 Å²	126.6	53%	0.534	63%	0.627	S	S	.	*	H	α-helix	trans	-66.9	-41.9	172	-82.3	160.7	0	0	0	112.6	S25 I31 A32 E33	S25-L29 PolarHBondContact O-N 3.08Å; L29-I31 VanDerWaalsContact C-N 3.35Å; L29-I31 PolarHBondContact O-N 3.5Å; L29-A32 PolarHBondContact O-N 2.89Å; L29-E33 VanDerWaalsContact O-CB 3.24Å; L29-E33 WeakPolarHBondContact O-CB 3.46Å; L29-E33 PolarHBondContact O-N 2.6Å
30	R	56.2	Low	49.4	Very low	192 Å²	192	129.4 Å²	129.4	73%	0.725	63%	0.629	S	S	*	*	H	α-helix	trans	-65.3	-36.9	173.3	-80.2	-178	177.1	173.8	0.2	112.7	N26 Q34	N26-R30 WeakPolarHBondContact O-CG 3.24Å; N26-R30 PolarHBondContact O-N 3.11Å; R30-Q34 WeakPolarHBondContact O-CB 2.98Å; R30-Q34 PolarHBondContact O-N 2.73Å
31	I	58	Low	49.8	Very low	82 Å²	82	125.5 Å²	125.5	42%	0.421	61%	0.612	S	S	.	*	H	α-helix	trans	-67.1	-44.2	174.8	-70	163.3	0	0	0	110.1	R27 S28 L29 E33 Q34 E35	R27-I31 HydrophobicContact CG-CD1 4.22Å; R27-I31 WeakPolarHBondContact O-CB 3.06Å; R27-I31 VanDerWaalsContact O-CD1 3.29Å; R27-I31 WeakPolarHBondContact O-CD1 3.42Å; R27-I31 WeakPolarHBondContact O-CG1 3.01Å; R27-I31 PolarHBondContact O-N 3.2Å; S28-I31 PolarHBondContact O-N 2.69Å; L29-I31 VanDerWaalsContact C-N 3.35Å; L29-I31 PolarHBondContact O-N 3.5Å; I31-E33 VanDerWaalsContact C-N 3.35Å; I31-E33 PolarHBondContact O-N 3.04Å; I31-Q34 CarbonylContact O-C 3.57Å; I31-Q34 PolarHBondContact O-N 3.25Å; I31-E35 WeakPolarHBondContact O-CB 3.35Å; I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 3.01Å
32	A	55.3	Low	50.8	Low	46 Å²	46	127 Å²	127	38%	0.38	61%	0.61	S	S	.	*	H	α-helix	trans	-66.5	-34.5	178.2	0	0	0	0	0	112.9	S28 L29 R36	S28-A32 VanDerWaalsContact O-CB 3.24Å; S28-A32 WeakPolarHBondContact O-CB 3.13Å; S28-A32 PolarHBondContact O-N 3.38Å; L29-A32 PolarHBondContact O-N 2.89Å; A32-R36 WeakPolarHBondContact O-CB 3.19Å; A32-R36 PolarHBondContact O-N 2.91Å
33	E	55	Low	52.4	Low	122 Å²	122	125 Å²	125	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-77.5	-31.8	176.4	-161.1	161.7	-160.4	0	0	111.9	L29 I31 R37	L29-E33 VanDerWaalsContact O-CB 3.24Å; L29-E33 WeakPolarHBondContact O-CB 3.46Å; L29-E33 PolarHBondContact O-N 2.6Å; I31-E33 VanDerWaalsContact C-N 3.35Å; I31-E33 PolarHBondContact O-N 3.04Å; E33-R37 PolarHBondContact O-N 2.72Å
34	Q	53.6	Low	54	Low	137 Å²	137	117 Å²	117	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-74.2	-28.8	171.1	-160.6	170.3	20	0	0	112.2	R30 I31 K38	R30-Q34 WeakPolarHBondContact O-CB 2.98Å; R30-Q34 PolarHBondContact O-N 2.73Å; I31-Q34 CarbonylContact O-C 3.57Å; I31-Q34 PolarHBondContact O-N 3.25Å; Q34-K38 WeakPolarHBondContact O-CB 3.4Å; Q34-K38 PolarHBondContact O-N 3.28Å; Q34-K38 VanDerWaalsContact O-N 3.13Å
35	E	51.4	Low	55.8	Low	110 Å²	110	115 Å²	115	51%	0.514	56%	0.556	S	S	.	*	H	α-helix	trans	-73.5	-40.1	169.1	-81.4	173.5	157.4	0	0	111.8	I31 K38 N39	I31-E35 WeakPolarHBondContact O-CB 3.35Å; I31-E35 WeakPolarHBondContact O-CG 3.41Å; I31-E35 PolarHBondContact O-N 3.01Å; E35-K38 WeakPolarHBondContact O-CB 3.42Å; E35-K38 PolarHBondContact O-N 3.47Å; E35-K38 VanDerWaalsContact O-N 3.17Å; E35-N39 PolarHBondContact O-N 2.99Å; E35-N39 PolarHBondContact O-ND2 3.45Å
36	R	49.6	Very low	57.4	Low	185 Å²	185	116 Å²	116	70%	0.698	56%	0.559	S	S	*	*	H	α-helix	trans	-61.4	-45.3	171.4	-96	-175.8	163.8	173	-4.3	112.4	A32 K38 N39 E40	A32-R36 WeakPolarHBondContact O-CB 3.19Å; A32-R36 PolarHBondContact O-N 2.91Å; R36-K38 VanDerWaalsContact C-N 3.25Å; R36-K38 PolarHBondContact O-N 3.09Å; R36-N39 PolarHBondContact O-N 3.17Å; R36-N39 VanDerWaalsContact O-N 3.11Å; R36-E40 PolarHBondContact O-N 2.93Å; R36-E40 VanDerWaalsContact O-N 3.12Å
37	R	52.4	Low	59.1	Low	190 Å²	190	114.2 Å²	114.2	72%	0.717	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-26.1	173.4	-77.1	-175.7	176.3	-178.1	0.3	113.7	E33 A41	E33-R37 PolarHBondContact O-N 2.72Å; R37-A41 PolarHBondContact O-N 3.14Å
38	K	50.3	Low	60.8	Low	163 Å²	163	105 Å²	105	71%	0.709	52%	0.515	S	S	*	.	H	α-helix	trans	-76	-30	172	-103.2	-179.1	173.9	179.7	0	113	Q34 E35 R36	Q34-K38 WeakPolarHBondContact O-CB 3.4Å; Q34-K38 PolarHBondContact O-N 3.28Å; Q34-K38 VanDerWaalsContact O-N 3.13Å; E35-K38 WeakPolarHBondContact O-CB 3.42Å; E35-K38 PolarHBondContact O-N 3.47Å; E35-K38 VanDerWaalsContact O-N 3.17Å; R36-K38 VanDerWaalsContact C-N 3.25Å; R36-K38 PolarHBondContact O-N 3.09Å
39	N	44.3	Very low	62.2	Low	140 Å²	140	102.7 Å²	102.7	75%	0.749	50%	0.497	S	S	*	.	H	α-helix	trans	-84.1	-20.4	-178.9	-68.8	-15.1	0	0	0	113.1	E35 R36	E35-N39 PolarHBondContact O-N 2.99Å; E35-N39 PolarHBondContact O-ND2 3.45Å; R36-N39 PolarHBondContact O-N 3.17Å; R36-N39 VanDerWaalsContact O-N 3.11Å
40	E	45.2	Very low	63.8	Low	159 Å²	159	102.6 Å²	102.6	74%	0.743	49%	0.492	S	S	*	.	H	α-helix	trans	-93.8	-15.4	174.4	-73	176.2	177.3	0	0	114	R36 E42	R36-E40 PolarHBondContact O-N 2.93Å; R36-E40 VanDerWaalsContact O-N 3.12Å; E40-E42 PolarHBondContact O-N 2.83Å
41	A	49.4	Very low	65.2	Low	64 Å²	64	95.2 Å²	95.2	53%	0.529	46%	0.464	S	S	.	.	S	Bend	trans	-75.5	106.4	173.7	0	0	0	0	0	109.2	R37 D43	R37-A41 PolarHBondContact O-N 3.14Å; A41-D43 PolarHBondContact O-N 2.93Å
42	E	57.6	Low	66.5	Low	112 Å²	112	91.4 Å²	91.4	52%	0.523	45%	0.445	S	S	.	.			trans	-46	132.6	168.2	-73.8	-174.1	173.5	0	0	109.2	E40 P44 L47	E40-E42 PolarHBondContact O-N 2.83Å; E42-P44 WeakPolarHBondContact O-CD 3.3Å; E42-P44 VanDerWaalsContact O-N 3.08Å; E42-L47 HydrophobicContact CB-CD1 4.1Å; E42-L47 HydrophobicContact CB-CD2 4.19Å; E42-L47 HydrophobicContact CB-CG 3.89Å; E42-L47 WeakPolarHBondContact OE2-CD2 3.33Å
43	D	73.8	Confident	68	Low	90 Å²	90	91.9 Å²	91.9	48%	0.481	45%	0.445	S	S	.	.			trans	-48.4	121.9	-178	177.9	-2.5	0	0	0	108.9	A41 F45 V46 L47	A41-D43 PolarHBondContact O-N 2.93Å; D43-F45 CarbonylContact O-C 3.6Å; D43-F45 PolarHBondContact O-N 3.4Å; D43-F45 PolarHBondContact OD1-N 3.35Å; D43-F45 VanDerWaalsContact OD1-N 3.12Å; D43-V46 HydrophobicContact CB-CB 4.31Å; D43-V46 HydrophobicContact CB-CG2 3.9Å; D43-V46 WeakPolarHBondContact O-CA 3.24Å; D43-V46 WeakPolarHBondContact O-CB 3.36Å; D43-V46 PolarHBondContact O-N 3.3Å; D43-L47 PolarHBondContact O-N 3.26Å; D43-L47 VanDerWaalsContact O-N 3.14Å
44	P	78	Confident	69.4	Low	68 Å²	68	91.9 Å²	91.9	44%	0.442	45%	0.445	S	S	.	.	H	α-helix	trans	-51.6	-22.5	-178.7	-29.7	34.9	0	0	0	114.4	E42 A48	E42-P44 WeakPolarHBondContact O-CD 3.3Å; E42-P44 VanDerWaalsContact O-N 3.08Å; P44-A48 PolarHBondContact O-N 3.49Å
45	F	83.6	Confident	70.8	Confident	29 Å²	29	85.9 Å²	85.9	13%	0.127	42%	0.418	C	S	.	.	H	α-helix	trans	-75	-40	172.3	179.1	-114.4	0	0	0	113.4	D43 A48 L49 V74 V77 L83 A87	D43-F45 CarbonylContact O-C 3.6Å; D43-F45 PolarHBondContact O-N 3.4Å; D43-F45 PolarHBondContact OD1-N 3.35Å; D43-F45 VanDerWaalsContact OD1-N 3.12Å; F45-A48 WeakPolarHBondContact O-CB 3.49Å; F45-A48 PolarHBondContact O-N 3.46Å; F45-L49 HydrophobicContact CD1-CD1 4.13Å; F45-L49 HydrophobicContact CE1-CD1 3.61Å; F45-L49 HydrophobicContact CE1-CG 4.32Å; F45-L49 HydrophobicContact CE2-CD1 4.48Å; F45-L49 HydrophobicContact CE2-CD2 4.47Å; F45-L49 HydrophobicContact CE2-CG 4.36Å; F45-L49 HydrophobicContact CZ-CD1 3.81Å; F45-L49 HydrophobicContact CZ-CD2 4.29Å; F45-L49 HydrophobicContact CZ-CG 4.15Å; F45-L49 WeakPolarHBondContact O-CG 3.43Å; F45-L49 PolarHBondContact O-N 2.91Å; F45-V74 HydrophobicContact CD2-CG2 4.5Å; F45-V74 HydrophobicContact CE2-CG2 4.23Å; F45-V77 HydrophobicContact CB-CG2 4.34Å; F45-V77 HydrophobicContact CD2-CB 3.86Å; F45-V77 HydrophobicContact CD2-CG1 4.04Å; F45-V77 HydrophobicContact CD2-CG2 3.61Å; F45-V77 HydrophobicContact CE1-CG1 4.27Å; F45-V77 HydrophobicContact CE2-CB 3.78Å; F45-V77 HydrophobicContact CE2-CG1 3.76Å; F45-V77 HydrophobicContact CE2-CG2 4.08Å; F45-V77 HydrophobicContact CG-CG1 4.41Å; F45-V77 HydrophobicContact CG-CG2 4.03Å; F45-V77 HydrophobicContact CZ-CB 4.41Å; F45-V77 HydrophobicContact CZ-CG1 3.88Å; F45-L83 HydrophobicContact CE2-CD2 3.97Å; F45-L83 HydrophobicContact CZ-CD2 3.77Å; F45-A87 HydrophobicContact CE1-CB 4.31Å; F45-A87 HydrophobicContact CZ-CB 3.93Å
46	V	82.9	Confident	72	Confident	76 Å²	76	87.8 Å²	87.8	46%	0.461	43%	0.427	S	S	.	.	H	α-helix	trans	-66.1	-41.2	176.7	176.4	0	0	0	0	110.5	D43 A48 L49 K50	D43-V46 HydrophobicContact CB-CB 4.31Å; D43-V46 HydrophobicContact CB-CG2 3.9Å; D43-V46 WeakPolarHBondContact O-CA 3.24Å; D43-V46 WeakPolarHBondContact O-CB 3.36Å; D43-V46 PolarHBondContact O-N 3.3Å; V46-A48 VanDerWaalsContact C-N 3.31Å; V46-A48 PolarHBondContact O-N 2.85Å; V46-L49 PolarHBondContact O-N 3.17Å; V46-K50 PolarHBondContact O-N 3.35Å
47	L	83.6	Confident	73.2	Confident	73 Å²	73	82.5 Å²	82.5	38%	0.382	42%	0.423	S	S	.	.	H	α-helix	trans	-59.1	-41.6	172.1	-75	171	0	0	0	112.1	E42 D43 K50 Y51	E42-L47 HydrophobicContact CB-CD1 4.1Å; E42-L47 HydrophobicContact CB-CD2 4.19Å; E42-L47 HydrophobicContact CB-CG 3.89Å; E42-L47 WeakPolarHBondContact OE2-CD2 3.33Å; D43-L47 PolarHBondContact O-N 3.26Å; D43-L47 VanDerWaalsContact O-N 3.14Å; L47-K50 PolarHBondContact O-N 2.77Å; L47-Y51 PolarHBondContact O-N 3.3Å
48	A	85.9	Confident	73.9	Confident	0 Å²	0	77 Å²	77	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-65.4	-40.4	176.3	0	0	0	0	0	112.1	P44 F45 V46 Y51 F52 N70 V74	P44-A48 PolarHBondContact O-N 3.49Å; F45-A48 WeakPolarHBondContact O-CB 3.49Å; F45-A48 PolarHBondContact O-N 3.46Å; V46-A48 VanDerWaalsContact C-N 3.31Å; V46-A48 PolarHBondContact O-N 2.85Å; A48-Y51 WeakPolarHBondContact O-CB 3.47Å; A48-Y51 PolarHBondContact O-N 3.14Å; A48-F52 WeakPolarHBondContact O-CD2 3.08Å; A48-F52 PolarHBondContact O-N 3.22Å; A48-N70 HydrophobicContact CB-CB 4.06Å; A48-V74 HydrophobicContact CB-CG2 4.14Å
49	L	86.7	Confident	75.3	Confident	17 Å²	17	71.4 Å²	71.4	9%	0.089	40%	0.404	C	S	.	.	H	α-helix	trans	-65.9	-39.3	175.5	-70	176	0	0	0	112.4	F45 V46 F52 S53 A87 I90 M91	F45-L49 HydrophobicContact CD1-CD1 4.13Å; F45-L49 HydrophobicContact CE1-CD1 3.61Å; F45-L49 HydrophobicContact CE1-CG 4.32Å; F45-L49 HydrophobicContact CE2-CD1 4.48Å; F45-L49 HydrophobicContact CE2-CD2 4.47Å; F45-L49 HydrophobicContact CE2-CG 4.36Å; F45-L49 HydrophobicContact CZ-CD1 3.81Å; F45-L49 HydrophobicContact CZ-CD2 4.29Å; F45-L49 HydrophobicContact CZ-CG 4.15Å; F45-L49 WeakPolarHBondContact O-CG 3.43Å; F45-L49 PolarHBondContact O-N 2.91Å; V46-L49 PolarHBondContact O-N 3.17Å; L49-F52 PolarHBondContact O-N 2.95Å; L49-S53 PolarHBondContact O-N 3.13Å; L49-A87 HydrophobicContact CD1-CB 3.72Å; L49-A87 HydrophobicContact CD2-CB 3.93Å; L49-A87 HydrophobicContact CG-CB 4.5Å; L49-I90 HydrophobicContact CB-CD1 4.38Å; L49-M91 HydrophobicContact CD2-CG 3.94Å; L49-M91 HydrophobicContact CD2-SD 3.97Å
50	K	86.3	Confident	76.7	Confident	100 Å²	100	68.9 Å²	68.9	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-60.7	-46.1	176.2	-170.3	177.1	179.6	-178.4	0	111.1	V46 L47 F52 S53 E54	V46-K50 PolarHBondContact O-N 3.35Å; L47-K50 PolarHBondContact O-N 2.77Å; K50-F52 PolarHBondContact O-N 3.48Å; K50-S53 PolarHBondContact O-N 3.3Å; K50-S53 VanDerWaalsContact O-N 3.08Å; K50-S53 PolarHBondContact O-OG 2.92Å; K50-E54 WeakPolarHBondContact CE-OE1 3.46Å; K50-E54 WeakPolarHBondContact CG-OE1 3.47Å; K50-E54 PolarHBondContact O-N 2.89Å; K50-E54 VanDerWaalsContact O-N 3.09Å
51	Y	86.6	Confident	78	Confident	36 Å²	36	64.1 Å²	64.1	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-51.6	-52.9	172.1	176.5	-92.6	0	0	0	111.7	L47 A48 S53 E54 V55 E66 L67 N70	L47-Y51 PolarHBondContact O-N 3.3Å; A48-Y51 WeakPolarHBondContact O-CB 3.47Å; A48-Y51 PolarHBondContact O-N 3.14Å; Y51-S53 VanDerWaalsContact C-N 3.25Å; Y51-S53 PolarHBondContact O-N 2.79Å; Y51-E54 PolarHBondContact O-N 2.79Å; Y51-E54 VanDerWaalsContact O-N 3.16Å; Y51-V55 HydrophobicContact CD1-CG2 3.75Å; Y51-V55 HydrophobicContact CD2-CG2 4.3Å; Y51-V55 HydrophobicContact CE1-CG2 3.48Å; Y51-V55 VanDerWaalsContact CE1-CG2 3.48Å; Y51-V55 HydrophobicContact CE2-CG2 4.08Å; Y51-V55 HydrophobicContact CG-CG2 4.14Å; Y51-V55 WeakPolarHBondContact O-CG2 3.4Å; Y51-V55 PolarHBondContact O-N 3.29Å; Y51-E66 HydrophobicContact CD2-CG 4.48Å; Y51-E66 HydrophobicContact CE2-CG 4.08Å; Y51-L67 HydrophobicContact CE1-CD1 4.04Å; Y51-N70 HydrophobicContact CD1-CB 4.31Å
52	F	85.6	Confident	79	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.009	39%	0.391	C	S	.	.	H	α-helix	trans	-65.9	-23.5	-179.7	-70	-63.9	0	0	0	114.7	A48 L49 K50 L67 N70 L71 V74 I90 M91 F94	A48-F52 WeakPolarHBondContact O-CD2 3.08Å; A48-F52 PolarHBondContact O-N 3.22Å; L49-F52 PolarHBondContact O-N 2.95Å; K50-F52 PolarHBondContact O-N 3.48Å; F52-L67 HydrophobicContact CE1-CD1 3.73Å; F52-L67 HydrophobicContact CZ-CD1 4.26Å; F52-N70 HydrophobicContact CE2-CB 3.98Å; F52-N70 HydrophobicContact CZ-CB 4.06Å; F52-L71 HydrophobicContact CE1-CD2 3.92Å; F52-L71 HydrophobicContact CE1-CG 4.2Å; F52-L71 HydrophobicContact CE2-CD2 4.46Å; F52-L71 HydrophobicContact CZ-CB 4.49Å; F52-L71 HydrophobicContact CZ-CD2 3.57Å; F52-L71 HydrophobicContact CZ-CG 3.72Å; F52-V74 HydrophobicContact CD2-CG2 4.26Å; F52-V74 HydrophobicContact CE2-CG2 3.84Å; F52-I90 HydrophobicContact CB-CG2 4.39Å; F52-M91 HydrophobicContact CB-SD 3.97Å; F52-M91 HydrophobicContact CD1-CE 4.44Å; F52-M91 HydrophobicContact CD2-CE 3.9Å; F52-M91 HydrophobicContact CD2-SD 3.5Å; F52-M91 VanDerWaalsContact CD2-SD 3.5Å; F52-M91 HydrophobicContact CE2-CE 4.11Å; F52-M91 HydrophobicContact CE2-SD 4.22Å; F52-M91 HydrophobicContact CG-CE 4.11Å; F52-M91 HydrophobicContact CG-SD 3.79Å; F52-M91 HydrophobicContact CZ-CE 4.48Å; F52-F94 HydrophobicContact CB-CD2 4.46Å; F52-F94 HydrophobicContact CB-CG 4.36Å; F52-F94 AromaticContact CD1-CD1 3.89Å; F52-F94 HydrophobicContact CD1-CD1 3.89Å; F52-F94 HydrophobicContact CD1-CD2 4.03Å; F52-F94 AromaticContact CD1-CE1 3.72Å; F52-F94 HydrophobicContact CD1-CE1 3.72Å; F52-F94 AromaticContact CD1-CE2 3.88Å; F52-F94 HydrophobicContact CD1-CE2 3.88Å; F52-F94 HydrophobicContact CD1-CG 4.05Å; F52-F94 AromaticContact CD1-CZ 3.72Å; F52-F94 HydrophobicContact CD1-CZ 3.72Å; F52-F94 HydrophobicContact CE1-CD1 4.46Å; F52-F94 AromaticContact CE1-CE1 3.93Å; F52-F94 HydrophobicContact CE1-CE1 3.93Å; F52-F94 AromaticContact CE1-CZ 3.96Å; F52-F94 HydrophobicContact CE1-CZ 3.96Å
53	S	85.9	Confident	79.5	Confident	56 Å²	56	65.7 Å²	65.7	39%	0.392	40%	0.404	S	S	.	.	H	α-helix	trans	-76	-34.4	174.3	72.9	0	0	0	0	113	L49 K50 Y51 R99	L49-S53 PolarHBondContact O-N 3.13Å; K50-S53 PolarHBondContact O-N 3.3Å; K50-S53 VanDerWaalsContact O-N 3.08Å; K50-S53 PolarHBondContact O-OG 2.92Å; Y51-S53 VanDerWaalsContact C-N 3.25Å; Y51-S53 PolarHBondContact O-N 2.79Å; S53-R99 PolarHBondContact O-NH1 2.98Å
54	E	83.9	Confident	79.9	Confident	123 Å²	123	63 Å²	63	58%	0.575	39%	0.389	S	S	*	.	H	α-helix	trans	-94.7	-16.3	-172.9	-68.8	174.3	-176.9	0	0	113.4	K50 Y51 E56	K50-E54 WeakPolarHBondContact CE-OE1 3.46Å; K50-E54 WeakPolarHBondContact CG-OE1 3.47Å; K50-E54 PolarHBondContact O-N 2.89Å; K50-E54 VanDerWaalsContact O-N 3.09Å; Y51-E54 PolarHBondContact O-N 2.79Å; Y51-E54 VanDerWaalsContact O-N 3.16Å; E54-E56 PolarHBondContact O-N 3.43Å
55	V	83.4	Confident	80	Confident	10 Å²	10	65.7 Å²	65.7	6%	0.061	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-56.3	125.6	-179.5	170.2	0	0	0	0	112.1	Y51 F94 R99 M100	Y51-V55 HydrophobicContact CD1-CG2 3.75Å; Y51-V55 HydrophobicContact CD2-CG2 4.3Å; Y51-V55 HydrophobicContact CE1-CG2 3.48Å; Y51-V55 VanDerWaalsContact CE1-CG2 3.48Å; Y51-V55 HydrophobicContact CE2-CG2 4.08Å; Y51-V55 HydrophobicContact CG-CG2 4.14Å; Y51-V55 WeakPolarHBondContact O-CG2 3.4Å; Y51-V55 PolarHBondContact O-N 3.29Å; V55-F94 HydrophobicContact CB-CE2 4.45Å; V55-F94 HydrophobicContact CG1-CE2 4.28Å; V55-R99 WeakPolarHBondContact O-CD 3.4Å; V55-R99 PolarHBondContact O-NH1 3.09Å; V55-M100 HydrophobicContact CG1-CE 3.95Å; V55-M100 HydrophobicContact CG1-CG 3.76Å; V55-M100 HydrophobicContact CG1-SD 4.23Å
56	E	76.4	Confident	79.9	Confident	151 Å²	151	69.9 Å²	69.9	71%	0.706	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-87	155.5	176.9	-63.1	-171.2	170.4	0	0	112.7	E54 G58 T59	E54-E56 PolarHBondContact O-N 3.43Å; E56-G58 PolarHBondContact O-N 3.24Å; E56-T59 PolarHBondContact O-OG1 3.31Å; E56-T59 VanDerWaalsContact O-OG1 3.05Å
57	A	74.6	Confident	79.9	Confident	74 Å²	74	66.4 Å²	66.4	61%	0.612	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	129.9	179.2	0	0	0	0	0	111.2	R99	A57-R99 WeakPolarHBondContact CA-O 3.47Å; A57-R99 HydrophobicContact CB-CB 4.4Å
58	G	68.2	Low	79.9	Confident	73 Å²	73	66.9 Å²	66.9	75%	0.753	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.1	0	179.1	0	0	0	0	0	115.4	E56 R99	E56-G58 PolarHBondContact O-N 3.24Å; G58-R99 PolarHBondContact N-O 3.01Å
59	T	78.6	Confident	79.9	Confident	46 Å²	46	71.1 Å²	71.1	28%	0.282	42%	0.422	S	S	.	.			trans	-61.6	133.9	173	-56.6	0	0	0	0	110.6	E56 M100	E56-T59 PolarHBondContact O-OG1 3.31Å; E56-T59 VanDerWaalsContact O-OG1 3.05Å; T59-M100 WeakPolarHBondContact CB-SD 3.49Å; T59-M100 HydrophobicContact CG2-CE 3.64Å; T59-M100 HydrophobicContact CG2-SD 3.71Å
60	P	74.3	Confident	79.8	Confident	87 Å²	87	70.9 Å²	70.9	57%	0.565	42%	0.42	S	S	*	.			trans	-71	136.3	-176.5	26.8	-33.6	0	0	0	112.1	N64	P60-N64 WeakPolarHBondContact O-CB 3.46Å; P60-N64 PolarHBondContact O-ND2 3.39Å
61	V	73.4	Confident	79.8	Confident	59 Å²	59	66.3 Å²	66.3	36%	0.358	40%	0.401	S	S	.	.			trans	-88.7	-38.3	-179.2	-178.4	0	0	0	0	112	L67 M100 P104	V61-L67 HydrophobicContact CG1-CD2 4.31Å; V61-M100 HydrophobicContact CG2-CB 4.34Å; V61-M100 WeakPolarHBondContact CG2-O 3.29Å; V61-M100 HydrophobicContact CG2-SD 4.34Å; V61-P104 HydrophobicContact CG1-CG 3.82Å; V61-P104 HydrophobicContact CG2-CG 4.13Å
62	T	69.1	Low	79.8	Confident	133 Å²	133	67.8 Å²	67.8	82%	0.816	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	120.4	-178.4	47.7	0	0	0	0	110.6
63	G	68.4	Low	79.8	Confident	77 Å²	77	72.9 Å²	72.9	79%	0.794	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	14.1	179.4	0	0	0	0	0	114.9
64	N	82	Confident	79.9	Confident	32 Å²	32	70.2 Å²	70.2	17%	0.171	41%	0.414	C	S	.	.			trans	-98.2	90.7	178.3	-170.2	-22	0	0	0	110.9	P60 E66 L67 E68	P60-N64 WeakPolarHBondContact O-CB 3.46Å; P60-N64 PolarHBondContact O-ND2 3.39Å; N64-E66 PolarHBondContact O-N 3.24Å; N64-E66 WeakPolarHBondContact OD1-CB 3.42Å; N64-E66 PolarHBondContact OD1-N 3.05Å; N64-L67 HydrophobicContact CB-CB 3.99Å; N64-L67 PolarHBondContact O-N 3.02Å; N64-L67 PolarHBondContact OD1-N 3.44Å; N64-E68 PolarHBondContact O-N 3.05Å
65	D	79.9	Confident	80	Confident	125 Å²	125	66.2 Å²	66.2	67%	0.668	40%	0.395	S	S	*	.	H	α-helix	trans	-64.3	-28.2	-179.6	-66.3	-26.5	0	0	0	112.4	N69	D65-N69 VanDerWaalsContact O-CB 3.24Å; D65-N69 WeakPolarHBondContact O-CB 3.32Å; D65-N69 PolarHBondContact O-N 2.95Å; D65-N69 PolarHBondContact O-ND2 3.21Å
66	E	82.3	Confident	80.1	Confident	117 Å²	117	73.4 Å²	73.4	55%	0.547	43%	0.426	S	S	.	.	H	α-helix	trans	-69.6	-44	178.2	-171.2	175.5	-165.4	0	0	111.6	Y51 N64 N69 N70	Y51-E66 HydrophobicContact CD2-CG 4.48Å; Y51-E66 HydrophobicContact CE2-CG 4.08Å; N64-E66 PolarHBondContact O-N 3.24Å; N64-E66 WeakPolarHBondContact OD1-CB 3.42Å; N64-E66 PolarHBondContact OD1-N 3.05Å; E66-N69 PolarHBondContact O-N 3.13Å; E66-N70 WeakPolarHBondContact O-CB 3.48Å; E66-N70 PolarHBondContact O-N 3.01Å; E66-N70 PolarHBondContact O-ND2 3.46Å
67	L	82.6	Confident	80.6	Confident	4 Å²	4	68 Å²	68	2%	0.021	40%	0.403	C	S	.	.	H	α-helix	trans	-58.8	-47.5	172.5	174.4	63.5	0	0	0	111.2	Y51 F52 V61 N64 N70 L71 M100	Y51-L67 HydrophobicContact CE1-CD1 4.04Å; F52-L67 HydrophobicContact CE1-CD1 3.73Å; F52-L67 HydrophobicContact CZ-CD1 4.26Å; V61-L67 HydrophobicContact CG1-CD2 4.31Å; N64-L67 HydrophobicContact CB-CB 3.99Å; N64-L67 PolarHBondContact O-N 3.02Å; N64-L67 PolarHBondContact OD1-N 3.44Å; L67-N70 PolarHBondContact O-N 3.16Å; L67-L71 HydrophobicContact CD1-CD1 3.97Å; L67-L71 HydrophobicContact CD1-CG 4.1Å; L67-L71 HydrophobicContact CG-CD1 4.01Å; L67-L71 HydrophobicContact CG-CG 4.5Å; L67-L71 WeakPolarHBondContact O-CB 3.01Å; L67-L71 WeakPolarHBondContact O-CG 3.46Å; L67-L71 PolarHBondContact O-N 3.1Å; L67-M100 HydrophobicContact CB-CE 4.35Å; L67-M100 HydrophobicContact CD1-CE 3.68Å; L67-M100 HydrophobicContact CD2-CE 3.64Å; L67-M100 HydrophobicContact CD2-SD 4.48Å; L67-M100 HydrophobicContact CG-CE 4.07Å
68	E	84.1	Confident	81.1	Confident	82 Å²	82	64.5 Å²	64.5	38%	0.383	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-45.7	-178.6	-172.6	57.6	-144.8	0	0	111.1	N64 N70 L71 V72 R107	N64-E68 PolarHBondContact O-N 3.05Å; E68-N70 PolarHBondContact O-N 3.23Å; E68-L71 PolarHBondContact O-N 3.17Å; E68-V72 HydrophobicContact CG-CG2 4.48Å; E68-V72 WeakPolarHBondContact O-CB 3.47Å; E68-V72 VanDerWaalsContact O-CG2 3.25Å; E68-V72 WeakPolarHBondContact O-CG2 3.01Å; E68-V72 PolarHBondContact O-N 3.32Å; E68-V72 WeakPolarHBondContact OE1-CG2 3.44Å; E68-R107 IonicContact OE1-CZ 3.85Å; E68-R107 VanDerWaalsContact OE1-CZ 3.3Å; E68-R107 IonicContact OE1-NH1 3.38Å; E68-R107 PolarHBondContact OE1-NH1 3.04Å; E68-R107 IonicContact OE1-NH2 2.74Å; E68-R107 PolarHBondContact OE1-NH2 3.37Å; E68-R107 IonicContact OE2-CZ 3.26Å; E68-R107 IonicContact OE2-NH1 3.93Å; E68-R107 PolarHBondContact OE2-NH1 3.25Å
69	N	85.3	Confident	81.9	Confident	90 Å²	90	66 Å²	66	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-61	-42.6	177.5	-76.6	-38.6	0	0	0	112.3	D65 E66 R73	D65-N69 VanDerWaalsContact O-CB 3.24Å; D65-N69 WeakPolarHBondContact O-CB 3.32Å; D65-N69 PolarHBondContact O-N 2.95Å; D65-N69 PolarHBondContact O-ND2 3.21Å; E66-N69 PolarHBondContact O-N 3.13Å; N69-R73 VanDerWaalsContact O-CG 3.24Å; N69-R73 WeakPolarHBondContact O-CG 3.5Å; N69-R73 PolarHBondContact O-N 2.89Å; N69-R73 VanDerWaalsContact O-N 3.11Å
70	N	86.1	Confident	82.1	Confident	11 Å²	11	66.2 Å²	66.2	6%	0.059	36%	0.363	C	S	.	.	H	α-helix	trans	-70.5	-39	178.2	-73.2	-28.1	0	0	0	112.2	A48 Y51 F52 E66 L67 E68 R73 V74	A48-N70 HydrophobicContact CB-CB 4.06Å; Y51-N70 HydrophobicContact CD1-CB 4.31Å; F52-N70 HydrophobicContact CE2-CB 3.98Å; F52-N70 HydrophobicContact CZ-CB 4.06Å; E66-N70 WeakPolarHBondContact O-CB 3.48Å; E66-N70 PolarHBondContact O-N 3.01Å; E66-N70 PolarHBondContact O-ND2 3.46Å; L67-N70 PolarHBondContact O-N 3.16Å; E68-N70 PolarHBondContact O-N 3.23Å; N70-R73 PolarHBondContact O-N 3.04Å; N70-V74 WeakPolarHBondContact O-CG2 3.17Å; N70-V74 PolarHBondContact O-N 3.32Å
71	L	85.1	Confident	82.4	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-62	-47	173.8	-80.2	174.6	0	0	0	111.8	F52 L67 E68 R73 V74 E75 V108	F52-L71 HydrophobicContact CE1-CD2 3.92Å; F52-L71 HydrophobicContact CE1-CG 4.2Å; F52-L71 HydrophobicContact CE2-CD2 4.46Å; F52-L71 HydrophobicContact CZ-CB 4.49Å; F52-L71 HydrophobicContact CZ-CD2 3.57Å; F52-L71 HydrophobicContact CZ-CG 3.72Å; L67-L71 HydrophobicContact CD1-CD1 3.97Å; L67-L71 HydrophobicContact CD1-CG 4.1Å; L67-L71 HydrophobicContact CG-CD1 4.01Å; L67-L71 HydrophobicContact CG-CG 4.5Å; L67-L71 WeakPolarHBondContact O-CB 3.01Å; L67-L71 WeakPolarHBondContact O-CG 3.46Å; L67-L71 PolarHBondContact O-N 3.1Å; E68-L71 PolarHBondContact O-N 3.17Å; L71-R73 VanDerWaalsContact C-N 3.26Å; L71-R73 PolarHBondContact O-N 3.21Å; L71-V74 PolarHBondContact O-N 3.36Å; L71-E75 WeakPolarHBondContact O-CB 3.28Å; L71-E75 WeakPolarHBondContact O-CG 3.42Å; L71-E75 PolarHBondContact O-N 2.75Å; L71-V108 HydrophobicContact CD2-CG2 3.72Å
72	V	86.7	Confident	83.1	Confident	67 Å²	67	68.2 Å²	68.2	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-37.9	178.3	170.4	0	0	0	0	111.1	E68 K76	E68-V72 HydrophobicContact CG-CG2 4.48Å; E68-V72 WeakPolarHBondContact O-CB 3.47Å; E68-V72 VanDerWaalsContact O-CG2 3.25Å; E68-V72 WeakPolarHBondContact O-CG2 3.01Å; E68-V72 PolarHBondContact O-N 3.32Å; E68-V72 WeakPolarHBondContact OE1-CG2 3.44Å; V72-K76 VanDerWaalsContact O-CB 3.32Å; V72-K76 WeakPolarHBondContact O-CB 3.42Å; V72-K76 PolarHBondContact O-N 3.09Å
73	R	86.1	Confident	83.9	Confident	109 Å²	109	62 Å²	62	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-47.5	174.7	-74	170.5	-173.8	179.7	3.1	111.9	N69 N70 L71 K76 V77	N69-R73 VanDerWaalsContact O-CG 3.24Å; N69-R73 WeakPolarHBondContact O-CG 3.5Å; N69-R73 PolarHBondContact O-N 2.89Å; N69-R73 VanDerWaalsContact O-N 3.11Å; N70-R73 PolarHBondContact O-N 3.04Å; L71-R73 VanDerWaalsContact C-N 3.26Å; L71-R73 PolarHBondContact O-N 3.21Å; R73-K76 PolarHBondContact O-N 3.24Å; R73-V77 WeakPolarHBondContact O-CG2 3.29Å; R73-V77 PolarHBondContact O-N 3.4Å; R73-V77 VanDerWaalsContact O-N 3.09Å
74	V	87	Confident	84.9	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-42.6	177.9	174.3	0	0	0	0	111.1	F45 A48 F52 N70 L71 K76 V77 A78 L83 M91	F45-V74 HydrophobicContact CD2-CG2 4.5Å; F45-V74 HydrophobicContact CE2-CG2 4.23Å; A48-V74 HydrophobicContact CB-CG2 4.14Å; F52-V74 HydrophobicContact CD2-CG2 4.26Å; F52-V74 HydrophobicContact CE2-CG2 3.84Å; N70-V74 WeakPolarHBondContact O-CG2 3.17Å; N70-V74 PolarHBondContact O-N 3.32Å; L71-V74 PolarHBondContact O-N 3.36Å; V74-K76 PolarHBondContact O-N 3.49Å; V74-V77 PolarHBondContact O-N 3.3Å; V74-A78 WeakPolarHBondContact O-CB 3.39Å; V74-A78 PolarHBondContact O-N 3.01Å; V74-L83 HydrophobicContact CG1-CD2 4.17Å; V74-M91 HydrophobicContact CG1-CE 4.01Å; V74-M91 HydrophobicContact CG1-CG 4.34Å; V74-M91 HydrophobicContact CG1-SD 4.25Å; V74-M91 HydrophobicContact CG2-SD 4.38Å
75	E	87.1	Confident	85.1	Confident	39 Å²	39	60 Å²	60	18%	0.182	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-45.1	175.6	-74	178.9	153.6	0	0	111.7	L71 V77 A78 F79 R107 C111	L71-E75 WeakPolarHBondContact O-CB 3.28Å; L71-E75 WeakPolarHBondContact O-CG 3.42Å; L71-E75 PolarHBondContact O-N 2.75Å; E75-V77 VanDerWaalsContact C-N 3.31Å; E75-V77 PolarHBondContact O-N 2.95Å; E75-A78 PolarHBondContact O-N 3.24Å; E75-F79 HydrophobicContact CB-CD2 4.47Å; E75-F79 WeakPolarHBondContact O-CD2 3.42Å; E75-F79 PolarHBondContact O-N 2.77Å; E75-R107 WeakPolarHBondContact OE1-CD 3.4Å; E75-R107 WeakPolarHBondContact OE1-CG 3.15Å; E75-R107 IonicContact OE1-CZ 3.42Å; E75-R107 IonicContact OE1-NE 3.84Å; E75-R107 PolarHBondContact OE1-NE 3.41Å; E75-R107 IonicContact OE1-NH2 2.97Å; E75-R107 IonicContact OE2-CZ 2.77Å; E75-R107 IonicContact OE2-NE 3.63Å; E75-R107 PolarHBondContact OE2-NE 3.49Å; E75-R107 IonicContact OE2-NH2 2.75Å; E75-R107 PolarHBondContact OE2-NH2 2.98Å; E75-C111 HydrophobicContact CG-CB 3.97Å
76	K	85.9	Confident	85.5	Confident	160 Å²	160	59.9 Å²	59.9	70%	0.696	29%	0.288	S	S	*	.	H	α-helix	trans	-59.5	-42	177.9	-173	178.5	-179.2	-179.8	0	111.8	V72 R73 V74 S80	V72-K76 VanDerWaalsContact O-CB 3.32Å; V72-K76 WeakPolarHBondContact O-CB 3.42Å; V72-K76 PolarHBondContact O-N 3.09Å; R73-K76 PolarHBondContact O-N 3.24Å; V74-K76 PolarHBondContact O-N 3.49Å; K76-S80 VanDerWaalsContact O-CB 3.25Å; K76-S80 WeakPolarHBondContact O-CB 3.33Å; K76-S80 PolarHBondContact O-N 3.37Å; K76-S80 PolarHBondContact O-OG 2.74Å
77	V	86.1	Confident	85.7	Confident	38 Å²	38	54.3 Å²	54.3	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-69.8	-45.8	176.9	175.9	0	0	0	0	110.9	F45 R73 V74 E75 F79 S80 R81 G82	F45-V77 HydrophobicContact CB-CG2 4.34Å; F45-V77 HydrophobicContact CD2-CB 3.86Å; F45-V77 HydrophobicContact CD2-CG1 4.04Å; F45-V77 HydrophobicContact CD2-CG2 3.61Å; F45-V77 HydrophobicContact CE1-CG1 4.27Å; F45-V77 HydrophobicContact CE2-CB 3.78Å; F45-V77 HydrophobicContact CE2-CG1 3.76Å; F45-V77 HydrophobicContact CE2-CG2 4.08Å; F45-V77 HydrophobicContact CG-CG1 4.41Å; F45-V77 HydrophobicContact CG-CG2 4.03Å; F45-V77 HydrophobicContact CZ-CB 4.41Å; F45-V77 HydrophobicContact CZ-CG1 3.88Å; R73-V77 WeakPolarHBondContact O-CG2 3.29Å; R73-V77 PolarHBondContact O-N 3.4Å; R73-V77 VanDerWaalsContact O-N 3.09Å; V74-V77 PolarHBondContact O-N 3.3Å; E75-V77 VanDerWaalsContact C-N 3.31Å; E75-V77 PolarHBondContact O-N 2.95Å; V77-F79 PolarHBondContact O-N 3.42Å; V77-S80 WeakPolarHBondContact CA-OG 3.42Å; V77-S80 PolarHBondContact O-N 3.32Å; V77-S80 PolarHBondContact O-OG 3.31Å; V77-S80 VanDerWaalsContact O-OG 3.11Å; V77-R81 PolarHBondContact O-N 2.88Å; V77-G82 PolarHBondContact O-N 2.88Å
78	A	85.9	Confident	86.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-43.5	-179.2	0	0	0	0	0	113.3	V74 E75 G82 L83 C111	V74-A78 WeakPolarHBondContact O-CB 3.39Å; V74-A78 PolarHBondContact O-N 3.01Å; E75-A78 PolarHBondContact O-N 3.24Å; A78-G82 VanDerWaalsContact O-CA 3.27Å; A78-G82 WeakPolarHBondContact O-CA 3.35Å; A78-G82 PolarHBondContact O-N 3.47Å; A78-G82 VanDerWaalsContact O-N 3.12Å; A78-L83 HydrophobicContact CB-CD1 4.21Å; A78-L83 HydrophobicContact CB-CD2 3.96Å; A78-L83 HydrophobicContact CB-CG 3.86Å; A78-C111 HydrophobicContact CB-CB 4.5Å; A78-C111 WeakPolarHBondContact CB-O 3.38Å
79	F	84.9	Confident	86.4	Confident	104 Å²	104	51.1 Å²	51.1	46%	0.456	25%	0.249	S	C	.	.	H	α-helix	trans	-79.5	-20.4	179.2	-73.4	-67.1	0	0	0	114.2	E75 V77 C111 L113 R258	E75-F79 HydrophobicContact CB-CD2 4.47Å; E75-F79 WeakPolarHBondContact O-CD2 3.42Å; E75-F79 PolarHBondContact O-N 2.77Å; V77-F79 PolarHBondContact O-N 3.42Å; F79-C111 HydrophobicContact CE2-CB 4.02Å; F79-C111 HydrophobicContact CZ-CB 4.3Å; F79-L113 HydrophobicContact CD1-CD1 3.61Å; F79-L113 HydrophobicContact CE1-CD1 3.77Å; F79-L113 HydrophobicContact CG-CD1 4.4Å; F79-R258 PolarHBondContact O-NH1 3Å
80	S	81.9	Confident	86.6	Confident	51 Å²	51	49.4 Å²	49.4	36%	0.357	24%	0.24	S	C	.	.	H	α-helix	trans	-88	-52.6	180	58.1	0	0	0	0	112.5	K76 V77	K76-S80 VanDerWaalsContact O-CB 3.25Å; K76-S80 WeakPolarHBondContact O-CB 3.33Å; K76-S80 PolarHBondContact O-N 3.37Å; K76-S80 PolarHBondContact O-OG 2.74Å; V77-S80 WeakPolarHBondContact CA-OG 3.42Å; V77-S80 PolarHBondContact O-N 3.32Å; V77-S80 PolarHBondContact O-OG 3.31Å; V77-S80 VanDerWaalsContact O-OG 3.11Å
81	R	81.6	Confident	86.8	Confident	183 Å²	183	49 Å²	49	69%	0.691	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-9.3	-172.8	-61.5	-177.8	-178.5	-175.2	-0.3	113.8	V77 A115 V255 N259	V77-R81 PolarHBondContact O-N 2.88Å; R81-A115 WeakPolarHBondContact O-CB 3.37Å; R81-V255 WeakPolarHBondContact O-CG1 3.46Å; R81-N259 PolarHBondContact O-ND2 3.25Å
82	G	86.1	Confident	87.1	Confident	6 Å²	6	48.8 Å²	48.8	6%	0.062	24%	0.236	C	C	.	.			trans	76.8	166.5	-168.4	0	0	0	0	0	112.2	V77 A78 L113	V77-G82 PolarHBondContact O-N 2.88Å; A78-G82 VanDerWaalsContact O-CA 3.27Å; A78-G82 WeakPolarHBondContact O-CA 3.35Å; A78-G82 PolarHBondContact O-N 3.47Å; A78-G82 VanDerWaalsContact O-N 3.12Å; G82-L113 CarbonylContact C-O 3.34Å; G82-L113 WeakPolarHBondContact CA-O 3.36Å
83	L	87.8	Confident	87.2	Confident	1 Å²	1	47 Å²	47	1%	0.005	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-93.7	141.4	-179	-61.7	174.8	0	0	0	110.9	F45 V74 A78 A87 I88 L112 L113 A115	F45-L83 HydrophobicContact CE2-CD2 3.97Å; F45-L83 HydrophobicContact CZ-CD2 3.77Å; V74-L83 HydrophobicContact CG1-CD2 4.17Å; A78-L83 HydrophobicContact CB-CD1 4.21Å; A78-L83 HydrophobicContact CB-CD2 3.96Å; A78-L83 HydrophobicContact CB-CG 3.86Å; L83-A87 HydrophobicContact CB-CB 4.14Å; L83-A87 HydrophobicContact CD2-CB 4.4Å; L83-I88 HydrophobicContact CB-CG1 3.79Å; L83-L112 HydrophobicContact CD1-CD2 4.14Å; L83-L113 PolarHBondContact N-O 3.37Å; L83-A115 VanDerWaalsContact O-CB 3.32Å; L83-A115 WeakPolarHBondContact O-CB 3.43Å; L83-A115 PolarHBondContact O-N 2.91Å
84	S	87.8	Confident	87.3	Confident	43 Å²	43	41.9 Å²	41.9	30%	0.301	21%	0.205	S	C	.	.			trans	-67.9	161.2	172.7	85.4	0	0	0	0	111.3	E86 A87 I88	S84-E86 WeakPolarHBondContact CB-OE2 3.41Å; S84-E86 PolarHBondContact O-N 3.32Å; S84-E86 PolarHBondContact OG-OE2 3.5Å; S84-A87 PolarHBondContact O-N 2.91Å; S84-A87 VanDerWaalsContact O-N 3.13Å; S84-A87 PolarHBondContact OG-N 3.47Å; S84-I88 WeakPolarHBondContact O-CG1 3.43Å; S84-I88 PolarHBondContact O-N 3.07Å
85	P	87.6	Confident	87.3	Confident	24 Å²	24	41.8 Å²	41.8	16%	0.156	21%	0.205	C	C	.	.	H	α-helix	trans	-53.8	-39	177.6	-25.5	35	0	0	0	113.4	S89 V117 P119	P85-S89 PolarHBondContact O-N 3.22Å; P85-V117 HydrophobicContact CG-CG2 3.93Å; P85-P119 HydrophobicContact CB-CG 3.71Å
86	E	87	Confident	87.3	Confident	123 Å²	123	40 Å²	40	58%	0.575	20%	0.196	S	C	*	.	H	α-helix	trans	-67.6	-46	177.5	-56.5	71.3	-152.6	0	0	111	S84 I88 S89 I90	S84-E86 WeakPolarHBondContact CB-OE2 3.41Å; S84-E86 PolarHBondContact O-N 3.32Å; S84-E86 PolarHBondContact OG-OE2 3.5Å; E86-I88 VanDerWaalsContact C-N 3.34Å; E86-I88 PolarHBondContact O-N 3.33Å; E86-S89 WeakPolarHBondContact O-CB 3.17Å; E86-S89 PolarHBondContact O-N 2.99Å; E86-S89 VanDerWaalsContact O-N 3.1Å; E86-I90 WeakPolarHBondContact O-CG1 3.07Å; E86-I90 PolarHBondContact O-N 3.38Å
87	A	87.3	Confident	87.1	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-41.6	177.6	0	0	0	0	0	111.7	F45 L49 L83 S84 S89 I90 M91	F45-A87 HydrophobicContact CE1-CB 4.31Å; F45-A87 HydrophobicContact CZ-CB 3.93Å; L49-A87 HydrophobicContact CD1-CB 3.72Å; L49-A87 HydrophobicContact CD2-CB 3.93Å; L49-A87 HydrophobicContact CG-CB 4.5Å; L83-A87 HydrophobicContact CB-CB 4.14Å; L83-A87 HydrophobicContact CD2-CB 4.4Å; S84-A87 PolarHBondContact O-N 2.91Å; S84-A87 VanDerWaalsContact O-N 3.13Å; S84-A87 PolarHBondContact OG-N 3.47Å; A87-S89 VanDerWaalsContact C-N 3.3Å; A87-S89 PolarHBondContact O-N 2.96Å; A87-I90 PolarHBondContact O-N 2.86Å; A87-M91 WeakPolarHBondContact O-CB 3.22Å; A87-M91 WeakPolarHBondContact O-CG 3.15Å; A87-M91 PolarHBondContact O-N 2.74Å
88	I	90.8	Very high	86.8	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.1	-44.4	173.3	-66.9	171.9	0	0	0	110.3	L83 S84 E86 I90 M91 L92 L112 P114 V118 W146	L83-I88 HydrophobicContact CB-CG1 3.79Å; S84-I88 WeakPolarHBondContact O-CG1 3.43Å; S84-I88 PolarHBondContact O-N 3.07Å; E86-I88 VanDerWaalsContact C-N 3.34Å; E86-I88 PolarHBondContact O-N 3.33Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I88-I90 PolarHBondContact O-N 3.45Å; I88-M91 PolarHBondContact O-N 3.49Å; I88-L92 WeakPolarHBondContact O-CB 3.46Å; I88-L92 PolarHBondContact O-N 3.28Å; I88-L112 HydrophobicContact CB-CD2 4.42Å; I88-L112 HydrophobicContact CG1-CD2 4.41Å; I88-L112 HydrophobicContact CG2-CD2 4.11Å; I88-P114 HydrophobicContact CD1-CB 3.53Å; I88-V118 HydrophobicContact CD1-CG2 4.11Å; I88-V118 HydrophobicContact CG2-CG1 4.32Å; I88-W146 HydrophobicContact CG2-CH2 4.22Å; I88-W146 HydrophobicContact CG2-CZ2 4.35Å
89	S	90.4	Very high	86.4	Confident	20 Å²	20	35.3 Å²	35.3	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-39.5	-178.2	-170.1	0	0	0	0	112.9	P85 E86 A87 D93 R125	P85-S89 PolarHBondContact O-N 3.22Å; E86-S89 WeakPolarHBondContact O-CB 3.17Å; E86-S89 PolarHBondContact O-N 2.99Å; E86-S89 VanDerWaalsContact O-N 3.1Å; A87-S89 VanDerWaalsContact C-N 3.3Å; A87-S89 PolarHBondContact O-N 2.96Å; S89-D93 WeakPolarHBondContact O-CB 3.48Å; S89-D93 PolarHBondContact O-N 2.92Å; S89-R125 PolarHBondContact OG-NH2 2.89Å
90	I	89.6	Confident	86	Confident	54 Å²	54	30.7 Å²	30.7	28%	0.277	15%	0.152	S	C	.	.	H	α-helix	trans	-71.8	-50.5	178.1	-65.3	167.1	0	0	0	110.2	L49 F52 E86 A87 I88 L92 D93 F94	L49-I90 HydrophobicContact CB-CD1 4.38Å; F52-I90 HydrophobicContact CB-CG2 4.39Å; E86-I90 WeakPolarHBondContact O-CG1 3.07Å; E86-I90 PolarHBondContact O-N 3.38Å; A87-I90 PolarHBondContact O-N 2.86Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I88-I90 PolarHBondContact O-N 3.45Å; I90-L92 VanDerWaalsContact C-N 3.33Å; I90-L92 PolarHBondContact O-N 3.2Å; I90-D93 PolarHBondContact O-N 3.09Å; I90-F94 PolarHBondContact O-N 3.05Å
91	M	90.6	Very high	85.7	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-67	-34.2	-176.4	-66.2	-55.8	-59.4	0	0	112.5	L49 F52 V74 A87 I88 A95 V108 L112	L49-M91 HydrophobicContact CD2-CG 3.94Å; L49-M91 HydrophobicContact CD2-SD 3.97Å; F52-M91 HydrophobicContact CB-SD 3.97Å; F52-M91 HydrophobicContact CD1-CE 4.44Å; F52-M91 HydrophobicContact CD2-CE 3.9Å; F52-M91 HydrophobicContact CD2-SD 3.5Å; F52-M91 VanDerWaalsContact CD2-SD 3.5Å; F52-M91 HydrophobicContact CE2-CE 4.11Å; F52-M91 HydrophobicContact CE2-SD 4.22Å; F52-M91 HydrophobicContact CG-CE 4.11Å; F52-M91 HydrophobicContact CG-SD 3.79Å; F52-M91 HydrophobicContact CZ-CE 4.48Å; V74-M91 HydrophobicContact CG1-CE 4.01Å; V74-M91 HydrophobicContact CG1-CG 4.34Å; V74-M91 HydrophobicContact CG1-SD 4.25Å; V74-M91 HydrophobicContact CG2-SD 4.38Å; A87-M91 WeakPolarHBondContact O-CB 3.22Å; A87-M91 WeakPolarHBondContact O-CG 3.15Å; A87-M91 PolarHBondContact O-N 2.74Å; I88-M91 PolarHBondContact O-N 3.49Å; M91-A95 VanDerWaalsContact O-CB 3.32Å; M91-A95 WeakPolarHBondContact O-CB 3.47Å; M91-A95 PolarHBondContact O-N 2.85Å; M91-V108 HydrophobicContact CB-CG1 4.03Å; M91-V108 HydrophobicContact CE-CB 4.34Å; M91-V108 HydrophobicContact CE-CG1 3.64Å; M91-V108 HydrophobicContact CE-CG2 3.68Å; M91-L112 HydrophobicContact CB-CD2 4.18Å
92	L	90.4	Very high	85.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71	-39.6	176.6	-172.8	64.4	0	0	0	111.7	I88 I90 A95 M96 L109 L112 A122 A126 F143 W146	I88-L92 WeakPolarHBondContact O-CB 3.46Å; I88-L92 PolarHBondContact O-N 3.28Å; I90-L92 VanDerWaalsContact C-N 3.33Å; I90-L92 PolarHBondContact O-N 3.2Å; L92-A95 PolarHBondContact O-N 3.5Å; L92-M96 HydrophobicContact CD1-CG 4.15Å; L92-M96 HydrophobicContact CG-CG 4.47Å; L92-M96 WeakPolarHBondContact O-CB 3.29Å; L92-M96 VanDerWaalsContact O-CG 3.26Å; L92-M96 WeakPolarHBondContact O-CG 3.4Å; L92-M96 PolarHBondContact O-N 3.48Å; L92-L109 HydrophobicContact CD1-CD2 4.08Å; L92-L112 HydrophobicContact CD1-CD1 4Å; L92-A122 HydrophobicContact CD2-CB 4.19Å; L92-A126 HydrophobicContact CD1-CB 4.35Å; L92-A126 HydrophobicContact CD2-CB 3.86Å; L92-A126 HydrophobicContact CG-CB 3.91Å; L92-F143 HydrophobicContact CD1-CD2 4.1Å; L92-F143 HydrophobicContact CD1-CE2 3.96Å; L92-F143 HydrophobicContact CD2-CE2 4.48Å; L92-W146 HydrophobicContact CD1-CE3 4.45Å; L92-W146 HydrophobicContact CD1-CH2 4.46Å; L92-W146 HydrophobicContact CD1-CZ3 4.11Å; L92-W146 HydrophobicContact CD2-CH2 3.99Å; L92-W146 HydrophobicContact CD2-CZ3 3.85Å
93	D	88.9	Confident	85	Confident	29 Å²	29	28.1 Å²	28.1	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-42.4	174	-168.9	67.1	0	0	0	111.3	S89 I90 M96 S97 R99 R125 W129	S89-D93 WeakPolarHBondContact O-CB 3.48Å; S89-D93 PolarHBondContact O-N 2.92Å; I90-D93 PolarHBondContact O-N 3.09Å; D93-M96 PolarHBondContact O-N 3.24Å; D93-S97 WeakPolarHBondContact O-CB 3.32Å; D93-S97 PolarHBondContact O-N 3.2Å; D93-S97 PolarHBondContact O-OG 2.98Å; D93-R99 IonicContact OD2-NH2 3.34Å; D93-R125 IonicContact OD1-NH1 3.74Å; D93-W129 PolarHBondContact OD1-NE1 3.19Å
94	F	87.9	Confident	84.7	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-49.7	172.9	173.7	-101	0	0	0	112	F52 V55 I90 M96 S97 M100 V108	F52-F94 HydrophobicContact CB-CD2 4.46Å; F52-F94 HydrophobicContact CB-CG 4.36Å; F52-F94 AromaticContact CD1-CD1 3.89Å; F52-F94 HydrophobicContact CD1-CD1 3.89Å; F52-F94 HydrophobicContact CD1-CD2 4.03Å; F52-F94 AromaticContact CD1-CE1 3.72Å; F52-F94 HydrophobicContact CD1-CE1 3.72Å; F52-F94 AromaticContact CD1-CE2 3.88Å; F52-F94 HydrophobicContact CD1-CE2 3.88Å; F52-F94 HydrophobicContact CD1-CG 4.05Å; F52-F94 AromaticContact CD1-CZ 3.72Å; F52-F94 HydrophobicContact CD1-CZ 3.72Å; F52-F94 HydrophobicContact CE1-CD1 4.46Å; F52-F94 AromaticContact CE1-CE1 3.93Å; F52-F94 HydrophobicContact CE1-CE1 3.93Å; F52-F94 AromaticContact CE1-CZ 3.96Å; F52-F94 HydrophobicContact CE1-CZ 3.96Å; V55-F94 HydrophobicContact CB-CE2 4.45Å; V55-F94 HydrophobicContact CG1-CE2 4.28Å; I90-F94 PolarHBondContact O-N 3.05Å; F94-M96 VanDerWaalsContact C-N 3.35Å; F94-M96 PolarHBondContact O-N 3.14Å; F94-S97 PolarHBondContact O-N 2.93Å; F94-S97 PolarHBondContact O-OG 3.32Å; F94-S97 VanDerWaalsContact O-OG 3.07Å; F94-M100 HydrophobicContact CE2-CB 4.38Å; F94-M100 HydrophobicContact CE2-CG 3.99Å; F94-M100 HydrophobicContact CZ-CB 4.08Å; F94-M100 HydrophobicContact CZ-CG 4.03Å; F94-V108 HydrophobicContact CD1-CG2 4.22Å; F94-V108 HydrophobicContact CE1-CG2 4.16Å
95	A	87.4	Confident	84.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-36.2	-178.4	0	0	0	0	0	113.1	M91 L92 C105 V108 L109	M91-A95 VanDerWaalsContact O-CB 3.32Å; M91-A95 WeakPolarHBondContact O-CB 3.47Å; M91-A95 PolarHBondContact O-N 2.85Å; L92-A95 PolarHBondContact O-N 3.5Å; A95-C105 HydrophobicContact CB-CB 4.49Å; A95-C105 VanDerWaalsContact O-CB 3.31Å; A95-C105 WeakPolarHBondContact O-CB 3.11Å; A95-C105 PolarHBondContact O-SG 2.94Å; A95-V108 HydrophobicContact CB-CB 4.14Å; A95-V108 HydrophobicContact CB-CG1 3.88Å; A95-L109 HydrophobicContact CB-CD2 4.4Å; A95-L109 HydrophobicContact CB-CG 4.19Å
96	M	86.9	Confident	84.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-86.1	-23.3	-177.5	-64.7	-60.7	-66.9	0	0	113.1	L92 D93 F94 L98 A126 W129 L130 L135 F143	L92-M96 HydrophobicContact CD1-CG 4.15Å; L92-M96 HydrophobicContact CG-CG 4.47Å; L92-M96 WeakPolarHBondContact O-CB 3.29Å; L92-M96 VanDerWaalsContact O-CG 3.26Å; L92-M96 WeakPolarHBondContact O-CG 3.4Å; L92-M96 PolarHBondContact O-N 3.48Å; D93-M96 PolarHBondContact O-N 3.24Å; F94-M96 VanDerWaalsContact C-N 3.35Å; F94-M96 PolarHBondContact O-N 3.14Å; M96-L98 VanDerWaalsContact C-N 3.3Å; M96-L98 PolarHBondContact O-N 3.5Å; M96-A126 HydrophobicContact CB-CB 4.44Å; M96-A126 WeakPolarHBondContact CE-O 3.42Å; M96-A126 HydrophobicContact CG-CB 3.77Å; M96-W129 HydrophobicContact CB-CB 3.85Å; M96-W129 HydrophobicContact CB-CG 4.07Å; M96-L130 HydrophobicContact CE-CD1 4.16Å; M96-L135 HydrophobicContact CE-CD2 3.78Å; M96-L135 HydrophobicContact SD-CD2 4.26Å; M96-F143 HydrophobicContact CE-CB 4.23Å; M96-F143 HydrophobicContact CE-CD1 3.69Å; M96-F143 HydrophobicContact CE-CD2 4.2Å; M96-F143 HydrophobicContact CE-CE1 4.08Å; M96-F143 HydrophobicContact CE-CG 3.76Å; M96-F143 HydrophobicContact SD-CB 3.95Å; M96-F143 HydrophobicContact SD-CD1 4.31Å; M96-F143 HydrophobicContact SD-CD2 3.81Å; M96-F143 HydrophobicContact SD-CE2 4.44Å; M96-F143 HydrophobicContact SD-CG 3.74Å
97	S	83.2	Confident	83.9	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-76.4	-12.5	176.6	59.2	0	0	0	0	113.8	D93 F94 R99 R133	D93-S97 WeakPolarHBondContact O-CB 3.32Å; D93-S97 PolarHBondContact O-N 3.2Å; D93-S97 PolarHBondContact O-OG 2.98Å; F94-S97 PolarHBondContact O-N 2.93Å; F94-S97 PolarHBondContact O-OG 3.32Å; F94-S97 VanDerWaalsContact O-OG 3.07Å; S97-R99 PolarHBondContact O-N 2.7Å; S97-R99 VanDerWaalsContact O-N 3.09Å; S97-R99 WeakPolarHBondContact OG-CG 3.24Å; S97-R99 PolarHBondContact OG-NE 3.31Å; S97-R133 PolarHBondContact O-NH1 3.34Å
98	L	78.1	Confident	83.9	Confident	32 Å²	32	23.8 Å²	23.8	17%	0.168	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	27.3	178.4	-65.5	-174.9	0	0	0	114.6	M96 M100 G101 C105 L135	M96-L98 VanDerWaalsContact C-N 3.3Å; M96-L98 PolarHBondContact O-N 3.5Å; L98-M100 PolarHBondContact O-N 3.44Å; L98-G101 PolarHBondContact O-N 3.11Å; L98-G101 VanDerWaalsContact O-N 3.14Å; L98-C105 HydrophobicContact CD2-CB 3.89Å; L98-C105 VanDerWaalsContact CD2-SG 3.55Å; L98-L135 HydrophobicContact CD1-CB 4.36Å; L98-L135 HydrophobicContact CD1-CD1 4.49Å; L98-L135 HydrophobicContact CD1-CG 3.74Å; L98-L135 HydrophobicContact CG-CG 4.18Å
99	R	79.3	Confident	83.6	Confident	69 Å²	69	23.8 Å²	23.8	26%	0.26	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.3	-176.5	-63.6	178.7	-164.1	-170.4	4.2	113.4	S53 V55 A57 G58 D93 S97	S53-R99 PolarHBondContact O-NH1 2.98Å; V55-R99 WeakPolarHBondContact O-CD 3.4Å; V55-R99 PolarHBondContact O-NH1 3.09Å; A57-R99 WeakPolarHBondContact CA-O 3.47Å; A57-R99 HydrophobicContact CB-CB 4.4Å; G58-R99 PolarHBondContact N-O 3.01Å; D93-R99 IonicContact OD2-NH2 3.34Å; S97-R99 PolarHBondContact O-N 2.7Å; S97-R99 VanDerWaalsContact O-N 3.09Å; S97-R99 WeakPolarHBondContact OG-CG 3.24Å; S97-R99 PolarHBondContact OG-NE 3.31Å
100	M	74.7	Confident	83.3	Confident	6 Å²	6	29 Å²	29	3%	0.03	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	24.3	-176	-74.8	-90.9	-121	0	0	112.5	V55 T59 V61 L67 F94 L98 P104	V55-M100 HydrophobicContact CG1-CE 3.95Å; V55-M100 HydrophobicContact CG1-CG 3.76Å; V55-M100 HydrophobicContact CG1-SD 4.23Å; T59-M100 WeakPolarHBondContact CB-SD 3.49Å; T59-M100 HydrophobicContact CG2-CE 3.64Å; T59-M100 HydrophobicContact CG2-SD 3.71Å; V61-M100 HydrophobicContact CG2-CB 4.34Å; V61-M100 WeakPolarHBondContact CG2-O 3.29Å; V61-M100 HydrophobicContact CG2-SD 4.34Å; L67-M100 HydrophobicContact CB-CE 4.35Å; L67-M100 HydrophobicContact CD1-CE 3.68Å; L67-M100 HydrophobicContact CD2-CE 3.64Å; L67-M100 HydrophobicContact CD2-SD 4.48Å; L67-M100 HydrophobicContact CG-CE 4.07Å; F94-M100 HydrophobicContact CE2-CB 4.38Å; F94-M100 HydrophobicContact CE2-CG 3.99Å; F94-M100 HydrophobicContact CZ-CB 4.08Å; F94-M100 HydrophobicContact CZ-CG 4.03Å; L98-M100 PolarHBondContact O-N 3.44Å; M100-P104 HydrophobicContact CB-CG 4.28Å; M100-P104 WeakPolarHBondContact O-CD 3.5Å
101	G	77.3	Confident	83.1	Confident	37 Å²	37	26.5 Å²	26.5	38%	0.381	15%	0.15	S	C	.	.			trans	75.2	-176.7	-178.2	0	0	0	0	0	114.6	L98 C105	L98-G101 PolarHBondContact O-N 3.11Å; L98-G101 VanDerWaalsContact O-N 3.14Å; G101-C105 PolarHBondContact O-SG 3.28Å
102	S	75.1	Confident	82.9	Confident	63 Å²	63	26.5 Å²	26.5	44%	0.441	15%	0.15	S	C	.	.	H	α-helix	trans	-80.8	-28.6	-167.7	58.8	0	0	0	0	115	C105 A106	S102-C105 PolarHBondContact O-N 2.92Å; S102-A106 PolarHBondContact O-N 3.33Å; S102-A106 VanDerWaalsContact O-N 3.13Å
103	S	76.9	Confident	82.7	Confident	87 Å²	87	26.6 Å²	26.6	61%	0.608	15%	0.15	S	C	*	.	H	α-helix	trans	-65.6	-51.7	-174.4	174.9	0	0	0	0	112.9	C105 A106 R107	S103-C105 VanDerWaalsContact C-N 3.28Å; S103-C105 PolarHBondContact O-N 2.65Å; S103-A106 PolarHBondContact O-N 3.15Å; S103-R107 PolarHBondContact O-N 3.25Å
104	P	82.2	Confident	82.6	Confident	5 Å²	5	25.2 Å²	25.2	3%	0.032	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-35.3	175.9	-23.4	35.7	0	0	0	112.7	V61 M100 R107 V108	V61-P104 HydrophobicContact CG1-CG 3.82Å; V61-P104 HydrophobicContact CG2-CG 4.13Å; M100-P104 HydrophobicContact CB-CG 4.28Å; M100-P104 WeakPolarHBondContact O-CD 3.5Å; P104-R107 WeakPolarHBondContact O-CB 3.45Å; P104-R107 PolarHBondContact O-N 3.15Å; P104-V108 WeakPolarHBondContact O-CG2 3.41Å; P104-V108 PolarHBondContact O-N 2.81Å
105	C	80.8	Confident	82.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.5	-42.7	-178.5	-61.2	0	0	0	0	112.4	A95 L98 G101 S102 S103 R107 V108 L109	A95-C105 HydrophobicContact CB-CB 4.49Å; A95-C105 VanDerWaalsContact O-CB 3.31Å; A95-C105 WeakPolarHBondContact O-CB 3.11Å; A95-C105 PolarHBondContact O-SG 2.94Å; L98-C105 HydrophobicContact CD2-CB 3.89Å; L98-C105 VanDerWaalsContact CD2-SG 3.55Å; G101-C105 PolarHBondContact O-SG 3.28Å; S102-C105 PolarHBondContact O-N 2.92Å; S103-C105 VanDerWaalsContact C-N 3.28Å; S103-C105 PolarHBondContact O-N 2.65Å; C105-R107 VanDerWaalsContact C-N 3.27Å; C105-R107 PolarHBondContact O-N 3.32Å; C105-V108 PolarHBondContact O-N 3.42Å; C105-L109 WeakPolarHBondContact O-CG 3.21Å; C105-L109 PolarHBondContact O-N 3.12Å
106	A	80.9	Confident	82.1	Confident	27 Å²	27	28.5 Å²	28.5	22%	0.223	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-33	175	0	0	0	0	0	112.1	S102 S103 K110 L142	S102-A106 PolarHBondContact O-N 3.33Å; S102-A106 VanDerWaalsContact O-N 3.13Å; S103-A106 PolarHBondContact O-N 3.15Å; A106-K110 WeakPolarHBondContact O-CD 3.42Å; A106-K110 VanDerWaalsContact O-CG 3.23Å; A106-K110 WeakPolarHBondContact O-CG 3.33Å; A106-K110 PolarHBondContact O-N 2.89Å; A106-L142 HydrophobicContact CB-CD2 4.27Å
107	R	83.8	Confident	82	Confident	67 Å²	67	31.8 Å²	31.8	25%	0.253	19%	0.187	S	C	.	.	H	α-helix	trans	-67.9	-47.5	174.9	-173.8	173.7	175.2	-173.6	-0.8	111.3	E68 E75 S103 P104 C105 K110 C111	E68-R107 IonicContact OE1-CZ 3.85Å; E68-R107 VanDerWaalsContact OE1-CZ 3.3Å; E68-R107 IonicContact OE1-NH1 3.38Å; E68-R107 PolarHBondContact OE1-NH1 3.04Å; E68-R107 IonicContact OE1-NH2 2.74Å; E68-R107 PolarHBondContact OE1-NH2 3.37Å; E68-R107 IonicContact OE2-CZ 3.26Å; E68-R107 IonicContact OE2-NH1 3.93Å; E68-R107 PolarHBondContact OE2-NH1 3.25Å; E75-R107 WeakPolarHBondContact OE1-CD 3.4Å; E75-R107 WeakPolarHBondContact OE1-CG 3.15Å; E75-R107 IonicContact OE1-CZ 3.42Å; E75-R107 IonicContact OE1-NE 3.84Å; E75-R107 PolarHBondContact OE1-NE 3.41Å; E75-R107 IonicContact OE1-NH2 2.97Å; E75-R107 IonicContact OE2-CZ 2.77Å; E75-R107 IonicContact OE2-NE 3.63Å; E75-R107 PolarHBondContact OE2-NE 3.49Å; E75-R107 IonicContact OE2-NH2 2.75Å; E75-R107 PolarHBondContact OE2-NH2 2.98Å; S103-R107 PolarHBondContact O-N 3.25Å; P104-R107 WeakPolarHBondContact O-CB 3.45Å; P104-R107 PolarHBondContact O-N 3.15Å; C105-R107 VanDerWaalsContact C-N 3.27Å; C105-R107 PolarHBondContact O-N 3.32Å; R107-K110 PolarHBondContact O-N 3.4Å; R107-C111 PolarHBondContact O-N 3.35Å
108	V	86.3	Confident	82.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-45.9	177.1	174.4	0	0	0	0	112.1	L71 M91 F94 A95 P104 C105 K110 C111 L112	L71-V108 HydrophobicContact CD2-CG2 3.72Å; M91-V108 HydrophobicContact CB-CG1 4.03Å; M91-V108 HydrophobicContact CE-CB 4.34Å; M91-V108 HydrophobicContact CE-CG1 3.64Å; M91-V108 HydrophobicContact CE-CG2 3.68Å; F94-V108 HydrophobicContact CD1-CG2 4.22Å; F94-V108 HydrophobicContact CE1-CG2 4.16Å; A95-V108 HydrophobicContact CB-CB 4.14Å; A95-V108 HydrophobicContact CB-CG1 3.88Å; P104-V108 WeakPolarHBondContact O-CG2 3.41Å; P104-V108 PolarHBondContact O-N 2.81Å; C105-V108 PolarHBondContact O-N 3.42Å; V108-K110 PolarHBondContact O-N 3.3Å; V108-C111 CarbonylContact O-C 3.6Å; V108-C111 PolarHBondContact O-N 2.96Å; V108-C111 VanDerWaalsContact O-N 3.1Å; V108-C111 PolarHBondContact O-SG 3.14Å; V108-L112 HydrophobicContact CG1-CD1 3.91Å; V108-L112 HydrophobicContact CG1-CG 4.22Å; V108-L112 WeakPolarHBondContact O-CG 3.38Å; V108-L112 PolarHBondContact O-N 3.35Å
109	L	85.9	Confident	82.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-34.7	176.8	-74.1	171.2	0	0	0	112.7	L92 A95 C105 L112 T139 L142 F143 W248	L92-L109 HydrophobicContact CD1-CD2 4.08Å; A95-L109 HydrophobicContact CB-CD2 4.4Å; A95-L109 HydrophobicContact CB-CG 4.19Å; C105-L109 WeakPolarHBondContact O-CG 3.21Å; C105-L109 PolarHBondContact O-N 3.12Å; L109-L112 HydrophobicContact CD2-CD1 3.87Å; L109-T139 HydrophobicContact CD1-CG2 3.8Å; L109-L142 HydrophobicContact CB-CD2 3.61Å; L109-L142 HydrophobicContact CB-CG 4.13Å; L109-L142 HydrophobicContact CD1-CB 4.4Å; L109-L142 HydrophobicContact CD1-CD2 3.95Å; L109-L142 HydrophobicContact CD1-CG 4.36Å; L109-L142 HydrophobicContact CG-CD2 4.45Å; L109-F143 HydrophobicContact CD1-CB 4.34Å; L109-F143 HydrophobicContact CD2-CB 4.48Å; L109-F143 HydrophobicContact CD2-CD2 4.33Å; L109-W248 VanDerWaalsContact O-CZ2 3.25Å; L109-W248 WeakPolarHBondContact O-CZ2 3.36Å; L109-W248 PolarHBondContact O-NE1 2.9Å
110	K	83.8	Confident	83.4	Confident	129 Å²	129	29.5 Å²	29.5	56%	0.561	18%	0.181	S	C	*	.	H	α-helix	trans	-70.6	-31.4	177	-72.5	169.4	-174.5	178.1	0	113	A106 R107 V108 L142 W248	A106-K110 WeakPolarHBondContact O-CD 3.42Å; A106-K110 VanDerWaalsContact O-CG 3.23Å; A106-K110 WeakPolarHBondContact O-CG 3.33Å; A106-K110 PolarHBondContact O-N 2.89Å; R107-K110 PolarHBondContact O-N 3.4Å; V108-K110 PolarHBondContact O-N 3.3Å; K110-L142 HydrophobicContact CG-CD2 4.44Å; K110-W248 PolarHBondContact O-NE1 3.06Å; K110-W248 VanDerWaalsContact O-NE1 3.13Å
111	C	84.8	Confident	84.1	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.02	20%	0.197	C	C	.	.	H	α-helix	trans	-98	0.2	179.8	70.2	0	0	0	0	114.3	E75 A78 F79 R107 V108 L113	E75-C111 HydrophobicContact CG-CB 3.97Å; A78-C111 HydrophobicContact CB-CB 4.5Å; A78-C111 WeakPolarHBondContact CB-O 3.38Å; F79-C111 HydrophobicContact CE2-CB 4.02Å; F79-C111 HydrophobicContact CZ-CB 4.3Å; R107-C111 PolarHBondContact O-N 3.35Å; V108-C111 CarbonylContact O-C 3.6Å; V108-C111 PolarHBondContact O-N 2.96Å; V108-C111 VanDerWaalsContact O-N 3.1Å; V108-C111 PolarHBondContact O-SG 3.14Å; C111-L113 VanDerWaalsContact C-N 3.3Å; C111-L113 PolarHBondContact O-N 3.04Å
112	L	86.6	Confident	84.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.			trans	-67.7	80.2	175.8	-94.9	159	0	0	0	111.9	L83 I88 M91 L92 V108 L109 W146	L83-L112 HydrophobicContact CD1-CD2 4.14Å; I88-L112 HydrophobicContact CB-CD2 4.42Å; I88-L112 HydrophobicContact CG1-CD2 4.41Å; I88-L112 HydrophobicContact CG2-CD2 4.11Å; M91-L112 HydrophobicContact CB-CD2 4.18Å; L92-L112 HydrophobicContact CD1-CD1 4Å; V108-L112 HydrophobicContact CG1-CD1 3.91Å; V108-L112 HydrophobicContact CG1-CG 4.22Å; V108-L112 WeakPolarHBondContact O-CG 3.38Å; V108-L112 PolarHBondContact O-N 3.35Å; L109-L112 HydrophobicContact CD2-CD1 3.87Å; L112-W146 HydrophobicContact CB-CZ2 4.33Å; L112-W146 HydrophobicContact CD2-CZ2 4.47Å; L112-W146 PolarHBondContact O-NE1 3.15Å
113	L	86.3	Confident	85.4	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	16%	0.159	C	C	.	.			trans	-107.3	112.1	179.7	-64.7	173.3	0	0	0	110.2	F79 G82 L83 C111 A251 V255	F79-L113 HydrophobicContact CD1-CD1 3.61Å; F79-L113 HydrophobicContact CE1-CD1 3.77Å; F79-L113 HydrophobicContact CG-CD1 4.4Å; G82-L113 CarbonylContact C-O 3.34Å; G82-L113 WeakPolarHBondContact CA-O 3.36Å; L83-L113 PolarHBondContact N-O 3.37Å; C111-L113 VanDerWaalsContact C-N 3.3Å; C111-L113 PolarHBondContact O-N 3.04Å; L113-A251 HydrophobicContact CD1-CB 3.89Å; L113-A251 HydrophobicContact CD2-CB 3.91Å; L113-V255 HydrophobicContact CD1-CG2 4.33Å
114	P	86.4	Confident	86.1	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-68.7	137.6	178.2	23.5	-32.1	0	0	0	113.3	I88 V118 V150 M153 L252	I88-P114 HydrophobicContact CD1-CB 3.53Å; P114-V118 HydrophobicContact CB-CG2 3.81Å; P114-V118 HydrophobicContact CG-CG2 4.03Å; P114-V150 HydrophobicContact CG-CB 4.48Å; P114-V150 HydrophobicContact CG-CG1 3.88Å; P114-M153 HydrophobicContact CB-CE 3.67Å; P114-M153 HydrophobicContact CB-SD 4.39Å; P114-M153 HydrophobicContact CG-CE 3.52Å; P114-M153 HydrophobicContact CG-SD 3.61Å; P114-L252 HydrophobicContact CG-CD1 3.81Å
115	A	83.7	Confident	86.4	Confident	21 Å²	21	30.1 Å²	30.1	17%	0.174	15%	0.154	C	C	.	.	S	Bend	trans	-79.3	-35.9	170.5	0	0	0	0	0	112.7	R81 L83	R81-A115 WeakPolarHBondContact O-CB 3.37Å; L83-A115 VanDerWaalsContact O-CB 3.32Å; L83-A115 WeakPolarHBondContact O-CB 3.43Å; L83-A115 PolarHBondContact O-N 2.91Å
116	S	81.1	Confident	86.8	Confident	50 Å²	50	30.1 Å²	30.1	35%	0.35	16%	0.155	S	C	.	.	S	Bend	trans	-138.9	-92.7	-175.7	57.9	0	0	0	0	112.7	M153	S116-M153 WeakPolarHBondContact O-CE 2.94Å
117	V	85.4	Confident	87.1	Confident	69 Å²	69	29.1 Å²	29.1	42%	0.418	15%	0.145	S	C	.	.			trans	-112.9	149.8	-178.3	-64.6	0	0	0	0	111	P85 M153 D155	P85-V117 HydrophobicContact CG-CG2 3.93Å; V117-M153 CarbonylContact C-O 3.57Å; V117-M153 WeakPolarHBondContact CA-O 3.5Å; V117-D155 HydrophobicContact CB-CB 4.46Å
118	V	88.2	Confident	87.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-102	119.5	174	178.3	0	0	0	0	108.2	I88 P114 Q120 V123 W146 V150 M153 I154 D155	I88-V118 HydrophobicContact CD1-CG2 4.11Å; I88-V118 HydrophobicContact CG2-CG1 4.32Å; P114-V118 HydrophobicContact CB-CG2 3.81Å; P114-V118 HydrophobicContact CG-CG2 4.03Å; V118-Q120 PolarHBondContact O-N 2.8Å; V118-V123 HydrophobicContact CG1-CG2 3.75Å; V118-W146 HydrophobicContact CG1-CH2 3.98Å; V118-V150 HydrophobicContact CG2-CB 4.23Å; V118-V150 HydrophobicContact CG2-CG2 4.24Å; V118-M153 HydrophobicContact CG2-CB 4.28Å; V118-M153 PolarHBondContact N-O 3.35Å; V118-I154 HydrophobicContact CB-CG1 4.39Å; V118-I154 WeakPolarHBondContact O-CA 3.15Å; V118-D155 PolarHBondContact O-N 2.76Å; V118-D155 VanDerWaalsContact O-N 3.08Å
119	P	88.8	Confident	87.2	Confident	25 Å²	25	32.1 Å²	32.1	16%	0.162	16%	0.164	C	C	.	.			trans	-64	128.6	178	-23.6	34.1	0	0	0	112.4	P85 E121 A122 V123	P85-P119 HydrophobicContact CB-CG 3.71Å; P119-E121 PolarHBondContact O-N 3.46Å; P119-A122 HydrophobicContact CB-CB 4.38Å; P119-A122 WeakPolarHBondContact O-CB 3.49Å; P119-A122 PolarHBondContact O-N 3.26Å; P119-A122 VanDerWaalsContact O-N 3.09Å; P119-V123 PolarHBondContact O-N 2.73Å
120	Q	91.4	Very high	87.1	Confident	27 Å²	27	32.4 Å²	32.4	13%	0.126	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-34.7	178.6	66.8	174.6	-17.8	0	0	112.4	V118 A122 V123 V124 I154 D155 A156	V118-Q120 PolarHBondContact O-N 2.8Å; Q120-A122 VanDerWaalsContact C-N 3.25Å; Q120-A122 PolarHBondContact O-N 2.91Å; Q120-V123 PolarHBondContact O-N 2.94Å; Q120-V124 WeakPolarHBondContact O-CG2 3.35Å; Q120-V124 PolarHBondContact O-N 3.46Å; Q120-I154 HydrophobicContact CB-CG2 4.03Å; Q120-D155 VanDerWaalsContact CB-OD1 3.28Å; Q120-D155 WeakPolarHBondContact CB-OD1 3.48Å; Q120-D155 PolarHBondContact N-OD1 2.79Å; Q120-A156 VanDerWaalsContact CB-O 3.29Å; Q120-A156 WeakPolarHBondContact CB-O 3.25Å; Q120-A156 HydrophobicContact CG-CB 4.43Å; Q120-A156 PolarHBondContact OE1-O 3.23Å
121	E	89.4	Confident	86.9	Confident	78 Å²	78	29.5 Å²	29.5	36%	0.364	16%	0.159	S	C	.	.	H	α-helix	trans	-60.1	-37.4	178.1	-56.3	-47.6	132.7	0	0	111.9	P119 V124 R125 K159	P119-E121 PolarHBondContact O-N 3.46Å; E121-V124 PolarHBondContact O-N 3.3Å; E121-R125 WeakPolarHBondContact O-CB 3.05Å; E121-R125 WeakPolarHBondContact O-CG 3.32Å; E121-R125 PolarHBondContact O-N 3.42Å; E121-K159 WeakPolarHBondContact OE1-CD 3.43Å; E121-K159 WeakPolarHBondContact OE1-CE 3.36Å; E121-K159 IonicContact OE1-NZ 2.6Å; E121-K159 PolarHBondContact OE1-NZ 2.94Å; E121-K159 IonicContact OE2-NZ 2.91Å; E121-K159 PolarHBondContact OE2-NZ 3.19Å
122	A	89.9	Confident	86.3	Confident	3 Å²	3	34.1 Å²	34.1	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-43	179.8	0	0	0	0	0	110.7	L92 P119 Q120 R125 A126	L92-A122 HydrophobicContact CD2-CB 4.19Å; P119-A122 HydrophobicContact CB-CB 4.38Å; P119-A122 WeakPolarHBondContact O-CB 3.49Å; P119-A122 PolarHBondContact O-N 3.26Å; P119-A122 VanDerWaalsContact O-N 3.09Å; Q120-A122 VanDerWaalsContact C-N 3.25Å; Q120-A122 PolarHBondContact O-N 2.91Å; A122-R125 PolarHBondContact O-N 3.42Å; A122-A126 WeakPolarHBondContact O-CB 3.26Å; A122-A126 PolarHBondContact O-N 3.01Å
123	V	91.3	Very high	85.2	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-66.9	-41.3	177.2	-176.6	0	0	0	0	111.1	V118 P119 Q120 A126 I127 W146 V147 I154 L160	V118-V123 HydrophobicContact CG1-CG2 3.75Å; P119-V123 PolarHBondContact O-N 2.73Å; Q120-V123 PolarHBondContact O-N 2.94Å; V123-A126 WeakPolarHBondContact O-CB 3.35Å; V123-A126 PolarHBondContact O-N 3.35Å; V123-I127 HydrophobicContact CG1-CD1 4.08Å; V123-I127 WeakPolarHBondContact O-CG1 3.21Å; V123-I127 PolarHBondContact O-N 3.41Å; V123-W146 HydrophobicContact CG2-CZ3 4.46Å; V123-V147 HydrophobicContact CG1-CG1 4.29Å; V123-V147 HydrophobicContact CG1-CG2 4.13Å; V123-I154 HydrophobicContact CG2-CD1 4.3Å; V123-L160 HydrophobicContact CG1-CD1 4.34Å
124	V	90.7	Very high	84.4	Confident	22 Å²	22	49.5 Å²	49.5	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-47.2	176.8	169.7	0	0	0	0	110.9	Q120 E121 A126 I127 V128 K159 I163	Q120-V124 WeakPolarHBondContact O-CG2 3.35Å; Q120-V124 PolarHBondContact O-N 3.46Å; E121-V124 PolarHBondContact O-N 3.3Å; V124-A126 VanDerWaalsContact C-N 3.3Å; V124-A126 PolarHBondContact O-N 3.47Å; V124-I127 PolarHBondContact O-N 3.26Å; V124-I127 VanDerWaalsContact O-N 3.14Å; V124-V128 WeakPolarHBondContact O-CG2 3.38Å; V124-V128 PolarHBondContact O-N 3.49Å; V124-K159 HydrophobicContact CG2-CB 4.08Å; V124-I163 HydrophobicContact CG1-CD1 4.27Å; V124-I163 HydrophobicContact CG2-CD1 4.15Å
125	R	88.7	Confident	84.1	Confident	107 Å²	107	49.9 Å²	49.9	40%	0.404	25%	0.253	S	S	.	.	H	α-helix	trans	-58.6	-41.6	174.8	-76.7	-167.7	-69.5	156.3	-15.2	112.3	S89 D93 E121 A122 I127 V128 W129	S89-R125 PolarHBondContact OG-NH2 2.89Å; D93-R125 IonicContact OD1-NH1 3.74Å; E121-R125 WeakPolarHBondContact O-CB 3.05Å; E121-R125 WeakPolarHBondContact O-CG 3.32Å; E121-R125 PolarHBondContact O-N 3.42Å; A122-R125 PolarHBondContact O-N 3.42Å; R125-I127 PolarHBondContact O-N 3.33Å; R125-V128 WeakPolarHBondContact O-CB 3.26Å; R125-V128 PolarHBondContact O-N 3.05Å; R125-W129 PolarHBondContact O-N 2.98Å
