A0A5K4F215_SCHMA Loading...

Small nuclear RNA activating complex, polypeptide 1b

AlphaFold DB , UniProt , Accession A0A5K4F215, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 453 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	38	Very low	33.3	Very low	248 Å²	248	142.6 Å²	142.6	100%	1.222	83%	0.83	S	S	*	*				0	89	0	-61.3	-50.9	-153.3	0	0	108.4
2	G	31.8	Very low	33.6	Very low	80 Å²	80	145.6 Å²	145.6	83%	0.825	82%	0.819	S	S	*	*			trans	-121.1	117.8	175.4	0	0	0	0	0	108.6
3	G	32.7	Very low	33.5	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	79%	0.786	S	S	*	*			trans	-93.2	115.8	168.6	0	0	0	0	0	108.5
4	Q	36.3	Very low	33.3	Very low	195 Å²	195	134.7 Å²	134.7	91%	0.911	78%	0.78	S	S	*	*			trans	-76.6	121.7	165.4	-72.7	172.8	-110.7	0	0	107.5	E6	Q4-E6 PolarHBondContact O-N 3.38Å
5	Q	36	Very low	33.4	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.874	76%	0.763	S	S	*	*			trans	-78.2	114.4	165	-72.8	-178.7	-63.7	0	0	107.6	T7	Q5-T7 PolarHBondContact O-N 3.18Å
6	E	32.3	Very low	33.7	Very low	180 Å²	180	136.1 Å²	136.1	84%	0.841	75%	0.754	S	S	*	*			trans	-76.2	111.3	174	-166.3	154.8	-144.5	0	0	107.9	Q4	Q4-E6 PolarHBondContact O-N 3.38Å
7	T	34.1	Very low	34.2	Very low	120 Å²	120	129.3 Å²	129.3	74%	0.736	72%	0.716	S	S	*	*			trans	-92	105	-177.9	53.8	0	0	0	0	109.7	Q5 S9	Q5-T7 PolarHBondContact O-N 3.18Å; T7-S9 PolarHBondContact O-N 3.45Å
8	D	31	Very low	34.3	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	71%	0.71	S	S	*	*			trans	-58.8	93.4	179.1	-74.1	-43.8	0	0	0	112.4	V10	D8-V10 PolarHBondContact O-N 3.1Å
9	S	31.3	Very low	34.9	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	67%	0.673	S	S	*	*			trans	-77.9	89.3	174.7	49	0	0	0	0	109.9	T7 T11	T7-S9 PolarHBondContact O-N 3.45Å; S9-T11 VanDerWaalsContact C-N 3.32Å; S9-T11 PolarHBondContact O-N 3.36Å; S9-T11 PolarHBondContact O-OG1 3.39Å
10	V	34.2	Very low	35.1	Very low	110 Å²	110	119.5 Å²	119.5	67%	0.667	66%	0.664	S	S	*	*			trans	-54.3	94.8	175.1	-179.6	0	0	0	0	109.8	D8 Y12	D8-V10 PolarHBondContact O-N 3.1Å; V10-Y12 HydrophobicContact CG1-CD2 4.35Å; V10-Y12 HydrophobicContact CG1-CE2 4.01Å; V10-Y12 WeakPolarHBondContact O-CD2 3.5Å; V10-Y12 PolarHBondContact O-N 3.11Å
11	T	28.4	Very low	35.4	Very low	122 Å²	122	119.7 Å²	119.7	75%	0.748	66%	0.659	S	S	*	*			trans	-80.8	95.6	-172.2	-63.3	0	0	0	0	108.5	S9 G13	S9-T11 VanDerWaalsContact C-N 3.32Å; S9-T11 PolarHBondContact O-N 3.36Å; S9-T11 PolarHBondContact O-OG1 3.39Å; T11-G13 PolarHBondContact O-N 2.98Å
12	Y	37.3	Very low	35.8	Very low	178 Å²	178	111.8 Å²	111.8	70%	0.698	62%	0.621	S	S	*	*			trans	-62.2	105.9	168.8	-76	-94.9	0	0	0	108.5	V10	V10-Y12 HydrophobicContact CG1-CD2 4.35Å; V10-Y12 HydrophobicContact CG1-CE2 4.01Å; V10-Y12 WeakPolarHBondContact O-CD2 3.5Å; V10-Y12 PolarHBondContact O-N 3.11Å
13	G	32.2	Very low	36.6	Very low	38 Å²	38	112.9 Å²	112.9	39%	0.392	61%	0.614	S	S	.	*			trans	-54.5	151.3	173.3	0	0	0	0	0	111.2	T11 Y15	T11-G13 PolarHBondContact O-N 2.98Å; G13-Y15 WeakPolarHBondContact O-CD2 3.48Å; G13-Y15 WeakPolarHBondContact O-CE2 3.3Å; G13-Y15 PolarHBondContact O-N 3.07Å
14	S	30.1	Very low	37.7	Very low	101 Å²	101	110.7 Å²	110.7	71%	0.706	58%	0.583	S	S	*	*			trans	-64.7	96.6	-173.2	-170.7	0	0	0	0	111.9
15	Y	35.7	Very low	38.7	Very low	132 Å²	132	110.2 Å²	110.2	52%	0.518	58%	0.583	S	S	.	*			trans	-104.9	117.4	171.8	-61.1	-71	0	0	0	109	G13 P159	G13-Y15 WeakPolarHBondContact O-CD2 3.48Å; G13-Y15 WeakPolarHBondContact O-CE2 3.3Å; G13-Y15 PolarHBondContact O-N 3.07Å; Y15-P159 HydrophobicContact CD1-CG 4.28Å; Y15-P159 HydrophobicContact CE1-CB 4.4Å; Y15-P159 HydrophobicContact CE1-CG 4.07Å
16	Y	37.1	Very low	40.1	Very low	160 Å²	160	102.4 Å²	102.4	63%	0.627	55%	0.552	S	S	*	*			trans	-83.9	131.3	169.8	-59.8	-79.8	0	0	0	110.3	Q18 Y155	Y16-Q18 VanDerWaalsContact C-N 3.27Å; Y16-Q18 PolarHBondContact O-N 3.49Å; Y16-Y155 PolarHBondContact O-OH 3.03Å
17	L	42.1	Very low	42	Very low	20 Å²	20	93.8 Å²	93.8	11%	0.105	51%	0.512	C	S	.	.			trans	-72.8	75.4	176.3	-74.6	177.8	0	0	0	112.4	I19 L27 D28 I31 C77	L17-I19 VanDerWaalsContact C-N 3.31Å; L17-I19 PolarHBondContact O-N 3.32Å; L17-L27 HydrophobicContact CB-CD2 4.34Å; L17-L27 HydrophobicContact CD1-CD2 3.89Å; L17-L27 HydrophobicContact CD1-CG 4.03Å; L17-D28 VanDerWaalsContact CB-OD2 3.31Å; L17-D28 WeakPolarHBondContact CB-OD2 3.49Å; L17-D28 WeakPolarHBondContact CD1-OD1 3.46Å; L17-D28 WeakPolarHBondContact CG-OD1 3.34Å; L17-D28 WeakPolarHBondContact CG-OD2 3.44Å; L17-D28 PolarHBondContact N-OD2 3.43Å; L17-I31 HydrophobicContact CD1-CD1 4.17Å; L17-C77 HydrophobicContact CD1-CB 3.78Å; L17-C77 HydrophobicContact CD2-CB 3.64Å; L17-C77 HydrophobicContact CG-CB 4.26Å
18	Q	36.5	Very low	43.6	Very low	129 Å²	129	88.8 Å²	88.8	60%	0.603	48%	0.481	S	S	*	.			trans	-72.7	85.7	171.8	-65.7	-166.1	0.2	0	0	111.1	Y16 A20 Y155	Y16-Q18 VanDerWaalsContact C-N 3.27Å; Y16-Q18 PolarHBondContact O-N 3.49Å; Q18-A20 PolarHBondContact O-N 3.12Å; Q18-Y155 HydrophobicContact CB-CE2 4.26Å; Q18-Y155 WeakPolarHBondContact O-CD1 3.29Å
19	I	46.1	Very low	45.8	Very low	3 Å²	3	86.7 Å²	86.7	2%	0.015	47%	0.466	C	S	.	.			trans	-60.6	101.5	169.5	-71	-176.3	0	0	0	109.3	L17 F21 N22 P23 I24 L27 D73 I74	L17-I19 VanDerWaalsContact C-N 3.31Å; L17-I19 PolarHBondContact O-N 3.32Å; I19-F21 PolarHBondContact O-N 3.18Å; I19-N22 WeakPolarHBondContact CB-O 3.48Å; I19-N22 HydrophobicContact CG2-CB 4.38Å; I19-N22 WeakPolarHBondContact CG2-O 3.29Å; I19-N22 CarbonylContact O-C 3.59Å; I19-N22 PolarHBondContact O-N 3.29Å; I19-N22 VanDerWaalsContact O-N 3.13Å; I19-P23 WeakPolarHBondContact O-CA 3.41Å; I19-P23 VanDerWaalsContact O-N 3.11Å; I19-I24 HydrophobicContact CD1-CB 4.45Å; I19-I24 HydrophobicContact CD1-CD1 3.94Å; I19-I24 HydrophobicContact CD1-CG1 4Å; I19-L27 HydrophobicContact CD1-CD2 3.45Å; I19-L27 VanDerWaalsContact CD1-CD2 3.45Å; I19-L27 HydrophobicContact CG1-CD2 4.28Å; I19-D73 HydrophobicContact CB-CB 4.28Å; I19-D73 HydrophobicContact CD1-CB 4.46Å; I19-D73 HydrophobicContact CG1-CB 4.09Å; I19-D73 HydrophobicContact CG2-CB 3.63Å; I19-D73 VanDerWaalsContact CG2-OD2 3.29Å; I19-D73 WeakPolarHBondContact CG2-OD2 3.31Å; I19-I74 HydrophobicContact CD1-CG1 3.67Å