126	A	88.8	Confident	84.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-39.9	175.2	0	0	0	0	0	113	L92 M96 A122 V123 V124 V128 W129 L130 F143	L92-A126 HydrophobicContact CD1-CB 4.35Å; L92-A126 HydrophobicContact CD2-CB 3.86Å; L92-A126 HydrophobicContact CG-CB 3.91Å; M96-A126 HydrophobicContact CB-CB 4.44Å; M96-A126 WeakPolarHBondContact CE-O 3.42Å; M96-A126 HydrophobicContact CG-CB 3.77Å; A122-A126 WeakPolarHBondContact O-CB 3.26Å; A122-A126 PolarHBondContact O-N 3.01Å; V123-A126 WeakPolarHBondContact O-CB 3.35Å; V123-A126 PolarHBondContact O-N 3.35Å; V124-A126 VanDerWaalsContact C-N 3.3Å; V124-A126 PolarHBondContact O-N 3.47Å; A126-V128 VanDerWaalsContact C-N 3.34Å; A126-W129 WeakPolarHBondContact O-CB 3.31Å; A126-W129 PolarHBondContact O-N 2.94Å; A126-L130 PolarHBondContact O-N 2.92Å; A126-L130 VanDerWaalsContact O-N 3.14Å; A126-F143 HydrophobicContact CB-CD2 4.5Å; A126-F143 HydrophobicContact CB-CE1 4.31Å; A126-F143 HydrophobicContact CB-CE2 3.52Å; A126-F143 HydrophobicContact CB-CZ 3.39Å
127	I	88.8	Confident	84.2	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-36	174.2	-66.9	164.5	0	0	0	110.9	V123 V124 R125 W129 L130 T131 F143 L160 I163 I167	V123-I127 HydrophobicContact CG1-CD1 4.08Å; V123-I127 WeakPolarHBondContact O-CG1 3.21Å; V123-I127 PolarHBondContact O-N 3.41Å; V124-I127 PolarHBondContact O-N 3.26Å; V124-I127 VanDerWaalsContact O-N 3.14Å; R125-I127 PolarHBondContact O-N 3.33Å; I127-W129 VanDerWaalsContact C-N 3.35Å; I127-W129 PolarHBondContact O-N 3.1Å; I127-L130 WeakPolarHBondContact O-CB 3.26Å; I127-L130 PolarHBondContact O-N 3.18Å; I127-L130 VanDerWaalsContact O-N 3.15Å; I127-T131 PolarHBondContact O-N 3.1Å; I127-F143 HydrophobicContact CG1-CE1 3.96Å; I127-F143 HydrophobicContact CG1-CZ 4.08Å; I127-L160 HydrophobicContact CD1-CD1 3.35Å; I127-I163 HydrophobicContact CB-CD1 4.09Å; I127-I163 HydrophobicContact CD1-CD1 3.85Å; I127-I163 HydrophobicContact CG2-CD1 3.87Å; I127-I167 HydrophobicContact CD1-CD1 4.18Å; I127-I167 HydrophobicContact CD1-CG1 4.43Å; I127-I167 HydrophobicContact CG2-CG1 4.4Å
128	V	86	Confident	84.1	Confident	73 Å²	73	52.5 Å²	52.5	44%	0.442	27%	0.269	S	S	.	.	H	α-helix	trans	-61.2	-44.8	172.9	174	0	0	0	0	110.5	V124 R125 A126 L130 T131 V132	V124-V128 WeakPolarHBondContact O-CG2 3.38Å; V124-V128 PolarHBondContact O-N 3.49Å; R125-V128 WeakPolarHBondContact O-CB 3.26Å; R125-V128 PolarHBondContact O-N 3.05Å; A126-V128 VanDerWaalsContact C-N 3.34Å; V128-L130 PolarHBondContact O-N 3.12Å; V128-T131 PolarHBondContact O-N 3.39Å; V128-T131 PolarHBondContact O-OG1 3.45Å; V128-V132 HydrophobicContact CG1-CG2 4.17Å; V128-V132 WeakPolarHBondContact O-CG2 3.07Å; V128-V132 PolarHBondContact O-N 2.85Å; V128-V132 VanDerWaalsContact O-N 3.15Å
129	W	84.9	Confident	83.9	Confident	57 Å²	57	52.6 Å²	52.6	22%	0.216	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-35.9	174	-75.8	119.4	0	0	0	113.2	D93 M96 R125 A126 I127 T131 V132 R133 L135	D93-W129 PolarHBondContact OD1-NE1 3.19Å; M96-W129 HydrophobicContact CB-CB 3.85Å; M96-W129 HydrophobicContact CB-CG 4.07Å; R125-W129 PolarHBondContact O-N 2.98Å; A126-W129 WeakPolarHBondContact O-CB 3.31Å; A126-W129 PolarHBondContact O-N 2.94Å; I127-W129 VanDerWaalsContact C-N 3.35Å; I127-W129 PolarHBondContact O-N 3.1Å; W129-T131 PolarHBondContact O-N 3.08Å; W129-V132 PolarHBondContact O-N 3.38Å; W129-R133 PolarHBondContact O-N 2.85Å; W129-L135 WeakPolarHBondContact O-CD1 3.45Å
130	L	84.6	Confident	83.8	Confident	7 Å²	7	52.3 Å²	52.3	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-32.8	173.8	-159.1	83	0	0	0	112.6	M96 A126 I127 V128 Q140 F143 I144 F170	M96-L130 HydrophobicContact CE-CD1 4.16Å; A126-L130 PolarHBondContact O-N 2.92Å; A126-L130 VanDerWaalsContact O-N 3.14Å; I127-L130 WeakPolarHBondContact O-CB 3.26Å; I127-L130 PolarHBondContact O-N 3.18Å; I127-L130 VanDerWaalsContact O-N 3.15Å; V128-L130 PolarHBondContact O-N 3.12Å; L130-Q140 HydrophobicContact CD1-CB 3.83Å; L130-Q140 HydrophobicContact CD1-CG 3.61Å; L130-F143 HydrophobicContact CD1-CD1 4.37Å; L130-I144 HydrophobicContact CD2-CD1 4.38Å; L130-F170 HydrophobicContact CB-CZ 4.18Å; L130-F170 HydrophobicContact CD2-CD1 4.15Å; L130-F170 HydrophobicContact CD2-CD2 4.11Å; L130-F170 HydrophobicContact CD2-CE1 3.74Å; L130-F170 HydrophobicContact CD2-CE2 3.71Å; L130-F170 HydrophobicContact CD2-CG 4.32Å; L130-F170 HydrophobicContact CD2-CZ 3.49Å; L130-F170 VanDerWaalsContact CD2-CZ 3.49Å; L130-F170 HydrophobicContact CG-CE1 4.03Å; L130-F170 HydrophobicContact CG-CZ 3.86Å
131	T	78.1	Confident	83.5	Confident	68 Å²	68	52 Å²	52	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-84.3	-28.1	-179.5	62.6	0	0	0	0	113.9	I127 V128 W129 F170	I127-T131 PolarHBondContact O-N 3.1Å; V128-T131 PolarHBondContact O-N 3.39Å; V128-T131 PolarHBondContact O-OG1 3.45Å; W129-T131 PolarHBondContact O-N 3.08Å; T131-F170 HydrophobicContact CG2-CE2 3.84Å; T131-F170 HydrophobicContact CG2-CZ 3.58Å
132	V	72.4	Confident	83.3	Confident	100 Å²	100	49.9 Å²	49.9	61%	0.606	26%	0.257	S	S	*	.	H	α-helix	trans	-91.1	-31.7	-170.2	176.2	0	0	0	0	112.9	V128 W129	V128-V132 HydrophobicContact CG1-CG2 4.17Å; V128-V132 WeakPolarHBondContact O-CG2 3.07Å; V128-V132 PolarHBondContact O-N 2.85Å; V128-V132 VanDerWaalsContact O-N 3.15Å; W129-V132 PolarHBondContact O-N 3.38Å
133	R	65.1	Low	83.3	Confident	113 Å²	113	49.7 Å²	49.7	43%	0.426	26%	0.256	S	S	.	.	S	Bend	trans	-121.4	148.8	-174.5	-72.5	-173	178.8	-168.5	-3.1	112.4	S97 W129 L135	S97-R133 PolarHBondContact O-NH1 3.34Å; W129-R133 PolarHBondContact O-N 2.85Å; R133-L135 VanDerWaalsContact C-N 3.25Å; R133-L135 HydrophobicContact CB-CD1 3.87Å; R133-L135 WeakPolarHBondContact O-CD1 3.29Å; R133-L135 PolarHBondContact O-N 2.93Å
134	K	69.3	Low	83.2	Confident	212 Å²	212	49.8 Å²	49.8	92%	0.922	26%	0.257	S	S	*	.			trans	-72.2	79.4	168.2	-69.5	-175.5	-179.9	179.8	0	109.8
135	L	79.5	Confident	82.9	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.042	26%	0.262	C	S	.	.			trans	-69.4	146.2	170	-81.2	80.5	0	0	0	109.9	M96 L98 W129 R133 T137 T139 Q140	M96-L135 HydrophobicContact CE-CD2 3.78Å; M96-L135 HydrophobicContact SD-CD2 4.26Å; L98-L135 HydrophobicContact CD1-CB 4.36Å; L98-L135 HydrophobicContact CD1-CD1 4.49Å; L98-L135 HydrophobicContact CD1-CG 3.74Å; L98-L135 HydrophobicContact CG-CG 4.18Å; W129-L135 WeakPolarHBondContact O-CD1 3.45Å; R133-L135 VanDerWaalsContact C-N 3.25Å; R133-L135 HydrophobicContact CB-CD1 3.87Å; R133-L135 WeakPolarHBondContact O-CD1 3.29Å; R133-L135 PolarHBondContact O-N 2.93Å; L135-T137 PolarHBondContact O-N 2.99Å; L135-T139 HydrophobicContact CD2-CG2 4.2Å; L135-Q140 HydrophobicContact CB-CG 3.65Å; L135-Q140 PolarHBondContact O-NE2 3.14Å
136	P	83.3	Confident	82.9	Confident	47 Å²	47	46.3 Å²	46.3	31%	0.305	24%	0.242	S	C	.	.			trans	-56.4	134.6	168.3	-22.6	32.9	0	0	0	110.8	S138 T139 Q140	P136-S138 PolarHBondContact O-N 2.86Å; P136-S138 VanDerWaalsContact O-N 3.1Å; P136-T139 WeakPolarHBondContact O-CB 3.34Å; P136-T139 PolarHBondContact O-N 3.41Å; P136-Q140 PolarHBondContact O-N 3.07Å; P136-Q140 VanDerWaalsContact O-N 3.13Å
137	T	83.3	Confident	82.8	Confident	59 Å²	59	46.2 Å²	46.2	36%	0.362	24%	0.242	S	C	.	.	H	α-helix	trans	-54.1	-34.5	-178.5	-49.9	0	0	0	0	112.4	L135 T139 Q140 V141 N175	L135-T137 PolarHBondContact O-N 2.99Å; T137-T139 PolarHBondContact O-N 3.43Å; T137-Q140 PolarHBondContact O-N 3.46Å; T137-V141 HydrophobicContact CG2-CG2 4.44Å; T137-V141 VanDerWaalsContact O-CG2 3.32Å; T137-V141 WeakPolarHBondContact O-CG2 3.38Å; T137-V141 PolarHBondContact O-N 3.46Å; T137-N175 HydrophobicContact CG2-CB 3.5Å
138	S	82.7	Confident	82.7	Confident	89 Å²	89	46.5 Å²	46.5	62%	0.622	24%	0.243	S	C	*	.	H	α-helix	trans	-60.6	-42	175.4	54.4	0	0	0	0	112.9	P136 L142	P136-S138 PolarHBondContact O-N 2.86Å; P136-S138 VanDerWaalsContact O-N 3.1Å; S138-L142 VanDerWaalsContact O-CB 3.32Å; S138-L142 WeakPolarHBondContact O-CB 3.32Å; S138-L142 PolarHBondContact O-N 3.14Å
139	T	84.4	Confident	82.5	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-69.9	-40.7	176.9	-53.7	0	0	0	0	111.2	L109 L135 P136 T137 L142 F143	L109-T139 HydrophobicContact CD1-CG2 3.8Å; L135-T139 HydrophobicContact CD2-CG2 4.2Å; P136-T139 WeakPolarHBondContact O-CB 3.34Å; P136-T139 PolarHBondContact O-N 3.41Å; T137-T139 PolarHBondContact O-N 3.43Å; T139-L142 WeakPolarHBondContact O-CB 3.37Å; T139-L142 PolarHBondContact O-N 3.2Å; T139-F143 WeakPolarHBondContact O-CB 3.41Å; T139-F143 PolarHBondContact O-N 2.94Å
140	Q	86.9	Confident	82.5	Confident	18 Å²	18	41 Å²	41	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-48.1	176.4	-60.6	179.7	-19.9	0	0	111.4	L130 L135 P136 T137 L142 F143 I144 L176	L130-Q140 HydrophobicContact CD1-CB 3.83Å; L130-Q140 HydrophobicContact CD1-CG 3.61Å; L135-Q140 HydrophobicContact CB-CG 3.65Å; L135-Q140 PolarHBondContact O-NE2 3.14Å; P136-Q140 PolarHBondContact O-N 3.07Å; P136-Q140 VanDerWaalsContact O-N 3.13Å; T137-Q140 PolarHBondContact O-N 3.46Å; Q140-L142 VanDerWaalsContact C-N 3.32Å; Q140-L142 PolarHBondContact O-N 3.05Å; Q140-F143 PolarHBondContact O-N 3.44Å; Q140-I144 WeakPolarHBondContact O-CG1 3.41Å; Q140-I144 PolarHBondContact O-N 3.44Å; Q140-L176 HydrophobicContact CB-CD1 4.39Å; Q140-L176 HydrophobicContact CB-CD2 3.83Å
141	V	86.3	Confident	82.5	Confident	22 Å²	22	41.1 Å²	41.1	13%	0.133	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-41.8	175.7	170.1	0	0	0	0	111.1	T137 I144 K145 L176 F179	T137-V141 HydrophobicContact CG2-CG2 4.44Å; T137-V141 VanDerWaalsContact O-CG2 3.32Å; T137-V141 WeakPolarHBondContact O-CG2 3.38Å; T137-V141 PolarHBondContact O-N 3.46Å; V141-I144 PolarHBondContact O-N 2.89Å; V141-K145 HydrophobicContact CG1-CD 4Å; V141-K145 VanDerWaalsContact CG1-CE 3.5Å; V141-K145 HydrophobicContact CG1-CG 4.45Å; V141-K145 WeakPolarHBondContact O-CB 3.45Å; V141-K145 VanDerWaalsContact O-CG 3.28Å; V141-K145 WeakPolarHBondContact O-CG 3.33Å; V141-K145 PolarHBondContact O-N 3.45Å; V141-L176 HydrophobicContact CG2-CD2 3.74Å; V141-F179 HydrophobicContact CG1-CD2 4.11Å; V141-F179 HydrophobicContact CG1-CE2 3.58Å; V141-F179 HydrophobicContact CG1-CZ 3.89Å; V141-F179 HydrophobicContact CG2-CD2 4.41Å; V141-F179 HydrophobicContact CG2-CE2 4.21Å
142	L	84.9	Confident	82.6	Confident	32 Å²	32	40.9 Å²	40.9	17%	0.168	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-43.7	178.7	-166.8	73.4	0	0	0	111.4	A106 L109 K110 S138 T139 Q140 W146 W248	A106-L142 HydrophobicContact CB-CD2 4.27Å; L109-L142 HydrophobicContact CB-CD2 3.61Å; L109-L142 HydrophobicContact CB-CG 4.13Å; L109-L142 HydrophobicContact CD1-CB 4.4Å; L109-L142 HydrophobicContact CD1-CD2 3.95Å; L109-L142 HydrophobicContact CD1-CG 4.36Å; L109-L142 HydrophobicContact CG-CD2 4.45Å; K110-L142 HydrophobicContact CG-CD2 4.44Å; S138-L142 VanDerWaalsContact O-CB 3.32Å; S138-L142 WeakPolarHBondContact O-CB 3.32Å; S138-L142 PolarHBondContact O-N 3.14Å; T139-L142 WeakPolarHBondContact O-CB 3.37Å; T139-L142 PolarHBondContact O-N 3.2Å; Q140-L142 VanDerWaalsContact C-N 3.32Å; Q140-L142 PolarHBondContact O-N 3.05Å; L142-W146 PolarHBondContact O-N 3.33Å; L142-W248 HydrophobicContact CD1-CH2 3.35Å; L142-W248 HydrophobicContact CD1-CZ2 4.05Å; L142-W248 HydrophobicContact CD1-CZ3 4.24Å; L142-W248 HydrophobicContact CG-CH2 3.78Å; L142-W248 HydrophobicContact CG-CZ2 4.27Å
143	F	89	Confident	83	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-49.7	176.5	168.8	-112.5	0	0	0	112.3	L92 M96 L109 A126 I127 L130 T139 Q140 K145 W146 V147	L92-F143 HydrophobicContact CD1-CD2 4.1Å; L92-F143 HydrophobicContact CD1-CE2 3.96Å; L92-F143 HydrophobicContact CD2-CE2 4.48Å; M96-F143 HydrophobicContact CE-CB 4.23Å; M96-F143 HydrophobicContact CE-CD1 3.69Å; M96-F143 HydrophobicContact CE-CD2 4.2Å; M96-F143 HydrophobicContact CE-CE1 4.08Å; M96-F143 HydrophobicContact CE-CG 3.76Å; M96-F143 HydrophobicContact SD-CB 3.95Å; M96-F143 HydrophobicContact SD-CD1 4.31Å; M96-F143 HydrophobicContact SD-CD2 3.81Å; M96-F143 HydrophobicContact SD-CE2 4.44Å; M96-F143 HydrophobicContact SD-CG 3.74Å; L109-F143 HydrophobicContact CD1-CB 4.34Å; L109-F143 HydrophobicContact CD2-CB 4.48Å; L109-F143 HydrophobicContact CD2-CD2 4.33Å; A126-F143 HydrophobicContact CB-CD2 4.5Å; A126-F143 HydrophobicContact CB-CE1 4.31Å; A126-F143 HydrophobicContact CB-CE2 3.52Å; A126-F143 HydrophobicContact CB-CZ 3.39Å; I127-F143 HydrophobicContact CG1-CE1 3.96Å; I127-F143 HydrophobicContact CG1-CZ 4.08Å; L130-F143 HydrophobicContact CD1-CD1 4.37Å; T139-F143 WeakPolarHBondContact O-CB 3.41Å; T139-F143 PolarHBondContact O-N 2.94Å; Q140-F143 PolarHBondContact O-N 3.44Å; F143-K145 VanDerWaalsContact C-N 3.3Å; F143-K145 PolarHBondContact O-N 3.24Å; F143-W146 HydrophobicContact CD2-CE3 4.28Å; F143-W146 HydrophobicContact CE2-CE3 4.19Å; F143-W146 HydrophobicContact CE2-CZ3 4.32Å; F143-W146 WeakPolarHBondContact O-CA 3.22Å; F143-W146 WeakPolarHBondContact O-CB 3.24Å; F143-W146 PolarHBondContact O-N 3.15Å; F143-V147 HydrophobicContact CD2-CG2 4.13Å; F143-V147 HydrophobicContact CE1-CG2 4.14Å; F143-V147 HydrophobicContact CE2-CG2 3.56Å; F143-V147 HydrophobicContact CZ-CG2 3.58Å; F143-V147 WeakPolarHBondContact O-CG2 3.48Å; F143-V147 PolarHBondContact O-N 3.43Å
144	I	88.6	Confident	83.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-179.8	-57.5	-60.9	0	0	0	111.2	L130 Q140 V141 W146 V147 L148 F179 I180	L130-I144 HydrophobicContact CD2-CD1 4.38Å; Q140-I144 WeakPolarHBondContact O-CG1 3.41Å; Q140-I144 PolarHBondContact O-N 3.44Å; V141-I144 PolarHBondContact O-N 2.89Å; I144-W146 VanDerWaalsContact C-N 3.32Å; I144-W146 PolarHBondContact O-N 2.89Å; I144-V147 PolarHBondContact O-N 3.25Å; I144-L148 HydrophobicContact CG2-CD1 4.28Å; I144-L148 HydrophobicContact CG2-CG 4.49Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.78Å; I144-F179 HydrophobicContact CB-CB 4.22Å; I144-F179 HydrophobicContact CG2-CB 3.55Å; I144-I180 HydrophobicContact CD1-CD1 3.93Å; I144-I180 HydrophobicContact CG1-CD1 4.11Å; I144-I180 HydrophobicContact CG2-CD1 4.33Å
145	K	84.7	Confident	84.5	Confident	55 Å²	55	26 Å²	26	24%	0.239	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-40.8	172	-76	174.9	-179.6	173.8	0	112.1	V141 F143 L148 T149 F179 H244 W248	V141-K145 HydrophobicContact CG1-CD 4Å; V141-K145 VanDerWaalsContact CG1-CE 3.5Å; V141-K145 HydrophobicContact CG1-CG 4.45Å; V141-K145 WeakPolarHBondContact O-CB 3.45Å; V141-K145 VanDerWaalsContact O-CG 3.28Å; V141-K145 WeakPolarHBondContact O-CG 3.33Å; V141-K145 PolarHBondContact O-N 3.45Å; F143-K145 VanDerWaalsContact C-N 3.3Å; F143-K145 PolarHBondContact O-N 3.24Å; K145-L148 PolarHBondContact O-N 3.31Å; K145-T149 PolarHBondContact O-N 3.36Å; K145-T149 PolarHBondContact O-OG1 3.33Å; K145-F179 HydrophobicContact CD-CE1 4.08Å; K145-F179 HydrophobicContact CD-CZ 4.45Å; K145-F179 HydrophobicContact CG-CD1 3.83Å; K145-F179 HydrophobicContact CG-CE1 3.74Å; K145-F179 HydrophobicContact CG-CZ 4.46Å; K145-H244 HydrophobicContact CD-CB 4.38Å; K145-H244 HydrophobicContact CG-CB 4.4Å; K145-W248 HydrophobicContact CB-CZ3 4.08Å
146	W	88.4	Confident	84.6	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-49.1	174.7	176.4	84.7	0	0	0	111	I88 L92 L112 V118 V123 L142 F143 I144 L148 T149 V150 W248	I88-W146 HydrophobicContact CG2-CH2 4.22Å; I88-W146 HydrophobicContact CG2-CZ2 4.35Å; L92-W146 HydrophobicContact CD1-CE3 4.45Å; L92-W146 HydrophobicContact CD1-CH2 4.46Å; L92-W146 HydrophobicContact CD1-CZ3 4.11Å; L92-W146 HydrophobicContact CD2-CH2 3.99Å; L92-W146 HydrophobicContact CD2-CZ3 3.85Å; L112-W146 HydrophobicContact CB-CZ2 4.33Å; L112-W146 HydrophobicContact CD2-CZ2 4.47Å; L112-W146 PolarHBondContact O-NE1 3.15Å; V118-W146 HydrophobicContact CG1-CH2 3.98Å; V123-W146 HydrophobicContact CG2-CZ3 4.46Å; L142-W146 PolarHBondContact O-N 3.33Å; F143-W146 HydrophobicContact CD2-CE3 4.28Å; F143-W146 HydrophobicContact CE2-CE3 4.19Å; F143-W146 HydrophobicContact CE2-CZ3 4.32Å; F143-W146 WeakPolarHBondContact O-CA 3.22Å; F143-W146 WeakPolarHBondContact O-CB 3.24Å; F143-W146 PolarHBondContact O-N 3.15Å; I144-W146 VanDerWaalsContact C-N 3.32Å; I144-W146 PolarHBondContact O-N 2.89Å; W146-L148 VanDerWaalsContact C-N 3.32Å; W146-L148 PolarHBondContact O-N 3.05Å; W146-T149 WeakPolarHBondContact O-CA 3.39Å; W146-T149 VanDerWaalsContact O-CB 3.29Å; W146-T149 WeakPolarHBondContact O-CB 3.39Å; W146-T149 PolarHBondContact O-N 3.21Å; W146-V150 HydrophobicContact CD2-CG2 4.12Å; W146-V150 HydrophobicContact CE3-CG2 4.14Å; W146-V150 HydrophobicContact CH2-CG2 3.92Å; W146-V150 HydrophobicContact CZ2-CG1 4.28Å; W146-V150 HydrophobicContact CZ2-CG2 3.89Å; W146-V150 HydrophobicContact CZ3-CG2 4.04Å; W146-V150 WeakPolarHBondContact O-CG2 3.47Å; W146-V150 PolarHBondContact O-N 3.13Å; W146-W248 HydrophobicContact CB-CH2 4.42Å; W146-W248 HydrophobicContact CB-CZ2 4.38Å; W146-W248 AromaticContact CD1-NE1 4Å
147	V	88.1	Confident	84.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.9	-45.3	176.4	175.3	0	0	0	0	111.6	V123 F143 I144 T149 V150 F151 L183	V123-V147 HydrophobicContact CG1-CG1 4.29Å; V123-V147 HydrophobicContact CG1-CG2 4.13Å; F143-V147 HydrophobicContact CD2-CG2 4.13Å; F143-V147 HydrophobicContact CE1-CG2 4.14Å; F143-V147 HydrophobicContact CE2-CG2 3.56Å; F143-V147 HydrophobicContact CZ-CG2 3.58Å; F143-V147 WeakPolarHBondContact O-CG2 3.48Å; F143-V147 PolarHBondContact O-N 3.43Å; I144-V147 PolarHBondContact O-N 3.25Å; V147-T149 PolarHBondContact O-N 3.23Å; V147-V150 PolarHBondContact O-N 2.97Å; V147-F151 WeakPolarHBondContact O-CA 3.48Å; V147-F151 WeakPolarHBondContact O-CB 3.32Å; V147-F151 PolarHBondContact O-N 3.45Å; V147-L183 HydrophobicContact CG1-CD1 4.08Å; V147-L183 HydrophobicContact CG1-CD2 4.46Å
148	L	85.3	Confident	84.9	Confident	10 Å²	10	28.2 Å²	28.2	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-27.4	175.7	-71.2	170	0	0	0	113	I144 K145 W146 F179 H182 L183 L186	I144-L148 HydrophobicContact CG2-CD1 4.28Å; I144-L148 HydrophobicContact CG2-CG 4.49Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.78Å; K145-L148 PolarHBondContact O-N 3.31Å; W146-L148 VanDerWaalsContact C-N 3.32Å; W146-L148 PolarHBondContact O-N 3.05Å; L148-F179 HydrophobicContact CD1-CB 4.23Å; L148-F179 HydrophobicContact CD1-CD1 4.4Å; L148-H182 HydrophobicContact CD1-CB 4.26Å; L148-H182 HydrophobicContact CD2-CB 4.17Å; L148-L183 HydrophobicContact CD2-CB 4.04Å; L148-L183 HydrophobicContact CD2-CD1 4.35Å; L148-L186 HydrophobicContact CD2-CD1 3.97Å
149	T	83.3	Confident	85.1	Confident	10 Å²	10	28.6 Å²	28.6	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-77.2	-38.3	178.2	-51.1	0	0	0	0	111.9	K145 W146 V147 I245 W248 K249	K145-T149 PolarHBondContact O-N 3.36Å; K145-T149 PolarHBondContact O-OG1 3.33Å; W146-T149 WeakPolarHBondContact O-CA 3.39Å; W146-T149 VanDerWaalsContact O-CB 3.29Å; W146-T149 WeakPolarHBondContact O-CB 3.39Å; W146-T149 PolarHBondContact O-N 3.21Å; V147-T149 PolarHBondContact O-N 3.23Å; T149-I245 HydrophobicContact CG2-CG2 3.62Å; T149-I245 VanDerWaalsContact OG1-CG2 3.31Å; T149-I245 WeakPolarHBondContact OG1-CG2 3.27Å; T149-W248 HydrophobicContact CG2-CB 3.61Å; T149-K249 HydrophobicContact CG2-CG 4.13Å
150	V	83.4	Confident	85.1	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-100.2	8.3	-176.7	-55.1	0	0	0	0	113.1	P114 V118 W146 V147 D152 M153 I154	P114-V150 HydrophobicContact CG-CB 4.48Å; P114-V150 HydrophobicContact CG-CG1 3.88Å; V118-V150 HydrophobicContact CG2-CB 4.23Å; V118-V150 HydrophobicContact CG2-CG2 4.24Å; W146-V150 HydrophobicContact CD2-CG2 4.12Å; W146-V150 HydrophobicContact CE3-CG2 4.14Å; W146-V150 HydrophobicContact CH2-CG2 3.92Å; W146-V150 HydrophobicContact CZ2-CG1 4.28Å; W146-V150 HydrophobicContact CZ2-CG2 3.89Å; W146-V150 HydrophobicContact CZ3-CG2 4.04Å; W146-V150 WeakPolarHBondContact O-CG2 3.47Å; W146-V150 PolarHBondContact O-N 3.13Å; V147-V150 PolarHBondContact O-N 2.97Å; V150-D152 PolarHBondContact O-N 3.12Å; V150-D152 VanDerWaalsContact O-N 3.13Å; V150-M153 WeakPolarHBondContact O-CA 3.45Å; V150-M153 WeakPolarHBondContact O-CB 3.45Å; V150-M153 PolarHBondContact O-N 3.18Å; V150-I154 PolarHBondContact O-N 2.96Å
151	F	84.9	Confident	85.2	Confident	11 Å²	11	30.4 Å²	30.4	5%	0.048	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-53.6	-38.3	-172.1	-173.5	-96.5	0	0	0	113.4	V147 M153 I154 K157 L160 L183 L186 L187	V147-F151 WeakPolarHBondContact O-CA 3.48Å; V147-F151 WeakPolarHBondContact O-CB 3.32Å; V147-F151 PolarHBondContact O-N 3.45Å; F151-M153 VanDerWaalsContact C-N 3.3Å; F151-M153 PolarHBondContact O-N 3Å; F151-I154 HydrophobicContact CD2-CD1 4.3Å; F151-I154 PolarHBondContact O-N 2.77Å; F151-K157 HydrophobicContact CE1-CD 4.02Å; F151-K157 VanDerWaalsContact CE1-CE 3.47Å; F151-K157 HydrophobicContact CZ-CD 3.9Å; F151-K157 WeakPolarHBondContact O-CE 3.24Å; F151-K157 PolarHBondContact O-NZ 3.21Å; F151-K157 VanDerWaalsContact O-NZ 3.1Å; F151-L160 HydrophobicContact CE2-CD2 4.37Å; F151-L183 HydrophobicContact CD2-CD1 3.93Å; F151-L183 HydrophobicContact CE2-CD1 3.85Å; F151-L186 HydrophobicContact CD1-CB 4.41Å; F151-L186 HydrophobicContact CD1-CD1 3.96Å; F151-L186 HydrophobicContact CD2-CD1 4.28Å; F151-L186 HydrophobicContact CE1-CB 3.76Å; F151-L186 HydrophobicContact CE1-CD1 4.16Å; F151-L186 HydrophobicContact CE1-CG 4.42Å; F151-L186 HydrophobicContact CE2-CB 4.08Å; F151-L186 HydrophobicContact CE2-CD1 4.47Å; F151-L186 HydrophobicContact CG-CD1 4.02Å; F151-L186 HydrophobicContact CZ-CB 3.57Å; F151-L186 HydrophobicContact CZ-CD1 4.41Å; F151-L187 HydrophobicContact CE2-CD2 3.84Å; F151-L187 HydrophobicContact CE2-CG 4.13Å; F151-L187 HydrophobicContact CZ-CD2 3.89Å; F151-L187 HydrophobicContact CZ-CG 4.32Å
152	D	81.8	Confident	85.3	Confident	63 Å²	63	33.3 Å²	33.3	34%	0.337	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-72	-24.9	178.5	-56.6	-55.1	0	0	0	113.1	V150 I154 G266 I267	V150-D152 PolarHBondContact O-N 3.12Å; V150-D152 VanDerWaalsContact O-N 3.13Å; D152-I154 VanDerWaalsContact C-N 3.35Å; D152-G266 VanDerWaalsContact OD2-O 3.07Å; D152-I267 WeakPolarHBondContact OD1-CD1 3.32Å; D152-I267 WeakPolarHBondContact OD1-CG1 3.22Å; D152-I267 WeakPolarHBondContact OD2-CB 3.32Å
153	M	79.9	Confident	85.6	Confident	18 Å²	18	33.1 Å²	33.1	9%	0.089	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-87.8	-3.7	-179.5	-57.7	178.9	70.8	0	0	112.9	P114 S116 V117 V118 V150 F151 D155 L252	P114-M153 HydrophobicContact CB-CE 3.67Å; P114-M153 HydrophobicContact CB-SD 4.39Å; P114-M153 HydrophobicContact CG-CE 3.52Å; P114-M153 HydrophobicContact CG-SD 3.61Å; S116-M153 WeakPolarHBondContact O-CE 2.94Å; V117-M153 CarbonylContact C-O 3.57Å; V117-M153 WeakPolarHBondContact CA-O 3.5Å; V118-M153 HydrophobicContact CG2-CB 4.28Å; V118-M153 PolarHBondContact N-O 3.35Å; V150-M153 WeakPolarHBondContact O-CA 3.45Å; V150-M153 WeakPolarHBondContact O-CB 3.45Å; V150-M153 PolarHBondContact O-N 3.18Å; F151-M153 VanDerWaalsContact C-N 3.3Å; F151-M153 PolarHBondContact O-N 3Å; M153-D155 PolarHBondContact O-N 3.06Å; M153-L252 HydrophobicContact CE-CD1 4.19Å; M153-L252 HydrophobicContact SD-CD1 3.89Å; M153-L252 HydrophobicContact SD-CD2 3.65Å; M153-L252 HydrophobicContact SD-CG 4.24Å
154	I	83.8	Confident	85.7	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-72.3	121.1	175	-51.6	175.5	0	0	0	109.2	V118 Q120 V123 V150 F151 D152 A156 K157 L160	V118-I154 HydrophobicContact CB-CG1 4.39Å; V118-I154 WeakPolarHBondContact O-CA 3.15Å; Q120-I154 HydrophobicContact CB-CG2 4.03Å; V123-I154 HydrophobicContact CG2-CD1 4.3Å; V150-I154 PolarHBondContact O-N 2.96Å; F151-I154 HydrophobicContact CD2-CD1 4.3Å; F151-I154 PolarHBondContact O-N 2.77Å; D152-I154 VanDerWaalsContact C-N 3.35Å; I154-A156 WeakPolarHBondContact CG2-O 3.34Å; I154-A156 PolarHBondContact O-N 3.12Å; I154-K157 PolarHBondContact O-NZ 3.37Å; I154-K157 VanDerWaalsContact O-NZ 3.1Å; I154-L160 HydrophobicContact CD1-CD2 4.28Å
155	D	81.7	Confident	85.8	Confident	89 Å²	89	34.8 Å²	34.8	48%	0.476	20%	0.196	S	C	.	.	S	Bend	trans	-52.4	-45.9	-173.9	60.9	-10.5	0	0	0	114.2	V117 V118 Q120 M153	V117-D155 HydrophobicContact CB-CB 4.46Å; V118-D155 PolarHBondContact O-N 2.76Å; V118-D155 VanDerWaalsContact O-N 3.08Å; Q120-D155 VanDerWaalsContact CB-OD1 3.28Å; Q120-D155 WeakPolarHBondContact CB-OD1 3.48Å; Q120-D155 PolarHBondContact N-OD1 2.79Å; M153-D155 PolarHBondContact O-N 3.06Å
156	A	82.7	Confident	86	Confident	29 Å²	29	38.2 Å²	38.2	24%	0.24	21%	0.211	C	C	.	.			trans	-142.3	158.7	175.3	0	0	0	0	0	110.5	Q120 I154	Q120-A156 VanDerWaalsContact CB-O 3.29Å; Q120-A156 WeakPolarHBondContact CB-O 3.25Å; Q120-A156 HydrophobicContact CG-CB 4.43Å; Q120-A156 PolarHBondContact OE1-O 3.23Å; I154-A156 WeakPolarHBondContact CG2-O 3.34Å; I154-A156 PolarHBondContact O-N 3.12Å
157	K	86.4	Confident	86.1	Confident	40 Å²	40	38.4 Å²	38.4	17%	0.174	21%	0.212	C	C	.	.			trans	-123	5.3	-174.4	-65.6	171.7	177.8	64	0	112.5	F151 I154 L160 R161	F151-K157 HydrophobicContact CE1-CD 4.02Å; F151-K157 VanDerWaalsContact CE1-CE 3.47Å; F151-K157 HydrophobicContact CZ-CD 3.9Å; F151-K157 WeakPolarHBondContact O-CE 3.24Å; F151-K157 PolarHBondContact O-NZ 3.21Å; F151-K157 VanDerWaalsContact O-NZ 3.1Å; I154-K157 PolarHBondContact O-NZ 3.37Å; I154-K157 VanDerWaalsContact O-NZ 3.1Å; K157-L160 PolarHBondContact O-N 3.28Å; K157-R161 WeakPolarHBondContact O-CB 3.45Å; K157-R161 WeakPolarHBondContact O-CD 3.48Å; K157-R161 WeakPolarHBondContact O-CG 3.17Å; K157-R161 PolarHBondContact O-N 2.86Å
158	D	85.6	Confident	86.3	Confident	92 Å²	92	39.1 Å²	39.1	49%	0.492	22%	0.215	S	C	.	.	H	α-helix	trans	-76.9	-40.9	-170.1	-57	-44	0	0	0	112.1	L160 R161 A162	D158-L160 VanDerWaalsContact C-N 3.32Å; D158-L160 PolarHBondContact O-N 3.29Å; D158-R161 PolarHBondContact O-N 3.09Å; D158-R161 IonicContact OD1-NH1 2.82Å; D158-R161 PolarHBondContact OD1-NH1 3.48Å; D158-A162 PolarHBondContact O-N 3.38Å
159	K	86.3	Confident	86.6	Confident	96 Å²	96	41.7 Å²	41.7	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-68.6	-34.5	172.4	-69.2	-178.5	-178.6	-172.3	0	112.1	E121 V124 R161 A162 I163	E121-K159 WeakPolarHBondContact OE1-CD 3.43Å; E121-K159 WeakPolarHBondContact OE1-CE 3.36Å; E121-K159 IonicContact OE1-NZ 2.6Å; E121-K159 PolarHBondContact OE1-NZ 2.94Å; E121-K159 IonicContact OE2-NZ 2.91Å; E121-K159 PolarHBondContact OE2-NZ 3.19Å; V124-K159 HydrophobicContact CG2-CB 4.08Å; K159-R161 VanDerWaalsContact C-N 3.33Å; K159-A162 WeakPolarHBondContact O-CB 3.44Å; K159-A162 PolarHBondContact O-N 3.34Å; K159-I163 PolarHBondContact O-N 3.32Å
160	L	85.9	Confident	86.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-37.4	173.9	-171.3	60.9	0	0	0	111.8	V123 I127 F151 I154 K157 D158 I163 I167 L187	V123-L160 HydrophobicContact CG1-CD1 4.34Å; I127-L160 HydrophobicContact CD1-CD1 3.35Å; F151-L160 HydrophobicContact CE2-CD2 4.37Å; I154-L160 HydrophobicContact CD1-CD2 4.28Å; K157-L160 PolarHBondContact O-N 3.28Å; D158-L160 VanDerWaalsContact C-N 3.32Å; D158-L160 PolarHBondContact O-N 3.29Å; L160-I163 HydrophobicContact CD1-CD1 4.13Å; L160-I163 HydrophobicContact CD1-CG1 4.38Å; L160-I163 WeakPolarHBondContact O-CG1 3.33Å; L160-I167 HydrophobicContact CD1-CD1 3.8Å; L160-I167 HydrophobicContact CG-CD1 4.39Å; L160-L187 HydrophobicContact CD2-CD1 4.19Å; L160-L187 HydrophobicContact CD2-CD2 3.84Å; L160-L187 HydrophobicContact CG-CD1 3.92Å; L160-L187 HydrophobicContact CG-CD2 3.95Å
161	R	88.3	Confident	87.1	Confident	58 Å²	58	42.5 Å²	42.5	22%	0.219	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-35.9	171.5	-72.5	164.6	-176.5	143	-1.5	112.4	K157 D158 K159 I163 Y164 L187 R189	K157-R161 WeakPolarHBondContact O-CB 3.45Å; K157-R161 WeakPolarHBondContact O-CD 3.48Å; K157-R161 WeakPolarHBondContact O-CG 3.17Å; K157-R161 PolarHBondContact O-N 2.86Å; D158-R161 PolarHBondContact O-N 3.09Å; D158-R161 IonicContact OD1-NH1 2.82Å; D158-R161 PolarHBondContact OD1-NH1 3.48Å; K159-R161 VanDerWaalsContact C-N 3.33Å; R161-I163 PolarHBondContact O-N 3.04Å; R161-Y164 WeakPolarHBondContact O-CB 3.49Å; R161-Y164 PolarHBondContact O-N 3.11Å; R161-L187 HydrophobicContact CG-CD2 4.19Å; R161-R189 VanDerWaalsContact CZ-NH2 3.27Å
162	A	89.1	Confident	87.1	Confident	83 Å²	83	45.4 Å²	45.4	69%	0.686	26%	0.255	S	S	*	.	H	α-helix	trans	-60.3	-35.2	176.4	0	0	0	0	0	111.7	D158 K159 Y164	D158-A162 PolarHBondContact O-N 3.38Å; K159-A162 WeakPolarHBondContact O-CB 3.44Å; K159-A162 PolarHBondContact O-N 3.34Å; A162-Y164 VanDerWaalsContact C-N 3.3Å; A162-Y164 PolarHBondContact O-N 3.37Å
163	I	90.1	Very high	87.2	Confident	28 Å²	28	44.8 Å²	44.8	14%	0.144	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	13.7	175.5	67	167.6	0	0	0	114.1	V124 I127 K159 L160 R161 G165 F166 I167	V124-I163 HydrophobicContact CG1-CD1 4.27Å; V124-I163 HydrophobicContact CG2-CD1 4.15Å; I127-I163 HydrophobicContact CB-CD1 4.09Å; I127-I163 HydrophobicContact CD1-CD1 3.85Å; I127-I163 HydrophobicContact CG2-CD1 3.87Å; K159-I163 PolarHBondContact O-N 3.32Å; L160-I163 HydrophobicContact CD1-CD1 4.13Å; L160-I163 HydrophobicContact CD1-CG1 4.38Å; L160-I163 WeakPolarHBondContact O-CG1 3.33Å; R161-I163 PolarHBondContact O-N 3.04Å; I163-G165 PolarHBondContact O-N 2.86Å; I163-G165 VanDerWaalsContact O-N 3.09Å; I163-F166 HydrophobicContact CB-CD2 4.06Å; I163-F166 HydrophobicContact CG2-CD2 4.31Å; I163-F166 WeakPolarHBondContact O-CB 3.38Å; I163-F166 PolarHBondContact O-N 3.35Å; I163-I167 HydrophobicContact CD1-CD1 4.39Å; I163-I167 HydrophobicContact CD1-CG1 4.49Å; I163-I167 HydrophobicContact CG1-CD1 4.15Å; I163-I167 HydrophobicContact CG1-CG1 4.4Å; I163-I167 PolarHBondContact O-N 2.91Å; I163-I167 VanDerWaalsContact O-N 3.11Å
164	Y	91.8	Very high	87.4	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-51.7	-37.1	179.8	-175.4	-85.5	0	0	0	112.7	R161 A162 F166 I167 F168 L184 L187 T188 N192 Y221	R161-Y164 WeakPolarHBondContact O-CB 3.49Å; R161-Y164 PolarHBondContact O-N 3.11Å; A162-Y164 VanDerWaalsContact C-N 3.3Å; A162-Y164 PolarHBondContact O-N 3.37Å; Y164-F166 VanDerWaalsContact C-N 3.35Å; Y164-F166 PolarHBondContact O-N 2.91Å; Y164-I167 PolarHBondContact O-N 2.96Å; Y164-F168 HydrophobicContact CE1-CD2 4.41Å; Y164-F168 VanDerWaalsContact O-CB 3.32Å; Y164-F168 WeakPolarHBondContact O-CB 3.47Å; Y164-F168 PolarHBondContact O-N 2.8Å; Y164-L184 HydrophobicContact CD1-CD2 4.46Å; Y164-L184 HydrophobicContact CD2-CD2 3.87Å; Y164-L184 HydrophobicContact CE1-CD2 4.09Å; Y164-L184 HydrophobicContact CE2-CB 4.3Å; Y164-L184 HydrophobicContact CE2-CD2 3.45Å; Y164-L184 VanDerWaalsContact CE2-CD2 3.45Å; Y164-L184 HydrophobicContact CE2-CG 4.47Å; Y164-L184 HydrophobicContact CG-CD2 4.34Å; Y164-L187 HydrophobicContact CD2-CB 4.03Å; Y164-L187 HydrophobicContact CE2-CB 4.16Å; Y164-T188 PolarHBondContact OH-OG1 3.5Å; Y164-N192 HydrophobicContact CD1-CB 4.08Å; Y164-N192 HydrophobicContact CE1-CB 3.86Å; Y164-N192 HydrophobicContact CE2-CB 4.34Å; Y164-N192 HydrophobicContact CG-CB 4.43Å; Y164-Y221 PolarHBondContact OH-OH 3.3Å
165	G	89.6	Confident	87.4	Confident	36 Å²	36	54.7 Å²	54.7	37%	0.371	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-40.4	175.9	0	0	0	0	0	113.7	I163 F168 S169	I163-G165 PolarHBondContact O-N 2.86Å; I163-G165 VanDerWaalsContact O-N 3.09Å; G165-F168 PolarHBondContact O-N 2.92Å; G165-S169 PolarHBondContact O-N 3.33Å
166	F	89.6	Confident	87.6	Confident	128 Å²	128	50.5 Å²	50.5	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-73	-37.2	176.9	-64.6	-80	0	0	0	111.8	I163 Y164 F168 S169 F170	I163-F166 HydrophobicContact CB-CD2 4.06Å; I163-F166 HydrophobicContact CG2-CD2 4.31Å; I163-F166 WeakPolarHBondContact O-CB 3.38Å; I163-F166 PolarHBondContact O-N 3.35Å; Y164-F166 VanDerWaalsContact C-N 3.35Å; Y164-F166 PolarHBondContact O-N 2.91Å; F166-F168 VanDerWaalsContact C-N 3.26Å; F166-F168 PolarHBondContact O-N 2.75Å; F166-S169 PolarHBondContact O-N 3.43Å; F166-S169 PolarHBondContact O-OG 2.86Å; F166-F170 WeakPolarHBondContact O-CD2 3.47Å; F166-F170 WeakPolarHBondContact O-CE2 3.42Å
167	I	91.2	Very high	87.7	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-38.4	174	-58.5	172.7	0	0	0	109.8	I127 L160 I163 Y164 S169 F170 I180 L183 L184 L187	I127-I167 HydrophobicContact CD1-CD1 4.18Å; I127-I167 HydrophobicContact CD1-CG1 4.43Å; I127-I167 HydrophobicContact CG2-CG1 4.4Å; L160-I167 HydrophobicContact CD1-CD1 3.8Å; L160-I167 HydrophobicContact CG-CD1 4.39Å; I163-I167 HydrophobicContact CD1-CD1 4.39Å; I163-I167 HydrophobicContact CD1-CG1 4.49Å; I163-I167 HydrophobicContact CG1-CD1 4.15Å; I163-I167 HydrophobicContact CG1-CG1 4.4Å; I163-I167 PolarHBondContact O-N 2.91Å; I163-I167 VanDerWaalsContact O-N 3.11Å; Y164-I167 PolarHBondContact O-N 2.96Å; I167-S169 VanDerWaalsContact C-N 3.3Å; I167-S169 PolarHBondContact O-N 3.1Å; I167-F170 PolarHBondContact O-N 3.13Å; I167-I180 HydrophobicContact CG2-CD1 4.34Å; I167-I180 HydrophobicContact CG2-CG2 4.22Å; I167-I180 WeakPolarHBondContact O-CG2 3.43Å; I167-L183 HydrophobicContact CD1-CD2 4.48Å; I167-L183 HydrophobicContact CG2-CD2 4.06Å; I167-L184 HydrophobicContact CB-CD2 4.07Å; I167-L184 HydrophobicContact CG2-CD2 3.7Å; I167-L184 HydrophobicContact CG2-CG 4.12Å; I167-L187 HydrophobicContact CD1-CD1 3.73Å
168	F	92.3	Very high	87.7	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.07	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-29.5	178.9	-172.2	-91.4	0	0	0	113.4	Y164 G165 F166 F170 V171 L184 R197 K200 L201	Y164-F168 HydrophobicContact CE1-CD2 4.41Å; Y164-F168 VanDerWaalsContact O-CB 3.32Å; Y164-F168 WeakPolarHBondContact O-CB 3.47Å; Y164-F168 PolarHBondContact O-N 2.8Å; G165-F168 PolarHBondContact O-N 2.92Å; F166-F168 VanDerWaalsContact C-N 3.26Å; F166-F168 PolarHBondContact O-N 2.75Å; F168-F170 PolarHBondContact O-N 2.93Å; F168-V171 HydrophobicContact CD2-CG2 4.21Å; F168-V171 HydrophobicContact CE2-CG2 4.44Å; F168-V171 WeakPolarHBondContact O-CB 3.4Å; F168-V171 VanDerWaalsContact O-CG2 3.24Å; F168-V171 WeakPolarHBondContact O-CG2 3.34Å; F168-V171 PolarHBondContact O-N 3.05Å; F168-V171 VanDerWaalsContact O-N 3.13Å; F168-L184 HydrophobicContact CB-CD2 4.4Å; F168-L184 HydrophobicContact CD2-CD1 3.92Å; F168-R197 HydrophobicContact CD1-CG 4.21Å; F168-R197 HydrophobicContact CD2-CG 4.43Å; F168-R197 HydrophobicContact CE1-CB 4.1Å; F168-R197 HydrophobicContact CE1-CG 3.94Å; F168-R197 HydrophobicContact CE2-CB 3.88Å; F168-R197 HydrophobicContact CE2-CG 4.19Å; F168-R197 HydrophobicContact CG-CG 4.45Å; F168-R197 HydrophobicContact CZ-CB 3.62Å; F168-R197 HydrophobicContact CZ-CG 3.95Å; F168-R197 WeakPolarHBondContact CZ-O 3.24Å; F168-K200 HydrophobicContact CE1-CB 3.95Å; F168-K200 HydrophobicContact CE1-CG 4.05Å; F168-K200 HydrophobicContact CZ-CB 4.03Å; F168-K200 HydrophobicContact CZ-CG 4.42Å; F168-L201 HydrophobicContact CE2-CD1 4.22Å; F168-L201 HydrophobicContact CE2-CD2 4.03Å; F168-L201 HydrophobicContact CE2-CG 3.94Å; F168-L201 HydrophobicContact CZ-CD2 4.32Å; F168-L201 HydrophobicContact CZ-CG 4.02Å
169	S	90.4	Very high	87.7	Confident	64 Å²	64	45.3 Å²	45.3	45%	0.448	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-25.2	177.6	61.7	0	0	0	0	112.9	G165 F166 I167 V171 T172	G165-S169 PolarHBondContact O-N 3.33Å; F166-S169 PolarHBondContact O-N 3.43Å; F166-S169 PolarHBondContact O-OG 2.86Å; I167-S169 VanDerWaalsContact C-N 3.3Å; I167-S169 PolarHBondContact O-N 3.1Å; S169-V171 PolarHBondContact O-N 3.02Å; S169-T172 PolarHBondContact O-OG1 3.48Å; S169-T172 VanDerWaalsContact O-OG1 3.05Å
170	F	88.7	Confident	87.8	Confident	29 Å²	29	40.8 Å²	40.8	13%	0.127	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-75.5	-5.2	177	-63.8	-74.6	0	0	0	114.1	L130 T131 F166 I167 F168 T172 D173 L176 I180	L130-F170 HydrophobicContact CB-CZ 4.18Å; L130-F170 HydrophobicContact CD2-CD1 4.15Å; L130-F170 HydrophobicContact CD2-CD2 4.11Å; L130-F170 HydrophobicContact CD2-CE1 3.74Å; L130-F170 HydrophobicContact CD2-CE2 3.71Å; L130-F170 HydrophobicContact CD2-CG 4.32Å; L130-F170 HydrophobicContact CD2-CZ 3.49Å; L130-F170 VanDerWaalsContact CD2-CZ 3.49Å; L130-F170 HydrophobicContact CG-CE1 4.03Å; L130-F170 HydrophobicContact CG-CZ 3.86Å; T131-F170 HydrophobicContact CG2-CE2 3.84Å; T131-F170 HydrophobicContact CG2-CZ 3.58Å; F166-F170 WeakPolarHBondContact O-CD2 3.47Å; F166-F170 WeakPolarHBondContact O-CE2 3.42Å; I167-F170 PolarHBondContact O-N 3.13Å; F168-F170 PolarHBondContact O-N 2.93Å; F170-T172 PolarHBondContact O-N 2.77Å; F170-D173 PolarHBondContact O-N 2.97Å; F170-L176 HydrophobicContact CB-CD1 4.5Å; F170-L176 HydrophobicContact CD1-CD1 4.06Å; F170-I180 HydrophobicContact CB-CD1 3.95Å; F170-I180 HydrophobicContact CB-CG1 3.83Å; F170-I180 HydrophobicContact CB-CG2 4.27Å
171	V	88.8	Confident	87.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-64.3	-23.4	175.2	177.3	0	0	0	0	111.7	F168 S169 D173 C177 I180 L184 L201 Q204 L214	F168-V171 HydrophobicContact CD2-CG2 4.21Å; F168-V171 HydrophobicContact CE2-CG2 4.44Å; F168-V171 WeakPolarHBondContact O-CB 3.4Å; F168-V171 VanDerWaalsContact O-CG2 3.24Å; F168-V171 WeakPolarHBondContact O-CG2 3.34Å; F168-V171 PolarHBondContact O-N 3.05Å; F168-V171 VanDerWaalsContact O-N 3.13Å; S169-V171 PolarHBondContact O-N 3.02Å; V171-D173 VanDerWaalsContact C-N 3.3Å; V171-D173 PolarHBondContact O-N 2.96Å; V171-C177 PolarHBondContact O-SG 3.17Å; V171-I180 HydrophobicContact CG2-CG2 3.69Å; V171-L184 HydrophobicContact CG2-CD1 3.38Å; V171-L201 HydrophobicContact CG1-CD2 3.88Å; V171-Q204 HydrophobicContact CG1-CG 4.29Å; V171-L214 HydrophobicContact CG1-CD2 4.26Å
172	T	85.2	Confident	87.8	Confident	73 Å²	73	38.3 Å²	38.3	45%	0.448	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-77.3	-12	178	57.9	0	0	0	0	114.1	S169 F170	S169-T172 PolarHBondContact O-OG1 3.48Å; S169-T172 VanDerWaalsContact O-OG1 3.05Å; F170-T172 PolarHBondContact O-N 2.77Å
173	D	84.6	Confident	87.7	Confident	49 Å²	49	34.4 Å²	34.4	26%	0.262	19%	0.188	S	C	.	.			trans	-88.5	114.9	176.1	-176.9	-28	0	0	0	109.7	F170 V171 N175 L176 C177	F170-D173 PolarHBondContact O-N 2.97Å; V171-D173 VanDerWaalsContact C-N 3.3Å; V171-D173 PolarHBondContact O-N 2.96Å; D173-N175 PolarHBondContact O-N 3.1Å; D173-N175 PolarHBondContact OD1-N 3.25Å; D173-L176 HydrophobicContact CB-CB 4.19Å; D173-L176 HydrophobicContact CB-CD1 4.33Å; D173-L176 HydrophobicContact CB-CG 4.45Å; D173-L176 PolarHBondContact O-N 3.38Å; D173-C177 WeakPolarHBondContact O-CA 3.45Å; D173-C177 VanDerWaalsContact O-CB 3.22Å; D173-C177 WeakPolarHBondContact O-CB 3.34Å; D173-C177 PolarHBondContact O-N 2.91Å
174	E	83.3	Confident	87.7	Confident	134 Å²	134	33.1 Å²	33.1	63%	0.626	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.5	-175.4	-56.4	-171.3	167.1	0	0	113.5	L208	E174-L208 HydrophobicContact CG-CD2 3.99Å
175	N	83.9	Confident	87.5	Confident	98 Å²	98	37.1 Å²	37.1	52%	0.524	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-32.6	-177.5	-65.7	-60.7	0	0	0	112.3	T137 D173	T137-N175 HydrophobicContact CG2-CB 3.5Å; D173-N175 PolarHBondContact O-N 3.1Å; D173-N175 PolarHBondContact OD1-N 3.25Å
176	L	85.1	Confident	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.2	179.6	-66	177.6	0	0	0	112.5	Q140 V141 F170 D173 P178 F179 I180	Q140-L176 HydrophobicContact CB-CD1 4.39Å; Q140-L176 HydrophobicContact CB-CD2 3.83Å; V141-L176 HydrophobicContact CG2-CD2 3.74Å; F170-L176 HydrophobicContact CB-CD1 4.5Å; F170-L176 HydrophobicContact CD1-CD1 4.06Å; D173-L176 HydrophobicContact CB-CB 4.19Å; D173-L176 HydrophobicContact CB-CD1 4.33Å; D173-L176 HydrophobicContact CB-CG 4.45Å; D173-L176 PolarHBondContact O-N 3.38Å; L176-P178 VanDerWaalsContact C-CD 3.44Å; L176-P178 VanDerWaalsContact O-N 3.16Å; L176-F179 PolarHBondContact O-N 3.49Å; L176-I180 HydrophobicContact CB-CG1 3.89Å; L176-I180 WeakPolarHBondContact O-CG1 3.33Å; L176-I180 PolarHBondContact O-N 3.37Å
177	C	86.4	Confident	87.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-48.2	-45.9	-172.3	-165.2	0	0	0	0	113.8	V171 D173 F179 I180 C181 Y213	V171-C177 PolarHBondContact O-SG 3.17Å; D173-C177 WeakPolarHBondContact O-CA 3.45Å; D173-C177 VanDerWaalsContact O-CB 3.22Å; D173-C177 WeakPolarHBondContact O-CB 3.34Å; D173-C177 PolarHBondContact O-N 2.91Å; C177-F179 VanDerWaalsContact C-N 3.34Å; C177-F179 PolarHBondContact O-N 2.94Å; C177-I180 PolarHBondContact O-N 3.38Å; C177-C181 VanDerWaalsContact O-CB 3.27Å; C177-C181 WeakPolarHBondContact O-CB 3.48Å; C177-C181 PolarHBondContact O-N 2.95Å; C177-C181 PolarHBondContact O-SG 3.46Å; C177-Y213 HydrophobicContact CB-CE2 4.15Å; C177-Y213 VanDerWaalsContact SG-CE2 3.54Å
178	P	85	Confident	86.8	Confident	34 Å²	34	32 Å²	32	22%	0.221	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-38.2	179.1	-22.4	33.5	0	0	0	113.8	L176 H182 Y213	L176-P178 VanDerWaalsContact C-CD 3.44Å; L176-P178 VanDerWaalsContact O-N 3.16Å; P178-H182 PolarHBondContact O-N 3.31Å; P178-Y213 HydrophobicContact CB-CD1 3.92Å; P178-Y213 HydrophobicContact CB-CE1 4.18Å; P178-Y213 HydrophobicContact CB-CG 4.16Å; P178-Y213 HydrophobicContact CG-CD1 4.1Å; P178-Y213 HydrophobicContact CG-CE1 3.82Å; P178-Y213 HydrophobicContact CG-CE2 4.48Å
179	F	85.8	Confident	86.4	Confident	18 Å²	18	36 Å²	36	8%	0.079	18%	0.183	C	C	.	.	H	α-helix	trans	-81.3	-38.4	-177.7	-52.1	-74.8	0	0	0	111.6	V141 I144 K145 L148 L176 C177 H182 L183 H244	V141-F179 HydrophobicContact CG1-CD2 4.11Å; V141-F179 HydrophobicContact CG1-CE2 3.58Å; V141-F179 HydrophobicContact CG1-CZ 3.89Å; V141-F179 HydrophobicContact CG2-CD2 4.41Å; V141-F179 HydrophobicContact CG2-CE2 4.21Å; I144-F179 HydrophobicContact CB-CB 4.22Å; I144-F179 HydrophobicContact CG2-CB 3.55Å; K145-F179 HydrophobicContact CD-CE1 4.08Å; K145-F179 HydrophobicContact CD-CZ 4.45Å; K145-F179 HydrophobicContact CG-CD1 3.83Å; K145-F179 HydrophobicContact CG-CE1 3.74Å; K145-F179 HydrophobicContact CG-CZ 4.46Å; L148-F179 HydrophobicContact CD1-CB 4.23Å; L148-F179 HydrophobicContact CD1-CD1 4.4Å; L176-F179 PolarHBondContact O-N 3.49Å; C177-F179 VanDerWaalsContact C-N 3.34Å; C177-F179 PolarHBondContact O-N 2.94Å; F179-H182 WeakPolarHBondContact O-CB 3.48Å; F179-H182 PolarHBondContact O-N 2.89Å; F179-L183 PolarHBondContact O-N 3.06Å; F179-H244 HydrophobicContact CE1-CB 4.03Å; F179-H244 AromaticContact CE1-CD2 3.33Å; F179-H244 WeakPolarHBondContact CE1-CD2 3.23Å; F179-H244 AromaticContact CE1-CG 3.6Å; F179-H244 AromaticContact CE1-NE2 3.73Å
180	I	90	Very high	86	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-67.3	-42.8	176.6	-65.7	-66.1	0	0	0	110.4	I144 I167 F170 V171 L176 C177 H182 L183 L184	I144-I180 HydrophobicContact CD1-CD1 3.93Å; I144-I180 HydrophobicContact CG1-CD1 4.11Å; I144-I180 HydrophobicContact CG2-CD1 4.33Å; I167-I180 HydrophobicContact CG2-CD1 4.34Å; I167-I180 HydrophobicContact CG2-CG2 4.22Å; I167-I180 WeakPolarHBondContact O-CG2 3.43Å; F170-I180 HydrophobicContact CB-CD1 3.95Å; F170-I180 HydrophobicContact CB-CG1 3.83Å; F170-I180 HydrophobicContact CB-CG2 4.27Å; V171-I180 HydrophobicContact CG2-CG2 3.69Å; L176-I180 HydrophobicContact CB-CG1 3.89Å; L176-I180 WeakPolarHBondContact O-CG1 3.33Å; L176-I180 PolarHBondContact O-N 3.37Å; C177-I180 PolarHBondContact O-N 3.38Å; I180-H182 PolarHBondContact O-N 3.33Å; I180-L183 PolarHBondContact O-N 3.36Å; I180-L183 VanDerWaalsContact O-N 3.16Å; I180-L184 HydrophobicContact CG2-CD1 3.73Å; I180-L184 HydrophobicContact CG2-CG 4.11Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 VanDerWaalsContact O-CG 3.22Å; I180-L184 WeakPolarHBondContact O-CG 3.19Å; I180-L184 PolarHBondContact O-N 3.41Å
181	C	87.8	Confident	85.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-36.8	174.9	-71.4	0	0	0	0	112	C177 Y185 Y213 F241	C177-C181 VanDerWaalsContact O-CB 3.27Å; C177-C181 WeakPolarHBondContact O-CB 3.48Å; C177-C181 PolarHBondContact O-N 2.95Å; C177-C181 PolarHBondContact O-SG 3.46Å; C181-Y185 VanDerWaalsContact O-CB 3.27Å; C181-Y185 WeakPolarHBondContact O-CB 3.41Å; C181-Y185 PolarHBondContact O-N 3.18Å; C181-Y213 HydrophobicContact CB-CD2 4.13Å; C181-F241 HydrophobicContact CB-CE1 4.33Å
182	H	85.4	Confident	85.5	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-45.4	174.5	-168.8	-175.7	0	0	0	111.8	L148 P178 F179 I180 L184 Y185 L186 F241	L148-H182 HydrophobicContact CD1-CB 4.26Å; L148-H182 HydrophobicContact CD2-CB 4.17Å; P178-H182 PolarHBondContact O-N 3.31Å; F179-H182 WeakPolarHBondContact O-CB 3.48Å; F179-H182 PolarHBondContact O-N 2.89Å; I180-H182 PolarHBondContact O-N 3.33Å; H182-L184 VanDerWaalsContact C-N 3.35Å; H182-L184 PolarHBondContact O-N 2.91Å; H182-Y185 WeakPolarHBondContact O-CB 3.45Å; H182-Y185 PolarHBondContact O-N 3.32Å; H182-L186 WeakPolarHBondContact O-CG 3.38Å; H182-L186 PolarHBondContact O-N 3.31Å; H182-L186 VanDerWaalsContact O-N 3.14Å; H182-F241 HydrophobicContact CB-CD1 3.54Å; H182-F241 HydrophobicContact CB-CE1 3.67Å; H182-F241 HydrophobicContact CB-CG 4.12Å; H182-F241 HydrophobicContact CB-CZ 4.33Å; H182-F241 AromaticContact CD2-CD2 3.95Å; H182-F241 AromaticContact CD2-CG 3.93Å; H182-F241 AromaticContact CG-CD1 3.78Å; H182-F241 AromaticContact CG-CG 3.81Å
183	L	86.9	Confident	85.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-42.9	177.5	-178.5	59	0	0	0	111.4	V147 L148 F151 I167 F179 I180 Y185 L186 L187	V147-L183 HydrophobicContact CG1-CD1 4.08Å; V147-L183 HydrophobicContact CG1-CD2 4.46Å; L148-L183 HydrophobicContact CD2-CB 4.04Å; L148-L183 HydrophobicContact CD2-CD1 4.35Å; F151-L183 HydrophobicContact CD2-CD1 3.93Å; F151-L183 HydrophobicContact CE2-CD1 3.85Å; I167-L183 HydrophobicContact CD1-CD2 4.48Å; I167-L183 HydrophobicContact CG2-CD2 4.06Å; F179-L183 PolarHBondContact O-N 3.06Å; I180-L183 PolarHBondContact O-N 3.36Å; I180-L183 VanDerWaalsContact O-N 3.16Å; L183-Y185 VanDerWaalsContact C-N 3.35Å; L183-L186 PolarHBondContact O-N 3.13Å; L183-L187 HydrophobicContact CD1-CD1 4.01Å; L183-L187 HydrophobicContact CD1-CG 4.38Å; L183-L187 HydrophobicContact CG-CD1 3.91Å; L183-L187 WeakPolarHBondContact O-CG 3.37Å; L183-L187 PolarHBondContact O-N 3.33Å; L183-L187 VanDerWaalsContact O-N 3.07Å
184	L	89.6	Confident	85.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-40.6	175.4	-69	170.8	0	0	0	111.5	Y164 I167 F168 V171 I180 H182 L186 L187 T188 L217	Y164-L184 HydrophobicContact CD1-CD2 4.46Å; Y164-L184 HydrophobicContact CD2-CD2 3.87Å; Y164-L184 HydrophobicContact CE1-CD2 4.09Å; Y164-L184 HydrophobicContact CE2-CB 4.3Å; Y164-L184 HydrophobicContact CE2-CD2 3.45Å; Y164-L184 VanDerWaalsContact CE2-CD2 3.45Å; Y164-L184 HydrophobicContact CE2-CG 4.47Å; Y164-L184 HydrophobicContact CG-CD2 4.34Å; I167-L184 HydrophobicContact CB-CD2 4.07Å; I167-L184 HydrophobicContact CG2-CD2 3.7Å; I167-L184 HydrophobicContact CG2-CG 4.12Å; F168-L184 HydrophobicContact CB-CD2 4.4Å; F168-L184 HydrophobicContact CD2-CD1 3.92Å; V171-L184 HydrophobicContact CG2-CD1 3.38Å; I180-L184 HydrophobicContact CG2-CD1 3.73Å; I180-L184 HydrophobicContact CG2-CG 4.11Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 VanDerWaalsContact O-CG 3.22Å; I180-L184 WeakPolarHBondContact O-CG 3.19Å; I180-L184 PolarHBondContact O-N 3.41Å; H182-L184 VanDerWaalsContact C-N 3.35Å; H182-L184 PolarHBondContact O-N 2.91Å; L184-L186 VanDerWaalsContact C-N 3.26Å; L184-L186 PolarHBondContact O-N 3.4Å; L184-L187 CarbonylContact O-C 3.48Å; L184-L187 PolarHBondContact O-N 3.43Å; L184-L187 VanDerWaalsContact O-N 3.07Å; L184-T188 WeakPolarHBondContact O-CB 3.38Å; L184-T188 PolarHBondContact O-N 3.46Å; L184-T188 PolarHBondContact O-OG1 3.07Å; L184-L217 HydrophobicContact CB-CD1 4.08Å; L184-L217 HydrophobicContact CB-CD2 4.03Å; L184-L217 HydrophobicContact CD1-CD2 4.01Å
185	Y	87.7	Confident	85.8	Confident	86 Å²	86	42.7 Å²	42.7	34%	0.337	20%	0.198	S	C	.	.	H	α-helix	trans	-56	-43	175	179.8	-88.2	0	0	0	111.3	C181 H182 L183 L187 L220 F241	C181-Y185 VanDerWaalsContact O-CB 3.27Å; C181-Y185 WeakPolarHBondContact O-CB 3.41Å; C181-Y185 PolarHBondContact O-N 3.18Å; H182-Y185 WeakPolarHBondContact O-CB 3.45Å; H182-Y185 PolarHBondContact O-N 3.32Å; L183-Y185 VanDerWaalsContact C-N 3.35Å; Y185-L187 PolarHBondContact O-N 2.93Å; Y185-L220 HydrophobicContact CD2-CB 3.98Å; Y185-L220 HydrophobicContact CD2-CD2 3.6Å; Y185-L220 HydrophobicContact CD2-CG 4.32Å; Y185-L220 HydrophobicContact CE2-CB 3.87Å; Y185-L220 HydrophobicContact CE2-CD1 4.25Å; Y185-L220 HydrophobicContact CE2-CD2 3.86Å; Y185-L220 HydrophobicContact CE2-CG 4.21Å; Y185-L220 HydrophobicContact CG-CD2 4.07Å; Y185-L220 WeakPolarHBondContact O-CD2 3.22Å; Y185-F241 HydrophobicContact CD1-CE2 4.31Å; Y185-F241 HydrophobicContact CD2-CE2 4.25Å; Y185-F241 HydrophobicContact CD2-CZ 4.49Å; Y185-F241 HydrophobicContact CG-CE2 4.03Å; Y185-F241 HydrophobicContact CG-CZ 4.28Å
186	L	84.5	Confident	86.1	Confident	45 Å²	45	43.6 Å²	43.6	24%	0.236	20%	0.197	C	C	.	.	H	α-helix	trans	-71.6	-25.8	176.9	-63	174.3	0	0	0	113.9	L148 F151 H182 L183 L184	L148-L186 HydrophobicContact CD2-CD1 3.97Å; F151-L186 HydrophobicContact CD1-CB 4.41Å; F151-L186 HydrophobicContact CD1-CD1 3.96Å; F151-L186 HydrophobicContact CD2-CD1 4.28Å; F151-L186 HydrophobicContact CE1-CB 3.76Å; F151-L186 HydrophobicContact CE1-CD1 4.16Å; F151-L186 HydrophobicContact CE1-CG 4.42Å; F151-L186 HydrophobicContact CE2-CB 4.08Å; F151-L186 HydrophobicContact CE2-CD1 4.47Å; F151-L186 HydrophobicContact CG-CD1 4.02Å; F151-L186 HydrophobicContact CZ-CB 3.57Å; F151-L186 HydrophobicContact CZ-CD1 4.41Å; H182-L186 WeakPolarHBondContact O-CG 3.38Å; H182-L186 PolarHBondContact O-N 3.31Å; H182-L186 VanDerWaalsContact O-N 3.14Å; L183-L186 PolarHBondContact O-N 3.13Å; L184-L186 VanDerWaalsContact C-N 3.26Å; L184-L186 PolarHBondContact O-N 3.4Å
187	L	86.1	Confident	86.3	Confident	1 Å²	1	45 Å²	45	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-96.3	-14.4	-177.6	-69.2	172.9	0	0	0	114.4	F151 L160 R161 Y164 I167 L183 L184 Y185 R189	F151-L187 HydrophobicContact CE2-CD2 3.84Å; F151-L187 HydrophobicContact CE2-CG 4.13Å; F151-L187 HydrophobicContact CZ-CD2 3.89Å; F151-L187 HydrophobicContact CZ-CG 4.32Å; L160-L187 HydrophobicContact CD2-CD1 4.19Å; L160-L187 HydrophobicContact CD2-CD2 3.84Å; L160-L187 HydrophobicContact CG-CD1 3.92Å; L160-L187 HydrophobicContact CG-CD2 3.95Å; R161-L187 HydrophobicContact CG-CD2 4.19Å; Y164-L187 HydrophobicContact CD2-CB 4.03Å; Y164-L187 HydrophobicContact CE2-CB 4.16Å; I167-L187 HydrophobicContact CD1-CD1 3.73Å; L183-L187 HydrophobicContact CD1-CD1 4.01Å; L183-L187 HydrophobicContact CD1-CG 4.38Å; L183-L187 HydrophobicContact CG-CD1 3.91Å; L183-L187 WeakPolarHBondContact O-CG 3.37Å; L183-L187 PolarHBondContact O-N 3.33Å; L183-L187 VanDerWaalsContact O-N 3.07Å; L184-L187 CarbonylContact O-C 3.48Å; L184-L187 PolarHBondContact O-N 3.43Å; L184-L187 VanDerWaalsContact O-N 3.07Å; Y185-L187 PolarHBondContact O-N 2.93Å; L187-R189 PolarHBondContact O-N 3.4Å
188	T	86.1	Confident	86.4	Confident	14 Å²	14	45.2 Å²	45.2	9%	0.086	20%	0.204	C	C	.	.			trans	-66.2	131.8	-171.9	-63.6	0	0	0	0	111.3	Y164 L184 V193 L220 Y221 F224	Y164-T188 PolarHBondContact OH-OG1 3.5Å; L184-T188 WeakPolarHBondContact O-CB 3.38Å; L184-T188 PolarHBondContact O-N 3.46Å; L184-T188 PolarHBondContact O-OG1 3.07Å; T188-V193 HydrophobicContact CG2-CG2 4.03Å; T188-L220 HydrophobicContact CG2-CD2 4.05Å; T188-L220 HydrophobicContact CG2-CG 4.43Å; T188-Y221 HydrophobicContact CG2-CD1 3.93Å; T188-Y221 HydrophobicContact CG2-CE1 3.6Å; T188-F224 HydrophobicContact CG2-CD2 4.01Å; T188-F224 HydrophobicContact CG2-CE2 3.91Å
189	R	83.4	Confident	86.5	Confident	101 Å²	101	51.6 Å²	51.6	38%	0.381	22%	0.223	S	C	.	.			trans	-123.2	165.4	167.9	-72.7	179.4	167	-179.4	-6.4	108.6	R161 L187 E191 N192	R161-R189 VanDerWaalsContact CZ-NH2 3.27Å; L187-R189 PolarHBondContact O-N 3.4Å; R189-E191 HydrophobicContact CB-CG 3.99Å; R189-E191 VanDerWaalsContact CD-OE1 3.29Å; R189-E191 WeakPolarHBondContact CD-OE1 3.48Å; R189-E191 IonicContact NH1-OE1 3.58Å; R189-E191 PolarHBondContact O-N 3.34Å; R189-E191 VanDerWaalsContact O-N 3.15Å; R189-N192 PolarHBondContact N-ND2 3.07Å; R189-N192 WeakPolarHBondContact O-CB 3.27Å; R189-N192 PolarHBondContact O-N 3.14Å
190	K	81.8	Confident	86.6	Confident	145 Å²	145	54.1 Å²	54.1	63%	0.63	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-51.3	-40.3	178.7	-169.6	176.1	-178.2	179	0	112.9	N192 V193 F224	K190-N192 PolarHBondContact O-N 3.25Å; K190-V193 PolarHBondContact O-N 3.49Å; K190-F224 HydrophobicContact CB-CD1 4.09Å; K190-F224 HydrophobicContact CG-CB 4.46Å
191	E	85.3	Confident	86.6	Confident	106 Å²	106	54 Å²	54	50%	0.495	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-61.9	-25.9	178	65.2	-168.6	158.4	0	0	114.9	R189 V193 R194	R189-E191 HydrophobicContact CB-CG 3.99Å; R189-E191 VanDerWaalsContact CD-OE1 3.29Å; R189-E191 WeakPolarHBondContact CD-OE1 3.48Å; R189-E191 IonicContact NH1-OE1 3.58Å; R189-E191 PolarHBondContact O-N 3.34Å; R189-E191 VanDerWaalsContact O-N 3.15Å; E191-V193 VanDerWaalsContact C-N 3.34Å; E191-R194 PolarHBondContact O-NE 2.91Å
192	N	82.1	Confident	86.5	Confident	16 Å²	16	56.7 Å²	56.7	9%	0.086	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-81.5	-17.2	-178.2	-66.8	-30.5	0	0	0	112.2	Y164 R189 K190 R194 R197	Y164-N192 HydrophobicContact CD1-CB 4.08Å; Y164-N192 HydrophobicContact CE1-CB 3.86Å; Y164-N192 HydrophobicContact CE2-CB 4.34Å; Y164-N192 HydrophobicContact CG-CB 4.43Å; R189-N192 PolarHBondContact N-ND2 3.07Å; R189-N192 WeakPolarHBondContact O-CB 3.27Å; R189-N192 PolarHBondContact O-N 3.14Å; K190-N192 PolarHBondContact O-N 3.25Å; N192-R194 PolarHBondContact O-N 3.03Å; N192-R194 VanDerWaalsContact O-N 3.15Å; N192-R197 WeakPolarHBondContact O-CD 3.37Å; N192-R197 PolarHBondContact O-NH1 3.04Å
193	V	86.9	Confident	86.6	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.042	26%	0.262	C	S	.	.			trans	-82.1	95.1	-179.4	-173.8	0	0	0	0	109.4	T188 K190 E191 V198 Y221 F224 C225 L228	T188-V193 HydrophobicContact CG2-CG2 4.03Å; K190-V193 PolarHBondContact O-N 3.49Å; E191-V193 VanDerWaalsContact C-N 3.34Å; V193-V198 HydrophobicContact CG1-CG2 4.44Å; V193-Y221 HydrophobicContact CB-CD2 4.48Å; V193-Y221 HydrophobicContact CB-CG 4.46Å; V193-Y221 HydrophobicContact CG1-CD2 3.82Å; V193-Y221 HydrophobicContact CG1-CE2 4.49Å; V193-Y221 HydrophobicContact CG1-CG 3.88Å; V193-Y221 HydrophobicContact CG2-CD1 3.83Å; V193-Y221 HydrophobicContact CG2-CD2 4.34Å; V193-Y221 HydrophobicContact CG2-CE1 4.16Å; V193-Y221 HydrophobicContact CG2-CG 3.92Å; V193-F224 HydrophobicContact CG2-CB 3.94Å; V193-F224 HydrophobicContact CG2-CD2 4.18Å; V193-F224 HydrophobicContact CG2-CG 4.44Å; V193-C225 HydrophobicContact CG1-CB 3.9Å; V193-L228 HydrophobicContact CG1-CD1 4.42Å
194	R	87.6	Confident	86.5	Confident	141 Å²	141	60.1 Å²	60.1	53%	0.532	26%	0.264	S	S	.	.			trans	-119.6	148.6	-178.9	-59	-66.8	-178.7	157.4	3.9	110.6	E191 N192 F196 R197 V198	E191-R194 PolarHBondContact O-NE 2.91Å; N192-R194 PolarHBondContact O-N 3.03Å; N192-R194 VanDerWaalsContact O-N 3.15Å; R194-F196 VanDerWaalsContact C-N 3.28Å; R194-F196 HydrophobicContact CB-CD1 3.67Å; R194-F196 HydrophobicContact CB-CE1 3.44Å; R194-F196 VanDerWaalsContact CB-CE1 3.44Å; R194-F196 HydrophobicContact CB-CZ 4.32Å; R194-F196 HydrophobicContact CG-CE1 3.97Å; R194-F196 PolarHBondContact O-N 3.43Å; R194-R197 PolarHBondContact O-N 3.26Å; R194-V198 PolarHBondContact O-N 3.31Å; R194-V198 VanDerWaalsContact O-N 3.12Å
195	V	85.4	Confident	86.3	Confident	74 Å²	74	61.4 Å²	61.4	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-53.2	-41.3	-175.5	-170.1	0	0	0	0	112.9	R197 V198 R199 L228	V195-R197 VanDerWaalsContact C-N 3.34Å; V195-R197 PolarHBondContact O-N 2.93Å; V195-V198 PolarHBondContact O-N 3.09Å; V195-R199 PolarHBondContact O-N 3.34Å; V195-L228 HydrophobicContact CG2-CD1 4.26Å; V195-L228 HydrophobicContact CG2-CD2 3.77Å
196	F	88.3	Confident	86.2	Confident	117 Å²	117	61.9 Å²	61.9	51%	0.513	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-32.9	-179.9	73.7	-90.4	0	0	0	112.9	R194 K200	R194-F196 VanDerWaalsContact C-N 3.28Å; R194-F196 HydrophobicContact CB-CD1 3.67Å; R194-F196 HydrophobicContact CB-CE1 3.44Å; R194-F196 VanDerWaalsContact CB-CE1 3.44Å; R194-F196 HydrophobicContact CB-CZ 4.32Å; R194-F196 HydrophobicContact CG-CE1 3.97Å; R194-F196 PolarHBondContact O-N 3.43Å; F196-K200 WeakPolarHBondContact O-CB 3.34Å; F196-K200 PolarHBondContact O-N 3.13Å
197	R	90.6	Very high	86.2	Confident	31 Å²	31	66 Å²	66	12%	0.117	30%	0.302	C	S	.	.	H	α-helix	trans	-72.9	-40.3	176.5	-64.6	-170.6	179.6	118.1	0.4	111.1	F168 N192 R194 V195 K200 L201 Y221	F168-R197 HydrophobicContact CD1-CG 4.21Å; F168-R197 HydrophobicContact CD2-CG 4.43Å; F168-R197 HydrophobicContact CE1-CB 4.1Å; F168-R197 HydrophobicContact CE1-CG 3.94Å; F168-R197 HydrophobicContact CE2-CB 3.88Å; F168-R197 HydrophobicContact CE2-CG 4.19Å; F168-R197 HydrophobicContact CG-CG 4.45Å; F168-R197 HydrophobicContact CZ-CB 3.62Å; F168-R197 HydrophobicContact CZ-CG 3.95Å; F168-R197 WeakPolarHBondContact CZ-O 3.24Å; N192-R197 WeakPolarHBondContact O-CD 3.37Å; N192-R197 PolarHBondContact O-NH1 3.04Å; R194-R197 PolarHBondContact O-N 3.26Å; V195-R197 VanDerWaalsContact C-N 3.34Å; V195-R197 PolarHBondContact O-N 2.93Å; R197-K200 PolarHBondContact O-N 3.46Å; R197-L201 WeakPolarHBondContact O-CG 3.5Å; R197-L201 PolarHBondContact O-N 3.16Å; R197-Y221 HydrophobicContact CB-CE2 4.09Å
198	V	87.9	Confident	85.9	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.024	31%	0.31	C	S	.	.	H	α-helix	trans	-58.9	-51.2	172.6	178.1	0	0	0	0	109.9	V193 R194 V195 K200 L201 L202 Y221 L228 V229	V193-V198 HydrophobicContact CG1-CG2 4.44Å; R194-V198 PolarHBondContact O-N 3.31Å; R194-V198 VanDerWaalsContact O-N 3.12Å; V195-V198 PolarHBondContact O-N 3.09Å; V198-K200 VanDerWaalsContact C-N 3.28Å; V198-K200 PolarHBondContact O-N 3.1Å; V198-L201 PolarHBondContact O-N 2.68Å; V198-L201 VanDerWaalsContact O-N 3.13Å; V198-L202 HydrophobicContact CG1-CD1 4Å; V198-L202 HydrophobicContact CG1-CG 4.34Å; V198-L202 WeakPolarHBondContact O-CG 3.45Å; V198-L202 PolarHBondContact O-N 2.7Å; V198-Y221 HydrophobicContact CG2-CD2 3.81Å; V198-Y221 HydrophobicContact CG2-CE2 4.45Å; V198-L228 WeakPolarHBondContact CG1-O 3.47Å; V198-L228 HydrophobicContact CG2-CB 4.33Å; V198-V229 HydrophobicContact CG1-CG2 4.04Å; V198-V229 HydrophobicContact CG2-CG2 4.26Å
199	R	87.5	Confident	85.5	Confident	167 Å²	167	68.4 Å²	68.4	63%	0.63	32%	0.322	S	S	*	.	H	α-helix	trans	-54.4	-43.9	176.2	-80.7	-171.2	-88.6	171.4	-10.4	112.2	V195 L202 E203	V195-R199 PolarHBondContact O-N 3.34Å; R199-L202 PolarHBondContact O-N 2.95Å; R199-E203 PolarHBondContact O-N 3.17Å
200	K	88.6	Confident	85.1	Confident	71 Å²	71	72.8 Å²	72.8	31%	0.309	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-41.2	178.3	-163.1	72.1	-174.2	166.8	0	112.7	F168 F196 R197 V198 L202 E203 Q204	F168-K200 HydrophobicContact CE1-CB 3.95Å; F168-K200 HydrophobicContact CE1-CG 4.05Å; F168-K200 HydrophobicContact CZ-CB 4.03Å; F168-K200 HydrophobicContact CZ-CG 4.42Å; F196-K200 WeakPolarHBondContact O-CB 3.34Å; F196-K200 PolarHBondContact O-N 3.13Å; R197-K200 PolarHBondContact O-N 3.46Å; V198-K200 VanDerWaalsContact C-N 3.28Å; V198-K200 PolarHBondContact O-N 3.1Å; K200-L202 VanDerWaalsContact C-N 3.33Å; K200-L202 PolarHBondContact O-N 2.61Å; K200-E203 WeakPolarHBondContact CD-OE2 3.32Å; K200-E203 WeakPolarHBondContact CE-OE2 3.48Å; K200-E203 IonicContact NZ-OE1 2.88Å; K200-E203 IonicContact NZ-OE2 3.8Å; K200-E203 PolarHBondContact NZ-OE2 2.9Å; K200-E203 WeakPolarHBondContact O-CB 3.48Å; K200-E203 PolarHBondContact O-N 3.02Å; K200-Q204 WeakPolarHBondContact O-CG 3.44Å; K200-Q204 PolarHBondContact O-N 2.84Å
201	L	88.3	Confident	85	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-37.8	175.8	-71.9	172.5	0	0	0	112.2	F168 V171 R197 V198 Q204 Q205 L214 L217 L218 Y221	F168-L201 HydrophobicContact CE2-CD1 4.22Å; F168-L201 HydrophobicContact CE2-CD2 4.03Å; F168-L201 HydrophobicContact CE2-CG 3.94Å; F168-L201 HydrophobicContact CZ-CD2 4.32Å; F168-L201 HydrophobicContact CZ-CG 4.02Å; V171-L201 HydrophobicContact CG1-CD2 3.88Å; R197-L201 WeakPolarHBondContact O-CG 3.5Å; R197-L201 PolarHBondContact O-N 3.16Å; V198-L201 PolarHBondContact O-N 2.68Å; V198-L201 VanDerWaalsContact O-N 3.13Å; L201-Q204 PolarHBondContact O-N 2.8Å; L201-Q205 WeakPolarHBondContact O-CB 3.39Å; L201-Q205 PolarHBondContact O-N 3.3Å; L201-L214 HydrophobicContact CD2-CD2 3.82Å; L201-L217 HydrophobicContact CD1-CD2 3.92Å; L201-L217 HydrophobicContact CD1-CG 4.06Å; L201-L217 HydrophobicContact CD2-CD2 3.85Å; L201-L218 HydrophobicContact CB-CD2 3.77Å; L201-L218 HydrophobicContact CB-CG 4.19Å; L201-L218 HydrophobicContact CD1-CD2 4.08Å; L201-L218 HydrophobicContact CD1-CG 4.44Å; L201-Y221 HydrophobicContact CD1-CD2 3.96Å; L201-Y221 HydrophobicContact CD1-CE2 3.65Å
202	L	86.3	Confident	84.7	Confident	56 Å²	56	66.7 Å²	66.7	29%	0.293	32%	0.316	S	S	.	.	H	α-helix	trans	-66.3	-41.2	174.3	-66.5	177.2	0	0	0	112	V198 R199 K200 Q204 Q205 S206 L218 L231	V198-L202 HydrophobicContact CG1-CD1 4Å; V198-L202 HydrophobicContact CG1-CG 4.34Å; V198-L202 WeakPolarHBondContact O-CG 3.45Å; V198-L202 PolarHBondContact O-N 2.7Å; R199-L202 PolarHBondContact O-N 2.95Å; K200-L202 VanDerWaalsContact C-N 3.33Å; K200-L202 PolarHBondContact O-N 2.61Å; L202-Q204 VanDerWaalsContact C-N 3.3Å; L202-Q204 PolarHBondContact O-N 3.1Å; L202-Q205 WeakPolarHBondContact O-CB 3.2Å; L202-Q205 PolarHBondContact O-N 3.32Å; L202-S206 PolarHBondContact O-N 3.49Å; L202-L218 HydrophobicContact CD2-CD1 4.13Å; L202-L218 HydrophobicContact CD2-CD2 4.23Å; L202-L231 HydrophobicContact CD2-CD1 3.26Å; L202-L231 HydrophobicContact CD2-CG 4.14Å
203	E	87.9	Confident	84.6	Confident	70 Å²	70	67.3 Å²	67.3	33%	0.327	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-37.8	173.7	-165.3	-156.5	152	0	0	111.7	R199 K200 S206 K207	R199-E203 PolarHBondContact O-N 3.17Å; K200-E203 WeakPolarHBondContact CD-OE2 3.32Å; K200-E203 WeakPolarHBondContact CE-OE2 3.48Å; K200-E203 IonicContact NZ-OE1 2.88Å; K200-E203 IonicContact NZ-OE2 3.8Å; K200-E203 PolarHBondContact NZ-OE2 2.9Å; K200-E203 WeakPolarHBondContact O-CB 3.48Å; K200-E203 PolarHBondContact O-N 3.02Å; E203-S206 PolarHBondContact O-N 3.32Å; E203-S206 PolarHBondContact O-OG 3.29Å; E203-K207 WeakPolarHBondContact O-CG 3.25Å; E203-K207 PolarHBondContact O-N 3.4Å; E203-K207 WeakPolarHBondContact OE1-CE 3.33Å; E203-K207 IonicContact OE1-NZ 3.71Å; E203-K207 PolarHBondContact OE1-NZ 3.15Å
204	Q	85.8	Confident	84.6	Confident	10 Å²	10	67 Å²	67	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-70.2	-38.9	175	-67.5	-58.1	-53.7	0	0	111.7	V171 K200 L201 L202 S206 K207 L208 L214	V171-Q204 HydrophobicContact CG1-CG 4.29Å; K200-Q204 WeakPolarHBondContact O-CG 3.44Å; K200-Q204 PolarHBondContact O-N 2.84Å; L201-Q204 PolarHBondContact O-N 2.8Å; L202-Q204 VanDerWaalsContact C-N 3.3Å; L202-Q204 PolarHBondContact O-N 3.1Å; Q204-S206 VanDerWaalsContact C-N 3.33Å; Q204-S206 PolarHBondContact O-N 3.26Å; Q204-K207 PolarHBondContact O-N 3.2Å; Q204-L208 WeakPolarHBondContact O-CB 3.46Å; Q204-L208 PolarHBondContact O-N 2.89Å; Q204-L214 HydrophobicContact CB-CD1 4.24Å; Q204-L214 HydrophobicContact CB-CD2 4.4Å
205	Q	85.3	Confident	84.4	Confident	27 Å²	27	61.1 Å²	61.1	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-37	174.1	-178.7	-179	70.1	0	0	112.2	L201 L202 K207 G209	L201-Q205 WeakPolarHBondContact O-CB 3.39Å; L201-Q205 PolarHBondContact O-N 3.3Å; L202-Q205 WeakPolarHBondContact O-CB 3.2Å; L202-Q205 PolarHBondContact O-N 3.32Å; Q205-K207 VanDerWaalsContact C-N 3.3Å; Q205-K207 PolarHBondContact O-N 3.32Å; Q205-G209 CarbonylContact O-C 3.09Å; Q205-G209 WeakPolarHBondContact O-CA 3.14Å; Q205-G209 PolarHBondContact O-N 3.14Å
206	S	84.1	Confident	84.1	Confident	96 Å²	96	60 Å²	60	67%	0.671	28%	0.283	S	S	*	.	H	α-helix	trans	-67.8	-30.4	176	60.3	0	0	0	0	112.6	L202 E203 Q204	L202-S206 PolarHBondContact O-N 3.49Å; E203-S206 PolarHBondContact O-N 3.32Å; E203-S206 PolarHBondContact O-OG 3.29Å; Q204-S206 VanDerWaalsContact C-N 3.33Å; Q204-S206 PolarHBondContact O-N 3.26Å
207	K	84.9	Confident	84	Confident	131 Å²	131	54.4 Å²	54.4	57%	0.57	26%	0.259	S	S	*	.	H	α-helix	trans	-79.8	-46.4	177.8	-69.7	176.6	-172.2	176.8	0	112.9	E203 Q204 Q205	E203-K207 WeakPolarHBondContact O-CG 3.25Å; E203-K207 PolarHBondContact O-N 3.4Å; E203-K207 WeakPolarHBondContact OE1-CE 3.33Å; E203-K207 IonicContact OE1-NZ 3.71Å; E203-K207 PolarHBondContact OE1-NZ 3.15Å; Q204-K207 PolarHBondContact O-N 3.2Å; Q205-K207 VanDerWaalsContact C-N 3.3Å; Q205-K207 PolarHBondContact O-N 3.32Å
208	L	79.8	Confident	83.7	Confident	33 Å²	33	53.1 Å²	53.1	17%	0.173	25%	0.254	C	S	.	.	H	α-helix	trans	-96.2	-6	-172.2	-62.5	171.1	0	0	0	113.7	E174 Q204 Q211 L214	E174-L208 HydrophobicContact CG-CD2 3.99Å; Q204-L208 WeakPolarHBondContact O-CB 3.46Å; Q204-L208 PolarHBondContact O-N 2.89Å; L208-Q211 HydrophobicContact CB-CG 4.08Å; L208-Q211 WeakPolarHBondContact O-CG 3.14Å; L208-Q211 PolarHBondContact O-NE2 3.25Å; L208-L214 HydrophobicContact CD1-CD1 4.41Å
209	G	77.1	Confident	83.4	Confident	33 Å²	33	54.3 Å²	54.3	34%	0.34	26%	0.262	S	S	.	.			trans	78.5	-171.2	-172.8	0	0	0	0	0	113.5	Q205 Q211	Q205-G209 CarbonylContact O-C 3.09Å; Q205-G209 WeakPolarHBondContact O-CA 3.14Å; Q205-G209 PolarHBondContact O-N 3.14Å; G209-Q211 PolarHBondContact O-N 3.25Å
210	R	75.2	Confident	83.2	Confident	193 Å²	193	47.7 Å²	47.7	73%	0.728	24%	0.239	S	C	*	.	S	Bend	trans	-75	65.7	-178.2	-71.3	-175.8	178.7	179	-0.1	112.4	L215	R210-L215 HydrophobicContact CB-CD1 4.19Å
211	Q	80.4	Confident	83.1	Confident	72 Å²	72	44.3 Å²	44.3	34%	0.336	23%	0.225	S	C	.	.			trans	-73.5	138.4	179.9	-62.7	-66.6	-19.8	0	0	111.3	L208 G209 Y213 L214 L215	L208-Q211 HydrophobicContact CB-CG 4.08Å; L208-Q211 WeakPolarHBondContact O-CG 3.14Å; L208-Q211 PolarHBondContact O-NE2 3.25Å; G209-Q211 PolarHBondContact O-N 3.25Å; Q211-Y213 HydrophobicContact CB-CD1 4.1Å; Q211-Y213 HydrophobicContact CB-CD2 4.47Å; Q211-Y213 HydrophobicContact CB-CE1 3.56Å; Q211-Y213 HydrophobicContact CB-CE2 3.95Å; Q211-Y213 VanDerWaalsContact CB-CZ 3.47Å; Q211-Y213 HydrophobicContact CG-CE1 4.04Å; Q211-Y213 WeakPolarHBondContact CG-OH 3.46Å; Q211-Y213 PolarHBondContact O-N 3.41Å; Q211-L214 HydrophobicContact CB-CD1 4.38Å; Q211-L214 PolarHBondContact O-N 3.29Å; Q211-L215 WeakPolarHBondContact O-CG 3.49Å; Q211-L215 PolarHBondContact O-N 3.49Å
212	P	78.3	Confident	82.7	Confident	51 Å²	51	47.5 Å²	47.5	33%	0.331	24%	0.238	S	C	.	.	H	α-helix	trans	-56.6	-48	-177.7	-26	33.7	0	0	0	113.1	L214 L215 Y216	P212-L214 VanDerWaalsContact C-N 3.32Å; P212-L214 PolarHBondContact O-N 2.92Å; P212-L215 PolarHBondContact O-N 2.95Å; P212-L215 VanDerWaalsContact O-N 3.11Å; P212-Y216 VanDerWaalsContact O-CD2 3.27Å; P212-Y216 WeakPolarHBondContact O-CD2 3.46Å; P212-Y216 PolarHBondContact O-N 3.29Å
213	Y	81.6	Confident	82.3	Confident	30 Å²	30	50.3 Å²	50.3	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-35.8	-175.8	52.3	-96.6	0	0	0	113.6	C177 P178 C181 Q211 L217	C177-Y213 HydrophobicContact CB-CE2 4.15Å; C177-Y213 VanDerWaalsContact SG-CE2 3.54Å; P178-Y213 HydrophobicContact CB-CD1 3.92Å; P178-Y213 HydrophobicContact CB-CE1 4.18Å; P178-Y213 HydrophobicContact CB-CG 4.16Å; P178-Y213 HydrophobicContact CG-CD1 4.1Å; P178-Y213 HydrophobicContact CG-CE1 3.82Å; P178-Y213 HydrophobicContact CG-CE2 4.48Å; C181-Y213 HydrophobicContact CB-CD2 4.13Å; Q211-Y213 HydrophobicContact CB-CD1 4.1Å; Q211-Y213 HydrophobicContact CB-CD2 4.47Å; Q211-Y213 HydrophobicContact CB-CE1 3.56Å; Q211-Y213 HydrophobicContact CB-CE2 3.95Å; Q211-Y213 VanDerWaalsContact CB-CZ 3.47Å; Q211-Y213 HydrophobicContact CG-CE1 4.04Å; Q211-Y213 WeakPolarHBondContact CG-OH 3.46Å; Q211-Y213 PolarHBondContact O-N 3.41Å; Y213-L217 PolarHBondContact O-N 3.49Å
214	L	85.8	Confident	81.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72.2	-41.2	174.8	-75.8	169.6	0	0	0	111.7	V171 L201 Q204 L208 Q211 P212 Y216 L217 L218	V171-L214 HydrophobicContact CG1-CD2 4.26Å; L201-L214 HydrophobicContact CD2-CD2 3.82Å; Q204-L214 HydrophobicContact CB-CD1 4.24Å; Q204-L214 HydrophobicContact CB-CD2 4.4Å; L208-L214 HydrophobicContact CD1-CD1 4.41Å; Q211-L214 HydrophobicContact CB-CD1 4.38Å; Q211-L214 PolarHBondContact O-N 3.29Å; P212-L214 VanDerWaalsContact C-N 3.32Å; P212-L214 PolarHBondContact O-N 2.92Å; L214-Y216 VanDerWaalsContact C-N 3.31Å; L214-Y216 PolarHBondContact O-N 3.13Å; L214-L217 PolarHBondContact O-N 2.95Å; L214-L218 WeakPolarHBondContact O-CB 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.4Å; L214-L218 PolarHBondContact O-N 3.36Å
215	L	83.3	Confident	81.5	Confident	18 Å²	18	51 Å²	51	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-36.3	178.6	-71.9	167.6	0	0	0	112.2	R210 Q211 P212 L218 S219 M237	R210-L215 HydrophobicContact CB-CD1 4.19Å; Q211-L215 WeakPolarHBondContact O-CG 3.49Å; Q211-L215 PolarHBondContact O-N 3.49Å; P212-L215 PolarHBondContact O-N 2.95Å; P212-L215 VanDerWaalsContact O-N 3.11Å; L215-L218 PolarHBondContact O-N 2.74Å; L215-S219 WeakPolarHBondContact O-CB 3.43Å; L215-S219 PolarHBondContact O-N 3.28Å; L215-S219 PolarHBondContact O-OG 3.39Å; L215-M237 VanDerWaalsContact C-CE 3.41Å; L215-M237 HydrophobicContact CB-CE 3.41Å; L215-M237 VanDerWaalsContact CB-CE 3.41Å; L215-M237 HydrophobicContact CB-SD 3.39Å; L215-M237 WeakPolarHBondContact CB-SD 3.47Å; L215-M237 HydrophobicContact CD1-SD 3.7Å; L215-M237 HydrophobicContact CG-SD 4.11Å
216	Y	79.8	Confident	81	Confident	50 Å²	50	53.7 Å²	53.7	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-36.4	176.5	-90	-94.4	0	0	0	112.5	P212 L214 S219 L220 M237 G240 F241	P212-Y216 VanDerWaalsContact O-CD2 3.27Å; P212-Y216 WeakPolarHBondContact O-CD2 3.46Å; P212-Y216 PolarHBondContact O-N 3.29Å; L214-Y216 VanDerWaalsContact C-N 3.31Å; L214-Y216 PolarHBondContact O-N 3.13Å; Y216-S219 WeakPolarHBondContact CA-OG 3.46Å; Y216-S219 PolarHBondContact O-OG 2.99Å; Y216-L220 PolarHBondContact O-N 3.31Å; Y216-L220 VanDerWaalsContact O-N 3.13Å; Y216-M237 HydrophobicContact CD1-CE 4.44Å; Y216-M237 HydrophobicContact CD2-CE 3.4Å; Y216-M237 HydrophobicContact CD2-CG 4.09Å; Y216-M237 HydrophobicContact CD2-SD 4.46Å; Y216-M237 HydrophobicContact CE2-CB 3.78Å; Y216-M237 HydrophobicContact CE2-CE 3.67Å; Y216-M237 HydrophobicContact CE2-CG 3.5Å; Y216-M237 VanDerWaalsContact CE2-CG 3.5Å; Y216-M237 HydrophobicContact CE2-SD 4.4Å; Y216-M237 HydrophobicContact CG-CE 3.83Å; Y216-M237 PolarHBondContact OH-O 2.73Å; Y216-G240 VanDerWaalsContact CE2-N 3.29Å; Y216-G240 VanDerWaalsContact CZ-CA 3.48Å; Y216-G240 VanDerWaalsContact CZ-N 3.35Å; Y216-G240 PolarHBondContact OH-N 2.83Å; Y216-F241 HydrophobicContact CD1-CE2 4.28Å; Y216-F241 HydrophobicContact CG-CE2 4.08Å; Y216-F241 HydrophobicContact CG-CZ 4.49Å
217	L	86.1	Confident	80.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71.2	-40.8	174.1	-172.4	60.6	0	0	0	111.3	L184 L201 Y213 L214 L220 Y221	L184-L217 HydrophobicContact CB-CD1 4.08Å; L184-L217 HydrophobicContact CB-CD2 4.03Å; L184-L217 HydrophobicContact CD1-CD2 4.01Å; L201-L217 HydrophobicContact CD1-CD2 3.92Å; L201-L217 HydrophobicContact CD1-CG 4.06Å; L201-L217 HydrophobicContact CD2-CD2 3.85Å; Y213-L217 PolarHBondContact O-N 3.49Å; L214-L217 PolarHBondContact O-N 2.95Å; L217-L220 PolarHBondContact O-N 3.32Å; L217-Y221 HydrophobicContact CD1-CD1 4.14Å; L217-Y221 HydrophobicContact CD1-CE1 3.68Å; L217-Y221 HydrophobicContact CG-CD1 4.34Å; L217-Y221 HydrophobicContact CG-CE1 4Å; L217-Y221 VanDerWaalsContact O-CD1 3.24Å; L217-Y221 WeakPolarHBondContact O-CD1 3.04Å; L217-Y221 PolarHBondContact O-N 3.13Å
218	L	85	Confident	79.6	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-36.1	175	-77.4	168.8	0	0	0	112.6	L201 L202 L214 L215 Y221 K222	L201-L218 HydrophobicContact CB-CD2 3.77Å; L201-L218 HydrophobicContact CB-CG 4.19Å; L201-L218 HydrophobicContact CD1-CD2 4.08Å; L201-L218 HydrophobicContact CD1-CG 4.44Å; L202-L218 HydrophobicContact CD2-CD1 4.13Å; L202-L218 HydrophobicContact CD2-CD2 4.23Å; L214-L218 WeakPolarHBondContact O-CB 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.4Å; L214-L218 PolarHBondContact O-N 3.36Å; L215-L218 PolarHBondContact O-N 2.74Å; L218-Y221 PolarHBondContact O-N 3.43Å; L218-K222 WeakPolarHBondContact O-CB 3.29Å; L218-K222 PolarHBondContact O-N 3.11Å
219	S	81.5	Confident	79	Confident	29 Å²	29	53 Å²	53	20%	0.203	27%	0.272	C	S	.	.	H	α-helix	trans	-67.3	-41.7	174.7	69.1	0	0	0	0	111.5	L215 Y216 Y221 K222 V223 I233	L215-S219 WeakPolarHBondContact O-CB 3.43Å; L215-S219 PolarHBondContact O-N 3.28Å; L215-S219 PolarHBondContact O-OG 3.39Å; Y216-S219 WeakPolarHBondContact CA-OG 3.46Å; Y216-S219 PolarHBondContact O-OG 2.99Å; S219-Y221 VanDerWaalsContact C-N 3.31Å; S219-Y221 PolarHBondContact O-N 2.94Å; S219-K222 WeakPolarHBondContact O-CB 3.25Å; S219-K222 PolarHBondContact O-N 2.7Å; S219-V223 WeakPolarHBondContact O-CG2 3.47Å; S219-V223 PolarHBondContact O-N 3.15Å; S219-I233 VanDerWaalsContact CA-CD1 3.42Å
220	L	81.9	Confident	77.9	Confident	28 Å²	28	57.8 Å²	57.8	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-42	172.9	-172	64.7	0	0	0	111.4	Y185 T188 Y216 L217 K222 V223 F224	Y185-L220 HydrophobicContact CD2-CB 3.98Å; Y185-L220 HydrophobicContact CD2-CD2 3.6Å; Y185-L220 HydrophobicContact CD2-CG 4.32Å; Y185-L220 HydrophobicContact CE2-CB 3.87Å; Y185-L220 HydrophobicContact CE2-CD1 4.25Å; Y185-L220 HydrophobicContact CE2-CD2 3.86Å; Y185-L220 HydrophobicContact CE2-CG 4.21Å; Y185-L220 HydrophobicContact CG-CD2 4.07Å; Y185-L220 WeakPolarHBondContact O-CD2 3.22Å; T188-L220 HydrophobicContact CG2-CD2 4.05Å; T188-L220 HydrophobicContact CG2-CG 4.43Å; Y216-L220 PolarHBondContact O-N 3.31Å; Y216-L220 VanDerWaalsContact O-N 3.13Å; L217-L220 PolarHBondContact O-N 3.32Å; L220-K222 VanDerWaalsContact C-N 3.35Å; L220-K222 PolarHBondContact O-N 3.11Å; L220-V223 PolarHBondContact O-N 3.4Å; L220-F224 HydrophobicContact CD1-CD2 4.23Å; L220-F224 HydrophobicContact CD1-CE2 3.62Å; L220-F224 HydrophobicContact CD1-CZ 4.28Å; L220-F224 HydrophobicContact CD2-CE2 4.21Å; L220-F224 HydrophobicContact CG-CD2 4.01Å; L220-F224 HydrophobicContact CG-CE2 3.65Å; L220-F224 WeakPolarHBondContact O-CD2 3.43Å; L220-F224 PolarHBondContact O-N 3.09Å; L220-F224 VanDerWaalsContact O-N 3.14Å
221	Y	86.1	Confident	77.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-38.7	175.7	-81.3	30.6	0	0	0	112.1	Y164 T188 V193 R197 V198 L201 L217 L218 S219 F224 C225	Y164-Y221 PolarHBondContact OH-OH 3.3Å; T188-Y221 HydrophobicContact CG2-CD1 3.93Å; T188-Y221 HydrophobicContact CG2-CE1 3.6Å; V193-Y221 HydrophobicContact CB-CD2 4.48Å; V193-Y221 HydrophobicContact CB-CG 4.46Å; V193-Y221 HydrophobicContact CG1-CD2 3.82Å; V193-Y221 HydrophobicContact CG1-CE2 4.49Å; V193-Y221 HydrophobicContact CG1-CG 3.88Å; V193-Y221 HydrophobicContact CG2-CD1 3.83Å; V193-Y221 HydrophobicContact CG2-CD2 4.34Å; V193-Y221 HydrophobicContact CG2-CE1 4.16Å; V193-Y221 HydrophobicContact CG2-CG 3.92Å; R197-Y221 HydrophobicContact CB-CE2 4.09Å; V198-Y221 HydrophobicContact CG2-CD2 3.81Å; V198-Y221 HydrophobicContact CG2-CE2 4.45Å; L201-Y221 HydrophobicContact CD1-CD2 3.96Å; L201-Y221 HydrophobicContact CD1-CE2 3.65Å; L217-Y221 HydrophobicContact CD1-CD1 4.14Å; L217-Y221 HydrophobicContact CD1-CE1 3.68Å; L217-Y221 HydrophobicContact CG-CD1 4.34Å; L217-Y221 HydrophobicContact CG-CE1 4Å; L217-Y221 VanDerWaalsContact O-CD1 3.24Å; L217-Y221 WeakPolarHBondContact O-CD1 3.04Å; L217-Y221 PolarHBondContact O-N 3.13Å; L218-Y221 PolarHBondContact O-N 3.43Å; S219-Y221 VanDerWaalsContact C-N 3.31Å; S219-Y221 PolarHBondContact O-N 2.94Å; Y221-F224 PolarHBondContact O-N 3.38Å; Y221-C225 PolarHBondContact O-N 3.08Å
222	K	80.8	Confident	75.7	Confident	67 Å²	67	53.5 Å²	53.5	29%	0.291	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-38.8	175.1	-171.8	173.8	-173.9	175.1	0	112.3	L218 S219 L220 F224 C225 P226 V229 L231 I233	L218-K222 WeakPolarHBondContact O-CB 3.29Å; L218-K222 PolarHBondContact O-N 3.11Å; S219-K222 WeakPolarHBondContact O-CB 3.25Å; S219-K222 PolarHBondContact O-N 2.7Å; L220-K222 VanDerWaalsContact C-N 3.35Å; L220-K222 PolarHBondContact O-N 3.11Å; K222-F224 VanDerWaalsContact C-N 3.33Å; K222-C225 CarbonylContact O-C 3.43Å; K222-P226 WeakPolarHBondContact O-CA 3.41Å; K222-P226 WeakPolarHBondContact O-CD 3.28Å; K222-P226 VanDerWaalsContact O-N 3.11Å; K222-V229 HydrophobicContact CB-CB 3.84Å; K222-V229 HydrophobicContact CB-CG1 4.05Å; K222-V229 HydrophobicContact CB-CG2 4.27Å; K222-V229 HydrophobicContact CD-CB 4.5Å; K222-V229 HydrophobicContact CD-CG1 4.4Å; K222-V229 WeakPolarHBondContact CE-O 3.33Å; K222-V229 HydrophobicContact CG-CB 4.07Å; K222-V229 HydrophobicContact CG-CG1 4.41Å; K222-L231 PolarHBondContact NZ-O 3.39Å; K222-I233 HydrophobicContact CB-CD1 4.07Å; K222-I233 HydrophobicContact CD-CD1 3.61Å; K222-I233 HydrophobicContact CD-CG1 4.1Å; K222-I233 HydrophobicContact CG-CD1 4.47Å
223	V	77.4	Confident	74.6	Confident	116 Å²	116	53.1 Å²	53.1	70%	0.703	29%	0.291	S	S	*	.	H	α-helix	trans	-62.8	-40.9	175	170.5	0	0	0	0	110.9	S219 L220	S219-V223 WeakPolarHBondContact O-CG2 3.47Å; S219-V223 PolarHBondContact O-N 3.15Å; L220-V223 PolarHBondContact O-N 3.4Å
224	F	79.2	Confident	73.1	Confident	68 Å²	68	54.7 Å²	54.7	30%	0.298	31%	0.305	S	S	.	.	H	α-helix	trans	-77.3	-37.4	-179.8	-74.9	-55.9	0	0	0	114.3	T188 K190 V193 L220 Y221 K222	T188-F224 HydrophobicContact CG2-CD2 4.01Å; T188-F224 HydrophobicContact CG2-CE2 3.91Å; K190-F224 HydrophobicContact CB-CD1 4.09Å; K190-F224 HydrophobicContact CG-CB 4.46Å; V193-F224 HydrophobicContact CG2-CB 3.94Å; V193-F224 HydrophobicContact CG2-CD2 4.18Å; V193-F224 HydrophobicContact CG2-CG 4.44Å; L220-F224 HydrophobicContact CD1-CD2 4.23Å; L220-F224 HydrophobicContact CD1-CE2 3.62Å; L220-F224 HydrophobicContact CD1-CZ 4.28Å; L220-F224 HydrophobicContact CD2-CE2 4.21Å; L220-F224 HydrophobicContact CG-CD2 4.01Å; L220-F224 HydrophobicContact CG-CE2 3.65Å; L220-F224 WeakPolarHBondContact O-CD2 3.43Å; L220-F224 PolarHBondContact O-N 3.09Å; L220-F224 VanDerWaalsContact O-N 3.14Å; Y221-F224 PolarHBondContact O-N 3.38Å; K222-F224 VanDerWaalsContact C-N 3.33Å
225	C	78.8	Confident	71.1	Confident	27 Å²	27	61 Å²	61	18%	0.182	35%	0.35	C	S	.	.			trans	-142.6	82.1	-178.4	-65.1	0	0	0	0	110.2	V193 Y221 K222 E227 L228	V193-C225 HydrophobicContact CG1-CB 3.9Å; Y221-C225 PolarHBondContact O-N 3.08Å; K222-C225 CarbonylContact O-C 3.43Å; C225-E227 VanDerWaalsContact C-N 3.25Å; C225-E227 PolarHBondContact O-N 2.87Å; C225-L228 HydrophobicContact CB-CB 4.32Å; C225-L228 HydrophobicContact CB-CD1 3.86Å; C225-L228 HydrophobicContact CB-CG 4.06Å; C225-L228 PolarHBondContact O-N 3.34Å; C225-L228 VanDerWaalsContact O-N 3.15Å
226	P	73.5	Confident	69.2	Low	83 Å²	83	71.1 Å²	71.1	54%	0.539	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-62.6	-31.1	-173.7	22.6	-32.9	0	0	0	113.3	K222 L228 V229	K222-P226 WeakPolarHBondContact O-CA 3.41Å; K222-P226 WeakPolarHBondContact O-CD 3.28Å; K222-P226 VanDerWaalsContact O-N 3.11Å; P226-L228 PolarHBondContact O-N 3.21Å; P226-V229 PolarHBondContact O-N 3.03Å
227	E	72.6	Confident	67.8	Low	181 Å²	181	70.9 Å²	70.9	85%	0.846	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-64.4	-24.6	178.7	-58	-165	-171	0	0	113.8	C225	C225-E227 VanDerWaalsContact C-N 3.25Å; C225-E227 PolarHBondContact O-N 2.87Å
228	L	67.8	Low	65.9	Low	63 Å²	63	80.3 Å²	80.3	33%	0.33	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-87.8	-16.7	-177	-62.1	-176.4	0	0	0	113.2	V193 V195 V198 C225 P226	V193-L228 HydrophobicContact CG1-CD1 4.42Å; V195-L228 HydrophobicContact CG2-CD1 4.26Å; V195-L228 HydrophobicContact CG2-CD2 3.77Å; V198-L228 WeakPolarHBondContact CG1-O 3.47Å; V198-L228 HydrophobicContact CG2-CB 4.33Å; C225-L228 HydrophobicContact CB-CB 4.32Å; C225-L228 HydrophobicContact CB-CD1 3.86Å; C225-L228 HydrophobicContact CB-CG 4.06Å; C225-L228 PolarHBondContact O-N 3.34Å; C225-L228 VanDerWaalsContact O-N 3.15Å; P226-L228 PolarHBondContact O-N 3.21Å
229	V	66.2	Low	64.3	Low	2 Å²	2	82.3 Å²	82.3	1%	0.012	44%	0.443	C	S	.	.			trans	-124.3	82.4	-174.9	-170.9	0	0	0	0	109.6	V198 K222 P226 L231	V198-V229 HydrophobicContact CG1-CG2 4.04Å; V198-V229 HydrophobicContact CG2-CG2 4.26Å; K222-V229 HydrophobicContact CB-CB 3.84Å; K222-V229 HydrophobicContact CB-CG1 4.05Å; K222-V229 HydrophobicContact CB-CG2 4.27Å; K222-V229 HydrophobicContact CD-CB 4.5Å; K222-V229 HydrophobicContact CD-CG1 4.4Å; K222-V229 WeakPolarHBondContact CE-O 3.33Å; K222-V229 HydrophobicContact CG-CB 4.07Å; K222-V229 HydrophobicContact CG-CG1 4.41Å; P226-V229 PolarHBondContact O-N 3.03Å; V229-L231 PolarHBondContact O-N 3.24Å
230	T	55.7	Low	62.7	Low	132 Å²	132	81.4 Å²	81.4	81%	0.81	44%	0.438	S	S	*	.			trans	-71.6	-4.5	-179.4	48.6	0	0	0	0	114.4
231	L	58.5	Low	61.8	Low	67 Å²	67	81.2 Å²	81.2	35%	0.351	44%	0.436	S	S	.	.	S	Bend	trans	-70.7	135.8	-179.7	-68.9	-176.3	0	0	0	112.4	L202 K222 V229 I233	L202-L231 HydrophobicContact CD2-CD1 3.26Å; L202-L231 HydrophobicContact CD2-CG 4.14Å; K222-L231 PolarHBondContact NZ-O 3.39Å; V229-L231 PolarHBondContact O-N 3.24Å; L231-I233 PolarHBondContact O-N 2.98Å
232	S	49.4	Very low	60.5	Low	109 Å²	109	88.6 Å²	88.6	76%	0.762	47%	0.468	S	S	*	.			trans	-69.8	105.7	164.4	49.5	0	0	0	0	108.9
233	I	55.6	Low	59.2	Low	43 Å²	43	87.1 Å²	87.1	22%	0.221	46%	0.464	C	S	.	.			trans	-83.5	128.1	177.8	-55.5	-178.7	0	0	0	106.9	S219 K222 L231 S235 M237	S219-I233 VanDerWaalsContact CA-CD1 3.42Å; K222-I233 HydrophobicContact CB-CD1 4.07Å; K222-I233 HydrophobicContact CD-CD1 3.61Å; K222-I233 HydrophobicContact CD-CG1 4.1Å; K222-I233 HydrophobicContact CG-CD1 4.47Å; L231-I233 PolarHBondContact O-N 2.98Å; I233-S235 PolarHBondContact O-N 2.85Å; I233-M237 HydrophobicContact CG2-CE 4.49Å; I233-M237 HydrophobicContact CG2-SD 4.48Å
234	P	50.1	Low	58.2	Low	62 Å²	62	85.2 Å²	85.2	40%	0.403	45%	0.447	S	S	.	.			trans	-58.2	132.6	179.8	-21.7	30.9	0	0	0	111.6	R236	P234-R236 PolarHBondContact O-N 2.69Å
235	S	44.7	Very low	57	Low	134 Å²	134	82.3 Å²	82.3	94%	0.937	43%	0.434	S	S	*	.	S	Bend	trans	-62.7	-15	-178.5	-36.5	0	0	0	0	114	I233	I233-S235 PolarHBondContact O-N 2.85Å
236	R	42.8	Very low	56.1	Low	230 Å²	230	84.5 Å²	84.5	87%	0.868	45%	0.45	S	S	*	.			trans	-118.3	104.7	175.7	-81.4	-176	175.6	-176.3	-0.6	110.7	P234	P234-R236 PolarHBondContact O-N 2.69Å
237	M	51.2	Low	55.7	Low	45 Å²	45	84.9 Å²	84.9	22%	0.222	45%	0.453	C	S	.	.			trans	-112.3	100.8	168.8	-137.9	132.4	76	0	0	110	L215 Y216 I233 S239	L215-M237 VanDerWaalsContact C-CE 3.41Å; L215-M237 HydrophobicContact CB-CE 3.41Å; L215-M237 VanDerWaalsContact CB-CE 3.41Å; L215-M237 HydrophobicContact CB-SD 3.39Å; L215-M237 WeakPolarHBondContact CB-SD 3.47Å; L215-M237 HydrophobicContact CD1-SD 3.7Å; L215-M237 HydrophobicContact CG-SD 4.11Å; Y216-M237 HydrophobicContact CD1-CE 4.44Å; Y216-M237 HydrophobicContact CD2-CE 3.4Å; Y216-M237 HydrophobicContact CD2-CG 4.09Å; Y216-M237 HydrophobicContact CD2-SD 4.46Å; Y216-M237 HydrophobicContact CE2-CB 3.78Å; Y216-M237 HydrophobicContact CE2-CE 3.67Å; Y216-M237 HydrophobicContact CE2-CG 3.5Å; Y216-M237 VanDerWaalsContact CE2-CG 3.5Å; Y216-M237 HydrophobicContact CE2-SD 4.4Å; Y216-M237 HydrophobicContact CG-CE 3.83Å; Y216-M237 PolarHBondContact OH-O 2.73Å; I233-M237 HydrophobicContact CG2-CE 4.49Å; I233-M237 HydrophobicContact CG2-SD 4.48Å; M237-S239 PolarHBondContact O-N 2.74Å
238	K	45	Very low	55.6	Low	197 Å²	197	77.3 Å²	77.3	86%	0.857	42%	0.416	S	S	*	.			trans	-56	127.6	172.1	-71.7	178.8	177.5	177.6	0	108.8	G240	K238-G240 PolarHBondContact O-N 2.85Å
239	S	52	Low	55.7	Low	45 Å²	45	76.5 Å²	76.5	32%	0.315	41%	0.41	S	S	.	.			trans	22.1	83.6	161.9	175.1	0	0	0	0	116	M237 F241 F271	M237-S239 PolarHBondContact O-N 2.74Å; S239-F241 PolarHBondContact O-N 3.41Å; S239-F271 VanDerWaalsContact OG-CD2 3.25Å; S239-F271 WeakPolarHBondContact OG-CD2 3.27Å; S239-F271 WeakPolarHBondContact OG-CE2 3.49Å; S239-F271 WeakPolarHBondContact OG-CZ 3.31Å
240	G	48.2	Very low	56.1	Low	11 Å²	11	80.2 Å²	80.2	11%	0.113	44%	0.436	C	S	.	.	S	Bend	trans	-63.5	-40	-168.9	0	0	0	0	0	117.8	Y216 K238	Y216-G240 VanDerWaalsContact CE2-N 3.29Å; Y216-G240 VanDerWaalsContact CZ-CA 3.48Å; Y216-G240 VanDerWaalsContact CZ-N 3.35Å; Y216-G240 PolarHBondContact OH-N 2.83Å; K238-G240 PolarHBondContact O-N 2.85Å
241	F	62.7	Low	57	Low	24 Å²	24	75.3 Å²	75.3	11%	0.105	41%	0.409	C	S	.	.	S	Bend	trans	-114.8	114.6	-177.3	-60.1	-71	0	0	0	107.8	C181 H182 Y185 Y216 S239 N243	C181-F241 HydrophobicContact CB-CE1 4.33Å; H182-F241 HydrophobicContact CB-CD1 3.54Å; H182-F241 HydrophobicContact CB-CE1 3.67Å; H182-F241 HydrophobicContact CB-CG 4.12Å; H182-F241 HydrophobicContact CB-CZ 4.33Å; H182-F241 AromaticContact CD2-CD2 3.95Å; H182-F241 AromaticContact CD2-CG 3.93Å; H182-F241 AromaticContact CG-CD1 3.78Å; H182-F241 AromaticContact CG-CG 3.81Å; Y185-F241 HydrophobicContact CD1-CE2 4.31Å; Y185-F241 HydrophobicContact CD2-CE2 4.25Å; Y185-F241 HydrophobicContact CD2-CZ 4.49Å; Y185-F241 HydrophobicContact CG-CE2 4.03Å; Y185-F241 HydrophobicContact CG-CZ 4.28Å; Y216-F241 HydrophobicContact CD1-CE2 4.28Å; Y216-F241 HydrophobicContact CG-CE2 4.08Å; Y216-F241 HydrophobicContact CG-CZ 4.49Å; S239-F241 PolarHBondContact O-N 3.41Å; F241-N243 PolarHBondContact O-N 2.83Å
242	K	58	Low	57.8	Low	155 Å²	155	72.8 Å²	72.8	67%	0.674	40%	0.396	S	S	*	.			trans	-60.4	133.2	172.1	-74.4	179	179.7	178.4	0	108	H244	K242-H244 VanDerWaalsContact C-N 3.33Å; K242-H244 WeakPolarHBondContact CB-NE2 3.42Å; K242-H244 PolarHBondContact O-CD2 3.19Å; K242-H244 PolarHBondContact O-N 3.48Å
243	N	54.5	Low	58.9	Low	36 Å²	36	71 Å²	71	19%	0.193	38%	0.377	C	S	.	.			trans	-71.6	87.8	176.7	-98.6	-0.4	0	0	0	111	F241 I245 L269 A270 F271	F241-N243 PolarHBondContact O-N 2.83Å; N243-I245 PolarHBondContact O-N 3.42Å; N243-I245 VanDerWaalsContact O-N 3.15Å; N243-L269 PolarHBondContact ND2-O 3.06Å; N243-L269 WeakPolarHBondContact OD1-CB 3.45Å; N243-A270 VanDerWaalsContact CG-O 3.27Å; N243-A270 VanDerWaalsContact ND2-C 3.29Å; N243-A270 PolarHBondContact ND2-O 3.05Å; N243-A270 PolarHBondContact OD1-O 3.41Å; N243-F271 HydrophobicContact CB-CB 3.72Å; N243-F271 WeakPolarHBondContact CB-O 3.35Å; N243-F271 VanDerWaalsContact CG-O 3.3Å; N243-F271 WeakPolarHBondContact ND2-CA 3.21Å; N243-F271 WeakPolarHBondContact ND2-CB 3.32Å; N243-F271 PolarHBondContact ND2-N 2.9Å; N243-F271 PolarHBondContact ND2-O 3.13Å
244	H	54.7	Low	59.9	Low	75 Å²	75	70.1 Å²	70.1	35%	0.347	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	16	176.8	-61.5	-70.3	0	0	0	113.9	K145 F179 K242	K145-H244 HydrophobicContact CD-CB 4.38Å; K145-H244 HydrophobicContact CG-CB 4.4Å; F179-H244 HydrophobicContact CE1-CB 4.03Å; F179-H244 AromaticContact CE1-CD2 3.33Å; F179-H244 WeakPolarHBondContact CE1-CD2 3.23Å; F179-H244 AromaticContact CE1-CG 3.6Å; F179-H244 AromaticContact CE1-NE2 3.73Å; K242-H244 VanDerWaalsContact C-N 3.33Å; K242-H244 WeakPolarHBondContact CB-NE2 3.42Å; K242-H244 PolarHBondContact O-CD2 3.19Å; K242-H244 PolarHBondContact O-N 3.48Å
245	I	55.9	Low	61.2	Low	7 Å²	7	67.2 Å²	67.2	4%	0.036	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	1.6	-153.5	-43.6	-179.2	0	0	0	112.9	T149 N243 K249 L269	T149-I245 HydrophobicContact CG2-CG2 3.62Å; T149-I245 VanDerWaalsContact OG1-CG2 3.31Å; T149-I245 WeakPolarHBondContact OG1-CG2 3.27Å; N243-I245 PolarHBondContact O-N 3.42Å; N243-I245 VanDerWaalsContact O-N 3.15Å; I245-K249 HydrophobicContact CB-CD 3.97Å; I245-K249 HydrophobicContact CG2-CD 3.46Å; I245-K249 VanDerWaalsContact CG2-CD 3.46Å; I245-K249 VanDerWaalsContact CG2-CE 3.48Å; I245-K249 HydrophobicContact CG2-CG 3.72Å; I245-K249 WeakPolarHBondContact O-CB 3.17Å; I245-K249 PolarHBondContact O-N 3.25Å; I245-L269 HydrophobicContact CD1-CD1 3.34Å
246	S	59.3	Low	62.7	Low	74 Å²	74	63.1 Å²	63.1	52%	0.517	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-48.6	-166.7	-173.5	0	0	0	0	116.9	S250	S246-S250 PolarHBondContact O-N 3.02Å; S246-S250 PolarHBondContact O-OG 3.26Å
247	P	64.6	Low	64.1	Low	91 Å²	91	60.7 Å²	60.7	59%	0.591	32%	0.317	S	S	*	.	H	α-helix	trans	-72.5	-45.4	-171.6	24.1	-30.6	0	0	0	113.6	S250 A251	P247-S250 PolarHBondContact O-N 3.13Å; P247-A251 PolarHBondContact O-N 3.31Å
248	W	70.5	Confident	65.1	Low	21 Å²	21	66.9 Å²	66.9	8%	0.08	34%	0.337	C	S	.	.	H	α-helix	trans	-65.9	-38.9	176.4	-80.5	-72.3	0	0	0	112.5	L109 K110 L142 K145 W146 T149 S250 A251 L252	L109-W248 VanDerWaalsContact O-CZ2 3.25Å; L109-W248 WeakPolarHBondContact O-CZ2 3.36Å; L109-W248 PolarHBondContact O-NE1 2.9Å; K110-W248 PolarHBondContact O-NE1 3.06Å; K110-W248 VanDerWaalsContact O-NE1 3.13Å; L142-W248 HydrophobicContact CD1-CH2 3.35Å; L142-W248 HydrophobicContact CD1-CZ2 4.05Å; L142-W248 HydrophobicContact CD1-CZ3 4.24Å; L142-W248 HydrophobicContact CG-CH2 3.78Å; L142-W248 HydrophobicContact CG-CZ2 4.27Å; K145-W248 HydrophobicContact CB-CZ3 4.08Å; W146-W248 HydrophobicContact CB-CH2 4.42Å; W146-W248 HydrophobicContact CB-CZ2 4.38Å; W146-W248 AromaticContact CD1-NE1 4Å; T149-W248 HydrophobicContact CG2-CB 3.61Å; W248-S250 VanDerWaalsContact C-N 3.3Å; W248-S250 PolarHBondContact O-N 3.21Å; W248-A251 PolarHBondContact O-N 3.21Å; W248-L252 WeakPolarHBondContact O-CB 3.49Å; W248-L252 PolarHBondContact O-N 3.16Å
249	K	70.8	Confident	66.3	Low	47 Å²	47	60.1 Å²	60.1	20%	0.204	31%	0.311	C	S	.	.	H	α-helix	trans	-58.3	-43	175.5	-92.4	176	171.3	177.3	0	112	T149 I245 L252 I253	T149-K249 HydrophobicContact CG2-CG 4.13Å; I245-K249 HydrophobicContact CB-CD 3.97Å; I245-K249 HydrophobicContact CG2-CD 3.46Å; I245-K249 VanDerWaalsContact CG2-CD 3.46Å; I245-K249 VanDerWaalsContact CG2-CE 3.48Å; I245-K249 HydrophobicContact CG2-CG 3.72Å; I245-K249 WeakPolarHBondContact O-CB 3.17Å; I245-K249 PolarHBondContact O-N 3.25Å; K249-L252 PolarHBondContact O-N 3.32Å; K249-I253 WeakPolarHBondContact O-CB 3.38Å; K249-I253 WeakPolarHBondContact O-CD1 3.46Å; K249-I253 WeakPolarHBondContact O-CG1 3.24Å; K249-I253 PolarHBondContact O-N 2.7Å
250	S	73.3	Confident	66.5	Low	79 Å²	79	61.1 Å²	61.1	55%	0.552	33%	0.328	S	S	*	.	H	α-helix	trans	-65.6	-43	179.7	-59	0	0	0	0	112.1	S246 P247 W248 G254	S246-S250 PolarHBondContact O-N 3.02Å; S246-S250 PolarHBondContact O-OG 3.26Å; P247-S250 PolarHBondContact O-N 3.13Å; W248-S250 VanDerWaalsContact C-N 3.3Å; W248-S250 PolarHBondContact O-N 3.21Å; S250-G254 PolarHBondContact O-N 3.36Å
251	A	74.5	Confident	66.7	Low	29 Å²	29	63.8 Å²	63.8	24%	0.24	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-43.1	176.5	0	0	0	0	0	112.3	L113 P247 W248 G254 V255	L113-A251 HydrophobicContact CD1-CB 3.89Å; L113-A251 HydrophobicContact CD2-CB 3.91Å; P247-A251 PolarHBondContact O-N 3.31Å; W248-A251 PolarHBondContact O-N 3.21Å; A251-G254 WeakPolarHBondContact O-CA 3.39Å; A251-G254 PolarHBondContact O-N 3.12Å; A251-G254 VanDerWaalsContact O-N 3.14Å; A251-V255 PolarHBondContact O-N 3.16Å
252	L	76.4	Confident	65.9	Low	14 Å²	14	71.8 Å²	71.8	7%	0.073	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-44.2	179.3	-175	66.9	0	0	0	112.1	P114 M153 W248 K249 G254 V255 Q256	P114-L252 HydrophobicContact CG-CD1 3.81Å; M153-L252 HydrophobicContact CE-CD1 4.19Å; M153-L252 HydrophobicContact SD-CD1 3.89Å; M153-L252 HydrophobicContact SD-CD2 3.65Å; M153-L252 HydrophobicContact SD-CG 4.24Å; W248-L252 WeakPolarHBondContact O-CB 3.49Å; W248-L252 PolarHBondContact O-N 3.16Å; K249-L252 PolarHBondContact O-N 3.32Å; L252-G254 PolarHBondContact O-N 3.08Å; L252-V255 PolarHBondContact O-N 2.97Å; L252-Q256 HydrophobicContact CG-CG 4.5Å; L252-Q256 WeakPolarHBondContact O-CB 3.45Å; L252-Q256 WeakPolarHBondContact O-CG 3.33Å; L252-Q256 PolarHBondContact O-N 3.47Å
253	I	73.1	Confident	65.1	Low	71 Å²	71	68.1 Å²	68.1	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-37.4	174	-69.8	164.7	0	0	0	110.8	K249 R257	K249-I253 WeakPolarHBondContact O-CB 3.38Å; K249-I253 WeakPolarHBondContact O-CD1 3.46Å; K249-I253 WeakPolarHBondContact O-CG1 3.24Å; K249-I253 PolarHBondContact O-N 2.7Å; I253-R257 WeakPolarHBondContact O-CG 3.28Å; I253-R257 PolarHBondContact O-N 2.73Å; I253-R257 VanDerWaalsContact O-N 3.08Å
254	G	75.8	Confident	64.1	Low	25 Å²	25	70.5 Å²	70.5	26%	0.258	40%	0.395	S	S	.	.	H	α-helix	trans	-64.1	-42.6	176.4	0	0	0	0	0	113	S250 A251 L252 R258	S250-G254 PolarHBondContact O-N 3.36Å; A251-G254 WeakPolarHBondContact O-CA 3.39Å; A251-G254 PolarHBondContact O-N 3.12Å; A251-G254 VanDerWaalsContact O-N 3.14Å; L252-G254 PolarHBondContact O-N 3.08Å; G254-R258 WeakPolarHBondContact O-CG 3.42Å; G254-R258 PolarHBondContact O-N 2.99Å
255	V	78.4	Confident	63	Low	2 Å²	2	72.6 Å²	72.6	1%	0.012	42%	0.418	C	S	.	.	H	α-helix	trans	-69.1	-46.2	176.9	172.1	0	0	0	0	111.2	R81 L113 A251 L252 R257 R258 N259	R81-V255 WeakPolarHBondContact O-CG1 3.46Å; L113-V255 HydrophobicContact CD1-CG2 4.33Å; A251-V255 PolarHBondContact O-N 3.16Å; L252-V255 PolarHBondContact O-N 2.97Å; V255-R257 PolarHBondContact O-N 3.06Å; V255-R258 PolarHBondContact O-N 3.47Å; V255-R258 VanDerWaalsContact O-N 3.13Å; V255-N259 PolarHBondContact O-N 3.16Å; V255-N259 VanDerWaalsContact O-N 3.11Å
256	Q	74.6	Confident	61.8	Low	47 Å²	47	74.3 Å²	74.3	22%	0.22	44%	0.438	C	S	.	.	H	α-helix	trans	-59.9	-41.8	179	-74.3	174.6	-20.7	0	0	112.6	L252 R258 N259 G260	L252-Q256 HydrophobicContact CG-CG 4.5Å; L252-Q256 WeakPolarHBondContact O-CB 3.45Å; L252-Q256 WeakPolarHBondContact O-CG 3.33Å; L252-Q256 PolarHBondContact O-N 3.47Å; Q256-R258 VanDerWaalsContact C-N 3.31Å; Q256-R258 PolarHBondContact O-N 3.04Å; Q256-N259 PolarHBondContact O-N 2.96Å; Q256-G260 PolarHBondContact O-N 3.01Å
257	R	72.6	Confident	60.5	Low	179 Å²	179	74.7 Å²	74.7	68%	0.675	43%	0.433	S	S	*	.	H	α-helix	trans	-62	-36.4	175.7	-78.5	-169.4	-137.7	169.5	9.6	113.1	I253 V255	I253-R257 WeakPolarHBondContact O-CG 3.28Å; I253-R257 PolarHBondContact O-N 2.73Å; I253-R257 VanDerWaalsContact O-N 3.08Å; V255-R257 PolarHBondContact O-N 3.06Å
258	R	73.2	Confident	58.5	Low	175 Å²	175	75.4 Å²	75.4	66%	0.66	44%	0.44	S	S	*	.	H	α-helix	trans	-74.4	-29.9	-180	-70.9	177.6	-170.7	143	0.4	112.6	F79 G254 V255 Q256	F79-R258 PolarHBondContact O-NH1 3Å; G254-R258 WeakPolarHBondContact O-CG 3.42Å; G254-R258 PolarHBondContact O-N 2.99Å; V255-R258 PolarHBondContact O-N 3.47Å; V255-R258 VanDerWaalsContact O-N 3.13Å; Q256-R258 VanDerWaalsContact C-N 3.31Å; Q256-R258 PolarHBondContact O-N 3.04Å
259	N	70.4	Confident	56.6	Low	56 Å²	56	76.2 Å²	76.2	30%	0.299	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.8	-177.8	-68.6	-9.9	0	0	0	114	R81 V255 Q256 V261	R81-N259 PolarHBondContact O-ND2 3.25Å; V255-N259 PolarHBondContact O-N 3.16Å; V255-N259 VanDerWaalsContact O-N 3.11Å; Q256-N259 PolarHBondContact O-N 2.96Å; N259-V261 HydrophobicContact CB-CG2 4.46Å; N259-V261 PolarHBondContact O-N 3.47Å
260	G	55.9	Low	54.6	Low	66 Å²	66	77.5 Å²	77.5	68%	0.68	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	3.9	179.6	0	0	0	0	0	114.9	Q256 Q262	Q256-G260 PolarHBondContact O-N 3.01Å; G260-Q262 PolarHBondContact O-N 3.02Å
261	V	52.7	Low	52.6	Low	66 Å²	66	80 Å²	80	40%	0.4	47%	0.466	S	S	.	.			trans	-87.7	94.4	-178.7	175	0	0	0	0	108.7	N259 V263	N259-V261 HydrophobicContact CB-CG2 4.46Å; N259-V261 PolarHBondContact O-N 3.47Å; V261-V263 VanDerWaalsContact C-N 3.27Å; V261-V263 HydrophobicContact CG1-CG2 3.67Å; V261-V263 PolarHBondContact O-N 3.46Å; V261-V263 VanDerWaalsContact O-N 3.09Å
262	Q	45.1	Very low	50.2	Low	193 Å²	193	82.4 Å²	82.4	90%	0.902	49%	0.487	S	S	*	.			trans	-76.6	80.9	163.9	-74.6	-115.9	10.2	0	0	108.8	G260 A264	G260-Q262 PolarHBondContact O-N 3.02Å; Q262-A264 PolarHBondContact O-N 3.39Å
263	V	41.3	Very low	48.1	Very low	77 Å²	77	87.8 Å²	87.8	47%	0.467	52%	0.52	S	S	.	.			trans	-70.8	121.1	158.5	168.4	0	0	0	0	106.3	V261 S265	V261-V263 VanDerWaalsContact C-N 3.27Å; V261-V263 HydrophobicContact CG1-CG2 3.67Å; V261-V263 PolarHBondContact O-N 3.46Å; V261-V263 VanDerWaalsContact O-N 3.09Å; V263-S265 PolarHBondContact O-N 2.86Å; V263-S265 VanDerWaalsContact O-N 3.15Å
264	A	34.3	Very low	46	Very low	86 Å²	86	94.7 Å²	94.7	71%	0.711	54%	0.541	S	S	*	.			trans	-43.6	122.6	175	0	0	0	0	0	109.5	Q262 G266	Q262-A264 PolarHBondContact O-N 3.39Å; A264-G266 PolarHBondContact O-N 2.92Å
265	S	30.6	Very low	43.7	Very low	119 Å²	119	99.8 Å²	99.8	83%	0.832	56%	0.563	S	S	*	*			trans	-68.6	71.1	178.2	42.9	0	0	0	0	110.7	V263 I267	V263-S265 PolarHBondContact O-N 2.86Å; V263-S265 VanDerWaalsContact O-N 3.15Å; S265-I267 PolarHBondContact O-N 3.04Å
266	G	30.6	Very low	41.4	Very low	44 Å²	44	108.6 Å²	108.6	45%	0.454	60%	0.601	S	S	.	*			trans	-67.5	121.1	156.3	0	0	0	0	0	108.1	D152 A264	D152-G266 VanDerWaalsContact OD2-O 3.07Å; A264-G266 PolarHBondContact O-N 2.92Å
267	I	31.8	Very low	39.2	Very low	81 Å²	81	113 Å²	113	42%	0.415	63%	0.631	S	S	.	*			trans	74.2	64.9	167.4	-39.4	179.5	0	0	0	116	D152 S265 L269	D152-I267 WeakPolarHBondContact OD1-CD1 3.32Å; D152-I267 WeakPolarHBondContact OD1-CG1 3.22Å; D152-I267 WeakPolarHBondContact OD2-CB 3.32Å; S265-I267 PolarHBondContact O-N 3.04Å; I267-L269 VanDerWaalsContact C-N 3.26Å; I267-L269 HydrophobicContact CG2-CD1 4.4Å; I267-L269 HydrophobicContact CG2-CG 3.85Å; I267-L269 PolarHBondContact O-N 3.27Å; I267-L269 VanDerWaalsContact O-N 3.08Å
268	S	23.5	Very low	37	Very low	106 Å²	106	109.2 Å²	109.2	74%	0.741	64%	0.638	S	S	*	*			trans	-71.7	89.9	140.8	-175	0	0	0	0	108.9	A270	S268-A270 PolarHBondContact O-N 3.47Å; S268-A270 VanDerWaalsContact O-N 3.08Å
269	L	29.7	Very low	34.8	Very low	38 Å²	38	105.9 Å²	105.9	20%	0.199	64%	0.641	C	S	.	*			trans	-44.2	118.6	160.7	-81.8	150.4	0	0	0	109.5	N243 I245 I267	N243-L269 PolarHBondContact ND2-O 3.06Å; N243-L269 WeakPolarHBondContact OD1-CB 3.45Å; I245-L269 HydrophobicContact CD1-CD1 3.34Å; I267-L269 VanDerWaalsContact C-N 3.26Å; I267-L269 HydrophobicContact CG2-CD1 4.4Å; I267-L269 HydrophobicContact CG2-CG 3.85Å; I267-L269 PolarHBondContact O-N 3.27Å; I267-L269 VanDerWaalsContact O-N 3.08Å
270	A	29.7	Very low	32.9	Very low	75 Å²	75	112.9 Å²	112.9	62%	0.62	66%	0.664	S	S	*	*	S	Bend	trans	-46.2	140.9	168.8	0	0	0	0	0	110	N243 S268	N243-A270 VanDerWaalsContact CG-O 3.27Å; N243-A270 VanDerWaalsContact ND2-C 3.29Å; N243-A270 PolarHBondContact ND2-O 3.05Å; N243-A270 PolarHBondContact OD1-O 3.41Å; S268-A270 PolarHBondContact O-N 3.47Å; S268-A270 VanDerWaalsContact O-N 3.08Å
271	F	30	Very low	31.7	Very low	130 Å²	130	117 Å²	117	57%	0.57	66%	0.663	S	S	*	*			trans	108.2	53.8	-178.3	-74.4	-91.8	0	0	0	117.6	S239 N243	S239-F271 VanDerWaalsContact OG-CD2 3.25Å; S239-F271 WeakPolarHBondContact OG-CD2 3.27Å; S239-F271 WeakPolarHBondContact OG-CE2 3.49Å; S239-F271 WeakPolarHBondContact OG-CZ 3.31Å; N243-F271 HydrophobicContact CB-CB 3.72Å; N243-F271 WeakPolarHBondContact CB-O 3.35Å; N243-F271 VanDerWaalsContact CG-O 3.3Å; N243-F271 WeakPolarHBondContact ND2-CA 3.21Å; N243-F271 WeakPolarHBondContact ND2-CB 3.32Å; N243-F271 PolarHBondContact ND2-N 2.9Å; N243-F271 PolarHBondContact ND2-O 3.13Å
272	A	24.9	Very low	30.9	Very low	81 Å²	81	126 Å²	126	67%	0.669	69%	0.69	S	S	*	*			trans	-151.7	120.3	146.2	0	0	0	0	0	109.6	R274	A272-R274 PolarHBondContact O-N 3.32Å
273	V	32.3	Very low	30.4	Very low	127 Å²	127	122.4 Å²	122.4	77%	0.77	67%	0.671	S	S	*	*			trans	-58.4	125.3	-179.1	172.8	0	0	0	0	110.4
274	R	28.3	Very low	30.2	Very low	215 Å²	215	126.3 Å²	126.3	81%	0.811	68%	0.684	S	S	*	*			trans	-114	94.8	155.2	-106.3	-172.3	-173.1	179	4.9	108	A272	A272-R274 PolarHBondContact O-N 3.32Å
275	D	27.7	Very low	30.4	Very low	132 Å²	132	124.5 Å²	124.5	71%	0.706	67%	0.669	S	S	*	*			trans	-72.1	135.3	145.6	-81.1	-28.7	0	0	0	106
276	K	31	Very low	31.2	Very low	188 Å²	188	123.8 Å²	123.8	82%	0.817	65%	0.652	S	S	*	*	S	Bend	cis	-152.4	150.9	15.6	-51.7	175.7	178	172.8	0	103.5
277	T	27.7	Very low	32.2	Very low	139 Å²	139	122.1 Å²	122.1	85%	0.853	63%	0.633	S	S	*	*	S	Bend	cis	-156.2	86.8	33.6	41.8	0	0	0	0	107.3
278	A	27.2	Very low	32.9	Very low	99 Å²	99	124.1 Å²	124.1	82%	0.818	64%	0.641	S	S	*	*	S	Bend	trans	-145	111.7	157.1	0	0	0	0	0	105	R280	A278-R280 PolarHBondContact O-N 3.42Å; A278-R280 VanDerWaalsContact O-N 3.1Å
279	S	25.4	Very low	34.2	Very low	105 Å²	105	119.7 Å²	119.7	73%	0.734	61%	0.608	S	S	*	*			trans	-61.2	112.6	-169.7	154.2	0	0	0	0	111.6
280	R	32.1	Very low	35.1	Very low	203 Å²	203	119.3 Å²	119.3	77%	0.766	61%	0.608	S	S	*	*	S	Bend	trans	85.2	102.1	138.3	-62.2	172.2	180	-177.4	-0.5	120.1	A278	A278-R280 PolarHBondContact O-N 3.42Å; A278-R280 VanDerWaalsContact O-N 3.1Å
281	K	30.7	Very low	35.9	Very low	152 Å²	152	120.4 Å²	120.4	66%	0.661	61%	0.609	S	S	*	*			trans	63.7	97.5	138.9	-59.8	176.2	178	175.2	0	117	K283	K281-K283 PolarHBondContact O-N 2.88Å
282	R	36	Very low	36.6	Very low	256 Å²	256	116.8 Å²	116.8	97%	0.966	60%	0.595	S	S	*	*			trans	-72.2	81.4	149.9	-83.2	-175.3	-179.4	170.9	0.1	108.7
283	K	33.7	Very low	37.3	Very low	118 Å²	118	115.8 Å²	115.8	51%	0.513	58%	0.583	S	S	.	*			trans	-77.9	150.8	159.1	-91.7	-175.6	169.6	-170.5	0	107	K281 A285	K281-K283 PolarHBondContact O-N 2.88Å; K283-A285 PolarHBondContact O-N 2.89Å
284	H	37.5	Very low	37.3	Very low	158 Å²	158	114.6 Å²	114.6	73%	0.731	58%	0.578	S	S	*	*	S	Bend	trans	-43.4	103	164.9	-59.6	-88.6	0	0	0	110.3
285	A	38.4	Very low	37.6	Very low	48 Å²	48	110.3 Å²	110.3	40%	0.397	58%	0.576	S	S	.	*			trans	-179.3	106.9	171.5	0	0	0	0	0	104.8	K283 E371	K283-A285 PolarHBondContact O-N 2.89Å; A285-E371 WeakPolarHBondContact CB-OE2 3.46Å
286	H	47.9	Very low	37.7	Very low	105 Å²	105	109.7 Å²	109.7	49%	0.486	58%	0.577	S	S	.	*			trans	-154.7	106.2	152.3	-112.3	-56.6	0	0	0	106.3	E288 E386	H286-E288 HydrophobicContact CB-CB 4.36Å; H286-E288 VanDerWaalsContact CE1-CD 3.42Å; H286-E288 IonicContact CE1-OE1 2.82Å; H286-E288 PolarHBondContact CE1-OE1 2.97Å; H286-E288 IonicContact CE1-OE2 3.24Å; H286-E288 WeakPolarHBondContact ND1-CG 3.32Å; H286-E288 IonicContact ND1-OE1 3.54Å; H286-E288 IonicContact ND1-OE2 2.69Å; H286-E288 PolarHBondContact O-N 3.48Å; H286-E386 IonicContact CE1-OE1 3.44Å; H286-E386 PolarHBondContact CE1-OE1 2.75Å; H286-E386 IonicContact CE1-OE2 3.1Å; H286-E386 PolarHBondContact CE1-OE2 2.88Å; H286-E386 VanDerWaalsContact CE1-OE2 3.26Å; H286-E386 IonicContact CG-OE2 3.72Å; H286-E386 IonicContact ND1-OE1 2.97Å; H286-E386 IonicContact ND1-OE2 3.98Å; H286-E386 PolarHBondContact ND1-OE2 2.99Å
287	L	51.1	Low	37.8	Very low	9 Å²	9	106.9 Å²	106.9	5%	0.047	57%	0.569	C	S	.	*			trans	-73.9	9.6	166	-71.4	178.6	0	0	0	111.7	L289 A367 E371 F372 A387 F390	L287-L289 PolarHBondContact O-N 3.35Å; L287-A367 HydrophobicContact CD2-CB 4.31Å; L287-E371 HydrophobicContact CD1-CB 4.17Å; L287-E371 HydrophobicContact CD1-CG 3.69Å; L287-E371 HydrophobicContact CD2-CB 4.35Å; L287-E371 HydrophobicContact CG-CB 4.35Å; L287-E371 HydrophobicContact CG-CG 4.14Å; L287-F372 HydrophobicContact CD1-CE2 4.45Å; L287-A387 VanDerWaalsContact CD1-CA 3.49Å; L287-A387 HydrophobicContact CD1-CB 3.71Å; L287-F390 HydrophobicContact CB-CB 3.72Å; L287-F390 HydrophobicContact CB-CD1 4.41Å; L287-F390 HydrophobicContact CB-CD2 4.27Å; L287-F390 HydrophobicContact CB-CG 3.88Å; L287-F390 HydrophobicContact CD1-CB 4.2Å; L287-F390 HydrophobicContact CD1-CD1 3.95Å; L287-F390 HydrophobicContact CD1-CG 4.21Å; L287-F390 HydrophobicContact CD2-CD1 3.69Å; L287-F390 HydrophobicContact CD2-CD2 4.15Å; L287-F390 HydrophobicContact CD2-CE1 3.8Å; L287-F390 HydrophobicContact CD2-CE2 4.25Å; L287-F390 HydrophobicContact CD2-CG 3.87Å; L287-F390 HydrophobicContact CD2-CZ 4.08Å; L287-F390 HydrophobicContact CG-CB 4.41Å; L287-F390 HydrophobicContact CG-CD1 4.26Å; L287-F390 HydrophobicContact CG-CG 4.23Å
288	E	46.6	Very low	37.9	Very low	123 Å²	123	109.3 Å²	109.3	58%	0.575	57%	0.568	S	S	*	*			trans	-62.1	107.4	169.4	-79.8	-174.4	179.4	0	0	109.7	H286 P290	H286-E288 HydrophobicContact CB-CB 4.36Å; H286-E288 VanDerWaalsContact CE1-CD 3.42Å; H286-E288 IonicContact CE1-OE1 2.82Å; H286-E288 PolarHBondContact CE1-OE1 2.97Å; H286-E288 IonicContact CE1-OE2 3.24Å; H286-E288 WeakPolarHBondContact ND1-CG 3.32Å; H286-E288 IonicContact ND1-OE1 3.54Å; H286-E288 IonicContact ND1-OE2 2.69Å; H286-E288 PolarHBondContact O-N 3.48Å; E288-P290 VanDerWaalsContact O-CD 3.29Å; E288-P290 WeakPolarHBondContact O-CD 3.48Å
289	L	50.4	Low	38	Very low	13 Å²	13	112.1 Å²	112.1	7%	0.068	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-60.9	121.4	170.3	-65.3	164.3	0	0	0	107.6	L287 G336 L339 W363 F390 R393	L287-L289 PolarHBondContact O-N 3.35Å; L289-G336 WeakPolarHBondContact CD2-O 3.47Å; L289-L339 HydrophobicContact CD1-CB 4.42Å; L289-L339 HydrophobicContact CD2-CB 4.36Å; L289-L339 HydrophobicContact CD2-CD1 4.02Å; L289-W363 HydrophobicContact CD2-CH2 3.7Å; L289-W363 HydrophobicContact CD2-CZ3 4.14Å; L289-F390 HydrophobicContact CD2-CD2 3.96Å; L289-F390 HydrophobicContact CD2-CE2 3.97Å; L289-F390 HydrophobicContact CG-CD2 4.16Å; L289-R393 HydrophobicContact CD1-CB 3.83Å; L289-R393 HydrophobicContact CD1-CG 4.2Å
290	P	48.9	Very low	38.5	Very low	30 Å²	30	113.1 Å²	113.1	20%	0.195	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-59.4	132.1	179.6	-24.1	34.8	0	0	0	109.6	E288 Q334 S337	E288-P290 VanDerWaalsContact O-CD 3.29Å; E288-P290 WeakPolarHBondContact O-CD 3.48Å; P290-Q334 HydrophobicContact CB-CB 4.33Å; P290-Q334 HydrophobicContact CG-CB 4.11Å; P290-Q334 HydrophobicContact CG-CG 4.34Å; P290-S337 WeakPolarHBondContact O-CA 3.18Å; P290-S337 WeakPolarHBondContact O-CB 3.29Å
291	P	45.5	Very low	38.5	Very low	97 Å²	97	113.1 Å²	113.1	63%	0.63	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-60.6	143.8	174.6	19.3	-25.3	0	0	0	109.4	S293	P291-S293 WeakPolarHBondContact CG-OG 3.42Å; P291-S293 PolarHBondContact O-N 2.95Å; P291-S293 PolarHBondContact O-OG 3.48Å
292	L	46.1	Very low	38.7	Very low	55 Å²	55	110.4 Å²	110.4	29%	0.288	58%	0.583	S	S	.	*			trans	-62.5	79.5	167.8	-74.8	173.4	0	0	0	108.5	Q314 S337	L292-Q314 HydrophobicContact CB-CG 3.91Å; L292-Q314 HydrophobicContact CD2-CG 4.11Å; L292-S337 WeakPolarHBondContact CD2-OG 3.44Å
293	S	38.2	Very low	38.6	Very low	59 Å²	59	102.9 Å²	102.9	41%	0.413	58%	0.576	S	S	.	*			trans	-94.1	139.1	-171	-48	0	0	0	0	109.2	P291 V295	P291-S293 WeakPolarHBondContact CG-OG 3.42Å; P291-S293 PolarHBondContact O-N 2.95Å; P291-S293 PolarHBondContact O-OG 3.48Å; S293-V295 PolarHBondContact O-N 2.93Å
294	P	32.6	Very low	38.9	Very low	103 Å²	103	107.4 Å²	107.4	67%	0.669	60%	0.598	S	S	*	*			trans	-67.1	109	169.5	28.8	-30.9	0	0	0	107.3	T296	P294-T296 PolarHBondContact O-N 3.2Å
295	V	34.2	Very low	38.5	Very low	125 Å²	125	102.6 Å²	102.6	76%	0.758	59%	0.592	S	S	*	*			trans	-69.8	94.3	151	-176.8	0	0	0	0	103.9	S293 I297	S293-V295 PolarHBondContact O-N 2.93Å; V295-I297 HydrophobicContact CG1-CG1 3.89Å; V295-I297 PolarHBondContact O-N 2.87Å
296	T	29.6	Very low	38.5	Very low	118 Å²	118	106.7 Å²	106.7	72%	0.724	62%	0.617	S	S	*	*			trans	-62.1	82.9	168	29.5	0	0	0	0	108.3	P294 K298	P294-T296 PolarHBondContact O-N 3.2Å; T296-K298 VanDerWaalsContact C-N 3.27Å; T296-K298 PolarHBondContact O-N 3.35Å
297	I	34.2	Very low	38.1	Very low	130 Å²	130	106.3 Å²	106.3	67%	0.667	63%	0.627	S	S	*	*			trans	-77.6	92.3	151.4	-52.5	179.9	0	0	0	103.9	V295 E299	V295-I297 HydrophobicContact CG1-CG1 3.89Å; V295-I297 PolarHBondContact O-N 2.87Å; I297-E299 HydrophobicContact CG2-CG 3.91Å; I297-E299 PolarHBondContact O-N 3.44Å
298	K	29.2	Very low	38.1	Very low	189 Å²	189	115 Å²	115	82%	0.822	66%	0.659	S	S	*	*			trans	-66.6	93.2	156.9	-75.9	-175	175.7	-178.5	0	105.7	T296	T296-K298 VanDerWaalsContact C-N 3.27Å; T296-K298 PolarHBondContact O-N 3.35Å
299	E	29.7	Very low	38.7	Very low	159 Å²	159	117.5 Å²	117.5	74%	0.743	67%	0.668	S	S	*	*			trans	-61	128	165.9	-72.7	-174.2	151.4	0	0	108.5	I297 Q301	I297-E299 HydrophobicContact CG2-CG 3.91Å; I297-E299 PolarHBondContact O-N 3.44Å; E299-Q301 PolarHBondContact O-N 2.95Å
300	P	35.3	Very low	39.5	Very low	126 Å²	126	121.2 Å²	121.2	82%	0.818	69%	0.687	S	S	*	*			trans	-67.2	118.9	161.9	-4.4	20.2	0	0	0	107.1	A302	P300-A302 VanDerWaalsContact C-N 3.33Å; P300-A302 PolarHBondContact O-N 3.35Å
301	Q	32	Very low	40.7	Very low	202 Å²	202	121 Å²	121	94%	0.944	69%	0.685	S	S	*	*	S	Bend	trans	-65.8	89.8	173.8	-66.8	179.1	-5.7	0	0	110	E299	E299-Q301 PolarHBondContact O-N 2.95Å
302	A	36.6	Very low	42.2	Very low	95 Å²	95	118 Å²	118	79%	0.785	67%	0.666	S	S	*	*			trans	-170.6	79.9	158.4	0	0	0	0	0	110.9	P300	P300-A302 VanDerWaalsContact C-N 3.33Å; P300-A302 PolarHBondContact O-N 3.35Å
303	A	32.8	Very low	43.4	Very low	99 Å²	99	115.7 Å²	115.7	82%	0.818	65%	0.654	S	S	*	*			trans	-170.4	94.7	149	0	0	0	0	0	108.8	G305	A303-G305 PolarHBondContact O-N 2.82Å; A303-G305 VanDerWaalsContact O-N 3.12Å
304	Q	40	Very low	44.8	Very low	212 Å²	212	115.6 Å²	115.6	99%	0.991	65%	0.647	S	S	*	*			trans	-70.4	101.4	163.9	-72	179.7	-2.1	0	0	108.3
305	G	30	Very low	46.5	Very low	57 Å²	57	116.7 Å²	116.7	59%	0.588	64%	0.643	S	S	*	*			trans	-140.1	141	160.8	0	0	0	0	0	107	A303 S307	A303-G305 PolarHBondContact O-N 2.82Å; A303-G305 VanDerWaalsContact O-N 3.12Å; G305-S307 PolarHBondContact O-N 2.93Å
306	S	36.8	Very low	48.5	Very low	134 Å²	134	111.2 Å²	111.2	94%	0.937	61%	0.61	S	S	*	*			trans	-70.1	59	-160.6	63.1	0	0	0	0	115.8
307	S	41	Very low	50.8	Low	98 Å²	98	113.5 Å²	113.5	69%	0.685	61%	0.612	S	S	*	*			trans	-84.2	121.3	162.8	175.1	0	0	0	0	107.9	G305 K309	G305-S307 PolarHBondContact O-N 2.93Å; S307-K309 PolarHBondContact O-N 3.31Å
308	R	49.8	Very low	53.1	Low	191 Å²	191	109.4 Å²	109.4	72%	0.721	60%	0.595	S	S	*	*			trans	-52.4	116	169.4	-91.9	178.8	175.2	165.8	-1.7	107.2	L310	R308-L310 PolarHBondContact O-N 3.44Å
309	K	59.3	Low	55.8	Low	175 Å²	175	105 Å²	105	76%	0.761	58%	0.576	S	S	*	*			trans	-56.1	104.2	175.9	-71.7	-178.6	176.8	-177.8	0	108.8	S307 R328	S307-K309 PolarHBondContact O-N 3.31Å; K309-R328 WeakPolarHBondContact O-CD 3.15Å
310	L	68.6	Low	58.4	Low	92 Å²	92	100.2 Å²	100.2	48%	0.482	56%	0.563	S	S	.	*			trans	-77.8	141.4	173.4	-64.9	169.8	0	0	0	108.8	R308 R328 E330	R308-L310 PolarHBondContact O-N 3.44Å; L310-R328 CarbonylContact C-O 3.42Å; L310-R328 WeakPolarHBondContact CA-O 3.5Å; L310-R328 WeakPolarHBondContact CD2-O 3.35Å; L310-E330 HydrophobicContact CB-CB 4.1Å
311	V	74.3	Confident	60.6	Low	24 Å²	24	97.7 Å²	97.7	15%	0.145	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.2	-180	179.5	0	0	0	0	107.3	M313 Q315 V316 N325 R328 I329 E330	V311-M313 PolarHBondContact O-N 3.44Å; V311-Q315 HydrophobicContact CG1-CB 4.02Å; V311-V316 HydrophobicContact CG1-CG2 4.36Å; V311-N325 HydrophobicContact CG2-CB 4.41Å; V311-R328 HydrophobicContact CG2-CB 4.37Å; V311-R328 PolarHBondContact N-O 3.47Å; V311-I329 CarbonylContact O-C 3.59Å; V311-I329 VanDerWaalsContact O-CA 3.26Å; V311-I329 WeakPolarHBondContact O-CA 3.4Å; V311-E330 PolarHBondContact O-N 3.05Å
312	P	76.7	Confident	63.1	Low	35 Å²	35	88.1 Å²	88.1	23%	0.227	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	137.5	175.2	-23.6	32.7	0	0	0	111.1	Q314 Q315	P312-Q314 PolarHBondContact O-N 3.41Å; P312-Q315 HydrophobicContact CB-CG 4.5Å; P312-Q315 PolarHBondContact O-N 3.2Å
313	M	69.9	Low	65.3	Low	6 Å²	6	87.7 Å²	87.7	3%	0.03	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-50.1	-28.9	179.4	-177.1	66.7	90.5	0	0	113.1	V311 Q315 V316 L322 I329 E330 L331 A344 Y347	V311-M313 PolarHBondContact O-N 3.44Å; M313-Q315 VanDerWaalsContact C-N 3.29Å; M313-Q315 PolarHBondContact O-N 2.8Å; M313-V316 PolarHBondContact O-N 2.97Å; M313-L322 HydrophobicContact SD-CD1 4.25Å; M313-I329 HydrophobicContact CB-CG2 4.16Å; M313-I329 HydrophobicContact CE-CG2 3.72Å; M313-I329 HydrophobicContact SD-CG2 3.94Å; M313-E330 PolarHBondContact N-O 3.15Å; M313-E330 VanDerWaalsContact N-O 3.1Å; M313-L331 HydrophobicContact CE-CD2 3.89Å; M313-A344 HydrophobicContact CE-CB 4.3Å; M313-A344 HydrophobicContact CG-CB 4.34Å; M313-A344 HydrophobicContact SD-CB 4.46Å; M313-Y347 HydrophobicContact CE-CD1 3.46Å; M313-Y347 VanDerWaalsContact CE-CD1 3.46Å; M313-Y347 HydrophobicContact CE-CD2 4.21Å; M313-Y347 HydrophobicContact CE-CE1 4.18Å; M313-Y347 HydrophobicContact CE-CG 3.48Å; M313-Y347 VanDerWaalsContact CE-CG 3.48Å
314	Q	67.8	Low	67.8	Low	58 Å²	58	89.6 Å²	89.6	27%	0.271	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-69	-21.9	179.8	-55.9	83	-0.2	0	0	114	L292 P312 V316	L292-Q314 HydrophobicContact CB-CG 3.91Å; L292-Q314 HydrophobicContact CD2-CG 4.11Å; P312-Q314 PolarHBondContact O-N 3.41Å; Q314-V316 VanDerWaalsContact C-N 3.3Å
315	Q	69.4	Low	69.8	Low	125 Å²	125	81.3 Å²	81.3	58%	0.584	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-82.4	-11.8	179.6	-64.8	-177	3.4	0	0	112.6	V311 P312 M313 Q317	V311-Q315 HydrophobicContact CG1-CB 4.02Å; P312-Q315 HydrophobicContact CB-CG 4.5Å; P312-Q315 PolarHBondContact O-N 3.2Å; M313-Q315 VanDerWaalsContact C-N 3.29Å; M313-Q315 PolarHBondContact O-N 2.8Å; Q315-Q317 PolarHBondContact O-N 3.17Å
316	V	74.9	Confident	72.2	Confident	11 Å²	11	81.6 Å²	81.6	7%	0.067	42%	0.422	C	S	.	.			trans	-86.6	108.5	178.2	-177	0	0	0	0	108.9	V311 M313 Q314 S318 Q321 L322 I329	V311-V316 HydrophobicContact CG1-CG2 4.36Å; M313-V316 PolarHBondContact O-N 2.97Å; Q314-V316 VanDerWaalsContact C-N 3.3Å; V316-S318 WeakPolarHBondContact CG1-O 3.43Å; V316-Q321 HydrophobicContact CG1-CB 4.06Å; V316-L322 HydrophobicContact CG1-CB 3.71Å; V316-L322 HydrophobicContact CG1-CD1 3.95Å; V316-L322 HydrophobicContact CG1-CG 4.48Å; V316-I329 HydrophobicContact CG2-CD1 4.4Å; V316-I329 HydrophobicContact CG2-CG1 4.44Å
317	Q	78.1	Confident	74.4	Confident	165 Å²	165	80.6 Å²	80.6	77%	0.771	40%	0.402	S	S	*	.			trans	-105.2	-10.4	-176.7	-63.4	-176.9	-1.9	0	0	113.2	Q315	Q315-Q317 PolarHBondContact O-N 3.17Å
318	S	83.8	Confident	76.2	Confident	44 Å²	44	80.7 Å²	80.7	31%	0.308	39%	0.387	S	S	.	.	S	Bend	trans	-139.8	155	179.5	64.8	0	0	0	0	111.5	V316 A320 Q321 L322	V316-S318 WeakPolarHBondContact CG1-O 3.43Å; S318-A320 VanDerWaalsContact C-N 3.27Å; S318-A320 PolarHBondContact O-N 3.05Å; S318-Q321 WeakPolarHBondContact O-CB 3.22Å; S318-Q321 PolarHBondContact O-N 3.41Å; S318-Q321 VanDerWaalsContact O-N 3.14Å; S318-Q321 VanDerWaalsContact OG-CG 3.29Å; S318-Q321 WeakPolarHBondContact OG-CG 3.5Å; S318-Q321 PolarHBondContact OG-N 3.48Å; S318-L322 PolarHBondContact O-N 3.18Å
319	F	84.4	Confident	77.8	Confident	98 Å²	98	72.3 Å²	72.3	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-59.5	-37.3	176.2	-175.1	-112.5	0	0	0	112.4	Q321 L322 L323 L343	F319-Q321 VanDerWaalsContact C-N 3.33Å; F319-Q321 PolarHBondContact O-N 3.18Å; F319-L322 HydrophobicContact CD2-CD2 4.12Å; F319-L322 HydrophobicContact CE2-CD2 4.28Å; F319-L322 VanDerWaalsContact O-CB 3.26Å; F319-L322 WeakPolarHBondContact O-CB 3.27Å; F319-L322 PolarHBondContact O-N 3.12Å; F319-L322 VanDerWaalsContact O-N 3.12Å; F319-L323 HydrophobicContact CD1-CD1 4Å; F319-L323 HydrophobicContact CD1-CG 4.44Å; F319-L323 HydrophobicContact CE1-CD1 3.61Å; F319-L323 HydrophobicContact CE1-CD2 4.41Å; F319-L323 HydrophobicContact CE1-CG 4.1Å; F319-L323 HydrophobicContact CZ-CD1 4.11Å; F319-L323 HydrophobicContact CZ-CD2 4.06Å; F319-L323 HydrophobicContact CZ-CG 4.17Å; F319-L323 WeakPolarHBondContact O-CG 3.47Å; F319-L323 PolarHBondContact O-N 2.92Å; F319-L343 HydrophobicContact CB-CD2 4.21Å
320	A	84.5	Confident	78.8	Confident	57 Å²	57	68.9 Å²	68.9	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-40.6	175.8	0	0	0	0	0	112.4	S318 L322 L323 Q324	S318-A320 VanDerWaalsContact C-N 3.27Å; S318-A320 PolarHBondContact O-N 3.05Å; A320-L322 VanDerWaalsContact C-N 3.32Å; A320-L323 PolarHBondContact O-N 3.36Å; A320-Q324 WeakPolarHBondContact O-CG 3.49Å; A320-Q324 PolarHBondContact O-N 2.63Å; A320-Q324 VanDerWaalsContact O-N 3.17Å
321	Q	82	Confident	79.3	Confident	73 Å²	73	65.6 Å²	65.6	34%	0.341	33%	0.326	S	S	.	.	H	α-helix	trans	-68.8	-31.5	175.1	-73.8	171.6	-11.3	0	0	112.4	V316 S318 F319 N325	V316-Q321 HydrophobicContact CG1-CB 4.06Å; S318-Q321 WeakPolarHBondContact O-CB 3.22Å; S318-Q321 PolarHBondContact O-N 3.41Å; S318-Q321 VanDerWaalsContact O-N 3.14Å; S318-Q321 VanDerWaalsContact OG-CG 3.29Å; S318-Q321 WeakPolarHBondContact OG-CG 3.5Å; S318-Q321 PolarHBondContact OG-N 3.48Å; F319-Q321 VanDerWaalsContact C-N 3.33Å; F319-Q321 PolarHBondContact O-N 3.18Å; Q321-N325 WeakPolarHBondContact O-CB 3.42Å; Q321-N325 PolarHBondContact O-N 3.49Å; Q321-N325 PolarHBondContact O-ND2 2.81Å
322	L	84.3	Confident	79.5	Confident	2 Å²	2	65 Å²	65	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-55.3	174	-172.5	75.4	0	0	0	109.4	M313 V316 S318 F319 A320 Q324 N325 M326 I329 Q346 Y347	M313-L322 HydrophobicContact SD-CD1 4.25Å; V316-L322 HydrophobicContact CG1-CB 3.71Å; V316-L322 HydrophobicContact CG1-CD1 3.95Å; V316-L322 HydrophobicContact CG1-CG 4.48Å; S318-L322 PolarHBondContact O-N 3.18Å; F319-L322 HydrophobicContact CD2-CD2 4.12Å; F319-L322 HydrophobicContact CE2-CD2 4.28Å; F319-L322 VanDerWaalsContact O-CB 3.26Å; F319-L322 WeakPolarHBondContact O-CB 3.27Å; F319-L322 PolarHBondContact O-N 3.12Å; F319-L322 VanDerWaalsContact O-N 3.12Å; A320-L322 VanDerWaalsContact C-N 3.32Å; L322-Q324 VanDerWaalsContact C-N 3.32Å; L322-Q324 PolarHBondContact O-N 2.92Å; L322-N325 CarbonylContact O-C 3.57Å; L322-N325 PolarHBondContact O-N 2.91Å; L322-M326 WeakPolarHBondContact O-CG 3.49Å; L322-M326 PolarHBondContact O-N 3.22Å; L322-I329 HydrophobicContact CD1-CD1 3.38Å; L322-I329 HydrophobicContact CG-CD1 4.27Å; L322-Q346 HydrophobicContact CD2-CB 4.22Å; L322-Y347 HydrophobicContact CD1-CD2 4.04Å; L322-Y347 HydrophobicContact CD1-CG 4.43Å
323	L	84	Confident	79.2	Confident	86 Å²	86	67.8 Å²	67.8	45%	0.45	35%	0.348	S	S	.	.	H	α-helix	trans	-56.2	-44.1	-179.5	-67.5	175.5	0	0	0	112.4	F319 A320 N325 M326	F319-L323 HydrophobicContact CD1-CD1 4Å; F319-L323 HydrophobicContact CD1-CG 4.44Å; F319-L323 HydrophobicContact CE1-CD1 3.61Å; F319-L323 HydrophobicContact CE1-CD2 4.41Å; F319-L323 HydrophobicContact CE1-CG 4.1Å; F319-L323 HydrophobicContact CZ-CD1 4.11Å; F319-L323 HydrophobicContact CZ-CD2 4.06Å; F319-L323 HydrophobicContact CZ-CG 4.17Å; F319-L323 WeakPolarHBondContact O-CG 3.47Å; F319-L323 PolarHBondContact O-N 2.92Å; A320-L323 PolarHBondContact O-N 3.36Å; L323-N325 VanDerWaalsContact C-N 3.26Å; L323-N325 PolarHBondContact O-N 3.46Å; L323-M326 HydrophobicContact CD2-SD 3.75Å
324	Q	83.3	Confident	79.5	Confident	139 Å²	139	72.7 Å²	72.7	65%	0.65	37%	0.371	S	S	*	.	H	α-helix	trans	-64	-30.9	179	-71.8	174.7	5	0	0	113.1	A320 L322	A320-Q324 WeakPolarHBondContact O-CG 3.49Å; A320-Q324 PolarHBondContact O-N 2.63Å; A320-Q324 VanDerWaalsContact O-N 3.17Å; L322-Q324 VanDerWaalsContact C-N 3.32Å; L322-Q324 PolarHBondContact O-N 2.92Å
325	N	82.5	Confident	80.1	Confident	38 Å²	38	70.1 Å²	70.1	20%	0.203	36%	0.359	C	S	.	.	H	α-helix	trans	-110.5	6.5	-174.6	-64	-68.6	0	0	0	114	V311 Q321 L322 L323 H327 R328 I329	V311-N325 HydrophobicContact CG2-CB 4.41Å; Q321-N325 WeakPolarHBondContact O-CB 3.42Å; Q321-N325 PolarHBondContact O-N 3.49Å; Q321-N325 PolarHBondContact O-ND2 2.81Å; L322-N325 CarbonylContact O-C 3.57Å; L322-N325 PolarHBondContact O-N 2.91Å; L323-N325 VanDerWaalsContact C-N 3.26Å; L323-N325 PolarHBondContact O-N 3.46Å; N325-H327 PolarHBondContact O-N 3.29Å; N325-R328 CarbonylContact O-C 3.6Å; N325-R328 WeakPolarHBondContact O-CA 3.42Å; N325-R328 PolarHBondContact O-N 3.22Å; N325-I329 HydrophobicContact CB-CG1 4.4Å; N325-I329 WeakPolarHBondContact O-CG1 3.4Å; N325-I329 PolarHBondContact O-N 3.43Å