20	A	38.4	Very low	48.2	Very low	59 Å²	59	85.3 Å²	85.3	49%	0.488	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-30	-167.8	0	0	0	0	0	114.4	Q18	Q18-A20 PolarHBondContact O-N 3.12Å
21	F	40.9	Very low	50.4	Low	125 Å²	125	80.3 Å²	80.3	55%	0.548	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-9.5	-177.6	-63.7	-76.5	0	0	0	114.9	I19 H69 D73	I19-F21 PolarHBondContact O-N 3.18Å; F21-H69 HydrophobicContact CB-CB 4.37Å; F21-H69 HydrophobicContact CD2-CB 3.84Å; F21-H69 HydrophobicContact CE2-CB 4.31Å; F21-H69 HydrophobicContact CG-CB 4.02Å; F21-D73 WeakPolarHBondContact CD2-OD2 3.17Å; F21-D73 PolarHBondContact N-OD2 3.18Å
22	N	46.2	Very low	52.8	Low	81 Å²	81	78.8 Å²	78.8	43%	0.433	41%	0.405	S	S	.	.	S	Bend	trans	-170.7	81.7	178.1	-88.6	-77.7	0	0	0	109.3	I19 I24 R65	I19-N22 WeakPolarHBondContact CB-O 3.48Å; I19-N22 HydrophobicContact CG2-CB 4.38Å; I19-N22 WeakPolarHBondContact CG2-O 3.29Å; I19-N22 CarbonylContact O-C 3.59Å; I19-N22 PolarHBondContact O-N 3.29Å; I19-N22 VanDerWaalsContact O-N 3.13Å; N22-I24 PolarHBondContact O-N 3.48Å; N22-R65 PolarHBondContact O-NH2 3.24Å
23	P	48.7	Very low	55	Low	103 Å²	103	72 Å²	72	67%	0.669	39%	0.385	S	S	*	.			trans	-56.5	127	-175.3	21.8	-33.2	0	0	0	111.5	I19	I19-P23 WeakPolarHBondContact O-CA 3.41Å; I19-P23 VanDerWaalsContact O-N 3.11Å
24	I	56.6	Low	57.6	Low	35 Å²	35	70.2 Å²	70.2	18%	0.179	37%	0.367	C	S	.	.			trans	-102.5	105.1	168.9	-55.1	-179.9	0	0	0	106.8	I19 N22 L27 L61 I74	I19-I24 HydrophobicContact CD1-CB 4.45Å; I19-I24 HydrophobicContact CD1-CD1 3.94Å; I19-I24 HydrophobicContact CD1-CG1 4Å; N22-I24 PolarHBondContact O-N 3.48Å; I24-L27 HydrophobicContact CB-CB 3.87Å; I24-L27 HydrophobicContact CD1-CD1 4.49Å; I24-L27 HydrophobicContact CD1-CD2 4.37Å; I24-L27 HydrophobicContact CG2-CB 3.75Å; I24-L61 HydrophobicContact CD1-CD2 4.34Å; I24-I74 HydrophobicContact CD1-CD1 4.02Å; I24-I74 HydrophobicContact CD1-CG1 4.26Å
25	M	56.8	Low	60.1	Low	184 Å²	184	65.8 Å²	65.8	91%	0.906	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	137.7	161.3	-60.8	177.3	68.3	0	0	108
26	G	67.1	Low	62.4	Low	23 Å²	23	65 Å²	65	24%	0.237	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-4.4	-175.7	0	0	0	0	0	115.2	E29 D30	G26-E29 WeakPolarHBondContact CA-OE2 3.49Å; G26-E29 PolarHBondContact N-OE2 2.93Å; G26-D30 WeakPolarHBondContact O-CB 3.39Å; G26-D30 VanDerWaalsContact O-CG 3.31Å; G26-D30 PolarHBondContact O-N 3.15Å
27	L	71.3	Confident	64.7	Low	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.9	-38.5	-177.6	179	63.3	0	0	0	112.9	L17 I19 I24 E29 I31 L61	L17-L27 HydrophobicContact CB-CD2 4.34Å; L17-L27 HydrophobicContact CD1-CD2 3.89Å; L17-L27 HydrophobicContact CD1-CG 4.03Å; I19-L27 HydrophobicContact CD1-CD2 3.45Å; I19-L27 VanDerWaalsContact CD1-CD2 3.45Å; I19-L27 HydrophobicContact CG1-CD2 4.28Å; I24-L27 HydrophobicContact CB-CB 3.87Å; I24-L27 HydrophobicContact CD1-CD1 4.49Å; I24-L27 HydrophobicContact CD1-CD2 4.37Å; I24-L27 HydrophobicContact CG2-CB 3.75Å; L27-E29 VanDerWaalsContact C-N 3.34Å; L27-I31 HydrophobicContact CD1-CD1 3.73Å; L27-I31 HydrophobicContact CD1-CG1 4.1Å; L27-I31 HydrophobicContact CD2-CD1 4.48Å; L27-I31 HydrophobicContact CG-CD1 3.74Å; L27-I31 HydrophobicContact CG-CG1 4.48Å; L27-I31 WeakPolarHBondContact O-CB 3.48Å; L27-I31 WeakPolarHBondContact O-CD1 3.42Å; L27-I31 WeakPolarHBondContact O-CG1 3.46Å; L27-I31 PolarHBondContact O-N 3.49Å; L27-L61 HydrophobicContact CD1-CD1 3.7Å; L27-L61 HydrophobicContact CD1-CD2 4.03Å; L27-L61 HydrophobicContact CD1-CG 4.43Å
28	D	67.1	Low	66.8	Low	15 Å²	15	59.1 Å²	59.1	8%	0.08	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-46.8	177.1	-78.7	-59.9	0	0	0	110	L17 I31 E32 R81	L17-D28 VanDerWaalsContact CB-OD2 3.31Å; L17-D28 WeakPolarHBondContact CB-OD2 3.49Å; L17-D28 WeakPolarHBondContact CD1-OD1 3.46Å; L17-D28 WeakPolarHBondContact CG-OD1 3.34Å; L17-D28 WeakPolarHBondContact CG-OD2 3.44Å; L17-D28 PolarHBondContact N-OD2 3.43Å; D28-I31 PolarHBondContact O-N 3.03Å; D28-E32 WeakPolarHBondContact O-CB 3.44Å; D28-E32 PolarHBondContact O-N 3.31Å; D28-R81 VanDerWaalsContact CG-NH1 3.29Å; D28-R81 IonicContact OD1-CZ 3.87Å; D28-R81 IonicContact OD1-NE 3.86Å; D28-R81 IonicContact OD1-NH1 2.6Å; D28-R81 PolarHBondContact OD1-NH1 3.08Å
29	E	78.8	Confident	69	Low	106 Å²	106	56 Å²	56	50%	0.495	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-41.1	-179.7	-55.1	93	144.5	0	0	111.9	G26 L27 A33	G26-E29 WeakPolarHBondContact CA-OE2 3.49Å; G26-E29 PolarHBondContact N-OE2 2.93Å; L27-E29 VanDerWaalsContact C-N 3.34Å; E29-A33 WeakPolarHBondContact O-CB 3.44Å; E29-A33 PolarHBondContact O-N 2.88Å
30	D	81.2	Confident	70.8	Confident	68 Å²	68	62.3 Å²	62.3	36%	0.364	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-43.6	172.7	-87	-16.1	0	0	0	111.6	G26 F34 M58	G26-D30 WeakPolarHBondContact O-CB 3.39Å; G26-D30 VanDerWaalsContact O-CG 3.31Å; G26-D30 PolarHBondContact O-N 3.15Å; D30-F34 WeakPolarHBondContact O-CB 3.42Å; D30-F34 PolarHBondContact O-N 3.16Å; D30-F34 VanDerWaalsContact O-N 3.13Å; D30-M58 HydrophobicContact CB-CE 4.05Å; D30-M58 WeakPolarHBondContact O-CE 3.41Å
31	I	79.1	Confident	72.8	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-70.5	-40.4	179	-69.1	164.4	0	0	0	111	L17 L27 D28 T35 I78 R81 L82	L17-I31 HydrophobicContact CD1-CD1 4.17Å; L27-I31 HydrophobicContact CD1-CD1 3.73Å; L27-I31 HydrophobicContact CD1-CG1 4.1Å; L27-I31 HydrophobicContact CD2-CD1 4.48Å; L27-I31 HydrophobicContact CG-CD1 3.74Å; L27-I31 HydrophobicContact CG-CG1 4.48Å; L27-I31 WeakPolarHBondContact O-CB 3.48Å; L27-I31 WeakPolarHBondContact O-CD1 3.42Å; L27-I31 WeakPolarHBondContact O-CG1 3.46Å; L27-I31 PolarHBondContact O-N 3.49Å; D28-I31 PolarHBondContact O-N 3.03Å; I31-T35 VanDerWaalsContact O-CB 3.27Å; I31-T35 WeakPolarHBondContact O-CB 3.36Å; I31-T35 PolarHBondContact O-N 2.87Å; I31-T35 PolarHBondContact O-OG1 2.94Å; I31-I78 HydrophobicContact CD1-CD1 4.42Å; I31-I78 HydrophobicContact CD1-CG1 3.62Å; I31-I78 HydrophobicContact CG1-CG1 4.31Å; I31-R81 HydrophobicContact CG2-CG 4.4Å; I31-L82 HydrophobicContact CG2-CD1 4.02Å; I31-L82 HydrophobicContact CG2-CD2 4.14Å; I31-L82 HydrophobicContact CG2-CG 4.2Å
32	E	80.1	Confident	74.2	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-59.7	178.8	-170.8	124.2	-96.9	0	0	110.1	D28 F34 T35 E36 R81	D28-E32 WeakPolarHBondContact O-CB 3.44Å; D28-E32 PolarHBondContact O-N 3.31Å; E32-F34 VanDerWaalsContact C-N 3.25Å; E32-F34 PolarHBondContact O-N 2.96Å; E32-T35 CarbonylContact O-C 3.33Å; E32-T35 WeakPolarHBondContact O-CA 3.44Å; E32-T35 PolarHBondContact O-N 2.92Å; E32-E36 WeakPolarHBondContact O-CG 3.45Å; E32-E36 PolarHBondContact O-N 3.28Å; E32-R81 IonicContact OE1-CZ 2.94Å; E32-R81 IonicContact OE1-NH2 3.74Å; E32-R81 PolarHBondContact OE1-NH2 3.41Å; E32-R81 IonicContact OE2-CZ 3.93Å; E32-R81 IonicContact OE2-NH2 2.74Å; E32-R81 PolarHBondContact OE2-NH2 2.87Å
33	A	84.2	Confident	75.5	Confident	34 Å²	34	59 Å²	59	28%	0.281	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-34.7	179.2	0	0	0	0	0	112.8	E29 E37 Y56	E29-A33 WeakPolarHBondContact O-CB 3.44Å; E29-A33 PolarHBondContact O-N 2.88Å; A33-E37 PolarHBondContact O-N 3.32Å; A33-Y56 HydrophobicContact CB-CE1 4.14Å; A33-Y56 PolarHBondContact O-OH 3.44Å
34	F	86	Confident	77.1	Confident	1 Å²	1	55.5 Å²	55.5	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-37.7	173	-178.4	-85.7	0	0	0	112.8	D30 E32 F38 F49 L52 Y56 M58 L91	D30-F34 WeakPolarHBondContact O-CB 3.42Å; D30-F34 PolarHBondContact O-N 3.16Å; D30-F34 VanDerWaalsContact O-N 3.13Å; E32-F34 VanDerWaalsContact C-N 3.25Å; E32-F34 PolarHBondContact O-N 2.96Å; F34-F38 VanDerWaalsContact O-CB 3.27Å; F34-F38 WeakPolarHBondContact O-CB 3.35Å; F34-F38 PolarHBondContact O-N 3.34Å; F34-F49 HydrophobicContact CE1-CD2 4.06Å; F34-F49 AromaticContact CE1-CE2 3.75Å; F34-F49 HydrophobicContact CE1-CE2 3.75Å; F34-F49 AromaticContact CZ-CD2 3.8Å; F34-F49 HydrophobicContact CZ-CD2 3.8Å; F34-F49 AromaticContact CZ-CE2 3.54Å; F34-F49 HydrophobicContact CZ-CE2 3.54Å; F34-F49 HydrophobicContact CZ-CZ 4.41Å; F34-L52 HydrophobicContact CD2-CB 4.42Å; F34-L52 HydrophobicContact CE2-CB 3.71Å; F34-L52 HydrophobicContact CZ-CB 4.06Å; F34-Y56 AromaticContact CD2-CD2 3.91Å; F34-Y56 HydrophobicContact CD2-CD2 3.91Å; F34-Y56 AromaticContact CD2-CG 4Å; F34-Y56 HydrophobicContact CD2-CG 4Å; F34-M58 HydrophobicContact CB-CE 3.81Å; F34-M58 HydrophobicContact CD2-CE 3.89Å; F34-M58 HydrophobicContact CD2-CG 3.87Å; F34-M58 HydrophobicContact CD2-SD 4.42Å; F34-M58 HydrophobicContact CE2-CG 3.94Å; F34-M58 HydrophobicContact CG-CE 4.06Å; F34-L91 HydrophobicContact CD1-CD1 4.28Å; F34-L91 HydrophobicContact CD1-CD2 4.28Å; F34-L91 HydrophobicContact CE1-CD1 4.14Å; F34-L91 HydrophobicContact CE1-CD2 3.72Å; F34-L91 HydrophobicContact CE1-CG 4.17Å; F34-L91 HydrophobicContact CZ-CD2 4.05Å
35	T	82.5	Confident	78.5	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-79.3	-34.4	-177.5	-58.1	0	0	0	0	111.7	I31 E32 A39 L82	I31-T35 VanDerWaalsContact O-CB 3.27Å; I31-T35 WeakPolarHBondContact O-CB 3.36Å; I31-T35 PolarHBondContact O-N 2.87Å; I31-T35 PolarHBondContact O-OG1 2.94Å; E32-T35 CarbonylContact O-C 3.33Å; E32-T35 WeakPolarHBondContact O-CA 3.44Å; E32-T35 PolarHBondContact O-N 2.92Å; T35-A39 PolarHBondContact O-N 2.97Å; T35-A39 VanDerWaalsContact O-N 3.08Å; T35-L82 HydrophobicContact CG2-CD2 3.83Å; T35-L82 WeakPolarHBondContact OG1-CD2 3.29Å
36	E	84.2	Confident	80	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-54.9	170.4	-69.8	178.6	153.1	0	0	110.5	E32 F38 A39 D40	E32-E36 WeakPolarHBondContact O-CG 3.45Å; E32-E36 PolarHBondContact O-N 3.28Å; E36-F38 VanDerWaalsContact C-N 3.26Å; E36-F38 PolarHBondContact O-N 3.45Å; E36-A39 WeakPolarHBondContact O-CA 3.49Å; E36-A39 WeakPolarHBondContact O-CB 3.41Å; E36-A39 PolarHBondContact O-N 3.16Å; E36-D40 PolarHBondContact O-N 3.06Å
37	E	85.6	Confident	81.1	Confident	39 Å²	39	59.6 Å²	59.6	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-33	179.1	-164.1	-177.7	145.2	0	0	111.6	A33 A39 D40 F41 L52 K55 Y56	A33-E37 PolarHBondContact O-N 3.32Å; E37-A39 VanDerWaalsContact C-N 3.31Å; E37-A39 PolarHBondContact O-N 3.06Å; E37-D40 PolarHBondContact O-N 3.14Å; E37-F41 HydrophobicContact CG-CE2 4.26Å; E37-F41 VanDerWaalsContact O-CD2 3.25Å; E37-F41 WeakPolarHBondContact O-CD2 3.45Å; E37-F41 PolarHBondContact O-N 3.43Å; E37-L52 HydrophobicContact CB-CD2 3.92Å; E37-L52 VanDerWaalsContact CD-CD2 3.44Å; E37-L52 HydrophobicContact CG-CD2 3.76Å; E37-L52 WeakPolarHBondContact OE1-CD2 3.49Å; E37-K55 WeakPolarHBondContact OE1-CD 3.18Å; E37-K55 IonicContact OE1-NZ 2.67Å; E37-K55 PolarHBondContact OE1-NZ 3.39Å; E37-K55 IonicContact OE2-NZ 2.59Å; E37-K55 PolarHBondContact OE2-NZ 3.02Å; E37-Y56 WeakPolarHBondContact OE2-CE2 3.15Å; E37-Y56 PolarHBondContact OE2-OH 3.21Å; E37-Y56 VanDerWaalsContact OE2-OH 3.09Å