326	M	81.9	Confident	80.5	Confident	63 Å²	63	64.2 Å²	64.2	31%	0.31	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-44.8	-44.5	-174.9	-85.8	175.4	58.7	0	0	113.8	L322 L323 R328 V351	L322-M326 WeakPolarHBondContact O-CG 3.49Å; L322-M326 PolarHBondContact O-N 3.22Å; L323-M326 HydrophobicContact CD2-SD 3.75Å; M326-R328 VanDerWaalsContact C-N 3.26Å; M326-R328 PolarHBondContact O-N 3.22Å; M326-V351 HydrophobicContact CE-CG2 4.12Å
327	H	81.4	Confident	80.8	Confident	113 Å²	113	64 Å²	64	52%	0.523	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-78.2	-2.5	-178.3	63	-78.7	0	0	0	114.9	N325	N325-H327 PolarHBondContact O-N 3.29Å
328	R	80	Confident	81.1	Confident	100 Å²	100	56.1 Å²	56.1	38%	0.377	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-122.6	0	-176.7	-55.1	-172	-175.4	-175.4	1.7	112.7	K309 L310 V311 N325 M326 E330	K309-R328 WeakPolarHBondContact O-CD 3.15Å; L310-R328 CarbonylContact C-O 3.42Å; L310-R328 WeakPolarHBondContact CA-O 3.5Å; L310-R328 WeakPolarHBondContact CD2-O 3.35Å; V311-R328 HydrophobicContact CG2-CB 4.37Å; V311-R328 PolarHBondContact N-O 3.47Å; N325-R328 CarbonylContact O-C 3.6Å; N325-R328 WeakPolarHBondContact O-CA 3.42Å; N325-R328 PolarHBondContact O-N 3.22Å; M326-R328 VanDerWaalsContact C-N 3.26Å; M326-R328 PolarHBondContact O-N 3.22Å; R328-E330 PolarHBondContact O-N 2.91Å
329	I	82.9	Confident	81.1	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.072	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	127.7	-174.4	-74.1	164.1	0	0	0	110.6	V311 M313 V316 L322 N325 Y347	V311-I329 CarbonylContact O-C 3.59Å; V311-I329 VanDerWaalsContact O-CA 3.26Å; V311-I329 WeakPolarHBondContact O-CA 3.4Å; M313-I329 HydrophobicContact CB-CG2 4.16Å; M313-I329 HydrophobicContact CE-CG2 3.72Å; M313-I329 HydrophobicContact SD-CG2 3.94Å; V316-I329 HydrophobicContact CG2-CD1 4.4Å; V316-I329 HydrophobicContact CG2-CG1 4.44Å; L322-I329 HydrophobicContact CD1-CD1 3.38Å; L322-I329 HydrophobicContact CG-CD1 4.27Å; N325-I329 HydrophobicContact CB-CG1 4.4Å; N325-I329 WeakPolarHBondContact O-CG1 3.4Å; N325-I329 PolarHBondContact O-N 3.43Å; I329-Y347 HydrophobicContact CB-CD2 4.38Å; I329-Y347 HydrophobicContact CB-CE2 3.69Å; I329-Y347 HydrophobicContact CD1-CD2 3.5Å; I329-Y347 HydrophobicContact CD1-CE2 3.53Å; I329-Y347 HydrophobicContact CG1-CE2 4.17Å; I329-Y347 HydrophobicContact CG2-CD2 4.36Å; I329-Y347 HydrophobicContact CG2-CE1 4.38Å; I329-Y347 HydrophobicContact CG2-CE2 3.93Å
330	E	80.9	Confident	81	Confident	103 Å²	103	52.1 Å²	52.1	48%	0.481	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.9	170.5	-169.9	176.6	178.4	0	0	110	L310 V311 M313 R328	L310-E330 HydrophobicContact CB-CB 4.1Å; V311-E330 PolarHBondContact O-N 3.05Å; M313-E330 PolarHBondContact N-O 3.15Å; M313-E330 VanDerWaalsContact N-O 3.1Å; R328-E330 PolarHBondContact O-N 2.91Å
331	L	79.3	Confident	81	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.12	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-76.6	142.1	178.1	-71.2	168.7	0	0	0	111.6	M313 L338 Y347 A356	M313-L331 HydrophobicContact CE-CD2 3.89Å; L331-L338 HydrophobicContact CD2-CD1 4.33Å; L331-L338 HydrophobicContact CD2-CD2 4.32Å; L331-Y347 HydrophobicContact CD1-CE1 4.4Å; L331-Y347 HydrophobicContact CD2-CD1 4.12Å; L331-Y347 HydrophobicContact CD2-CE1 3.86Å; L331-Y347 HydrophobicContact CG-CE1 4.26Å; L331-A356 HydrophobicContact CD1-CB 3.32Å
332	P	76.6	Confident	81.2	Confident	13 Å²	13	50.3 Å²	50.3	8%	0.084	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-62.2	152.7	-179.9	25.8	-33.1	0	0	0	112.2	Q334 S337 L338 R359	P332-Q334 VanDerWaalsContact C-N 3.27Å; P332-Q334 PolarHBondContact O-N 3.14Å; P332-S337 WeakPolarHBondContact CG-OG 3.48Å; P332-L338 HydrophobicContact CG-CD2 3.75Å; P332-L338 HydrophobicContact CG-CG 4.1Å; P332-R359 PolarHBondContact O-NH2 2.64Å
333	A	71.9	Confident	81.2	Confident	92 Å²	92	51.7 Å²	51.7	76%	0.76	29%	0.286	S	S	*	.	S	Bend	trans	-64	-36.1	169.9	0	0	0	0	0	111.6	M335	A333-M335 PolarHBondContact O-N 2.97Å
334	Q	75.8	Confident	81.3	Confident	110 Å²	110	47.6 Å²	47.6	51%	0.514	26%	0.264	S	S	.	.	S	Bend	trans	-91.1	84.8	178.4	-69.2	176.3	-20.2	0	0	110.9	P290 P332 G336 S337	P290-Q334 HydrophobicContact CB-CB 4.33Å; P290-Q334 HydrophobicContact CG-CB 4.11Å; P290-Q334 HydrophobicContact CG-CG 4.34Å; P332-Q334 VanDerWaalsContact C-N 3.27Å; P332-Q334 PolarHBondContact O-N 3.14Å; Q334-G336 PolarHBondContact O-N 3.23Å; Q334-G336 VanDerWaalsContact O-N 3.16Å; Q334-S337 WeakPolarHBondContact O-CB 3.35Å; Q334-S337 PolarHBondContact O-N 3.45Å; Q334-S337 VanDerWaalsContact O-N 3.12Å; Q334-S337 PolarHBondContact O-OG 3.31Å
335	M	79.6	Confident	81.5	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.02	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-59	-29.1	-173.9	-63	-58.8	-73	0	0	114.1	A333 S337 L338 A356 R359 L360	A333-M335 PolarHBondContact O-N 2.97Å; M335-S337 PolarHBondContact O-N 3.49Å; M335-S337 VanDerWaalsContact O-N 3.13Å; M335-L338 HydrophobicContact CE-CD1 3.45Å; M335-L338 VanDerWaalsContact CE-CD1 3.45Å; M335-L338 WeakPolarHBondContact O-CB 3.3Å; M335-L338 VanDerWaalsContact O-CG 3.28Å; M335-L338 WeakPolarHBondContact O-CG 3.22Å; M335-L338 PolarHBondContact O-N 3.18Å; M335-L338 VanDerWaalsContact O-N 3.07Å; M335-L338 HydrophobicContact SD-CD1 4.08Å; M335-A356 HydrophobicContact CE-CB 4.15Å; M335-A356 VanDerWaalsContact CE-O 3.24Å; M335-A356 WeakPolarHBondContact CE-O 3.45Å; M335-R359 HydrophobicContact CE-CB 4.21Å; M335-R359 HydrophobicContact CG-CB 3.8Å; M335-R359 HydrophobicContact SD-CB 4.33Å; M335-L360 HydrophobicContact CB-CB 4.27Å; M335-L360 HydrophobicContact CB-CD1 3.98Å; M335-L360 HydrophobicContact CE-CB 4.21Å; M335-L360 WeakPolarHBondContact O-CD1 3.05Å
336	G	79	Confident	81.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-55.6	-30.5	176.3	0	0	0	0	0	114	L289 Q334 L338 L339 W363	L289-G336 WeakPolarHBondContact CD2-O 3.47Å; Q334-G336 PolarHBondContact O-N 3.23Å; Q334-G336 VanDerWaalsContact O-N 3.16Å; G336-L338 PolarHBondContact O-N 3.22Å; G336-L339 PolarHBondContact O-N 3.38Å; G336-L339 VanDerWaalsContact O-N 3.14Å; G336-W363 VanDerWaalsContact CA-CZ3 3.41Å
337	S	81.3	Confident	81.9	Confident	7 Å²	7	39.7 Å²	39.7	5%	0.049	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-59.2	-21.9	177.9	62.8	0	0	0	0	114.2	P290 L292 P332 Q334 M335 L339 G340	P290-S337 WeakPolarHBondContact O-CA 3.18Å; P290-S337 WeakPolarHBondContact O-CB 3.29Å; L292-S337 WeakPolarHBondContact CD2-OG 3.44Å; P332-S337 WeakPolarHBondContact CG-OG 3.48Å; Q334-S337 WeakPolarHBondContact O-CB 3.35Å; Q334-S337 PolarHBondContact O-N 3.45Å; Q334-S337 VanDerWaalsContact O-N 3.12Å; Q334-S337 PolarHBondContact O-OG 3.31Å; M335-S337 PolarHBondContact O-N 3.49Å; M335-S337 VanDerWaalsContact O-N 3.13Å; S337-L339 VanDerWaalsContact C-N 3.33Å; S337-L339 PolarHBondContact O-N 2.82Å; S337-G340 PolarHBondContact O-N 3.35Å
338	L	83.4	Confident	82	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-68.2	-31.3	179.3	-58.6	172.2	0	0	0	112.4	L331 P332 M335 G336 G340 S341 A344 L348	L331-L338 HydrophobicContact CD2-CD1 4.33Å; L331-L338 HydrophobicContact CD2-CD2 4.32Å; P332-L338 HydrophobicContact CG-CD2 3.75Å; P332-L338 HydrophobicContact CG-CG 4.1Å; M335-L338 HydrophobicContact CE-CD1 3.45Å; M335-L338 VanDerWaalsContact CE-CD1 3.45Å; M335-L338 WeakPolarHBondContact O-CB 3.3Å; M335-L338 VanDerWaalsContact O-CG 3.28Å; M335-L338 WeakPolarHBondContact O-CG 3.22Å; M335-L338 PolarHBondContact O-N 3.18Å; M335-L338 VanDerWaalsContact O-N 3.07Å; M335-L338 HydrophobicContact SD-CD1 4.08Å; G336-L338 PolarHBondContact O-N 3.22Å; L338-G340 PolarHBondContact O-N 3.19Å; L338-G340 VanDerWaalsContact O-N 3.12Å; L338-S341 PolarHBondContact O-N 3.45Å; L338-A344 HydrophobicContact CB-CB 4.24Å; L338-A344 HydrophobicContact CD2-CB 3.72Å; L338-L348 HydrophobicContact CB-CD1 4.38Å; L338-L348 HydrophobicContact CD1-CD1 4.19Å; L338-L348 HydrophobicContact CD1-CD2 4.49Å
339	L	84.8	Confident	82.2	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-63.4	-20.8	-178.9	-60.7	177.1	0	0	0	112.8	L289 G336 S337 L360 W363 L394 A397 F405	L289-L339 HydrophobicContact CD1-CB 4.42Å; L289-L339 HydrophobicContact CD2-CB 4.36Å; L289-L339 HydrophobicContact CD2-CD1 4.02Å; G336-L339 PolarHBondContact O-N 3.38Å; G336-L339 VanDerWaalsContact O-N 3.14Å; S337-L339 VanDerWaalsContact C-N 3.33Å; S337-L339 PolarHBondContact O-N 2.82Å; L339-L360 HydrophobicContact CD2-CD1 4.4Å; L339-L360 HydrophobicContact CD2-CD2 4.4Å; L339-L360 HydrophobicContact CG-CD1 4.42Å; L339-W363 HydrophobicContact CD1-CZ3 4.27Å; L339-L394 HydrophobicContact CD1-CD1 4.28Å; L339-A397 HydrophobicContact CB-CB 4.48Å; L339-A397 HydrophobicContact CD2-CB 3.89Å; L339-F405 HydrophobicContact CD2-CE2 3.94Å; L339-F405 HydrophobicContact CD2-CZ 3.76Å
340	G	80.9	Confident	82.1	Confident	55 Å²	55	36.5 Å²	36.5	57%	0.567	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-92.2	0.4	-179.1	0	0	0	0	0	115.2	S337 L338	S337-G340 PolarHBondContact O-N 3.35Å; L338-G340 PolarHBondContact O-N 3.19Å; L338-G340 VanDerWaalsContact O-N 3.12Å
341	S	85.3	Confident	82.1	Confident	26 Å²	26	34.1 Å²	34.1	18%	0.182	22%	0.217	C	C	.	.			trans	-129.5	120.9	-175	175.9	0	0	0	0	112.1	L338 L343 A344 L345	L338-S341 PolarHBondContact O-N 3.45Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 3.08Å; S341-A344 WeakPolarHBondContact O-CB 3.42Å; S341-A344 PolarHBondContact O-N 3.43Å; S341-A344 PolarHBondContact OG-N 2.94Å; S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 3.12Å
342	S	85.1	Confident	81.9	Confident	67 Å²	67	37.5 Å²	37.5	47%	0.469	23%	0.232	S	C	.	.	H	α-helix	trans	-60.9	-39.8	176.8	52.9	0	0	0	0	112.7	A344 L345 Q346	S342-A344 VanDerWaalsContact C-N 3.3Å; S342-A344 PolarHBondContact O-N 3.49Å; S342-L345 PolarHBondContact O-N 3.48Å; S342-Q346 VanDerWaalsContact O-CG 3.32Å; S342-Q346 WeakPolarHBondContact O-CG 3.33Å; S342-Q346 PolarHBondContact O-N 3.08Å
343	L	85.1	Confident	82	Confident	30 Å²	30	39.6 Å²	39.6	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-37.4	176.6	-67.5	174	0	0	0	112	F319 S341 Y347	F319-L343 HydrophobicContact CB-CD2 4.21Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 3.08Å; L343-Y347 PolarHBondContact O-N 3.28Å
344	A	85.4	Confident	82.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.3	-38.6	177	0	0	0	0	0	111.9	M313 L338 S341 S342 Y347 L348	M313-A344 HydrophobicContact CE-CB 4.3Å; M313-A344 HydrophobicContact CG-CB 4.34Å; M313-A344 HydrophobicContact SD-CB 4.46Å; L338-A344 HydrophobicContact CB-CB 4.24Å; L338-A344 HydrophobicContact CD2-CB 3.72Å; S341-A344 WeakPolarHBondContact O-CB 3.42Å; S341-A344 PolarHBondContact O-N 3.43Å; S341-A344 PolarHBondContact OG-N 2.94Å; S342-A344 VanDerWaalsContact C-N 3.3Å; S342-A344 PolarHBondContact O-N 3.49Å; A344-Y347 WeakPolarHBondContact O-CB 3.23Å; A344-Y347 PolarHBondContact O-N 3.13Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 3.1Å; A344-L348 VanDerWaalsContact O-N 3.08Å
345	L	87.8	Confident	82.1	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.031	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.5	-63.6	174.5	0	0	0	111.4	S341 S342 Y347 L348 D349 A397 F400 L401	S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 3.12Å; S342-L345 PolarHBondContact O-N 3.48Å; L345-Y347 VanDerWaalsContact C-N 3.28Å; L345-Y347 PolarHBondContact O-N 3.28Å; L345-L348 HydrophobicContact CD2-CD1 4.41Å; L345-L348 PolarHBondContact O-N 2.85Å; L345-L348 VanDerWaalsContact O-N 3.16Å; L345-D349 WeakPolarHBondContact O-CB 3.46Å; L345-D349 PolarHBondContact O-N 3.14Å; L345-A397 HydrophobicContact CD1-CB 3.82Å; L345-A397 HydrophobicContact CD2-CB 4.04Å; L345-F400 HydrophobicContact CB-CD1 3.5Å; L345-F400 HydrophobicContact CB-CE1 3.7Å; L345-F400 HydrophobicContact CB-CG 4.41Å; L345-F400 HydrophobicContact CD1-CB 4Å; L345-F400 HydrophobicContact CD1-CD1 3.88Å; L345-F400 HydrophobicContact CD1-CG 4.01Å; L345-F400 HydrophobicContact CG-CD1 4.34Å; L345-L401 HydrophobicContact CB-CD2 4.17Å; L345-L401 HydrophobicContact CD2-CD1 4.15Å; L345-L401 HydrophobicContact CD2-CG 4.44Å
346	Q	86.9	Confident	82.1	Confident	51 Å²	51	39.5 Å²	39.5	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-39.8	173.4	-72.8	172.5	-16.9	0	0	112.2	L322 S342 D349 C350 F400	L322-Q346 HydrophobicContact CD2-CB 4.22Å; S342-Q346 VanDerWaalsContact O-CG 3.32Å; S342-Q346 WeakPolarHBondContact O-CG 3.33Å; S342-Q346 PolarHBondContact O-N 3.08Å; Q346-D349 PolarHBondContact O-N 3.07Å; Q346-C350 WeakPolarHBondContact O-CB 3.29Å; Q346-C350 PolarHBondContact O-N 3.07Å; Q346-C350 PolarHBondContact O-SG 2.95Å; Q346-F400 HydrophobicContact CG-CE1 3.81Å; Q346-F400 HydrophobicContact CG-CZ 3.45Å; Q346-F400 VanDerWaalsContact CG-CZ 3.45Å
347	Y	86.4	Confident	82.2	Confident	17 Å²	17	42 Å²	42	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-44.8	174.8	177.5	-93.6	0	0	0	112.5	M313 L322 I329 L331 L343 A344 L345 D349 C350 V351	M313-Y347 HydrophobicContact CE-CD1 3.46Å; M313-Y347 VanDerWaalsContact CE-CD1 3.46Å; M313-Y347 HydrophobicContact CE-CD2 4.21Å; M313-Y347 HydrophobicContact CE-CE1 4.18Å; M313-Y347 HydrophobicContact CE-CG 3.48Å; M313-Y347 VanDerWaalsContact CE-CG 3.48Å; L322-Y347 HydrophobicContact CD1-CD2 4.04Å; L322-Y347 HydrophobicContact CD1-CG 4.43Å; I329-Y347 HydrophobicContact CB-CD2 4.38Å; I329-Y347 HydrophobicContact CB-CE2 3.69Å; I329-Y347 HydrophobicContact CD1-CD2 3.5Å; I329-Y347 HydrophobicContact CD1-CE2 3.53Å; I329-Y347 HydrophobicContact CG1-CE2 4.17Å; I329-Y347 HydrophobicContact CG2-CD2 4.36Å; I329-Y347 HydrophobicContact CG2-CE1 4.38Å; I329-Y347 HydrophobicContact CG2-CE2 3.93Å; L331-Y347 HydrophobicContact CD1-CE1 4.4Å; L331-Y347 HydrophobicContact CD2-CD1 4.12Å; L331-Y347 HydrophobicContact CD2-CE1 3.86Å; L331-Y347 HydrophobicContact CG-CE1 4.26Å; L343-Y347 PolarHBondContact O-N 3.28Å; A344-Y347 WeakPolarHBondContact O-CB 3.23Å; A344-Y347 PolarHBondContact O-N 3.13Å; L345-Y347 VanDerWaalsContact C-N 3.28Å; L345-Y347 PolarHBondContact O-N 3.28Å; Y347-D349 VanDerWaalsContact C-N 3.29Å; Y347-D349 PolarHBondContact O-N 3.15Å; Y347-C350 PolarHBondContact O-N 3.41Å; Y347-V351 HydrophobicContact CD2-CG2 3.74Å; Y347-V351 HydrophobicContact CE1-CB 4.28Å; Y347-V351 HydrophobicContact CE1-CG1 4.49Å; Y347-V351 HydrophobicContact CE1-CG2 4.28Å; Y347-V351 HydrophobicContact CE2-CB 4.33Å; Y347-V351 HydrophobicContact CE2-CG2 3.48Å; Y347-V351 VanDerWaalsContact CE2-CG2 3.48Å; Y347-V351 HydrophobicContact CG-CG2 4.27Å; Y347-V351 WeakPolarHBondContact O-CB 3.33Å; Y347-V351 WeakPolarHBondContact O-CG2 3.3Å; Y347-V351 PolarHBondContact O-N 2.86Å
348	L	84.3	Confident	82.1	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-43	178.4	-72.9	172.2	0	0	0	111.1	L338 A344 L345 Q352 A356 L360	L338-L348 HydrophobicContact CB-CD1 4.38Å; L338-L348 HydrophobicContact CD1-CD1 4.19Å; L338-L348 HydrophobicContact CD1-CD2 4.49Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 3.1Å; A344-L348 VanDerWaalsContact O-N 3.08Å; L345-L348 HydrophobicContact CD2-CD1 4.41Å; L345-L348 PolarHBondContact O-N 2.85Å; L345-L348 VanDerWaalsContact O-N 3.16Å; L348-Q352 WeakPolarHBondContact O-CA 3.3Å; L348-Q352 PolarHBondContact O-N 3.22Å; L348-A356 HydrophobicContact CD2-CB 4.07Å; L348-L360 HydrophobicContact CD1-CD2 3.97Å
349	D	84	Confident	82	Confident	82 Å²	82	52.5 Å²	52.5	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-64.9	-45.6	177.5	-173.1	50.9	0	0	0	112.4	L345 Q346 Y347 Q352 L401	L345-D349 WeakPolarHBondContact O-CB 3.46Å; L345-D349 PolarHBondContact O-N 3.14Å; Q346-D349 PolarHBondContact O-N 3.07Å; Y347-D349 VanDerWaalsContact C-N 3.29Å; Y347-D349 PolarHBondContact O-N 3.15Å; D349-Q352 WeakPolarHBondContact O-CG 3.25Å; D349-L401 HydrophobicContact CB-CD2 4.01Å
350	C	81.2	Confident	82	Confident	71 Å²	71	52.4 Å²	52.4	48%	0.48	29%	0.293	S	S	.	.	H	α-helix	trans	-74.2	-35.6	-177.9	-69.5	0	0	0	0	114.3	Q346 Y347	Q346-C350 WeakPolarHBondContact O-CB 3.29Å; Q346-C350 PolarHBondContact O-N 3.07Å; Q346-C350 PolarHBondContact O-SG 2.95Å; Y347-C350 PolarHBondContact O-N 3.41Å
351	V	79	Confident	82.2	Confident	54 Å²	54	51.1 Å²	51.1	33%	0.327	27%	0.273	S	S	.	.	H	α-helix	trans	-94.3	-27.1	-172.5	178.6	0	0	0	0	112.1	M326 Y347 D353	M326-V351 HydrophobicContact CE-CG2 4.12Å; Y347-V351 HydrophobicContact CD2-CG2 3.74Å; Y347-V351 HydrophobicContact CE1-CB 4.28Å; Y347-V351 HydrophobicContact CE1-CG1 4.49Å; Y347-V351 HydrophobicContact CE1-CG2 4.28Å; Y347-V351 HydrophobicContact CE2-CB 4.33Å; Y347-V351 HydrophobicContact CE2-CG2 3.48Å; Y347-V351 VanDerWaalsContact CE2-CG2 3.48Å; Y347-V351 HydrophobicContact CG-CG2 4.27Å; Y347-V351 WeakPolarHBondContact O-CB 3.33Å; Y347-V351 WeakPolarHBondContact O-CG2 3.3Å; Y347-V351 PolarHBondContact O-N 2.86Å; V351-D353 HydrophobicContact CG1-CB 4.21Å; V351-D353 PolarHBondContact O-N 3.07Å; V351-D353 VanDerWaalsContact O-N 3.09Å
352	Q	76.5	Confident	82	Confident	94 Å²	94	57.7 Å²	57.7	44%	0.439	30%	0.298	S	S	.	.			trans	47.2	39.3	179.2	-57.6	-169	-21.4	0	0	113.8	L348 D349 E354 H497	L348-Q352 WeakPolarHBondContact O-CA 3.3Å; L348-Q352 PolarHBondContact O-N 3.22Å; D349-Q352 WeakPolarHBondContact O-CG 3.25Å; Q352-E354 PolarHBondContact O-N 3.37Å; Q352-H497 PolarHBondContact OE1-NE2 3.48Å; Q352-H497 VanDerWaalsContact OE1-NE2 3.16Å
353	D	77.3	Confident	82.1	Confident	57 Å²	57	57.4 Å²	57.4	31%	0.305	29%	0.287	S	S	.	.			trans	-67.4	107.2	176.6	174.8	9.3	0	0	0	110	V351 S355 A356 L357	V351-D353 HydrophobicContact CG1-CB 4.21Å; V351-D353 PolarHBondContact O-N 3.07Å; V351-D353 VanDerWaalsContact O-N 3.09Å; D353-S355 VanDerWaalsContact CG-OG 3.27Å; D353-S355 PolarHBondContact O-N 3.3Å; D353-S355 VanDerWaalsContact O-N 3.17Å; D353-S355 WeakPolarHBondContact OD1-CB 3.49Å; D353-S355 PolarHBondContact OD1-N 2.93Å; D353-S355 PolarHBondContact OD1-OG 2.86Å; D353-S355 PolarHBondContact OD2-OG 3.48Å; D353-S355 VanDerWaalsContact OD2-OG 3.1Å; D353-A356 HydrophobicContact CB-CB 3.95Å; D353-A356 WeakPolarHBondContact O-CB 3.39Å; D353-A356 PolarHBondContact O-N 3.37Å; D353-L357 PolarHBondContact O-N 3.49Å
354	E	75.6	Confident	82.2	Confident	140 Å²	140	56 Å²	56	65%	0.654	28%	0.279	S	S	*	.	H	α-helix	trans	-53.6	-37.3	179	-65.2	-170.9	165.1	0	0	112.2	Q352 A356 L357 L358	Q352-E354 PolarHBondContact O-N 3.37Å; E354-A356 VanDerWaalsContact C-N 3.34Å; E354-A356 PolarHBondContact O-N 3.11Å; E354-L357 PolarHBondContact O-N 3.44Å; E354-L358 WeakPolarHBondContact O-CB 3.27Å; E354-L358 WeakPolarHBondContact O-CG 2.99Å; E354-L358 PolarHBondContact O-N 2.83Å
355	S	75.9	Confident	82.1	Confident	63 Å²	63	56.4 Å²	56.4	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-68.6	-36	-178.5	79.3	0	0	0	0	111.9	D353 R359	D353-S355 VanDerWaalsContact CG-OG 3.27Å; D353-S355 PolarHBondContact O-N 3.3Å; D353-S355 VanDerWaalsContact O-N 3.17Å; D353-S355 WeakPolarHBondContact OD1-CB 3.49Å; D353-S355 PolarHBondContact OD1-N 2.93Å; D353-S355 PolarHBondContact OD1-OG 2.86Å; D353-S355 PolarHBondContact OD2-OG 3.48Å; D353-S355 VanDerWaalsContact OD2-OG 3.1Å; S355-R359 WeakPolarHBondContact O-CB 3.48Å; S355-R359 WeakPolarHBondContact O-CG 3.37Å; S355-R359 PolarHBondContact O-N 2.88Å
356	A	78.3	Confident	81.7	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68	-47.1	174.5	0	0	0	0	0	111.1	L331 M335 L348 D353 E354 L358 R359 L360	L331-A356 HydrophobicContact CD1-CB 3.32Å; M335-A356 HydrophobicContact CE-CB 4.15Å; M335-A356 VanDerWaalsContact CE-O 3.24Å; M335-A356 WeakPolarHBondContact CE-O 3.45Å; L348-A356 HydrophobicContact CD2-CB 4.07Å; D353-A356 HydrophobicContact CB-CB 3.95Å; D353-A356 WeakPolarHBondContact O-CB 3.39Å; D353-A356 PolarHBondContact O-N 3.37Å; E354-A356 VanDerWaalsContact C-N 3.34Å; E354-A356 PolarHBondContact O-N 3.11Å; A356-L358 VanDerWaalsContact C-N 3.35Å; A356-L358 PolarHBondContact O-N 3.43Å; A356-R359 PolarHBondContact O-N 3.5Å; A356-L360 WeakPolarHBondContact O-CB 3.43Å; A356-L360 PolarHBondContact O-N 2.87Å
357	L	81	Confident	81.5	Confident	52 Å²	52	60.3 Å²	60.3	27%	0.272	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-41.8	177.7	-70	172.1	0	0	0	111.5	D353 E354 L360 N361	D353-L357 PolarHBondContact O-N 3.49Å; E354-L357 PolarHBondContact O-N 3.44Å; L357-L360 PolarHBondContact O-N 3.39Å; L357-N361 WeakPolarHBondContact O-CB 3.32Å; L357-N361 PolarHBondContact O-N 3.17Å; L357-N361 PolarHBondContact O-ND2 3.37Å
358	L	80.5	Confident	81.5	Confident	120 Å²	120	59.5 Å²	59.5	63%	0.628	30%	0.297	S	S	*	.	H	α-helix	trans	-62.9	-44.3	175.3	-76	169.6	0	0	0	112	E354 A356 L360 N361 F362	E354-L358 WeakPolarHBondContact O-CB 3.27Å; E354-L358 WeakPolarHBondContact O-CG 2.99Å; E354-L358 PolarHBondContact O-N 2.83Å; A356-L358 VanDerWaalsContact C-N 3.35Å; A356-L358 PolarHBondContact O-N 3.43Å; L358-L360 VanDerWaalsContact C-N 3.34Å; L358-L360 PolarHBondContact O-N 3.38Å; L358-N361 PolarHBondContact O-N 3.27Å; L358-F362 VanDerWaalsContact O-CB 3.3Å; L358-F362 WeakPolarHBondContact O-CB 3.38Å; L358-F362 PolarHBondContact O-N 3.38Å
359	R	79.8	Confident	81.3	Confident	109 Å²	109	60.6 Å²	60.6	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-39.1	177.3	-73.8	173.4	61.8	-162.7	-9.4	111.9	P332 M335 S355 A356 W363	P332-R359 PolarHBondContact O-NH2 2.64Å; M335-R359 HydrophobicContact CE-CB 4.21Å; M335-R359 HydrophobicContact CG-CB 3.8Å; M335-R359 HydrophobicContact SD-CB 4.33Å; S355-R359 WeakPolarHBondContact O-CB 3.48Å; S355-R359 WeakPolarHBondContact O-CG 3.37Å; S355-R359 PolarHBondContact O-N 2.88Å; A356-R359 PolarHBondContact O-N 3.5Å; R359-W363 WeakPolarHBondContact O-CB 3.18Å; R359-W363 PolarHBondContact O-N 2.71Å; R359-W363 VanDerWaalsContact O-N 3.11Å
360	L	85.2	Confident	80.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-49.8	176.2	-179.7	60.9	0	0	0	111.3	M335 L339 L348 A356 L357 L358 F362 W363 L364 F405	M335-L360 HydrophobicContact CB-CB 4.27Å; M335-L360 HydrophobicContact CB-CD1 3.98Å; M335-L360 HydrophobicContact CE-CB 4.21Å; M335-L360 WeakPolarHBondContact O-CD1 3.05Å; L339-L360 HydrophobicContact CD2-CD1 4.4Å; L339-L360 HydrophobicContact CD2-CD2 4.4Å; L339-L360 HydrophobicContact CG-CD1 4.42Å; L348-L360 HydrophobicContact CD1-CD2 3.97Å; A356-L360 WeakPolarHBondContact O-CB 3.43Å; A356-L360 PolarHBondContact O-N 2.87Å; L357-L360 PolarHBondContact O-N 3.39Å; L358-L360 VanDerWaalsContact C-N 3.34Å; L358-L360 PolarHBondContact O-N 3.38Å; L360-F362 VanDerWaalsContact C-N 3.33Å; L360-F362 PolarHBondContact O-N 3.36Å; L360-W363 PolarHBondContact O-N 2.97Å; L360-L364 VanDerWaalsContact O-CB 3.29Å; L360-L364 WeakPolarHBondContact O-CB 3.41Å; L360-L364 PolarHBondContact O-N 3.11Å; L360-F405 HydrophobicContact CD2-CD1 4.48Å; L360-F405 HydrophobicContact CD2-CE1 3.72Å; L360-F405 HydrophobicContact CD2-CZ 4.25Å
361	N	85	Confident	80.6	Confident	28 Å²	28	57.5 Å²	57.5	15%	0.15	28%	0.278	C	S	.	.	H	α-helix	trans	-59.1	-42.4	176.7	-84.8	-71.3	0	0	0	111.8	L357 L358 W363 L364 G365 N406 S407	L357-N361 WeakPolarHBondContact O-CB 3.32Å; L357-N361 PolarHBondContact O-N 3.17Å; L357-N361 PolarHBondContact O-ND2 3.37Å; L358-N361 PolarHBondContact O-N 3.27Å; N361-W363 PolarHBondContact O-N 2.81Å; N361-L364 PolarHBondContact O-N 2.81Å; N361-G365 PolarHBondContact O-N 2.7Å; N361-N406 PolarHBondContact OD1-N 2.86Å; N361-S407 WeakPolarHBondContact O-CB 3.26Å; N361-S407 PolarHBondContact O-OG 3.46Å; N361-S407 PolarHBondContact OD1-N 3.34Å; N361-S407 VanDerWaalsContact OD1-N 3.14Å; N361-S407 PolarHBondContact OD1-OG 2.87Å
362	F	81.3	Confident	80.5	Confident	163 Å²	163	56.2 Å²	56.2	72%	0.715	27%	0.267	S	S	*	.	H	α-helix	trans	-61.7	-46.2	176.5	-179.2	-92.9	0	0	0	111.9	L358 L360 Y366	L358-F362 VanDerWaalsContact O-CB 3.3Å; L358-F362 WeakPolarHBondContact O-CB 3.38Å; L358-F362 PolarHBondContact O-N 3.38Å; L360-F362 VanDerWaalsContact C-N 3.33Å; L360-F362 PolarHBondContact O-N 3.36Å; F362-Y366 WeakPolarHBondContact O-CB 3.48Å; F362-Y366 PolarHBondContact O-N 3.03Å
363	W	86.8	Confident	80.3	Confident	62 Å²	62	53.6 Å²	53.6	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-45.8	177.3	179.3	87.8	0	0	0	111.6	L289 G336 L339 R359 L360 N361 Y366 A367 F390	L289-W363 HydrophobicContact CD2-CH2 3.7Å; L289-W363 HydrophobicContact CD2-CZ3 4.14Å; G336-W363 VanDerWaalsContact CA-CZ3 3.41Å; L339-W363 HydrophobicContact CD1-CZ3 4.27Å; R359-W363 WeakPolarHBondContact O-CB 3.18Å; R359-W363 PolarHBondContact O-N 2.71Å; R359-W363 VanDerWaalsContact O-N 3.11Å; L360-W363 PolarHBondContact O-N 2.97Å; N361-W363 PolarHBondContact O-N 2.81Å; W363-Y366 PolarHBondContact O-N 2.82Å; W363-A367 HydrophobicContact CH2-CB 4.37Å; W363-A367 HydrophobicContact CZ3-CB 4.46Å; W363-A367 WeakPolarHBondContact O-CB 3.39Å; W363-A367 PolarHBondContact O-N 3.21Å; W363-F390 AromaticContact CH2-CE2 3.89Å; W363-F390 HydrophobicContact CH2-CE2 3.89Å; W363-F390 AromaticContact CZ3-CE2 3.99Å; W363-F390 HydrophobicContact CZ3-CE2 3.99Å; W363-F390 HydrophobicContact CZ3-CZ 4.49Å
364	L	87.1	Confident	79.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-45.5	-178.6	177.9	57.8	0	0	0	111.6	L360 N361 Y366 A367 L368 F390 L394 F405 S407	L360-L364 VanDerWaalsContact O-CB 3.29Å; L360-L364 WeakPolarHBondContact O-CB 3.41Å; L360-L364 PolarHBondContact O-N 3.11Å; N361-L364 PolarHBondContact O-N 2.81Å; L364-Y366 VanDerWaalsContact C-N 3.35Å; L364-Y366 PolarHBondContact O-N 2.91Å; L364-A367 PolarHBondContact O-N 2.9Å; L364-L368 HydrophobicContact CD1-CD1 3.86Å; L364-L368 HydrophobicContact CD1-CG 4.13Å; L364-L368 HydrophobicContact CG-CD1 3.97Å; L364-L368 WeakPolarHBondContact O-CB 3.44Å; L364-L368 WeakPolarHBondContact O-CG 3.35Å; L364-L368 PolarHBondContact O-N 3Å; L364-F390 HydrophobicContact CD1-CE1 4.46Å; L364-F390 HydrophobicContact CD1-CE2 4.48Å; L364-F390 HydrophobicContact CD1-CZ 3.66Å; L364-L394 HydrophobicContact CD1-CD1 3.98Å; L364-L394 HydrophobicContact CD1-CD2 4.08Å; L364-L394 HydrophobicContact CD2-CD1 3.69Å; L364-F405 HydrophobicContact CD2-CB 3.66Å; L364-F405 HydrophobicContact CD2-CD1 4.43Å; L364-F405 HydrophobicContact CD2-CD2 3.74Å; L364-F405 HydrophobicContact CD2-CG 3.69Å; L364-S407 WeakPolarHBondContact CB-OG 3.37Å; L364-S407 WeakPolarHBondContact CD2-OG 3.4Å; L364-S407 WeakPolarHBondContact CG-OG 3.36Å
365	G	84.1	Confident	78.6	Confident	9 Å²	9	51.8 Å²	51.8	9%	0.093	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-44.4	174.9	0	0	0	0	0	112	N361 H369	N361-G365 PolarHBondContact O-N 2.7Å; G365-H369 VanDerWaalsContact O-CB 3.3Å; G365-H369 WeakPolarHBondContact O-CB 3.32Å; G365-H369 PolarHBondContact O-CD2 2.81Å; G365-H369 PolarHBondContact O-N 3.23Å
366	Y	80.6	Confident	77	Confident	124 Å²	124	53.7 Å²	53.7	49%	0.486	26%	0.261	S	S	.	.	H	α-helix	trans	-61.6	-46.6	175.6	-178.7	-104.5	0	0	0	112	F362 W363 L364 H369 E370	F362-Y366 WeakPolarHBondContact O-CB 3.48Å; F362-Y366 PolarHBondContact O-N 3.03Å; W363-Y366 PolarHBondContact O-N 2.82Å; L364-Y366 VanDerWaalsContact C-N 3.35Å; L364-Y366 PolarHBondContact O-N 2.91Å; Y366-H369 PolarHBondContact O-N 2.88Å; Y366-E370 HydrophobicContact CD1-CG 4.28Å; Y366-E370 HydrophobicContact CD2-CG 3.99Å; Y366-E370 HydrophobicContact CE1-CG 3.88Å; Y366-E370 HydrophobicContact CE2-CG 3.52Å; Y366-E370 HydrophobicContact CG-CG 4.34Å; Y366-E370 VanDerWaalsContact CZ-CG 3.46Å; Y366-E370 WeakPolarHBondContact O-CB 3.5Å; Y366-E370 VanDerWaalsContact O-CG 3.32Å; Y366-E370 WeakPolarHBondContact O-CG 3.49Å; Y366-E370 PolarHBondContact O-N 3.3Å
367	A	82.1	Confident	75.1	Confident	15 Å²	15	60.7 Å²	60.7	12%	0.124	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-45.9	179.6	0	0	0	0	0	112.5	L287 W363 L364 E371	L287-A367 HydrophobicContact CD2-CB 4.31Å; W363-A367 HydrophobicContact CH2-CB 4.37Å; W363-A367 HydrophobicContact CZ3-CB 4.46Å; W363-A367 WeakPolarHBondContact O-CB 3.39Å; W363-A367 PolarHBondContact O-N 3.21Å; L364-A367 PolarHBondContact O-N 2.9Å; A367-E371 PolarHBondContact O-N 2.7Å
368	L	85.3	Confident	73.2	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.6	-44.5	177.9	-73.1	167.9	0	0	0	112	L364 F372 F390 L391 F411	L364-L368 HydrophobicContact CD1-CD1 3.86Å; L364-L368 HydrophobicContact CD1-CG 4.13Å; L364-L368 HydrophobicContact CG-CD1 3.97Å; L364-L368 WeakPolarHBondContact O-CB 3.44Å; L364-L368 WeakPolarHBondContact O-CG 3.35Å; L364-L368 PolarHBondContact O-N 3Å; L368-F372 HydrophobicContact CD2-CD2 4.18Å; L368-F372 HydrophobicContact CD2-CE2 4.05Å; L368-F372 WeakPolarHBondContact O-CB 3.23Å; L368-F372 WeakPolarHBondContact O-CD2 3.28Å; L368-F372 PolarHBondContact O-N 3.49Å; L368-F390 HydrophobicContact CD2-CE1 3.79Å; L368-F390 HydrophobicContact CG-CE1 4.34Å; L368-L391 HydrophobicContact CD2-CD2 4.07Å; L368-F411 HydrophobicContact CB-CB 4.14Å; L368-F411 HydrophobicContact CB-CD1 4.17Å; L368-F411 HydrophobicContact CB-CD2 3.83Å; L368-F411 HydrophobicContact CB-CE2 4.31Å; L368-F411 HydrophobicContact CB-CG 3.75Å; L368-F411 HydrophobicContact CD1-CB 4.09Å; L368-F411 HydrophobicContact CD1-CD1 3.92Å; L368-F411 HydrophobicContact CD1-CG 4.05Å; L368-F411 HydrophobicContact CD2-CD1 4.12Å; L368-F411 HydrophobicContact CD2-CE1 4.07Å; L368-F411 HydrophobicContact CD2-CZ 4.49Å; L368-F411 HydrophobicContact CG-CD1 4.31Å; L368-F411 HydrophobicContact CG-CG 4.34Å
369	H	81.3	Confident	71.4	Confident	30 Å²	30	56.9 Å²	56.9	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-42.7	-179.9	-81	-60.9	0	0	0	113	G365 Y366 L373 F374	G365-H369 VanDerWaalsContact O-CB 3.3Å; G365-H369 WeakPolarHBondContact O-CB 3.32Å; G365-H369 PolarHBondContact O-CD2 2.81Å; G365-H369 PolarHBondContact O-N 3.23Å; Y366-H369 PolarHBondContact O-N 2.88Å; H369-L373 VanDerWaalsContact CE1-CD1 3.49Å; H369-L373 WeakPolarHBondContact CE1-CD1 3.39Å; H369-L373 WeakPolarHBondContact ND1-CD1 3.37Å; H369-L373 WeakPolarHBondContact O-CA 3.46Å; H369-L373 WeakPolarHBondContact O-CB 3.37Å; H369-L373 PolarHBondContact O-N 3.05Å; H369-F374 HydrophobicContact CB-CD2 4.16Å; H369-F374 HydrophobicContact CB-CE2 3.76Å; H369-F374 VanDerWaalsContact O-CD2 3.28Å; H369-F374 WeakPolarHBondContact O-CD2 3.45Å; H369-F374 PolarHBondContact O-N 3.25Å
370	E	75.4	Confident	69.6	Low	54 Å²	54	54.3 Å²	54.3	25%	0.252	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-45	178.3	-74.7	-73.3	128.6	0	0	112.1	Y366 F374 C375	Y366-E370 HydrophobicContact CD1-CG 4.28Å; Y366-E370 HydrophobicContact CD2-CG 3.99Å; Y366-E370 HydrophobicContact CE1-CG 3.88Å; Y366-E370 HydrophobicContact CE2-CG 3.52Å; Y366-E370 HydrophobicContact CG-CG 4.34Å; Y366-E370 VanDerWaalsContact CZ-CG 3.46Å; Y366-E370 WeakPolarHBondContact O-CB 3.5Å; Y366-E370 VanDerWaalsContact O-CG 3.32Å; Y366-E370 WeakPolarHBondContact O-CG 3.49Å; Y366-E370 PolarHBondContact O-N 3.3Å; E370-F374 HydrophobicContact CG-CD2 4.48Å; E370-F374 WeakPolarHBondContact OE1-CD2 3.44Å; E370-C375 PolarHBondContact O-SG 2.83Å
371	E	74.6	Confident	67.9	Low	34 Å²	34	61 Å²	61	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-74.2	-46.5	-176.2	-164.3	72	-169.1	0	0	112.3	A285 L287 A367 C375	A285-E371 WeakPolarHBondContact CB-OE2 3.46Å; L287-E371 HydrophobicContact CD1-CB 4.17Å; L287-E371 HydrophobicContact CD1-CG 3.69Å; L287-E371 HydrophobicContact CD2-CB 4.35Å; L287-E371 HydrophobicContact CG-CB 4.35Å; L287-E371 HydrophobicContact CG-CG 4.14Å; A367-E371 PolarHBondContact O-N 2.7Å; E371-C375 WeakPolarHBondContact O-CB 3.03Å
372	F	77.1	Confident	66.4	Low	26 Å²	26	64.5 Å²	64.5	11%	0.114	35%	0.353	C	S	.	.	H	α-helix	trans	-98.2	-28.1	-167.8	-68.3	-78.5	0	0	0	114.4	L287 L368 A387 L391 F411 F415 L423 L424	L287-F372 HydrophobicContact CD1-CE2 4.45Å; L368-F372 HydrophobicContact CD2-CD2 4.18Å; L368-F372 HydrophobicContact CD2-CE2 4.05Å; L368-F372 WeakPolarHBondContact O-CB 3.23Å; L368-F372 WeakPolarHBondContact O-CD2 3.28Å; L368-F372 PolarHBondContact O-N 3.49Å; F372-A387 HydrophobicContact CZ-CB 4.22Å; F372-L391 HydrophobicContact CE2-CD2 4.34Å; F372-L391 HydrophobicContact CZ-CD1 4Å; F372-L391 HydrophobicContact CZ-CD2 4.42Å; F372-L391 HydrophobicContact CZ-CG 4.33Å; F372-F411 HydrophobicContact CB-CE2 3.58Å; F372-F411 HydrophobicContact CB-CZ 3.81Å; F372-F411 HydrophobicContact CD2-CE2 4.19Å; F372-F411 AromaticContact CD2-CZ 3.89Å; F372-F411 HydrophobicContact CD2-CZ 3.89Å; F372-F411 HydrophobicContact CG-CE2 4.13Å; F372-F411 AromaticContact CG-CZ 3.88Å; F372-F411 HydrophobicContact CG-CZ 3.88Å; F372-F415 HydrophobicContact CB-CD2 3.99Å; F372-F415 HydrophobicContact CB-CE2 3.84Å; F372-F415 HydrophobicContact CD1-CE2 4.22Å; F372-F415 HydrophobicContact CD1-CZ 4.19Å; F372-F415 HydrophobicContact CG-CE2 4.42Å; F372-L423 HydrophobicContact CD1-CD2 4.13Å; F372-L423 HydrophobicContact CE1-CD2 4.17Å; F372-L424 HydrophobicContact CE1-CD1 3.98Å; F372-L424 HydrophobicContact CZ-CD1 4.04Å
373	L	72.3	Confident	65.5	Low	39 Å²	39	61 Å²	61	20%	0.204	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-33.3	-174.3	-78.8	160.6	0	0	0	113.8	H369 F411 K414 F415 V418	H369-L373 VanDerWaalsContact CE1-CD1 3.49Å; H369-L373 WeakPolarHBondContact CE1-CD1 3.39Å; H369-L373 WeakPolarHBondContact ND1-CD1 3.37Å; H369-L373 WeakPolarHBondContact O-CA 3.46Å; H369-L373 WeakPolarHBondContact O-CB 3.37Å; H369-L373 PolarHBondContact O-N 3.05Å; L373-F411 HydrophobicContact CD1-CD2 3.92Å; L373-F411 HydrophobicContact CD1-CE2 4.13Å; L373-F411 HydrophobicContact CG-CE2 4.46Å; L373-K414 HydrophobicContact CD1-CB 3.99Å; L373-F415 HydrophobicContact CD2-CD2 4.47Å; L373-F415 HydrophobicContact CG-CD2 4.4Å; L373-V418 HydrophobicContact CD2-CG2 3.67Å
374	F	62.3	Low	64.6	Low	127 Å²	127	61.4 Å²	61.4	56%	0.557	35%	0.352	S	S	*	.	S	Bend	trans	-94.9	-7.9	-177.8	-62.1	-52.3	0	0	0	114.5	H369 E370 S376	H369-F374 HydrophobicContact CB-CD2 4.16Å; H369-F374 HydrophobicContact CB-CE2 3.76Å; H369-F374 VanDerWaalsContact O-CD2 3.28Å; H369-F374 WeakPolarHBondContact O-CD2 3.45Å; H369-F374 PolarHBondContact O-N 3.25Å; E370-F374 HydrophobicContact CG-CD2 4.48Å; E370-F374 WeakPolarHBondContact OE1-CD2 3.44Å; F374-S376 VanDerWaalsContact C-N 3.29Å; F374-S376 PolarHBondContact O-N 3.35Å
375	C	54.3	Low	64.2	Low	32 Å²	32	68.4 Å²	68.4	22%	0.216	39%	0.385	C	S	.	.			trans	-88.6	40.1	175.6	-77.2	0	0	0	0	114.1	E370 E371 D377 A380	E370-C375 PolarHBondContact O-SG 2.83Å; E371-C375 WeakPolarHBondContact O-CB 3.03Å; C375-D377 PolarHBondContact O-N 2.93Å; C375-A380 HydrophobicContact CB-CB 4.33Å
376	S	42.7	Very low	64	Low	103 Å²	103	70 Å²	70	72%	0.72	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11	-179.7	54.5	0	0	0	0	115.4	F374	F374-S376 VanDerWaalsContact C-N 3.29Å; F374-S376 PolarHBondContact O-N 3.35Å
377	D	39.2	Very low	64	Low	147 Å²	147	64.4 Å²	64.4	79%	0.786	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	79.4	174.8	-91.8	-23.3	0	0	0	111.9	C375 G379	C375-D377 PolarHBondContact O-N 2.93Å; D377-G379 PolarHBondContact O-N 3.2Å
378	G	40.3	Very low	64.3	Low	80 Å²	80	66.8 Å²	66.8	83%	0.825	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	25.2	164	0	0	0	0	0	116.3
379	G	41.7	Very low	64.4	Low	13 Å²	13	71.6 Å²	71.6	13%	0.134	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-28.5	-174.1	0	0	0	0	0	116.1	D377 N381 K382	D377-G379 PolarHBondContact O-N 3.2Å; G379-N381 PolarHBondContact O-N 2.9Å; G379-K382 PolarHBondContact O-N 3.49Å
380	A	43.5	Very low	64.7	Low	55 Å²	55	70.3 Å²	70.3	46%	0.455	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-1.6	-170.3	0	0	0	0	0	115.7	C375	C375-A380 HydrophobicContact CB-CB 4.33Å
381	N	47.9	Very low	65.5	Low	140 Å²	140	67.8 Å²	67.8	75%	0.749	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	19.6	-172.2	-129	9	0	0	0	113.5	G379	G379-N381 PolarHBondContact O-N 2.9Å
382	K	53.8	Low	66.3	Low	102 Å²	102	69.5 Å²	69.5	44%	0.443	39%	0.394	S	S	.	.	S	Bend	trans	-81.8	-36.5	-172.9	-75.7	-173	173.1	-164.4	0	114.1	G379	G379-K382 PolarHBondContact O-N 3.49Å
383	N	62.4	Low	66.9	Low	90 Å²	90	73.2 Å²	73.2	48%	0.481	41%	0.407	S	S	.	.			trans	-153.5	82.6	176.4	-77.2	-24.4	0	0	0	111.6	E385 E386	N383-E385 PolarHBondContact O-N 3.25Å; N383-E386 HydrophobicContact CB-CB 4.24Å; N383-E386 HydrophobicContact CB-CG 4.02Å; N383-E386 PolarHBondContact ND2-OE1 3.37Å; N383-E386 PolarHBondContact O-N 2.89Å
384	P	69.4	Low	67.8	Low	69 Å²	69	71.3 Å²	71.3	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-62.6	-25	178.8	26.5	-34.8	0	0	0	113.1	A387 L388	P384-A387 PolarHBondContact O-N 2.94Å; P384-L388 VanDerWaalsContact O-CB 3.31Å; P384-L388 WeakPolarHBondContact O-CB 3.39Å; P384-L388 PolarHBondContact O-N 3.47Å
385	E	77.3	Confident	69.2	Low	148 Å²	148	66.1 Å²	66.1	69%	0.692	38%	0.376	S	S	*	.	H	α-helix	trans	-66.7	-38.5	177.9	-69.3	175.6	179.3	0	0	112.8	N383 L388 Q389	N383-E385 PolarHBondContact O-N 3.25Å; E385-L388 PolarHBondContact O-N 3.29Å; E385-Q389 VanDerWaalsContact O-CG 3.31Å; E385-Q389 WeakPolarHBondContact O-CG 3.46Å; E385-Q389 PolarHBondContact O-N 3.34Å
386	E	79.6	Confident	71	Confident	41 Å²	41	67.7 Å²	67.7	19%	0.192	39%	0.387	C	S	.	.	H	α-helix	trans	-66.5	-42.8	176	-72.2	-178.8	-147	0	0	111	H286 N383 L388 Q389 F390	H286-E386 IonicContact CE1-OE1 3.44Å; H286-E386 PolarHBondContact CE1-OE1 2.75Å; H286-E386 IonicContact CE1-OE2 3.1Å; H286-E386 PolarHBondContact CE1-OE2 2.88Å; H286-E386 VanDerWaalsContact CE1-OE2 3.26Å; H286-E386 IonicContact CG-OE2 3.72Å; H286-E386 IonicContact ND1-OE1 2.97Å; H286-E386 IonicContact ND1-OE2 3.98Å; H286-E386 PolarHBondContact ND1-OE2 2.99Å; N383-E386 HydrophobicContact CB-CB 4.24Å; N383-E386 HydrophobicContact CB-CG 4.02Å; N383-E386 PolarHBondContact ND2-OE1 3.37Å; N383-E386 PolarHBondContact O-N 2.89Å; E386-L388 VanDerWaalsContact C-N 3.34Å; E386-Q389 PolarHBondContact O-N 3.31Å; E386-F390 WeakPolarHBondContact O-CB 3.44Å; E386-F390 PolarHBondContact O-N 2.92Å
387	A	82.5	Confident	73.3	Confident	7 Å²	7	62.8 Å²	62.8	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-42.6	175.5	0	0	0	0	0	111.8	L287 F372 P384 F390 L391 L424	L287-A387 VanDerWaalsContact CD1-CA 3.49Å; L287-A387 HydrophobicContact CD1-CB 3.71Å; F372-A387 HydrophobicContact CZ-CB 4.22Å; P384-A387 PolarHBondContact O-N 2.94Å; A387-F390 PolarHBondContact O-N 3.4Å; A387-L391 WeakPolarHBondContact O-CB 3.25Å; A387-L391 VanDerWaalsContact O-CG 3.31Å; A387-L391 WeakPolarHBondContact O-CG 2.97Å; A387-L391 PolarHBondContact O-N 2.75Å; A387-L424 HydrophobicContact CB-CD1 3.71Å
388	L	87	Confident	75.8	Confident	65 Å²	65	55.8 Å²	55.8	34%	0.34	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-47.1	174.7	-177.1	147.3	0	0	0	111.8	P384 E385 E386 F390 L391 N392 L424	P384-L388 VanDerWaalsContact O-CB 3.31Å; P384-L388 WeakPolarHBondContact O-CB 3.39Å; P384-L388 PolarHBondContact O-N 3.47Å; E385-L388 PolarHBondContact O-N 3.29Å; E386-L388 VanDerWaalsContact C-N 3.34Å; L388-F390 VanDerWaalsContact C-N 3.34Å; L388-F390 PolarHBondContact O-N 3.41Å; L388-L391 PolarHBondContact O-N 3.41Å; L388-N392 WeakPolarHBondContact CD2-ND2 3.44Å; L388-N392 WeakPolarHBondContact O-CB 3.47Å; L388-N392 PolarHBondContact O-N 2.9Å; L388-N392 PolarHBondContact O-ND2 3.48Å; L388-L424 HydrophobicContact CB-CD2 3.83Å; L388-L424 HydrophobicContact CD1-CD2 4.14Å; L388-L424 HydrophobicContact CG-CD2 4.35Å
389	Q	86.8	Confident	78.1	Confident	102 Å²	102	56.6 Å²	56.6	48%	0.477	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-41.6	178.7	-74.3	178.7	25.6	0	0	112.1	E385 E386 R393	E385-Q389 VanDerWaalsContact O-CG 3.31Å; E385-Q389 WeakPolarHBondContact O-CG 3.46Å; E385-Q389 PolarHBondContact O-N 3.34Å; E386-Q389 PolarHBondContact O-N 3.31Å; Q389-R393 WeakPolarHBondContact O-CG 3.23Å; Q389-R393 PolarHBondContact O-N 2.97Å
390	F	89.1	Confident	80.4	Confident	3 Å²	3	60 Å²	60	1%	0.013	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-50	176.4	169.6	-98.9	0	0	0	112.1	L287 L289 W363 L364 L368 E386 A387 L388 N392 R393 L394	L287-F390 HydrophobicContact CB-CB 3.72Å; L287-F390 HydrophobicContact CB-CD1 4.41Å; L287-F390 HydrophobicContact CB-CD2 4.27Å; L287-F390 HydrophobicContact CB-CG 3.88Å; L287-F390 HydrophobicContact CD1-CB 4.2Å; L287-F390 HydrophobicContact CD1-CD1 3.95Å; L287-F390 HydrophobicContact CD1-CG 4.21Å; L287-F390 HydrophobicContact CD2-CD1 3.69Å; L287-F390 HydrophobicContact CD2-CD2 4.15Å; L287-F390 HydrophobicContact CD2-CE1 3.8Å; L287-F390 HydrophobicContact CD2-CE2 4.25Å; L287-F390 HydrophobicContact CD2-CG 3.87Å; L287-F390 HydrophobicContact CD2-CZ 4.08Å; L287-F390 HydrophobicContact CG-CB 4.41Å; L287-F390 HydrophobicContact CG-CD1 4.26Å; L287-F390 HydrophobicContact CG-CG 4.23Å; L289-F390 HydrophobicContact CD2-CD2 3.96Å; L289-F390 HydrophobicContact CD2-CE2 3.97Å; L289-F390 HydrophobicContact CG-CD2 4.16Å; W363-F390 AromaticContact CH2-CE2 3.89Å; W363-F390 HydrophobicContact CH2-CE2 3.89Å; W363-F390 AromaticContact CZ3-CE2 3.99Å; W363-F390 HydrophobicContact CZ3-CE2 3.99Å; W363-F390 HydrophobicContact CZ3-CZ 4.49Å; L364-F390 HydrophobicContact CD1-CE1 4.46Å; L364-F390 HydrophobicContact CD1-CE2 4.48Å; L364-F390 HydrophobicContact CD1-CZ 3.66Å; L368-F390 HydrophobicContact CD2-CE1 3.79Å; L368-F390 HydrophobicContact CG-CE1 4.34Å; E386-F390 WeakPolarHBondContact O-CB 3.44Å; E386-F390 PolarHBondContact O-N 2.92Å; A387-F390 PolarHBondContact O-N 3.4Å; L388-F390 VanDerWaalsContact C-N 3.34Å; L388-F390 PolarHBondContact O-N 3.41Å; F390-N392 VanDerWaalsContact C-N 3.32Å; F390-N392 PolarHBondContact O-N 3.37Å; F390-R393 PolarHBondContact O-N 3.45Å; F390-L394 WeakPolarHBondContact O-CB 3.25Å; F390-L394 PolarHBondContact O-N 3.23Å
391	L	90.8	Very high	82.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.3	-38.6	178.6	-68.6	-171.9	0	0	0	111.8	L368 F372 A387 L388 R393 L394 L395 L424 Q427 I428 L431	L368-L391 HydrophobicContact CD2-CD2 4.07Å; F372-L391 HydrophobicContact CE2-CD2 4.34Å; F372-L391 HydrophobicContact CZ-CD1 4Å; F372-L391 HydrophobicContact CZ-CD2 4.42Å; F372-L391 HydrophobicContact CZ-CG 4.33Å; A387-L391 WeakPolarHBondContact O-CB 3.25Å; A387-L391 VanDerWaalsContact O-CG 3.31Å; A387-L391 WeakPolarHBondContact O-CG 2.97Å; A387-L391 PolarHBondContact O-N 2.75Å; L388-L391 PolarHBondContact O-N 3.41Å; L391-R393 VanDerWaalsContact C-N 3.34Å; L391-R393 PolarHBondContact O-N 2.86Å; L391-L394 HydrophobicContact CD2-CD2 4.41Å; L391-L394 WeakPolarHBondContact O-CB 3.17Å; L391-L394 PolarHBondContact O-N 3.24Å; L391-L395 WeakPolarHBondContact O-CB 3.03Å; L391-L395 WeakPolarHBondContact O-CG 3.43Å; L391-L395 PolarHBondContact O-N 2.79Å; L391-L424 HydrophobicContact CD1-CB 4.18Å; L391-L424 HydrophobicContact CD1-CD1 3.71Å; L391-Q427 HydrophobicContact CB-CB 3.9Å; L391-Q427 HydrophobicContact CB-CG 4.03Å; L391-Q427 HydrophobicContact CD1-CB 3.71Å; L391-Q427 HydrophobicContact CD1-CG 4.44Å; L391-Q427 HydrophobicContact CG-CB 4.48Å; L391-I428 HydrophobicContact CD1-CD1 4.11Å; L391-L431 HydrophobicContact CD2-CD1 4.01Å
392	N	91.6	Very high	84.2	Confident	70 Å²	70	59.4 Å²	59.4	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-40.2	175.2	-75.5	-12.5	0	0	0	111.9	L388 F390 L395 S396 Q427	L388-N392 WeakPolarHBondContact CD2-ND2 3.44Å; L388-N392 WeakPolarHBondContact O-CB 3.47Å; L388-N392 PolarHBondContact O-N 2.9Å; L388-N392 PolarHBondContact O-ND2 3.48Å; F390-N392 VanDerWaalsContact C-N 3.32Å; F390-N392 PolarHBondContact O-N 3.37Å; N392-L395 PolarHBondContact O-N 3.16Å; N392-S396 WeakPolarHBondContact O-CB 3.29Å; N392-S396 PolarHBondContact O-N 3.41Å; N392-Q427 WeakPolarHBondContact OD1-CG 3.49Å; N392-Q427 PolarHBondContact OD1-NE2 3.33Å
393	R	89.6	Confident	85.6	Confident	104 Å²	104	58.9 Å²	58.9	39%	0.392	29%	0.292	S	S	.	.	H	α-helix	trans	-68.9	-39.9	175.9	-72.3	175.2	-172.6	-173.1	13.6	111.7	L289 Q389 F390 L391 S396 A397	L289-R393 HydrophobicContact CD1-CB 3.83Å; L289-R393 HydrophobicContact CD1-CG 4.2Å; Q389-R393 WeakPolarHBondContact O-CG 3.23Å; Q389-R393 PolarHBondContact O-N 2.97Å; F390-R393 PolarHBondContact O-N 3.45Å; L391-R393 VanDerWaalsContact C-N 3.34Å; L391-R393 PolarHBondContact O-N 2.86Å; R393-S396 WeakPolarHBondContact CA-OG 3.5Å; R393-S396 PolarHBondContact O-N 3.14Å; R393-S396 PolarHBondContact O-OG 2.85Å; R393-A397 WeakPolarHBondContact O-CB 3.43Å; R393-A397 PolarHBondContact O-N 3.25Å
394	L	92	Very high	86.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.8	-47.5	172.9	178.4	61.7	0	0	0	111.4	L339 L364 F390 L391 S396 A397 Q398 F405 L431	L339-L394 HydrophobicContact CD1-CD1 4.28Å; L364-L394 HydrophobicContact CD1-CD1 3.98Å; L364-L394 HydrophobicContact CD1-CD2 4.08Å; L364-L394 HydrophobicContact CD2-CD1 3.69Å; F390-L394 WeakPolarHBondContact O-CB 3.25Å; F390-L394 PolarHBondContact O-N 3.23Å; L391-L394 HydrophobicContact CD2-CD2 4.41Å; L391-L394 WeakPolarHBondContact O-CB 3.17Å; L391-L394 PolarHBondContact O-N 3.24Å; L394-S396 VanDerWaalsContact C-N 3.35Å; L394-S396 PolarHBondContact O-N 3.04Å; L394-A397 WeakPolarHBondContact O-CB 3.43Å; L394-A397 PolarHBondContact O-N 3.18Å; L394-Q398 WeakPolarHBondContact O-CG 3.4Å; L394-Q398 PolarHBondContact O-N 3.28Å; L394-F405 HydrophobicContact CD1-CD2 3.59Å; L394-F405 HydrophobicContact CD1-CE2 3.69Å; L394-L431 HydrophobicContact CD2-CD1 4.33Å; L394-L431 HydrophobicContact CD2-CD2 3.77Å; L394-L431 HydrophobicContact CG-CD2 4.01Å
395	L	92.5	Very high	87.4	Confident	18 Å²	18	53 Å²	53	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-43.5	174.9	-75.2	167.6	0	0	0	111.6	L391 N392 A397 Q398 H399 Q427 L431	L391-L395 WeakPolarHBondContact O-CB 3.03Å; L391-L395 WeakPolarHBondContact O-CG 3.43Å; L391-L395 PolarHBondContact O-N 2.79Å; N392-L395 PolarHBondContact O-N 3.16Å; L395-A397 VanDerWaalsContact C-N 3.26Å; L395-A397 PolarHBondContact O-N 3.04Å; L395-Q398 PolarHBondContact O-N 3.22Å; L395-H399 WeakPolarHBondContact O-CB 3.33Å; L395-H399 PolarHBondContact O-CD2 3.21Å; L395-H399 PolarHBondContact O-N 3.17Å; L395-Q427 HydrophobicContact CD1-CB 4.16Å; L395-Q427 HydrophobicContact CD1-CG 4.29Å; L395-L431 HydrophobicContact CD2-CD2 3.61Å; L395-L431 HydrophobicContact CD2-CG 3.98Å; L395-L431 HydrophobicContact CG-CD2 3.96Å; L395-L431 HydrophobicContact CG-CG 4.37Å
396	S	91.3	Very high	87.8	Confident	64 Å²	64	49.5 Å²	49.5	45%	0.448	25%	0.248	S	C	.	.	H	α-helix	trans	-61.6	-36.3	176.7	74.4	0	0	0	0	112.3	N392 R393 L394 F400	N392-S396 WeakPolarHBondContact O-CB 3.29Å; N392-S396 PolarHBondContact O-N 3.41Å; R393-S396 WeakPolarHBondContact CA-OG 3.5Å; R393-S396 PolarHBondContact O-N 3.14Å; R393-S396 PolarHBondContact O-OG 2.85Å; L394-S396 VanDerWaalsContact C-N 3.35Å; L394-S396 PolarHBondContact O-N 3.04Å; S396-F400 VanDerWaalsContact O-CB 3.3Å; S396-F400 WeakPolarHBondContact O-CB 3.38Å; S396-F400 PolarHBondContact O-N 3.04Å
397	A	91.1	Very high	88.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-69.8	-42.7	176	0	0	0	0	0	111.7	L339 L345 R393 L394 L395 F400 L401 F405	L339-A397 HydrophobicContact CB-CB 4.48Å; L339-A397 HydrophobicContact CD2-CB 3.89Å; L345-A397 HydrophobicContact CD1-CB 3.82Å; L345-A397 HydrophobicContact CD2-CB 4.04Å; R393-A397 WeakPolarHBondContact O-CB 3.43Å; R393-A397 PolarHBondContact O-N 3.25Å; L394-A397 WeakPolarHBondContact O-CB 3.43Å; L394-A397 PolarHBondContact O-N 3.18Å; L395-A397 VanDerWaalsContact C-N 3.26Å; L395-A397 PolarHBondContact O-N 3.04Å; A397-F400 WeakPolarHBondContact O-CB 3.32Å; A397-F400 PolarHBondContact O-N 3.39Å; A397-L401 WeakPolarHBondContact O-CG 3.28Å; A397-L401 PolarHBondContact O-N 3.07Å; A397-F405 HydrophobicContact CB-CE2 4.43Å
398	Q	90.9	Very high	88.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-40.7	174.9	-70.4	-178.3	-29.6	0	0	112	L394 L395 F400 L401 Q402 E403 F405 L431 N434	L394-Q398 WeakPolarHBondContact O-CG 3.4Å; L394-Q398 PolarHBondContact O-N 3.28Å; L395-Q398 PolarHBondContact O-N 3.22Å; Q398-F400 VanDerWaalsContact C-N 3.31Å; Q398-F400 PolarHBondContact O-N 3.06Å; Q398-L401 PolarHBondContact O-N 3.06Å; Q398-Q402 VanDerWaalsContact O-CA 3.32Å; Q398-Q402 WeakPolarHBondContact O-CA 3.31Å; Q398-Q402 PolarHBondContact O-N 2.95Å; Q398-E403 WeakPolarHBondContact CA-O 3.22Å; Q398-E403 WeakPolarHBondContact CB-O 3.43Å; Q398-E403 PolarHBondContact O-N 3.02Å; Q398-F405 HydrophobicContact CG-CD2 3.72Å; Q398-F405 HydrophobicContact CG-CE2 3.77Å; Q398-L431 VanDerWaalsContact OE1-CD2 3.22Å; Q398-N434 PolarHBondContact OE1-ND2 3.06Å
399	H	89.3	Confident	88.6	Confident	96 Å²	96	45.2 Å²	45.2	44%	0.444	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-35.2	172.8	-74.2	-54.9	0	0	0	112.2	L395 Q402	L395-H399 WeakPolarHBondContact O-CB 3.33Å; L395-H399 PolarHBondContact O-CD2 3.21Å; L395-H399 PolarHBondContact O-N 3.17Å; H399-Q402 PolarHBondContact O-NE2 2.96Å
400	F	90	Very high	88.7	Confident	86 Å²	86	42.3 Å²	42.3	38%	0.377	22%	0.221	S	C	.	.	H	α-helix	trans	-66.5	-46.4	175.7	-177.4	-88	0	0	0	111.5	L345 Q346 S396 A397 Q398 Q402	L345-F400 HydrophobicContact CB-CD1 3.5Å; L345-F400 HydrophobicContact CB-CE1 3.7Å; L345-F400 HydrophobicContact CB-CG 4.41Å; L345-F400 HydrophobicContact CD1-CB 4Å; L345-F400 HydrophobicContact CD1-CD1 3.88Å; L345-F400 HydrophobicContact CD1-CG 4.01Å; L345-F400 HydrophobicContact CG-CD1 4.34Å; Q346-F400 HydrophobicContact CG-CE1 3.81Å; Q346-F400 HydrophobicContact CG-CZ 3.45Å; Q346-F400 VanDerWaalsContact CG-CZ 3.45Å; S396-F400 VanDerWaalsContact O-CB 3.3Å; S396-F400 WeakPolarHBondContact O-CB 3.38Å; S396-F400 PolarHBondContact O-N 3.04Å; A397-F400 WeakPolarHBondContact O-CB 3.32Å; A397-F400 PolarHBondContact O-N 3.39Å; Q398-F400 VanDerWaalsContact C-N 3.31Å; Q398-F400 PolarHBondContact O-N 3.06Å; F400-Q402 VanDerWaalsContact C-N 3.29Å; F400-Q402 PolarHBondContact O-N 3.21Å
401	L	86.7	Confident	88.8	Confident	27 Å²	27	42.2 Å²	42.2	14%	0.141	22%	0.22	C	C	.	.	H	α-helix	trans	-77.6	-14.1	-179.6	-64.9	174.2	0	0	0	113.2	L345 D349 A397 Q398 E403 F405	L345-L401 HydrophobicContact CB-CD2 4.17Å; L345-L401 HydrophobicContact CD2-CD1 4.15Å; L345-L401 HydrophobicContact CD2-CG 4.44Å; D349-L401 HydrophobicContact CB-CD2 4.01Å; A397-L401 WeakPolarHBondContact O-CG 3.28Å; A397-L401 PolarHBondContact O-N 3.07Å; Q398-L401 PolarHBondContact O-N 3.06Å; L401-E403 HydrophobicContact CB-CB 4.5Å; L401-E403 PolarHBondContact O-N 3.06Å; L401-E403 VanDerWaalsContact O-N 3.1Å; L401-F405 HydrophobicContact CD1-CE1 4.19Å; L401-F405 HydrophobicContact CD1-CZ 3.82Å
402	Q	85	Confident	88.8	Confident	154 Å²	154	42.2 Å²	42.2	72%	0.72	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	17.1	-168.6	-59.4	-68.3	-43.2	0	0	113.8	Q398 H399 F400	Q398-Q402 VanDerWaalsContact O-CA 3.32Å; Q398-Q402 WeakPolarHBondContact O-CA 3.31Å; Q398-Q402 PolarHBondContact O-N 2.95Å; H399-Q402 PolarHBondContact O-NE2 2.96Å; F400-Q402 VanDerWaalsContact C-N 3.29Å; F400-Q402 PolarHBondContact O-N 3.21Å
403	E	82	Confident	88.7	Confident	91 Å²	91	40.8 Å²	40.8	43%	0.425	21%	0.211	S	C	.	.	S	Bend	trans	-134.4	148.3	-177	-67.8	-169.3	164.5	0	0	112	Q398 L401	Q398-E403 WeakPolarHBondContact CA-O 3.22Å; Q398-E403 WeakPolarHBondContact CB-O 3.43Å; Q398-E403 PolarHBondContact O-N 3.02Å; L401-E403 HydrophobicContact CB-CB 4.5Å; L401-E403 PolarHBondContact O-N 3.06Å; L401-E403 VanDerWaalsContact O-N 3.1Å
404	G	83.9	Confident	88.7	Confident	26 Å²	26	41.6 Å²	41.6	27%	0.268	22%	0.217	S	C	.	.			trans	-78.8	168.9	172.7	0	0	0	0	0	112.6
405	F	87.4	Confident	88.6	Confident	9 Å²	9	42 Å²	42	4%	0.039	22%	0.219	C	C	.	.			trans	-107.4	128.8	170.8	-66.6	-75.8	0	0	0	108.7	L339 L360 L364 L394 A397 Q398 L401 S407 S408 D409	L339-F405 HydrophobicContact CD2-CE2 3.94Å; L339-F405 HydrophobicContact CD2-CZ 3.76Å; L360-F405 HydrophobicContact CD2-CD1 4.48Å; L360-F405 HydrophobicContact CD2-CE1 3.72Å; L360-F405 HydrophobicContact CD2-CZ 4.25Å; L364-F405 HydrophobicContact CD2-CB 3.66Å; L364-F405 HydrophobicContact CD2-CD1 4.43Å; L364-F405 HydrophobicContact CD2-CD2 3.74Å; L364-F405 HydrophobicContact CD2-CG 3.69Å; L394-F405 HydrophobicContact CD1-CD2 3.59Å; L394-F405 HydrophobicContact CD1-CE2 3.69Å; A397-F405 HydrophobicContact CB-CE2 4.43Å; Q398-F405 HydrophobicContact CG-CD2 3.72Å; Q398-F405 HydrophobicContact CG-CE2 3.77Å; L401-F405 HydrophobicContact CD1-CE1 4.19Å; L401-F405 HydrophobicContact CD1-CZ 3.82Å; F405-S407 PolarHBondContact O-N 3.09Å; F405-S408 WeakPolarHBondContact O-CA 3.49Å; F405-S408 VanDerWaalsContact O-CB 3.25Å; F405-S408 WeakPolarHBondContact O-CB 3.49Å; F405-S408 PolarHBondContact O-N 3.21Å; F405-D409 PolarHBondContact O-N 3.12Å
406	N	85.1	Confident	88.5	Confident	76 Å²	76	41.3 Å²	41.3	41%	0.406	22%	0.215	S	C	.	.	H	α-helix	trans	-52.4	-35	179.8	-65.6	-16.3	0	0	0	112.9	N361 S408 D409 A410	N361-N406 PolarHBondContact OD1-N 2.86Å; N406-S408 VanDerWaalsContact C-N 3.33Å; N406-D409 PolarHBondContact O-N 3.19Å; N406-A410 WeakPolarHBondContact O-CB 3.14Å; N406-A410 PolarHBondContact O-N 3.03Å
407	S	86.3	Confident	88.3	Confident	12 Å²	12	43.5 Å²	43.5	8%	0.084	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-30.5	176.3	58.3	0	0	0	0	113.9	N361 L364 F405 F411	N361-S407 WeakPolarHBondContact O-CB 3.26Å; N361-S407 PolarHBondContact O-OG 3.46Å; N361-S407 PolarHBondContact OD1-N 3.34Å; N361-S407 VanDerWaalsContact OD1-N 3.14Å; N361-S407 PolarHBondContact OD1-OG 2.87Å; L364-S407 WeakPolarHBondContact CB-OG 3.37Å; L364-S407 WeakPolarHBondContact CD2-OG 3.4Å; L364-S407 WeakPolarHBondContact CG-OG 3.36Å; F405-S407 PolarHBondContact O-N 3.09Å; S407-F411 VanDerWaalsContact O-CB 3.3Å; S407-F411 WeakPolarHBondContact O-CB 3.18Å; S407-F411 PolarHBondContact O-N 2.9Å; S407-F411 VanDerWaalsContact O-N 3.09Å
408	S	89.9	Confident	88	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.007	25%	0.25	C	C	.	.	H	α-helix	trans	-69.7	-41.8	174.5	-63.2	0	0	0	0	110.7	F405 N406 F411 L412	F405-S408 WeakPolarHBondContact O-CA 3.49Å; F405-S408 VanDerWaalsContact O-CB 3.25Å; F405-S408 WeakPolarHBondContact O-CB 3.49Å; F405-S408 PolarHBondContact O-N 3.21Å; N406-S408 VanDerWaalsContact C-N 3.33Å; S408-F411 WeakPolarHBondContact O-CB 3.16Å; S408-F411 PolarHBondContact O-N 3.43Å; S408-L412 VanDerWaalsContact O-CG 3.28Å; S408-L412 WeakPolarHBondContact O-CG 3.41Å; S408-L412 PolarHBondContact O-N 3.04Å
409	D	89.4	Confident	87.9	Confident	9 Å²	9	48.7 Å²	48.7	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-49.2	178.1	-51.7	-28.6	0	0	0	110.8	F405 N406 F411 L412 F413 P436	F405-D409 PolarHBondContact O-N 3.12Å; N406-D409 PolarHBondContact O-N 3.19Å; D409-F411 PolarHBondContact O-N 3.46Å; D409-L412 PolarHBondContact O-N 3.34Å; D409-F413 HydrophobicContact CB-CE2 4.01Å; D409-F413 HydrophobicContact CB-CZ 4.08Å; D409-F413 WeakPolarHBondContact O-CD2 3.39Å; D409-F413 VanDerWaalsContact O-CG 3.28Å; D409-F413 WeakPolarHBondContact O-CG 3.45Å; D409-F413 PolarHBondContact O-N 3.47Å; D409-P436 VanDerWaalsContact OD2-CD 3.27Å; D409-P436 WeakPolarHBondContact OD2-CD 3.36Å
410	A	88.3	Confident	87.6	Confident	42 Å²	42	49 Å²	49	35%	0.347	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-32.8	177	0	0	0	0	0	112.9	N406	N406-A410 WeakPolarHBondContact O-CB 3.14Å; N406-A410 PolarHBondContact O-N 3.03Å
411	F	91.2	Very high	87.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-51.6	171	157	-106.1	0	0	0	111.2	L368 F372 L373 S407 S408 D409 F413 K414 F415	L368-F411 HydrophobicContact CB-CB 4.14Å; L368-F411 HydrophobicContact CB-CD1 4.17Å; L368-F411 HydrophobicContact CB-CD2 3.83Å; L368-F411 HydrophobicContact CB-CE2 4.31Å; L368-F411 HydrophobicContact CB-CG 3.75Å; L368-F411 HydrophobicContact CD1-CB 4.09Å; L368-F411 HydrophobicContact CD1-CD1 3.92Å; L368-F411 HydrophobicContact CD1-CG 4.05Å; L368-F411 HydrophobicContact CD2-CD1 4.12Å; L368-F411 HydrophobicContact CD2-CE1 4.07Å; L368-F411 HydrophobicContact CD2-CZ 4.49Å; L368-F411 HydrophobicContact CG-CD1 4.31Å; L368-F411 HydrophobicContact CG-CG 4.34Å; F372-F411 HydrophobicContact CB-CE2 3.58Å; F372-F411 HydrophobicContact CB-CZ 3.81Å; F372-F411 HydrophobicContact CD2-CE2 4.19Å; F372-F411 AromaticContact CD2-CZ 3.89Å; F372-F411 HydrophobicContact CD2-CZ 3.89Å; F372-F411 HydrophobicContact CG-CE2 4.13Å; F372-F411 AromaticContact CG-CZ 3.88Å; F372-F411 HydrophobicContact CG-CZ 3.88Å; L373-F411 HydrophobicContact CD1-CD2 3.92Å; L373-F411 HydrophobicContact CD1-CE2 4.13Å; L373-F411 HydrophobicContact CG-CE2 4.46Å; S407-F411 VanDerWaalsContact O-CB 3.3Å; S407-F411 WeakPolarHBondContact O-CB 3.18Å; S407-F411 PolarHBondContact O-N 2.9Å; S407-F411 VanDerWaalsContact O-N 3.09Å; S408-F411 WeakPolarHBondContact O-CB 3.16Å; S408-F411 PolarHBondContact O-N 3.43Å; D409-F411 PolarHBondContact O-N 3.46Å; F411-F413 PolarHBondContact O-N 3.4Å; F411-K414 PolarHBondContact O-N 2.95Å; F411-K414 VanDerWaalsContact O-N 3.09Å; F411-F415 HydrophobicContact CD2-CB 4.12Å; F411-F415 HydrophobicContact CE1-CB 4.29Å; F411-F415 HydrophobicContact CE1-CD1 4.33Å; F411-F415 HydrophobicContact CE1-CG 4.34Å; F411-F415 HydrophobicContact CE2-CB 3.57Å; F411-F415 HydrophobicContact CE2-CD1 4.45Å; F411-F415 AromaticContact CE2-CD2 3.92Å; F411-F415 HydrophobicContact CE2-CD2 3.92Å; F411-F415 AromaticContact CE2-CG 3.72Å; F411-F415 HydrophobicContact CE2-CG 3.72Å; F411-F415 HydrophobicContact CZ-CB 3.68Å; F411-F415 AromaticContact CZ-CD1 3.78Å; F411-F415 HydrophobicContact CZ-CD1 3.78Å; F411-F415 AromaticContact CZ-CD2 3.95Å; F411-F415 HydrophobicContact CZ-CD2 3.95Å; F411-F415 HydrophobicContact CZ-CE1 4.42Å; F411-F415 AromaticContact CZ-CG 3.51Å; F411-F415 HydrophobicContact CZ-CG 3.51Å; F411-F415 WeakPolarHBondContact O-CB 3.32Å; F411-F415 PolarHBondContact O-N 3.42Å
412	L	91.7	Very high	87.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-45	-176.9	-73.9	167.1	0	0	0	112.1	S408 D409 K414 F415 L416 I428 L431 L432 I435	S408-L412 VanDerWaalsContact O-CG 3.28Å; S408-L412 WeakPolarHBondContact O-CG 3.41Å; S408-L412 PolarHBondContact O-N 3.04Å; D409-L412 PolarHBondContact O-N 3.34Å; L412-K414 PolarHBondContact O-N 2.82Å; L412-K414 VanDerWaalsContact O-N 3.14Å; L412-F415 PolarHBondContact O-N 3.28Å; L412-F415 VanDerWaalsContact O-N 3.11Å; L412-L416 WeakPolarHBondContact O-CB 3.46Å; L412-L416 VanDerWaalsContact O-CG 3.31Å; L412-L416 WeakPolarHBondContact O-CG 3.27Å; L412-L416 PolarHBondContact O-N 3.26Å; L412-I428 HydrophobicContact CD2-CG2 4.22Å; L412-L431 HydrophobicContact CD1-CB 3.92Å; L412-L431 HydrophobicContact CD2-CB 4.38Å; L412-L432 HydrophobicContact CB-CD2 4.23Å; L412-L432 HydrophobicContact CD1-CD2 4.1Å; L412-L432 HydrophobicContact CD1-CG 4.39Å; L412-L432 HydrophobicContact CD2-CD2 4.03Å; L412-L432 HydrophobicContact CD2-CG 4.12Å; L412-L432 HydrophobicContact CG-CD2 4.35Å; L412-I435 HydrophobicContact CD1-CD1 3.96Å; L412-I435 HydrophobicContact CD1-CG1 4.09Å
413	F	90.2	Very high	87.1	Confident	41 Å²	41	43.3 Å²	43.3	18%	0.18	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-31.6	178.1	-57.6	-37.2	0	0	0	113.1	D409 F411 N417 I435 I438 L446 L447	D409-F413 HydrophobicContact CB-CE2 4.01Å; D409-F413 HydrophobicContact CB-CZ 4.08Å; D409-F413 WeakPolarHBondContact O-CD2 3.39Å; D409-F413 VanDerWaalsContact O-CG 3.28Å; D409-F413 WeakPolarHBondContact O-CG 3.45Å; D409-F413 PolarHBondContact O-N 3.47Å; F411-F413 PolarHBondContact O-N 3.4Å; F413-N417 PolarHBondContact O-ND2 2.71Å; F413-N417 VanDerWaalsContact O-ND2 3.07Å; F413-I435 HydrophobicContact CE1-CD1 4.19Å; F413-I435 HydrophobicContact CE1-CG2 4.47Å; F413-I435 HydrophobicContact CZ-CG2 4.42Å; F413-I438 HydrophobicContact CE1-CD1 3.58Å; F413-I438 HydrophobicContact CZ-CD1 3.57Å; F413-I438 HydrophobicContact CZ-CG1 4.34Å; F413-L446 HydrophobicContact CB-CD2 4.26Å; F413-L446 HydrophobicContact CD1-CB 3.9Å; F413-L446 HydrophobicContact CD2-CD1 4.43Å; F413-L446 HydrophobicContact CE1-CB 4.3Å; F413-L446 HydrophobicContact CE2-CD1 4.46Å; F413-L446 HydrophobicContact CG-CB 4.28Å; F413-L446 HydrophobicContact CG-CD2 4.37Å; F413-L447 HydrophobicContact CD1-CD2 3.79Å; F413-L447 HydrophobicContact CD1-CG 4.26Å; F413-L447 HydrophobicContact CE1-CD1 4.35Å; F413-L447 HydrophobicContact CE1-CD2 3.77Å; F413-L447 HydrophobicContact CE1-CG 3.97Å
414	K	89.1	Confident	87.2	Confident	121 Å²	121	39.9 Å²	39.9	53%	0.526	23%	0.228	S	C	.	.	H	α-helix	trans	-85.8	-38.6	176.1	-62.4	-175.7	-161.5	162.2	0	111.7	L373 F411 L412	L373-K414 HydrophobicContact CD1-CB 3.99Å; F411-K414 PolarHBondContact O-N 2.95Å; F411-K414 VanDerWaalsContact O-N 3.09Å; L412-K414 PolarHBondContact O-N 2.82Å; L412-K414 VanDerWaalsContact O-N 3.14Å
415	F	89.4	Confident	87.5	Confident	7 Å²	7	41.7 Å²	41.7	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-70	-36.8	-176.1	-175.7	-113.3	0	0	0	113	F372 L373 F411 L412 N417 V418 W419 L423 I428	F372-F415 HydrophobicContact CB-CD2 3.99Å; F372-F415 HydrophobicContact CB-CE2 3.84Å; F372-F415 HydrophobicContact CD1-CE2 4.22Å; F372-F415 HydrophobicContact CD1-CZ 4.19Å; F372-F415 HydrophobicContact CG-CE2 4.42Å; L373-F415 HydrophobicContact CD2-CD2 4.47Å; L373-F415 HydrophobicContact CG-CD2 4.4Å; F411-F415 HydrophobicContact CD2-CB 4.12Å; F411-F415 HydrophobicContact CE1-CB 4.29Å; F411-F415 HydrophobicContact CE1-CD1 4.33Å; F411-F415 HydrophobicContact CE1-CG 4.34Å; F411-F415 HydrophobicContact CE2-CB 3.57Å; F411-F415 HydrophobicContact CE2-CD1 4.45Å; F411-F415 AromaticContact CE2-CD2 3.92Å; F411-F415 HydrophobicContact CE2-CD2 3.92Å; F411-F415 AromaticContact CE2-CG 3.72Å; F411-F415 HydrophobicContact CE2-CG 3.72Å; F411-F415 HydrophobicContact CZ-CB 3.68Å; F411-F415 AromaticContact CZ-CD1 3.78Å; F411-F415 HydrophobicContact CZ-CD1 3.78Å; F411-F415 AromaticContact CZ-CD2 3.95Å; F411-F415 HydrophobicContact CZ-CD2 3.95Å; F411-F415 HydrophobicContact CZ-CE1 4.42Å; F411-F415 AromaticContact CZ-CG 3.51Å; F411-F415 HydrophobicContact CZ-CG 3.51Å; F411-F415 WeakPolarHBondContact O-CB 3.32Å; F411-F415 PolarHBondContact O-N 3.42Å; L412-F415 PolarHBondContact O-N 3.28Å; L412-F415 VanDerWaalsContact O-N 3.11Å; F415-N417 PolarHBondContact O-N 3.5Å; F415-N417 VanDerWaalsContact O-N 3.12Å; F415-V418 HydrophobicContact CD2-CG2 3.95Å; F415-V418 HydrophobicContact CE2-CG2 4.4Å; F415-V418 WeakPolarHBondContact O-CG2 3.49Å; F415-V418 PolarHBondContact O-N 2.84Å; F415-W419 HydrophobicContact CD1-CB 4.01Å; F415-W419 HydrophobicContact CD1-CG 4.23Å; F415-W419 HydrophobicContact CE1-CB 3.7Å; F415-W419 AromaticContact CE1-CD1 3.54Å; F415-W419 HydrophobicContact CE1-CD2 4.19Å; F415-W419 AromaticContact CE1-CG 3.54Å; F415-W419 HydrophobicContact CE1-CG 3.54Å; F415-W419 HydrophobicContact CE2-CB 4.48Å; F415-W419 HydrophobicContact CZ-CB 3.96Å; F415-W419 AromaticContact CZ-CD1 3.57Å; F415-W419 AromaticContact CZ-CG 3.91Å; F415-W419 HydrophobicContact CZ-CG 3.91Å; F415-W419 WeakPolarHBondContact O-CB 3.35Å; F415-W419 PolarHBondContact O-N 2.91Å; F415-L423 HydrophobicContact CZ-CD2 4.47Å; F415-I428 HydrophobicContact CD1-CD1 4.39Å; F415-I428 HydrophobicContact CE1-CD1 3.94Å; F415-I428 HydrophobicContact CE1-CG1 4.21Å; F415-I428 HydrophobicContact CE1-CG2 4.45Å
416	L	89.9	Confident	87.7	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.1	178	-76.1	177.1	0	0	0	113.6	L412 V418 W419 L432 L447 P450 L451	L412-L416 WeakPolarHBondContact O-CB 3.46Å; L412-L416 VanDerWaalsContact O-CG 3.31Å; L412-L416 WeakPolarHBondContact O-CG 3.27Å; L412-L416 PolarHBondContact O-N 3.26Å; L416-V418 VanDerWaalsContact C-N 3.27Å; L416-V418 PolarHBondContact O-N 2.92Å; L416-W419 HydrophobicContact CD2-CE3 3.9Å; L416-W419 HydrophobicContact CD2-CZ3 4.29Å; L416-L432 HydrophobicContact CD1-CD2 3.83Å; L416-L432 HydrophobicContact CD2-CD1 4.02Å; L416-L432 HydrophobicContact CD2-CD2 4.1Å; L416-L432 HydrophobicContact CG-CD2 4.22Å; L416-L447 HydrophobicContact CD1-CD2 3.52Å; L416-P450 HydrophobicContact CB-CB 3.9Å; L416-P450 HydrophobicContact CB-CG 4.46Å; L416-L451 HydrophobicContact CD1-CD2 4.47Å; L416-L451 HydrophobicContact CD1-CG 4.45Å; L416-L451 HydrophobicContact CD2-CD2 3.9Å
417	N	86.9	Confident	88.1	Confident	110 Å²	110	43.1 Å²	43.1	59%	0.588	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.5	178.5	-68.1	-55.9	0	0	0	113.9	F413 F415 P450	F413-N417 PolarHBondContact O-ND2 2.71Å; F413-N417 VanDerWaalsContact O-ND2 3.07Å; F415-N417 PolarHBondContact O-N 3.5Å; F415-N417 VanDerWaalsContact O-N 3.12Å; N417-P450 WeakPolarHBondContact OD1-CG 3.4Å
418	V	86.4	Confident	88.4	Confident	97 Å²	97	42.6 Å²	42.6	59%	0.588	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.4	-11.1	-179.3	-62	0	0	0	0	113.2	L373 F415 L416	L373-V418 HydrophobicContact CD2-CG2 3.67Å; F415-V418 HydrophobicContact CD2-CG2 3.95Å; F415-V418 HydrophobicContact CE2-CG2 4.4Å; F415-V418 WeakPolarHBondContact O-CG2 3.49Å; F415-V418 PolarHBondContact O-N 2.84Å; L416-V418 VanDerWaalsContact C-N 3.27Å; L416-V418 PolarHBondContact O-N 2.92Å
419	W	87.9	Confident	88.6	Confident	13 Å²	13	43.1 Å²	43.1	5%	0.049	24%	0.238	C	C	.	.			trans	-76	137.8	-178.9	-176.6	47.4	0	0	0	110.7	F415 L416 G421 L423 R425 I428 L429 L454 F462	F415-W419 HydrophobicContact CD1-CB 4.01Å; F415-W419 HydrophobicContact CD1-CG 4.23Å; F415-W419 HydrophobicContact CE1-CB 3.7Å; F415-W419 AromaticContact CE1-CD1 3.54Å; F415-W419 HydrophobicContact CE1-CD2 4.19Å; F415-W419 AromaticContact CE1-CG 3.54Å; F415-W419 HydrophobicContact CE1-CG 3.54Å; F415-W419 HydrophobicContact CE2-CB 4.48Å; F415-W419 HydrophobicContact CZ-CB 3.96Å; F415-W419 AromaticContact CZ-CD1 3.57Å; F415-W419 AromaticContact CZ-CG 3.91Å; F415-W419 HydrophobicContact CZ-CG 3.91Å; F415-W419 WeakPolarHBondContact O-CB 3.35Å; F415-W419 PolarHBondContact O-N 2.91Å; L416-W419 HydrophobicContact CD2-CE3 3.9Å; L416-W419 HydrophobicContact CD2-CZ3 4.29Å; W419-G421 VanDerWaalsContact CE2-CA 3.43Å; W419-L423 PolarHBondContact NE1-O 3.27Å; W419-L423 VanDerWaalsContact NE1-O 3.09Å; W419-R425 HydrophobicContact CZ2-CB 4.2Å; W419-R425 HydrophobicContact CZ2-CG 4.47Å; W419-I428 HydrophobicContact CD2-CG2 4.3Å; W419-I428 HydrophobicContact CE3-CG2 4.18Å; W419-I428 HydrophobicContact CH2-CB 4.23Å; W419-I428 HydrophobicContact CH2-CG2 3.9Å; W419-I428 HydrophobicContact CZ2-CB 4.07Å; W419-I428 HydrophobicContact CZ2-CG1 4.48Å; W419-I428 HydrophobicContact CZ2-CG2 4.03Å; W419-I428 HydrophobicContact CZ3-CG2 3.97Å; W419-L429 HydrophobicContact CH2-CD2 4.35Å; W419-L429 HydrophobicContact CH2-CG 4.44Å; W419-L454 HydrophobicContact CE3-CD1 3.64Å; W419-L454 HydrophobicContact CZ3-CD1 4.04Å; W419-L454 WeakPolarHBondContact O-CD2 3.4Å; W419-F462 AromaticContact CH2-CE2 3.82Å; W419-F462 HydrophobicContact CH2-CE2 3.82Å; W419-F462 HydrophobicContact CH2-CZ 4.26Å; W419-F462 HydrophobicContact CZ2-CE2 4.47Å; W419-F462 HydrophobicContact CZ3-CE2 4.23Å; W419-F462 HydrophobicContact CZ3-CZ 4.23Å
420	D	83.1	Confident	88.8	Confident	103 Å²	103	43.5 Å²	43.5	55%	0.551	24%	0.244	S	C	*	.			trans	-94.2	-0	-178.6	68.9	-16.1	0	0	0	113.5	S422	D420-S422 VanDerWaalsContact C-N 3.32Å; D420-S422 PolarHBondContact O-N 2.97Å; D420-S422 PolarHBondContact OD1-N 2.68Å; D420-S422 PolarHBondContact OD1-OG 3.4Å; D420-S422 PolarHBondContact OD2-OG 3.07Å
421	G	83.1	Confident	89	Confident	7 Å²	7	41.5 Å²	41.5	7%	0.072	23%	0.228	C	C	.	.	S	Bend	trans	83.9	-3.5	-177.9	0	0	0	0	0	115.3	W419	W419-G421 VanDerWaalsContact CE2-CA 3.43Å
422	S	84.3	Confident	89.1	Confident	82 Å²	82	41.7 Å²	41.7	57%	0.573	23%	0.229	S	C	*	.			trans	-100.1	-44.7	-174.1	80.7	0	0	0	0	113.1	D420 L424	D420-S422 VanDerWaalsContact C-N 3.32Å; D420-S422 PolarHBondContact O-N 2.97Å; D420-S422 PolarHBondContact OD1-N 2.68Å; D420-S422 PolarHBondContact OD1-OG 3.4Å; D420-S422 PolarHBondContact OD2-OG 3.07Å; S422-L424 PolarHBondContact O-N 2.86Å
423	L	82.8	Confident	89.2	Confident	58 Å²	58	42.1 Å²	42.1	30%	0.304	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	123.1	-174.1	-178.2	67.6	0	0	0	111.9	F372 F415 W419 R425	F372-L423 HydrophobicContact CD1-CD2 4.13Å; F372-L423 HydrophobicContact CE1-CD2 4.17Å; F415-L423 HydrophobicContact CZ-CD2 4.47Å; W419-L423 PolarHBondContact NE1-O 3.27Å; W419-L423 VanDerWaalsContact NE1-O 3.09Å; L423-R425 PolarHBondContact O-N 3.48Å
424	L	84.8	Confident	89.3	Confident	20 Å²	20	41 Å²	41	11%	0.105	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	38.3	174.7	-61.5	172.4	0	0	0	113.2	F372 A387 L388 L391 S422 Q427 I428	F372-L424 HydrophobicContact CE1-CD1 3.98Å; F372-L424 HydrophobicContact CZ-CD1 4.04Å; A387-L424 HydrophobicContact CB-CD1 3.71Å; L388-L424 HydrophobicContact CB-CD2 3.83Å; L388-L424 HydrophobicContact CD1-CD2 4.14Å; L388-L424 HydrophobicContact CG-CD2 4.35Å; L391-L424 HydrophobicContact CD1-CB 4.18Å; L391-L424 HydrophobicContact CD1-CD1 3.71Å; S422-L424 PolarHBondContact O-N 2.86Å; L424-Q427 HydrophobicContact CB-CB 4.44Å; L424-Q427 WeakPolarHBondContact O-CB 3.3Å; L424-Q427 PolarHBondContact O-N 2.66Å; L424-Q427 PolarHBondContact O-OE1 3.24Å; L424-I428 HydrophobicContact CB-CG1 4.46Å; L424-I428 WeakPolarHBondContact O-CG1 3.27Å; L424-I428 PolarHBondContact O-N 3.12Å
425	R	90	Very high	89.3	Confident	63 Å²	63	35.3 Å²	35.3	24%	0.238	20%	0.202	C	C	.	.	H	α-helix	trans	-49.6	-50.6	-170.5	170.2	-163.5	151.2	-174.2	-11.4	114.1	W419 L423 Q427 I428 L429 F461 F462	W419-R425 HydrophobicContact CZ2-CB 4.2Å; W419-R425 HydrophobicContact CZ2-CG 4.47Å; L423-R425 PolarHBondContact O-N 3.48Å; R425-Q427 VanDerWaalsContact C-N 3.25Å; R425-Q427 PolarHBondContact O-N 2.8Å; R425-I428 PolarHBondContact O-N 3.14Å; R425-L429 HydrophobicContact CG-CD1 3.75Å; R425-L429 HydrophobicContact CG-CG 4.29Å; R425-L429 WeakPolarHBondContact O-CB 3.48Å; R425-L429 VanDerWaalsContact O-CG 3.31Å; R425-L429 WeakPolarHBondContact O-CG 3.39Å; R425-L429 PolarHBondContact O-N 3.1Å; R425-F461 PolarHBondContact NH2-O 3.45Å; R425-F462 HydrophobicContact CG-CD2 4.32Å; R425-F462 HydrophobicContact CG-CE2 4.47Å
426	P	91.9	Very high	89.2	Confident	92 Å²	92	37.1 Å²	37.1	60%	0.597	22%	0.215	S	C	*	.	H	α-helix	trans	-58.9	-39.1	180	-23.7	34.2	0	0	0	112.5	G430	P426-G430 PolarHBondContact O-N 2.88Å
427	Q	93.1	Very high	89.1	Confident	23 Å²	23	38 Å²	38	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-71.5	-43.6	-179	-66.1	74.6	15.2	0	0	111.7	L391 N392 L395 L424 R425 G430 L431	L391-Q427 HydrophobicContact CB-CB 3.9Å; L391-Q427 HydrophobicContact CB-CG 4.03Å; L391-Q427 HydrophobicContact CD1-CB 3.71Å; L391-Q427 HydrophobicContact CD1-CG 4.44Å; L391-Q427 HydrophobicContact CG-CB 4.48Å; N392-Q427 WeakPolarHBondContact OD1-CG 3.49Å; N392-Q427 PolarHBondContact OD1-NE2 3.33Å; L395-Q427 HydrophobicContact CD1-CB 4.16Å; L395-Q427 HydrophobicContact CD1-CG 4.29Å; L424-Q427 HydrophobicContact CB-CB 4.44Å; L424-Q427 WeakPolarHBondContact O-CB 3.3Å; L424-Q427 PolarHBondContact O-N 2.66Å; L424-Q427 PolarHBondContact O-OE1 3.24Å; R425-Q427 VanDerWaalsContact C-N 3.25Å; R425-Q427 PolarHBondContact O-N 2.8Å; Q427-G430 PolarHBondContact O-N 2.99Å; Q427-L431 WeakPolarHBondContact O-CG 3.28Å; Q427-L431 PolarHBondContact O-N 3.17Å
428	I	93.3	Very high	89	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-45.1	178.1	-61.5	-60.4	0	0	0	110.9	L391 L412 F415 W419 L424 R425 G430 L431 L432	L391-I428 HydrophobicContact CD1-CD1 4.11Å; L412-I428 HydrophobicContact CD2-CG2 4.22Å; F415-I428 HydrophobicContact CD1-CD1 4.39Å; F415-I428 HydrophobicContact CE1-CD1 3.94Å; F415-I428 HydrophobicContact CE1-CG1 4.21Å; F415-I428 HydrophobicContact CE1-CG2 4.45Å; W419-I428 HydrophobicContact CD2-CG2 4.3Å; W419-I428 HydrophobicContact CE3-CG2 4.18Å; W419-I428 HydrophobicContact CH2-CB 4.23Å; W419-I428 HydrophobicContact CH2-CG2 3.9Å; W419-I428 HydrophobicContact CZ2-CB 4.07Å; W419-I428 HydrophobicContact CZ2-CG1 4.48Å; W419-I428 HydrophobicContact CZ2-CG2 4.03Å; W419-I428 HydrophobicContact CZ3-CG2 3.97Å; L424-I428 HydrophobicContact CB-CG1 4.46Å; L424-I428 WeakPolarHBondContact O-CG1 3.27Å; L424-I428 PolarHBondContact O-N 3.12Å; R425-I428 PolarHBondContact O-N 3.14Å; I428-G430 VanDerWaalsContact C-N 3.29Å; I428-G430 PolarHBondContact O-N 3.24Å; I428-L431 PolarHBondContact O-N 3.01Å; I428-L432 HydrophobicContact CG2-CD1 4.1Å; I428-L432 WeakPolarHBondContact O-CG 3.02Å; I428-L432 PolarHBondContact O-N 3.22Å
429	L	94.1	Very high	88.9	Confident	12 Å²	12	29.6 Å²	29.6	6%	0.063	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-39.2	173	-68	176.2	0	0	0	111.4	W419 R425 L431 L432 S433 L466 C469	W419-L429 HydrophobicContact CH2-CD2 4.35Å; W419-L429 HydrophobicContact CH2-CG 4.44Å; R425-L429 HydrophobicContact CG-CD1 3.75Å; R425-L429 HydrophobicContact CG-CG 4.29Å; R425-L429 WeakPolarHBondContact O-CB 3.48Å; R425-L429 VanDerWaalsContact O-CG 3.31Å; R425-L429 WeakPolarHBondContact O-CG 3.39Å; R425-L429 PolarHBondContact O-N 3.1Å; L429-L431 PolarHBondContact O-N 3.37Å; L429-L432 HydrophobicContact CD2-CD1 4.1Å; L429-L432 PolarHBondContact O-N 3.49Å; L429-S433 PolarHBondContact O-N 3.42Å; L429-L466 HydrophobicContact CD2-CD1 4.12Å; L429-C469 HydrophobicContact CB-CB 4.15Å; L429-C469 HydrophobicContact CD2-CB 4.05Å; L429-C469 PolarHBondContact O-SG 2.93Å
430	G	93.1	Very high	88.8	Confident	17 Å²	17	31.4 Å²	31.4	18%	0.175	19%	0.188	C	C	.	.	H	α-helix	trans	-56.4	-47	172.4	0	0	0	0	0	112.5	P426 Q427 I428 S433	P426-G430 PolarHBondContact O-N 2.88Å; Q427-G430 PolarHBondContact O-N 2.99Å; I428-G430 VanDerWaalsContact C-N 3.29Å; I428-G430 PolarHBondContact O-N 3.24Å; G430-S433 PolarHBondContact O-N 3.29Å; G430-S433 PolarHBondContact O-OG 3.09Å
431	L	93.3	Very high	88.9	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-40.9	178.5	-65.8	175.3	0	0	0	111.9	L391 L394 L395 Q398 L412 Q427 I428 L429 S433 N434	L391-L431 HydrophobicContact CD2-CD1 4.01Å; L394-L431 HydrophobicContact CD2-CD1 4.33Å; L394-L431 HydrophobicContact CD2-CD2 3.77Å; L394-L431 HydrophobicContact CG-CD2 4.01Å; L395-L431 HydrophobicContact CD2-CD2 3.61Å; L395-L431 HydrophobicContact CD2-CG 3.98Å; L395-L431 HydrophobicContact CG-CD2 3.96Å; L395-L431 HydrophobicContact CG-CG 4.37Å; Q398-L431 VanDerWaalsContact OE1-CD2 3.22Å; L412-L431 HydrophobicContact CD1-CB 3.92Å; L412-L431 HydrophobicContact CD2-CB 4.38Å; Q427-L431 WeakPolarHBondContact O-CG 3.28Å; Q427-L431 PolarHBondContact O-N 3.17Å; I428-L431 PolarHBondContact O-N 3.01Å; L429-L431 PolarHBondContact O-N 3.37Å; L431-S433 PolarHBondContact O-N 2.84Å; L431-N434 WeakPolarHBondContact O-CB 3.3Å; L431-N434 PolarHBondContact O-N 3.25Å
432	L	93.8	Very high	89	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-58.5	-37.4	175.6	-73.4	165.7	0	0	0	111.5	L412 L416 I428 L429 N434 I435 L447 L451	L412-L432 HydrophobicContact CB-CD2 4.23Å; L412-L432 HydrophobicContact CD1-CD2 4.1Å; L412-L432 HydrophobicContact CD1-CG 4.39Å; L412-L432 HydrophobicContact CD2-CD2 4.03Å; L412-L432 HydrophobicContact CD2-CG 4.12Å; L412-L432 HydrophobicContact CG-CD2 4.35Å; L416-L432 HydrophobicContact CD1-CD2 3.83Å; L416-L432 HydrophobicContact CD2-CD1 4.02Å; L416-L432 HydrophobicContact CD2-CD2 4.1Å; L416-L432 HydrophobicContact CG-CD2 4.22Å; I428-L432 HydrophobicContact CG2-CD1 4.1Å; I428-L432 WeakPolarHBondContact O-CG 3.02Å; I428-L432 PolarHBondContact O-N 3.22Å; L429-L432 HydrophobicContact CD2-CD1 4.1Å; L429-L432 PolarHBondContact O-N 3.49Å; L432-N434 PolarHBondContact O-N 2.9Å; L432-I435 HydrophobicContact CD2-CD1 3.73Å; L432-I435 WeakPolarHBondContact O-CB 3.32Å; L432-I435 WeakPolarHBondContact O-CG1 3.44Å; L432-I435 PolarHBondContact O-N 2.96Å; L432-L447 HydrophobicContact CD2-CD2 4.29Å; L432-L451 HydrophobicContact CD1-CD2 4.34Å
433	S	93.8	Very high	89.2	Confident	8 Å²	8	31.6 Å²	31.6	6%	0.056	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.2	176.7	82.5	0	0	0	0	113.9	L429 G430 L431 K476	L429-S433 PolarHBondContact O-N 3.42Å; G430-S433 PolarHBondContact O-N 3.29Å; G430-S433 PolarHBondContact O-OG 3.09Å; L431-S433 PolarHBondContact O-N 2.84Å; S433-K476 VanDerWaalsContact O-CD 3.26Å; S433-K476 WeakPolarHBondContact O-CD 3.27Å; S433-K476 PolarHBondContact O-NZ 3.19Å; S433-K476 VanDerWaalsContact O-NZ 3.1Å; S433-K476 PolarHBondContact OG-NZ 3.29Å
434	N	90.8	Very high	89.5	Confident	17 Å²	17	34.2 Å²	34.2	9%	0.091	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	0.5	178.8	-71.4	-36.4	0	0	0	113.4	Q398 L431 L432 K476	Q398-N434 PolarHBondContact OE1-ND2 3.06Å; L431-N434 WeakPolarHBondContact O-CB 3.3Å; L431-N434 PolarHBondContact O-N 3.25Å; L432-N434 PolarHBondContact O-N 2.9Å; N434-K476 PolarHBondContact OD1-NZ 3.13Å
435	I	90.3	Very high	89.7	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-64	129.5	-179.5	-71.5	172.1	0	0	0	109.6	L412 F413 L432 I438 L447 W477	L412-I435 HydrophobicContact CD1-CD1 3.96Å; L412-I435 HydrophobicContact CD1-CG1 4.09Å; F413-I435 HydrophobicContact CE1-CD1 4.19Å; F413-I435 HydrophobicContact CE1-CG2 4.47Å; F413-I435 HydrophobicContact CZ-CG2 4.42Å; L432-I435 HydrophobicContact CD2-CD1 3.73Å; L432-I435 WeakPolarHBondContact O-CB 3.32Å; L432-I435 WeakPolarHBondContact O-CG1 3.44Å; L432-I435 PolarHBondContact O-N 2.96Å; I435-I438 HydrophobicContact CG2-CD1 3.76Å; I435-I438 HydrophobicContact CG2-CG1 4.13Å; I435-L447 HydrophobicContact CD1-CD1 4.12Å; I435-L447 HydrophobicContact CD1-CD2 3.82Å; I435-L447 HydrophobicContact CG2-CD1 4.28Å; I435-W477 PolarHBondContact O-NE1 3.41Å
436	P	87.4	Confident	89.6	Confident	45 Å²	45	36 Å²	36	29%	0.292	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-68.5	168.5	175.9	29.6	-35.4	0	0	0	111.5	D409 I438 T498	D409-P436 VanDerWaalsContact OD2-CD 3.27Å; D409-P436 WeakPolarHBondContact OD2-CD 3.36Å; P436-I438 PolarHBondContact O-N 3.44Å; P436-T498 HydrophobicContact CB-CG2 4.36Å
437	V	87.1	Confident	89.6	Confident	22 Å²	22	31.7 Å²	31.7	13%	0.133	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-61.4	124.5	-178.9	-174.4	0	0	0	0	111	W477 I502 F507	V437-W477 HydrophobicContact CB-CD2 4.44Å; V437-W477 HydrophobicContact CG1-CE3 4.47Å; V437-W477 HydrophobicContact CG1-CZ3 4.48Å; V437-W477 HydrophobicContact CG2-CB 3.97Å; V437-W477 HydrophobicContact CG2-CD2 3.58Å; V437-W477 HydrophobicContact CG2-CE3 4.07Å; V437-W477 HydrophobicContact CG2-CG 3.53Å; V437-I502 HydrophobicContact CG1-CD1 3.99Å; V437-F507 HydrophobicContact CB-CD2 4.17Å; V437-F507 HydrophobicContact CB-CE2 4.3Å; V437-F507 HydrophobicContact CG1-CD2 4.02Å; V437-F507 HydrophobicContact CG1-CE2 4.44Å; V437-F507 HydrophobicContact CG2-CD2 3.71Å; V437-F507 HydrophobicContact CG2-CE2 3.35Å; V437-F507 HydrophobicContact CG2-CZ 4.31Å
438	I	83.9	Confident	89.6	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.036	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-99.9	140	176.6	-58.4	166.7	0	0	0	108.4	F413 I435 P436 S440 Q442 I443 L447 S510	F413-I438 HydrophobicContact CE1-CD1 3.58Å; F413-I438 HydrophobicContact CZ-CD1 3.57Å; F413-I438 HydrophobicContact CZ-CG1 4.34Å; I435-I438 HydrophobicContact CG2-CD1 3.76Å; I435-I438 HydrophobicContact CG2-CG1 4.13Å; P436-I438 PolarHBondContact O-N 3.44Å; I438-S440 PolarHBondContact O-N 2.96Å; I438-Q442 HydrophobicContact CG2-CB 3.92Å; I438-I443 HydrophobicContact CB-CB 4.19Å; I438-I443 HydrophobicContact CB-CG1 4.42Å; I438-I443 HydrophobicContact CG2-CB 4.11Å; I438-L447 HydrophobicContact CD1-CD1 3.56Å; I438-L447 HydrophobicContact CD1-CG 4.11Å; I438-S510 WeakPolarHBondContact O-CB 3.42Å; I438-S510 PolarHBondContact O-OG 3.42Å
439	P	85.3	Confident	89.6	Confident	24 Å²	24	33.8 Å²	33.8	16%	0.156	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-53.1	140	172	-27	35.2	0	0	0	112.8	S441 Q442 I443 I500	P439-S441 PolarHBondContact O-N 2.91Å; P439-Q442 PolarHBondContact O-N 3.06Å; P439-I443 PolarHBondContact O-N 2.99Å; P439-I443 VanDerWaalsContact O-N 3.1Å; P439-I500 HydrophobicContact CG-CD1 4.43Å; P439-I500 HydrophobicContact CG-CG2 3.66Å
440	S	84.7	Confident	89.5	Confident	52 Å²	52	33.5 Å²	33.5	36%	0.364	20%	0.201	S	C	.	.	H	α-helix	trans	-54.8	-26.9	-178.8	60	0	0	0	0	113.9	I438 Q442 S510	I438-S440 PolarHBondContact O-N 2.96Å; S440-Q442 VanDerWaalsContact C-N 3.32Å; S440-Q442 PolarHBondContact O-N 2.72Å; S440-S510 PolarHBondContact N-OG 3.32Å; S440-S510 VanDerWaalsContact N-OG 3.13Å
441	S	85.1	Confident	89.5	Confident	97 Å²	97	33 Å²	33	68%	0.678	19%	0.194	S	C	*	.	H	α-helix	trans	-68.8	-25.6	176.3	57.6	0	0	0	0	114.2	P439	P439-S441 PolarHBondContact O-N 2.91Å
442	Q	85.8	Confident	89.6	Confident	98 Å²	98	35.5 Å²	35.5	46%	0.458	21%	0.206	S	C	.	.	H	α-helix	trans	-111.1	-28.5	-173.2	-62	-178.8	13.2	0	0	113	I438 P439 S440 K444 A445 L446	I438-Q442 HydrophobicContact CG2-CB 3.92Å; P439-Q442 PolarHBondContact O-N 3.06Å; S440-Q442 VanDerWaalsContact C-N 3.32Å; S440-Q442 PolarHBondContact O-N 2.72Å; Q442-K444 PolarHBondContact O-N 3.18Å; Q442-K444 VanDerWaalsContact O-N 3.13Å; Q442-A445 PolarHBondContact O-N 3.21Å; Q442-L446 HydrophobicContact CB-CD1 4.04Å; Q442-L446 WeakPolarHBondContact O-CG 3.46Å; Q442-L446 PolarHBondContact O-N 3.2Å; Q442-L446 VanDerWaalsContact O-N 3.17Å
443	I	89.7	Confident	89.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-55.9	-34.9	-175	-168	169	0	0	0	113.1	I438 P439 L447 F448 W477	I438-I443 HydrophobicContact CB-CB 4.19Å; I438-I443 HydrophobicContact CB-CG1 4.42Å; I438-I443 HydrophobicContact CG2-CB 4.11Å; P439-I443 PolarHBondContact O-N 2.99Å; P439-I443 VanDerWaalsContact O-N 3.1Å; I443-L447 HydrophobicContact CG1-CD1 4.37Å; I443-L447 PolarHBondContact O-N 3.23Å; I443-F448 HydrophobicContact CB-CE2 4.27Å; I443-F448 HydrophobicContact CB-CZ 4.47Å; I443-F448 HydrophobicContact CD1-CE1 3.88Å; I443-F448 HydrophobicContact CD1-CE2 3.95Å; I443-F448 HydrophobicContact CD1-CZ 3.34Å; I443-F448 HydrophobicContact CG1-CD1 4.43Å; I443-F448 HydrophobicContact CG1-CD2 4.4Å; I443-F448 HydrophobicContact CG1-CE1 3.89Å; I443-F448 HydrophobicContact CG1-CE2 3.8Å; I443-F448 HydrophobicContact CG1-CZ 3.55Å; I443-F448 HydrophobicContact CG2-CD2 4.2Å; I443-F448 HydrophobicContact CG2-CE2 3.58Å; I443-F448 HydrophobicContact CG2-CZ 4.13Å; I443-F448 PolarHBondContact O-N 3.2Å; I443-W477 HydrophobicContact CD1-CH2 3.68Å; I443-W477 HydrophobicContact CD1-CZ3 4.4Å
444	K	88.6	Confident	89.3	Confident	114 Å²	114	42.4 Å²	42.4	50%	0.496	24%	0.238	S	C	.	.	I	π-helix	trans	-63.5	-53.5	-178.2	-173.6	178.8	177.1	-177.7	0	112.3	Q442 F448 D449	Q442-K444 PolarHBondContact O-N 3.18Å; Q442-K444 VanDerWaalsContact O-N 3.13Å; K444-F448 HydrophobicContact CB-CD2 4.24Å; K444-F448 HydrophobicContact CG-CB 4.44Å; K444-F448 PolarHBondContact O-N 3.32Å; K444-F448 VanDerWaalsContact O-N 3.14Å; K444-D449 PolarHBondContact O-N 3.42Å
445	A	88.4	Confident	89.4	Confident	67 Å²	67	41.6 Å²	41.6	55%	0.554	23%	0.234	S	C	*	.	I	π-helix	trans	-70.6	-33.2	-177.2	0	0	0	0	0	112.5	Q442	Q442-A445 PolarHBondContact O-N 3.21Å
446	L	88.4	Confident	89.4	Confident	53 Å²	53	45 Å²	45	28%	0.277	25%	0.248	S	C	.	.	I	π-helix	trans	-83.6	-34.9	-175.3	-64.5	177.1	0	0	0	113.5	F413 Q442	F413-L446 HydrophobicContact CB-CD2 4.26Å; F413-L446 HydrophobicContact CD1-CB 3.9Å; F413-L446 HydrophobicContact CD2-CD1 4.43Å; F413-L446 HydrophobicContact CE1-CB 4.3Å; F413-L446 HydrophobicContact CE2-CD1 4.46Å; F413-L446 HydrophobicContact CG-CB 4.28Å; F413-L446 HydrophobicContact CG-CD2 4.37Å; Q442-L446 HydrophobicContact CB-CD1 4.04Å; Q442-L446 WeakPolarHBondContact O-CG 3.46Å; Q442-L446 PolarHBondContact O-N 3.2Å; Q442-L446 VanDerWaalsContact O-N 3.17Å
447	L	91.7	Very high	89.4	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	27%	0.268	C	S	.	.	I	π-helix	trans	-124.4	-51.6	-173.8	-67.4	-177.6	0	0	0	113.5	F413 L416 L432 I435 I438 I443 P450 L451	F413-L447 HydrophobicContact CD1-CD2 3.79Å; F413-L447 HydrophobicContact CD1-CG 4.26Å; F413-L447 HydrophobicContact CE1-CD1 4.35Å; F413-L447 HydrophobicContact CE1-CD2 3.77Å; F413-L447 HydrophobicContact CE1-CG 3.97Å; L416-L447 HydrophobicContact CD1-CD2 3.52Å; L432-L447 HydrophobicContact CD2-CD2 4.29Å; I435-L447 HydrophobicContact CD1-CD1 4.12Å; I435-L447 HydrophobicContact CD1-CD2 3.82Å; I435-L447 HydrophobicContact CG2-CD1 4.28Å; I438-L447 HydrophobicContact CD1-CD1 3.56Å; I438-L447 HydrophobicContact CD1-CG 4.11Å; I443-L447 HydrophobicContact CG1-CD1 4.37Å; I443-L447 PolarHBondContact O-N 3.23Å; L447-P450 WeakPolarHBondContact O-CD 3.34Å; L447-L451 HydrophobicContact CB-CD1 4.37Å; L447-L451 VanDerWaalsContact O-CB 3.27Å; L447-L451 WeakPolarHBondContact O-CB 3.45Å; L447-L451 WeakPolarHBondContact O-CD1 3.32Å; L447-L451 WeakPolarHBondContact O-CG 3.41Å; L447-L451 PolarHBondContact O-N 2.89Å; L447-L451 VanDerWaalsContact O-N 3.09Å
448	F	93.4	Very high	89.5	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	27%	0.27	C	S	.	.	I	π-helix	trans	-68.5	-44.8	-168.4	-63.2	-23.3	0	0	0	113.6	I443 K444 L451 M452 E513 L514 F517	I443-F448 HydrophobicContact CB-CE2 4.27Å; I443-F448 HydrophobicContact CB-CZ 4.47Å; I443-F448 HydrophobicContact CD1-CE1 3.88Å; I443-F448 HydrophobicContact CD1-CE2 3.95Å; I443-F448 HydrophobicContact CD1-CZ 3.34Å; I443-F448 HydrophobicContact CG1-CD1 4.43Å; I443-F448 HydrophobicContact CG1-CD2 4.4Å; I443-F448 HydrophobicContact CG1-CE1 3.89Å; I443-F448 HydrophobicContact CG1-CE2 3.8Å; I443-F448 HydrophobicContact CG1-CZ 3.55Å; I443-F448 HydrophobicContact CG2-CD2 4.2Å; I443-F448 HydrophobicContact CG2-CE2 3.58Å; I443-F448 HydrophobicContact CG2-CZ 4.13Å; I443-F448 PolarHBondContact O-N 3.2Å; K444-F448 HydrophobicContact CB-CD2 4.24Å; K444-F448 HydrophobicContact CG-CB 4.44Å; K444-F448 PolarHBondContact O-N 3.32Å; K444-F448 VanDerWaalsContact O-N 3.14Å; F448-L451 PolarHBondContact O-N 2.87Å; F448-M452 WeakPolarHBondContact O-CB 3.19Å; F448-M452 PolarHBondContact O-N 3.4Å; F448-E513 HydrophobicContact CD2-CG 4.41Å; F448-E513 HydrophobicContact CE2-CB 4.44Å; F448-E513 HydrophobicContact CE2-CG 3.64Å; F448-L514 HydrophobicContact CE1-CD1 3.92Å; F448-L514 HydrophobicContact CZ-CB 4.34Å; F448-L514 HydrophobicContact CZ-CD1 4.2Å; F448-F517 HydrophobicContact CB-CD2 3.68Å; F448-F517 HydrophobicContact CB-CE1 4.36Å; F448-F517 HydrophobicContact CB-CE2 3.49Å; F448-F517 VanDerWaalsContact CB-CE2 3.49Å; F448-F517 HydrophobicContact CB-CG 4.19Å; F448-F517 HydrophobicContact CB-CZ 3.84Å; F448-F517 HydrophobicContact CD1-CB 4.22Å; F448-F517 AromaticContact CD1-CD1 3.3Å; F448-F517 HydrophobicContact CD1-CD1 3.3Å; F448-F517 AromaticContact CD1-CD2 3.95Å; F448-F517 HydrophobicContact CD1-CD2 3.95Å; F448-F517 AromaticContact CD1-CE1 3.47Å; F448-F517 HydrophobicContact CD1-CE1 3.47Å; F448-F517 VanDerWaalsContact CD1-CE1 3.47Å; F448-F517 HydrophobicContact CD1-CE2 4.09Å; F448-F517 AromaticContact CD1-CG 3.54Å; F448-F517 HydrophobicContact CD1-CG 3.54Å; F448-F517 AromaticContact CD1-CZ 3.86Å; F448-F517 HydrophobicContact CD1-CZ 3.86Å; F448-F517 HydrophobicContact CD2-CB 4.12Å; F448-F517 HydrophobicContact CD2-CD2 4.13Å; F448-F517 HydrophobicContact CD2-CG 4.03Å; F448-F517 HydrophobicContact CE1-CB 4.07Å; F448-F517 AromaticContact CE1-CD1 3.49Å; F448-F517 HydrophobicContact CE1-CD1 3.49Å; F448-F517 VanDerWaalsContact CE1-CD1 3.49Å; F448-F517 HydrophobicContact CE1-CE1 4.03Å; F448-F517 AromaticContact CE1-CG 3.81Å; F448-F517 HydrophobicContact CE1-CG 3.81Å; F448-F517 HydrophobicContact CE2-CB 4.01Å; F448-F517 HydrophobicContact CE2-CG 4.3Å; F448-F517 HydrophobicContact CG-CB 4.24Å; F448-F517 AromaticContact CG-CD1 3.92Å; F448-F517 HydrophobicContact CG-CD1 3.92Å; F448-F517 AromaticContact CG-CD2 3.66Å; F448-F517 HydrophobicContact CG-CD2 3.66Å; F448-F517 HydrophobicContact CG-CE1 4.13Å; F448-F517 AromaticContact CG-CE2 3.89Å; F448-F517 HydrophobicContact CG-CE2 3.89Å; F448-F517 AromaticContact CG-CG 3.66Å; F448-F517 HydrophobicContact CG-CG 3.66Å; F448-F517 HydrophobicContact CG-CZ 4.11Å; F448-F517 HydrophobicContact CZ-CB 3.95Å; F448-F517 HydrophobicContact CZ-CD1 4.24Å; F448-F517 HydrophobicContact CZ-CG 4.18Å; F448-F517 WeakPolarHBondContact O-CZ 3.47Å
449	D	92.4	Very high	89.9	Confident	66 Å²	66	51.4 Å²	51.4	35%	0.353	29%	0.291	S	S	.	.	H	α-helix	trans	-63.7	-47.3	-177.6	-63.5	-25.2	0	0	0	111.7	K444 M452 Q453	K444-D449 PolarHBondContact O-N 3.42Å; D449-M452 PolarHBondContact O-N 3.41Å; D449-Q453 WeakPolarHBondContact O-CG 3.28Å; D449-Q453 PolarHBondContact O-N 2.94Å
450	P	92.3	Very high	90.3	Very high	6 Å²	6	51.4 Å²	51.4	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-44.6	174.3	-23.5	33.9	0	0	0	113.6	L416 N417 L447 M452 Q453 L454	L416-P450 HydrophobicContact CB-CB 3.9Å; L416-P450 HydrophobicContact CB-CG 4.46Å; N417-P450 WeakPolarHBondContact OD1-CG 3.4Å; L447-P450 WeakPolarHBondContact O-CD 3.34Å; P450-M452 VanDerWaalsContact C-N 3.31Å; P450-M452 PolarHBondContact O-N 3.44Å; P450-Q453 PolarHBondContact O-N 3.29Å; P450-L454 PolarHBondContact O-N 3Å; P450-L454 VanDerWaalsContact O-N 3.14Å
451	L	94.3	Very high	90.7	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-34.5	-179.1	-69.7	175.4	0	0	0	112.1	L416 L432 L447 F448 L454 F455 L466 L470 F517	L416-L451 HydrophobicContact CD1-CD2 4.47Å; L416-L451 HydrophobicContact CD1-CG 4.45Å; L416-L451 HydrophobicContact CD2-CD2 3.9Å; L432-L451 HydrophobicContact CD1-CD2 4.34Å; L447-L451 HydrophobicContact CB-CD1 4.37Å; L447-L451 VanDerWaalsContact O-CB 3.27Å; L447-L451 WeakPolarHBondContact O-CB 3.45Å; L447-L451 WeakPolarHBondContact O-CD1 3.32Å; L447-L451 WeakPolarHBondContact O-CG 3.41Å; L447-L451 PolarHBondContact O-N 2.89Å; L447-L451 VanDerWaalsContact O-N 3.09Å; F448-L451 PolarHBondContact O-N 2.87Å; L451-L454 PolarHBondContact O-N 2.96Å; L451-F455 VanDerWaalsContact O-CB 3.3Å; L451-F455 WeakPolarHBondContact O-CB 3.39Å; L451-F455 PolarHBondContact O-N 3.22Å; L451-L466 HydrophobicContact CB-CD2 4.37Å; L451-L466 HydrophobicContact CD1-CD1 4.32Å; L451-L466 HydrophobicContact CD2-CD1 3.9Å; L451-L470 HydrophobicContact CD1-CD2 4.4Å; L451-F517 HydrophobicContact CB-CZ 4.3Å
452	M	93.8	Very high	91.2	Very high	55 Å²	55	51.1 Å²	51.1	27%	0.271	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-44.4	175.7	-173.2	-178.4	-61	0	0	111.4	F448 D449 P450 L454 F455 F456 F517 L521	F448-M452 WeakPolarHBondContact O-CB 3.19Å; F448-M452 PolarHBondContact O-N 3.4Å; D449-M452 PolarHBondContact O-N 3.41Å; P450-M452 VanDerWaalsContact C-N 3.31Å; P450-M452 PolarHBondContact O-N 3.44Å; M452-L454 VanDerWaalsContact C-N 3.34Å; M452-L454 PolarHBondContact O-N 3.37Å; M452-F455 PolarHBondContact O-N 2.61Å; M452-F456 HydrophobicContact CG-CD2 3.81Å; M452-F456 HydrophobicContact CG-CE2 3.36Å; M452-F456 HydrophobicContact CG-CZ 4.39Å; M452-F456 WeakPolarHBondContact O-CD2 3.25Å; M452-F456 PolarHBondContact O-N 3.15Å; M452-F456 HydrophobicContact SD-CE2 4.04Å; M452-F517 HydrophobicContact CB-CE2 4.16Å; M452-F517 HydrophobicContact CB-CZ 4.43Å; M452-F517 HydrophobicContact CE-CD2 4.11Å; M452-F517 HydrophobicContact CE-CE2 3.67Å; M452-L521 HydrophobicContact CB-CD2 4.48Å; M452-L521 HydrophobicContact CG-CD2 4.16Å
453	Q	90.4	Very high	91.6	Very high	142 Å²	142	46.8 Å²	46.8	66%	0.664	25%	0.249	S	C	*	.	H	α-helix	trans	-61.2	-43.8	176.8	-70.4	-178.2	-6.8	0	0	111.6	D449 P450 T457	D449-Q453 WeakPolarHBondContact O-CG 3.28Å; D449-Q453 PolarHBondContact O-N 2.94Å; P450-Q453 PolarHBondContact O-N 3.29Å; Q453-T457 PolarHBondContact O-N 2.85Å; Q453-T457 PolarHBondContact O-OG1 3.1Å
454	L	91.6	Very high	91.9	Very high	15 Å²	15	47 Å²	47	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-43.1	176.1	-70.3	173.8	0	0	0	111.7	W419 P450 L451 M452 F456 T457 S458 F462	W419-L454 HydrophobicContact CE3-CD1 3.64Å; W419-L454 HydrophobicContact CZ3-CD1 4.04Å; W419-L454 WeakPolarHBondContact O-CD2 3.4Å; P450-L454 PolarHBondContact O-N 3Å; P450-L454 VanDerWaalsContact O-N 3.14Å; L451-L454 PolarHBondContact O-N 2.96Å; M452-L454 VanDerWaalsContact C-N 3.34Å; M452-L454 PolarHBondContact O-N 3.37Å; L454-F456 PolarHBondContact O-N 3.23Å; L454-T457 PolarHBondContact O-N 3.21Å; L454-T457 PolarHBondContact O-OG1 3.38Å; L454-S458 WeakPolarHBondContact O-CB 3.31Å; L454-S458 PolarHBondContact O-N 3.46Å; L454-S458 VanDerWaalsContact O-N 3.11Å; L454-S458 PolarHBondContact O-OG 2.91Å; L454-F462 HydrophobicContact CB-CE1 3.96Å; L454-F462 HydrophobicContact CB-CZ 3.98Å; L454-F462 HydrophobicContact CD1-CZ 4.47Å
455	F	93.8	Very high	92.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.6	-46.5	-178.9	-174.5	-91.4	0	0	0	112	L451 M452 T457 K463 L466 I467 L521	L451-F455 VanDerWaalsContact O-CB 3.3Å; L451-F455 WeakPolarHBondContact O-CB 3.39Å; L451-F455 PolarHBondContact O-N 3.22Å; M452-F455 PolarHBondContact O-N 2.61Å; F455-T457 PolarHBondContact O-N 3.49Å; F455-K463 HydrophobicContact CD1-CG 4.34Å; F455-K463 HydrophobicContact CD2-CB 4.02Å; F455-K463 HydrophobicContact CD2-CG 3.81Å; F455-K463 HydrophobicContact CE1-CD 4.17Å; F455-K463 HydrophobicContact CE1-CG 4.16Å; F455-K463 HydrophobicContact CE2-CB 3.46Å; F455-K463 VanDerWaalsContact CE2-CB 3.46Å; F455-K463 HydrophobicContact CE2-CD 4.4Å; F455-K463 HydrophobicContact CE2-CG 3.62Å; F455-K463 HydrophobicContact CG-CG 4.18Å; F455-K463 HydrophobicContact CZ-CB 3.84Å; F455-K463 HydrophobicContact CZ-CD 4.08Å; F455-K463 HydrophobicContact CZ-CG 3.8Å; F455-K463 WeakPolarHBondContact O-CE 3.48Å; F455-L466 HydrophobicContact CB-CD2 3.94Å; F455-L466 HydrophobicContact CD2-CD2 3.69Å; F455-L466 HydrophobicContact CD2-CG 4.5Å; F455-L466 HydrophobicContact CG-CD2 4.29Å; F455-I467 HydrophobicContact CE2-CD1 4.33Å; F455-I467 HydrophobicContact CE2-CG1 4.28Å; F455-L521 HydrophobicContact CB-CD2 4.15Å; F455-L521 HydrophobicContact CD1-CB 4.49Å; F455-L521 HydrophobicContact CD1-CD2 3.85Å; F455-L521 HydrophobicContact CD2-CD1 4.23Å; F455-L521 HydrophobicContact CE1-CB 4.23Å; F455-L521 HydrophobicContact CE1-CD2 4.38Å; F455-L521 WeakPolarHBondContact CE1-O 3.47Å; F455-L521 HydrophobicContact CE2-CB 4.39Å; F455-L521 HydrophobicContact CG-CD1 4.36Å; F455-L521 HydrophobicContact CG-CD2 3.96Å; F455-L521 HydrophobicContact CZ-CB 4.17Å
456	F	88.9	Confident	92.7	Very high	72 Å²	72	38.6 Å²	38.6	32%	0.316	20%	0.204	S	C	.	.	H	α-helix	trans	-73.4	-27	-176.5	-70.7	-54.3	0	0	0	114.7	M452 L454 L521 L524 L528	M452-F456 HydrophobicContact CG-CD2 3.81Å; M452-F456 HydrophobicContact CG-CE2 3.36Å; M452-F456 HydrophobicContact CG-CZ 4.39Å; M452-F456 WeakPolarHBondContact O-CD2 3.25Å; M452-F456 PolarHBondContact O-N 3.15Å; M452-F456 HydrophobicContact SD-CE2 4.04Å; L454-F456 PolarHBondContact O-N 3.23Å; F456-L521 HydrophobicContact CZ-CD2 4.41Å; F456-L524 HydrophobicContact CE1-CB 3.7Å; F456-L524 HydrophobicContact CE1-CD1 4.19Å; F456-L524 HydrophobicContact CZ-CB 3.92Å; F456-L524 HydrophobicContact CZ-CD1 3.56Å; F456-L524 HydrophobicContact CZ-CG 4.38Å; F456-L528 HydrophobicContact CD1-CD1 3.43Å; F456-L528 VanDerWaalsContact CD1-CD1 3.43Å; F456-L528 HydrophobicContact CE1-CD1 3.72Å
457	T	87.7	Confident	93.1	Very high	117 Å²	117	36.1 Å²	36.1	72%	0.718	19%	0.19	S	C	*	.	H	α-helix	trans	-92.5	-9.6	-177.8	53.3	0	0	0	0	113.5	Q453 L454 F455	Q453-T457 PolarHBondContact O-N 2.85Å; Q453-T457 PolarHBondContact O-OG1 3.1Å; L454-T457 PolarHBondContact O-N 3.21Å; L454-T457 PolarHBondContact O-OG1 3.38Å; F455-T457 PolarHBondContact O-N 3.49Å
458	S	89.7	Confident	93.4	Very high	25 Å²	25	40.1 Å²	40.1	18%	0.175	21%	0.209	C	C	.	.	S	Bend	trans	-100.1	168.6	-172.4	-63.1	0	0	0	0	114.6	L454 K463	L454-S458 WeakPolarHBondContact O-CB 3.31Å; L454-S458 PolarHBondContact O-N 3.46Å; L454-S458 VanDerWaalsContact O-N 3.11Å; L454-S458 PolarHBondContact O-OG 2.91Å; S458-K463 WeakPolarHBondContact O-CE 3.31Å
459	S	92.6	Very high	93.5	Very high	67 Å²	67	40.3 Å²	40.3	47%	0.469	21%	0.211	S	C	.	.			trans	-65.3	158.9	176.3	66.5	0	0	0	0	113.9	F461 F462 K463	S459-F461 PolarHBondContact O-N 2.9Å; S459-F462 WeakPolarHBondContact O-CB 3.42Å; S459-F462 PolarHBondContact O-N 3.22Å; S459-F462 PolarHBondContact OG-N 2.94Å; S459-K463 PolarHBondContact O-N 2.97Å
460	L	93.4	Very high	93.8	Very high	25 Å²	25	37.3 Å²	37.3	13%	0.131	20%	0.195	C	C	.	.	H	α-helix	trans	-48	-44.2	171.1	-178.9	72.1	0	0	0	112.7	F462 K463 C464 E529 H532 L534 L535	L460-F462 VanDerWaalsContact C-N 3.33Å; L460-F462 PolarHBondContact O-N 3.01Å; L460-K463 WeakPolarHBondContact O-CB 3.44Å; L460-K463 PolarHBondContact O-N 3.43Å; L460-C464 PolarHBondContact O-N 3.41Å; L460-C464 PolarHBondContact O-SG 2.89Å; L460-E529 HydrophobicContact CD1-CB 4.11Å; L460-E529 HydrophobicContact CD1-CG 3.79Å; L460-H532 HydrophobicContact CD1-CB 4.23Å; L460-L534 HydrophobicContact CD2-CD2 4.44Å; L460-L535 HydrophobicContact CD1-CB 3.81Å; L460-L535 HydrophobicContact CD1-CD2 4.29Å
461	F	93.6	Very high	94	Very high	137 Å²	137	38 Å²	38	60%	0.601	20%	0.198	S	C	*	.	H	α-helix	trans	-63.5	-38.9	179.3	-66.8	-74.4	0	0	0	112.1	R425 S459 C464 G465 L534	R425-F461 PolarHBondContact NH2-O 3.45Å; S459-F461 PolarHBondContact O-N 2.9Å; F461-C464 PolarHBondContact O-N 3.28Å; F461-G465 PolarHBondContact O-N 2.69Å; F461-L534 HydrophobicContact CD1-CD2 4.49Å; F461-L534 HydrophobicContact CE1-CD2 4.23Å
462	F	94.1	Very high	94.1	Very high	5 Å²	5	41.6 Å²	41.6	2%	0.022	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-45.2	175.2	-179.2	-85.4	0	0	0	110.9	W419 R425 L454 S459 L460 C464 G465 L466	W419-F462 AromaticContact CH2-CE2 3.82Å; W419-F462 HydrophobicContact CH2-CE2 3.82Å; W419-F462 HydrophobicContact CH2-CZ 4.26Å; W419-F462 HydrophobicContact CZ2-CE2 4.47Å; W419-F462 HydrophobicContact CZ3-CE2 4.23Å; W419-F462 HydrophobicContact CZ3-CZ 4.23Å; R425-F462 HydrophobicContact CG-CD2 4.32Å; R425-F462 HydrophobicContact CG-CE2 4.47Å; L454-F462 HydrophobicContact CB-CE1 3.96Å; L454-F462 HydrophobicContact CB-CZ 3.98Å; L454-F462 HydrophobicContact CD1-CZ 4.47Å; S459-F462 WeakPolarHBondContact O-CB 3.42Å; S459-F462 PolarHBondContact O-N 3.22Å; S459-F462 PolarHBondContact OG-N 2.94Å; L460-F462 VanDerWaalsContact C-N 3.33Å; L460-F462 PolarHBondContact O-N 3.01Å; F462-C464 VanDerWaalsContact C-N 3.31Å; F462-C464 PolarHBondContact O-N 3.36Å; F462-G465 PolarHBondContact O-N 3.24Å; F462-L466 HydrophobicContact CE1-CB 4.36Å; F462-L466 HydrophobicContact CE1-CD2 4.15Å; F462-L466 WeakPolarHBondContact O-CB 3.46Å; F462-L466 PolarHBondContact O-N 3.36Å
463	K	95.3	Very high	94.2	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-54.7	-48	175.9	-66.5	173.6	179.4	168.7	0	111.1	F455 S458 S459 L460 L466 I467 E529 L535	F455-K463 HydrophobicContact CD1-CG 4.34Å; F455-K463 HydrophobicContact CD2-CB 4.02Å; F455-K463 HydrophobicContact CD2-CG 3.81Å; F455-K463 HydrophobicContact CE1-CD 4.17Å; F455-K463 HydrophobicContact CE1-CG 4.16Å; F455-K463 HydrophobicContact CE2-CB 3.46Å; F455-K463 VanDerWaalsContact CE2-CB 3.46Å; F455-K463 HydrophobicContact CE2-CD 4.4Å; F455-K463 HydrophobicContact CE2-CG 3.62Å; F455-K463 HydrophobicContact CG-CG 4.18Å; F455-K463 HydrophobicContact CZ-CB 3.84Å; F455-K463 HydrophobicContact CZ-CD 4.08Å; F455-K463 HydrophobicContact CZ-CG 3.8Å; F455-K463 WeakPolarHBondContact O-CE 3.48Å; S458-K463 WeakPolarHBondContact O-CE 3.31Å; S459-K463 PolarHBondContact O-N 2.97Å; L460-K463 WeakPolarHBondContact O-CB 3.44Å; L460-K463 PolarHBondContact O-N 3.43Å; K463-L466 PolarHBondContact O-N 2.94Å; K463-I467 WeakPolarHBondContact O-CG1 3.21Å; K463-I467 PolarHBondContact O-N 2.75Å; K463-E529 HydrophobicContact CD-CG 4.22Å; K463-E529 IonicContact NZ-OE1 3.5Å; K463-E529 PolarHBondContact NZ-OE1 2.93Å; K463-L535 HydrophobicContact CB-CD1 4.2Å
464	C	96.2	Very high	94.4	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.027	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-50.1	175.8	-62.3	0	0	0	0	112	L460 F461 F462 L466 I467 E468 F538	L460-C464 PolarHBondContact O-N 3.41Å; L460-C464 PolarHBondContact O-SG 2.89Å; F461-C464 PolarHBondContact O-N 3.28Å; F462-C464 VanDerWaalsContact C-N 3.31Å; F462-C464 PolarHBondContact O-N 3.36Å; C464-L466 VanDerWaalsContact C-N 3.27Å; C464-L466 PolarHBondContact O-N 3.25Å; C464-I467 PolarHBondContact O-N 2.85Å; C464-E468 WeakPolarHBondContact O-CB 3.41Å; C464-E468 PolarHBondContact O-N 3.25Å; C464-F538 HydrophobicContact CB-CD1 4.47Å; C464-F538 HydrophobicContact CB-CD2 3.58Å; C464-F538 HydrophobicContact CB-CE2 3.77Å; C464-F538 HydrophobicContact CB-CG 3.97Å; C464-F538 HydrophobicContact CB-CZ 4.28Å
465	G	95.9	Very high	94.6	Very high	6 Å²	6	34.8 Å²	34.8	6%	0.062	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-29.9	179.5	0	0	0	0	0	113.7	F461 F462 C469	F461-G465 PolarHBondContact O-N 2.69Å; F462-G465 PolarHBondContact O-N 3.24Å; G465-C469 VanDerWaalsContact O-CB 3.28Å; G465-C469 WeakPolarHBondContact O-CB 3.32Å; G465-C469 PolarHBondContact O-N 2.97Å
466	L	96.4	Very high	94.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-71.6	-43.1	173.9	-178.3	57.4	0	0	0	111.4	L429 L451 F455 F462 K463 C464 E468 C469 L470 L521	L429-L466 HydrophobicContact CD2-CD1 4.12Å; L451-L466 HydrophobicContact CB-CD2 4.37Å; L451-L466 HydrophobicContact CD1-CD1 4.32Å; L451-L466 HydrophobicContact CD2-CD1 3.9Å; F455-L466 HydrophobicContact CB-CD2 3.94Å; F455-L466 HydrophobicContact CD2-CD2 3.69Å; F455-L466 HydrophobicContact CD2-CG 4.5Å; F455-L466 HydrophobicContact CG-CD2 4.29Å; F462-L466 HydrophobicContact CE1-CB 4.36Å; F462-L466 HydrophobicContact CE1-CD2 4.15Å; F462-L466 WeakPolarHBondContact O-CB 3.46Å; F462-L466 PolarHBondContact O-N 3.36Å; K463-L466 PolarHBondContact O-N 2.94Å; C464-L466 VanDerWaalsContact C-N 3.27Å; C464-L466 PolarHBondContact O-N 3.25Å; L466-E468 VanDerWaalsContact C-N 3.31Å; L466-E468 PolarHBondContact O-N 3.39Å; L466-C469 WeakPolarHBondContact O-CB 3.4Å; L466-C469 PolarHBondContact O-N 3.48Å; L466-L470 HydrophobicContact CD1-CD1 4.26Å; L466-L470 HydrophobicContact CD1-CG 4.25Å; L466-L470 HydrophobicContact CG-CD1 4.13Å; L466-L470 VanDerWaalsContact O-CG 3.28Å; L466-L470 WeakPolarHBondContact O-CG 3.41Å; L466-L470 PolarHBondContact O-N 3.49Å; L466-L521 HydrophobicContact CD2-CD1 4.45Å
467	I	97.6	Very high	94.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174.5	-63.9	-66.2	0	0	0	110.4	F455 K463 C464 L470 N471 V518 L521 L535 F538 I539 F542	F455-I467 HydrophobicContact CE2-CD1 4.33Å; F455-I467 HydrophobicContact CE2-CG1 4.28Å; K463-I467 WeakPolarHBondContact O-CG1 3.21Å; K463-I467 PolarHBondContact O-N 2.75Å; C464-I467 PolarHBondContact O-N 2.85Å; I467-L470 PolarHBondContact O-N 3.36Å; I467-N471 WeakPolarHBondContact O-CB 3.42Å; I467-N471 PolarHBondContact O-N 2.65Å; I467-V518 HydrophobicContact CD1-CG1 3.92Å; I467-L521 HydrophobicContact CD1-CB 4.48Å; I467-L535 HydrophobicContact CG1-CD1 4.36Å; I467-F538 HydrophobicContact CB-CB 4.43Å; I467-F538 HydrophobicContact CG2-CB 4.15Å; I467-F538 WeakPolarHBondContact CG2-O 3.41Å; I467-I539 HydrophobicContact CG1-CG1 4.46Å; I467-I539 HydrophobicContact CG2-CG1 4.32Å; I467-F542 HydrophobicContact CG2-CB 4.3Å
468	E	97.4	Very high	94.8	Very high	86 Å²	86	29 Å²	29	40%	0.402	15%	0.148	S	C	.	.	H	α-helix	trans	-59.4	-45.9	174.1	-176.4	-179.3	-165.5	0	0	112.1	C464 L466 L470 N471 H472 F538	C464-E468 WeakPolarHBondContact O-CB 3.41Å; C464-E468 PolarHBondContact O-N 3.25Å; L466-E468 VanDerWaalsContact C-N 3.31Å; L466-E468 PolarHBondContact O-N 3.39Å; E468-L470 VanDerWaalsContact C-N 3.35Å; E468-L470 PolarHBondContact O-N 2.94Å; E468-N471 WeakPolarHBondContact O-CB 3.44Å; E468-N471 PolarHBondContact O-N 3.32Å; E468-H472 VanDerWaalsContact CG-CE1 3.44Å; E468-H472 WeakPolarHBondContact CG-CE1 3.38Å; E468-H472 PolarHBondContact O-N 3.31Å; E468-H472 PolarHBondContact O-ND1 3.2Å; E468-H472 IonicContact OE1-CE1 3.63Å; E468-F538 HydrophobicContact CB-CD1 3.89Å; E468-F538 HydrophobicContact CB-CE1 4.01Å; E468-F538 HydrophobicContact CG-CD1 4.49Å; E468-F538 HydrophobicContact CG-CE1 4.29Å
469	C	96.7	Very high	94.8	Very high	6 Å²	6	30.8 Å²	30.8	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-57.2	-46.4	175.1	175.1	0	0	0	0	112.1	L429 G465 L466 N471 H472 M473	L429-C469 HydrophobicContact CB-CB 4.15Å; L429-C469 HydrophobicContact CD2-CB 4.05Å; L429-C469 PolarHBondContact O-SG 2.93Å; G465-C469 VanDerWaalsContact O-CB 3.28Å; G465-C469 WeakPolarHBondContact O-CB 3.32Å; G465-C469 PolarHBondContact O-N 2.97Å; L466-C469 WeakPolarHBondContact O-CB 3.4Å; L466-C469 PolarHBondContact O-N 3.48Å; C469-N471 VanDerWaalsContact C-N 3.33Å; C469-H472 PolarHBondContact O-N 3.44Å; C469-M473 PolarHBondContact O-N 3.07Å
470	L	97.3	Very high	94.5	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-69.4	-31.7	179.8	-64.7	171	0	0	0	111.8	L451 L466 I467 E468 M473 L474 L514 F517 V518 L521	L451-L470 HydrophobicContact CD1-CD2 4.4Å; L466-L470 HydrophobicContact CD1-CD1 4.26Å; L466-L470 HydrophobicContact CD1-CG 4.25Å; L466-L470 HydrophobicContact CG-CD1 4.13Å; L466-L470 VanDerWaalsContact O-CG 3.28Å; L466-L470 WeakPolarHBondContact O-CG 3.41Å; L466-L470 PolarHBondContact O-N 3.49Å; I467-L470 PolarHBondContact O-N 3.36Å; E468-L470 VanDerWaalsContact C-N 3.35Å; E468-L470 PolarHBondContact O-N 2.94Å; L470-M473 HydrophobicContact CD2-CE 3.71Å; L470-M473 PolarHBondContact O-N 3.32Å; L470-L474 WeakPolarHBondContact O-CB 3.5Å; L470-L474 PolarHBondContact O-N 3.05Å; L470-L514 HydrophobicContact CD2-CD1 4.05Å; L470-F517 HydrophobicContact CD1-CD1 4.35Å; L470-F517 HydrophobicContact CD1-CE1 4Å; L470-V518 HydrophobicContact CB-CG2 3.88Å; L470-V518 HydrophobicContact CD1-CG2 3.7Å; L470-V518 HydrophobicContact CG-CG2 4.35Å; L470-L521 HydrophobicContact CD1-CD1 4.21Å
471	N	97.5	Very high	94	Very high	21 Å²	21	30 Å²	30	11%	0.112	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-47.3	171.3	-166.1	20.9	0	0	0	111.6	I467 E468 C469 M473 L474 L475 D541 F542 T545	I467-N471 WeakPolarHBondContact O-CB 3.42Å; I467-N471 PolarHBondContact O-N 2.65Å; E468-N471 WeakPolarHBondContact O-CB 3.44Å; E468-N471 PolarHBondContact O-N 3.32Å; C469-N471 VanDerWaalsContact C-N 3.33Å; N471-M473 VanDerWaalsContact C-N 3.29Å; N471-M473 PolarHBondContact O-N 2.98Å; N471-L474 PolarHBondContact O-N 3.45Å; N471-L475 WeakPolarHBondContact O-CB 3.4Å; N471-L475 PolarHBondContact O-N 3.12Å; N471-D541 PolarHBondContact ND2-O 2.9Å; N471-F542 HydrophobicContact CB-CB 4.39Å; N471-F542 HydrophobicContact CB-CD2 3.84Å; N471-T545 WeakPolarHBondContact OD1-CB 3.37Å; N471-T545 PolarHBondContact OD1-OG1 2.92Å
472	H	96	Very high	93.6	Very high	81 Å²	81	24.9 Å²	24.9	38%	0.375	13%	0.125	S	C	.	.	H	α-helix	trans	-61.9	-37.7	175.9	-71.3	125.5	0	0	0	112.6	E468 C469 L475 K476	E468-H472 VanDerWaalsContact CG-CE1 3.44Å; E468-H472 WeakPolarHBondContact CG-CE1 3.38Å; E468-H472 PolarHBondContact O-N 3.31Å; E468-H472 PolarHBondContact O-ND1 3.2Å; E468-H472 IonicContact OE1-CE1 3.63Å; C469-H472 PolarHBondContact O-N 3.44Å; H472-L475 PolarHBondContact O-N 2.91Å; H472-K476 WeakPolarHBondContact O-CG 3.49Å; H472-K476 PolarHBondContact O-N 3Å; H472-K476 VanDerWaalsContact O-N 3.07Å
473	M	95.2	Very high	93	Very high	4 Å²	4	27 Å²	27	2%	0.02	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-49.6	173.8	-169.7	173.3	72.1	0	0	111.1	C469 L470 N471 L475 K476 W477 L514	C469-M473 PolarHBondContact O-N 3.07Å; L470-M473 HydrophobicContact CD2-CE 3.71Å; L470-M473 PolarHBondContact O-N 3.32Å; N471-M473 VanDerWaalsContact C-N 3.29Å; N471-M473 PolarHBondContact O-N 2.98Å; M473-L475 VanDerWaalsContact C-N 3.34Å; M473-L475 PolarHBondContact O-N 2.79Å; M473-K476 PolarHBondContact O-N 3.34Å; M473-W477 HydrophobicContact CE-CH2 4.03Å; M473-W477 HydrophobicContact CE-CZ2 3.94Å; M473-W477 HydrophobicContact CG-CD2 4.4Å; M473-W477 HydrophobicContact CG-CZ2 3.85Å; M473-W477 VanDerWaalsContact O-CG 3.29Å; M473-W477 PolarHBondContact O-N 2.67Å; M473-W477 HydrophobicContact SD-CH2 4.49Å; M473-W477 HydrophobicContact SD-CZ2 3.82Å; M473-L514 HydrophobicContact CE-CD1 3.39Å; M473-L514 HydrophobicContact CE-CD2 3.67Å; M473-L514 HydrophobicContact CE-CG 4.17Å
474	L	96	Very high	91.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.8	-47	175.7	176	64.3	0	0	0	111.5	L470 N471 K476 W477 L478 V511 L514 V515 F542 T545 V546	L470-L474 WeakPolarHBondContact O-CB 3.5Å; L470-L474 PolarHBondContact O-N 3.05Å; N471-L474 PolarHBondContact O-N 3.45Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.34Å; L474-W477 PolarHBondContact O-N 3.39Å; L474-L478 HydrophobicContact CD1-CD1 3.93Å; L474-L478 HydrophobicContact CD1-CG 3.99Å; L474-L478 HydrophobicContact CG-CD1 3.92Å; L474-L478 HydrophobicContact CG-CG 4.33Å; L474-L478 WeakPolarHBondContact O-CB 3.45Å; L474-L478 VanDerWaalsContact O-CG 3.32Å; L474-L478 WeakPolarHBondContact O-CG 3.36Å; L474-L478 PolarHBondContact O-N 2.95Å; L474-V511 HydrophobicContact CD1-CG1 3.78Å; L474-L514 HydrophobicContact CB-CD2 3.96Å; L474-L514 HydrophobicContact CD1-CD2 4.25Å; L474-V515 HydrophobicContact CD1-CG2 4.49Å; L474-V515 HydrophobicContact CD2-CG2 4.41Å; L474-F542 HydrophobicContact CB-CE2 4.21Å; L474-F542 HydrophobicContact CD2-CD2 4.32Å; L474-F542 HydrophobicContact CD2-CE2 3.63Å; L474-F542 HydrophobicContact CD2-CZ 3.79Å; L474-T545 HydrophobicContact CD2-CG2 4.04Å; L474-T545 HydrophobicContact CG-CG2 4.22Å; L474-V546 HydrophobicContact CD2-CG2 3.61Å
475	L	94.8	Very high	90.2	Very high	65 Å²	65	33.4 Å²	33.4	34%	0.34	18%	0.177	S	C	.	.	H	α-helix	trans	-59.5	-43.1	-179.7	-179.3	62.3	0	0	0	111.7	N471 H472 M473 L478 T479 T545 F553	N471-L475 WeakPolarHBondContact O-CB 3.4Å; N471-L475 PolarHBondContact O-N 3.12Å; H472-L475 PolarHBondContact O-N 2.91Å; M473-L475 VanDerWaalsContact C-N 3.34Å; M473-L475 PolarHBondContact O-N 2.79Å; L475-L478 PolarHBondContact O-N 3.23Å; L475-T479 VanDerWaalsContact O-CB 3.28Å; L475-T479 WeakPolarHBondContact O-CB 3.48Å; L475-T479 PolarHBondContact O-N 2.58Å; L475-T479 PolarHBondContact O-OG1 3.14Å; L475-T545 HydrophobicContact CB-CG2 4.3Å; L475-T545 HydrophobicContact CD1-CG2 4.24Å; L475-F553 HydrophobicContact CD1-CE1 4.23Å; L475-F553 HydrophobicContact CD1-CZ 3.62Å
476	K	91.8	Very high	88.1	Confident	60 Å²	60	40.4 Å²	40.4	26%	0.261	21%	0.212	S	C	.	.	H	α-helix	trans	-66.7	-41.6	177	-73.6	170.4	-167.6	163.4	0	112.1	S433 N434 H472 M473 L474 L478 T479 W480	S433-K476 VanDerWaalsContact O-CD 3.26Å; S433-K476 WeakPolarHBondContact O-CD 3.27Å; S433-K476 PolarHBondContact O-NZ 3.19Å; S433-K476 VanDerWaalsContact O-NZ 3.1Å; S433-K476 PolarHBondContact OG-NZ 3.29Å; N434-K476 PolarHBondContact OD1-NZ 3.13Å; H472-K476 WeakPolarHBondContact O-CG 3.49Å; H472-K476 PolarHBondContact O-N 3Å; H472-K476 VanDerWaalsContact O-N 3.07Å; M473-K476 PolarHBondContact O-N 3.34Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.34Å; K476-L478 PolarHBondContact O-N 3.11Å; K476-T479 PolarHBondContact O-N 2.89Å; K476-W480 VanDerWaalsContact O-CB 3.23Å; K476-W480 WeakPolarHBondContact O-CB 3.31Å; K476-W480 PolarHBondContact O-N 3.06Å
477	W	91.4	Very high	86	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.027	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-48.3	175.7	-66.6	3.1	0	0	0	111.2	I435 V437 I443 M473 L474 W480 H481 F507 V511 L514	I435-W477 PolarHBondContact O-NE1 3.41Å; V437-W477 HydrophobicContact CB-CD2 4.44Å; V437-W477 HydrophobicContact CG1-CE3 4.47Å; V437-W477 HydrophobicContact CG1-CZ3 4.48Å; V437-W477 HydrophobicContact CG2-CB 3.97Å; V437-W477 HydrophobicContact CG2-CD2 3.58Å; V437-W477 HydrophobicContact CG2-CE3 4.07Å; V437-W477 HydrophobicContact CG2-CG 3.53Å; I443-W477 HydrophobicContact CD1-CH2 3.68Å; I443-W477 HydrophobicContact CD1-CZ3 4.4Å; M473-W477 HydrophobicContact CE-CH2 4.03Å; M473-W477 HydrophobicContact CE-CZ2 3.94Å; M473-W477 HydrophobicContact CG-CD2 4.4Å; M473-W477 HydrophobicContact CG-CZ2 3.85Å; M473-W477 VanDerWaalsContact O-CG 3.29Å; M473-W477 PolarHBondContact O-N 2.67Å; M473-W477 HydrophobicContact SD-CH2 4.49Å; M473-W477 HydrophobicContact SD-CZ2 3.82Å; L474-W477 PolarHBondContact O-N 3.39Å; W477-W480 PolarHBondContact O-N 3.09Å; W477-H481 PolarHBondContact O-N 3.41Å; W477-F507 HydrophobicContact CB-CZ 4.25Å; W477-F507 WeakPolarHBondContact O-CZ 3.45Å; W477-V511 HydrophobicContact CE3-CG2 4.19Å; W477-L514 HydrophobicContact CE3-CD2 3.89Å; W477-L514 HydrophobicContact CH2-CD2 4.18Å; W477-L514 HydrophobicContact CZ3-CB 4.06Å; W477-L514 HydrophobicContact CZ3-CD2 3.67Å; W477-L514 HydrophobicContact CZ3-CG 4.45Å
478	L	91.6	Very high	83.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-39.6	178.8	-67.6	178.8	0	0	0	112.5	L474 L475 K476 H481 S482 V511 T545 T549 F553 L555	L474-L478 HydrophobicContact CD1-CD1 3.93Å; L474-L478 HydrophobicContact CD1-CG 3.99Å; L474-L478 HydrophobicContact CG-CD1 3.92Å; L474-L478 HydrophobicContact CG-CG 4.33Å; L474-L478 WeakPolarHBondContact O-CB 3.45Å; L474-L478 VanDerWaalsContact O-CG 3.32Å; L474-L478 WeakPolarHBondContact O-CG 3.36Å; L474-L478 PolarHBondContact O-N 2.95Å; L475-L478 PolarHBondContact O-N 3.23Å; K476-L478 PolarHBondContact O-N 3.11Å; L478-H481 PolarHBondContact O-N 2.85Å; L478-S482 WeakPolarHBondContact O-CB 3.28Å; L478-S482 PolarHBondContact O-N 3.03Å; L478-S482 PolarHBondContact O-OG 3.13Å; L478-V511 HydrophobicContact CD2-CG1 4.39Å; L478-T545 HydrophobicContact CD1-CG2 4.22Å; L478-T549 HydrophobicContact CD2-CG2 3.86Å; L478-F553 HydrophobicContact CB-CB 4.03Å; L478-F553 HydrophobicContact CB-CD1 3.72Å; L478-F553 HydrophobicContact CB-CD2 3.9Å; L478-F553 HydrophobicContact CB-CE1 4.07Å; L478-F553 HydrophobicContact CB-CE2 4.22Å; L478-F553 HydrophobicContact CB-CG 3.62Å; L478-F553 HydrophobicContact CB-CZ 4.3Å; L478-F553 HydrophobicContact CD1-CD2 3.77Å; L478-F553 HydrophobicContact CD1-CE2 3.95Å; L478-F553 HydrophobicContact CD1-CG 4.33Å; L478-F553 HydrophobicContact CD2-CB 4.46Å; L478-F553 HydrophobicContact CG-CD2 4.36Å; L478-F553 HydrophobicContact CG-CG 4.44Å; L478-L555 HydrophobicContact CD2-CD2 3.9Å
479	T	90.2	Very high	80.6	Confident	63 Å²	63	57.1 Å²	57.1	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-65.2	-45.4	177.4	-57.2	0	0	0	0	110.7	L475 K476 H481 S482 A483	L475-T479 VanDerWaalsContact O-CB 3.28Å; L475-T479 WeakPolarHBondContact O-CB 3.48Å; L475-T479 PolarHBondContact O-N 2.58Å; L475-T479 PolarHBondContact O-OG1 3.14Å; K476-T479 PolarHBondContact O-N 2.89Å; T479-H481 PolarHBondContact O-N 3.02Å; T479-S482 WeakPolarHBondContact CA-OG 3.42Å; T479-S482 PolarHBondContact O-N 3.28Å; T479-S482 VanDerWaalsContact O-N 3.16Å; T479-S482 PolarHBondContact O-OG 3.13Å; T479-A483 PolarHBondContact O-N 2.95Å
480	W	85.8	Confident	78	Confident	61 Å²	61	62.5 Å²	62.5	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-49.3	174.9	-174.5	93.7	0	0	0	110.8	K476 W477 S482 A483 Y484 L494 F507	K476-W480 VanDerWaalsContact O-CB 3.23Å; K476-W480 WeakPolarHBondContact O-CB 3.31Å; K476-W480 PolarHBondContact O-N 3.06Å; W477-W480 PolarHBondContact O-N 3.09Å; W480-S482 VanDerWaalsContact C-N 3.34Å; W480-S482 PolarHBondContact O-N 2.82Å; W480-A483 PolarHBondContact O-N 3.41Å; W480-Y484 AromaticContact CD1-CD2 3.62Å; W480-Y484 AromaticContact CD1-CE2 3.38Å; W480-Y484 AromaticContact CD2-CD2 3.82Å; W480-Y484 HydrophobicContact CD2-CD2 3.82Å; W480-Y484 HydrophobicContact CD2-CE2 4.35Å; W480-Y484 AromaticContact CE2-CD2 3.63Å; W480-Y484 AromaticContact CE2-CE2 3.92Å; W480-Y484 AromaticContact CG-CD2 3.82Å; W480-Y484 HydrophobicContact CG-CD2 3.82Å; W480-Y484 HydrophobicContact CG-CE2 4.05Å; W480-Y484 HydrophobicContact CZ2-CD2 4.32Å; W480-Y484 AromaticContact NE1-CD2 3.46Å; W480-Y484 AromaticContact NE1-CE2 3.25Å; W480-Y484 VanDerWaalsContact O-CD2 3.25Å; W480-Y484 WeakPolarHBondContact O-CD2 3.49Å; W480-Y484 PolarHBondContact O-N 3Å; W480-L494 HydrophobicContact CH2-CB 4.21Å; W480-L494 HydrophobicContact CH2-CD1 3.58Å; W480-L494 HydrophobicContact CH2-CD2 3.26Å; W480-L494 HydrophobicContact CH2-CG 3.82Å; W480-L494 HydrophobicContact CZ2-CD2 4.29Å; W480-L494 HydrophobicContact CZ3-CD1 3.69Å; W480-L494 HydrophobicContact CZ3-CD2 3.71Å; W480-L494 HydrophobicContact CZ3-CG 4.28Å; W480-F507 HydrophobicContact CE3-CE2 4.21Å; W480-F507 HydrophobicContact CZ3-CE2 4.37Å
481	H	84.1	Confident	75.3	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.069	37%	0.366	C	S	.	.	H	α-helix	trans	-55.3	-49	173.6	173.2	-88.6	0	0	0	111.8	W477 L478 T479 A483 Y484 A485 L504 F507 F553	W477-H481 PolarHBondContact O-N 3.41Å; L478-H481 PolarHBondContact O-N 2.85Å; T479-H481 PolarHBondContact O-N 3.02Å; H481-A483 VanDerWaalsContact C-N 3.33Å; H481-A483 PolarHBondContact O-N 2.89Å; H481-Y484 PolarHBondContact O-N 3.27Å; H481-A485 WeakPolarHBondContact O-CA 3.26Å; H481-A485 WeakPolarHBondContact O-CB 3.46Å; H481-A485 PolarHBondContact O-N 3.48Å; H481-L504 WeakPolarHBondContact NE2-CD1 3.49Å; H481-F507 HydrophobicContact CB-CE1 3.84Å; H481-F507 HydrophobicContact CB-CE2 4.34Å; H481-F507 HydrophobicContact CB-CZ 3.62Å; H481-F507 AromaticContact CD2-CE1 4Å; H481-F553 PolarHBondContact ND1-O 2.92Å
482	S	84.9	Confident	72.9	Confident	28 Å²	28	71.7 Å²	71.7	20%	0.196	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-34.6	-177.1	68.4	0	0	0	0	113.9	L478 T479 W480 L486	L478-S482 WeakPolarHBondContact O-CB 3.28Å; L478-S482 PolarHBondContact O-N 3.03Å; L478-S482 PolarHBondContact O-OG 3.13Å; T479-S482 WeakPolarHBondContact CA-OG 3.42Å; T479-S482 PolarHBondContact O-N 3.28Å; T479-S482 VanDerWaalsContact O-N 3.16Å; T479-S482 PolarHBondContact O-OG 3.13Å; W480-S482 VanDerWaalsContact C-N 3.34Å; W480-S482 PolarHBondContact O-N 2.82Å; S482-L486 VanDerWaalsContact O-CD1 3.23Å; S482-L486 WeakPolarHBondContact O-CD1 3.38Å; S482-L486 VanDerWaalsContact O-CG 3.3Å; S482-L486 WeakPolarHBondContact O-CG 3.41Å
483	A	81.5	Confident	70.4	Confident	49 Å²	49	70.7 Å²	70.7	41%	0.405	38%	0.378	S	S	.	.	H	α-helix	trans	-72.4	-47.9	179.2	0	0	0	0	0	111	T479 W480 H481	T479-A483 PolarHBondContact O-N 2.95Å; W480-A483 PolarHBondContact O-N 3.41Å; H481-A483 VanDerWaalsContact C-N 3.33Å; H481-A483 PolarHBondContact O-N 2.89Å
484	Y	69.5	Low	68.2	Low	100 Å²	100	71.5 Å²	71.5	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-84.9	-25.4	-174	-69.6	-73.6	0	0	0	113.9	W480 H481 L486 E487	W480-Y484 AromaticContact CD1-CD2 3.62Å; W480-Y484 AromaticContact CD1-CE2 3.38Å; W480-Y484 AromaticContact CD2-CD2 3.82Å; W480-Y484 HydrophobicContact CD2-CD2 3.82Å; W480-Y484 HydrophobicContact CD2-CE2 4.35Å; W480-Y484 AromaticContact CE2-CD2 3.63Å; W480-Y484 AromaticContact CE2-CE2 3.92Å; W480-Y484 AromaticContact CG-CD2 3.82Å; W480-Y484 HydrophobicContact CG-CD2 3.82Å; W480-Y484 HydrophobicContact CG-CE2 4.05Å; W480-Y484 HydrophobicContact CZ2-CD2 4.32Å; W480-Y484 AromaticContact NE1-CD2 3.46Å; W480-Y484 AromaticContact NE1-CE2 3.25Å; W480-Y484 VanDerWaalsContact O-CD2 3.25Å; W480-Y484 WeakPolarHBondContact O-CD2 3.49Å; W480-Y484 PolarHBondContact O-N 3Å; H481-Y484 PolarHBondContact O-N 3.27Å; Y484-L486 PolarHBondContact O-N 3.07Å; Y484-E487 PolarHBondContact O-N 3.02Å
485	A	63.1	Low	65.4	Low	46 Å²	46	76.7 Å²	76.7	38%	0.38	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.1	175.8	0	0	0	0	0	113.7	H481	H481-A485 WeakPolarHBondContact O-CA 3.26Å; H481-A485 WeakPolarHBondContact O-CB 3.46Å; H481-A485 PolarHBondContact O-N 3.48Å
486	L	52.8	Low	62.9	Low	154 Å²	154	75.5 Å²	75.5	81%	0.806	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-17.2	176.6	-71.8	171.7	0	0	0	113.1	S482 Y484	S482-L486 VanDerWaalsContact O-CD1 3.23Å; S482-L486 WeakPolarHBondContact O-CD1 3.38Å; S482-L486 VanDerWaalsContact O-CG 3.3Å; S482-L486 WeakPolarHBondContact O-CG 3.41Å; Y484-L486 PolarHBondContact O-N 3.07Å
487	E	50.7	Low	60.5	Low	148 Å²	148	77.8 Å²	77.8	69%	0.692	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-21.6	-173.8	-72.2	-172.2	163	0	0	113.8	Y484	Y484-E487 PolarHBondContact O-N 3.02Å