38	F	85.2	Confident	82	Confident	17 Å²	17	61.3 Å²	61.3	8%	0.075	34%	0.335	C	S	.	.	H	α-helix	trans	-64.9	-31.1	171.9	-174.8	-101.2	0	0	0	113.5	F34 E36 F49 L52 C87 Y90	F34-F38 VanDerWaalsContact O-CB 3.27Å; F34-F38 WeakPolarHBondContact O-CB 3.35Å; F34-F38 PolarHBondContact O-N 3.34Å; E36-F38 VanDerWaalsContact C-N 3.26Å; E36-F38 PolarHBondContact O-N 3.45Å; F38-F49 HydrophobicContact CD2-CB 4.3Å; F38-F49 HydrophobicContact CE2-CB 3.75Å; F38-F49 HydrophobicContact CE2-CD2 4.48Å; F38-L52 HydrophobicContact CB-CD1 3.77Å; F38-L52 HydrophobicContact CD2-CD1 3.78Å; F38-L52 HydrophobicContact CG-CD1 4.28Å; F38-C87 HydrophobicContact CD1-CB 3.63Å; F38-C87 HydrophobicContact CE1-CB 3.83Å; F38-C87 HydrophobicContact CG-CB 4.42Å; F38-Y90 HydrophobicContact CE2-CD2 4.5Å; F38-Y90 HydrophobicContact CZ-CD2 4.11Å; F38-Y90 HydrophobicContact CZ-CE2 4.05Å
39	A	84.1	Confident	83.1	Confident	64 Å²	64	60.7 Å²	60.7	53%	0.529	33%	0.331	S	S	.	.	H	α-helix	trans	-72.3	-40.3	172.6	0	0	0	0	0	111.4	T35 E36 E37 F41 G42	T35-A39 PolarHBondContact O-N 2.97Å; T35-A39 VanDerWaalsContact O-N 3.08Å; E36-A39 WeakPolarHBondContact O-CA 3.49Å; E36-A39 WeakPolarHBondContact O-CB 3.41Å; E36-A39 PolarHBondContact O-N 3.16Å; E37-A39 VanDerWaalsContact C-N 3.31Å; E37-A39 PolarHBondContact O-N 3.06Å; A39-F41 PolarHBondContact O-N 2.98Å; A39-G42 PolarHBondContact O-N 2.99Å
40	D	83.6	Confident	83.6	Confident	136 Å²	136	57.6 Å²	57.6	73%	0.727	32%	0.32	S	S	*	.	H	α-helix	trans	-60.6	-26.9	179	-70.7	-24	0	0	0	113.7	E36 E37 G42	E36-D40 PolarHBondContact O-N 3.06Å; E37-D40 PolarHBondContact O-N 3.14Å; D40-G42 PolarHBondContact O-N 3.2Å
41	F	80.4	Confident	84.1	Confident	96 Å²	96	56.8 Å²	56.8	42%	0.421	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.6	173	-89.3	-83.6	0	0	0	113.6	E37 A39 S43 D48 L52	E37-F41 HydrophobicContact CG-CE2 4.26Å; E37-F41 VanDerWaalsContact O-CD2 3.25Å; E37-F41 WeakPolarHBondContact O-CD2 3.45Å; E37-F41 PolarHBondContact O-N 3.43Å; A39-F41 PolarHBondContact O-N 2.98Å; F41-S43 PolarHBondContact O-N 3.03Å; F41-D48 HydrophobicContact CD1-CB 4.19Å; F41-D48 HydrophobicContact CG-CB 4.36Å; F41-L52 HydrophobicContact CD2-CD1 3.65Å; F41-L52 HydrophobicContact CD2-CG 4.25Å; F41-L52 HydrophobicContact CE2-CD1 3.72Å; F41-L52 HydrophobicContact CE2-CD2 4.15Å; F41-L52 HydrophobicContact CE2-CG 3.78Å
42	G	70.2	Confident	84.6	Confident	70 Å²	70	56.7 Å²	56.7	72%	0.722	32%	0.322	S	S	*	.			trans	60.8	3.7	-178.8	0	0	0	0	0	115.5	A39 D40	A39-G42 PolarHBondContact O-N 2.99Å; D40-G42 PolarHBondContact O-N 3.2Å
43	S	74	Confident	85	Confident	28 Å²	28	53.8 Å²	53.8	20%	0.196	31%	0.307	C	S	.	.			trans	-127.1	106.7	-170.3	170.1	0	0	0	0	108.7	F41 R45 D48	F41-S43 PolarHBondContact O-N 3.03Å; S43-R45 PolarHBondContact O-N 3.21Å; S43-R45 WeakPolarHBondContact OG-CD 3.35Å; S43-R45 WeakPolarHBondContact OG-CG 3.36Å; S43-D48 VanDerWaalsContact CB-OD2 3.3Å; S43-D48 WeakPolarHBondContact CB-OD2 3.35Å; S43-D48 PolarHBondContact OG-OD2 3.29Å
44	P	80.9	Confident	85.3	Confident	31 Å²	31	59 Å²	59	20%	0.201	32%	0.323	C	S	.	.			trans	-75.6	25	-178	31.2	-35.9	0	0	0	113.5	I86 Y90 H129	P44-I86 HydrophobicContact CB-CD1 3.88Å; P44-I86 HydrophobicContact CB-CG2 4.24Å; P44-Y90 VanDerWaalsContact O-CE2 3.26Å; P44-Y90 WeakPolarHBondContact O-CE2 3.45Å; P44-Y90 PolarHBondContact O-OH 3.25Å; P44-H129 VanDerWaalsContact CG-CE1 3.44Å; P44-H129 WeakPolarHBondContact CG-CE1 3.47Å; P44-H129 WeakPolarHBondContact CG-NE2 3.45Å
45	R	86.6	Confident	85.5	Confident	160 Å²	160	64.9 Å²	64.9	60%	0.604	35%	0.349	S	S	*	.			trans	-81.5	146.1	-174.1	-64.1	177.3	178.3	-165.3	-0.3	112.2	S43 V47 D48 F49 D131	S43-R45 PolarHBondContact O-N 3.21Å; S43-R45 WeakPolarHBondContact OG-CD 3.35Å; S43-R45 WeakPolarHBondContact OG-CG 3.36Å; R45-V47 PolarHBondContact O-N 3.01Å; R45-D48 PolarHBondContact O-N 2.92Å; R45-F49 PolarHBondContact O-N 3.14Å; R45-D131 WeakPolarHBondContact CA-OD2 3.33Å
46	F	88.6	Confident	85.7	Confident	60 Å²	60	68 Å²	68	26%	0.263	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-22.5	178.8	-172.5	-110.7	0	0	0	113.4	F49 V50 Y90 Y93 D131 V135	F46-F49 AromaticContact CD2-CD1 3.77Å; F46-F49 HydrophobicContact CD2-CD1 3.77Å; F46-F49 HydrophobicContact CD2-CE1 4.48Å; F46-F49 HydrophobicContact CD2-CG 4.47Å; F46-F49 AromaticContact CE2-CD1 3.56Å; F46-F49 HydrophobicContact CE2-CD1 3.56Å; F46-F49 AromaticContact CE2-CE1 3.87Å; F46-F49 HydrophobicContact CE2-CE1 3.87Å; F46-F49 HydrophobicContact CZ-CD1 4.44Å; F46-V50 HydrophobicContact CD1-CG2 3.95Å; F46-V50 HydrophobicContact CD2-CG2 4.45Å; F46-V50 HydrophobicContact CE1-CG2 3.48Å; F46-V50 VanDerWaalsContact CE1-CG2 3.48Å; F46-V50 HydrophobicContact CE2-CG2 4.04Å; F46-V50 HydrophobicContact CG-CG2 4.41Å; F46-V50 HydrophobicContact CZ-CG2 3.53Å; F46-V50 WeakPolarHBondContact O-CB 3.36Å; F46-V50 VanDerWaalsContact O-CG2 3.24Å; F46-V50 WeakPolarHBondContact O-CG2 3.36Å; F46-V50 PolarHBondContact O-N 2.94Å; F46-Y90 HydrophobicContact CB-CE1 3.97Å; F46-Y90 HydrophobicContact CB-CE2 4.43Å; F46-Y90 AromaticContact CD2-CD1 3.6Å; F46-Y90 HydrophobicContact CD2-CD1 3.6Å; F46-Y90 HydrophobicContact CD2-CD2 4.39Å; F46-Y90 AromaticContact CD2-CE1 3.7Å; F46-Y90 HydrophobicContact CD2-CE1 3.7Å; F46-Y90 HydrophobicContact CD2-CE2 4.5Å; F46-Y90 AromaticContact CD2-CG 3.95Å; F46-Y90 HydrophobicContact CD2-CG 3.95Å; F46-Y90 HydrophobicContact CE2-CD1 4.25Å; F46-Y90 HydrophobicContact CG-CE1 4.27Å; F46-Y90 PolarHBondContact N-OH 3.34Å; F46-Y93 AromaticContact CE2-CD1 3.97Å; F46-Y93 HydrophobicContact CE2-CD1 3.97Å; F46-Y93 HydrophobicContact CE2-CE1 4.06Å; F46-Y93 HydrophobicContact CZ-CD1 4.09Å; F46-Y93 AromaticContact CZ-CE1 3.73Å; F46-Y93 HydrophobicContact CZ-CE1 3.73Å; F46-D131 HydrophobicContact CB-CB 4.23Å; F46-D131 PolarHBondContact N-OD2 3.48Å; F46-V135 HydrophobicContact CD2-CG2 4.48Å
47	V	90.2	Very high	85.8	Confident	108 Å²	108	68.6 Å²	68.6	66%	0.655	36%	0.361	S	S	*	.	H	α-helix	trans	-64.9	-46.1	176.6	179.8	0	0	0	0	111.1	R45 V50 A51	R45-V47 PolarHBondContact O-N 3.01Å; V47-V50 PolarHBondContact O-N 3.41Å; V47-A51 PolarHBondContact O-N 2.89Å
48	D	89	Confident	85.8	Confident	36 Å²	36	67.1 Å²	67.1	19%	0.193	35%	0.354	C	S	.	.	H	α-helix	trans	-72.1	-41.8	-175.9	-51.2	-39.1	0	0	0	109.7	F41 S43 R45 V50 A51 L52	F41-D48 HydrophobicContact CD1-CB 4.19Å; F41-D48 HydrophobicContact CG-CB 4.36Å; S43-D48 VanDerWaalsContact CB-OD2 3.3Å; S43-D48 WeakPolarHBondContact CB-OD2 3.35Å; S43-D48 PolarHBondContact OG-OD2 3.29Å; R45-D48 PolarHBondContact O-N 2.92Å; D48-V50 VanDerWaalsContact C-N 3.31Å; D48-V50 PolarHBondContact O-N 3.4Å; D48-A51 WeakPolarHBondContact O-CB 3.07Å; D48-A51 PolarHBondContact O-N 3.48Å; D48-A51 VanDerWaalsContact O-N 3.1Å; D48-L52 PolarHBondContact O-N 3.37Å
49	F	90.2	Very high	85.7	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.009	36%	0.361	C	S	.	.	H	α-helix	trans	-52.5	-44.3	166.6	174.3	-95.7	0	0	0	112.9	F34 F38 R45 F46 A51 L52 W53 Y90 L91 A94	F34-F49 HydrophobicContact CE1-CD2 4.06Å; F34-F49 AromaticContact CE1-CE2 3.75Å; F34-F49 HydrophobicContact CE1-CE2 3.75Å; F34-F49 AromaticContact CZ-CD2 3.8Å; F34-F49 HydrophobicContact CZ-CD2 3.8Å; F34-F49 AromaticContact CZ-CE2 3.54Å; F34-F49 HydrophobicContact CZ-CE2 3.54Å; F34-F49 HydrophobicContact CZ-CZ 4.41Å; F38-F49 HydrophobicContact CD2-CB 4.3Å; F38-F49 HydrophobicContact CE2-CB 3.75Å; F38-F49 HydrophobicContact CE2-CD2 4.48Å; R45-F49 PolarHBondContact O-N 3.14Å; F46-F49 AromaticContact CD2-CD1 3.77Å; F46-F49 HydrophobicContact CD2-CD1 3.77Å; F46-F49 HydrophobicContact CD2-CE1 4.48Å; F46-F49 HydrophobicContact CD2-CG 4.47Å; F46-F49 AromaticContact CE2-CD1 3.56Å; F46-F49 HydrophobicContact CE2-CD1 3.56Å; F46-F49 AromaticContact CE2-CE1 3.87Å; F46-F49 HydrophobicContact CE2-CE1 3.87Å; F46-F49 HydrophobicContact CZ-CD1 4.44Å; F49-A51 VanDerWaalsContact C-N 3.33Å; F49-A51 PolarHBondContact O-N 2.88Å; F49-L52 PolarHBondContact O-N 2.96Å; F49-W53 HydrophobicContact CE1-CB 4.43Å; F49-W53 HydrophobicContact CE1-CE3 4.38Å; F49-W53 HydrophobicContact CZ-CD2 4.49Å; F49-W53 AromaticContact CZ-CE3 3.79Å; F49-W53 HydrophobicContact CZ-CE3 3.79Å; F49-W53 HydrophobicContact CZ-CZ3 4.47Å; F49-W53 VanDerWaalsContact O-CB 3.29Å; F49-W53 WeakPolarHBondContact O-CB 3.28Å; F49-W53 PolarHBondContact O-N 3.38Å; F49-Y90 HydrophobicContact CB-CD2 3.76Å; F49-Y90 HydrophobicContact CB-CE2 4.21Å; F49-Y90 HydrophobicContact CB-CG 4.47Å; F49-Y90 HydrophobicContact CD1-CD2 4.38Å; F49-Y90 HydrophobicContact CD1-CG 4.27Å; F49-Y90 AromaticContact CD2-CD2 3.95Å; F49-Y90 HydrophobicContact CD2-CD2 3.95Å; F49-Y90 HydrophobicContact CD2-CG 4.24Å; F49-Y90 AromaticContact CG-CD2 3.75Å; F49-Y90 HydrophobicContact CG-CD2 3.75Å; F49-Y90 HydrophobicContact CG-CG 4.04Å; F49-Y90 WeakPolarHBondContact CZ-O 3.33Å; F49-L91 HydrophobicContact CE2-CD2 3.69Å; F49-L91 HydrophobicContact CE2-CG 3.81Å; F49-L91 HydrophobicContact CZ-CD2 3.89Å; F49-L91 HydrophobicContact CZ-CG 4.21Å; F49-A94 HydrophobicContact CE1-CB 4.03Å; F49-A94 HydrophobicContact CZ-CB 3.95Å
50	V	90.7	Very high	85.6	Confident	41 Å²	41	70.6 Å²	70.6	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-70.7	-27.1	179.4	164.3	0	0	0	0	112.5	F46 V47 D48 K54	F46-V50 HydrophobicContact CD1-CG2 3.95Å; F46-V50 HydrophobicContact CD2-CG2 4.45Å; F46-V50 HydrophobicContact CE1-CG2 3.48Å; F46-V50 VanDerWaalsContact CE1-CG2 3.48Å; F46-V50 HydrophobicContact CE2-CG2 4.04Å; F46-V50 HydrophobicContact CG-CG2 4.41Å; F46-V50 HydrophobicContact CZ-CG2 3.53Å; F46-V50 WeakPolarHBondContact O-CB 3.36Å; F46-V50 VanDerWaalsContact O-CG2 3.24Å; F46-V50 WeakPolarHBondContact O-CG2 3.36Å; F46-V50 PolarHBondContact O-N 2.94Å; V47-V50 PolarHBondContact O-N 3.41Å; D48-V50 VanDerWaalsContact C-N 3.31Å; D48-V50 PolarHBondContact O-N 3.4Å; V50-K54 HydrophobicContact CG1-CD 4.44Å; V50-K54 VanDerWaalsContact O-CD 3.32Å; V50-K54 WeakPolarHBondContact O-CD 3.26Å; V50-K54 VanDerWaalsContact O-CG 3.26Å; V50-K54 WeakPolarHBondContact O-CG 3.33Å; V50-K54 PolarHBondContact O-N 2.98Å
51	A	90.2	Very high	85.3	Confident	51 Å²	51	65 Å²	65	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-68.8	-50.2	170.9	0	0	0	0	0	110.6	V47 D48 F49 W53 K54 K55	V47-A51 PolarHBondContact O-N 2.89Å; D48-A51 WeakPolarHBondContact O-CB 3.07Å; D48-A51 PolarHBondContact O-N 3.48Å; D48-A51 VanDerWaalsContact O-N 3.1Å; F49-A51 VanDerWaalsContact C-N 3.33Å; F49-A51 PolarHBondContact O-N 2.88Å; A51-W53 PolarHBondContact O-N 2.81Å; A51-K54 WeakPolarHBondContact O-CB 3.45Å; A51-K54 PolarHBondContact O-N 3.27Å; A51-K55 PolarHBondContact O-N 3.22Å
52	L	89.7	Confident	84.9	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-47.5	175.6	-86.3	164.3	0	0	0	113.3	F34 E37 F38 F41 D48 F49 K54 K55 Y56	F34-L52 HydrophobicContact CD2-CB 4.42Å; F34-L52 HydrophobicContact CE2-CB 3.71Å; F34-L52 HydrophobicContact CZ-CB 4.06Å; E37-L52 HydrophobicContact CB-CD2 3.92Å; E37-L52 VanDerWaalsContact CD-CD2 3.44Å; E37-L52 HydrophobicContact CG-CD2 3.76Å; E37-L52 WeakPolarHBondContact OE1-CD2 3.49Å; F38-L52 HydrophobicContact CB-CD1 3.77Å; F38-L52 HydrophobicContact CD2-CD1 3.78Å; F38-L52 HydrophobicContact CG-CD1 4.28Å; F41-L52 HydrophobicContact CD2-CD1 3.65Å; F41-L52 HydrophobicContact CD2-CG 4.25Å; F41-L52 HydrophobicContact CE2-CD1 3.72Å; F41-L52 HydrophobicContact CE2-CD2 4.15Å; F41-L52 HydrophobicContact CE2-CG 3.78Å; D48-L52 PolarHBondContact O-N 3.37Å; F49-L52 PolarHBondContact O-N 2.96Å; L52-K54 PolarHBondContact O-N 3.46Å; L52-K54 VanDerWaalsContact O-N 3.15Å; L52-K55 HydrophobicContact CD2-CD 4.47Å; L52-K55 WeakPolarHBondContact O-CB 3.15Å; L52-K55 PolarHBondContact O-N 2.6Å; L52-Y56 HydrophobicContact CD2-CD2 3.97Å; L52-Y56 HydrophobicContact CD2-CE2 3.72Å; L52-Y56 PolarHBondContact O-N 2.99Å