488	D	41.7	Very low	58.2	Low	102 Å²	102	79.5 Å²	79.5	55%	0.545	43%	0.43	S	S	.	.			trans	-140.6	121.4	-175.9	-86.7	-32	0	0	0	113.4	L490	D488-L490 HydrophobicContact CB-CB 4.03Å; D488-L490 HydrophobicContact CB-CD1 3.86Å; D488-L490 VanDerWaalsContact CG-CD1 3.47Å; D488-L490 PolarHBondContact O-N 3.38Å; D488-L490 VanDerWaalsContact OD1-CD1 3.27Å; D488-L490 WeakPolarHBondContact OD1-CD1 3.41Å
489	D	40.6	Very low	55.9	Low	187 Å²	187	84.4 Å²	84.4	100%	1	46%	0.464	S	S	*	.			trans	-66.2	13.8	156.7	-91.1	-30.3	0	0	0	112
490	L	41.3	Very low	54	Low	119 Å²	119	84.4 Å²	84.4	62%	0.623	46%	0.461	S	S	*	.	S	Bend	trans	-81.4	136.5	174	-79.8	101.3	0	0	0	110.2	D488 I492	D488-L490 HydrophobicContact CB-CB 4.03Å; D488-L490 HydrophobicContact CB-CD1 3.86Å; D488-L490 VanDerWaalsContact CG-CD1 3.47Å; D488-L490 PolarHBondContact O-N 3.38Å; D488-L490 VanDerWaalsContact OD1-CD1 3.27Å; D488-L490 WeakPolarHBondContact OD1-CD1 3.41Å; L490-I492 PolarHBondContact O-N 2.9Å; L490-I492 VanDerWaalsContact O-N 3.12Å
491	D	41.8	Very low	52.8	Low	155 Å²	155	86.9 Å²	86.9	83%	0.829	48%	0.479	S	S	*	.			trans	-32.7	120.9	161.6	-86.5	-39.2	0	0	0	110	S493	D491-S493 PolarHBondContact O-N 3.41Å
492	I	46.9	Very low	52.1	Low	61 Å²	61	86.9 Å²	86.9	31%	0.313	48%	0.48	S	S	.	.			trans	-66.2	69.6	178.4	-61.8	161.6	0	0	0	108.1	L490 L494 L504	L490-I492 PolarHBondContact O-N 2.9Å; L490-I492 VanDerWaalsContact O-N 3.12Å; I492-L494 HydrophobicContact CG2-CD1 4.15Å; I492-L494 HydrophobicContact CG2-CD2 3.73Å; I492-L494 HydrophobicContact CG2-CG 3.72Å; I492-L504 HydrophobicContact CB-CB 4.13Å; I492-L504 HydrophobicContact CD1-CB 3.6Å; I492-L504 HydrophobicContact CD1-CD1 3.93Å; I492-L504 HydrophobicContact CD1-CD2 3.67Å; I492-L504 HydrophobicContact CD1-CG 3.9Å; I492-L504 HydrophobicContact CG1-CB 4.46Å; I492-L504 HydrophobicContact CG2-CB 4.08Å
493	S	43.5	Very low	51.8	Low	61 Å²	61	89.2 Å²	89.2	43%	0.427	49%	0.492	S	S	.	.			trans	-95.2	94.1	157.3	108.8	0	0	0	0	102.2	D491 N495	D491-S493 PolarHBondContact O-N 3.41Å; S493-N495 PolarHBondContact O-N 2.91Å; S493-N495 VanDerWaalsContact OG-CG 3.27Å; S493-N495 PolarHBondContact OG-ND2 2.94Å; S493-N495 PolarHBondContact OG-OD1 3.13Å
494	L	47.8	Very low	51.7	Low	20 Å²	20	88.6 Å²	88.6	11%	0.105	48%	0.482	C	S	.	.			trans	-63.7	79.9	-178.9	-67.4	174.3	0	0	0	109.4	W480 I492 S496 I502	W480-L494 HydrophobicContact CH2-CB 4.21Å; W480-L494 HydrophobicContact CH2-CD1 3.58Å; W480-L494 HydrophobicContact CH2-CD2 3.26Å; W480-L494 HydrophobicContact CH2-CG 3.82Å; W480-L494 HydrophobicContact CZ2-CD2 4.29Å; W480-L494 HydrophobicContact CZ3-CD1 3.69Å; W480-L494 HydrophobicContact CZ3-CD2 3.71Å; W480-L494 HydrophobicContact CZ3-CG 4.28Å; I492-L494 HydrophobicContact CG2-CD1 4.15Å; I492-L494 HydrophobicContact CG2-CD2 3.73Å; I492-L494 HydrophobicContact CG2-CG 3.72Å; L494-S496 VanDerWaalsContact C-N 3.32Å; L494-I502 HydrophobicContact CB-CG2 4.46Å; L494-I502 HydrophobicContact CD1-CB 4.37Å; L494-I502 HydrophobicContact CD1-CG2 3.2Å; L494-I502 VanDerWaalsContact CD1-O 3.28Å; L494-I502 WeakPolarHBondContact CD1-O 3.4Å; L494-I502 HydrophobicContact CG-CG2 4.33Å; L494-I502 WeakPolarHBondContact CG-O 3.3Å
495	N	38.8	Very low	52.2	Low	109 Å²	109	87.3 Å²	87.3	58%	0.583	49%	0.488	S	S	*	.			trans	-93.2	13	-178.5	-75.5	-17.5	0	0	0	112.3	S493 H497 N501	S493-N495 PolarHBondContact O-N 2.91Å; S493-N495 VanDerWaalsContact OG-CG 3.27Å; S493-N495 PolarHBondContact OG-ND2 2.94Å; S493-N495 PolarHBondContact OG-OD1 3.13Å; N495-H497 PolarHBondContact O-N 3.3Å; N495-N501 PolarHBondContact OD1-ND2 3.46Å; N495-N501 PolarHBondContact OD1-OD1 3.1Å
496	S	40.9	Very low	53.2	Low	41 Å²	41	85.8 Å²	85.8	29%	0.287	48%	0.477	S	S	.	.	S	Bend	trans	-90	92.7	176.5	56.8	0	0	0	0	110	L494 T498	L494-S496 VanDerWaalsContact C-N 3.32Å; S496-T498 PolarHBondContact O-N 3.13Å; S496-T498 PolarHBondContact O-OG1 3.17Å
497	H	41.5	Very low	54.8	Low	108 Å²	108	78.6 Å²	78.6	50%	0.5	44%	0.439	S	S	.	.	S	Bend	trans	51.4	-8.5	161.1	-55.7	-71.1	0	0	0	120.6	Q352 N495	Q352-H497 PolarHBondContact OE1-NE2 3.48Å; Q352-H497 VanDerWaalsContact OE1-NE2 3.16Å; N495-H497 PolarHBondContact O-N 3.3Å
498	T	43.9	Very low	56.6	Low	43 Å²	43	73.8 Å²	73.8	26%	0.264	42%	0.416	S	S	.	.			trans	-78.3	127.6	166.3	51	0	0	0	0	107.8	P436 S496 I500	P436-T498 HydrophobicContact CB-CG2 4.36Å; S496-T498 PolarHBondContact O-N 3.13Å; S496-T498 PolarHBondContact O-OG1 3.17Å; T498-I500 PolarHBondContact O-N 2.92Å
499	S	41.9	Very low	58.9	Low	103 Å²	103	72.4 Å²	72.4	72%	0.72	41%	0.408	S	S	*	.	S	Bend	trans	-63.7	5.6	-177.7	54.1	0	0	0	0	115.2
500	I	52.3	Low	61.3	Low	62 Å²	62	63.5 Å²	63.5	32%	0.318	36%	0.361	S	S	.	.	S	Bend	trans	-129.8	106.4	-175.3	-53.7	178.1	0	0	0	108.5	P439 T498 I502	P439-I500 HydrophobicContact CG-CD1 4.43Å; P439-I500 HydrophobicContact CG-CG2 3.66Å; T498-I500 PolarHBondContact O-N 2.92Å; I500-I502 PolarHBondContact O-N 3.03Å
501	N	59.1	Low	63.8	Low	113 Å²	113	57.8 Å²	57.8	60%	0.604	33%	0.331	S	S	*	.			trans	-67.3	105.1	168	-67.4	9.1	0	0	0	107.8	N495	N495-N501 PolarHBondContact OD1-ND2 3.46Å; N495-N501 PolarHBondContact OD1-OD1 3.1Å
502	I	70.3	Confident	66.3	Low	16 Å²	16	53.1 Å²	53.1	8%	0.082	31%	0.305	C	S	.	.			trans	-107.7	137.2	174.4	-166.6	171.5	0	0	0	109	V437 L494 I500	V437-I502 HydrophobicContact CG1-CD1 3.99Å; L494-I502 HydrophobicContact CB-CG2 4.46Å; L494-I502 HydrophobicContact CD1-CB 4.37Å; L494-I502 HydrophobicContact CD1-CG2 3.2Å; L494-I502 VanDerWaalsContact CD1-O 3.28Å; L494-I502 WeakPolarHBondContact CD1-O 3.4Å; L494-I502 HydrophobicContact CG-CG2 4.33Å; L494-I502 WeakPolarHBondContact CG-O 3.3Å; I500-I502 PolarHBondContact O-N 3.03Å
503	T	78.5	Confident	68.6	Low	76 Å²	76	53 Å²	53	47%	0.466	30%	0.303	S	S	.	.			trans	-79.8	162.1	175.1	59.3	0	0	0	0	109.7	S505 G506 F507	T503-S505 PolarHBondContact O-N 3.15Å; T503-S505 PolarHBondContact OG1-OG 3.47Å; T503-G506 PolarHBondContact O-N 2.82Å; T503-G506 PolarHBondContact OG1-N 3.44Å; T503-G506 VanDerWaalsContact OG1-N 3.12Å; T503-F507 PolarHBondContact O-N 3.01Å
504	L	79	Confident	71.1	Confident	37 Å²	37	50 Å²	50	19%	0.194	28%	0.282	C	S	.	.	H	α-helix	trans	-53.4	-39.1	172.2	179.2	59.7	0	0	0	112.5	H481 I492 F507 K508 L555 F606	H481-L504 WeakPolarHBondContact NE2-CD1 3.49Å; I492-L504 HydrophobicContact CB-CB 4.13Å; I492-L504 HydrophobicContact CD1-CB 3.6Å; I492-L504 HydrophobicContact CD1-CD1 3.93Å; I492-L504 HydrophobicContact CD1-CD2 3.67Å; I492-L504 HydrophobicContact CD1-CG 3.9Å; I492-L504 HydrophobicContact CG1-CB 4.46Å; I492-L504 HydrophobicContact CG2-CB 4.08Å; L504-F507 PolarHBondContact O-N 2.95Å; L504-K508 WeakPolarHBondContact O-CB 3.48Å; L504-K508 PolarHBondContact O-N 2.81Å; L504-L555 HydrophobicContact CD1-CD1 4.02Å; L504-F606 HydrophobicContact CD2-CE1 4.08Å; L504-F606 HydrophobicContact CD2-CZ 3.9Å
505	S	80.8	Confident	73.4	Confident	73 Å²	73	49.2 Å²	49.2	51%	0.51	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-45.7	175.7	64.4	0	0	0	0	111.5	T503 F507 K508 D509	T503-S505 PolarHBondContact O-N 3.15Å; T503-S505 PolarHBondContact OG1-OG 3.47Å; S505-F507 VanDerWaalsContact C-N 3.33Å; S505-F507 PolarHBondContact O-N 3.02Å; S505-K508 PolarHBondContact O-N 2.99Å; S505-D509 PolarHBondContact O-N 3.33Å
506	G	83.2	Confident	76.1	Confident	14 Å²	14	48 Å²	48	14%	0.144	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-39.2	176.4	0	0	0	0	0	112.5	T503 D509 S510	T503-G506 PolarHBondContact O-N 2.82Å; T503-G506 PolarHBondContact OG1-N 3.44Å; T503-G506 VanDerWaalsContact OG1-N 3.12Å; G506-D509 PolarHBondContact O-N 3.41Å; G506-S510 PolarHBondContact O-N 3.1Å; G506-S510 PolarHBondContact O-OG 3.32Å
507	F	86.9	Confident	78.7	Confident	2 Å²	2	46 Å²	46	1%	0.009	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-48.2	175	179.5	-83.6	0	0	0	111.1	V437 W477 W480 H481 T503 L504 S505 D509 S510 V511 L555	V437-F507 HydrophobicContact CB-CD2 4.17Å; V437-F507 HydrophobicContact CB-CE2 4.3Å; V437-F507 HydrophobicContact CG1-CD2 4.02Å; V437-F507 HydrophobicContact CG1-CE2 4.44Å; V437-F507 HydrophobicContact CG2-CD2 3.71Å; V437-F507 HydrophobicContact CG2-CE2 3.35Å; V437-F507 HydrophobicContact CG2-CZ 4.31Å; W477-F507 HydrophobicContact CB-CZ 4.25Å; W477-F507 WeakPolarHBondContact O-CZ 3.45Å; W480-F507 HydrophobicContact CE3-CE2 4.21Å; W480-F507 HydrophobicContact CZ3-CE2 4.37Å; H481-F507 HydrophobicContact CB-CE1 3.84Å; H481-F507 HydrophobicContact CB-CE2 4.34Å; H481-F507 HydrophobicContact CB-CZ 3.62Å; H481-F507 AromaticContact CD2-CE1 4Å; T503-F507 PolarHBondContact O-N 3.01Å; L504-F507 PolarHBondContact O-N 2.95Å; S505-F507 VanDerWaalsContact C-N 3.33Å; S505-F507 PolarHBondContact O-N 3.02Å; F507-D509 VanDerWaalsContact C-N 3.31Å; F507-D509 PolarHBondContact O-N 3.35Å; F507-S510 PolarHBondContact O-N 3.09Å; F507-V511 HydrophobicContact CD1-CG2 4.01Å; F507-V511 HydrophobicContact CE1-CG2 3.56Å; F507-V511 HydrophobicContact CZ-CG2 3.95Å; F507-V511 WeakPolarHBondContact O-CG2 3.4Å; F507-V511 PolarHBondContact O-N 2.87Å; F507-L555 HydrophobicContact CD1-CD1 3.79Å; F507-L555 HydrophobicContact CD1-CD2 4.35Å; F507-L555 HydrophobicContact CE1-CD1 3.89Å; F507-L555 HydrophobicContact CE1-CD2 3.96Å
508	K	87.7	Confident	81.4	Confident	47 Å²	47	40.9 Å²	40.9	20%	0.204	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-44.2	175.8	176.4	177.8	170.8	168.4	0	111.6	L504 S505 V511 M512 P556 L557	L504-K508 WeakPolarHBondContact O-CB 3.48Å; L504-K508 PolarHBondContact O-N 2.81Å; S505-K508 PolarHBondContact O-N 2.99Å; K508-V511 PolarHBondContact O-N 2.91Å; K508-M512 VanDerWaalsContact O-CB 3.3Å; K508-M512 WeakPolarHBondContact O-CB 3.49Å; K508-M512 PolarHBondContact O-N 2.89Å; K508-P556 WeakPolarHBondContact CE-O 3.32Å; K508-P556 PolarHBondContact NZ-O 3.39Å; K508-L557 HydrophobicContact CG-CB 4.34Å; K508-L557 HydrophobicContact CG-CD1 4.21Å; K508-L557 HydrophobicContact CG-CD2 4.37Å
509	D	90.2	Very high	83.9	Confident	73 Å²	73	39.1 Å²	39.1	39%	0.39	22%	0.221	S	C	.	.	H	α-helix	trans	-63.9	-40.9	179	-66.7	-20.4	0	0	0	111.6	S505 G506 F507 M512 E513	S505-D509 PolarHBondContact O-N 3.33Å; G506-D509 PolarHBondContact O-N 3.41Å; F507-D509 VanDerWaalsContact C-N 3.31Å; F507-D509 PolarHBondContact O-N 3.35Å; D509-M512 PolarHBondContact O-N 3.44Å; D509-E513 PolarHBondContact O-N 3.46Å
510	S	91.8	Very high	86.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-42.3	176.2	-68.6	0	0	0	0	113	I438 S440 G506 F507 M512 E513 L514	I438-S510 WeakPolarHBondContact O-CB 3.42Å; I438-S510 PolarHBondContact O-OG 3.42Å; S440-S510 PolarHBondContact N-OG 3.32Å; S440-S510 VanDerWaalsContact N-OG 3.13Å; G506-S510 PolarHBondContact O-N 3.1Å; G506-S510 PolarHBondContact O-OG 3.32Å; F507-S510 PolarHBondContact O-N 3.09Å; S510-M512 VanDerWaalsContact C-N 3.35Å; S510-E513 PolarHBondContact O-N 3.11Å; S510-L514 PolarHBondContact O-N 3.2Å
511	V	93.6	Very high	88.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-44.8	173.6	174.9	0	0	0	0	110.2	L474 W477 L478 F507 K508 E513 L514 V515 L555 L557	L474-V511 HydrophobicContact CD1-CG1 3.78Å; W477-V511 HydrophobicContact CE3-CG2 4.19Å; L478-V511 HydrophobicContact CD2-CG1 4.39Å; F507-V511 HydrophobicContact CD1-CG2 4.01Å; F507-V511 HydrophobicContact CE1-CG2 3.56Å; F507-V511 HydrophobicContact CZ-CG2 3.95Å; F507-V511 WeakPolarHBondContact O-CG2 3.4Å; F507-V511 PolarHBondContact O-N 2.87Å; K508-V511 PolarHBondContact O-N 2.91Å; V511-E513 PolarHBondContact O-N 3.1Å; V511-L514 PolarHBondContact O-N 3.35Å; V511-V515 HydrophobicContact CG1-CG2 4.49Å; V511-V515 WeakPolarHBondContact O-CG2 3.31Å; V511-V515 PolarHBondContact O-N 3.15Å; V511-L555 HydrophobicContact CB-CD2 4.28Å; V511-L555 HydrophobicContact CG1-CD2 4.15Å; V511-L555 HydrophobicContact CG2-CD2 4.17Å; V511-L557 HydrophobicContact CB-CD2 4.03Å; V511-L557 HydrophobicContact CG1-CD2 3.64Å
512	M	93.3	Very high	90.3	Very high	57 Å²	57	30.8 Å²	30.8	28%	0.281	16%	0.162	S	C	.	.	H	α-helix	trans	-60.1	-46	178.5	-171.9	-172.4	-63.2	0	0	111.6	K508 D509 S510 L514 V515 H516 L557 V559	K508-M512 VanDerWaalsContact O-CB 3.3Å; K508-M512 WeakPolarHBondContact O-CB 3.49Å; K508-M512 PolarHBondContact O-N 2.89Å; D509-M512 PolarHBondContact O-N 3.44Å; S510-M512 VanDerWaalsContact C-N 3.35Å; M512-L514 VanDerWaalsContact C-N 3.34Å; M512-L514 PolarHBondContact O-N 3.23Å; M512-V515 PolarHBondContact O-N 3.44Å; M512-H516 WeakPolarHBondContact CG-NE2 3.39Å; M512-H516 PolarHBondContact O-CD2 3.48Å; M512-H516 PolarHBondContact O-N 3.28Å; M512-L557 HydrophobicContact CB-CD1 4.32Å; M512-L557 HydrophobicContact CB-CD2 4.29Å; M512-L557 HydrophobicContact CE-CD1 3.48Å; M512-L557 VanDerWaalsContact CE-CD1 3.48Å; M512-L557 HydrophobicContact CG-CD1 4.39Å; M512-V559 HydrophobicContact CG-CG2 4.31Å
513	E	94.9	Very high	91.5	Very high	57 Å²	57	30.9 Å²	30.9	27%	0.266	16%	0.164	S	C	.	.	H	α-helix	trans	-65.8	-36.5	178.4	-169.8	64.5	-146.1	0	0	111.8	F448 D509 S510 V511 H516 F517 R520	F448-E513 HydrophobicContact CD2-CG 4.41Å; F448-E513 HydrophobicContact CE2-CB 4.44Å; F448-E513 HydrophobicContact CE2-CG 3.64Å; D509-E513 PolarHBondContact O-N 3.46Å; S510-E513 PolarHBondContact O-N 3.11Å; V511-E513 PolarHBondContact O-N 3.1Å; E513-H516 PolarHBondContact O-N 2.94Å; E513-F517 VanDerWaalsContact O-CB 3.26Å; E513-F517 WeakPolarHBondContact O-CB 3.39Å; E513-F517 PolarHBondContact O-N 2.92Å; E513-R520 IonicContact OE1-CZ 2.61Å; E513-R520 IonicContact OE1-NH1 2.68Å; E513-R520 PolarHBondContact OE1-NH1 3.32Å; E513-R520 IonicContact OE1-NH2 2.92Å; E513-R520 PolarHBondContact OE1-NH2 3.27Å
514	L	96.4	Very high	92.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-47.9	172.6	176.8	63	0	0	0	111.6	F448 L470 M473 L474 W477 S510 V511 M512 H516 F517 V518	F448-L514 HydrophobicContact CE1-CD1 3.92Å; F448-L514 HydrophobicContact CZ-CB 4.34Å; F448-L514 HydrophobicContact CZ-CD1 4.2Å; L470-L514 HydrophobicContact CD2-CD1 4.05Å; M473-L514 HydrophobicContact CE-CD1 3.39Å; M473-L514 HydrophobicContact CE-CD2 3.67Å; M473-L514 HydrophobicContact CE-CG 4.17Å; L474-L514 HydrophobicContact CB-CD2 3.96Å; L474-L514 HydrophobicContact CD1-CD2 4.25Å; W477-L514 HydrophobicContact CE3-CD2 3.89Å; W477-L514 HydrophobicContact CH2-CD2 4.18Å; W477-L514 HydrophobicContact CZ3-CB 4.06Å; W477-L514 HydrophobicContact CZ3-CD2 3.67Å; W477-L514 HydrophobicContact CZ3-CG 4.45Å; S510-L514 PolarHBondContact O-N 3.2Å; V511-L514 PolarHBondContact O-N 3.35Å; M512-L514 VanDerWaalsContact C-N 3.34Å; M512-L514 PolarHBondContact O-N 3.23Å; L514-H516 VanDerWaalsContact C-N 3.34Å; L514-H516 PolarHBondContact O-N 3.26Å; L514-F517 PolarHBondContact O-N 3.25Å; L514-V518 HydrophobicContact CD1-CG2 4.23Å; L514-V518 WeakPolarHBondContact O-CG2 3.37Å; L514-V518 PolarHBondContact O-N 2.88Å
515	V	96.6	Very high	93	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-41.1	178.9	177	0	0	0	0	111.1	L474 V511 M512 G519 F542 Y543 V546 V559	L474-V515 HydrophobicContact CD1-CG2 4.49Å; L474-V515 HydrophobicContact CD2-CG2 4.41Å; V511-V515 HydrophobicContact CG1-CG2 4.49Å; V511-V515 WeakPolarHBondContact O-CG2 3.31Å; V511-V515 PolarHBondContact O-N 3.15Å; M512-V515 PolarHBondContact O-N 3.44Å; V515-G519 PolarHBondContact O-N 3.45Å; V515-F542 HydrophobicContact CG1-CE1 4.32Å; V515-F542 HydrophobicContact CG2-CZ 4.21Å; V515-Y543 HydrophobicContact CG1-CE1 4.41Å; V515-V546 HydrophobicContact CG1-CG1 3.98Å; V515-V546 HydrophobicContact CG1-CG2 4.1Å; V515-V546 HydrophobicContact CG2-CG1 4.33Å; V515-V546 HydrophobicContact CG2-CG2 3.91Å; V515-V559 HydrophobicContact CB-CG1 4.37Å; V515-V559 HydrophobicContact CG1-CB 3.88Å; V515-V559 HydrophobicContact CG1-CG1 3.56Å; V515-V559 HydrophobicContact CG1-CG2 4.49Å
516	H	95.6	Very high	93.7	Very high	83 Å²	83	25.7 Å²	25.7	38%	0.384	13%	0.127	S	C	.	.	H	α-helix	trans	-66.1	-40.6	175.1	-73.6	-46.7	0	0	0	112.6	M512 E513 L514 G519 R520	M512-H516 WeakPolarHBondContact CG-NE2 3.39Å; M512-H516 PolarHBondContact O-CD2 3.48Å; M512-H516 PolarHBondContact O-N 3.28Å; E513-H516 PolarHBondContact O-N 2.94Å; L514-H516 VanDerWaalsContact C-N 3.34Å; L514-H516 PolarHBondContact O-N 3.26Å; H516-G519 PolarHBondContact O-N 3.09Å; H516-R520 WeakPolarHBondContact O-CG 3.34Å; H516-R520 PolarHBondContact O-N 2.93Å
517	F	96.3	Very high	94.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-49.5	175.4	173.2	-108.7	0	0	0	111.7	F448 L451 M452 L470 E513 L514 G519 R520 L521	F448-F517 HydrophobicContact CB-CD2 3.68Å; F448-F517 HydrophobicContact CB-CE1 4.36Å; F448-F517 HydrophobicContact CB-CE2 3.49Å; F448-F517 VanDerWaalsContact CB-CE2 3.49Å; F448-F517 HydrophobicContact CB-CG 4.19Å; F448-F517 HydrophobicContact CB-CZ 3.84Å; F448-F517 HydrophobicContact CD1-CB 4.22Å; F448-F517 AromaticContact CD1-CD1 3.3Å; F448-F517 HydrophobicContact CD1-CD1 3.3Å; F448-F517 AromaticContact CD1-CD2 3.95Å; F448-F517 HydrophobicContact CD1-CD2 3.95Å; F448-F517 AromaticContact CD1-CE1 3.47Å; F448-F517 HydrophobicContact CD1-CE1 3.47Å; F448-F517 VanDerWaalsContact CD1-CE1 3.47Å; F448-F517 HydrophobicContact CD1-CE2 4.09Å; F448-F517 AromaticContact CD1-CG 3.54Å; F448-F517 HydrophobicContact CD1-CG 3.54Å; F448-F517 AromaticContact CD1-CZ 3.86Å; F448-F517 HydrophobicContact CD1-CZ 3.86Å; F448-F517 HydrophobicContact CD2-CB 4.12Å; F448-F517 HydrophobicContact CD2-CD2 4.13Å; F448-F517 HydrophobicContact CD2-CG 4.03Å; F448-F517 HydrophobicContact CE1-CB 4.07Å; F448-F517 AromaticContact CE1-CD1 3.49Å; F448-F517 HydrophobicContact CE1-CD1 3.49Å; F448-F517 VanDerWaalsContact CE1-CD1 3.49Å; F448-F517 HydrophobicContact CE1-CE1 4.03Å; F448-F517 AromaticContact CE1-CG 3.81Å; F448-F517 HydrophobicContact CE1-CG 3.81Å; F448-F517 HydrophobicContact CE2-CB 4.01Å; F448-F517 HydrophobicContact CE2-CG 4.3Å; F448-F517 HydrophobicContact CG-CB 4.24Å; F448-F517 AromaticContact CG-CD1 3.92Å; F448-F517 HydrophobicContact CG-CD1 3.92Å; F448-F517 AromaticContact CG-CD2 3.66Å; F448-F517 HydrophobicContact CG-CD2 3.66Å; F448-F517 HydrophobicContact CG-CE1 4.13Å; F448-F517 AromaticContact CG-CE2 3.89Å; F448-F517 HydrophobicContact CG-CE2 3.89Å; F448-F517 AromaticContact CG-CG 3.66Å; F448-F517 HydrophobicContact CG-CG 3.66Å; F448-F517 HydrophobicContact CG-CZ 4.11Å; F448-F517 HydrophobicContact CZ-CB 3.95Å; F448-F517 HydrophobicContact CZ-CD1 4.24Å; F448-F517 HydrophobicContact CZ-CG 4.18Å; F448-F517 WeakPolarHBondContact O-CZ 3.47Å; L451-F517 HydrophobicContact CB-CZ 4.3Å; M452-F517 HydrophobicContact CB-CE2 4.16Å; M452-F517 HydrophobicContact CB-CZ 4.43Å; M452-F517 HydrophobicContact CE-CD2 4.11Å; M452-F517 HydrophobicContact CE-CE2 3.67Å; L470-F517 HydrophobicContact CD1-CD1 4.35Å; L470-F517 HydrophobicContact CD1-CE1 4Å; E513-F517 VanDerWaalsContact O-CB 3.26Å; E513-F517 WeakPolarHBondContact O-CB 3.39Å; E513-F517 PolarHBondContact O-N 2.92Å; L514-F517 PolarHBondContact O-N 3.25Å; F517-G519 VanDerWaalsContact C-N 3.3Å; F517-G519 PolarHBondContact O-N 3.12Å; F517-R520 WeakPolarHBondContact O-CB 3.37Å; F517-R520 PolarHBondContact O-N 3.33Å; F517-L521 HydrophobicContact CD1-CD1 4.18Å; F517-L521 HydrophobicContact CE1-CD1 3.5Å; F517-L521 VanDerWaalsContact CE1-CD1 3.5Å; F517-L521 HydrophobicContact CE1-CG 4.22Å; F517-L521 HydrophobicContact CE2-CD1 4.24Å; F517-L521 HydrophobicContact CE2-CD2 4.29Å; F517-L521 HydrophobicContact CE2-CG 4.18Å; F517-L521 HydrophobicContact CZ-CD1 3.55Å; F517-L521 HydrophobicContact CZ-CD2 4.26Å; F517-L521 HydrophobicContact CZ-CG 3.99Å; F517-L521 PolarHBondContact O-N 3.46Å
518	V	97.3	Very high	94.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-40	175.8	176.5	0	0	0	0	110.9	I467 L470 L514 R520 L521 A522 F542	I467-V518 HydrophobicContact CD1-CG1 3.92Å; L470-V518 HydrophobicContact CB-CG2 3.88Å; L470-V518 HydrophobicContact CD1-CG2 3.7Å; L470-V518 HydrophobicContact CG-CG2 4.35Å; L514-V518 HydrophobicContact CD1-CG2 4.23Å; L514-V518 WeakPolarHBondContact O-CG2 3.37Å; L514-V518 PolarHBondContact O-N 2.88Å; V518-R520 VanDerWaalsContact C-N 3.32Å; V518-R520 PolarHBondContact O-N 2.98Å; V518-L521 PolarHBondContact O-N 3.14Å; V518-A522 WeakPolarHBondContact O-CB 3.39Å; V518-A522 PolarHBondContact O-N 3.13Å; V518-F542 HydrophobicContact CB-CD1 4.23Å; V518-F542 HydrophobicContact CB-CE1 3.63Å; V518-F542 HydrophobicContact CB-CE2 4.13Å; V518-F542 HydrophobicContact CB-CZ 3.58Å; V518-F542 HydrophobicContact CG1-CD1 3.53Å; V518-F542 HydrophobicContact CG1-CD2 4.04Å; V518-F542 HydrophobicContact CG1-CE1 3.47Å; V518-F542 VanDerWaalsContact CG1-CE1 3.47Å; V518-F542 HydrophobicContact CG1-CE2 4.01Å; V518-F542 HydrophobicContact CG1-CG 3.82Å; V518-F542 HydrophobicContact CG1-CZ 3.73Å; V518-F542 HydrophobicContact CG2-CD2 4.49Å; V518-F542 HydrophobicContact CG2-CE1 4.22Å; V518-F542 HydrophobicContact CG2-CE2 3.8Å; V518-F542 HydrophobicContact CG2-CZ 3.65Å
519	G	96.3	Very high	94.7	Very high	6 Å²	6	37.2 Å²	37.2	6%	0.062	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-38.4	175	0	0	0	0	0	113.6	V515 H516 F517 S523 Y543	V515-G519 PolarHBondContact O-N 3.45Å; H516-G519 PolarHBondContact O-N 3.09Å; F517-G519 VanDerWaalsContact C-N 3.3Å; F517-G519 PolarHBondContact O-N 3.12Å; G519-S523 WeakPolarHBondContact O-CB 3.2Å; G519-S523 PolarHBondContact O-N 2.93Å; G519-S523 PolarHBondContact O-OG 2.96Å; G519-Y543 WeakPolarHBondContact CA-OH 3.23Å
520	R	95.8	Very high	94.6	Very high	102 Å²	102	36.9 Å²	36.9	39%	0.385	20%	0.195	S	C	.	.	H	α-helix	trans	-65.4	-48	172.7	-70	-174.8	-63.5	-111	5	111.3	E513 H516 F517 V518 A522 S523 L524	E513-R520 IonicContact OE1-CZ 2.61Å; E513-R520 IonicContact OE1-NH1 2.68Å; E513-R520 PolarHBondContact OE1-NH1 3.32Å; E513-R520 IonicContact OE1-NH2 2.92Å; E513-R520 PolarHBondContact OE1-NH2 3.27Å; H516-R520 WeakPolarHBondContact O-CG 3.34Å; H516-R520 PolarHBondContact O-N 2.93Å; F517-R520 WeakPolarHBondContact O-CB 3.37Å; F517-R520 PolarHBondContact O-N 3.33Å; V518-R520 VanDerWaalsContact C-N 3.32Å; V518-R520 PolarHBondContact O-N 2.98Å; R520-A522 VanDerWaalsContact C-N 3.34Å; R520-A522 PolarHBondContact O-N 2.96Å; R520-S523 PolarHBondContact O-N 3.5Å; R520-L524 WeakPolarHBondContact O-CG 3.46Å; R520-L524 PolarHBondContact O-N 3.46Å; R520-L524 VanDerWaalsContact O-N 3.09Å
521	L	96.3	Very high	94.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-42.2	177.5	-68.9	-174.3	0	0	0	112.2	M452 F455 F456 L466 I467 L470 F517 V518 G525	M452-L521 HydrophobicContact CB-CD2 4.48Å; M452-L521 HydrophobicContact CG-CD2 4.16Å; F455-L521 HydrophobicContact CB-CD2 4.15Å; F455-L521 HydrophobicContact CD1-CB 4.49Å; F455-L521 HydrophobicContact CD1-CD2 3.85Å; F455-L521 HydrophobicContact CD2-CD1 4.23Å; F455-L521 HydrophobicContact CE1-CB 4.23Å; F455-L521 HydrophobicContact CE1-CD2 4.38Å; F455-L521 WeakPolarHBondContact CE1-O 3.47Å; F455-L521 HydrophobicContact CE2-CB 4.39Å; F455-L521 HydrophobicContact CG-CD1 4.36Å; F455-L521 HydrophobicContact CG-CD2 3.96Å; F455-L521 HydrophobicContact CZ-CB 4.17Å; F456-L521 HydrophobicContact CZ-CD2 4.41Å; L466-L521 HydrophobicContact CD2-CD1 4.45Å; I467-L521 HydrophobicContact CD1-CB 4.48Å; L470-L521 HydrophobicContact CD1-CD1 4.21Å; F517-L521 HydrophobicContact CD1-CD1 4.18Å; F517-L521 HydrophobicContact CE1-CD1 3.5Å; F517-L521 VanDerWaalsContact CE1-CD1 3.5Å; F517-L521 HydrophobicContact CE1-CG 4.22Å; F517-L521 HydrophobicContact CE2-CD1 4.24Å; F517-L521 HydrophobicContact CE2-CD2 4.29Å; F517-L521 HydrophobicContact CE2-CG 4.18Å; F517-L521 HydrophobicContact CZ-CD1 3.55Å; F517-L521 HydrophobicContact CZ-CD2 4.26Å; F517-L521 HydrophobicContact CZ-CG 3.99Å; F517-L521 PolarHBondContact O-N 3.46Å; V518-L521 PolarHBondContact O-N 3.14Å; L521-G525 WeakPolarHBondContact O-CA 3.28Å; L521-G525 PolarHBondContact O-N 3.3Å
522	A	96.5	Very high	94.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-48.2	179.5	0	0	0	0	0	111.4	V518 R520 L524 G525 L526 I539 V565	V518-A522 WeakPolarHBondContact O-CB 3.39Å; V518-A522 PolarHBondContact O-N 3.13Å; R520-A522 VanDerWaalsContact C-N 3.34Å; R520-A522 PolarHBondContact O-N 2.96Å; A522-L524 PolarHBondContact O-N 3.28Å; A522-G525 PolarHBondContact O-N 3.49Å; A522-L526 WeakPolarHBondContact O-CB 3.28Å; A522-L526 VanDerWaalsContact O-CG 3.29Å; A522-L526 WeakPolarHBondContact O-CG 3.26Å; A522-L526 PolarHBondContact O-N 2.99Å; A522-I539 HydrophobicContact CB-CB 4.47Å; A522-I539 HydrophobicContact CB-CD1 3.66Å; A522-I539 HydrophobicContact CB-CG1 3.81Å; A522-I539 HydrophobicContact CB-CG2 3.79Å; A522-V565 HydrophobicContact CB-CG2 3.49Å; A522-V565 VanDerWaalsContact CB-CG2 3.49Å
523	S	95.2	Very high	94.5	Very high	19 Å²	19	43.5 Å²	43.5	13%	0.133	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-47.2	179.3	-57.6	0	0	0	0	111.7	G519 R520 Q527 P562	G519-S523 WeakPolarHBondContact O-CB 3.2Å; G519-S523 PolarHBondContact O-N 2.93Å; G519-S523 PolarHBondContact O-OG 2.96Å; R520-S523 PolarHBondContact O-N 3.5Å; S523-Q527 VanDerWaalsContact O-CG 3.3Å; S523-Q527 WeakPolarHBondContact O-CG 3.47Å; S523-Q527 PolarHBondContact O-N 2.96Å; S523-P562 WeakPolarHBondContact OG-CG 3.42Å
524	L	94.5	Very high	94.6	Very high	75 Å²	75	44 Å²	44	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-73.7	-37.5	-180	-65.7	170.1	0	0	0	111.8	F456 R520 A522 Q527 L528	F456-L524 HydrophobicContact CE1-CB 3.7Å; F456-L524 HydrophobicContact CE1-CD1 4.19Å; F456-L524 HydrophobicContact CZ-CB 3.92Å; F456-L524 HydrophobicContact CZ-CD1 3.56Å; F456-L524 HydrophobicContact CZ-CG 4.38Å; R520-L524 WeakPolarHBondContact O-CG 3.46Å; R520-L524 PolarHBondContact O-N 3.46Å; R520-L524 VanDerWaalsContact O-N 3.09Å; A522-L524 PolarHBondContact O-N 3.28Å; L524-Q527 PolarHBondContact O-N 2.69Å; L524-L528 WeakPolarHBondContact O-CB 3.39Å; L524-L528 WeakPolarHBondContact O-CG 3.36Å; L524-L528 PolarHBondContact O-N 2.9Å
525	G	94.6	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-45	177.9	0	0	0	0	0	112.4	L521 A522 Q527 L528 E529	L521-G525 WeakPolarHBondContact O-CA 3.28Å; L521-G525 PolarHBondContact O-N 3.3Å; A522-G525 PolarHBondContact O-N 3.49Å; G525-Q527 VanDerWaalsContact C-N 3.34Å; G525-L528 PolarHBondContact O-N 3.12Å; G525-E529 WeakPolarHBondContact O-CB 3.39Å; G525-E529 WeakPolarHBondContact O-CG 3.46Å; G525-E529 PolarHBondContact O-N 3.46Å
526	L	94.8	Very high	94.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-39.7	174.8	-72.4	169.9	0	0	0	111.6	A522 G530 C531 L535 L536 I539 V565 P568	A522-L526 WeakPolarHBondContact O-CB 3.28Å; A522-L526 VanDerWaalsContact O-CG 3.29Å; A522-L526 WeakPolarHBondContact O-CG 3.26Å; A522-L526 PolarHBondContact O-N 2.99Å; L526-G530 PolarHBondContact O-N 3.41Å; L526-C531 WeakPolarHBondContact O-CA 3.13Å; L526-C531 PolarHBondContact O-N 3.26Å; L526-L535 HydrophobicContact CD2-CD2 4.35Å; L526-L535 HydrophobicContact CD2-CG 4.28Å; L526-L536 HydrophobicContact CD1-CD1 4.11Å; L526-L536 HydrophobicContact CD2-CB 3.97Å; L526-L536 HydrophobicContact CD2-CD1 4.37Å; L526-I539 HydrophobicContact CD1-CD1 3.77Å; L526-I539 HydrophobicContact CD2-CD1 3.98Å; L526-I539 HydrophobicContact CG-CD1 3.64Å; L526-V565 HydrophobicContact CD1-CG2 4.32Å; L526-P568 HydrophobicContact CD1-CB 4.14Å; L526-P568 HydrophobicContact CD1-CG 4.46Å
527	Q	93	Very high	94.6	Very high	138 Å²	138	42 Å²	42	65%	0.645	24%	0.236	S	C	*	.	H	α-helix	trans	-63.2	-44.8	175.7	-75	176.8	-12.3	0	0	112.3	S523 L524 G525 G530	S523-Q527 VanDerWaalsContact O-CG 3.3Å; S523-Q527 WeakPolarHBondContact O-CG 3.47Å; S523-Q527 PolarHBondContact O-N 2.96Å; L524-Q527 PolarHBondContact O-N 2.69Å; G525-Q527 VanDerWaalsContact C-N 3.34Å; Q527-G530 PolarHBondContact O-N 3.28Å
528	L	92.7	Very high	94.7	Very high	107 Å²	107	44.1 Å²	44.1	56%	0.56	25%	0.246	S	C	*	.	H	α-helix	trans	-68.2	-35.7	-178.3	-70.9	169.6	0	0	0	113.1	F456 L524 G525	F456-L528 HydrophobicContact CD1-CD1 3.43Å; F456-L528 VanDerWaalsContact CD1-CD1 3.43Å; F456-L528 HydrophobicContact CE1-CD1 3.72Å; L524-L528 WeakPolarHBondContact O-CB 3.39Å; L524-L528 WeakPolarHBondContact O-CG 3.36Å; L524-L528 PolarHBondContact O-N 2.9Å; G525-L528 PolarHBondContact O-N 3.12Å
529	E	92.6	Very high	94.7	Very high	60 Å²	60	44.1 Å²	44.1	28%	0.28	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	10.3	-177.1	-60.9	-66.8	164.6	0	0	113	L460 K463 G525 C531 H532 L535	L460-E529 HydrophobicContact CD1-CB 4.11Å; L460-E529 HydrophobicContact CD1-CG 3.79Å; K463-E529 HydrophobicContact CD-CG 4.22Å; K463-E529 IonicContact NZ-OE1 3.5Å; K463-E529 PolarHBondContact NZ-OE1 2.93Å; G525-E529 WeakPolarHBondContact O-CB 3.39Å; G525-E529 WeakPolarHBondContact O-CG 3.46Å; G525-E529 PolarHBondContact O-N 3.46Å; E529-C531 PolarHBondContact O-N 2.92Å; E529-H532 HydrophobicContact CB-CB 4.23Å; E529-L535 HydrophobicContact CB-CD2 4.45Å; E529-L535 HydrophobicContact CG-CD2 4.21Å
530	G	89.4	Confident	94.7	Very high	66 Å²	66	44 Å²	44	68%	0.68	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	37.5	178.4	0	0	0	0	0	114.2	L526 Q527 H532	L526-G530 PolarHBondContact O-N 3.41Å; Q527-G530 PolarHBondContact O-N 3.28Å; G530-H532 VanDerWaalsContact C-N 3.35Å; G530-H532 PolarHBondContact O-N 3.46Å
531	C	89.7	Confident	94.8	Very high	61 Å²	61	41.6 Å²	41.6	41%	0.412	24%	0.239	S	C	.	.	S	Bend	trans	57.8	40.6	-178.7	-60.3	0	0	0	0	113.8	L526 E529 S533	L526-C531 WeakPolarHBondContact O-CA 3.13Å; L526-C531 PolarHBondContact O-N 3.26Å; E529-C531 PolarHBondContact O-N 2.92Å; C531-S533 PolarHBondContact O-N 3.14Å
532	H	93.8	Very high	94.9	Very high	82 Å²	82	41.6 Å²	41.6	38%	0.38	24%	0.238	S	C	.	.			trans	-56.9	124	-179.9	-167.6	-69	0	0	0	113.1	L460 E529 G530 L534 L535 L536	L460-H532 HydrophobicContact CD1-CB 4.23Å; E529-H532 HydrophobicContact CB-CB 4.23Å; G530-H532 VanDerWaalsContact C-N 3.35Å; G530-H532 PolarHBondContact O-N 3.46Å; H532-L534 VanDerWaalsContact C-N 3.31Å; H532-L534 VanDerWaalsContact CE1-CB 3.46Å; H532-L534 WeakPolarHBondContact CE1-CB 3.36Å; H532-L534 WeakPolarHBondContact ND1-CB 3.19Å; H532-L534 PolarHBondContact ND1-N 2.97Å; H532-L534 VanDerWaalsContact ND1-N 3.14Å; H532-L534 PolarHBondContact O-N 3.09Å; H532-L535 PolarHBondContact O-N 2.73Å; H532-L535 VanDerWaalsContact O-N 3.13Å; H532-L536 PolarHBondContact O-N 3.04Å; H532-L536 VanDerWaalsContact O-N 3.14Å
533	S	92.8	Very high	94.9	Very high	54 Å²	54	41.7 Å²	41.7	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-56.4	-36.5	-175.1	-59.9	0	0	0	0	114.4	C531 L536 S537 D574	C531-S533 PolarHBondContact O-N 3.14Å; S533-L536 WeakPolarHBondContact O-CB 3.36Å; S533-L536 PolarHBondContact O-N 3.24Å; S533-S537 PolarHBondContact O-N 2.63Å; S533-D574 WeakPolarHBondContact CB-OD1 3.44Å; S533-D574 PolarHBondContact OG-OD1 3.11Å
534	L	95.6	Very high	95	Very high	66 Å²	66	43.2 Å²	43.2	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-58.4	-51.5	176	-174.7	67.1	0	0	0	112.1	L460 F461 H532 L536 S537 F538	L460-L534 HydrophobicContact CD2-CD2 4.44Å; F461-L534 HydrophobicContact CD1-CD2 4.49Å; F461-L534 HydrophobicContact CE1-CD2 4.23Å; H532-L534 VanDerWaalsContact C-N 3.31Å; H532-L534 VanDerWaalsContact CE1-CB 3.46Å; H532-L534 WeakPolarHBondContact CE1-CB 3.36Å; H532-L534 WeakPolarHBondContact ND1-CB 3.19Å; H532-L534 PolarHBondContact ND1-N 2.97Å; H532-L534 VanDerWaalsContact ND1-N 3.14Å; H532-L534 PolarHBondContact O-N 3.09Å; L534-L536 VanDerWaalsContact C-N 3.29Å; L534-L536 PolarHBondContact O-N 3.44Å; L534-S537 WeakPolarHBondContact O-CB 3.45Å; L534-S537 PolarHBondContact O-N 3.3Å; L534-F538 HydrophobicContact CD1-CD2 4.43Å; L534-F538 HydrophobicContact CD1-CE2 3.91Å; L534-F538 HydrophobicContact CG-CD2 4.41Å; L534-F538 HydrophobicContact CG-CE2 4.18Å; L534-F538 WeakPolarHBondContact O-CD2 3.49Å; L534-F538 PolarHBondContact O-N 3.44Å
535	L	96.3	Very high	95	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-39.5	179.7	176.2	61	0	0	0	110.9	L460 K463 I467 L526 E529 H532 S537 F538 I539	L460-L535 HydrophobicContact CD1-CB 3.81Å; L460-L535 HydrophobicContact CD1-CD2 4.29Å; K463-L535 HydrophobicContact CB-CD1 4.2Å; I467-L535 HydrophobicContact CG1-CD1 4.36Å; L526-L535 HydrophobicContact CD2-CD2 4.35Å; L526-L535 HydrophobicContact CD2-CG 4.28Å; E529-L535 HydrophobicContact CB-CD2 4.45Å; E529-L535 HydrophobicContact CG-CD2 4.21Å; H532-L535 PolarHBondContact O-N 2.73Å; H532-L535 VanDerWaalsContact O-N 3.13Å; L535-S537 VanDerWaalsContact C-N 3.31Å; L535-S537 PolarHBondContact O-N 3.48Å; L535-F538 PolarHBondContact O-N 2.95Å; L535-I539 HydrophobicContact CD1-CD1 4.07Å; L535-I539 HydrophobicContact CD1-CG1 4.37Å; L535-I539 HydrophobicContact CD2-CD1 4.45Å; L535-I539 HydrophobicContact CG-CD1 3.75Å; L535-I539 HydrophobicContact CG-CG1 4.5Å; L535-I539 WeakPolarHBondContact O-CD1 3.36Å; L535-I539 VanDerWaalsContact O-CG1 3.27Å; L535-I539 WeakPolarHBondContact O-CG1 3.48Å; L535-I539 PolarHBondContact O-N 3.16Å
536	L	96.4	Very high	95.1	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-43.1	174.2	-179.2	60.9	0	0	0	111.8	L526 H532 S533 L534 F538 I539 L540 A569 A572 S577	L526-L536 HydrophobicContact CD1-CD1 4.11Å; L526-L536 HydrophobicContact CD2-CB 3.97Å; L526-L536 HydrophobicContact CD2-CD1 4.37Å; H532-L536 PolarHBondContact O-N 3.04Å; H532-L536 VanDerWaalsContact O-N 3.14Å; S533-L536 WeakPolarHBondContact O-CB 3.36Å; S533-L536 PolarHBondContact O-N 3.24Å; L534-L536 VanDerWaalsContact C-N 3.29Å; L534-L536 PolarHBondContact O-N 3.44Å; L536-F538 PolarHBondContact O-N 3.13Å; L536-I539 WeakPolarHBondContact O-CB 3.31Å; L536-I539 PolarHBondContact O-N 3.06Å; L536-L540 HydrophobicContact CD1-CD1 4.35Å; L536-L540 HydrophobicContact CD1-CG 4.24Å; L536-L540 HydrophobicContact CG-CD1 4.1Å; L536-L540 HydrophobicContact CG-CG 4.41Å; L536-L540 VanDerWaalsContact O-CG 3.31Å; L536-L540 WeakPolarHBondContact O-CG 3.15Å; L536-L540 PolarHBondContact O-N 3.48Å; L536-A569 HydrophobicContact CD1-CB 4.01Å; L536-A572 HydrophobicContact CD2-CB 3.88Å; L536-S577 WeakPolarHBondContact CD2-OG 3.49Å
537	S	96.9	Very high	95	Very high	41 Å²	41	40.7 Å²	40.7	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-57.5	-48.6	176.3	-174	0	0	0	0	112.4	S533 L534 L535 I539 L540 D541 R580	S533-S537 PolarHBondContact O-N 2.63Å; L534-S537 WeakPolarHBondContact O-CB 3.45Å; L534-S537 PolarHBondContact O-N 3.3Å; L535-S537 VanDerWaalsContact C-N 3.31Å; L535-S537 PolarHBondContact O-N 3.48Å; S537-I539 VanDerWaalsContact C-N 3.3Å; S537-I539 PolarHBondContact O-N 2.76Å; S537-L540 PolarHBondContact O-N 3.19Å; S537-D541 VanDerWaalsContact O-CG 3.28Å; S537-D541 PolarHBondContact O-N 2.97Å; S537-R580 PolarHBondContact O-NH1 2.86Å; S537-R580 PolarHBondContact OG-NH1 3.1Å; S537-R580 VanDerWaalsContact OG-NH1 3.11Å
538	F	97.5	Very high	94.9	Very high	46 Å²	46	35.1 Å²	35.1	20%	0.202	21%	0.206	C	C	.	.	H	α-helix	trans	-64.3	-34.7	177.5	-78.7	-86.6	0	0	0	112.6	C464 I467 E468 L534 L535 L536 D541 F542	C464-F538 HydrophobicContact CB-CD1 4.47Å; C464-F538 HydrophobicContact CB-CD2 3.58Å; C464-F538 HydrophobicContact CB-CE2 3.77Å; C464-F538 HydrophobicContact CB-CG 3.97Å; C464-F538 HydrophobicContact CB-CZ 4.28Å; I467-F538 HydrophobicContact CB-CB 4.43Å; I467-F538 HydrophobicContact CG2-CB 4.15Å; I467-F538 WeakPolarHBondContact CG2-O 3.41Å; E468-F538 HydrophobicContact CB-CD1 3.89Å; E468-F538 HydrophobicContact CB-CE1 4.01Å; E468-F538 HydrophobicContact CG-CD1 4.49Å; E468-F538 HydrophobicContact CG-CE1 4.29Å; L534-F538 HydrophobicContact CD1-CD2 4.43Å; L534-F538 HydrophobicContact CD1-CE2 3.91Å; L534-F538 HydrophobicContact CG-CD2 4.41Å; L534-F538 HydrophobicContact CG-CE2 4.18Å; L534-F538 WeakPolarHBondContact O-CD2 3.49Å; L534-F538 PolarHBondContact O-N 3.44Å; L535-F538 PolarHBondContact O-N 2.95Å; L536-F538 PolarHBondContact O-N 3.13Å; F538-D541 PolarHBondContact O-N 3.45Å; F538-F542 PolarHBondContact O-N 3.28Å
539	I	97.9	Very high	94.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.5	-39.8	174.9	-69.4	163.1	0	0	0	110.8	I467 A522 L526 L535 L536 S537 D541 F542 Y543 V565	I467-I539 HydrophobicContact CG1-CG1 4.46Å; I467-I539 HydrophobicContact CG2-CG1 4.32Å; A522-I539 HydrophobicContact CB-CB 4.47Å; A522-I539 HydrophobicContact CB-CD1 3.66Å; A522-I539 HydrophobicContact CB-CG1 3.81Å; A522-I539 HydrophobicContact CB-CG2 3.79Å; L526-I539 HydrophobicContact CD1-CD1 3.77Å; L526-I539 HydrophobicContact CD2-CD1 3.98Å; L526-I539 HydrophobicContact CG-CD1 3.64Å; L535-I539 HydrophobicContact CD1-CD1 4.07Å; L535-I539 HydrophobicContact CD1-CG1 4.37Å; L535-I539 HydrophobicContact CD2-CD1 4.45Å; L535-I539 HydrophobicContact CG-CD1 3.75Å; L535-I539 HydrophobicContact CG-CG1 4.5Å; L535-I539 WeakPolarHBondContact O-CD1 3.36Å; L535-I539 VanDerWaalsContact O-CG1 3.27Å; L535-I539 WeakPolarHBondContact O-CG1 3.48Å; L535-I539 PolarHBondContact O-N 3.16Å; L536-I539 WeakPolarHBondContact O-CB 3.31Å; L536-I539 PolarHBondContact O-N 3.06Å; S537-I539 VanDerWaalsContact C-N 3.3Å; S537-I539 PolarHBondContact O-N 2.76Å; I539-D541 VanDerWaalsContact C-N 3.35Å; I539-F542 WeakPolarHBondContact O-CB 3.14Å; I539-F542 PolarHBondContact O-N 3.21Å; I539-Y543 HydrophobicContact CG2-CD2 3.91Å; I539-Y543 HydrophobicContact CG2-CE2 3.91Å; I539-Y543 VanDerWaalsContact O-CD2 3.31Å; I539-Y543 WeakPolarHBondContact O-CD2 3.44Å; I539-Y543 PolarHBondContact O-N 3.47Å; I539-Y543 VanDerWaalsContact O-N 3.1Å; I539-V565 HydrophobicContact CG2-CB 4.37Å; I539-V565 HydrophobicContact CG2-CG1 3.5Å; I539-V565 VanDerWaalsContact CG2-CG1 3.5Å; I539-V565 HydrophobicContact CG2-CG2 3.89Å
540	L	97.3	Very high	94.5	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-67.4	-36.1	175.8	-67.1	173.9	0	0	0	111.3	L536 S537 F542 Y543 E544 A569 R580 I584	L536-L540 HydrophobicContact CD1-CD1 4.35Å; L536-L540 HydrophobicContact CD1-CG 4.24Å; L536-L540 HydrophobicContact CG-CD1 4.1Å; L536-L540 HydrophobicContact CG-CG 4.41Å; L536-L540 VanDerWaalsContact O-CG 3.31Å; L536-L540 WeakPolarHBondContact O-CG 3.15Å; L536-L540 PolarHBondContact O-N 3.48Å; S537-L540 PolarHBondContact O-N 3.19Å; L540-F542 PolarHBondContact O-N 3.2Å; L540-Y543 PolarHBondContact O-N 3.08Å; L540-Y543 VanDerWaalsContact O-N 3.11Å; L540-E544 WeakPolarHBondContact O-CG 3.41Å; L540-E544 PolarHBondContact O-N 3.33Å; L540-A569 HydrophobicContact CD2-CB 4.07Å; L540-R580 HydrophobicContact CD1-CB 4.1Å; L540-I584 HydrophobicContact CB-CD1 4.4Å; L540-I584 HydrophobicContact CD2-CD1 3.79Å
541	D	97.4	Very high	94.4	Very high	53 Å²	53	28.4 Å²	28.4	28%	0.283	16%	0.156	S	C	.	.	H	α-helix	trans	-58.3	-40	173.1	-62.3	-31.3	0	0	0	110.6	N471 S537 F538 I539 T545 R580	N471-D541 PolarHBondContact ND2-O 2.9Å; S537-D541 VanDerWaalsContact O-CG 3.28Å; S537-D541 PolarHBondContact O-N 2.97Å; F538-D541 PolarHBondContact O-N 3.45Å; I539-D541 VanDerWaalsContact C-N 3.35Å; D541-T545 PolarHBondContact O-N 2.93Å; D541-T545 PolarHBondContact O-OG1 3.47Å; D541-R580 IonicContact OD1-CZ 2.83Å; D541-R580 IonicContact OD1-NH1 3.41Å; D541-R580 PolarHBondContact OD1-NH1 3.02Å; D541-R580 IonicContact OD1-NH2 2.85Å; D541-R580 PolarHBondContact OD1-NH2 3.18Å
542	F	97.9	Very high	94.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-47	175.1	-179.4	-95.8	0	0	0	111.8	I467 N471 L474 V515 V518 F538 I539 L540 E544 T545 V546	I467-F542 HydrophobicContact CG2-CB 4.3Å; N471-F542 HydrophobicContact CB-CB 4.39Å; N471-F542 HydrophobicContact CB-CD2 3.84Å; L474-F542 HydrophobicContact CB-CE2 4.21Å; L474-F542 HydrophobicContact CD2-CD2 4.32Å; L474-F542 HydrophobicContact CD2-CE2 3.63Å; L474-F542 HydrophobicContact CD2-CZ 3.79Å; V515-F542 HydrophobicContact CG1-CE1 4.32Å; V515-F542 HydrophobicContact CG2-CZ 4.21Å; V518-F542 HydrophobicContact CB-CD1 4.23Å; V518-F542 HydrophobicContact CB-CE1 3.63Å; V518-F542 HydrophobicContact CB-CE2 4.13Å; V518-F542 HydrophobicContact CB-CZ 3.58Å; V518-F542 HydrophobicContact CG1-CD1 3.53Å; V518-F542 HydrophobicContact CG1-CD2 4.04Å; V518-F542 HydrophobicContact CG1-CE1 3.47Å; V518-F542 VanDerWaalsContact CG1-CE1 3.47Å; V518-F542 HydrophobicContact CG1-CE2 4.01Å; V518-F542 HydrophobicContact CG1-CG 3.82Å; V518-F542 HydrophobicContact CG1-CZ 3.73Å; V518-F542 HydrophobicContact CG2-CD2 4.49Å; V518-F542 HydrophobicContact CG2-CE1 4.22Å; V518-F542 HydrophobicContact CG2-CE2 3.8Å; V518-F542 HydrophobicContact CG2-CZ 3.65Å; F538-F542 PolarHBondContact O-N 3.28Å; I539-F542 WeakPolarHBondContact O-CB 3.14Å; I539-F542 PolarHBondContact O-N 3.21Å; L540-F542 PolarHBondContact O-N 3.2Å; F542-E544 VanDerWaalsContact C-N 3.33Å; F542-E544 PolarHBondContact O-N 3.29Å; F542-T545 WeakPolarHBondContact O-CB 3.26Å; F542-T545 PolarHBondContact O-N 3.26Å; F542-T545 VanDerWaalsContact O-N 3.15Å; F542-V546 HydrophobicContact CD1-CG2 3.79Å; F542-V546 HydrophobicContact CE1-CG2 3.43Å; F542-V546 VanDerWaalsContact CE1-CG2 3.43Å; F542-V546 HydrophobicContact CZ-CG2 3.86Å; F542-V546 WeakPolarHBondContact O-CG2 3.35Å; F542-V546 PolarHBondContact O-N 2.78Å
543	Y	97.3	Very high	94	Very high	3 Å²	3	28.2 Å²	28.2	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-73.8	-20.4	-178.6	-79.1	-69.1	0	0	0	114.6	V515 G519 I539 L540 V546 C547 P561 P562 V565	V515-Y543 HydrophobicContact CG1-CE1 4.41Å; G519-Y543 WeakPolarHBondContact CA-OH 3.23Å; I539-Y543 HydrophobicContact CG2-CD2 3.91Å; I539-Y543 HydrophobicContact CG2-CE2 3.91Å; I539-Y543 VanDerWaalsContact O-CD2 3.31Å; I539-Y543 WeakPolarHBondContact O-CD2 3.44Å; I539-Y543 PolarHBondContact O-N 3.47Å; I539-Y543 VanDerWaalsContact O-N 3.1Å; L540-Y543 PolarHBondContact O-N 3.08Å; L540-Y543 VanDerWaalsContact O-N 3.11Å; Y543-V546 HydrophobicContact CD1-CB 4.1Å; Y543-V546 HydrophobicContact CD1-CG1 4.32Å; Y543-V546 HydrophobicContact CD1-CG2 4.22Å; Y543-V546 PolarHBondContact O-N 3.05Å; Y543-C547 WeakPolarHBondContact O-CB 3.43Å; Y543-C547 PolarHBondContact O-N 3.09Å; Y543-P561 HydrophobicContact CD1-CB 3.94Å; Y543-P561 HydrophobicContact CD2-CB 4.33Å; Y543-P561 HydrophobicContact CE1-CB 3.92Å; Y543-P561 HydrophobicContact CE2-CB 4.31Å; Y543-P561 HydrophobicContact CG-CB 4.17Å; Y543-P562 WeakPolarHBondContact OH-CD 3.28Å; Y543-V565 HydrophobicContact CD2-CG1 3.98Å; Y543-V565 HydrophobicContact CE2-CB 4.32Å; Y543-V565 HydrophobicContact CE2-CG1 3.89Å; Y543-V565 HydrophobicContact CE2-CG2 4.16Å
544	E	95.9	Very high	93.6	Very high	50 Å²	50	28.1 Å²	28.1	23%	0.234	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-40	165.9	-76.9	172.1	-163.9	0	0	111.5	L540 F542 C547 R580 F583 I584	L540-E544 WeakPolarHBondContact O-CG 3.41Å; L540-E544 PolarHBondContact O-N 3.33Å; F542-E544 VanDerWaalsContact C-N 3.33Å; F542-E544 PolarHBondContact O-N 3.29Å; E544-C547 PolarHBondContact O-SG 3.21Å; E544-R580 IonicContact OE1-CZ 3.78Å; E544-R580 VanDerWaalsContact OE1-CZ 3.26Å; E544-R580 IonicContact OE1-NE 2.97Å; E544-R580 PolarHBondContact OE1-NE 3Å; E544-R580 IonicContact OE1-NH2 2.59Å; E544-R580 PolarHBondContact OE1-NH2 3.36Å; E544-R580 IonicContact OE2-NH2 3.14Å; E544-R580 PolarHBondContact OE2-NH2 3.41Å; E544-R580 VanDerWaalsContact OE2-NH2 3.1Å; E544-F583 HydrophobicContact CG-CD1 4.11Å; E544-F583 HydrophobicContact CG-CE1 4.18Å; E544-I584 HydrophobicContact CG-CD1 4.01Å; E544-I584 HydrophobicContact CG-CG1 3.69Å
545	T	95.8	Very high	93.1	Very high	20 Å²	20	25 Å²	25	12%	0.123	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-44.9	171.2	-53.4	0	0	0	0	111.5	N471 L474 L475 L478 D541 F542 C547 D548	N471-T545 WeakPolarHBondContact OD1-CB 3.37Å; N471-T545 PolarHBondContact OD1-OG1 2.92Å; L474-T545 HydrophobicContact CD2-CG2 4.04Å; L474-T545 HydrophobicContact CG-CG2 4.22Å; L475-T545 HydrophobicContact CB-CG2 4.3Å; L475-T545 HydrophobicContact CD1-CG2 4.24Å; L478-T545 HydrophobicContact CD1-CG2 4.22Å; D541-T545 PolarHBondContact O-N 2.93Å; D541-T545 PolarHBondContact O-OG1 3.47Å; F542-T545 WeakPolarHBondContact O-CB 3.26Å; F542-T545 PolarHBondContact O-N 3.26Å; F542-T545 VanDerWaalsContact O-N 3.15Å; T545-C547 VanDerWaalsContact C-N 3.31Å; T545-C547 PolarHBondContact O-N 3.4Å; T545-D548 PolarHBondContact O-N 2.86Å; T545-D548 VanDerWaalsContact O-N 3.13Å
546	V	95.6	Very high	92.6	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.018	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-40.7	-179.5	175.8	0	0	0	0	111.2	L474 V515 F542 Y543 D548 T549 V559 Y588	L474-V546 HydrophobicContact CD2-CG2 3.61Å; V515-V546 HydrophobicContact CG1-CG1 3.98Å; V515-V546 HydrophobicContact CG1-CG2 4.1Å; V515-V546 HydrophobicContact CG2-CG1 4.33Å; V515-V546 HydrophobicContact CG2-CG2 3.91Å; F542-V546 HydrophobicContact CD1-CG2 3.79Å; F542-V546 HydrophobicContact CE1-CG2 3.43Å; F542-V546 VanDerWaalsContact CE1-CG2 3.43Å; F542-V546 HydrophobicContact CZ-CG2 3.86Å; F542-V546 WeakPolarHBondContact O-CG2 3.35Å; F542-V546 PolarHBondContact O-N 2.78Å; Y543-V546 HydrophobicContact CD1-CB 4.1Å; Y543-V546 HydrophobicContact CD1-CG1 4.32Å; Y543-V546 HydrophobicContact CD1-CG2 4.22Å; Y543-V546 PolarHBondContact O-N 3.05Å; V546-D548 PolarHBondContact O-N 3.12Å; V546-T549 VanDerWaalsContact O-CB 3.27Å; V546-T549 WeakPolarHBondContact O-CB 3.44Å; V546-T549 PolarHBondContact O-N 2.9Å; V546-T549 PolarHBondContact O-OG1 3.02Å; V546-V559 HydrophobicContact CG1-CB 4.49Å; V546-Y588 WeakPolarHBondContact CG1-OH 3.34Å
547	C	93.2	Very high	92.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-27.8	-179.8	80.7	0	0	0	0	111.4	Y543 E544 T545 T549 I584 R587 Y588 N591	Y543-C547 WeakPolarHBondContact O-CB 3.43Å; Y543-C547 PolarHBondContact O-N 3.09Å; E544-C547 PolarHBondContact O-SG 3.21Å; T545-C547 VanDerWaalsContact C-N 3.31Å; T545-C547 PolarHBondContact O-N 3.4Å; C547-T549 VanDerWaalsContact C-N 3.29Å; C547-T549 PolarHBondContact O-N 2.79Å; C547-I584 HydrophobicContact CB-CG2 4.41Å; C547-R587 HydrophobicContact CB-CB 4.19Å; C547-R587 VanDerWaalsContact SG-CB 3.54Å; C547-Y588 HydrophobicContact CB-CD1 4.13Å; C547-Y588 HydrophobicContact CB-CD2 4.23Å; C547-Y588 HydrophobicContact CB-CE1 3.75Å; C547-Y588 HydrophobicContact CB-CE2 3.87Å; C547-Y588 HydrophobicContact CB-CG 4.33Å; C547-N591 PolarHBondContact O-ND2 3.42Å
548	D	90	Very high	91.8	Very high	21 Å²	21	24.3 Å²	24.3	11%	0.112	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-8.4	177.8	-87.2	-8.5	0	0	0	115	T545 V546 F550 K552 F553 R587	T545-D548 PolarHBondContact O-N 2.86Å; T545-D548 VanDerWaalsContact O-N 3.13Å; V546-D548 PolarHBondContact O-N 3.12Å; D548-F550 VanDerWaalsContact C-N 3.3Å; D548-F550 PolarHBondContact O-N 3.47Å; D548-F550 VanDerWaalsContact O-N 3.14Å; D548-K552 HydrophobicContact CB-CB 3.98Å; D548-K552 HydrophobicContact CB-CD 3.75Å; D548-K552 VanDerWaalsContact O-CB 3.27Å; D548-K552 WeakPolarHBondContact O-CB 3.37Å; D548-K552 PolarHBondContact O-N 2.78Å; D548-K552 VanDerWaalsContact O-N 3.12Å; D548-K552 WeakPolarHBondContact OD2-CD 3.33Å; D548-K552 IonicContact OD2-NZ 2.74Å; D548-K552 PolarHBondContact OD2-NZ 2.61Å; D548-F553 HydrophobicContact CB-CD2 4.24Å; D548-F553 HydrophobicContact CB-CE2 3.91Å; D548-R587 IonicContact OD1-CZ 3.72Å; D548-R587 IonicContact OD1-NE 3.3Å; D548-R587 PolarHBondContact OD1-NE 3.31Å; D548-R587 IonicContact OD1-NH2 3.52Å; D548-R587 PolarHBondContact OD1-NH2 3.31Å
549	T	90.3	Very high	91.5	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-43.3	-174.1	-57.3	0	0	0	0	114.2	L478 V546 C547 L555 L557	L478-T549 HydrophobicContact CD2-CG2 3.86Å; V546-T549 VanDerWaalsContact O-CB 3.27Å; V546-T549 WeakPolarHBondContact O-CB 3.44Å; V546-T549 PolarHBondContact O-N 2.9Å; V546-T549 PolarHBondContact O-OG1 3.02Å; C547-T549 VanDerWaalsContact C-N 3.29Å; C547-T549 PolarHBondContact O-N 2.79Å; T549-L555 HydrophobicContact CG2-CB 3.86Å; T549-L555 HydrophobicContact CG2-CD2 3.73Å; T549-L555 HydrophobicContact CG2-CG 4.21Å; T549-L555 PolarHBondContact O-N 2.94Å; T549-L557 HydrophobicContact CG2-CB 4.08Å
550	F	88.3	Confident	91.3	Very high	18 Å²	18	23.4 Å²	23.4	8%	0.079	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-63.2	-173.3	-173.1	-101.5	0	0	0	113.7	D548 G554 L555 P556 V558 N591 A595 Q598 I608	D548-F550 VanDerWaalsContact C-N 3.3Å; D548-F550 PolarHBondContact O-N 3.47Å; D548-F550 VanDerWaalsContact O-N 3.14Å; F550-G554 VanDerWaalsContact O-CA 3.29Å; F550-G554 WeakPolarHBondContact O-CA 3.32Å; F550-G554 PolarHBondContact O-N 2.95Å; F550-L555 WeakPolarHBondContact CA-O 3.36Å; F550-P556 HydrophobicContact CE2-CB 4.37Å; F550-V558 HydrophobicContact CB-CG2 3.92Å; F550-V558 HydrophobicContact CD2-CG2 4.34Å; F550-V558 HydrophobicContact CG-CG2 4.23Å; F550-N591 HydrophobicContact CB-CB 4.25Å; F550-N591 HydrophobicContact CD1-CB 4.27Å; F550-A595 HydrophobicContact CD1-CB 4.49Å; F550-A595 HydrophobicContact CE1-CB 3.73Å; F550-A595 HydrophobicContact CE2-CB 4.18Å; F550-A595 HydrophobicContact CZ-CB 3.55Å; F550-Q598 VanDerWaalsContact CZ-OE1 3.24Å; F550-I608 HydrophobicContact CD2-CD1 4.44Å; F550-I608 HydrophobicContact CE2-CD1 4.28Å
551	L	86.9	Confident	91.2	Very high	69 Å²	69	23.6 Å²	23.6	36%	0.361	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-37.8	-173.1	-75.1	-178.2	0	0	0	113.7	V590 N591	L551-V590 HydrophobicContact CD1-CG1 3.74Å; L551-N591 WeakPolarHBondContact CB-OD1 3.43Å; L551-N591 WeakPolarHBondContact CD1-OD1 3.18Å; L551-N591 WeakPolarHBondContact CG-OD1 3.37Å
552	K	88.4	Confident	91	Very high	127 Å²	127	22.5 Å²	22.5	55%	0.552	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-42.7	-173.4	-174.4	-178.4	-177.3	-179.6	0	111.9	D548	D548-K552 HydrophobicContact CB-CB 3.98Å; D548-K552 HydrophobicContact CB-CD 3.75Å; D548-K552 VanDerWaalsContact O-CB 3.27Å; D548-K552 WeakPolarHBondContact O-CB 3.37Å; D548-K552 PolarHBondContact O-N 2.78Å; D548-K552 VanDerWaalsContact O-N 3.12Å; D548-K552 WeakPolarHBondContact OD2-CD 3.33Å; D548-K552 IonicContact OD2-NZ 2.74Å; D548-K552 PolarHBondContact OD2-NZ 2.61Å
553	F	87.2	Confident	90.7	Very high	12 Å²	12	25.2 Å²	25.2	5%	0.053	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-1.5	-175.9	-59.7	-75	0	0	0	113.7	L475 L478 H481 D548 L555	L475-F553 HydrophobicContact CD1-CE1 4.23Å; L475-F553 HydrophobicContact CD1-CZ 3.62Å; L478-F553 HydrophobicContact CB-CB 4.03Å; L478-F553 HydrophobicContact CB-CD1 3.72Å; L478-F553 HydrophobicContact CB-CD2 3.9Å; L478-F553 HydrophobicContact CB-CE1 4.07Å; L478-F553 HydrophobicContact CB-CE2 4.22Å; L478-F553 HydrophobicContact CB-CG 3.62Å; L478-F553 HydrophobicContact CB-CZ 4.3Å; L478-F553 HydrophobicContact CD1-CD2 3.77Å; L478-F553 HydrophobicContact CD1-CE2 3.95Å; L478-F553 HydrophobicContact CD1-CG 4.33Å; L478-F553 HydrophobicContact CD2-CB 4.46Å; L478-F553 HydrophobicContact CG-CD2 4.36Å; L478-F553 HydrophobicContact CG-CG 4.44Å; H481-F553 PolarHBondContact ND1-O 2.92Å; D548-F553 HydrophobicContact CB-CD2 4.24Å; D548-F553 HydrophobicContact CB-CE2 3.91Å; F553-L555 PolarHBondContact O-N 3.11Å; F553-L555 VanDerWaalsContact O-N 3.17Å
554	G	83.4	Confident	90.4	Very high	52 Å²	52	26 Å²	26	54%	0.536	15%	0.153	S	C	.	.			trans	68.4	10.2	175.2	0	0	0	0	0	114.8	F550	F550-G554 VanDerWaalsContact O-CA 3.29Å; F550-G554 WeakPolarHBondContact O-CA 3.32Å; F550-G554 PolarHBondContact O-N 2.95Å
555	L	86.2	Confident	90.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.143	C	C	.	.			trans	-86.9	123	-179.5	-174.8	74.2	0	0	0	109.4	L478 L504 F507 V511 T549 F550 F553 L557	L478-L555 HydrophobicContact CD2-CD2 3.9Å; L504-L555 HydrophobicContact CD1-CD1 4.02Å; F507-L555 HydrophobicContact CD1-CD1 3.79Å; F507-L555 HydrophobicContact CD1-CD2 4.35Å; F507-L555 HydrophobicContact CE1-CD1 3.89Å; F507-L555 HydrophobicContact CE1-CD2 3.96Å; V511-L555 HydrophobicContact CB-CD2 4.28Å; V511-L555 HydrophobicContact CG1-CD2 4.15Å; V511-L555 HydrophobicContact CG2-CD2 4.17Å; T549-L555 HydrophobicContact CG2-CB 3.86Å; T549-L555 HydrophobicContact CG2-CD2 3.73Å; T549-L555 HydrophobicContact CG2-CG 4.21Å; T549-L555 PolarHBondContact O-N 2.94Å; F550-L555 WeakPolarHBondContact CA-O 3.36Å; F553-L555 PolarHBondContact O-N 3.11Å; F553-L555 VanDerWaalsContact O-N 3.17Å; L555-L557 HydrophobicContact CD2-CB 4.05Å; L555-L557 HydrophobicContact CD2-CD2 4.03Å; L555-L557 HydrophobicContact CG-CB 4.13Å; L555-L557 PolarHBondContact O-N 3.19Å
556	P	85.1	Confident	90.3	Very high	8 Å²	8	22.7 Å²	22.7	5%	0.052	14%	0.137	C	C	.	.	S	Bend	trans	-75.6	64	-176.5	32.4	-38.3	0	0	0	112.9	K508 F550 F606	K508-P556 WeakPolarHBondContact CE-O 3.32Å; K508-P556 PolarHBondContact NZ-O 3.39Å; F550-P556 HydrophobicContact CE2-CB 4.37Å; P556-F606 HydrophobicContact CB-CB 3.34Å; P556-F606 HydrophobicContact CB-CD1 3.83Å; P556-F606 HydrophobicContact CB-CD2 3.37Å; P556-F606 HydrophobicContact CB-CE1 4.45Å; P556-F606 HydrophobicContact CB-CE2 4.07Å; P556-F606 HydrophobicContact CB-CG 3.23Å; P556-F606 HydrophobicContact CG-CB 4.02Å; P556-F606 HydrophobicContact CG-CD1 3.46Å; P556-F606 VanDerWaalsContact CG-CD1 3.46Å; P556-F606 HydrophobicContact CG-CD2 3.52Å; P556-F606 HydrophobicContact CG-CE1 3.67Å; P556-F606 HydrophobicContact CG-CE2 3.73Å; P556-F606 HydrophobicContact CG-CG 3.38Å; P556-F606 HydrophobicContact CG-CZ 3.8Å
557	L	87	Confident	90.2	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.047	14%	0.139	C	C	.	.			trans	-142.9	128	-175.4	179.1	64.9	0	0	0	109.4	K508 V511 M512 T549 L555 V559	K508-L557 HydrophobicContact CG-CB 4.34Å; K508-L557 HydrophobicContact CG-CD1 4.21Å; K508-L557 HydrophobicContact CG-CD2 4.37Å; V511-L557 HydrophobicContact CB-CD2 4.03Å; V511-L557 HydrophobicContact CG1-CD2 3.64Å; M512-L557 HydrophobicContact CB-CD1 4.32Å; M512-L557 HydrophobicContact CB-CD2 4.29Å; M512-L557 HydrophobicContact CE-CD1 3.48Å; M512-L557 VanDerWaalsContact CE-CD1 3.48Å; M512-L557 HydrophobicContact CG-CD1 4.39Å; T549-L557 HydrophobicContact CG2-CB 4.08Å; L555-L557 HydrophobicContact CD2-CB 4.05Å; L555-L557 HydrophobicContact CD2-CD2 4.03Å; L555-L557 HydrophobicContact CG-CB 4.13Å; L555-L557 PolarHBondContact O-N 3.19Å; L557-V559 HydrophobicContact CD1-CG2 3.73Å; L557-V559 HydrophobicContact CD2-CG2 4.33Å; L557-V559 HydrophobicContact CG-CG2 3.94Å
558	V	89.9	Confident	90.2	Very high	12 Å²	12	24.5 Å²	24.5	7%	0.073	15%	0.146	C	C	.	.			trans	-132.4	116.3	171.5	179.7	0	0	0	0	107.7	F550 Y588 L592 I608 T612	F550-V558 HydrophobicContact CB-CG2 3.92Å; F550-V558 HydrophobicContact CD2-CG2 4.34Å; F550-V558 HydrophobicContact CG-CG2 4.23Å; V558-Y588 HydrophobicContact CG1-CD1 3.81Å; V558-Y588 HydrophobicContact CG1-CE1 3.98Å; V558-L592 HydrophobicContact CB-CD2 4.44Å; V558-L592 HydrophobicContact CG1-CD2 4.04Å; V558-L592 HydrophobicContact CG1-CG 4.42Å; V558-L592 HydrophobicContact CG2-CD2 4.5Å; V558-I608 HydrophobicContact CB-CD1 4.32Å; V558-I608 HydrophobicContact CG2-CD1 3.7Å; V558-T612 HydrophobicContact CB-CG2 4.25Å; V558-T612 HydrophobicContact CG1-CG2 3.93Å
559	V	91.6	Very high	90.4	Very high	15 Å²	15	23.5 Å²	23.5	9%	0.091	14%	0.141	C	C	.	.			trans	-119.7	123.3	179.5	-176.6	0	0	0	0	108.2	M512 V515 V546 L557 Y588	M512-V559 HydrophobicContact CG-CG2 4.31Å; V515-V559 HydrophobicContact CB-CG1 4.37Å; V515-V559 HydrophobicContact CG1-CB 3.88Å; V515-V559 HydrophobicContact CG1-CG1 3.56Å; V515-V559 HydrophobicContact CG1-CG2 4.49Å; V546-V559 HydrophobicContact CG1-CB 4.49Å; L557-V559 HydrophobicContact CD1-CG2 3.73Å; L557-V559 HydrophobicContact CD2-CG2 4.33Å; L557-V559 HydrophobicContact CG-CG2 3.94Å; V559-Y588 PolarHBondContact O-OH 3.43Å
560	M	92.4	Very high	90.5	Very high	13 Å²	13	23.3 Å²	23.3	6%	0.064	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-77.1	151.2	-178.9	-63.7	-57	-64.9	0	0	111.4	M585 Y588 T612 E615 F616 Y619	M560-M585 HydrophobicContact CE-CE 4.43Å; M560-M585 HydrophobicContact CE-SD 4.21Å; M560-Y588 HydrophobicContact CE-CD2 4.17Å; M560-Y588 HydrophobicContact CE-CG 4.38Å; M560-Y588 HydrophobicContact SD-CD1 4.1Å; M560-Y588 HydrophobicContact SD-CD2 4.32Å; M560-Y588 HydrophobicContact SD-CE1 4.37Å; M560-Y588 HydrophobicContact SD-CG 4.11Å; M560-T612 HydrophobicContact CG-CG2 4.02Å; M560-T612 HydrophobicContact SD-CG2 4.39Å; M560-E615 HydrophobicContact CG-CB 4.24Å; M560-F616 HydrophobicContact CE-CB 3.86Å; M560-F616 HydrophobicContact CE-CD2 3.84Å; M560-F616 HydrophobicContact CE-CG 4.36Å; M560-F616 HydrophobicContact SD-CB 4.08Å; M560-F616 HydrophobicContact SD-CD2 4.44Å; M560-Y619 HydrophobicContact CB-CE2 4.4Å; M560-Y619 HydrophobicContact CE-CD2 3.79Å; M560-Y619 HydrophobicContact CE-CE2 4.26Å
561	P	94.7	Very high	90.6	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.032	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-60.2	139.1	168	25.2	-33.8	0	0	0	110.4	Y543 Y588 Y619	Y543-P561 HydrophobicContact CD1-CB 3.94Å; Y543-P561 HydrophobicContact CD2-CB 4.33Å; Y543-P561 HydrophobicContact CE1-CB 3.92Å; Y543-P561 HydrophobicContact CE2-CB 4.31Å; Y543-P561 HydrophobicContact CG-CB 4.17Å; P561-Y588 HydrophobicContact CG-CE2 4.46Å; P561-Y619 HydrophobicContact CG-CE2 4.3Å; P561-Y619 VanDerWaalsContact O-CE2 3.29Å; P561-Y619 WeakPolarHBondContact O-CE2 3.19Å; P561-Y619 PolarHBondContact O-OH 3.21Å
562	P	94.4	Very high	90.8	Very high	30 Å²	30	22.8 Å²	22.8	20%	0.195	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-66.5	157.1	178.2	29.4	-35.5	0	0	0	110.3	S523 Y543 G564 V565 F566	S523-P562 WeakPolarHBondContact OG-CG 3.42Å; Y543-P562 WeakPolarHBondContact OH-CD 3.28Å; P562-G564 PolarHBondContact O-N 3.31Å; P562-G564 VanDerWaalsContact O-N 3.14Å; P562-V565 HydrophobicContact CG-CB 4.14Å; P562-V565 HydrophobicContact CG-CG2 3.78Å; P562-V565 PolarHBondContact O-N 3.3Å; P562-F566 PolarHBondContact O-N 3.02Å
563	P	91.6	Very high	90.9	Very high	57 Å²	57	20.2 Å²	20.2	37%	0.37	14%	0.139	S	C	.	.	H	α-helix	trans	-53.2	-36.7	177.3	-29.6	36.5	0	0	0	113.3	V565 F566 Y567 Y619	P563-V565 PolarHBondContact O-N 3.46Å; P563-V565 VanDerWaalsContact O-N 3.14Å; P563-F566 PolarHBondContact O-N 2.7Å; P563-Y567 HydrophobicContact CB-CD2 3.98Å; P563-Y567 HydrophobicContact CB-CE2 3.92Å; P563-Y567 VanDerWaalsContact O-CD2 3.27Å; P563-Y567 WeakPolarHBondContact O-CD2 3.27Å; P563-Y567 PolarHBondContact O-N 3.5Å; P563-Y567 VanDerWaalsContact O-N 3.1Å; P563-Y619 WeakPolarHBondContact CD-OH 3.39Å
564	G	91.1	Very high	91.1	Very high	19 Å²	19	21.3 Å²	21.3	20%	0.196	15%	0.145	C	C	.	.	H	α-helix	trans	-68.1	-4	177.5	0	0	0	0	0	115.2	P562 P568	P562-G564 PolarHBondContact O-N 3.31Å; P562-G564 VanDerWaalsContact O-N 3.14Å; G564-P568 VanDerWaalsContact O-CG 3.31Å; G564-P568 WeakPolarHBondContact O-CG 3.31Å
565	V	94.9	Very high	91.5	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-113.7	-44.9	170.7	173.4	0	0	0	0	110.4	A522 L526 I539 Y543 P562 P563 Y567 P568 A569	A522-V565 HydrophobicContact CB-CG2 3.49Å; A522-V565 VanDerWaalsContact CB-CG2 3.49Å; L526-V565 HydrophobicContact CD1-CG2 4.32Å; I539-V565 HydrophobicContact CG2-CB 4.37Å; I539-V565 HydrophobicContact CG2-CG1 3.5Å; I539-V565 VanDerWaalsContact CG2-CG1 3.5Å; I539-V565 HydrophobicContact CG2-CG2 3.89Å; Y543-V565 HydrophobicContact CD2-CG1 3.98Å; Y543-V565 HydrophobicContact CE2-CB 4.32Å; Y543-V565 HydrophobicContact CE2-CG1 3.89Å; Y543-V565 HydrophobicContact CE2-CG2 4.16Å; P562-V565 HydrophobicContact CG-CB 4.14Å; P562-V565 HydrophobicContact CG-CG2 3.78Å; P562-V565 PolarHBondContact O-N 3.3Å; P563-V565 PolarHBondContact O-N 3.46Å; P563-V565 VanDerWaalsContact O-N 3.14Å; V565-Y567 PolarHBondContact O-N 3.18Å; V565-P568 WeakPolarHBondContact O-CD 3.3Å; V565-A569 VanDerWaalsContact O-CB 3.26Å; V565-A569 WeakPolarHBondContact O-CB 3.35Å; V565-A569 PolarHBondContact O-N 2.74Å