53	W	88.4	Confident	85	Confident	30 Å²	30	62.9 Å²	62.9	11%	0.114	30%	0.303	C	S	.	.	H	α-helix	trans	-56.1	-33.8	177.9	177.3	-83.8	0	0	0	112.4	F49 A51 K57 M58 I59 L91 A94 F95	F49-W53 HydrophobicContact CE1-CB 4.43Å; F49-W53 HydrophobicContact CE1-CE3 4.38Å; F49-W53 HydrophobicContact CZ-CD2 4.49Å; F49-W53 AromaticContact CZ-CE3 3.79Å; F49-W53 HydrophobicContact CZ-CE3 3.79Å; F49-W53 HydrophobicContact CZ-CZ3 4.47Å; F49-W53 VanDerWaalsContact O-CB 3.29Å; F49-W53 WeakPolarHBondContact O-CB 3.28Å; F49-W53 PolarHBondContact O-N 3.38Å; A51-W53 PolarHBondContact O-N 2.81Å; W53-K57 WeakPolarHBondContact O-CA 3.41Å; W53-K57 PolarHBondContact O-N 3.11Å; W53-K57 VanDerWaalsContact O-N 3.16Å; W53-M58 HydrophobicContact CD2-CB 3.71Å; W53-M58 HydrophobicContact CE3-CB 3.46Å; W53-M58 VanDerWaalsContact CE3-CB 3.46Å; W53-M58 HydrophobicContact CE3-CG 4.18Å; W53-M58 HydrophobicContact CG-CB 4.41Å; W53-M58 HydrophobicContact CH2-CB 3.94Å; W53-M58 HydrophobicContact CZ2-CB 4.15Å; W53-M58 HydrophobicContact CZ3-CB 3.58Å; W53-M58 HydrophobicContact CZ3-CG 4.46Å; W53-M58 PolarHBondContact O-N 3.25Å; W53-I59 HydrophobicContact CZ2-CB 4.26Å; W53-L91 HydrophobicContact CE3-CD2 3.94Å; W53-L91 HydrophobicContact CZ3-CD2 3.76Å; W53-A94 HydrophobicContact CD2-CB 4.06Å; W53-A94 HydrophobicContact CE3-CB 3.69Å; W53-A94 HydrophobicContact CH2-CB 3.56Å; W53-A94 HydrophobicContact CZ2-CB 3.94Å; W53-A94 HydrophobicContact CZ3-CB 3.43Å; W53-A94 VanDerWaalsContact CZ3-CB 3.43Å; W53-F95 AromaticContact CH2-CD1 3.86Å; W53-F95 HydrophobicContact CH2-CD1 3.86Å; W53-F95 AromaticContact CH2-CD2 3.97Å; W53-F95 HydrophobicContact CH2-CD2 3.97Å; W53-F95 AromaticContact CH2-CE1 3.6Å; W53-F95 HydrophobicContact CH2-CE1 3.6Å; W53-F95 AromaticContact CH2-CE2 3.68Å; W53-F95 HydrophobicContact CH2-CE2 3.68Å; W53-F95 HydrophobicContact CH2-CG 4.03Å; W53-F95 AromaticContact CH2-CZ 3.49Å; W53-F95 HydrophobicContact CH2-CZ 3.49Å; W53-F95 VanDerWaalsContact CH2-CZ 3.49Å; W53-F95 AromaticContact CZ3-CD2 3.99Å; W53-F95 HydrophobicContact CZ3-CD2 3.99Å; W53-F95 HydrophobicContact CZ3-CE1 4.24Å; W53-F95 AromaticContact CZ3-CE2 3.51Å; W53-F95 HydrophobicContact CZ3-CE2 3.51Å; W53-F95 AromaticContact CZ3-CZ 3.65Å; W53-F95 HydrophobicContact CZ3-CZ 3.65Å
54	K	90.5	Very high	84.6	Confident	142 Å²	142	64.6 Å²	64.6	62%	0.617	33%	0.325	S	S	*	.	H	α-helix	trans	-77.9	-41.3	173.5	-67.4	166.3	-173.2	167.3	0	112.3	V50 A51 L52 K57	V50-K54 HydrophobicContact CG1-CD 4.44Å; V50-K54 VanDerWaalsContact O-CD 3.32Å; V50-K54 WeakPolarHBondContact O-CD 3.26Å; V50-K54 VanDerWaalsContact O-CG 3.26Å; V50-K54 WeakPolarHBondContact O-CG 3.33Å; V50-K54 PolarHBondContact O-N 2.98Å; A51-K54 WeakPolarHBondContact O-CB 3.45Å; A51-K54 PolarHBondContact O-N 3.27Å; L52-K54 PolarHBondContact O-N 3.46Å; L52-K54 VanDerWaalsContact O-N 3.15Å; K54-K57 WeakPolarHBondContact O-CG 3.36Å; K54-K57 PolarHBondContact O-N 3.49Å
55	K	90.5	Very high	84	Confident	125 Å²	125	64.8 Å²	64.8	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-57	-57	178.3	-173.3	-166.8	-176.9	-171.6	0	111.3	E37 A51 L52 K57	E37-K55 WeakPolarHBondContact OE1-CD 3.18Å; E37-K55 IonicContact OE1-NZ 2.67Å; E37-K55 PolarHBondContact OE1-NZ 3.39Å; E37-K55 IonicContact OE2-NZ 2.59Å; E37-K55 PolarHBondContact OE2-NZ 3.02Å; A51-K55 PolarHBondContact O-N 3.22Å; L52-K55 HydrophobicContact CD2-CD 4.47Å; L52-K55 WeakPolarHBondContact O-CB 3.15Å; L52-K55 PolarHBondContact O-N 2.6Å; K55-K57 PolarHBondContact O-N 3.21Å
56	Y	86.1	Confident	82.7	Confident	73 Å²	73	63.4 Å²	63.4	29%	0.286	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-11.1	176.5	-76.7	-96.1	0	0	0	113.2	A33 F34 E37 L52 M58	A33-Y56 HydrophobicContact CB-CE1 4.14Å; A33-Y56 PolarHBondContact O-OH 3.44Å; F34-Y56 AromaticContact CD2-CD2 3.91Å; F34-Y56 HydrophobicContact CD2-CD2 3.91Å; F34-Y56 AromaticContact CD2-CG 4Å; F34-Y56 HydrophobicContact CD2-CG 4Å; E37-Y56 WeakPolarHBondContact OE2-CE2 3.15Å; E37-Y56 PolarHBondContact OE2-OH 3.21Å; E37-Y56 VanDerWaalsContact OE2-OH 3.09Å; L52-Y56 HydrophobicContact CD2-CD2 3.97Å; L52-Y56 HydrophobicContact CD2-CE2 3.72Å; L52-Y56 PolarHBondContact O-N 2.99Å; Y56-M58 HydrophobicContact CD1-CE 4.06Å; Y56-M58 HydrophobicContact CG-CE 4.18Å; Y56-M58 PolarHBondContact O-N 3.49Å
57	K	87.1	Confident	81.5	Confident	130 Å²	130	62.8 Å²	62.8	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.9	-178.9	-45.8	168	-173.2	162.5	0	112.7	W53 K54 K55 I59 H60	W53-K57 WeakPolarHBondContact O-CA 3.41Å; W53-K57 PolarHBondContact O-N 3.11Å; W53-K57 VanDerWaalsContact O-N 3.16Å; K54-K57 WeakPolarHBondContact O-CG 3.36Å; K54-K57 PolarHBondContact O-N 3.49Å; K55-K57 PolarHBondContact O-N 3.21Å; K57-I59 WeakPolarHBondContact O-CG2 3.28Å; K57-I59 PolarHBondContact O-N 3.31Å; K57-H60 WeakPolarHBondContact CB-ND1 3.48Å; K57-H60 PolarHBondContact O-N 2.78Å; K57-H60 PolarHBondContact O-ND1 2.84Å
58	M	84.5	Confident	80.3	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.034	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-49.1	-22.6	-172.2	-79.8	-76	153.7	0	0	115.6	D30 F34 W53 Y56 H60 L61	D30-M58 HydrophobicContact CB-CE 4.05Å; D30-M58 WeakPolarHBondContact O-CE 3.41Å; F34-M58 HydrophobicContact CB-CE 3.81Å; F34-M58 HydrophobicContact CD2-CE 3.89Å; F34-M58 HydrophobicContact CD2-CG 3.87Å; F34-M58 HydrophobicContact CD2-SD 4.42Å; F34-M58 HydrophobicContact CE2-CG 3.94Å; F34-M58 HydrophobicContact CG-CE 4.06Å; W53-M58 HydrophobicContact CD2-CB 3.71Å; W53-M58 HydrophobicContact CE3-CB 3.46Å; W53-M58 VanDerWaalsContact CE3-CB 3.46Å; W53-M58 HydrophobicContact CE3-CG 4.18Å; W53-M58 HydrophobicContact CG-CB 4.41Å; W53-M58 HydrophobicContact CH2-CB 3.94Å; W53-M58 HydrophobicContact CZ2-CB 4.15Å; W53-M58 HydrophobicContact CZ3-CB 3.58Å; W53-M58 HydrophobicContact CZ3-CG 4.46Å; W53-M58 PolarHBondContact O-N 3.25Å; Y56-M58 HydrophobicContact CD1-CE 4.06Å; Y56-M58 HydrophobicContact CG-CE 4.18Å; Y56-M58 PolarHBondContact O-N 3.49Å; M58-H60 PolarHBondContact O-N 3.48Å; M58-H60 VanDerWaalsContact O-N 3.1Å; M58-L61 PolarHBondContact O-N 3.43Å; M58-L61 HydrophobicContact SD-CD1 3.59Å; M58-L61 VanDerWaalsContact SD-CD1 3.59Å