566	F	94.9	Very high	91.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.4	-50.3	-178.6	175.7	-92.8	0	0	0	112.7	P562 P563 A569 F570 L581 M585 Y619 F622 L623	P562-F566 PolarHBondContact O-N 3.02Å; P563-F566 PolarHBondContact O-N 2.7Å; F566-A569 PolarHBondContact O-N 2.95Å; F566-F570 PolarHBondContact O-N 3.06Å; F566-F570 VanDerWaalsContact O-N 3.07Å; F566-L581 HydrophobicContact CD2-CD1 3.83Å; F566-L581 HydrophobicContact CD2-CD2 4.46Å; F566-L581 HydrophobicContact CE2-CD1 4.15Å; F566-L581 HydrophobicContact CE2-CD2 4.33Å; F566-M585 HydrophobicContact CD2-SD 4.47Å; F566-M585 HydrophobicContact CE2-CG 4.34Å; F566-M585 HydrophobicContact CE2-SD 4.11Å; F566-Y619 HydrophobicContact CB-CE1 4.27Å; F566-Y619 HydrophobicContact CB-CE2 4.2Å; F566-Y619 AromaticContact CD1-CD1 3.66Å; F566-Y619 HydrophobicContact CD1-CD1 3.66Å; F566-Y619 AromaticContact CD1-CE1 3.75Å; F566-Y619 HydrophobicContact CD1-CE1 3.75Å; F566-Y619 HydrophobicContact CD1-CG 4.14Å; F566-Y619 HydrophobicContact CD2-CD1 4.1Å; F566-Y619 AromaticContact CD2-CD2 3.72Å; F566-Y619 HydrophobicContact CD2-CD2 3.72Å; F566-Y619 HydrophobicContact CD2-CE1 4.44Å; F566-Y619 HydrophobicContact CD2-CE2 4.08Å; F566-Y619 AromaticContact CD2-CG 3.73Å; F566-Y619 HydrophobicContact CD2-CG 3.73Å; F566-Y619 AromaticContact CE1-CD1 3.62Å; F566-Y619 HydrophobicContact CE1-CD1 3.62Å; F566-Y619 HydrophobicContact CE1-CE1 4.19Å; F566-Y619 HydrophobicContact CE1-CG 4.01Å; F566-Y619 VanDerWaalsContact CE2-CB 3.49Å; F566-Y619 HydrophobicContact CE2-CD1 4.09Å; F566-Y619 AromaticContact CE2-CD2 3.97Å; F566-Y619 HydrophobicContact CE2-CD2 3.97Å; F566-Y619 AromaticContact CE2-CG 3.6Å; F566-Y619 HydrophobicContact CE2-CG 3.6Å; F566-Y619 AromaticContact CG-CD1 3.9Å; F566-Y619 HydrophobicContact CG-CD1 3.9Å; F566-Y619 HydrophobicContact CG-CD2 4.1Å; F566-Y619 AromaticContact CG-CE1 3.89Å; F566-Y619 HydrophobicContact CG-CE1 3.89Å; F566-Y619 HydrophobicContact CG-CE2 4.09Å; F566-Y619 HydrophobicContact CG-CG 4.01Å; F566-Y619 AromaticContact CG-CZ 3.98Å; F566-Y619 AromaticContact CZ-CD1 3.83Å; F566-Y619 HydrophobicContact CZ-CD1 3.83Å; F566-Y619 AromaticContact CZ-CG 3.73Å; F566-Y619 HydrophobicContact CZ-CG 3.73Å; F566-F622 AromaticContact CE1-CD1 3.71Å; F566-F622 HydrophobicContact CE1-CD1 3.71Å; F566-F622 HydrophobicContact CE1-CE1 4.28Å; F566-F622 HydrophobicContact CE1-CG 4.39Å; F566-F622 HydrophobicContact CZ-CD1 4.1Å; F566-L623 HydrophobicContact CE2-CD1 3.98Å; F566-L623 HydrophobicContact CE2-CG 4.22Å; F566-L623 HydrophobicContact CZ-CD1 4.13Å; F566-L623 HydrophobicContact CZ-CD2 4.41Å; F566-L623 HydrophobicContact CZ-CG 3.87Å
567	Y	91.8	Very high	92.3	Very high	16 Å²	16	24.7 Å²	24.7	6%	0.063	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-44	-177.3	-66.1	-66.3	0	0	0	112.7	P563 V565 A569 F570 F571 R618 F622 V639	P563-Y567 HydrophobicContact CB-CD2 3.98Å; P563-Y567 HydrophobicContact CB-CE2 3.92Å; P563-Y567 VanDerWaalsContact O-CD2 3.27Å; P563-Y567 WeakPolarHBondContact O-CD2 3.27Å; P563-Y567 PolarHBondContact O-N 3.5Å; P563-Y567 VanDerWaalsContact O-N 3.1Å; V565-Y567 PolarHBondContact O-N 3.18Å; Y567-A569 VanDerWaalsContact C-N 3.28Å; Y567-A569 PolarHBondContact O-N 3.49Å; Y567-F570 PolarHBondContact O-N 2.91Å; Y567-F570 VanDerWaalsContact O-N 3.15Å; Y567-F571 HydrophobicContact CD1-CE2 4.28Å; Y567-F571 WeakPolarHBondContact O-CD2 3.44Å; Y567-F571 PolarHBondContact O-N 3.44Å; Y567-R618 PolarHBondContact OH-NH2 3.03Å; Y567-F622 HydrophobicContact CD1-CD1 4.44Å; Y567-F622 AromaticContact CD1-CE1 3.9Å; Y567-F622 HydrophobicContact CD1-CE1 3.9Å; Y567-F622 AromaticContact CD1-CZ 3.97Å; Y567-F622 HydrophobicContact CD1-CZ 3.97Å; Y567-F622 AromaticContact CE1-CD1 3.99Å; Y567-F622 HydrophobicContact CE1-CD1 3.99Å; Y567-F622 HydrophobicContact CE1-CD2 4.15Å; Y567-F622 AromaticContact CE1-CE1 3.79Å; Y567-F622 HydrophobicContact CE1-CE1 3.79Å; Y567-F622 AromaticContact CE1-CE2 3.96Å; Y567-F622 HydrophobicContact CE1-CE2 3.96Å; Y567-F622 HydrophobicContact CE1-CG 4.16Å; Y567-F622 AromaticContact CE1-CZ 3.78Å; Y567-F622 HydrophobicContact CE1-CZ 3.78Å; Y567-V639 HydrophobicContact CD1-CG2 3.87Å; Y567-V639 HydrophobicContact CD2-CG2 3.62Å; Y567-V639 HydrophobicContact CE1-CB 4.43Å; Y567-V639 HydrophobicContact CE1-CG2 3.66Å; Y567-V639 HydrophobicContact CE2-CG2 3.41Å; Y567-V639 VanDerWaalsContact CE2-CG2 3.41Å; Y567-V639 HydrophobicContact CG-CG2 3.85Å; Y567-V639 VanDerWaalsContact CZ-CG2 3.44Å
568	P	93.2	Very high	92.6	Very high	25 Å²	25	24.3 Å²	24.3	16%	0.162	15%	0.149	C	C	.	.	H	α-helix	trans	-59.1	-36.3	172	-31	40.6	0	0	0	114.1	L526 G564 V565 F570 A572	L526-P568 HydrophobicContact CD1-CB 4.14Å; L526-P568 HydrophobicContact CD1-CG 4.46Å; G564-P568 VanDerWaalsContact O-CG 3.31Å; G564-P568 WeakPolarHBondContact O-CG 3.31Å; V565-P568 WeakPolarHBondContact O-CD 3.3Å; P568-F570 VanDerWaalsContact C-N 3.34Å; P568-A572 PolarHBondContact O-N 3.32Å; P568-A572 VanDerWaalsContact O-N 3.12Å
569	A	94.5	Very high	92.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-39.7	174.4	0	0	0	0	0	112.3	L536 L540 V565 F566 Y567 A572 L581	L536-A569 HydrophobicContact CD1-CB 4.01Å; L540-A569 HydrophobicContact CD2-CB 4.07Å; V565-A569 VanDerWaalsContact O-CB 3.26Å; V565-A569 WeakPolarHBondContact O-CB 3.35Å; V565-A569 PolarHBondContact O-N 2.74Å; F566-A569 PolarHBondContact O-N 2.95Å; Y567-A569 VanDerWaalsContact C-N 3.28Å; Y567-A569 PolarHBondContact O-N 3.49Å; A569-A572 WeakPolarHBondContact O-CB 3.34Å; A569-L581 HydrophobicContact CB-CB 4.29Å; A569-L581 HydrophobicContact CB-CD1 4.2Å; A569-L581 HydrophobicContact CB-CD2 3.98Å; A569-L581 HydrophobicContact CB-CG 4.39Å
570	F	92.9	Very high	93	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.7	-48	176.3	176.1	-103.9	0	0	0	112	F566 Y567 P568 A572 L581 F622 L623 C626 L627 F658 H663	F566-F570 PolarHBondContact O-N 3.06Å; F566-F570 VanDerWaalsContact O-N 3.07Å; Y567-F570 PolarHBondContact O-N 2.91Å; Y567-F570 VanDerWaalsContact O-N 3.15Å; P568-F570 VanDerWaalsContact C-N 3.34Å; F570-A572 PolarHBondContact O-N 3.3Å; F570-L581 HydrophobicContact CB-CD2 3.86Å; F570-F622 AromaticContact CD1-CE1 3.62Å; F570-F622 HydrophobicContact CD1-CE1 3.62Å; F570-F622 HydrophobicContact CD1-CZ 4.17Å; F570-F622 AromaticContact CE1-CE1 3.86Å; F570-F622 HydrophobicContact CE1-CE1 3.86Å; F570-F622 HydrophobicContact CE1-CZ 4.19Å; F570-F622 AromaticContact CG-CE1 4Å; F570-F622 HydrophobicContact CG-CE1 4Å; F570-F622 HydrophobicContact CZ-CE1 4.42Å; F570-L623 HydrophobicContact CD2-CD2 3.41Å; F570-L623 VanDerWaalsContact CD2-CD2 3.41Å; F570-L623 HydrophobicContact CE2-CD2 3.88Å; F570-L623 HydrophobicContact CG-CD2 4.34Å; F570-C626 HydrophobicContact CE1-CB 4.07Å; F570-C626 HydrophobicContact CE2-CB 4.1Å; F570-C626 HydrophobicContact CZ-CB 3.38Å; F570-L627 HydrophobicContact CE2-CD1 4.49Å; F570-L627 HydrophobicContact CE2-CD2 3.78Å; F570-L627 HydrophobicContact CE2-CG 3.89Å; F570-L627 HydrophobicContact CZ-CD2 4.41Å; F570-F658 HydrophobicContact CE1-CB 4.32Å; F570-F658 HydrophobicContact CE1-CD1 4.33Å; F570-F658 HydrophobicContact CE1-CG 4.4Å; F570-F658 HydrophobicContact CZ-CB 4.11Å; F570-H663 AromaticContact CZ-NE2 3.92Å; F570-H663 PolarHBondContact O-CE1 3.44Å; F570-H663 PolarHBondContact O-NE2 3.24Å
571	F	90.6	Very high	93.2	Very high	67 Å²	67	24.9 Å²	24.9	29%	0.294	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	6.9	-178.5	-64.2	-59.1	0	0	0	114.1	Y567 F622 M632 F658	Y567-F571 HydrophobicContact CD1-CE2 4.28Å; Y567-F571 WeakPolarHBondContact O-CD2 3.44Å; Y567-F571 PolarHBondContact O-N 3.44Å; F571-F622 HydrophobicContact CZ-CZ 4.12Å; F571-M632 HydrophobicContact CE1-CE 3.98Å; F571-M632 HydrophobicContact CZ-CE 3.6Å; F571-F658 HydrophobicContact CD1-CD1 4.11Å; F571-F658 AromaticContact CD1-CE1 3.6Å; F571-F658 HydrophobicContact CD1-CE1 3.6Å; F571-F658 AromaticContact CD1-CZ 3.9Å; F571-F658 HydrophobicContact CD1-CZ 3.9Å; F571-F658 HydrophobicContact CE1-CD1 4.22Å; F571-F658 AromaticContact CE1-CE1 3.88Å; F571-F658 HydrophobicContact CE1-CE1 3.88Å; F571-F658 HydrophobicContact CE1-CE2 4.17Å; F571-F658 AromaticContact CE1-CZ 3.85Å; F571-F658 HydrophobicContact CE1-CZ 3.85Å
572	A	92.2	Very high	93.2	Very high	9 Å²	9	24.8 Å²	24.8	7%	0.074	15%	0.149	C	C	.	.			trans	-59.4	141	177	0	0	0	0	0	110.9	L536 P568 A569 F570 D574	L536-A572 HydrophobicContact CD2-CB 3.88Å; P568-A572 PolarHBondContact O-N 3.32Å; P568-A572 VanDerWaalsContact O-N 3.12Å; A569-A572 WeakPolarHBondContact O-CB 3.34Å; F570-A572 PolarHBondContact O-N 3.3Å; A572-D574 VanDerWaalsContact C-N 3.26Å
573	A	89.9	Confident	93.2	Very high	73 Å²	73	26.6 Å²	26.6	60%	0.603	15%	0.154	S	C	*	.	S	Bend	trans	-79.4	-12.8	174.2	0	0	0	0	0	112.3	A665	A573-A665 VanDerWaalsContact O-CA 3.3Å; A573-A665 WeakPolarHBondContact O-CA 3.47Å
574	D	91.3	Very high	93.4	Very high	35 Å²	35	24 Å²	24	19%	0.187	14%	0.137	C	C	.	.	S	Bend	trans	-93.6	131.1	176.5	62.4	-84.9	0	0	0	111.5	S533 A572 I576 S577	S533-D574 WeakPolarHBondContact CB-OD1 3.44Å; S533-D574 PolarHBondContact OG-OD1 3.11Å; A572-D574 VanDerWaalsContact C-N 3.26Å; D574-I576 PolarHBondContact O-N 3.37Å; D574-S577 PolarHBondContact O-N 2.89Å; D574-S577 PolarHBondContact OD1-OG 2.86Å; D574-S577 WeakPolarHBondContact OD2-CB 3.33Å; D574-S577 PolarHBondContact OD2-N 3.29Å; D574-S577 PolarHBondContact OD2-OG 3.39Å
575	P	91.7	Very high	93.6	Very high	20 Å²	20	23 Å²	23	13%	0.13	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-25.6	-177.4	28.4	-37.7	0	0	0	112.8	V578 D579 A665 F666 Y669 F707	P575-V578 PolarHBondContact O-N 2.78Å; P575-D579 WeakPolarHBondContact O-CB 3.3Å; P575-D579 PolarHBondContact O-N 3.47Å; P575-A665 HydrophobicContact CB-CB 4.28Å; P575-A665 WeakPolarHBondContact CB-O 3.5Å; P575-F666 HydrophobicContact CB-CD1 4.01Å; P575-F666 HydrophobicContact CB-CE1 3.66Å; P575-F666 HydrophobicContact CB-CZ 4.33Å; P575-Y669 HydrophobicContact CB-CE2 4.35Å; P575-Y669 HydrophobicContact CG-CE2 3.89Å; P575-F707 HydrophobicContact CB-CE1 3.73Å; P575-F707 HydrophobicContact CB-CZ 3.72Å; P575-F707 HydrophobicContact CG-CE1 4.14Å; P575-F707 HydrophobicContact CG-CZ 4.03Å
576	I	93.1	Very high	93.5	Very high	108 Å²	108	23.9 Å²	23.9	55%	0.554	13%	0.131	S	C	*	.	H	α-helix	trans	-63.6	-46.3	179.7	-62.1	170.8	0	0	0	109.8	D574 V578 D579 R580	D574-I576 PolarHBondContact O-N 3.37Å; I576-V578 VanDerWaalsContact C-N 3.3Å; I576-V578 PolarHBondContact O-N 2.96Å; I576-D579 PolarHBondContact O-N 2.95Å; I576-R580 HydrophobicContact CG2-CG 4.2Å; I576-R580 WeakPolarHBondContact O-CB 3.42Å; I576-R580 WeakPolarHBondContact O-CG 3.39Å; I576-R580 PolarHBondContact O-N 3.11Å
577	S	94.4	Very high	93.4	Very high	3 Å²	3	27 Å²	27	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-38.9	177.9	-68	0	0	0	0	112.9	L536 D574 L581	L536-S577 WeakPolarHBondContact CD2-OG 3.49Å; D574-S577 PolarHBondContact O-N 2.89Å; D574-S577 PolarHBondContact OD1-OG 2.86Å; D574-S577 WeakPolarHBondContact OD2-CB 3.33Å; D574-S577 PolarHBondContact OD2-N 3.29Å; D574-S577 PolarHBondContact OD2-OG 3.39Å; S577-L581 WeakPolarHBondContact O-CB 2.96Å; S577-L581 PolarHBondContact O-N 3.18Å
578	V	94.1	Very high	93.5	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-70.2	-41.1	178.7	-174.3	0	0	0	0	111.3	P575 I576 L581 A582 A665 F666	P575-V578 PolarHBondContact O-N 2.78Å; I576-V578 VanDerWaalsContact C-N 3.3Å; I576-V578 PolarHBondContact O-N 2.96Å; V578-L581 PolarHBondContact O-N 3.03Å; V578-A582 WeakPolarHBondContact O-CB 3.47Å; V578-A582 PolarHBondContact O-N 3.31Å; V578-A665 HydrophobicContact CG2-CB 3.98Å; V578-F666 HydrophobicContact CB-CE2 4.16Å; V578-F666 HydrophobicContact CB-CZ 4.13Å; V578-F666 HydrophobicContact CG1-CE2 3.82Å; V578-F666 HydrophobicContact CG1-CZ 4.11Å
579	D	94.9	Very high	93.4	Very high	22 Å²	22	26.4 Å²	26.4	12%	0.118	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-46	175	-177.7	70.4	0	0	0	111.8	P575 I576 L581 A582 F583 F707 G709 L710	P575-D579 WeakPolarHBondContact O-CB 3.3Å; P575-D579 PolarHBondContact O-N 3.47Å; I576-D579 PolarHBondContact O-N 2.95Å; D579-L581 PolarHBondContact O-N 2.92Å; D579-A582 WeakPolarHBondContact O-CB 3.27Å; D579-A582 PolarHBondContact O-N 3.4Å; D579-A582 VanDerWaalsContact O-N 3.12Å; D579-F583 PolarHBondContact O-N 3.43Å; D579-F707 HydrophobicContact CB-CD1 3.97Å; D579-F707 VanDerWaalsContact OD1-CA 3.23Å; D579-F707 WeakPolarHBondContact OD1-CA 3.39Å; D579-F707 WeakPolarHBondContact OD1-CB 3.43Å; D579-G709 WeakPolarHBondContact OD1-CA 3.31Å; D579-G709 PolarHBondContact OD1-N 3Å; D579-G709 VanDerWaalsContact OD1-N 3.09Å; D579-L710 WeakPolarHBondContact OD1-CB 3.44Å; D579-L710 PolarHBondContact OD1-N 3.12Å
580	R	95.7	Very high	93.2	Very high	27 Å²	27	28.8 Å²	28.8	10%	0.102	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-40.1	175.9	-69.5	-179.3	69.1	177.2	7.5	112.5	S537 L540 D541 E544 I576 A582 F583 I584	S537-R580 PolarHBondContact O-NH1 2.86Å; S537-R580 PolarHBondContact OG-NH1 3.1Å; S537-R580 VanDerWaalsContact OG-NH1 3.11Å; L540-R580 HydrophobicContact CD1-CB 4.1Å; D541-R580 IonicContact OD1-CZ 2.83Å; D541-R580 IonicContact OD1-NH1 3.41Å; D541-R580 PolarHBondContact OD1-NH1 3.02Å; D541-R580 IonicContact OD1-NH2 2.85Å; D541-R580 PolarHBondContact OD1-NH2 3.18Å; E544-R580 IonicContact OE1-CZ 3.78Å; E544-R580 VanDerWaalsContact OE1-CZ 3.26Å; E544-R580 IonicContact OE1-NE 2.97Å; E544-R580 PolarHBondContact OE1-NE 3Å; E544-R580 IonicContact OE1-NH2 2.59Å; E544-R580 PolarHBondContact OE1-NH2 3.36Å; E544-R580 IonicContact OE2-NH2 3.14Å; E544-R580 PolarHBondContact OE2-NH2 3.41Å; E544-R580 VanDerWaalsContact OE2-NH2 3.1Å; I576-R580 HydrophobicContact CG2-CG 4.2Å; I576-R580 WeakPolarHBondContact O-CB 3.42Å; I576-R580 WeakPolarHBondContact O-CG 3.39Å; I576-R580 PolarHBondContact O-N 3.11Å; R580-A582 VanDerWaalsContact C-N 3.32Å; R580-A582 PolarHBondContact O-N 2.83Å; R580-F583 WeakPolarHBondContact O-CB 3.26Å; R580-F583 PolarHBondContact O-N 3.48Å; R580-I584 VanDerWaalsContact O-CG1 3.27Å; R580-I584 WeakPolarHBondContact O-CG1 3.16Å; R580-I584 PolarHBondContact O-N 2.93Å
581	L	95.9	Very high	93	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-43.8	172.1	178.8	64.8	0	0	0	111.3	F566 A569 F570 S577 V578 D579 F583 I584 M585 L623	F566-L581 HydrophobicContact CD2-CD1 3.83Å; F566-L581 HydrophobicContact CD2-CD2 4.46Å; F566-L581 HydrophobicContact CE2-CD1 4.15Å; F566-L581 HydrophobicContact CE2-CD2 4.33Å; A569-L581 HydrophobicContact CB-CB 4.29Å; A569-L581 HydrophobicContact CB-CD1 4.2Å; A569-L581 HydrophobicContact CB-CD2 3.98Å; A569-L581 HydrophobicContact CB-CG 4.39Å; F570-L581 HydrophobicContact CB-CD2 3.86Å; S577-L581 WeakPolarHBondContact O-CB 2.96Å; S577-L581 PolarHBondContact O-N 3.18Å; V578-L581 PolarHBondContact O-N 3.03Å; D579-L581 PolarHBondContact O-N 2.92Å; L581-F583 VanDerWaalsContact C-N 3.34Å; L581-I584 PolarHBondContact O-N 2.85Å; L581-M585 HydrophobicContact CD1-CG 4.37Å; L581-M585 WeakPolarHBondContact O-CB 3.21Å; L581-M585 VanDerWaalsContact O-CG 3.3Å; L581-M585 WeakPolarHBondContact O-CG 3.39Å; L581-M585 PolarHBondContact O-N 3.31Å; L581-L623 HydrophobicContact CD2-CD2 4.07Å
582	A	94.4	Very high	93	Very high	2 Å²	2	25.6 Å²	25.6	2%	0.017	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-41.7	176.7	0	0	0	0	0	111.6	V578 D579 R580 M585 H586 L710 F713	V578-A582 WeakPolarHBondContact O-CB 3.47Å; V578-A582 PolarHBondContact O-N 3.31Å; D579-A582 WeakPolarHBondContact O-CB 3.27Å; D579-A582 PolarHBondContact O-N 3.4Å; D579-A582 VanDerWaalsContact O-N 3.12Å; R580-A582 VanDerWaalsContact C-N 3.32Å; R580-A582 PolarHBondContact O-N 2.83Å; A582-M585 PolarHBondContact O-N 3.38Å; A582-H586 WeakPolarHBondContact O-CB 3.34Å; A582-H586 PolarHBondContact O-N 2.97Å; A582-L710 HydrophobicContact CB-CB 4.49Å; A582-L710 HydrophobicContact CB-CD1 4.32Å; A582-F713 HydrophobicContact CB-CB 3.83Å; A582-F713 HydrophobicContact CB-CG 4.14Å
583	F	95.1	Very high	92.8	Very high	69 Å²	69	27 Å²	27	30%	0.303	15%	0.146	S	C	.	.	H	α-helix	trans	-58.5	-52.5	172.6	175.8	-103.7	0	0	0	111.9	E544 D579 R580 L581 M585 H586 R587	E544-F583 HydrophobicContact CG-CD1 4.11Å; E544-F583 HydrophobicContact CG-CE1 4.18Å; D579-F583 PolarHBondContact O-N 3.43Å; R580-F583 WeakPolarHBondContact O-CB 3.26Å; R580-F583 PolarHBondContact O-N 3.48Å; L581-F583 VanDerWaalsContact C-N 3.34Å; F583-M585 VanDerWaalsContact C-N 3.3Å; F583-M585 PolarHBondContact O-N 2.72Å; F583-H586 WeakPolarHBondContact O-CB 3.43Å; F583-H586 PolarHBondContact O-N 3.36Å; F583-H586 VanDerWaalsContact O-N 3.11Å; F583-R587 HydrophobicContact CD1-CG 4.3Å; F583-R587 HydrophobicContact CD2-CG 4.41Å; F583-R587 HydrophobicContact CE1-CG 3.9Å; F583-R587 HydrophobicContact CE2-CG 4.02Å; F583-R587 HydrophobicContact CZ-CG 3.75Å; F583-R587 WeakPolarHBondContact O-CG 3.4Å; F583-R587 PolarHBondContact O-N 3.26Å
584	I	95.7	Very high	92.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-55.8	-46.1	178.1	-70.6	164.3	0	0	0	110.7	L540 E544 C547 R580 L581 H586 R587 Y588	L540-I584 HydrophobicContact CB-CD1 4.4Å; L540-I584 HydrophobicContact CD2-CD1 3.79Å; E544-I584 HydrophobicContact CG-CD1 4.01Å; E544-I584 HydrophobicContact CG-CG1 3.69Å; C547-I584 HydrophobicContact CB-CG2 4.41Å; R580-I584 VanDerWaalsContact O-CG1 3.27Å; R580-I584 WeakPolarHBondContact O-CG1 3.16Å; R580-I584 PolarHBondContact O-N 2.93Å; L581-I584 PolarHBondContact O-N 2.85Å; I584-H586 PolarHBondContact O-N 3.42Å; I584-R587 PolarHBondContact O-N 2.87Å; I584-Y588 HydrophobicContact CG2-CD2 3.66Å; I584-Y588 HydrophobicContact CG2-CE2 3.31Å; I584-Y588 WeakPolarHBondContact O-CD2 3.5Å; I584-Y588 PolarHBondContact O-N 2.88Å
585	M	94.6	Very high	92.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.8	-36.3	178.7	-72	-60.3	-60.4	0	0	112.7	M560 F566 L581 A582 F583 Y588 K589 F616 Y619 L623 F713	M560-M585 HydrophobicContact CE-CE 4.43Å; M560-M585 HydrophobicContact CE-SD 4.21Å; F566-M585 HydrophobicContact CD2-SD 4.47Å; F566-M585 HydrophobicContact CE2-CG 4.34Å; F566-M585 HydrophobicContact CE2-SD 4.11Å; L581-M585 HydrophobicContact CD1-CG 4.37Å; L581-M585 WeakPolarHBondContact O-CB 3.21Å; L581-M585 VanDerWaalsContact O-CG 3.3Å; L581-M585 WeakPolarHBondContact O-CG 3.39Å; L581-M585 PolarHBondContact O-N 3.31Å; A582-M585 PolarHBondContact O-N 3.38Å; F583-M585 VanDerWaalsContact C-N 3.3Å; F583-M585 PolarHBondContact O-N 2.72Å; M585-Y588 HydrophobicContact SD-CD2 4.45Å; M585-K589 PolarHBondContact O-N 3.38Å; M585-K589 VanDerWaalsContact O-N 3.13Å; M585-F616 HydrophobicContact CE-CD2 3.72Å; M585-F616 HydrophobicContact CE-CE2 3.64Å; M585-F616 WeakPolarHBondContact O-CE2 3.48Å; M585-Y619 HydrophobicContact SD-CD2 4.38Å; M585-L623 HydrophobicContact CB-CD1 4.18Å; M585-L623 HydrophobicContact CG-CD1 3.67Å; M585-F713 HydrophobicContact CB-CD2 4.03Å; M585-F713 HydrophobicContact CB-CE2 3.88Å
586	H	93.3	Very high	91.9	Very high	20 Å²	20	24.7 Å²	24.7	9%	0.093	12%	0.124	C	C	.	.	H	α-helix	trans	-61.2	-48.3	171.6	171.4	67	0	0	0	111.1	A582 F583 I584 Y588 K589 V590 D712 F713 N716	A582-H586 WeakPolarHBondContact O-CB 3.34Å; A582-H586 PolarHBondContact O-N 2.97Å; F583-H586 WeakPolarHBondContact O-CB 3.43Å; F583-H586 PolarHBondContact O-N 3.36Å; F583-H586 VanDerWaalsContact O-N 3.11Å; I584-H586 PolarHBondContact O-N 3.42Å; H586-Y588 PolarHBondContact O-N 3.41Å; H586-K589 VanDerWaalsContact O-CB 3.26Å; H586-K589 WeakPolarHBondContact O-CB 3.47Å; H586-K589 PolarHBondContact O-N 3.22Å; H586-K589 VanDerWaalsContact O-N 3.12Å; H586-V590 WeakPolarHBondContact O-CG2 3.23Å; H586-V590 PolarHBondContact O-N 2.81Å; H586-V590 VanDerWaalsContact O-N 3.14Å; H586-D712 PolarHBondContact ND1-O 3.24Å; H586-F713 HydrophobicContact CB-CB 4.43Å; H586-N716 PolarHBondContact CE1-ND2 3.14Å; H586-N716 PolarHBondContact ND1-ND2 3.06Å
587	R	92.9	Very high	91.4	Very high	66 Å²	66	27.7 Å²	27.7	25%	0.249	13%	0.128	C	C	.	.	H	α-helix	trans	-59.8	-45.5	178.1	-65.4	-66.3	-66.3	172.3	-2	112	C547 D548 F583 I584 K589 V590 N591	C547-R587 HydrophobicContact CB-CB 4.19Å; C547-R587 VanDerWaalsContact SG-CB 3.54Å; D548-R587 IonicContact OD1-CZ 3.72Å; D548-R587 IonicContact OD1-NE 3.3Å; D548-R587 PolarHBondContact OD1-NE 3.31Å; D548-R587 IonicContact OD1-NH2 3.52Å; D548-R587 PolarHBondContact OD1-NH2 3.31Å; F583-R587 HydrophobicContact CD1-CG 4.3Å; F583-R587 HydrophobicContact CD2-CG 4.41Å; F583-R587 HydrophobicContact CE1-CG 3.9Å; F583-R587 HydrophobicContact CE2-CG 4.02Å; F583-R587 HydrophobicContact CZ-CG 3.75Å; F583-R587 WeakPolarHBondContact O-CG 3.4Å; F583-R587 PolarHBondContact O-N 3.26Å; I584-R587 PolarHBondContact O-N 2.87Å; R587-K589 VanDerWaalsContact C-N 3.28Å; R587-K589 PolarHBondContact O-N 3.21Å; R587-V590 WeakPolarHBondContact O-CB 3.42Å; R587-V590 PolarHBondContact O-N 2.94Å; R587-V590 VanDerWaalsContact O-N 3.09Å; R587-N591 PolarHBondContact O-N 3.42Å; R587-N591 PolarHBondContact O-ND2 3.31Å
588	Y	92.8	Very high	90.6	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-57.2	-40.2	174.3	-79.3	-56.4	0	0	0	112.7	V546 C547 V558 V559 M560 P561 I584 M585 H586 V590 N591 L592	V546-Y588 WeakPolarHBondContact CG1-OH 3.34Å; C547-Y588 HydrophobicContact CB-CD1 4.13Å; C547-Y588 HydrophobicContact CB-CD2 4.23Å; C547-Y588 HydrophobicContact CB-CE1 3.75Å; C547-Y588 HydrophobicContact CB-CE2 3.87Å; C547-Y588 HydrophobicContact CB-CG 4.33Å; V558-Y588 HydrophobicContact CG1-CD1 3.81Å; V558-Y588 HydrophobicContact CG1-CE1 3.98Å; V559-Y588 PolarHBondContact O-OH 3.43Å; M560-Y588 HydrophobicContact CE-CD2 4.17Å; M560-Y588 HydrophobicContact CE-CG 4.38Å; M560-Y588 HydrophobicContact SD-CD1 4.1Å; M560-Y588 HydrophobicContact SD-CD2 4.32Å; M560-Y588 HydrophobicContact SD-CE1 4.37Å; M560-Y588 HydrophobicContact SD-CG 4.11Å; P561-Y588 HydrophobicContact CG-CE2 4.46Å; I584-Y588 HydrophobicContact CG2-CD2 3.66Å; I584-Y588 HydrophobicContact CG2-CE2 3.31Å; I584-Y588 WeakPolarHBondContact O-CD2 3.5Å; I584-Y588 PolarHBondContact O-N 2.88Å; M585-Y588 HydrophobicContact SD-CD2 4.45Å; H586-Y588 PolarHBondContact O-N 3.41Å; Y588-V590 VanDerWaalsContact C-N 3.34Å; Y588-V590 PolarHBondContact O-N 3Å; Y588-N591 PolarHBondContact O-N 3.44Å; Y588-L592 WeakPolarHBondContact O-CB 3.45Å; Y588-L592 VanDerWaalsContact O-CG 3.31Å; Y588-L592 WeakPolarHBondContact O-CG 3.43Å; Y588-L592 PolarHBondContact O-N 3.24Å
589	K	91.2	Very high	89.6	Confident	27 Å²	27	35.7 Å²	35.7	12%	0.117	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-45.8	175.3	-168.1	176.6	179.5	169.5	0	111.8	M585 H586 R587 T593 F616 N716 N717	M585-K589 PolarHBondContact O-N 3.38Å; M585-K589 VanDerWaalsContact O-N 3.13Å; H586-K589 VanDerWaalsContact O-CB 3.26Å; H586-K589 WeakPolarHBondContact O-CB 3.47Å; H586-K589 PolarHBondContact O-N 3.22Å; H586-K589 VanDerWaalsContact O-N 3.12Å; R587-K589 VanDerWaalsContact C-N 3.28Å; R587-K589 PolarHBondContact O-N 3.21Å; K589-T593 VanDerWaalsContact O-CB 3.26Å; K589-T593 WeakPolarHBondContact O-CB 3.22Å; K589-T593 PolarHBondContact O-N 2.86Å; K589-T593 PolarHBondContact O-OG1 2.99Å; K589-F616 HydrophobicContact CB-CE1 4.45Å; K589-F616 HydrophobicContact CB-CE2 4.16Å; K589-F616 HydrophobicContact CB-CZ 3.59Å; K589-F616 HydrophobicContact CG-CE1 4.39Å; K589-F616 HydrophobicContact CG-CZ 3.93Å; K589-N716 PolarHBondContact NZ-O 3.14Å; K589-N717 PolarHBondContact NZ-OD1 3.33Å
590	V	90.8	Very high	88.4	Confident	49 Å²	49	42.6 Å²	42.6	30%	0.297	19%	0.194	S	C	.	.	H	α-helix	trans	-62.2	-44.9	179.8	177.4	0	0	0	0	110.4	L551 H586 R587 Y588 S594	L551-V590 HydrophobicContact CD1-CG1 3.74Å; H586-V590 WeakPolarHBondContact O-CG2 3.23Å; H586-V590 PolarHBondContact O-N 2.81Å; H586-V590 VanDerWaalsContact O-N 3.14Å; R587-V590 WeakPolarHBondContact O-CB 3.42Å; R587-V590 PolarHBondContact O-N 2.94Å; R587-V590 VanDerWaalsContact O-N 3.09Å; Y588-V590 VanDerWaalsContact C-N 3.34Å; Y588-V590 PolarHBondContact O-N 3Å; V590-S594 WeakPolarHBondContact O-CB 3.43Å; V590-S594 PolarHBondContact O-N 3.18Å; V590-S594 PolarHBondContact O-OG 2.85Å
591	N	89.4	Confident	87	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-50.5	178.1	-62.7	-31.4	0	0	0	112.5	C547 F550 L551 R587 Y588 T593 S594 A595	C547-N591 PolarHBondContact O-ND2 3.42Å; F550-N591 HydrophobicContact CB-CB 4.25Å; F550-N591 HydrophobicContact CD1-CB 4.27Å; L551-N591 WeakPolarHBondContact CB-OD1 3.43Å; L551-N591 WeakPolarHBondContact CD1-OD1 3.18Å; L551-N591 WeakPolarHBondContact CG-OD1 3.37Å; R587-N591 PolarHBondContact O-N 3.42Å; R587-N591 PolarHBondContact O-ND2 3.31Å; Y588-N591 PolarHBondContact O-N 3.44Å; N591-T593 VanDerWaalsContact C-N 3.32Å; N591-T593 PolarHBondContact O-N 3.4Å; N591-S594 PolarHBondContact O-N 3.39Å; N591-S594 VanDerWaalsContact O-N 3.13Å; N591-A595 WeakPolarHBondContact O-CB 3.41Å; N591-A595 PolarHBondContact O-N 3.03Å
592	L	89	Confident	85.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-37.1	-178.7	-72.2	171.7	0	0	0	112	V558 Y588 S594 K596 I608 T612 F613 F616 L748	V558-L592 HydrophobicContact CB-CD2 4.44Å; V558-L592 HydrophobicContact CG1-CD2 4.04Å; V558-L592 HydrophobicContact CG1-CG 4.42Å; V558-L592 HydrophobicContact CG2-CD2 4.5Å; Y588-L592 WeakPolarHBondContact O-CB 3.45Å; Y588-L592 VanDerWaalsContact O-CG 3.31Å; Y588-L592 WeakPolarHBondContact O-CG 3.43Å; Y588-L592 PolarHBondContact O-N 3.24Å; L592-S594 VanDerWaalsContact C-N 3.32Å; L592-K596 WeakPolarHBondContact O-CB 3.08Å; L592-K596 PolarHBondContact O-N 3.17Å; L592-I608 HydrophobicContact CD2-CD1 4.3Å; L592-I608 HydrophobicContact CD2-CG2 4.2Å; L592-T612 HydrophobicContact CD2-CG2 4.29Å; L592-F613 HydrophobicContact CB-CD1 4.36Å; L592-F613 HydrophobicContact CB-CE1 3.82Å; L592-F613 HydrophobicContact CD2-CD1 4.16Å; L592-F613 HydrophobicContact CD2-CE1 3.86Å; L592-F613 HydrophobicContact CD2-CE2 4.45Å; L592-F613 HydrophobicContact CD2-CZ 4.02Å; L592-F613 HydrophobicContact CG-CE1 4.34Å; L592-F616 HydrophobicContact CD1-CB 3.56Å; L592-F616 HydrophobicContact CD1-CD1 3.76Å; L592-F616 HydrophobicContact CD1-CD2 3.75Å; L592-F616 HydrophobicContact CD1-CE1 4.45Å; L592-F616 HydrophobicContact CD1-CE2 4.45Å; L592-F616 HydrophobicContact CD1-CG 3.37Å; L592-L748 HydrophobicContact CB-CD1 4.14Å
593	T	88.6	Confident	83	Confident	38 Å²	38	60.1 Å²	60.1	23%	0.233	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-39.6	174.3	-55.8	0	0	0	0	111.1	K589 N591 R597	K589-T593 VanDerWaalsContact O-CB 3.26Å; K589-T593 WeakPolarHBondContact O-CB 3.22Å; K589-T593 PolarHBondContact O-N 2.86Å; K589-T593 PolarHBondContact O-OG1 2.99Å; N591-T593 VanDerWaalsContact C-N 3.32Å; N591-T593 PolarHBondContact O-N 3.4Å; T593-R597 WeakPolarHBondContact O-CG 3.46Å; T593-R597 PolarHBondContact O-N 3.09Å; T593-R597 VanDerWaalsContact O-N 3.13Å
594	S	86.1	Confident	80.7	Confident	27 Å²	27	65.4 Å²	65.4	19%	0.189	32%	0.315	C	S	.	.	H	α-helix	trans	-70.7	-42.3	178.5	-57.8	0	0	0	0	111.9	V590 N591 L592 K596 R597 Q598	V590-S594 WeakPolarHBondContact O-CB 3.43Å; V590-S594 PolarHBondContact O-N 3.18Å; V590-S594 PolarHBondContact O-OG 2.85Å; N591-S594 PolarHBondContact O-N 3.39Å; N591-S594 VanDerWaalsContact O-N 3.13Å; L592-S594 VanDerWaalsContact C-N 3.32Å; S594-K596 VanDerWaalsContact C-N 3.33Å; S594-K596 PolarHBondContact O-N 2.96Å; S594-R597 WeakPolarHBondContact O-CB 3.38Å; S594-R597 PolarHBondContact O-N 3.49Å; S594-Q598 WeakPolarHBondContact O-CG 3.44Å; S594-Q598 PolarHBondContact O-N 2.89Å
595	A	84.5	Confident	78.7	Confident	9 Å²	9	66.1 Å²	66.1	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-58	-44.9	173.5	0	0	0	0	0	111.8	F550 N591 R597 Q598 E599 I608	F550-A595 HydrophobicContact CD1-CB 4.49Å; F550-A595 HydrophobicContact CE1-CB 3.73Å; F550-A595 HydrophobicContact CE2-CB 4.18Å; F550-A595 HydrophobicContact CZ-CB 3.55Å; N591-A595 WeakPolarHBondContact O-CB 3.41Å; N591-A595 PolarHBondContact O-N 3.03Å; A595-R597 VanDerWaalsContact C-N 3.26Å; A595-R597 PolarHBondContact O-N 2.83Å; A595-Q598 PolarHBondContact O-N 3.14Å; A595-E599 WeakPolarHBondContact O-CB 3.42Å; A595-E599 PolarHBondContact O-N 3.09Å; A595-I608 HydrophobicContact CB-CD1 3.26Å; A595-I608 HydrophobicContact CB-CG1 4.22Å
596	K	83.6	Confident	77.1	Confident	43 Å²	43	72 Å²	72	19%	0.187	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-29.6	175.5	-170.6	175.1	-176.9	-179.3	0	113.1	L592 S594 K600 L748 S750	L592-K596 WeakPolarHBondContact O-CB 3.08Å; L592-K596 PolarHBondContact O-N 3.17Å; S594-K596 VanDerWaalsContact C-N 3.33Å; S594-K596 PolarHBondContact O-N 2.96Å; K596-K600 WeakPolarHBondContact O-CG 3.4Å; K596-L748 PolarHBondContact NZ-O 3.15Å; K596-S750 PolarHBondContact NZ-O 2.9Å
597	R	82.5	Confident	75.8	Confident	172 Å²	172	77.6 Å²	77.6	65%	0.649	37%	0.373	S	S	*	.	H	α-helix	trans	-73.5	-43.2	173.6	-72.9	173.1	-177.2	-175.6	1	111.2	T593 S594 A595 K600 V601	T593-R597 WeakPolarHBondContact O-CG 3.46Å; T593-R597 PolarHBondContact O-N 3.09Å; T593-R597 VanDerWaalsContact O-N 3.13Å; S594-R597 WeakPolarHBondContact O-CB 3.38Å; S594-R597 PolarHBondContact O-N 3.49Å; A595-R597 VanDerWaalsContact C-N 3.26Å; A595-R597 PolarHBondContact O-N 2.83Å; R597-K600 PolarHBondContact O-N 3.34Å; R597-V601 WeakPolarHBondContact O-CG2 3.35Å; R597-V601 PolarHBondContact O-N 3.47Å
598	Q	77.1	Confident	75.1	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-38.9	178.5	-71.1	175.7	-5.5	0	0	112	F550 S594 A595 K600 V601 T602	F550-Q598 VanDerWaalsContact CZ-OE1 3.24Å; S594-Q598 WeakPolarHBondContact O-CG 3.44Å; S594-Q598 PolarHBondContact O-N 2.89Å; A595-Q598 PolarHBondContact O-N 3.14Å; Q598-K600 PolarHBondContact O-N 3.47Å; Q598-V601 PolarHBondContact O-N 3.5Å; Q598-T602 PolarHBondContact O-N 3.27Å
599	E	73.6	Confident	74.5	Confident	77 Å²	77	78 Å²	78	36%	0.36	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-27.6	174.3	-168.8	175.9	-156	0	0	113.2	A595 H607	A595-E599 WeakPolarHBondContact O-CB 3.42Å; A595-E599 PolarHBondContact O-N 3.09Å; E599-H607 IonicContact OE1-CE1 3.26Å; E599-H607 IonicContact OE1-CG 2.78Å; E599-H607 IonicContact OE1-ND1 2.79Å; E599-H607 PolarHBondContact OE1-ND1 2.65Å
600	K	69.8	Low	74.2	Confident	167 Å²	167	86.3 Å²	86.3	73%	0.726	42%	0.416	S	S	*	.	H	α-helix	trans	-83.1	-20.4	176.6	-69.8	179.9	-179.9	-165.7	0	113.9	K596 R597 Q598	K596-K600 WeakPolarHBondContact O-CG 3.4Å; R597-K600 PolarHBondContact O-N 3.34Å; Q598-K600 PolarHBondContact O-N 3.47Å
601	V	65.4	Low	73.9	Confident	125 Å²	125	89.9 Å²	89.9	76%	0.758	43%	0.429	S	S	*	.	H	α-helix	trans	-97.3	-32.7	-174	174.9	0	0	0	0	111.4	R597 Q598	R597-V601 WeakPolarHBondContact O-CG2 3.35Å; R597-V601 PolarHBondContact O-N 3.47Å; Q598-V601 PolarHBondContact O-N 3.5Å
602	T	57.6	Low	73.8	Confident	73 Å²	73	90.6 Å²	90.6	45%	0.448	43%	0.433	S	S	.	.			trans	-126.5	114.3	-176.3	-37.6	0	0	0	0	109.6	Q598 Q604 A605	Q598-T602 PolarHBondContact O-N 3.27Å; T602-Q604 HydrophobicContact CG2-CB 4.41Å; T602-Q604 PolarHBondContact O-N 2.9Å; T602-Q604 VanDerWaalsContact O-N 3.09Å; T602-A605 WeakPolarHBondContact O-CB 3.47Å; T602-A605 PolarHBondContact O-N 3.32Å
603	E	48.5	Very low	73.8	Confident	201 Å²	201	91.3 Å²	91.3	94%	0.939	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.7	177.5	-72.2	-174.7	161.4	0	0	113.3
604	Q	47.9	Very low	73.8	Confident	180 Å²	180	97.2 Å²	97.2	84%	0.841	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	6.9	174.6	-67.8	177.2	-19.9	0	0	113.8	T602	T602-Q604 HydrophobicContact CG2-CB 4.41Å; T602-Q604 PolarHBondContact O-N 2.9Å; T602-Q604 VanDerWaalsContact O-N 3.09Å
605	A	53.5	Low	73.9	Confident	17 Å²	17	98.8 Å²	98.8	14%	0.14	46%	0.459	C	S	.	.	S	Bend	trans	-65.1	138.3	179.5	0	0	0	0	0	111.4	T602 H607	T602-A605 WeakPolarHBondContact O-CB 3.47Å; T602-A605 PolarHBondContact O-N 3.32Å; A605-H607 PolarHBondContact O-N 3.27Å; A605-H607 VanDerWaalsContact O-N 3.15Å
606	F	60.6	Low	74.2	Confident	123 Å²	123	98.4 Å²	98.4	54%	0.539	46%	0.456	S	S	.	.			trans	-55.2	118.3	179.1	-59.5	-86.5	0	0	0	112.2	L504 P556 I608	L504-F606 HydrophobicContact CD2-CE1 4.08Å; L504-F606 HydrophobicContact CD2-CZ 3.9Å; P556-F606 HydrophobicContact CB-CB 3.34Å; P556-F606 HydrophobicContact CB-CD1 3.83Å; P556-F606 HydrophobicContact CB-CD2 3.37Å; P556-F606 HydrophobicContact CB-CE1 4.45Å; P556-F606 HydrophobicContact CB-CE2 4.07Å; P556-F606 HydrophobicContact CB-CG 3.23Å; P556-F606 HydrophobicContact CG-CB 4.02Å; P556-F606 HydrophobicContact CG-CD1 3.46Å; P556-F606 VanDerWaalsContact CG-CD1 3.46Å; P556-F606 HydrophobicContact CG-CD2 3.52Å; P556-F606 HydrophobicContact CG-CE1 3.67Å; P556-F606 HydrophobicContact CG-CE2 3.73Å; P556-F606 HydrophobicContact CG-CG 3.38Å; P556-F606 HydrophobicContact CG-CZ 3.8Å; F606-I608 PolarHBondContact O-N 3.31Å
607	H	66.4	Low	74.5	Confident	137 Å²	137	97 Å²	97	63%	0.634	45%	0.45	S	S	*	.			trans	-71.2	114.4	177.8	-66.8	-67.8	0	0	0	111.3	E599 A605	E599-H607 IonicContact OE1-CE1 3.26Å; E599-H607 IonicContact OE1-CG 2.78Å; E599-H607 IonicContact OE1-ND1 2.79Å; E599-H607 PolarHBondContact OE1-ND1 2.65Å; A605-H607 PolarHBondContact O-N 3.27Å; A605-H607 VanDerWaalsContact O-N 3.15Å
608	I	78.3	Confident	74.7	Confident	17 Å²	17	91.1 Å²	91.1	9%	0.087	43%	0.428	C	S	.	.			trans	-74.9	138.5	164.8	-62	-174.7	0	0	0	108.3	F550 V558 L592 A595 F606 R610 T612 F613	F550-I608 HydrophobicContact CD2-CD1 4.44Å; F550-I608 HydrophobicContact CE2-CD1 4.28Å; V558-I608 HydrophobicContact CB-CD1 4.32Å; V558-I608 HydrophobicContact CG2-CD1 3.7Å; L592-I608 HydrophobicContact CD2-CD1 4.3Å; L592-I608 HydrophobicContact CD2-CG2 4.2Å; A595-I608 HydrophobicContact CB-CD1 3.26Å; A595-I608 HydrophobicContact CB-CG1 4.22Å; F606-I608 PolarHBondContact O-N 3.31Å; I608-R610 PolarHBondContact O-N 3.07Å; I608-T612 HydrophobicContact CG2-CG2 4.21Å; I608-F613 HydrophobicContact CB-CE2 3.99Å; I608-F613 HydrophobicContact CG2-CD2 4.32Å; I608-F613 HydrophobicContact CG2-CE2 3.88Å
609	S	81.1	Confident	75.3	Confident	59 Å²	59	86.8 Å²	86.8	41%	0.413	41%	0.408	S	S	.	.			trans	-60.9	138.8	-177.5	91.1	0	0	0	0	111.7	Q611 T612 F613	S609-Q611 PolarHBondContact O-N 2.71Å; S609-Q611 VanDerWaalsContact O-N 3.16Å; S609-Q611 PolarHBondContact OG-N 3.39Å; S609-T612 WeakPolarHBondContact O-CB 3.43Å; S609-T612 PolarHBondContact O-N 3.06Å; S609-T612 VanDerWaalsContact O-N 3.13Å; S609-T612 PolarHBondContact OG-N 3.01Å; S609-T612 PolarHBondContact OG-OG1 3.04Å; S609-F613 WeakPolarHBondContact O-CD2 3.49Å
610	R	83.4	Confident	76.1	Confident	202 Å²	202	83.5 Å²	83.5	76%	0.762	39%	0.392	S	S	*	.	H	α-helix	trans	-59.5	-25.7	172.6	-70.2	-176.1	179	-175.2	-0.5	112.3	I608 F613 R614	I608-R610 PolarHBondContact O-N 3.07Å; R610-F613 PolarHBondContact O-N 3.32Å; R610-R614 WeakPolarHBondContact O-CG 3.26Å; R610-R614 PolarHBondContact O-N 3.3Å
611	Q	85.8	Confident	77	Confident	124 Å²	124	77.3 Å²	77.3	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-65.4	-44	176.3	-179.2	174.2	-13	0	0	111.4	S609 F613 R614 E615	S609-Q611 PolarHBondContact O-N 2.71Å; S609-Q611 VanDerWaalsContact O-N 3.16Å; S609-Q611 PolarHBondContact OG-N 3.39Å; Q611-F613 VanDerWaalsContact C-N 3.29Å; Q611-F613 PolarHBondContact O-N 2.93Å; Q611-R614 WeakPolarHBondContact O-CB 3.35Å; Q611-R614 PolarHBondContact O-N 3.34Å; Q611-E615 HydrophobicContact CG-CG 4.39Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.49Å; Q611-E615 PolarHBondContact NE2-OE1 2.93Å; Q611-E615 WeakPolarHBondContact O-CG 3.31Å; Q611-E615 PolarHBondContact O-N 3.35Å
612	T	87.1	Confident	78	Confident	15 Å²	15	71.3 Å²	71.3	9%	0.092	33%	0.332	C	S	.	.	H	α-helix	trans	-56.7	-42.2	176.3	-50.1	0	0	0	0	111.7	V558 M560 L592 I608 S609 E615 F616	V558-T612 HydrophobicContact CB-CG2 4.25Å; V558-T612 HydrophobicContact CG1-CG2 3.93Å; M560-T612 HydrophobicContact CG-CG2 4.02Å; M560-T612 HydrophobicContact SD-CG2 4.39Å; L592-T612 HydrophobicContact CD2-CG2 4.29Å; I608-T612 HydrophobicContact CG2-CG2 4.21Å; S609-T612 WeakPolarHBondContact O-CB 3.43Å; S609-T612 PolarHBondContact O-N 3.06Å; S609-T612 VanDerWaalsContact O-N 3.13Å; S609-T612 PolarHBondContact OG-N 3.01Å; S609-T612 PolarHBondContact OG-OG1 3.04Å; T612-E615 PolarHBondContact O-N 3.43Å; T612-F616 WeakPolarHBondContact O-CB 3.45Å; T612-F616 PolarHBondContact O-N 2.55Å
613	F	87.6	Confident	79.5	Confident	15 Å²	15	68 Å²	68	7%	0.066	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-38.4	175.4	-75.1	-81.6	0	0	0	112.9	L592 I608 S609 R610 Q611 N617 L748 L749	L592-F613 HydrophobicContact CB-CD1 4.36Å; L592-F613 HydrophobicContact CB-CE1 3.82Å; L592-F613 HydrophobicContact CD2-CD1 4.16Å; L592-F613 HydrophobicContact CD2-CE1 3.86Å; L592-F613 HydrophobicContact CD2-CE2 4.45Å; L592-F613 HydrophobicContact CD2-CZ 4.02Å; L592-F613 HydrophobicContact CG-CE1 4.34Å; I608-F613 HydrophobicContact CB-CE2 3.99Å; I608-F613 HydrophobicContact CG2-CD2 4.32Å; I608-F613 HydrophobicContact CG2-CE2 3.88Å; S609-F613 WeakPolarHBondContact O-CD2 3.49Å; R610-F613 PolarHBondContact O-N 3.32Å; Q611-F613 VanDerWaalsContact C-N 3.29Å; Q611-F613 PolarHBondContact O-N 2.93Å; F613-N617 WeakPolarHBondContact O-CB 3.41Å; F613-N617 VanDerWaalsContact O-CG 3.23Å; F613-N617 PolarHBondContact O-N 3.43Å; F613-N617 PolarHBondContact O-ND2 3.44Å; F613-N617 VanDerWaalsContact O-ND2 3.09Å; F613-L748 HydrophobicContact CD1-CB 4.14Å; F613-L748 HydrophobicContact CD1-CD1 4.39Å; F613-L749 HydrophobicContact CB-CD2 4.05Å
614	R	88.6	Confident	81.4	Confident	162 Å²	162	58.7 Å²	58.7	61%	0.611	27%	0.268	S	S	*	.	H	α-helix	trans	-65.4	-46.6	176.3	-72.7	174.7	178.2	-179.1	-1.6	111.3	R610 Q611 N617 R618 L749	R610-R614 WeakPolarHBondContact O-CG 3.26Å; R610-R614 PolarHBondContact O-N 3.3Å; Q611-R614 WeakPolarHBondContact O-CB 3.35Å; Q611-R614 PolarHBondContact O-N 3.34Å; R614-N617 PolarHBondContact O-N 3.13Å; R614-R618 WeakPolarHBondContact O-CB 3.47Å; R614-R618 PolarHBondContact O-N 3.35Å; R614-L749 HydrophobicContact CG-CD1 3.87Å; R614-L749 HydrophobicContact CG-CD2 4.39Å
615	E	88.6	Confident	83.2	Confident	61 Å²	61	51.1 Å²	51.1	29%	0.285	23%	0.234	S	C	.	.	H	α-helix	trans	-60.3	-47.1	177	-71.8	173.8	-171.3	0	0	111.4	M560 Q611 T612 R618 Y619	M560-E615 HydrophobicContact CG-CB 4.24Å; Q611-E615 HydrophobicContact CG-CG 4.39Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.49Å; Q611-E615 PolarHBondContact NE2-OE1 2.93Å; Q611-E615 WeakPolarHBondContact O-CG 3.31Å; Q611-E615 PolarHBondContact O-N 3.35Å; T612-E615 PolarHBondContact O-N 3.43Å; E615-R618 WeakPolarHBondContact O-CB 3.29Å; E615-R618 PolarHBondContact O-N 3.19Å; E615-Y619 PolarHBondContact O-N 2.99Å
616	F	91.1	Very high	84.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.8	-50	175.2	172.1	-94.6	0	0	0	112.8	M560 M585 K589 L592 T612 R618 Y619 Q620 L748	M560-F616 HydrophobicContact CE-CB 3.86Å; M560-F616 HydrophobicContact CE-CD2 3.84Å; M560-F616 HydrophobicContact CE-CG 4.36Å; M560-F616 HydrophobicContact SD-CB 4.08Å; M560-F616 HydrophobicContact SD-CD2 4.44Å; M585-F616 HydrophobicContact CE-CD2 3.72Å; M585-F616 HydrophobicContact CE-CE2 3.64Å; M585-F616 WeakPolarHBondContact O-CE2 3.48Å; K589-F616 HydrophobicContact CB-CE1 4.45Å; K589-F616 HydrophobicContact CB-CE2 4.16Å; K589-F616 HydrophobicContact CB-CZ 3.59Å; K589-F616 HydrophobicContact CG-CE1 4.39Å; K589-F616 HydrophobicContact CG-CZ 3.93Å; L592-F616 HydrophobicContact CD1-CB 3.56Å; L592-F616 HydrophobicContact CD1-CD1 3.76Å; L592-F616 HydrophobicContact CD1-CD2 3.75Å; L592-F616 HydrophobicContact CD1-CE1 4.45Å; L592-F616 HydrophobicContact CD1-CE2 4.45Å; L592-F616 HydrophobicContact CD1-CG 3.37Å; T612-F616 WeakPolarHBondContact O-CB 3.45Å; T612-F616 PolarHBondContact O-N 2.55Å; F616-R618 PolarHBondContact O-N 3.44Å; F616-Y619 PolarHBondContact O-N 3.19Å; F616-Q620 HydrophobicContact CE1-CB 4.36Å; F616-Q620 HydrophobicContact CZ-CB 4.35Å; F616-Q620 HydrophobicContact CZ-CG 4.46Å; F616-Q620 WeakPolarHBondContact O-CB 3.27Å; F616-Q620 PolarHBondContact O-N 2.9Å; F616-L748 HydrophobicContact CD1-CD1 3.78Å; F616-L748 HydrophobicContact CE1-CD1 3.59Å
617	N	90.1	Very high	85.9	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-37.7	179.2	-73.9	-33.2	0	0	0	111	F613 R614 Q620 V621 L748 L749	F613-N617 WeakPolarHBondContact O-CB 3.41Å; F613-N617 VanDerWaalsContact O-CG 3.23Å; F613-N617 PolarHBondContact O-N 3.43Å; F613-N617 PolarHBondContact O-ND2 3.44Å; F613-N617 VanDerWaalsContact O-ND2 3.09Å; R614-N617 PolarHBondContact O-N 3.13Å; N617-Q620 PolarHBondContact O-N 3.24Å; N617-V621 WeakPolarHBondContact O-CB 3.33Å; N617-V621 VanDerWaalsContact O-CG2 3.24Å; N617-V621 WeakPolarHBondContact O-CG2 3.24Å; N617-V621 PolarHBondContact O-N 3.16Å; N617-L748 PolarHBondContact OD1-N 3.48Å; N617-L749 VanDerWaalsContact ND2-CD1 3.34Å; N617-L749 WeakPolarHBondContact ND2-CD1 3.34Å; N617-L749 WeakPolarHBondContact ND2-CG 3.13Å
618	R	87.2	Confident	86.7	Confident	50 Å²	50	39.7 Å²	39.7	19%	0.189	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-49.1	176.5	-163.6	-170.1	90.7	-174.4	21.5	112	Y567 R614 E615 F616 V621 F622 E638	Y567-R618 PolarHBondContact OH-NH2 3.03Å; R614-R618 WeakPolarHBondContact O-CB 3.47Å; R614-R618 PolarHBondContact O-N 3.35Å; E615-R618 WeakPolarHBondContact O-CB 3.29Å; E615-R618 PolarHBondContact O-N 3.19Å; F616-R618 PolarHBondContact O-N 3.44Å; R618-V621 PolarHBondContact O-N 3.08Å; R618-F622 WeakPolarHBondContact O-CB 3.39Å; R618-F622 PolarHBondContact O-N 3.42Å; R618-E638 IonicContact CZ-OE1 3.73Å; R618-E638 IonicContact CZ-OE2 3.87Å; R618-E638 IonicContact NH1-OE1 2.69Å; R618-E638 PolarHBondContact NH1-OE1 3.01Å; R618-E638 IonicContact NH1-OE2 2.76Å; R618-E638 PolarHBondContact NH1-OE2 3.36Å; R618-E638 IonicContact NH2-OE1 3.96Å; R618-E638 IonicContact NH2-OE2 2.63Å; R618-E638 PolarHBondContact NH2-OE2 3.06Å
619	Y	90.3	Very high	86.9	Confident	5 Å²	5	41.3 Å²	41.3	2%	0.02	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-40.3	177.1	-71.7	-14.3	0	0	0	112.6	M560 P561 P563 F566 M585 E615 F616 F622 L623	M560-Y619 HydrophobicContact CB-CE2 4.4Å; M560-Y619 HydrophobicContact CE-CD2 3.79Å; M560-Y619 HydrophobicContact CE-CE2 4.26Å; P561-Y619 HydrophobicContact CG-CE2 4.3Å; P561-Y619 VanDerWaalsContact O-CE2 3.29Å; P561-Y619 WeakPolarHBondContact O-CE2 3.19Å; P561-Y619 PolarHBondContact O-OH 3.21Å; P563-Y619 WeakPolarHBondContact CD-OH 3.39Å; F566-Y619 HydrophobicContact CB-CE1 4.27Å; F566-Y619 HydrophobicContact CB-CE2 4.2Å; F566-Y619 AromaticContact CD1-CD1 3.66Å; F566-Y619 HydrophobicContact CD1-CD1 3.66Å; F566-Y619 AromaticContact CD1-CE1 3.75Å; F566-Y619 HydrophobicContact CD1-CE1 3.75Å; F566-Y619 HydrophobicContact CD1-CG 4.14Å; F566-Y619 HydrophobicContact CD2-CD1 4.1Å; F566-Y619 AromaticContact CD2-CD2 3.72Å; F566-Y619 HydrophobicContact CD2-CD2 3.72Å; F566-Y619 HydrophobicContact CD2-CE1 4.44Å; F566-Y619 HydrophobicContact CD2-CE2 4.08Å; F566-Y619 AromaticContact CD2-CG 3.73Å; F566-Y619 HydrophobicContact CD2-CG 3.73Å; F566-Y619 AromaticContact CE1-CD1 3.62Å; F566-Y619 HydrophobicContact CE1-CD1 3.62Å; F566-Y619 HydrophobicContact CE1-CE1 4.19Å; F566-Y619 HydrophobicContact CE1-CG 4.01Å; F566-Y619 VanDerWaalsContact CE2-CB 3.49Å; F566-Y619 HydrophobicContact CE2-CD1 4.09Å; F566-Y619 AromaticContact CE2-CD2 3.97Å; F566-Y619 HydrophobicContact CE2-CD2 3.97Å; F566-Y619 AromaticContact CE2-CG 3.6Å; F566-Y619 HydrophobicContact CE2-CG 3.6Å; F566-Y619 AromaticContact CG-CD1 3.9Å; F566-Y619 HydrophobicContact CG-CD1 3.9Å; F566-Y619 HydrophobicContact CG-CD2 4.1Å; F566-Y619 AromaticContact CG-CE1 3.89Å; F566-Y619 HydrophobicContact CG-CE1 3.89Å; F566-Y619 HydrophobicContact CG-CE2 4.09Å; F566-Y619 HydrophobicContact CG-CG 4.01Å; F566-Y619 AromaticContact CG-CZ 3.98Å; F566-Y619 AromaticContact CZ-CD1 3.83Å; F566-Y619 HydrophobicContact CZ-CD1 3.83Å; F566-Y619 AromaticContact CZ-CG 3.73Å; F566-Y619 HydrophobicContact CZ-CG 3.73Å; M585-Y619 HydrophobicContact SD-CD2 4.38Å; E615-Y619 PolarHBondContact O-N 2.99Å; F616-Y619 PolarHBondContact O-N 3.19Å; Y619-F622 PolarHBondContact O-N 3.4Å; Y619-L623 PolarHBondContact O-N 3.49Å
620	Q	89.1	Confident	86.8	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-63	-46.7	177.5	-168.1	-168.5	-75.2	0	0	111.2	F616 N617 F622 L623 V624 F713 N717	F616-Q620 HydrophobicContact CE1-CB 4.36Å; F616-Q620 HydrophobicContact CZ-CB 4.35Å; F616-Q620 HydrophobicContact CZ-CG 4.46Å; F616-Q620 WeakPolarHBondContact O-CB 3.27Å; F616-Q620 PolarHBondContact O-N 2.9Å; N617-Q620 PolarHBondContact O-N 3.24Å; Q620-F622 VanDerWaalsContact C-N 3.33Å; Q620-F622 PolarHBondContact O-N 2.96Å; Q620-L623 PolarHBondContact O-N 3.03Å; Q620-V624 WeakPolarHBondContact O-CG2 3.44Å; Q620-V624 PolarHBondContact O-N 2.65Å; Q620-V624 VanDerWaalsContact O-N 3.08Å; Q620-F713 HydrophobicContact CG-CZ 4.46Å; Q620-N717 PolarHBondContact NE2-OD1 3.06Å; Q620-N717 PolarHBondContact OE1-OD1 3.49Å
621	V	88.2	Confident	86.5	Confident	36 Å²	36	33.2 Å²	33.2	22%	0.218	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-43.1	177	169.9	0	0	0	0	110.5	N617 R618 V624 N625 Y634	N617-V621 WeakPolarHBondContact O-CB 3.33Å; N617-V621 VanDerWaalsContact O-CG2 3.24Å; N617-V621 WeakPolarHBondContact O-CG2 3.24Å; N617-V621 PolarHBondContact O-N 3.16Å; R618-V621 PolarHBondContact O-N 3.08Å; V621-V624 PolarHBondContact O-N 3.44Å; V621-N625 VanDerWaalsContact CG1-ND2 3.34Å; V621-N625 WeakPolarHBondContact CG1-ND2 3.47Å; V621-N625 VanDerWaalsContact O-CB 3.23Å; V621-N625 WeakPolarHBondContact O-CB 3.39Å; V621-N625 VanDerWaalsContact O-CG 3.24Å; V621-N625 PolarHBondContact O-N 3.14Å; V621-N625 PolarHBondContact O-ND2 3.03Å; V621-Y634 HydrophobicContact CG1-CD2 4.46Å; V621-Y634 HydrophobicContact CG1-CE2 3.85Å
622	F	88.1	Confident	85.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.5	-51.4	177.2	-176.8	-95.5	0	0	0	112.4	F566 Y567 F570 F571 R618 Y619 Q620 V624 N625 C626 Y634	F566-F622 AromaticContact CE1-CD1 3.71Å; F566-F622 HydrophobicContact CE1-CD1 3.71Å; F566-F622 HydrophobicContact CE1-CE1 4.28Å; F566-F622 HydrophobicContact CE1-CG 4.39Å; F566-F622 HydrophobicContact CZ-CD1 4.1Å; Y567-F622 HydrophobicContact CD1-CD1 4.44Å; Y567-F622 AromaticContact CD1-CE1 3.9Å; Y567-F622 HydrophobicContact CD1-CE1 3.9Å; Y567-F622 AromaticContact CD1-CZ 3.97Å; Y567-F622 HydrophobicContact CD1-CZ 3.97Å; Y567-F622 AromaticContact CE1-CD1 3.99Å; Y567-F622 HydrophobicContact CE1-CD1 3.99Å; Y567-F622 HydrophobicContact CE1-CD2 4.15Å; Y567-F622 AromaticContact CE1-CE1 3.79Å; Y567-F622 HydrophobicContact CE1-CE1 3.79Å; Y567-F622 AromaticContact CE1-CE2 3.96Å; Y567-F622 HydrophobicContact CE1-CE2 3.96Å; Y567-F622 HydrophobicContact CE1-CG 4.16Å; Y567-F622 AromaticContact CE1-CZ 3.78Å; Y567-F622 HydrophobicContact CE1-CZ 3.78Å; F570-F622 AromaticContact CD1-CE1 3.62Å; F570-F622 HydrophobicContact CD1-CE1 3.62Å; F570-F622 HydrophobicContact CD1-CZ 4.17Å; F570-F622 AromaticContact CE1-CE1 3.86Å; F570-F622 HydrophobicContact CE1-CE1 3.86Å; F570-F622 HydrophobicContact CE1-CZ 4.19Å; F570-F622 AromaticContact CG-CE1 4Å; F570-F622 HydrophobicContact CG-CE1 4Å; F570-F622 HydrophobicContact CZ-CE1 4.42Å; F571-F622 HydrophobicContact CZ-CZ 4.12Å; R618-F622 WeakPolarHBondContact O-CB 3.39Å; R618-F622 PolarHBondContact O-N 3.42Å; Y619-F622 PolarHBondContact O-N 3.4Å; Q620-F622 VanDerWaalsContact C-N 3.33Å; Q620-F622 PolarHBondContact O-N 2.96Å; F622-V624 PolarHBondContact O-N 3Å; F622-N625 PolarHBondContact O-N 2.91Å; F622-C626 WeakPolarHBondContact O-CB 3.41Å; F622-C626 PolarHBondContact O-N 3.47Å; F622-C626 PolarHBondContact O-SG 3.44Å; F622-Y634 VanDerWaalsContact CA-OH 3.29Å; F622-Y634 WeakPolarHBondContact CA-OH 3.39Å; F622-Y634 VanDerWaalsContact CB-OH 3.31Å; F622-Y634 WeakPolarHBondContact CB-OH 3.38Å; F622-Y634 HydrophobicContact CD2-CE1 4.01Å; F622-Y634 PolarHBondContact N-OH 3.14Å
623	L	88.9	Confident	84.6	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-60.7	-46.5	-180	-79.6	170.9	0	0	0	112.3	F566 F570 L581 M585 Y619 Q620 C626 L627 F713	F566-L623 HydrophobicContact CE2-CD1 3.98Å; F566-L623 HydrophobicContact CE2-CG 4.22Å; F566-L623 HydrophobicContact CZ-CD1 4.13Å; F566-L623 HydrophobicContact CZ-CD2 4.41Å; F566-L623 HydrophobicContact CZ-CG 3.87Å; F570-L623 HydrophobicContact CD2-CD2 3.41Å; F570-L623 VanDerWaalsContact CD2-CD2 3.41Å; F570-L623 HydrophobicContact CE2-CD2 3.88Å; F570-L623 HydrophobicContact CG-CD2 4.34Å; L581-L623 HydrophobicContact CD2-CD2 4.07Å; M585-L623 HydrophobicContact CB-CD1 4.18Å; M585-L623 HydrophobicContact CG-CD1 3.67Å; Y619-L623 PolarHBondContact O-N 3.49Å; Q620-L623 PolarHBondContact O-N 3.03Å; L623-C626 PolarHBondContact O-N 2.94Å; L623-L627 HydrophobicContact CD2-CD1 4.24Å; L623-L627 VanDerWaalsContact O-CB 3.28Å; L623-L627 WeakPolarHBondContact O-CB 3.42Å; L623-L627 WeakPolarHBondContact O-CG 3.16Å; L623-L627 PolarHBondContact O-N 3.5Å; L623-F713 HydrophobicContact CB-CE1 4.15Å; L623-F713 HydrophobicContact CB-CZ 3.82Å; L623-F713 HydrophobicContact CD1-CE2 4.19Å; L623-F713 HydrophobicContact CD1-CZ 4Å
624	V	87.6	Confident	83.5	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.036	15%	0.149	C	C	.	.	H	α-helix	trans	-65.2	-42.4	179.7	174.4	0	0	0	0	110.6	Q620 V621 F622 C626 W628 N629 F713 N717 I744	Q620-V624 WeakPolarHBondContact O-CG2 3.44Å; Q620-V624 PolarHBondContact O-N 2.65Å; Q620-V624 VanDerWaalsContact O-N 3.08Å; V621-V624 PolarHBondContact O-N 3.44Å; F622-V624 PolarHBondContact O-N 3Å; V624-C626 PolarHBondContact O-N 3.46Å; V624-W628 HydrophobicContact CG1-CB 4.45Å; V624-W628 WeakPolarHBondContact O-CA 3.38Å; V624-W628 VanDerWaalsContact O-CB 3.24Å; V624-W628 WeakPolarHBondContact O-CB 3.44Å; V624-W628 PolarHBondContact O-N 3.44Å; V624-N629 PolarHBondContact O-N 2.77Å; V624-F713 HydrophobicContact CG2-CE1 4.07Å; V624-F713 HydrophobicContact CG2-CZ 4.07Å; V624-N717 HydrophobicContact CG2-CB 4.35Å; V624-I744 HydrophobicContact CG1-CD1 4.14Å; V624-I744 HydrophobicContact CG1-CG1 4.19Å
625	N	85.6	Confident	81.8	Confident	22 Å²	22	28.1 Å²	28.1	12%	0.118	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-40	-179.8	-77.1	-15.5	0	0	0	112.7	V621 F622 N629 S630 N631 Y634	V621-N625 VanDerWaalsContact CG1-ND2 3.34Å; V621-N625 WeakPolarHBondContact CG1-ND2 3.47Å; V621-N625 VanDerWaalsContact O-CB 3.23Å; V621-N625 WeakPolarHBondContact O-CB 3.39Å; V621-N625 VanDerWaalsContact O-CG 3.24Å; V621-N625 PolarHBondContact O-N 3.14Å; V621-N625 PolarHBondContact O-ND2 3.03Å; F622-N625 PolarHBondContact O-N 2.91Å; N625-N629 CarbonylContact O-C 3.52Å; N625-N629 PolarHBondContact O-N 3.48Å; N625-N629 PolarHBondContact OD1-ND2 2.74Å; N625-S630 PolarHBondContact O-N 3.19Å; N625-S630 VanDerWaalsContact O-N 3.14Å; N625-N631 CarbonylContact C-O 3.47Å; N625-N631 WeakPolarHBondContact CB-O 3.29Å; N625-N631 PolarHBondContact O-N 3.37Å; N625-Y634 HydrophobicContact CB-CD1 4.08Å; N625-Y634 HydrophobicContact CB-CE1 4.13Å; N625-Y634 WeakPolarHBondContact ND2-CD1 3.4Å
626	C	85.9	Confident	80.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.9	-53.7	179.1	-59.4	0	0	0	0	111.9	F570 F622 L623 V624 F658 D659	F570-C626 HydrophobicContact CE1-CB 4.07Å; F570-C626 HydrophobicContact CE2-CB 4.1Å; F570-C626 HydrophobicContact CZ-CB 3.38Å; F622-C626 WeakPolarHBondContact O-CB 3.41Å; F622-C626 PolarHBondContact O-N 3.47Å; F622-C626 PolarHBondContact O-SG 3.44Å; L623-C626 PolarHBondContact O-N 2.94Å; V624-C626 PolarHBondContact O-N 3.46Å; C626-F658 CarbonylContact C-O 3.54Å; C626-F658 HydrophobicContact CB-CB 4.4Å; C626-F658 CarbonylContact O-C 3.31Å; C626-F658 VanDerWaalsContact O-O 3.08Å; C626-D659 WeakPolarHBondContact O-CA 3.29Å; C626-D659 PolarHBondContact O-N 3.18Å
627	L	85.9	Confident	78.7	Confident	2 Å²	2	33 Å²	33	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-71.6	-36.3	-173.8	-66.1	176	0	0	0	113.3	F570 L623 L660 L710	F570-L627 HydrophobicContact CE2-CD1 4.49Å; F570-L627 HydrophobicContact CE2-CD2 3.78Å; F570-L627 HydrophobicContact CE2-CG 3.89Å; F570-L627 HydrophobicContact CZ-CD2 4.41Å; L623-L627 HydrophobicContact CD2-CD1 4.24Å; L623-L627 VanDerWaalsContact O-CB 3.28Å; L623-L627 WeakPolarHBondContact O-CB 3.42Å; L623-L627 WeakPolarHBondContact O-CG 3.16Å; L623-L627 PolarHBondContact O-N 3.5Å; L627-L660 HydrophobicContact CB-CD2 4.45Å; L627-L660 HydrophobicContact CB-CG 4.18Å; L627-L660 HydrophobicContact CD2-CD2 4.11Å; L627-L660 PolarHBondContact O-N 2.9Å; L627-L660 VanDerWaalsContact O-N 3.09Å; L627-L710 HydrophobicContact CD1-CD1 4.25Å
628	W	83.3	Confident	77	Confident	35 Å²	35	38.4 Å²	38.4	13%	0.133	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-46.2	-170.6	-164.7	-89.9	0	0	0	113.9	V624 S630 L660 W695 L699 L714 I718 V722 M723	V624-W628 HydrophobicContact CG1-CB 4.45Å; V624-W628 WeakPolarHBondContact O-CA 3.38Å; V624-W628 VanDerWaalsContact O-CB 3.24Å; V624-W628 WeakPolarHBondContact O-CB 3.44Å; V624-W628 PolarHBondContact O-N 3.44Å; W628-S630 VanDerWaalsContact C-N 3.32Å; W628-L660 HydrophobicContact CE3-CD1 4.18Å; W628-L660 HydrophobicContact CZ3-CD1 4.46Å; W628-W695 HydrophobicContact CD2-CZ2 4.36Å; W628-W695 AromaticContact CE3-CZ2 3.84Å; W628-W695 HydrophobicContact CE3-CZ2 3.84Å; W628-W695 AromaticContact CH2-CZ2 3.95Å; W628-W695 HydrophobicContact CH2-CZ2 3.95Å; W628-W695 AromaticContact CH2-NE1 3.45Å; W628-W695 HydrophobicContact CZ2-CZ2 4.42Å; W628-W695 AromaticContact CZ2-NE1 3.73Å; W628-W695 AromaticContact CZ3-CZ2 3.63Å; W628-W695 HydrophobicContact CZ3-CZ2 3.63Å; W628-L699 HydrophobicContact CH2-CD1 3.63Å; W628-L699 HydrophobicContact CZ3-CD1 3.77Å; W628-L699 HydrophobicContact CZ3-CD2 4.16Å; W628-L714 HydrophobicContact CE3-CD2 3.9Å; W628-L714 HydrophobicContact CZ3-CD1 4.34Å; W628-L714 HydrophobicContact CZ3-CD2 4.27Å; W628-I718 HydrophobicContact CB-CD1 4.23Å; W628-I718 HydrophobicContact CD2-CD1 3.32Å; W628-I718 HydrophobicContact CE3-CD1 3.42Å; W628-I718 VanDerWaalsContact CE3-CD1 3.42Å; W628-I718 HydrophobicContact CG-CD1 3.69Å; W628-I718 HydrophobicContact CH2-CD1 4.22Å; W628-I718 HydrophobicContact CZ2-CD1 4.17Å; W628-I718 HydrophobicContact CZ2-CG2 4.15Å; W628-I718 HydrophobicContact CZ3-CD1 3.88Å; W628-V722 HydrophobicContact CZ2-CG1 3.97Å; W628-M723 HydrophobicContact CH2-CE 4.44Å
629	N	81.1	Confident	75.7	Confident	51 Å²	51	38.2 Å²	38.2	27%	0.273	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.8	-175.6	-59.2	-32.9	0	0	0	113.5	V624 N625 N631 P742	V624-N629 PolarHBondContact O-N 2.77Å; N625-N629 CarbonylContact O-C 3.52Å; N625-N629 PolarHBondContact O-N 3.48Å; N625-N629 PolarHBondContact OD1-ND2 2.74Å; N629-N631 PolarHBondContact O-N 3.49Å; N629-N631 VanDerWaalsContact O-N 3.16Å; N629-P742 WeakPolarHBondContact OD1-CG 3.3Å
630	S	79.4	Confident	74.4	Confident	28 Å²	28	46.1 Å²	46.1	20%	0.196	24%	0.238	C	C	.	.			trans	51.3	36.1	-177.5	-55	0	0	0	0	113	N625 W628 S655 D659	N625-S630 PolarHBondContact O-N 3.19Å; N625-S630 VanDerWaalsContact O-N 3.14Å; W628-S630 VanDerWaalsContact C-N 3.32Å; S630-S655 CarbonylContact C-O 3.42Å; S630-S655 VanDerWaalsContact C-O 3.31Å; S630-S655 CarbonylContact O-C 3.58Å; S630-D659 WeakPolarHBondContact OG-CB 3.49Å; S630-D659 PolarHBondContact OG-OD2 2.91Å
631	N	76.8	Confident	73.2	Confident	62 Å²	62	49.6 Å²	49.6	33%	0.332	26%	0.256	S	S	.	.			trans	-134.5	96.1	-177.2	-171.2	13.5	0	0	0	112.8	N625 N629 C633	N625-N631 CarbonylContact C-O 3.47Å; N625-N631 WeakPolarHBondContact CB-O 3.29Å; N625-N631 PolarHBondContact O-N 3.37Å; N629-N631 PolarHBondContact O-N 3.49Å; N629-N631 VanDerWaalsContact O-N 3.16Å; N631-C633 PolarHBondContact OD1-N 3.3Å; N631-C633 PolarHBondContact OD1-O 3.26Å
632	M	70.4	Confident	72.3	Confident	10 Å²	10	50.5 Å²	50.5	5%	0.049	26%	0.264	C	S	.	.			trans	-75.5	-26.7	171.8	-169.8	-179.2	174	0	0	113.4	F571 Y634 S655 F658	F571-M632 HydrophobicContact CE1-CE 3.98Å; F571-M632 HydrophobicContact CZ-CE 3.6Å; M632-Y634 PolarHBondContact O-N 3.35Å; M632-S655 PolarHBondContact N-O 2.82Å; M632-F658 HydrophobicContact SD-CD2 3.75Å; M632-F658 HydrophobicContact SD-CE2 3.75Å
633	C	62	Low	71.4	Confident	70 Å²	70	56.7 Å²	56.7	47%	0.473	30%	0.297	S	S	.	.			trans	-99.4	81.1	-174.8	-70.6	0	0	0	0	111.1	N631 F654	N631-C633 PolarHBondContact OD1-N 3.3Å; N631-C633 PolarHBondContact OD1-O 3.26Å; C633-F654 WeakPolarHBondContact SG-CE2 3.39Å; C633-F654 WeakPolarHBondContact SG-CZ 3.41Å
634	Y	65.3	Low	70.5	Confident	19 Å²	19	63.8 Å²	63.8	8%	0.075	33%	0.33	C	S	.	.			trans	-112.2	154.4	170.4	65.9	-86.1	0	0	0	111.2	V621 F622 N625 M632 E636 A637	V621-Y634 HydrophobicContact CG1-CD2 4.46Å; V621-Y634 HydrophobicContact CG1-CE2 3.85Å; F622-Y634 VanDerWaalsContact CA-OH 3.29Å; F622-Y634 WeakPolarHBondContact CA-OH 3.39Å; F622-Y634 VanDerWaalsContact CB-OH 3.31Å; F622-Y634 WeakPolarHBondContact CB-OH 3.38Å; F622-Y634 HydrophobicContact CD2-CE1 4.01Å; F622-Y634 PolarHBondContact N-OH 3.14Å; N625-Y634 HydrophobicContact CB-CD1 4.08Å; N625-Y634 HydrophobicContact CB-CE1 4.13Å; N625-Y634 WeakPolarHBondContact ND2-CD1 3.4Å; M632-Y634 PolarHBondContact O-N 3.35Å; Y634-E636 HydrophobicContact CD2-CB 4.05Å; Y634-E636 HydrophobicContact CE2-CB 3.92Å; Y634-E636 PolarHBondContact O-N 3.4Å; Y634-A637 HydrophobicContact CD1-CB 4.21Å; Y634-A637 HydrophobicContact CE1-CB 4Å; Y634-A637 HydrophobicContact CE2-CB 4.33Å; Y634-A637 HydrophobicContact CG-CB 4.46Å; Y634-A637 WeakPolarHBondContact O-CB 3.29Å; Y634-A637 PolarHBondContact O-N 2.91Å
635	P	53.5	Low	69.7	Low	111 Å²	111	68 Å²	68	72%	0.721	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.9	-168.2	-27.3	34.8	0	0	0	115	R640	P635-R640 PolarHBondContact O-NH2 3.48Å
636	E	56.4	Low	69.1	Low	154 Å²	154	68.2 Å²	68.2	72%	0.72	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	10.1	-176.2	-60.8	176.2	168.6	0	0	114	Y634 E638	Y634-E636 HydrophobicContact CD2-CB 4.05Å; Y634-E636 HydrophobicContact CE2-CB 3.92Å; Y634-E636 PolarHBondContact O-N 3.4Å; E636-E638 PolarHBondContact O-N 3.49Å
637	A	58	Low	68.5	Low	10 Å²	10	72 Å²	72	8%	0.083	38%	0.384	C	S	.	.			trans	-72.8	123.9	178.1	0	0	0	0	0	111.3	Y634	Y634-A637 HydrophobicContact CD1-CB 4.21Å; Y634-A637 HydrophobicContact CE1-CB 4Å; Y634-A637 HydrophobicContact CE2-CB 4.33Å; Y634-A637 HydrophobicContact CG-CB 4.46Å; Y634-A637 WeakPolarHBondContact O-CB 3.29Å; Y634-A637 PolarHBondContact O-N 2.91Å
638	E	53.7	Low	68	Low	125 Å²	125	79 Å²	79	58%	0.584	42%	0.417	S	S	*	.	S	Bend	trans	-76.4	-33.2	177.6	-113.1	-171.7	-147.6	0	0	113.1	R618 E636 R640	R618-E638 IonicContact CZ-OE1 3.73Å; R618-E638 IonicContact CZ-OE2 3.87Å; R618-E638 IonicContact NH1-OE1 2.69Å; R618-E638 PolarHBondContact NH1-OE1 3.01Å; R618-E638 IonicContact NH1-OE2 2.76Å; R618-E638 PolarHBondContact NH1-OE2 3.36Å; R618-E638 IonicContact NH2-OE1 3.96Å; R618-E638 IonicContact NH2-OE2 2.63Å; R618-E638 PolarHBondContact NH2-OE2 3.06Å; E636-E638 PolarHBondContact O-N 3.49Å; E638-R640 VanDerWaalsContact C-N 3.31Å; E638-R640 PolarHBondContact O-N 3.38Å; E638-R640 VanDerWaalsContact O-N 3.12Å
639	V	60.6	Low	67.5	Low	46 Å²	46	80.3 Å²	80.3	28%	0.279	43%	0.432	S	S	.	.			trans	-87.4	79	174.1	-176.2	0	0	0	0	107.8	Y567	Y567-V639 HydrophobicContact CD1-CG2 3.87Å; Y567-V639 HydrophobicContact CD2-CG2 3.62Å; Y567-V639 HydrophobicContact CE1-CB 4.43Å; Y567-V639 HydrophobicContact CE1-CG2 3.66Å; Y567-V639 HydrophobicContact CE2-CG2 3.41Å; Y567-V639 VanDerWaalsContact CE2-CG2 3.41Å; Y567-V639 HydrophobicContact CG-CG2 3.85Å; Y567-V639 VanDerWaalsContact CZ-CG2 3.44Å
640	R	61.6	Low	67.2	Low	172 Å²	172	81 Å²	81	65%	0.649	45%	0.451	S	S	*	.			trans	-92.6	100.6	162.5	-72.3	-176.1	-176.4	-166	4.6	107.7	P635 E638	P635-R640 PolarHBondContact O-NH2 3.48Å; E638-R640 VanDerWaalsContact C-N 3.31Å; E638-R640 PolarHBondContact O-N 3.38Å; E638-R640 VanDerWaalsContact O-N 3.12Å
641	L	63.9	Low	66.9	Low	81 Å²	81	83 Å²	83	42%	0.424	46%	0.462	S	S	.	.			trans	-60.1	139.5	160	-72.5	158.8	0	0	0	107.1	D643 L646	L641-D643 PolarHBondContact O-N 3.09Å; L641-L646 HydrophobicContact CB-CD1 3.88Å; L641-L646 HydrophobicContact CB-CD2 3.99Å; L641-L646 HydrophobicContact CB-CG 3.73Å; L641-L646 HydrophobicContact CD1-CD2 3.82Å
642	S	69.9	Low	66.5	Low	54 Å²	54	84.2 Å²	84.2	38%	0.378	47%	0.473	S	S	.	.			trans	-60.1	139.6	177.3	59.3	0	0	0	0	109.3	E644 L645 L646	S642-E644 PolarHBondContact O-N 2.9Å; S642-L645 PolarHBondContact O-N 3.14Å; S642-L645 WeakPolarHBondContact OG-CB 3.47Å; S642-L645 WeakPolarHBondContact OG-CD1 3.41Å; S642-L645 WeakPolarHBondContact OG-CG 3.24Å; S642-L645 PolarHBondContact OG-N 2.79Å; S642-L646 PolarHBondContact O-N 3.08Å; S642-L646 VanDerWaalsContact O-N 3.07Å