59	I	83.9	Confident	79	Confident	45 Å²	45	65 Å²	65	23%	0.231	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-50.4	-29.5	168.3	-171.5	60	0	0	0	113.9	W53 K57 L61 I62 Q63 K98	W53-I59 HydrophobicContact CZ2-CB 4.26Å; K57-I59 WeakPolarHBondContact O-CG2 3.28Å; K57-I59 PolarHBondContact O-N 3.31Å; I59-L61 VanDerWaalsContact C-N 3.27Å; I59-L61 PolarHBondContact O-N 2.97Å; I59-I62 HydrophobicContact CD1-CD1 3.99Å; I59-I62 HydrophobicContact CD1-CG1 4.07Å; I59-I62 WeakPolarHBondContact O-CG1 3.35Å; I59-I62 PolarHBondContact O-N 3.23Å; I59-Q63 WeakPolarHBondContact O-CB 3.41Å; I59-Q63 PolarHBondContact O-N 3.31Å; I59-K98 HydrophobicContact CD1-CB 3.69Å; I59-K98 HydrophobicContact CD1-CG 4.22Å
60	H	82.2	Confident	77.6	Confident	109 Å²	109	64.9 Å²	64.9	51%	0.505	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-66.1	-25.9	-178.4	-69.8	82.4	0	0	0	113.6	K57 M58 I62 Q63	K57-H60 WeakPolarHBondContact CB-ND1 3.48Å; K57-H60 PolarHBondContact O-N 2.78Å; K57-H60 PolarHBondContact O-ND1 2.84Å; M58-H60 PolarHBondContact O-N 3.48Å; M58-H60 VanDerWaalsContact O-N 3.1Å; H60-I62 PolarHBondContact O-N 3.49Å; H60-Q63 PolarHBondContact O-N 3.33Å
61	L	76.6	Confident	76.6	Confident	19 Å²	19	63 Å²	63	10%	0.099	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-60.9	-34.3	177.3	-62.2	177.6	0	0	0	112	I24 L27 M58 I59 R65 I74 F95	I24-L61 HydrophobicContact CD1-CD2 4.34Å; L27-L61 HydrophobicContact CD1-CD1 3.7Å; L27-L61 HydrophobicContact CD1-CD2 4.03Å; L27-L61 HydrophobicContact CD1-CG 4.43Å; M58-L61 PolarHBondContact O-N 3.43Å; M58-L61 HydrophobicContact SD-CD1 3.59Å; M58-L61 VanDerWaalsContact SD-CD1 3.59Å; I59-L61 VanDerWaalsContact C-N 3.27Å; I59-L61 PolarHBondContact O-N 2.97Å; L61-R65 WeakPolarHBondContact O-CD 3.49Å; L61-R65 PolarHBondContact O-NE 3.03Å; L61-I74 WeakPolarHBondContact O-CD1 3.2Å; L61-F95 HydrophobicContact CB-CE1 4.26Å; L61-F95 HydrophobicContact CB-CZ 4.46Å; L61-F95 HydrophobicContact CD1-CZ 4.14Å
62	I	73.3	Confident	75.6	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-15.4	175.6	59.1	160.9	0	0	0	114.2	I59 H60 G64 R65 L71 I74 F95 K98	I59-I62 HydrophobicContact CD1-CD1 3.99Å; I59-I62 HydrophobicContact CD1-CG1 4.07Å; I59-I62 WeakPolarHBondContact O-CG1 3.35Å; I59-I62 PolarHBondContact O-N 3.23Å; H60-I62 PolarHBondContact O-N 3.49Å; I62-G64 PolarHBondContact O-N 3.43Å; I62-R65 PolarHBondContact O-N 3.49Å; I62-L71 HydrophobicContact CB-CD2 3.63Å; I62-L71 HydrophobicContact CG2-CD2 3.47Å; I62-L71 VanDerWaalsContact CG2-CD2 3.47Å; I62-I74 HydrophobicContact CG2-CD1 3.97Å; I62-I74 HydrophobicContact CG2-CG2 4.35Å; I62-F95 HydrophobicContact CB-CD1 4.38Å; I62-F95 HydrophobicContact CD1-CD1 3.94Å; I62-F95 HydrophobicContact CG1-CD1 3.98Å; I62-F95 HydrophobicContact CG1-CE1 4.13Å; I62-F95 HydrophobicContact CG2-CD1 3.51Å; I62-F95 HydrophobicContact CG2-CE1 3.78Å; I62-K98 HydrophobicContact CD1-CB 3.97Å; I62-K98 WeakPolarHBondContact CD1-O 3.37Å
63	Q	71.4	Confident	74.4	Confident	120 Å²	120	63.5 Å²	63.5	56%	0.561	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	129.8	-178.4	-167.8	168	-65.7	0	0	110.9	I59 H60 R65	I59-Q63 WeakPolarHBondContact O-CB 3.41Å; I59-Q63 PolarHBondContact O-N 3.31Å; H60-Q63 PolarHBondContact O-N 3.33Å; Q63-R65 VanDerWaalsContact C-N 3.27Å; Q63-R65 PolarHBondContact O-N 2.85Å
64	G	65.3	Low	73.5	Confident	63 Å²	63	62.1 Å²	62.1	65%	0.649	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-19.3	-175.6	0	0	0	0	0	114.5	I62 Q66	I62-G64 PolarHBondContact O-N 3.43Å; G64-Q66 PolarHBondContact O-N 2.79Å
65	R	68.1	Low	72.6	Confident	35 Å²	35	55.7 Å²	55.7	13%	0.132	28%	0.275	C	S	.	.			trans	-70.6	117.9	171.7	-64.4	-172.4	169.8	-127.9	-14.4	109.5	N22 L61 I62 Q63 G70 L71 P100	N22-R65 PolarHBondContact O-NH2 3.24Å; L61-R65 WeakPolarHBondContact O-CD 3.49Å; L61-R65 PolarHBondContact O-NE 3.03Å; I62-R65 PolarHBondContact O-N 3.49Å; Q63-R65 VanDerWaalsContact C-N 3.27Å; Q63-R65 PolarHBondContact O-N 2.85Å; R65-G70 WeakPolarHBondContact CD-O 3.44Å; R65-G70 PolarHBondContact NH1-O 3.42Å; R65-L71 HydrophobicContact CB-CD2 3.95Å; R65-L71 HydrophobicContact CB-CG 4.28Å; R65-P100 WeakPolarHBondContact O-CG 3.47Å
66	Q	60.3	Low	71.5	Confident	131 Å²	131	50.6 Å²	50.6	61%	0.612	26%	0.257	S	S	*	.			trans	-114.2	-10	-178.5	-66.1	-68.1	-91.7	0	0	113.3	G64 P100	G64-Q66 PolarHBondContact O-N 2.79Å; Q66-P100 PolarHBondContact NE2-O 3.02Å; Q66-P100 VanDerWaalsContact NE2-O 3.12Å
67	S	63.2	Low	70.4	Confident	47 Å²	47	47.2 Å²	47.2	33%	0.329	24%	0.244	S	C	.	.	S	Bend	trans	-85.2	139.7	171.9	59.8	0	0	0	0	110.5	H69 G70	S67-H69 VanDerWaalsContact C-N 3.28Å; S67-H69 PolarHBondContact O-N 3.45Å; S67-G70 PolarHBondContact OG-N 3.48Å
68	Q	64.7	Low	69.5	Low	79 Å²	79	41.1 Å²	41.1	37%	0.369	22%	0.218	S	C	.	.	S	Bend	trans	-61.4	-39	172.1	-79.1	-177.8	-36.2	0	0	111.3	G70 L71 Y72 I101 N103 V105	Q68-G70 PolarHBondContact O-N 3.23Å; Q68-L71 CarbonylContact O-C 3.12Å; Q68-L71 PolarHBondContact O-N 3.13Å; Q68-Y72 HydrophobicContact CB-CD2 4.18Å; Q68-Y72 HydrophobicContact CB-CE2 4.08Å; Q68-Y72 VanDerWaalsContact O-CD2 3.29Å; Q68-Y72 WeakPolarHBondContact O-CD2 3.44Å; Q68-Y72 PolarHBondContact O-N 2.86Å; Q68-I101 HydrophobicContact CG-CD1 3.62Å; Q68-N103 PolarHBondContact NE2-O 2.83Å; Q68-V105 HydrophobicContact CB-CG2 3.89Å; Q68-V105 HydrophobicContact CG-CG2 3.94Å
69	H	61.7	Low	68.8	Low	111 Å²	111	41.1 Å²	41.1	51%	0.514	22%	0.218	S	C	.	.	H	α-helix	trans	-54.4	-51.6	177.8	-56.8	112.5	0	0	0	112.8	F21 S67 L71 Y72 D73	F21-H69 HydrophobicContact CB-CB 4.37Å; F21-H69 HydrophobicContact CD2-CB 3.84Å; F21-H69 HydrophobicContact CE2-CB 4.31Å; F21-H69 HydrophobicContact CG-CB 4.02Å; S67-H69 VanDerWaalsContact C-N 3.28Å; S67-H69 PolarHBondContact O-N 3.45Å; H69-L71 PolarHBondContact O-N 3.26Å; H69-Y72 PolarHBondContact O-N 3.07Å; H69-Y72 VanDerWaalsContact O-N 3.12Å; H69-D73 VanDerWaalsContact O-CG 3.22Å; H69-D73 PolarHBondContact O-N 3.18Å