643	D	68.8	Low	66.5	Low	131 Å²	131	90.6 Å²	90.6	70%	0.701	50%	0.503	S	S	*	.	H	α-helix	trans	-56.3	-28	179.7	-65.4	-34.3	0	0	0	111.2	L641 A647	L641-D643 PolarHBondContact O-N 3.09Å; D643-A647 VanDerWaalsContact O-CB 3.31Å; D643-A647 WeakPolarHBondContact O-CB 3.44Å; D643-A647 PolarHBondContact O-N 3.32Å
644	E	69.9	Low	67	Low	150 Å²	150	89.8 Å²	89.8	70%	0.701	49%	0.491	S	S	*	.	H	α-helix	trans	-64.7	-44.7	172.8	-63	176.5	-178.1	0	0	113.4	S642 A647 Q648	S642-E644 PolarHBondContact O-N 2.9Å; E644-A647 PolarHBondContact O-N 3.16Å; E644-Q648 VanDerWaalsContact O-CG 3.3Å; E644-Q648 WeakPolarHBondContact O-CG 3.46Å; E644-Q648 PolarHBondContact O-N 3.21Å; E644-Q648 VanDerWaalsContact O-N 3.13Å
645	L	72	Confident	67.2	Low	96 Å²	96	90.4 Å²	90.4	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-70.5	-35.3	177.4	-74.4	172.1	0	0	0	111.6	S642 Q648 S649	S642-L645 PolarHBondContact O-N 3.14Å; S642-L645 WeakPolarHBondContact OG-CB 3.47Å; S642-L645 WeakPolarHBondContact OG-CD1 3.41Å; S642-L645 WeakPolarHBondContact OG-CG 3.24Å; S642-L645 PolarHBondContact OG-N 2.79Å; L645-Q648 PolarHBondContact O-N 3.24Å; L645-S649 PolarHBondContact O-N 2.97Å
646	L	72.3	Confident	68.3	Low	25 Å²	25	86.8 Å²	86.8	13%	0.131	47%	0.474	C	S	.	.	H	α-helix	trans	-68.5	-39.9	175.5	-71.5	166.9	0	0	0	111.5	L641 S642 Q648 S649 F654	L641-L646 HydrophobicContact CB-CD1 3.88Å; L641-L646 HydrophobicContact CB-CD2 3.99Å; L641-L646 HydrophobicContact CB-CG 3.73Å; L641-L646 HydrophobicContact CD1-CD2 3.82Å; S642-L646 PolarHBondContact O-N 3.08Å; S642-L646 VanDerWaalsContact O-N 3.07Å; L646-Q648 VanDerWaalsContact C-N 3.29Å; L646-Q648 PolarHBondContact O-N 2.65Å; L646-S649 WeakPolarHBondContact O-CB 3.19Å; L646-S649 PolarHBondContact O-N 2.68Å; L646-S649 VanDerWaalsContact O-N 3.15Å; L646-S649 PolarHBondContact O-OG 3.28Å; L646-F654 HydrophobicContact CD1-CD2 4.26Å; L646-F654 HydrophobicContact CD1-CE1 4.17Å; L646-F654 HydrophobicContact CD1-CE2 3.64Å; L646-F654 HydrophobicContact CD1-CZ 3.6Å; L646-F654 HydrophobicContact CD2-CD2 3.92Å; L646-F654 HydrophobicContact CD2-CE2 4.15Å; L646-F654 HydrophobicContact CD2-CG 4.22Å; L646-F654 HydrophobicContact CG-CE2 4.46Å
647	A	72.6	Confident	69.4	Low	80 Å²	80	84 Å²	84	66%	0.661	46%	0.457	S	S	*	.	H	α-helix	trans	-62.8	-36.3	173.6	0	0	0	0	0	112.2	D643 E644 S649 G650	D643-A647 VanDerWaalsContact O-CB 3.31Å; D643-A647 WeakPolarHBondContact O-CB 3.44Å; D643-A647 PolarHBondContact O-N 3.32Å; E644-A647 PolarHBondContact O-N 3.16Å; A647-S649 PolarHBondContact O-N 3.22Å; A647-G650 PolarHBondContact O-N 2.88Å
648	Q	76.3	Confident	70.7	Confident	149 Å²	149	85.5 Å²	85.5	70%	0.696	46%	0.462	S	S	*	.	H	α-helix	trans	-65.7	-21.8	175.2	-73.2	173.1	18.5	0	0	113.8	E644 L645 L646 G650	E644-Q648 VanDerWaalsContact O-CG 3.3Å; E644-Q648 WeakPolarHBondContact O-CG 3.46Å; E644-Q648 PolarHBondContact O-N 3.21Å; E644-Q648 VanDerWaalsContact O-N 3.13Å; L645-Q648 PolarHBondContact O-N 3.24Å; L646-Q648 VanDerWaalsContact C-N 3.29Å; L646-Q648 PolarHBondContact O-N 2.65Å; Q648-G650 VanDerWaalsContact C-N 3.26Å; Q648-G650 PolarHBondContact O-N 3.4Å
649	S	72.8	Confident	72.3	Confident	63 Å²	63	79.8 Å²	79.8	44%	0.441	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.7	179.1	76.2	0	0	0	0	113.9	L645 L646 A647 V651	L645-S649 PolarHBondContact O-N 2.97Å; L646-S649 WeakPolarHBondContact O-CB 3.19Å; L646-S649 PolarHBondContact O-N 2.68Å; L646-S649 VanDerWaalsContact O-N 3.15Å; L646-S649 PolarHBondContact O-OG 3.28Å; A647-S649 PolarHBondContact O-N 3.22Å; S649-V651 PolarHBondContact O-N 3.13Å; S649-V651 VanDerWaalsContact O-N 3.16Å; S649-V651 PolarHBondContact OG-N 2.86Å
650	G	74.5	Confident	73.5	Confident	65 Å²	65	77.6 Å²	77.6	67%	0.67	42%	0.422	S	S	*	.			trans	67.2	7.3	-178.8	0	0	0	0	0	115.3	A647 Q648 P652	A647-G650 PolarHBondContact O-N 2.88Å; Q648-G650 VanDerWaalsContact C-N 3.26Å; Q648-G650 PolarHBondContact O-N 3.4Å; G650-P652 WeakPolarHBondContact O-CD 3.33Å
651	V	74.4	Confident	74.7	Confident	71 Å²	71	69.4 Å²	69.4	43%	0.43	39%	0.391	S	S	.	.			trans	-85.5	118.2	-177.8	-178.1	0	0	0	0	110.8	S649 Q653 R657	S649-V651 PolarHBondContact O-N 3.13Å; S649-V651 VanDerWaalsContact O-N 3.16Å; S649-V651 PolarHBondContact OG-N 2.86Å; V651-Q653 PolarHBondContact O-N 2.9Å; V651-R657 HydrophobicContact CG1-CG 3.92Å
652	P	68.3	Low	75.8	Confident	86 Å²	86	66.7 Å²	66.7	56%	0.558	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	133.4	176.5	27.4	-32.4	0	0	0	110.9	G650 R657	G650-P652 WeakPolarHBondContact O-CD 3.33Å; P652-R657 PolarHBondContact O-NE 3.14Å
653	Q	70.2	Confident	76.7	Confident	145 Å²	145	64.1 Å²	64.1	68%	0.678	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	51.8	177.8	-62.1	177.7	-18.1	0	0	113.7	V651 S655 T656	V651-Q653 PolarHBondContact O-N 2.9Å; Q653-S655 PolarHBondContact O-N 3.17Å; Q653-T656 PolarHBondContact O-N 2.88Å; Q653-T656 PolarHBondContact O-OG1 3.19Å
654	F	71.3	Confident	77.7	Confident	53 Å²	53	61 Å²	61	23%	0.232	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-50.3	-34.4	-177	72.4	-89.3	0	0	0	114.2	C633 L646 T656 R657	C633-F654 WeakPolarHBondContact SG-CE2 3.39Å; C633-F654 WeakPolarHBondContact SG-CZ 3.41Å; L646-F654 HydrophobicContact CD1-CD2 4.26Å; L646-F654 HydrophobicContact CD1-CE1 4.17Å; L646-F654 HydrophobicContact CD1-CE2 3.64Å; L646-F654 HydrophobicContact CD1-CZ 3.6Å; L646-F654 HydrophobicContact CD2-CD2 3.92Å; L646-F654 HydrophobicContact CD2-CE2 4.15Å; L646-F654 HydrophobicContact CD2-CG 4.22Å; L646-F654 HydrophobicContact CG-CE2 4.46Å; F654-T656 PolarHBondContact O-N 3.14Å; F654-T656 VanDerWaalsContact O-N 3.13Å; F654-R657 PolarHBondContact O-N 3.3Å; F654-R657 VanDerWaalsContact O-N 3.11Å
655	S	69.8	Low	78.7	Confident	31 Å²	31	53.9 Å²	53.9	22%	0.217	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.7	-178.9	56.5	0	0	0	0	113.7	S630 M632 Q653	S630-S655 CarbonylContact C-O 3.42Å; S630-S655 VanDerWaalsContact C-O 3.31Å; S630-S655 CarbonylContact O-C 3.58Å; M632-S655 PolarHBondContact N-O 2.82Å; Q653-S655 PolarHBondContact O-N 3.17Å
656	T	76.1	Confident	79.6	Confident	35 Å²	35	49.3 Å²	49.3	22%	0.215	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-95.7	-7.2	-177.9	65.4	0	0	0	0	113.6	Q653 F654 F658	Q653-T656 PolarHBondContact O-N 2.88Å; Q653-T656 PolarHBondContact O-OG1 3.19Å; F654-T656 PolarHBondContact O-N 3.14Å; F654-T656 VanDerWaalsContact O-N 3.13Å; T656-F658 VanDerWaalsContact C-N 3.33Å; T656-F658 PolarHBondContact O-N 3.34Å
657	R	81.4	Confident	80.5	Confident	95 Å²	95	50.4 Å²	50.4	36%	0.358	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.2	-172.8	-63.9	-62.6	-175.1	172.4	-1	114.7	V651 P652 F654 H662 H663	V651-R657 HydrophobicContact CG1-CG 3.92Å; P652-R657 PolarHBondContact O-NE 3.14Å; F654-R657 PolarHBondContact O-N 3.3Å; F654-R657 VanDerWaalsContact O-N 3.11Å; R657-H662 CarbonylContact O-C 3.4Å; R657-H662 WeakPolarHBondContact O-CB 3.41Å; R657-H663 PolarHBondContact O-N 3.45Å
658	F	83.9	Confident	81.3	Confident	43 Å²	43	49.8 Å²	49.8	19%	0.189	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	15.3	176.6	-65.1	-74.7	0	0	0	113.2	F570 F571 C626 M632 T656 H663 P664	F570-F658 HydrophobicContact CE1-CB 4.32Å; F570-F658 HydrophobicContact CE1-CD1 4.33Å; F570-F658 HydrophobicContact CE1-CG 4.4Å; F570-F658 HydrophobicContact CZ-CB 4.11Å; F571-F658 HydrophobicContact CD1-CD1 4.11Å; F571-F658 AromaticContact CD1-CE1 3.6Å; F571-F658 HydrophobicContact CD1-CE1 3.6Å; F571-F658 AromaticContact CD1-CZ 3.9Å; F571-F658 HydrophobicContact CD1-CZ 3.9Å; F571-F658 HydrophobicContact CE1-CD1 4.22Å; F571-F658 AromaticContact CE1-CE1 3.88Å; F571-F658 HydrophobicContact CE1-CE1 3.88Å; F571-F658 HydrophobicContact CE1-CE2 4.17Å; F571-F658 AromaticContact CE1-CZ 3.85Å; F571-F658 HydrophobicContact CE1-CZ 3.85Å; C626-F658 CarbonylContact C-O 3.54Å; C626-F658 HydrophobicContact CB-CB 4.4Å; C626-F658 CarbonylContact O-C 3.31Å; C626-F658 VanDerWaalsContact O-O 3.08Å; M632-F658 HydrophobicContact SD-CD2 3.75Å; M632-F658 HydrophobicContact SD-CE2 3.75Å; T656-F658 VanDerWaalsContact C-N 3.33Å; T656-F658 PolarHBondContact O-N 3.34Å; F658-H663 AromaticContact CD1-CD2 3.9Å; F658-P664 HydrophobicContact CE1-CG 4.38Å
659	D	87.3	Confident	81.9	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	27%	0.265	C	S	.	.	S	Bend	trans	-69.9	162.4	169.7	71.8	19.4	0	0	0	111.2	C626 S630 I661 H662 H663 K690	C626-D659 WeakPolarHBondContact O-CA 3.29Å; C626-D659 PolarHBondContact O-N 3.18Å; S630-D659 WeakPolarHBondContact OG-CB 3.49Å; S630-D659 PolarHBondContact OG-OD2 2.91Å; D659-I661 PolarHBondContact O-N 3.07Å; D659-I661 PolarHBondContact OD1-N 3.15Å; D659-I661 VanDerWaalsContact OD1-N 3.11Å; D659-H662 VanDerWaalsContact CG-ND1 3.26Å; D659-H662 PolarHBondContact O-N 3.07Å; D659-H662 VanDerWaalsContact O-N 3.15Å; D659-H662 VanDerWaalsContact OD1-CB 3.29Å; D659-H662 WeakPolarHBondContact OD1-CB 3.45Å; D659-H662 IonicContact OD1-CE1 3.92Å; D659-H662 IonicContact OD1-CG 3.35Å; D659-H662 PolarHBondContact OD1-N 3.37Å; D659-H662 IonicContact OD1-ND1 2.78Å; D659-H662 PolarHBondContact OD1-ND1 2.98Å; D659-H662 IonicContact OD2-CE1 3.73Å; D659-H662 IonicContact OD2-ND1 3Å; D659-H662 PolarHBondContact OD2-ND1 3.2Å; D659-H663 WeakPolarHBondContact O-CA 3.21Å; D659-H663 WeakPolarHBondContact O-CB 3.37Å; D659-H663 PolarHBondContact O-N 2.98Å; D659-K690 WeakPolarHBondContact OD2-CE 3.24Å; D659-K690 IonicContact OD2-NZ 2.76Å; D659-K690 PolarHBondContact OD2-NZ 3.12Å
660	L	86.1	Confident	82.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.1	-177.8	-74.5	166.3	0	0	0	115.6	L627 W628 F666 W695 Y698 L699 L710 L714	L627-L660 HydrophobicContact CB-CD2 4.45Å; L627-L660 HydrophobicContact CB-CG 4.18Å; L627-L660 HydrophobicContact CD2-CD2 4.11Å; L627-L660 PolarHBondContact O-N 2.9Å; L627-L660 VanDerWaalsContact O-N 3.09Å; W628-L660 HydrophobicContact CE3-CD1 4.18Å; W628-L660 HydrophobicContact CZ3-CD1 4.46Å; L660-F666 HydrophobicContact CD2-CD2 4.09Å; L660-F666 HydrophobicContact CD2-CE2 4.04Å; L660-F666 VanDerWaalsContact O-CB 3.29Å; L660-F666 WeakPolarHBondContact O-CB 3.36Å; L660-W695 HydrophobicContact CB-CH2 4Å; L660-W695 HydrophobicContact CD1-CH2 4.02Å; L660-W695 HydrophobicContact CD1-CZ2 4.37Å; L660-Y698 PolarHBondContact O-OH 2.79Å; L660-L699 HydrophobicContact CD1-CD2 3.98Å; L660-L710 HydrophobicContact CD2-CD1 4.15Å; L660-L710 HydrophobicContact CD2-CD2 3.77Å; L660-L714 HydrophobicContact CD1-CD1 4.05Å
661	I	86.9	Confident	83.4	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-44.6	180	-57.2	171.8	0	0	0	109.8	D659 V667 A670 L686 I689 K690 W695 Y698	D659-I661 PolarHBondContact O-N 3.07Å; D659-I661 PolarHBondContact OD1-N 3.15Å; D659-I661 VanDerWaalsContact OD1-N 3.11Å; I661-V667 WeakPolarHBondContact O-CA 3.45Å; I661-A670 HydrophobicContact CG2-CB 3.93Å; I661-A670 WeakPolarHBondContact O-CB 2.89Å; I661-L686 HydrophobicContact CG2-CB 3.87Å; I661-I689 HydrophobicContact CD1-CB 4.02Å; I661-I689 HydrophobicContact CD1-CG2 4.01Å; I661-I689 HydrophobicContact CG1-CG2 4.31Å; I661-I689 HydrophobicContact CG2-CD1 4.18Å; I661-K690 HydrophobicContact CD1-CD 4.33Å; I661-K690 HydrophobicContact CD1-CG 3.41Å; I661-K690 VanDerWaalsContact CD1-CG 3.41Å; I661-W695 HydrophobicContact CD1-CE3 4.06Å; I661-W695 HydrophobicContact CD1-CZ3 3.69Å; I661-W695 HydrophobicContact CG1-CE3 4.39Å; I661-W695 HydrophobicContact CG1-CZ3 3.65Å; I661-Y698 HydrophobicContact CG1-CD1 4.37Å; I661-Y698 HydrophobicContact CG1-CE1 3.98Å
662	H	87.1	Confident	84	Confident	24 Å²	24	42.1 Å²	42.1	11%	0.111	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.3	-171.4	-58.3	100.3	0	0	0	113.2	R657 D659	R657-H662 CarbonylContact O-C 3.4Å; R657-H662 WeakPolarHBondContact O-CB 3.41Å; D659-H662 VanDerWaalsContact CG-ND1 3.26Å; D659-H662 PolarHBondContact O-N 3.07Å; D659-H662 VanDerWaalsContact O-N 3.15Å; D659-H662 VanDerWaalsContact OD1-CB 3.29Å; D659-H662 WeakPolarHBondContact OD1-CB 3.45Å; D659-H662 IonicContact OD1-CE1 3.92Å; D659-H662 IonicContact OD1-CG 3.35Å; D659-H662 PolarHBondContact OD1-N 3.37Å; D659-H662 IonicContact OD1-ND1 2.78Å; D659-H662 PolarHBondContact OD1-ND1 2.98Å; D659-H662 IonicContact OD2-CE1 3.73Å; D659-H662 IonicContact OD2-ND1 3Å; D659-H662 PolarHBondContact OD2-ND1 3.2Å
663	H	89.7	Confident	85	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-52.2	132.7	177.5	-164.9	-82.7	0	0	0	109.6	F570 R657 F658 D659 A665 F666 V667	F570-H663 AromaticContact CZ-NE2 3.92Å; F570-H663 PolarHBondContact O-CE1 3.44Å; F570-H663 PolarHBondContact O-NE2 3.24Å; R657-H663 PolarHBondContact O-N 3.45Å; F658-H663 AromaticContact CD1-CD2 3.9Å; D659-H663 WeakPolarHBondContact O-CA 3.21Å; D659-H663 WeakPolarHBondContact O-CB 3.37Å; D659-H663 PolarHBondContact O-N 2.98Å; H663-A665 WeakPolarHBondContact ND1-CB 3.28Å; H663-A665 PolarHBondContact ND1-N 3.11Å; H663-A665 VanDerWaalsContact ND1-N 3.17Å; H663-A665 PolarHBondContact O-N 2.59Å; H663-F666 HydrophobicContact CB-CD2 3.95Å; H663-F666 PolarHBondContact O-N 3.24Å; H663-V667 PolarHBondContact O-N 3.49Å
664	P	89.4	Confident	85.8	Confident	64 Å²	64	31.6 Å²	31.6	42%	0.416	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-34.5	-178.6	-29.8	35.6	0	0	0	113.6	F658	F658-P664 HydrophobicContact CE1-CG 4.38Å
665	A	90.7	Very high	86.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.4	177.4	0	0	0	0	0	115.8	A573 P575 V578 H663	A573-A665 VanDerWaalsContact O-CA 3.3Å; A573-A665 WeakPolarHBondContact O-CA 3.47Å; P575-A665 HydrophobicContact CB-CB 4.28Å; P575-A665 WeakPolarHBondContact CB-O 3.5Å; V578-A665 HydrophobicContact CG2-CB 3.98Å; H663-A665 WeakPolarHBondContact ND1-CB 3.28Å; H663-A665 PolarHBondContact ND1-N 3.11Å; H663-A665 VanDerWaalsContact ND1-N 3.17Å; H663-A665 PolarHBondContact O-N 2.59Å
666	F	91.2	Very high	87.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-9.5	-172.3	-61.9	-64.6	0	0	0	113.8	P575 V578 L660 H663 S668 Y669 A670 L702 F707 L710	P575-F666 HydrophobicContact CB-CD1 4.01Å; P575-F666 HydrophobicContact CB-CE1 3.66Å; P575-F666 HydrophobicContact CB-CZ 4.33Å; V578-F666 HydrophobicContact CB-CE2 4.16Å; V578-F666 HydrophobicContact CB-CZ 4.13Å; V578-F666 HydrophobicContact CG1-CE2 3.82Å; V578-F666 HydrophobicContact CG1-CZ 4.11Å; L660-F666 HydrophobicContact CD2-CD2 4.09Å; L660-F666 HydrophobicContact CD2-CE2 4.04Å; L660-F666 VanDerWaalsContact O-CB 3.29Å; L660-F666 WeakPolarHBondContact O-CB 3.36Å; H663-F666 HydrophobicContact CB-CD2 3.95Å; H663-F666 PolarHBondContact O-N 3.24Å; F666-S668 PolarHBondContact O-N 2.92Å; F666-Y669 WeakPolarHBondContact O-CA 3.41Å; F666-Y669 WeakPolarHBondContact O-CB 3.35Å; F666-Y669 PolarHBondContact O-N 3.48Å; F666-A670 PolarHBondContact O-N 2.96Å; F666-L702 HydrophobicContact CD1-CD2 4.3Å; F666-F707 HydrophobicContact CE1-CD2 4.35Å; F666-F707 HydrophobicContact CE1-CE2 4.26Å; F666-F707 HydrophobicContact CE1-CZ 4.36Å; F666-L710 HydrophobicContact CE1-CD2 4.49Å; F666-L710 HydrophobicContact CZ-CD2 4.14Å
667	V	89.9	Confident	87.5	Confident	48 Å²	48	38.5 Å²	38.5	29%	0.291	20%	0.196	S	C	.	.	H	α-helix	trans	-59.2	-33.8	-176	75	0	0	0	0	113.3	I661 H663 A670 L671 L686	I661-V667 WeakPolarHBondContact O-CA 3.45Å; H663-V667 PolarHBondContact O-N 3.49Å; V667-A670 PolarHBondContact O-N 3.34Å; V667-L671 WeakPolarHBondContact O-CG 3.43Å; V667-L671 PolarHBondContact O-N 2.9Å; V667-L686 HydrophobicContact CG2-CD1 4.03Å
668	S	89.5	Confident	87.5	Confident	67 Å²	67	36.9 Å²	36.9	47%	0.469	19%	0.189	S	C	.	.	H	α-helix	trans	-65.5	-38.9	174.8	54	0	0	0	0	112.2	F666 L671 D672	F666-S668 PolarHBondContact O-N 2.92Å; S668-L671 PolarHBondContact O-N 3.48Å; S668-D672 PolarHBondContact O-N 3.49Å
669	Y	90.5	Very high	87	Confident	65 Å²	65	40.2 Å²	40.2	26%	0.255	22%	0.216	S	C	.	.	H	α-helix	trans	-70.8	-36.7	175.3	-67	-91.4	0	0	0	111.7	P575 F666 L671 D672 F673 Y701 L702 Q705 F707	P575-Y669 HydrophobicContact CB-CE2 4.35Å; P575-Y669 HydrophobicContact CG-CE2 3.89Å; F666-Y669 WeakPolarHBondContact O-CA 3.41Å; F666-Y669 WeakPolarHBondContact O-CB 3.35Å; F666-Y669 PolarHBondContact O-N 3.48Å; Y669-L671 VanDerWaalsContact C-N 3.34Å; Y669-D672 PolarHBondContact O-N 3Å; Y669-F673 VanDerWaalsContact O-CB 3.24Å; Y669-F673 WeakPolarHBondContact O-CB 3.23Å; Y669-F673 PolarHBondContact O-N 3.1Å; Y669-Y701 HydrophobicContact CD1-CE1 4.44Å; Y669-L702 HydrophobicContact CG-CD2 4.3Å; Y669-Q705 HydrophobicContact CD1-CG 4.1Å; Y669-Q705 HydrophobicContact CE1-CB 4.3Å; Y669-Q705 HydrophobicContact CE1-CG 4.1Å; Y669-F707 HydrophobicContact CD1-CE2 4.24Å; Y669-F707 AromaticContact CE1-CE2 3.99Å; Y669-F707 HydrophobicContact CE1-CE2 3.99Å; Y669-F707 HydrophobicContact CE1-CZ 4.07Å; Y669-F707 HydrophobicContact CE2-CE2 4.4Å; Y669-F707 HydrophobicContact CE2-CZ 4.03Å; Y669-F707 AromaticContact CZ-CZ 3.71Å
670	A	89.3	Confident	86.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-42.1	173.2	0	0	0	0	0	111.8	I661 F666 V667 H674 L686 I689 Y698	I661-A670 HydrophobicContact CG2-CB 3.93Å; I661-A670 WeakPolarHBondContact O-CB 2.89Å; F666-A670 PolarHBondContact O-N 2.96Å; V667-A670 PolarHBondContact O-N 3.34Å; A670-H674 WeakPolarHBondContact O-CB 3.39Å; A670-H674 PolarHBondContact O-N 3.31Å; A670-L686 HydrophobicContact CB-CD2 4.08Å; A670-I689 HydrophobicContact CB-CD1 4.15Å; A670-Y698 HydrophobicContact CB-CE2 4.15Å
671	L	88.2	Confident	85.6	Confident	58 Å²	58	49.8 Å²	49.8	30%	0.304	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-47	176	-73	167.7	0	0	0	112	V667 S668 Y669 F673 H674 H675 T684 L686	V667-L671 WeakPolarHBondContact O-CG 3.43Å; V667-L671 PolarHBondContact O-N 2.9Å; S668-L671 PolarHBondContact O-N 3.48Å; Y669-L671 VanDerWaalsContact C-N 3.34Å; L671-F673 PolarHBondContact O-N 3.26Å; L671-H674 PolarHBondContact O-N 3.36Å; L671-H675 PolarHBondContact O-CD2 3.02Å; L671-H675 PolarHBondContact O-N 2.93Å; L671-T684 HydrophobicContact CD2-CG2 3.87Å; L671-L686 HydrophobicContact CD2-CD1 4.39Å; L671-L686 HydrophobicContact CD2-CD2 3.91Å; L671-L686 HydrophobicContact CD2-CG 4.4Å; L671-L686 HydrophobicContact CG-CD2 4.3Å
672	D	88.3	Confident	84.4	Confident	64 Å²	64	59.4 Å²	59.4	34%	0.342	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-42.3	177.7	-178.1	49.4	0	0	0	111.9	S668 Y669 H674 H675 K676 Y701	S668-D672 PolarHBondContact O-N 3.49Å; Y669-D672 PolarHBondContact O-N 3Å; D672-H674 PolarHBondContact O-N 3.21Å; D672-H675 PolarHBondContact O-N 3.44Å; D672-K676 WeakPolarHBondContact O-CG 3.5Å; D672-K676 PolarHBondContact O-N 3.45Å; D672-K676 IonicContact OD1-NZ 3.89Å; D672-K676 VanDerWaalsContact OD2-CE 3.29Å; D672-K676 WeakPolarHBondContact OD2-CE 3.09Å; D672-K676 IonicContact OD2-NZ 2.83Å; D672-K676 PolarHBondContact OD2-NZ 2.69Å; D672-Y701 PolarHBondContact OD2-OH 2.98Å
673	F	89	Confident	83.5	Confident	10 Å²	10	64.7 Å²	64.7	4%	0.044	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-45.1	172.8	179.9	-100.9	0	0	0	112	Y669 L671 H675 K676 C677 I689 W697 Y698 Y701	Y669-F673 VanDerWaalsContact O-CB 3.24Å; Y669-F673 WeakPolarHBondContact O-CB 3.23Å; Y669-F673 PolarHBondContact O-N 3.1Å; L671-F673 PolarHBondContact O-N 3.26Å; F673-H675 VanDerWaalsContact C-N 3.33Å; F673-H675 PolarHBondContact O-N 3.41Å; F673-K676 PolarHBondContact O-N 2.63Å; F673-C677 WeakPolarHBondContact CZ-SG 3.31Å; F673-C677 PolarHBondContact O-N 2.85Å; F673-I689 HydrophobicContact CD1-CD1 4.16Å; F673-I689 HydrophobicContact CD1-CG1 4.31Å; F673-I689 HydrophobicContact CD1-CG2 4.46Å; F673-I689 HydrophobicContact CE1-CG2 4.32Å; F673-W697 HydrophobicContact CE2-CB 4.15Å; F673-W697 HydrophobicContact CZ-CB 3.74Å; F673-Y698 HydrophobicContact CB-CD2 3.86Å; F673-Y698 HydrophobicContact CB-CE2 4.15Å; F673-Y698 AromaticContact CD1-CD2 3.62Å; F673-Y698 HydrophobicContact CD1-CD2 3.62Å; F673-Y698 HydrophobicContact CD1-CG 4.21Å; F673-Y698 HydrophobicContact CD2-CD2 4.2Å; F673-Y698 HydrophobicContact CE1-CD2 4.21Å; F673-Y698 HydrophobicContact CE1-CG 4.38Å; F673-Y698 AromaticContact CG-CD2 3.62Å; F673-Y698 HydrophobicContact CG-CD2 3.62Å; F673-Y698 HydrophobicContact CG-CE2 4.4Å; F673-Y701 HydrophobicContact CB-CD1 3.8Å; F673-Y701 HydrophobicContact CB-CE1 3.92Å; F673-Y701 AromaticContact CD2-CD1 3.7Å; F673-Y701 HydrophobicContact CD2-CD1 3.7Å; F673-Y701 HydrophobicContact CD2-CD2 4.33Å; F673-Y701 HydrophobicContact CD2-CE1 4.47Å; F673-Y701 AromaticContact CD2-CG 3.61Å; F673-Y701 HydrophobicContact CD2-CG 3.61Å; F673-Y701 HydrophobicContact CE2-CG 4.3Å; F673-Y701 HydrophobicContact CG-CD1 4.1Å; F673-Y701 HydrophobicContact CG-CG 4.45Å
674	H	86.9	Confident	82.5	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.1	-42.3	177	-179.5	-86	0	0	0	111.8	A670 L671 D672 K676 C677 W678 L686 I689	A670-H674 WeakPolarHBondContact O-CB 3.39Å; A670-H674 PolarHBondContact O-N 3.31Å; L671-H674 PolarHBondContact O-N 3.36Å; D672-H674 PolarHBondContact O-N 3.21Å; H674-K676 VanDerWaalsContact C-N 3.34Å; H674-K676 PolarHBondContact O-N 2.76Å; H674-C677 PolarHBondContact O-N 3.37Å; H674-W678 AromaticContact CD2-CE3 3.51Å; H674-W678 AromaticContact CD2-CZ3 3.88Å; H674-W678 AromaticContact NE2-CE3 3.93Å; H674-W678 PolarHBondContact O-N 2.94Å; H674-L686 HydrophobicContact CB-CD2 4.43Å; H674-I689 HydrophobicContact CB-CD1 4.4Å
675	H	84.8	Confident	82	Confident	98 Å²	98	68.4 Å²	68.4	45%	0.454	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-37.9	175.6	-76	-59.5	0	0	0	112.8	L671 D672 F673 P679	L671-H675 PolarHBondContact O-CD2 3.02Å; L671-H675 PolarHBondContact O-N 2.93Å; D672-H675 PolarHBondContact O-N 3.44Å; F673-H675 VanDerWaalsContact C-N 3.33Å; F673-H675 PolarHBondContact O-N 3.41Å; H675-P679 WeakPolarHBondContact O-CA 3.3Å
676	K	84.4	Confident	81.4	Confident	120 Å²	120	69.4 Å²	69.4	52%	0.522	37%	0.371	S	S	.	.	H	α-helix	trans	-68.2	-39.5	176.5	-73.3	168.5	178.1	166.4	0	112.4	D672 F673 H674 Y701	D672-K676 WeakPolarHBondContact O-CG 3.5Å; D672-K676 PolarHBondContact O-N 3.45Å; D672-K676 IonicContact OD1-NZ 3.89Å; D672-K676 VanDerWaalsContact OD2-CE 3.29Å; D672-K676 WeakPolarHBondContact OD2-CE 3.09Å; D672-K676 IonicContact OD2-NZ 2.83Å; D672-K676 PolarHBondContact OD2-NZ 2.69Å; F673-K676 PolarHBondContact O-N 2.63Å; H674-K676 VanDerWaalsContact C-N 3.34Å; H674-K676 PolarHBondContact O-N 2.76Å; K676-Y701 HydrophobicContact CD-CE2 4.49Å; K676-Y701 PolarHBondContact NZ-OH 3.14Å; K676-Y701 VanDerWaalsContact NZ-OH 3.08Å
677	C	82.1	Confident	80.9	Confident	47 Å²	47	73.5 Å²	73.5	32%	0.318	39%	0.392	S	S	.	.	H	α-helix	trans	-81.9	-30.6	-179	-69.8	0	0	0	0	113.8	F673 H674	F673-C677 WeakPolarHBondContact CZ-SG 3.31Å; F673-C677 PolarHBondContact O-N 2.85Å; H674-C677 PolarHBondContact O-N 3.37Å
678	W	82.7	Confident	80.3	Confident	60 Å²	60	71.5 Å²	71.5	23%	0.227	38%	0.381	C	S	.	.			trans	-134.1	68.2	-178.3	-62.5	-80.1	0	0	0	112.8	H674 G680 R681 I689 P694	H674-W678 AromaticContact CD2-CE3 3.51Å; H674-W678 AromaticContact CD2-CZ3 3.88Å; H674-W678 AromaticContact NE2-CE3 3.93Å; H674-W678 PolarHBondContact O-N 2.94Å; W678-G680 PolarHBondContact O-N 3.18Å; W678-R681 HydrophobicContact CB-CB 4.34Å; W678-R681 HydrophobicContact CB-CG 4.33Å; W678-R681 PolarHBondContact O-N 3.47Å; W678-I689 HydrophobicContact CZ3-CG1 4.42Å; W678-P694 HydrophobicContact CH2-CB 3.9Å; W678-P694 HydrophobicContact CH2-CG 3.98Å; W678-P694 HydrophobicContact CZ2-CG 4.13Å
679	P	74.1	Confident	79.9	Confident	114 Å²	114	68.3 Å²	68.3	74%	0.74	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.5	-175.2	24.5	-34.5	0	0	0	114.5	H675	H675-P679 WeakPolarHBondContact O-CA 3.3Å
680	G	69.4	Low	79.3	Confident	77 Å²	77	69.1 Å²	69.1	79%	0.794	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-7	-179.1	0	0	0	0	0	116.1	W678	W678-G680 PolarHBondContact O-N 3.18Å
681	R	72.9	Confident	78.8	Confident	128 Å²	128	74.7 Å²	74.7	48%	0.483	39%	0.389	S	S	.	.			trans	-89.6	123.3	179.7	-78.3	-173.4	176	-175	-1.1	110.5	W678 S688	W678-R681 HydrophobicContact CB-CB 4.34Å; W678-R681 HydrophobicContact CB-CG 4.33Å; W678-R681 PolarHBondContact O-N 3.47Å; R681-S688 PolarHBondContact NH1-OG 3.48Å
682	K	61.8	Low	78.1	Confident	203 Å²	203	77.2 Å²	77.2	88%	0.883	41%	0.407	S	S	*	.			trans	-82.4	-24.6	175	-69.4	-174.1	177.8	-178.7	0	113.2
683	D	67.9	Low	77.6	Confident	135 Å²	135	80.6 Å²	80.6	72%	0.722	42%	0.419	S	S	*	.	S	Bend	trans	-89.6	121.1	176.6	-60.8	-30.8	0	0	0	110.2	D685	D683-D685 PolarHBondContact O-N 3.41Å; D683-D685 VanDerWaalsContact O-N 3.14Å
684	T	69.5	Low	77.2	Confident	77 Å²	77	80.6 Å²	80.6	47%	0.472	42%	0.42	S	S	.	.			trans	-82.9	79.8	178.4	36.2	0	0	0	0	111	L671 L686	L671-T684 HydrophobicContact CD2-CG2 3.87Å; T684-L686 PolarHBondContact O-N 3.02Å
685	D	78.9	Confident	77.1	Confident	65 Å²	65	82.7 Å²	82.7	35%	0.348	43%	0.428	S	S	.	.			trans	-86.7	92.5	169.4	176.3	35.2	0	0	0	111.2	D683 N687 S688	D683-D685 PolarHBondContact O-N 3.41Å; D683-D685 VanDerWaalsContact O-N 3.14Å; D685-N687 PolarHBondContact O-N 2.93Å; D685-N687 WeakPolarHBondContact OD1-CB 3.22Å; D685-N687 PolarHBondContact OD1-N 3.49Å; D685-N687 VanDerWaalsContact OD1-N 3.1Å; D685-S688 VanDerWaalsContact O-CB 3.31Å; D685-S688 WeakPolarHBondContact O-CB 3.39Å; D685-S688 PolarHBondContact O-N 3.31Å; D685-S688 VanDerWaalsContact O-N 3.16Å; D685-S688 PolarHBondContact OD2-N 3.22Å; D685-S688 PolarHBondContact OD2-OG 2.89Å
686	L	78.7	Confident	77	Confident	22 Å²	22	79.7 Å²	79.7	12%	0.115	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-65.1	-19	176.5	-66.1	179.3	0	0	0	113.2	I661 V667 A670 L671 H674 T684 S688 I689	I661-L686 HydrophobicContact CG2-CB 3.87Å; V667-L686 HydrophobicContact CG2-CD1 4.03Å; A670-L686 HydrophobicContact CB-CD2 4.08Å; L671-L686 HydrophobicContact CD2-CD1 4.39Å; L671-L686 HydrophobicContact CD2-CD2 3.91Å; L671-L686 HydrophobicContact CD2-CG 4.4Å; L671-L686 HydrophobicContact CG-CD2 4.3Å; H674-L686 HydrophobicContact CB-CD2 4.43Å; T684-L686 PolarHBondContact O-N 3.02Å; L686-S688 PolarHBondContact O-N 2.91Å; L686-I689 HydrophobicContact CD2-CD1 4.04Å; L686-I689 WeakPolarHBondContact O-CB 3.29Å; L686-I689 PolarHBondContact O-N 3.47Å
687	N	79.8	Confident	77.1	Confident	85 Å²	85	80.6 Å²	80.6	46%	0.455	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-71	-19	176.1	-63.1	-55.5	0	0	0	112.6	D685 I689 K690	D685-N687 PolarHBondContact O-N 2.93Å; D685-N687 WeakPolarHBondContact OD1-CB 3.22Å; D685-N687 PolarHBondContact OD1-N 3.49Å; D685-N687 VanDerWaalsContact OD1-N 3.1Å; N687-I689 PolarHBondContact O-N 3.01Å; N687-K690 WeakPolarHBondContact O-CB 3.46Å; N687-K690 PolarHBondContact O-N 2.98Å
688	S	77.8	Confident	77.4	Confident	7 Å²	7	78.3 Å²	78.3	5%	0.049	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-59.5	-24.1	171.5	-71.1	0	0	0	0	112.4	R681 D685 L686 K690 Q691	R681-S688 PolarHBondContact NH1-OG 3.48Å; D685-S688 VanDerWaalsContact O-CB 3.31Å; D685-S688 WeakPolarHBondContact O-CB 3.39Å; D685-S688 PolarHBondContact O-N 3.31Å; D685-S688 VanDerWaalsContact O-N 3.16Å; D685-S688 PolarHBondContact OD2-N 3.22Å; D685-S688 PolarHBondContact OD2-OG 2.89Å; L686-S688 PolarHBondContact O-N 2.91Å; S688-K690 VanDerWaalsContact C-N 3.33Å; S688-Q691 WeakPolarHBondContact O-CG 3.34Å
689	I	80.3	Confident	77.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-71.6	-25.7	175.5	-55.2	173.7	0	0	0	111.8	I661 A670 F673 H674 W678 L686 N687 Q691 W695 Y698	I661-I689 HydrophobicContact CD1-CB 4.02Å; I661-I689 HydrophobicContact CD1-CG2 4.01Å; I661-I689 HydrophobicContact CG1-CG2 4.31Å; I661-I689 HydrophobicContact CG2-CD1 4.18Å; A670-I689 HydrophobicContact CB-CD1 4.15Å; F673-I689 HydrophobicContact CD1-CD1 4.16Å; F673-I689 HydrophobicContact CD1-CG1 4.31Å; F673-I689 HydrophobicContact CD1-CG2 4.46Å; F673-I689 HydrophobicContact CE1-CG2 4.32Å; H674-I689 HydrophobicContact CB-CD1 4.4Å; W678-I689 HydrophobicContact CZ3-CG1 4.42Å; L686-I689 HydrophobicContact CD2-CD1 4.04Å; L686-I689 WeakPolarHBondContact O-CB 3.29Å; L686-I689 PolarHBondContact O-N 3.47Å; N687-I689 PolarHBondContact O-N 3.01Å; I689-Q691 PolarHBondContact O-N 3.44Å; I689-Q691 VanDerWaalsContact O-N 3.15Å; I689-W695 HydrophobicContact CG2-CE3 4.44Å; I689-W695 WeakPolarHBondContact O-CA 3.34Å; I689-W695 WeakPolarHBondContact O-CB 3.35Å; I689-W695 PolarHBondContact O-N 2.99Å; I689-W695 VanDerWaalsContact O-N 3.13Å; I689-Y698 HydrophobicContact CG2-CD1 3.88Å; I689-Y698 HydrophobicContact CG2-CD2 4.33Å; I689-Y698 HydrophobicContact CG2-CG 3.69Å
690	K	78.8	Confident	78.2	Confident	82 Å²	82	76.5 Å²	76.5	36%	0.357	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-69.9	-8	-180	-65.8	-175.9	172.7	-178	0	113.7	D659 I661 N687 S688	D659-K690 WeakPolarHBondContact OD2-CE 3.24Å; D659-K690 IonicContact OD2-NZ 2.76Å; D659-K690 PolarHBondContact OD2-NZ 3.12Å; I661-K690 HydrophobicContact CD1-CD 4.33Å; I661-K690 HydrophobicContact CD1-CG 3.41Å; I661-K690 VanDerWaalsContact CD1-CG 3.41Å; N687-K690 WeakPolarHBondContact O-CB 3.46Å; N687-K690 PolarHBondContact O-N 2.98Å; S688-K690 VanDerWaalsContact C-N 3.33Å
691	Q	78.8	Confident	79.1	Confident	117 Å²	117	74 Å²	74	55%	0.547	35%	0.354	S	S	.	.	S	Bend	trans	-66.7	147.1	174	-64.6	-179.9	6.3	0	0	111.1	S688 I689 K693 P694 W695	S688-Q691 WeakPolarHBondContact O-CG 3.34Å; I689-Q691 PolarHBondContact O-N 3.44Å; I689-Q691 VanDerWaalsContact O-N 3.15Å; Q691-K693 PolarHBondContact O-N 3.37Å; Q691-P694 HydrophobicContact CB-CG 3.94Å; Q691-P694 WeakPolarHBondContact O-CD 3.27Å; Q691-W695 WeakPolarHBondContact O-CB 3.46Å; Q691-W695 PolarHBondContact O-N 3.18Å
692	T	72.8	Confident	79.9	Confident	110 Å²	110	67.9 Å²	67.9	68%	0.675	33%	0.331	S	S	*	.	H	α-helix	trans	-57.7	-41.5	-166.4	-28.1	0	0	0	0	114.3
693	K	77.6	Confident	81.2	Confident	136 Å²	136	59.8 Å²	59.8	59%	0.591	30%	0.295	S	S	*	.	H	α-helix	trans	-74.5	-54.9	177.7	-72.9	-175.9	-179.9	-174.1	0	111.9	Q691 W695 S696 W697	Q691-K693 PolarHBondContact O-N 3.37Å; K693-W695 PolarHBondContact O-N 2.94Å; K693-S696 PolarHBondContact O-N 2.97Å; K693-S696 VanDerWaalsContact O-N 3.16Å; K693-S696 PolarHBondContact O-OG 2.95Å; K693-W697 PolarHBondContact O-N 3.15Å
694	P	82.3	Confident	82.2	Confident	10 Å²	10	58 Å²	58	7%	0.065	29%	0.289	C	S	.	.	H	α-helix	trans	-54.8	-34.8	174.9	-30.5	37.1	0	0	0	115.3	W678 Q691 W697 Y698	W678-P694 HydrophobicContact CH2-CB 3.9Å; W678-P694 HydrophobicContact CH2-CG 3.98Å; W678-P694 HydrophobicContact CZ2-CG 4.13Å; Q691-P694 HydrophobicContact CB-CG 3.94Å; Q691-P694 WeakPolarHBondContact O-CD 3.27Å; P694-W697 PolarHBondContact O-N 2.87Å; P694-Y698 WeakPolarHBondContact O-CB 3.31Å; P694-Y698 PolarHBondContact O-N 3Å
695	W	83.3	Confident	83.1	Confident	43 Å²	43	58.5 Å²	58.5	16%	0.163	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-44	177.8	178.2	-116	0	0	0	112.3	W628 L660 I661 I689 Q691 K693 Y698 L699	W628-W695 HydrophobicContact CD2-CZ2 4.36Å; W628-W695 AromaticContact CE3-CZ2 3.84Å; W628-W695 HydrophobicContact CE3-CZ2 3.84Å; W628-W695 AromaticContact CH2-CZ2 3.95Å; W628-W695 HydrophobicContact CH2-CZ2 3.95Å; W628-W695 AromaticContact CH2-NE1 3.45Å; W628-W695 HydrophobicContact CZ2-CZ2 4.42Å; W628-W695 AromaticContact CZ2-NE1 3.73Å; W628-W695 AromaticContact CZ3-CZ2 3.63Å; W628-W695 HydrophobicContact CZ3-CZ2 3.63Å; L660-W695 HydrophobicContact CB-CH2 4Å; L660-W695 HydrophobicContact CD1-CH2 4.02Å; L660-W695 HydrophobicContact CD1-CZ2 4.37Å; I661-W695 HydrophobicContact CD1-CE3 4.06Å; I661-W695 HydrophobicContact CD1-CZ3 3.69Å; I661-W695 HydrophobicContact CG1-CE3 4.39Å; I661-W695 HydrophobicContact CG1-CZ3 3.65Å; I689-W695 HydrophobicContact CG2-CE3 4.44Å; I689-W695 WeakPolarHBondContact O-CA 3.34Å; I689-W695 WeakPolarHBondContact O-CB 3.35Å; I689-W695 PolarHBondContact O-N 2.99Å; I689-W695 VanDerWaalsContact O-N 3.13Å; Q691-W695 WeakPolarHBondContact O-CB 3.46Å; Q691-W695 PolarHBondContact O-N 3.18Å; K693-W695 PolarHBondContact O-N 2.94Å; W695-Y698 HydrophobicContact CE3-CD1 4.1Å; W695-Y698 AromaticContact CZ3-CD1 3.89Å; W695-Y698 HydrophobicContact CZ3-CD1 3.89Å; W695-Y698 HydrophobicContact CZ3-CE1 4.3Å; W695-Y698 PolarHBondContact O-N 3.32Å; W695-L699 HydrophobicContact CD2-CD1 4.49Å; W695-L699 HydrophobicContact CH2-CD2 4.44Å; W695-L699 HydrophobicContact CZ2-CD1 4.29Å; W695-L699 HydrophobicContact CZ2-CD2 4.2Å; W695-L699 HydrophobicContact CZ2-CG 4.43Å; W695-L699 WeakPolarHBondContact O-CG 3.37Å; W695-L699 PolarHBondContact O-N 3.31Å
696	S	84.3	Confident	83.5	Confident	35 Å²	35	57.5 Å²	57.5	25%	0.245	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-42	177.6	64.8	0	0	0	0	112.2	K693 Y698 L699 E700	K693-S696 PolarHBondContact O-N 2.97Å; K693-S696 VanDerWaalsContact O-N 3.16Å; K693-S696 PolarHBondContact O-OG 2.95Å; S696-Y698 VanDerWaalsContact C-N 3.34Å; S696-L699 PolarHBondContact O-N 3.18Å; S696-E700 PolarHBondContact O-N 3.19Å
697	W	86.3	Confident	84.1	Confident	139 Å²	139	56.9 Å²	56.9	53%	0.527	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-35.3	175.4	-62.4	-23	0	0	0	112.5	F673 K693 P694 E700 Y701	F673-W697 HydrophobicContact CE2-CB 4.15Å; F673-W697 HydrophobicContact CZ-CB 3.74Å; K693-W697 PolarHBondContact O-N 3.15Å; P694-W697 PolarHBondContact O-N 2.87Å; W697-E700 PolarHBondContact O-N 2.76Å; W697-Y701 VanDerWaalsContact O-CB 3.23Å; W697-Y701 WeakPolarHBondContact O-CB 3.47Å; W697-Y701 PolarHBondContact O-N 2.89Å
698	Y	87.2	Confident	84.6	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-41.3	176.1	179.3	-119.2	0	0	0	112	L660 I661 A670 F673 I689 P694 W695 S696 Y701 L702	L660-Y698 PolarHBondContact O-OH 2.79Å; I661-Y698 HydrophobicContact CG1-CD1 4.37Å; I661-Y698 HydrophobicContact CG1-CE1 3.98Å; A670-Y698 HydrophobicContact CB-CE2 4.15Å; F673-Y698 HydrophobicContact CB-CD2 3.86Å; F673-Y698 HydrophobicContact CB-CE2 4.15Å; F673-Y698 AromaticContact CD1-CD2 3.62Å; F673-Y698 HydrophobicContact CD1-CD2 3.62Å; F673-Y698 HydrophobicContact CD1-CG 4.21Å; F673-Y698 HydrophobicContact CD2-CD2 4.2Å; F673-Y698 HydrophobicContact CE1-CD2 4.21Å; F673-Y698 HydrophobicContact CE1-CG 4.38Å; F673-Y698 AromaticContact CG-CD2 3.62Å; F673-Y698 HydrophobicContact CG-CD2 3.62Å; F673-Y698 HydrophobicContact CG-CE2 4.4Å; I689-Y698 HydrophobicContact CG2-CD1 3.88Å; I689-Y698 HydrophobicContact CG2-CD2 4.33Å; I689-Y698 HydrophobicContact CG2-CG 3.69Å; P694-Y698 WeakPolarHBondContact O-CB 3.31Å; P694-Y698 PolarHBondContact O-N 3Å; W695-Y698 HydrophobicContact CE3-CD1 4.1Å; W695-Y698 AromaticContact CZ3-CD1 3.89Å; W695-Y698 HydrophobicContact CZ3-CD1 3.89Å; W695-Y698 HydrophobicContact CZ3-CE1 4.3Å; W695-Y698 PolarHBondContact O-N 3.32Å; S696-Y698 VanDerWaalsContact C-N 3.34Å; Y698-Y701 HydrophobicContact CD2-CD1 4.34Å; Y698-Y701 HydrophobicContact CE2-CD1 4.48Å; Y698-Y701 WeakPolarHBondContact O-CB 3.3Å; Y698-Y701 PolarHBondContact O-N 3.09Å; Y698-L702 HydrophobicContact CD1-CD1 4.18Å; Y698-L702 HydrophobicContact CD2-CG 4.47Å; Y698-L702 HydrophobicContact CE1-CD1 3.63Å; Y698-L702 HydrophobicContact CE1-CG 4.29Å; Y698-L702 HydrophobicContact CE2-CD1 4.28Å; Y698-L702 HydrophobicContact CE2-CD2 4.16Å; Y698-L702 HydrophobicContact CE2-CG 4.05Å; Y698-L702 WeakPolarHBondContact O-CG 3.4Å; Y698-L702 PolarHBondContact O-N 3.46Å
699	L	86.4	Confident	85.2	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-44.7	175.2	-69.1	174.1	0	0	0	111.7	W628 L660 W695 S696 Y701 L702 F703 L714 M723	W628-L699 HydrophobicContact CH2-CD1 3.63Å; W628-L699 HydrophobicContact CZ3-CD1 3.77Å; W628-L699 HydrophobicContact CZ3-CD2 4.16Å; L660-L699 HydrophobicContact CD1-CD2 3.98Å; W695-L699 HydrophobicContact CD2-CD1 4.49Å; W695-L699 HydrophobicContact CH2-CD2 4.44Å; W695-L699 HydrophobicContact CZ2-CD1 4.29Å; W695-L699 HydrophobicContact CZ2-CD2 4.2Å; W695-L699 HydrophobicContact CZ2-CG 4.43Å; W695-L699 WeakPolarHBondContact O-CG 3.37Å; W695-L699 PolarHBondContact O-N 3.31Å; S696-L699 PolarHBondContact O-N 3.18Å; L699-Y701 VanDerWaalsContact C-N 3.31Å; L699-Y701 PolarHBondContact O-N 2.78Å; L699-L702 PolarHBondContact O-N 3.46Å; L699-F703 HydrophobicContact CB-CE2 4.18Å; L699-F703 HydrophobicContact CB-CZ 4.37Å; L699-F703 WeakPolarHBondContact O-CD2 3.21Å; L699-F703 WeakPolarHBondContact O-CG 3.29Å; L699-F703 PolarHBondContact O-N 2.75Å; L699-L714 HydrophobicContact CD2-CD1 4.33Å; L699-M723 HydrophobicContact CD1-CE 4.08Å
700	E	87	Confident	85.6	Confident	127 Å²	127	56.8 Å²	56.8	59%	0.593	29%	0.287	S	S	*	.	H	α-helix	trans	-60.5	-43.7	174.5	-171.8	173.1	-167.4	0	0	111	S696 W697 L702 F703 T704	S696-E700 PolarHBondContact O-N 3.19Å; W697-E700 PolarHBondContact O-N 2.76Å; E700-L702 PolarHBondContact O-N 3.15Å; E700-F703 PolarHBondContact O-N 3.11Å; E700-F703 VanDerWaalsContact O-N 3.14Å; E700-T704 WeakPolarHBondContact O-CG2 3.5Å; E700-T704 PolarHBondContact O-N 3.5Å
701	Y	89.9	Confident	86.2	Confident	25 Å²	25	56.1 Å²	56.1	10%	0.098	29%	0.285	C	S	.	.	H	α-helix	trans	-55.6	-51.9	174.2	174.4	-111.1	0	0	0	111.8	Y669 D672 F673 K676 W697 Y698 L699 F703 T704 Q705	Y669-Y701 HydrophobicContact CD1-CE1 4.44Å; D672-Y701 PolarHBondContact OD2-OH 2.98Å; F673-Y701 HydrophobicContact CB-CD1 3.8Å; F673-Y701 HydrophobicContact CB-CE1 3.92Å; F673-Y701 AromaticContact CD2-CD1 3.7Å; F673-Y701 HydrophobicContact CD2-CD1 3.7Å; F673-Y701 HydrophobicContact CD2-CD2 4.33Å; F673-Y701 HydrophobicContact CD2-CE1 4.47Å; F673-Y701 AromaticContact CD2-CG 3.61Å; F673-Y701 HydrophobicContact CD2-CG 3.61Å; F673-Y701 HydrophobicContact CE2-CG 4.3Å; F673-Y701 HydrophobicContact CG-CD1 4.1Å; F673-Y701 HydrophobicContact CG-CG 4.45Å; K676-Y701 HydrophobicContact CD-CE2 4.49Å; K676-Y701 PolarHBondContact NZ-OH 3.14Å; K676-Y701 VanDerWaalsContact NZ-OH 3.08Å; W697-Y701 VanDerWaalsContact O-CB 3.23Å; W697-Y701 WeakPolarHBondContact O-CB 3.47Å; W697-Y701 PolarHBondContact O-N 2.89Å; Y698-Y701 HydrophobicContact CD2-CD1 4.34Å; Y698-Y701 HydrophobicContact CE2-CD1 4.48Å; Y698-Y701 WeakPolarHBondContact O-CB 3.3Å; Y698-Y701 PolarHBondContact O-N 3.09Å; L699-Y701 VanDerWaalsContact C-N 3.31Å; L699-Y701 PolarHBondContact O-N 2.78Å; Y701-F703 VanDerWaalsContact C-N 3.27Å; Y701-F703 PolarHBondContact O-N 3.17Å; Y701-T704 PolarHBondContact O-N 3.21Å; Y701-T704 VanDerWaalsContact O-N 3.08Å; Y701-T704 PolarHBondContact O-OG1 3.16Å; Y701-Q705 HydrophobicContact CE1-CG 4.37Å; Y701-Q705 HydrophobicContact CE2-CG 4.25Å; Y701-Q705 VanDerWaalsContact CE2-NE2 3.32Å; Y701-Q705 WeakPolarHBondContact O-CG 3.39Å; Y701-Q705 PolarHBondContact O-N 2.91Å
702	L	88.1	Confident	86.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.6	-42	176.5	-72.4	177.1	0	0	0	111.7	F666 Y669 Y698 L699 E700 T704 Q705 F707	F666-L702 HydrophobicContact CD1-CD2 4.3Å; Y669-L702 HydrophobicContact CG-CD2 4.3Å; Y698-L702 HydrophobicContact CD1-CD1 4.18Å; Y698-L702 HydrophobicContact CD2-CG 4.47Å; Y698-L702 HydrophobicContact CE1-CD1 3.63Å; Y698-L702 HydrophobicContact CE1-CG 4.29Å; Y698-L702 HydrophobicContact CE2-CD1 4.28Å; Y698-L702 HydrophobicContact CE2-CD2 4.16Å; Y698-L702 HydrophobicContact CE2-CG 4.05Å; Y698-L702 WeakPolarHBondContact O-CG 3.4Å; Y698-L702 PolarHBondContact O-N 3.46Å; L699-L702 PolarHBondContact O-N 3.46Å; E700-L702 PolarHBondContact O-N 3.15Å; L702-T704 VanDerWaalsContact C-N 3.34Å; L702-T704 PolarHBondContact O-N 3.02Å; L702-Q705 WeakPolarHBondContact O-CB 3.33Å; L702-Q705 PolarHBondContact O-N 3.34Å; L702-Q705 VanDerWaalsContact O-N 3.09Å; L702-F707 HydrophobicContact CB-CD2 4.27Å; L702-F707 HydrophobicContact CD2-CD2 4.2Å; L702-F707 HydrophobicContact CD2-CE2 4.16Å; L702-F707 WeakPolarHBondContact O-CD2 3.1Å
703	F	89.1	Confident	87.5	Confident	32 Å²	32	48 Å²	48	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-33.3	177.9	-56.9	-27.9	0	0	0	112.8	L699 E700 Y701 Q705 G706 K711 L714 M723	L699-F703 HydrophobicContact CB-CE2 4.18Å; L699-F703 HydrophobicContact CB-CZ 4.37Å; L699-F703 WeakPolarHBondContact O-CD2 3.21Å; L699-F703 WeakPolarHBondContact O-CG 3.29Å; L699-F703 PolarHBondContact O-N 2.75Å; E700-F703 PolarHBondContact O-N 3.11Å; E700-F703 VanDerWaalsContact O-N 3.14Å; Y701-F703 VanDerWaalsContact C-N 3.27Å; Y701-F703 PolarHBondContact O-N 3.17Å; F703-Q705 PolarHBondContact O-N 2.76Å; F703-G706 PolarHBondContact O-N 3.47Å; F703-K711 HydrophobicContact CB-CD 4.26Å; F703-K711 HydrophobicContact CD1-CB 3.52Å; F703-K711 HydrophobicContact CD1-CD 4.43Å; F703-K711 HydrophobicContact CD1-CG 3.99Å; F703-K711 HydrophobicContact CD2-CB 4.44Å; F703-K711 HydrophobicContact CD2-CD 4.35Å; F703-K711 HydrophobicContact CD2-CG 4Å; F703-K711 HydrophobicContact CE1-CB 3.57Å; F703-K711 HydrophobicContact CE1-CG 4.1Å; F703-K711 HydrophobicContact CE2-CB 4.47Å; F703-K711 HydrophobicContact CE2-CG 4.1Å; F703-K711 HydrophobicContact CG-CB 4Å; F703-K711 HydrophobicContact CG-CD 4.1Å; F703-K711 HydrophobicContact CG-CG 3.94Å; F703-K711 HydrophobicContact CZ-CB 4.07Å; F703-K711 HydrophobicContact CZ-CG 4.15Å; F703-L714 HydrophobicContact CE1-CD1 4.38Å; F703-L714 HydrophobicContact CZ-CD1 4.17Å; F703-M723 HydrophobicContact CE2-CE 4.44Å; F703-M723 HydrophobicContact CZ-CE 4.38Å
704	T	88.8	Confident	87.9	Confident	97 Å²	97	41.6 Å²	41.6	60%	0.595	21%	0.213	S	C	*	.	H	α-helix	trans	-66.9	-17.9	172.5	65.8	0	0	0	0	113.6	E700 Y701 L702 G706	E700-T704 WeakPolarHBondContact O-CG2 3.5Å; E700-T704 PolarHBondContact O-N 3.5Å; Y701-T704 PolarHBondContact O-N 3.21Å; Y701-T704 VanDerWaalsContact O-N 3.08Å; Y701-T704 PolarHBondContact O-OG1 3.16Å; L702-T704 VanDerWaalsContact C-N 3.34Å; L702-T704 PolarHBondContact O-N 3.02Å; T704-G706 VanDerWaalsContact C-N 3.27Å; T704-G706 PolarHBondContact O-N 3.1Å
705	Q	89.6	Confident	88	Confident	88 Å²	88	45.2 Å²	45.2	41%	0.411	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.2	175.8	-57.8	-52.5	-61.5	0	0	113.6	Y669 Y701 L702 F703 F707	Y669-Q705 HydrophobicContact CD1-CG 4.1Å; Y669-Q705 HydrophobicContact CE1-CB 4.3Å; Y669-Q705 HydrophobicContact CE1-CG 4.1Å; Y701-Q705 HydrophobicContact CE1-CG 4.37Å; Y701-Q705 HydrophobicContact CE2-CG 4.25Å; Y701-Q705 VanDerWaalsContact CE2-NE2 3.32Å; Y701-Q705 WeakPolarHBondContact O-CG 3.39Å; Y701-Q705 PolarHBondContact O-N 2.91Å; L702-Q705 WeakPolarHBondContact O-CB 3.33Å; L702-Q705 PolarHBondContact O-N 3.34Å; L702-Q705 VanDerWaalsContact O-N 3.09Å; F703-Q705 PolarHBondContact O-N 2.76Å; Q705-F707 HydrophobicContact CB-CD2 4.09Å; Q705-F707 HydrophobicContact CB-CE2 3.86Å
706	G	86.9	Confident	87.9	Confident	44 Å²	44	46.1 Å²	46.1	45%	0.454	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	15.9	176.9	0	0	0	0	0	115.2	F703 T704 D708	F703-G706 PolarHBondContact O-N 3.47Å; T704-G706 VanDerWaalsContact C-N 3.27Å; T704-G706 PolarHBondContact O-N 3.1Å; G706-D708 PolarHBondContact O-N 3.04Å
707	F	91.6	Very high	87.5	Confident	10 Å²	10	44.6 Å²	44.6	4%	0.044	23%	0.226	C	C	.	.			trans	-82	65	174	-58.4	-53.1	0	0	0	111.8	P575 D579 F666 Y669 L702 Q705 L710 K711	P575-F707 HydrophobicContact CB-CE1 3.73Å; P575-F707 HydrophobicContact CB-CZ 3.72Å; P575-F707 HydrophobicContact CG-CE1 4.14Å; P575-F707 HydrophobicContact CG-CZ 4.03Å; D579-F707 HydrophobicContact CB-CD1 3.97Å; D579-F707 VanDerWaalsContact OD1-CA 3.23Å; D579-F707 WeakPolarHBondContact OD1-CA 3.39Å; D579-F707 WeakPolarHBondContact OD1-CB 3.43Å; F666-F707 HydrophobicContact CE1-CD2 4.35Å; F666-F707 HydrophobicContact CE1-CE2 4.26Å; F666-F707 HydrophobicContact CE1-CZ 4.36Å; Y669-F707 HydrophobicContact CD1-CE2 4.24Å; Y669-F707 AromaticContact CE1-CE2 3.99Å; Y669-F707 HydrophobicContact CE1-CE2 3.99Å; Y669-F707 HydrophobicContact CE1-CZ 4.07Å; Y669-F707 HydrophobicContact CE2-CE2 4.4Å; Y669-F707 HydrophobicContact CE2-CZ 4.03Å; Y669-F707 AromaticContact CZ-CZ 3.71Å; L702-F707 HydrophobicContact CB-CD2 4.27Å; L702-F707 HydrophobicContact CD2-CD2 4.2Å; L702-F707 HydrophobicContact CD2-CE2 4.16Å; L702-F707 WeakPolarHBondContact O-CD2 3.1Å; Q705-F707 HydrophobicContact CB-CD2 4.09Å; Q705-F707 HydrophobicContact CB-CE2 3.86Å; F707-L710 HydrophobicContact CB-CB 4.28Å; F707-K711 PolarHBondContact O-N 3.42Å
708	D	90.6	Very high	87	Confident	86 Å²	86	38.7 Å²	38.7	46%	0.46	21%	0.205	S	C	.	.	H	α-helix	trans	-71.4	-33.3	-177.3	-72.1	-45.4	0	0	0	112.6	G706 L710 K711 D712	G706-D708 PolarHBondContact O-N 3.04Å; D708-L710 PolarHBondContact O-N 3.06Å; D708-K711 WeakPolarHBondContact O-CB 3.46Å; D708-K711 PolarHBondContact O-N 3.34Å; D708-D712 PolarHBondContact O-N 3.31Å
709	G	89.5	Confident	85.6	Confident	3 Å²	3	41 Å²	41	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-44.4	176.8	0	0	0	0	0	112.3	D579 F713	D579-G709 WeakPolarHBondContact OD1-CA 3.31Å; D579-G709 PolarHBondContact OD1-N 3Å; D579-G709 VanDerWaalsContact OD1-N 3.09Å; G709-F713 WeakPolarHBondContact O-CB 3.32Å; G709-F713 PolarHBondContact O-N 2.77Å
710	L	89.9	Confident	83.7	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-41.8	175.4	-175.1	67.4	0	0	0	111.5	D579 A582 L627 L660 F666 F707 D708 F713 L714	D579-L710 WeakPolarHBondContact OD1-CB 3.44Å; D579-L710 PolarHBondContact OD1-N 3.12Å; A582-L710 HydrophobicContact CB-CB 4.49Å; A582-L710 HydrophobicContact CB-CD1 4.32Å; L627-L710 HydrophobicContact CD1-CD1 4.25Å; L660-L710 HydrophobicContact CD2-CD1 4.15Å; L660-L710 HydrophobicContact CD2-CD2 3.77Å; F666-L710 HydrophobicContact CE1-CD2 4.49Å; F666-L710 HydrophobicContact CZ-CD2 4.14Å; F707-L710 HydrophobicContact CB-CB 4.28Å; D708-L710 PolarHBondContact O-N 3.06Å; L710-F713 PolarHBondContact O-N 3.24Å; L710-L714 HydrophobicContact CD1-CD1 4.09Å; L710-L714 HydrophobicContact CD1-CG 4.23Å; L710-L714 HydrophobicContact CD2-CD1 4.46Å; L710-L714 HydrophobicContact CG-CD1 3.87Å; L710-L714 HydrophobicContact CG-CG 4.37Å; L710-L714 WeakPolarHBondContact O-CB 3.38Å; L710-L714 VanDerWaalsContact O-CG 3.26Å; L710-L714 WeakPolarHBondContact O-CG 3.33Å; L710-L714 PolarHBondContact O-N 3.08Å
711	K	90	Very high	81.7	Confident	68 Å²	68	56 Å²	56	30%	0.296	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-52.4	175.8	-176.9	-175.1	175.9	-175.9	0	111.6	F703 F707 D708 F713 L714 Q715	F703-K711 HydrophobicContact CB-CD 4.26Å; F703-K711 HydrophobicContact CD1-CB 3.52Å; F703-K711 HydrophobicContact CD1-CD 4.43Å; F703-K711 HydrophobicContact CD1-CG 3.99Å; F703-K711 HydrophobicContact CD2-CB 4.44Å; F703-K711 HydrophobicContact CD2-CD 4.35Å; F703-K711 HydrophobicContact CD2-CG 4Å; F703-K711 HydrophobicContact CE1-CB 3.57Å; F703-K711 HydrophobicContact CE1-CG 4.1Å; F703-K711 HydrophobicContact CE2-CB 4.47Å; F703-K711 HydrophobicContact CE2-CG 4.1Å; F703-K711 HydrophobicContact CG-CB 4Å; F703-K711 HydrophobicContact CG-CD 4.1Å; F703-K711 HydrophobicContact CG-CG 3.94Å; F703-K711 HydrophobicContact CZ-CB 4.07Å; F703-K711 HydrophobicContact CZ-CG 4.15Å; F707-K711 PolarHBondContact O-N 3.42Å; D708-K711 WeakPolarHBondContact O-CB 3.46Å; D708-K711 PolarHBondContact O-N 3.34Å; K711-F713 VanDerWaalsContact C-N 3.31Å; K711-F713 PolarHBondContact O-N 2.75Å; K711-L714 PolarHBondContact O-N 3.24Å; K711-Q715 WeakPolarHBondContact O-CB 3.47Å; K711-Q715 VanDerWaalsContact O-CG 3.28Å; K711-Q715 WeakPolarHBondContact O-CG 3.34Å; K711-Q715 PolarHBondContact O-N 3.16Å
712	D	89.5	Confident	79.7	Confident	56 Å²	56	58.2 Å²	58.2	30%	0.299	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-39.1	-179.4	-76.5	-14.8	0	0	0	111.7	H586 D708 N716	H586-D712 PolarHBondContact ND1-O 3.24Å; D708-D712 PolarHBondContact O-N 3.31Å; D712-N716 WeakPolarHBondContact O-CB 3.19Å; D712-N716 PolarHBondContact O-N 3.11Å; D712-N716 PolarHBondContact O-ND2 3.35Å
713	F	89.4	Confident	77.6	Confident	1 Å²	1	61 Å²	61	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-51.4	175.9	-178.8	-97.3	0	0	0	112	A582 M585 H586 Q620 L623 V624 G709 L710 K711 N716 N717	A582-F713 HydrophobicContact CB-CB 3.83Å; A582-F713 HydrophobicContact CB-CG 4.14Å; M585-F713 HydrophobicContact CB-CD2 4.03Å; M585-F713 HydrophobicContact CB-CE2 3.88Å; H586-F713 HydrophobicContact CB-CB 4.43Å; Q620-F713 HydrophobicContact CG-CZ 4.46Å; L623-F713 HydrophobicContact CB-CE1 4.15Å; L623-F713 HydrophobicContact CB-CZ 3.82Å; L623-F713 HydrophobicContact CD1-CE2 4.19Å; L623-F713 HydrophobicContact CD1-CZ 4Å; V624-F713 HydrophobicContact CG2-CE1 4.07Å; V624-F713 HydrophobicContact CG2-CZ 4.07Å; G709-F713 WeakPolarHBondContact O-CB 3.32Å; G709-F713 PolarHBondContact O-N 2.77Å; L710-F713 PolarHBondContact O-N 3.24Å; K711-F713 VanDerWaalsContact C-N 3.31Å; K711-F713 PolarHBondContact O-N 2.75Å; F713-N716 PolarHBondContact O-N 3.13Å; F713-N717 VanDerWaalsContact CD2-ND2 3.32Å; F713-N717 WeakPolarHBondContact CD2-ND2 3.37Å; F713-N717 VanDerWaalsContact CE2-ND2 3.33Å; F713-N717 WeakPolarHBondContact CE2-ND2 3.44Å; F713-N717 WeakPolarHBondContact O-CB 3.32Å; F713-N717 PolarHBondContact O-N 3.34Å; F713-N717 VanDerWaalsContact O-N 3.11Å; F713-N717 PolarHBondContact O-ND2 3.1Å
714	L	86.4	Confident	75.2	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-46.2	-176.2	-68	172.8	0	0	0	111.6	W628 L660 L699 F703 L710 K711 N716 N717 I718 M723	W628-L714 HydrophobicContact CE3-CD2 3.9Å; W628-L714 HydrophobicContact CZ3-CD1 4.34Å; W628-L714 HydrophobicContact CZ3-CD2 4.27Å; L660-L714 HydrophobicContact CD1-CD1 4.05Å; L699-L714 HydrophobicContact CD2-CD1 4.33Å; F703-L714 HydrophobicContact CE1-CD1 4.38Å; F703-L714 HydrophobicContact CZ-CD1 4.17Å; L710-L714 HydrophobicContact CD1-CD1 4.09Å; L710-L714 HydrophobicContact CD1-CG 4.23Å; L710-L714 HydrophobicContact CD2-CD1 4.46Å; L710-L714 HydrophobicContact CG-CD1 3.87Å; L710-L714 HydrophobicContact CG-CG 4.37Å; L710-L714 WeakPolarHBondContact O-CB 3.38Å; L710-L714 VanDerWaalsContact O-CG 3.26Å; L710-L714 WeakPolarHBondContact O-CG 3.33Å; L710-L714 PolarHBondContact O-N 3.08Å; K711-L714 PolarHBondContact O-N 3.24Å; L714-N716 PolarHBondContact O-N 3.03Å; L714-N717 PolarHBondContact O-N 2.78Å; L714-I718 HydrophobicContact CB-CD1 4.36Å; L714-I718 HydrophobicContact CD2-CD1 3.52Å; L714-I718 VanDerWaalsContact O-CB 3.32Å; L714-I718 WeakPolarHBondContact O-CB 3.36Å; L714-I718 PolarHBondContact O-N 2.62Å; L714-M723 HydrophobicContact CB-CE 4.19Å
715	Q	84.9	Confident	72.9	Confident	86 Å²	86	64.5 Å²	64.5	40%	0.402	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-32.6	-179.5	-71.1	-176.3	2.4	0	0	113	K711 M723	K711-Q715 WeakPolarHBondContact O-CB 3.47Å; K711-Q715 VanDerWaalsContact O-CG 3.28Å; K711-Q715 WeakPolarHBondContact O-CG 3.34Å; K711-Q715 PolarHBondContact O-N 3.16Å; Q715-M723 HydrophobicContact CG-SD 4.17Å
716	N	80.1	Confident	70.6	Confident	61 Å²	61	62.4 Å²	62.4	33%	0.326	33%	0.326	S	S	.	.	H	α-helix	trans	-87.1	-24.3	-178.3	-77.2	-61	0	0	0	114	H586 K589 D712 F713 L714 K745	H586-N716 PolarHBondContact CE1-ND2 3.14Å; H586-N716 PolarHBondContact ND1-ND2 3.06Å; K589-N716 PolarHBondContact NZ-O 3.14Å; D712-N716 WeakPolarHBondContact O-CB 3.19Å; D712-N716 PolarHBondContact O-N 3.11Å; D712-N716 PolarHBondContact O-ND2 3.35Å; F713-N716 PolarHBondContact O-N 3.13Å; L714-N716 PolarHBondContact O-N 3.03Å; N716-K745 WeakPolarHBondContact O-CD 3.31Å; N716-K745 PolarHBondContact O-NZ 3.32Å
717	N	77.2	Confident	68.2	Low	3 Å²	3	66.9 Å²	66.9	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-98.8	-25.3	-177.8	-71.5	-64.7	0	0	0	113.7	K589 Q620 V624 F713 L714	K589-N717 PolarHBondContact NZ-OD1 3.33Å; Q620-N717 PolarHBondContact NE2-OD1 3.06Å; Q620-N717 PolarHBondContact OE1-OD1 3.49Å; V624-N717 HydrophobicContact CG2-CB 4.35Å; F713-N717 VanDerWaalsContact CD2-ND2 3.32Å; F713-N717 WeakPolarHBondContact CD2-ND2 3.37Å; F713-N717 VanDerWaalsContact CE2-ND2 3.33Å; F713-N717 WeakPolarHBondContact CE2-ND2 3.44Å; F713-N717 WeakPolarHBondContact O-CB 3.32Å; F713-N717 PolarHBondContact O-N 3.34Å; F713-N717 VanDerWaalsContact O-N 3.11Å; F713-N717 PolarHBondContact O-ND2 3.1Å; L714-N717 PolarHBondContact O-N 2.78Å
718	I	74.8	Confident	65.6	Low	15 Å²	15	77 Å²	77	8%	0.077	38%	0.378	C	S	.	.	S	Bend	trans	-109.7	141	-174.9	-52.6	-179.7	0	0	0	110.1	W628 L714 R720	W628-I718 HydrophobicContact CB-CD1 4.23Å; W628-I718 HydrophobicContact CD2-CD1 3.32Å; W628-I718 HydrophobicContact CE3-CD1 3.42Å; W628-I718 VanDerWaalsContact CE3-CD1 3.42Å; W628-I718 HydrophobicContact CG-CD1 3.69Å; W628-I718 HydrophobicContact CH2-CD1 4.22Å; W628-I718 HydrophobicContact CZ2-CD1 4.17Å; W628-I718 HydrophobicContact CZ2-CG2 4.15Å; W628-I718 HydrophobicContact CZ3-CD1 3.88Å; L714-I718 HydrophobicContact CB-CD1 4.36Å; L714-I718 HydrophobicContact CD2-CD1 3.52Å; L714-I718 VanDerWaalsContact O-CB 3.32Å; L714-I718 WeakPolarHBondContact O-CB 3.36Å; L714-I718 PolarHBondContact O-N 2.62Å; I718-R720 PolarHBondContact O-N 3.37Å
719	S	58.3	Low	62.9	Low	49 Å²	49	84.5 Å²	84.5	34%	0.343	40%	0.399	S	S	.	.			trans	-68.7	128.4	-175.8	-68.4	0	0	0	0	112.6	R721 V722	S719-R721 PolarHBondContact O-N 3.39Å; S719-V722 PolarHBondContact O-N 3.35Å
720	R	47	Very low	60.3	Low	217 Å²	217	93.5 Å²	93.5	82%	0.819	44%	0.441	S	S	*	.	H	α-helix	trans	-49.5	-25.5	179.8	-94.2	-175.9	-179.3	179.8	-0.7	115.3	I718 V722 M723 M724	I718-R720 PolarHBondContact O-N 3.37Å; R720-V722 PolarHBondContact O-N 3.43Å; R720-M723 PolarHBondContact O-N 3.07Å; R720-M724 PolarHBondContact O-N 2.92Å
721	R	43.3	Very low	57.4	Low	232 Å²	232	101.1 Å²	101.1	88%	0.875	48%	0.481	S	S	*	.	H	α-helix	trans	-60.2	-24.2	177.8	-79	-174.7	177.3	-177.8	-0.9	113.3	S719	S719-R721 PolarHBondContact O-N 3.39Å
722	V	48	Very low	54.5	Low	73 Å²	73	101.1 Å²	101.1	44%	0.442	50%	0.5	S	S	.	.	H	α-helix	trans	-86.6	-31.4	180	-177.5	0	0	0	0	112.4	W628 S719 R720	W628-V722 HydrophobicContact CZ2-CG1 3.97Å; S719-V722 PolarHBondContact O-N 3.35Å; R720-V722 PolarHBondContact O-N 3.43Å
723	M	44.3	Very low	51.5	Low	59 Å²	59	104.5 Å²	104.5	29%	0.291	52%	0.524	S	S	.	.	H	α-helix	trans	-79.9	-25	179.7	-77.1	-168	159.4	0	0	113.9	W628 L699 F703 L714 Q715 R720	W628-M723 HydrophobicContact CH2-CE 4.44Å; L699-M723 HydrophobicContact CD1-CE 4.08Å; F703-M723 HydrophobicContact CE2-CE 4.44Å; F703-M723 HydrophobicContact CZ-CE 4.38Å; L714-M723 HydrophobicContact CB-CE 4.19Å; Q715-M723 HydrophobicContact CG-SD 4.17Å; R720-M723 PolarHBondContact O-N 3.07Å
724	M	39.1	Very low	48.6	Very low	139 Å²	139	113.2 Å²	113.2	69%	0.685	56%	0.564	S	S	*	*	S	Bend	trans	-102.1	0.9	-177.9	-74.7	-72.1	-157.2	0	0	114.4	R720 G726 D727	R720-M724 PolarHBondContact O-N 2.92Å; M724-G726 PolarHBondContact O-N 3.05Å; M724-D727 PolarHBondContact O-N 3.47Å
725	A	39.9	Very low	45.6	Very low	62 Å²	62	118.2 Å²	118.2	51%	0.512	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-5.9	-178.4	0	0	0	0	0	114
726	G	41.7	Very low	43.1	Very low	45 Å²	45	123 Å²	123	46%	0.464	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-16.9	175	0	0	0	0	0	115.2	M724	M724-G726 PolarHBondContact O-N 3.05Å
727	D	35.9	Very low	40.4	Very low	137 Å²	137	129.2 Å²	129.2	73%	0.733	65%	0.649	S	S	*	*	S	Bend	trans	-113.6	3.5	-164.2	-149.6	28.3	0	0	0	115.1	M724	M724-D727 PolarHBondContact O-N 3.47Å
728	R	37.8	Very low	37.9	Very low	224 Å²	224	136.2 Å²	136.2	85%	0.845	69%	0.686	S	S	*	*			trans	-145.9	99.8	171.3	-68.6	-170.3	-172.1	-170.4	1.1	111.3
729	R	34.1	Very low	35.7	Very low	243 Å²	243	144.9 Å²	144.9	92%	0.917	73%	0.726	S	S	*	*			trans	-177.6	73.5	149	-99.8	165.4	-167.2	-153.9	3.5	110.3
730	E	34.1	Very low	34	Very low	192 Å²	192	147.8 Å²	147.8	90%	0.897	75%	0.746	S	S	*	*			trans	-110.4	91.5	137.2	-78.5	-171.8	171.9	0	0	105.3
731	D	30.1	Very low	33.1	Very low	159 Å²	159	141.6 Å²	141.6	85%	0.85	74%	0.741	S	S	*	*	S	Bend	trans	174.6	118	140.6	-91.6	-20	0	0	0	110.2
732	G	29.2	Very low	32.4	Very low	68 Å²	68	133.6 Å²	133.6	70%	0.701	72%	0.719	S	S	*	*			trans	58	113	140.2	0	0	0	0	0	121.3
733	T	27	Very low	31.8	Very low	128 Å²	128	138.2 Å²	138.2	79%	0.785	74%	0.736	S	S	*	*			trans	77.3	117.9	139.4	28.5	0	0	0	0	121.3
734	Q	26.6	Very low	31.7	Very low	183 Å²	183	138.2 Å²	138.2	86%	0.855	74%	0.737	S	S	*	*			trans	61.7	130.4	138.2	-72.7	-178.5	3.2	0	0	117.3
735	S	24.3	Very low	32.4	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	72%	0.724	S	S	*	*			cis	-161.5	168.5	25.8	-70.4	0	0	0	0	110.2
736	Q	31.8	Very low	32.8	Very low	188 Å²	188	140.9 Å²	140.9	88%	0.879	74%	0.735	S	S	*	*			trans	-46	132.1	171.7	-67	163.5	-47.4	0	0	113.9
737	E	23.9	Very low	33.4	Very low	190 Å²	190	142.4 Å²	142.4	89%	0.888	74%	0.737	S	S	*	*			trans	-152	138.7	147.4	-117.9	175.5	-165.3	0	0	109.7
738	L	25.2	Very low	34.3	Very low	151 Å²	151	137.2 Å²	137.2	79%	0.791	71%	0.709	S	S	*	*			trans	-66.1	155.3	-163.8	-83.8	81.6	0	0	0	114.5	S740	L738-S740 PolarHBondContact O-N 3.16Å; L738-S740 VanDerWaalsContact O-N 3.1Å
739	E	27.8	Very low	34.8	Very low	197 Å²	197	130.9 Å²	130.9	92%	0.921	69%	0.691	S	S	*	*			trans	-13.5	99	152	-66	175.1	151.3	0	0	115
740	S	23.7	Very low	35.1	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	69%	0.69	S	S	*	*			trans	-123.7	117	161.3	68.9	0	0	0	0	108.7	L738	L738-S740 PolarHBondContact O-N 3.16Å; L738-S740 VanDerWaalsContact O-N 3.1Å
741	A	26.7	Very low	35.2	Very low	86 Å²	86	122 Å²	122	71%	0.711	68%	0.679	S	S	*	*			trans	-49.3	148.3	175.5	0	0	0	0	0	112.1	Q743	A741-Q743 PolarHBondContact O-N 3.38Å; A741-Q743 VanDerWaalsContact O-N 3.16Å
742	P	29.7	Very low	35.4	Very low	64 Å²	64	120.1 Å²	120.1	42%	0.416	67%	0.67	S	S	.	*			trans	-61.4	120.1	-178	24.1	-32.4	0	0	0	111.1	N629 I744	N629-P742 WeakPolarHBondContact OD1-CG 3.3Å; P742-I744 PolarHBondContact O-N 3.37Å
743	Q	35	Very low	35.8	Very low	171 Å²	171	122.9 Å²	122.9	80%	0.799	67%	0.669	S	S	*	*			trans	-69.7	112.9	175.8	-75.2	-179	-13.9	0	0	110.6	A741	A741-Q743 PolarHBondContact O-N 3.38Å; A741-Q743 VanDerWaalsContact O-N 3.16Å
744	I	43.3	Very low	36.3	Very low	59 Å²	59	122.6 Å²	122.6	30%	0.303	66%	0.662	S	S	.	*			trans	-61.5	136.7	165	-58.5	175.2	0	0	0	107.8	V624 P742 Q746	V624-I744 HydrophobicContact CG1-CD1 4.14Å; V624-I744 HydrophobicContact CG1-CG1 4.19Å; P742-I744 PolarHBondContact O-N 3.37Å; I744-Q746 PolarHBondContact O-N 2.92Å
745	K	53.2	Low	36.9	Very low	98 Å²	98	118.9 Å²	118.9	43%	0.426	65%	0.65	S	S	.	*			trans	-53.2	128.7	170.2	-76.3	-177	-173.7	165	0	108.7	N716	N716-K745 WeakPolarHBondContact O-CD 3.31Å; N716-K745 PolarHBondContact O-NZ 3.32Å
746	Q	48.9	Very low	37.8	Very low	159 Å²	159	119.7 Å²	119.7	74%	0.743	64%	0.643	S	S	*	*			trans	-41.1	139.1	-171.3	-76.2	-178.8	-18.4	0	0	113.3	I744	I744-Q746 PolarHBondContact O-N 2.92Å
747	P	52.3	Low	38.2	Very low	77 Å²	77	114.8 Å²	114.8	50%	0.5	63%	0.626	S	S	.	*			trans	-57.4	145.9	178.1	22.9	-31.8	0	0	0	110.9	L749 S750	P747-L749 PolarHBondContact O-N 3.44Å; P747-S750 PolarHBondContact O-OG 3.13Å
748	L	56.2	Low	39.3	Very low	28 Å²	28	109 Å²	109	15%	0.147	61%	0.606	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	-1.4	-174.7	-72.6	170.9	0	0	0	114.4	L592 K596 F613 F616 N617	L592-L748 HydrophobicContact CB-CD1 4.14Å; K596-L748 PolarHBondContact NZ-O 3.15Å; F613-L748 HydrophobicContact CD1-CB 4.14Å; F613-L748 HydrophobicContact CD1-CD1 4.39Å; F616-L748 HydrophobicContact CD1-CD1 3.78Å; F616-L748 HydrophobicContact CE1-CD1 3.59Å; N617-L748 PolarHBondContact OD1-N 3.48Å
749	L	48.6	Very low	40.5	Very low	91 Å²	91	105.5 Å²	105.5	48%	0.476	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	5	-175.5	-73.7	161.7	0	0	0	115	F613 R614 N617 P747	F613-L749 HydrophobicContact CB-CD2 4.05Å; R614-L749 HydrophobicContact CG-CD1 3.87Å; R614-L749 HydrophobicContact CG-CD2 4.39Å; N617-L749 VanDerWaalsContact ND2-CD1 3.34Å; N617-L749 WeakPolarHBondContact ND2-CD1 3.34Å; N617-L749 WeakPolarHBondContact ND2-CG 3.13Å; P747-L749 PolarHBondContact O-N 3.44Å
750	S	40.2	Very low	41.6	Very low	126 Å²	126	97.2 Å²	97.2	88%	0.881	56%	0.561	S	S	*	*			trans	-81.3	0	172.5	45.6	0	0	0	0	113.8	K596 P747	K596-S750 PolarHBondContact NZ-O 2.9Å; P747-S750 PolarHBondContact O-OG 3.13Å

Retrieved 750 of 750 residues in 270.7 ms (Link to these results)

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