70	G	62.3	Low	67.6	Low	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-8.8	179	0	0	0	0	0	114.9	R65 S67 Q68	R65-G70 WeakPolarHBondContact CD-O 3.44Å; R65-G70 PolarHBondContact NH1-O 3.42Å; S67-G70 PolarHBondContact OG-N 3.48Å; Q68-G70 PolarHBondContact O-N 3.23Å
71	L	69.1	Low	66.5	Low	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-100	-36.5	172.3	-65.1	170.7	0	0	0	111.6	I62 R65 Q68 H69 D73 I74 V75 I101 V105	I62-L71 HydrophobicContact CB-CD2 3.63Å; I62-L71 HydrophobicContact CG2-CD2 3.47Å; I62-L71 VanDerWaalsContact CG2-CD2 3.47Å; R65-L71 HydrophobicContact CB-CD2 3.95Å; R65-L71 HydrophobicContact CB-CG 4.28Å; Q68-L71 CarbonylContact O-C 3.12Å; Q68-L71 PolarHBondContact O-N 3.13Å; H69-L71 PolarHBondContact O-N 3.26Å; L71-D73 VanDerWaalsContact C-N 3.29Å; L71-D73 PolarHBondContact O-N 3.01Å; L71-I74 PolarHBondContact O-N 3.12Å; L71-V75 WeakPolarHBondContact O-CB 3.3Å; L71-V75 VanDerWaalsContact O-CG2 3.3Å; L71-V75 WeakPolarHBondContact O-CG2 3.35Å; L71-V75 PolarHBondContact O-N 3.22Å; L71-I101 HydrophobicContact CD1-CD1 3.77Å; L71-I101 HydrophobicContact CD1-CG1 4.03Å; L71-I101 HydrophobicContact CD1-CG2 4Å; L71-V105 HydrophobicContact CB-CB 4.5Å; L71-V105 HydrophobicContact CB-CG2 4.03Å
72	Y	68.8	Low	65.7	Low	54 Å²	54	39.1 Å²	39.1	21%	0.212	20%	0.203	C	C	.	.	H	α-helix	trans	-55.9	-46.3	169.1	-87.8	-67.7	0	0	0	110.9	Q68 H69 V75 G76 V105	Q68-Y72 HydrophobicContact CB-CD2 4.18Å; Q68-Y72 HydrophobicContact CB-CE2 4.08Å; Q68-Y72 VanDerWaalsContact O-CD2 3.29Å; Q68-Y72 WeakPolarHBondContact O-CD2 3.44Å; Q68-Y72 PolarHBondContact O-N 2.86Å; H69-Y72 PolarHBondContact O-N 3.07Å; H69-Y72 VanDerWaalsContact O-N 3.12Å; Y72-V75 PolarHBondContact O-N 2.85Å; Y72-G76 PolarHBondContact O-N 3.29Å; Y72-V105 HydrophobicContact CD1-CG1 3.44Å; Y72-V105 VanDerWaalsContact CD1-CG1 3.44Å; Y72-V105 HydrophobicContact CD2-CG1 4.19Å; Y72-V105 HydrophobicContact CD2-CG2 3.81Å; Y72-V105 HydrophobicContact CE1-CB 4.44Å; Y72-V105 HydrophobicContact CE1-CG1 3.62Å; Y72-V105 HydrophobicContact CE2-CG1 4.34Å; Y72-V105 HydrophobicContact CE2-CG2 3.78Å; Y72-V105 HydrophobicContact CG-CG1 3.72Å; Y72-V105 HydrophobicContact CG-CG2 4.18Å
73	D	64.8	Low	64.8	Low	11 Å²	11	40.4 Å²	40.4	6%	0.059	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-56.5	179.4	-61.3	-13.6	0	0	0	110.3	I19 F21 H69 L71 V75 G76 C77	I19-D73 HydrophobicContact CB-CB 4.28Å; I19-D73 HydrophobicContact CD1-CB 4.46Å; I19-D73 HydrophobicContact CG1-CB 4.09Å; I19-D73 HydrophobicContact CG2-CB 3.63Å; I19-D73 VanDerWaalsContact CG2-OD2 3.29Å; I19-D73 WeakPolarHBondContact CG2-OD2 3.31Å; F21-D73 WeakPolarHBondContact CD2-OD2 3.17Å; F21-D73 PolarHBondContact N-OD2 3.18Å; H69-D73 VanDerWaalsContact O-CG 3.22Å; H69-D73 PolarHBondContact O-N 3.18Å; L71-D73 VanDerWaalsContact C-N 3.29Å; L71-D73 PolarHBondContact O-N 3.01Å; D73-V75 PolarHBondContact O-N 2.98Å; D73-G76 PolarHBondContact O-N 3.02Å; D73-C77 WeakPolarHBondContact O-CB 3.26Å; D73-C77 PolarHBondContact O-N 2.99Å; D73-C77 PolarHBondContact O-SG 2.88Å
74	I	68.4	Low	64	Low	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.6	-49.8	179.2	-66.9	172.5	0	0	0	111.6	I19 I24 L61 I62 L71 G76 C77 I78	I19-I74 HydrophobicContact CD1-CG1 3.67Å; I24-I74 HydrophobicContact CD1-CD1 4.02Å; I24-I74 HydrophobicContact CD1-CG1 4.26Å; L61-I74 WeakPolarHBondContact O-CD1 3.2Å; I62-I74 HydrophobicContact CG2-CD1 3.97Å; I62-I74 HydrophobicContact CG2-CG2 4.35Å; L71-I74 PolarHBondContact O-N 3.12Å; I74-G76 VanDerWaalsContact C-N 3.32Å; I74-G76 PolarHBondContact O-N 2.87Å; I74-C77 PolarHBondContact O-N 2.85Å; I74-I78 HydrophobicContact CG2-CD1 3.56Å; I74-I78 HydrophobicContact CG2-CG1 4.26Å; I74-I78 WeakPolarHBondContact O-CB 3.42Å; I74-I78 WeakPolarHBondContact O-CG1 3.45Å; I74-I78 PolarHBondContact O-N 3.46Å
75	V	72.8	Confident	64.3	Low	8 Å²	8	43.4 Å²	43.4	5%	0.048	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-38.9	-176.7	171.2	0	0	0	0	111	L71 Y72 D73 F79 L92 F95 I107	L71-V75 WeakPolarHBondContact O-CB 3.3Å; L71-V75 VanDerWaalsContact O-CG2 3.3Å; L71-V75 WeakPolarHBondContact O-CG2 3.35Å; L71-V75 PolarHBondContact O-N 3.22Å; Y72-V75 PolarHBondContact O-N 2.85Å; D73-V75 PolarHBondContact O-N 2.98Å; V75-F79 WeakPolarHBondContact O-CB 3.39Å; V75-F79 PolarHBondContact O-N 3.03Å; V75-L92 HydrophobicContact CG1-CD2 4.37Å; V75-F95 HydrophobicContact CG2-CB 4.44Å; V75-I107 HydrophobicContact CG1-CB 4.34Å; V75-I107 HydrophobicContact CG1-CG1 3.81Å; V75-I107 HydrophobicContact CG1-CG2 4.43Å
76	G	66.6	Low	65	Low	17 Å²	17	43.2 Å²	43.2	18%	0.175	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-45	173.8	0	0	0	0	0	112.7	Y72 D73 I74 F79 H80	Y72-G76 PolarHBondContact O-N 3.29Å; D73-G76 PolarHBondContact O-N 3.02Å; I74-G76 VanDerWaalsContact C-N 3.32Å; I74-G76 PolarHBondContact O-N 2.87Å; G76-F79 PolarHBondContact O-N 2.81Å; G76-H80 PolarHBondContact O-CD2 2.83Å; G76-H80 VanDerWaalsContact O-CD2 3.27Å; G76-H80 PolarHBondContact O-N 3.21Å
77	C	64.3	Low	66.1	Low	2 Å²	2	37.1 Å²	37.1	1%	0.014	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-48.2	179.7	-63.7	0	0	0	0	111.7	L17 D73 I74 H80 R81	L17-C77 HydrophobicContact CD1-CB 3.78Å; L17-C77 HydrophobicContact CD2-CB 3.64Å; L17-C77 HydrophobicContact CG-CB 4.26Å; D73-C77 WeakPolarHBondContact O-CB 3.26Å; D73-C77 PolarHBondContact O-N 2.99Å; D73-C77 PolarHBondContact O-SG 2.88Å; I74-C77 PolarHBondContact O-N 2.85Å; C77-H80 PolarHBondContact O-N 2.91Å; C77-R81 WeakPolarHBondContact O-CB 3.28Å; C77-R81 PolarHBondContact O-N 3.47Å
78	I	67.7	Low	66.9	Low	3 Å²	3	35.3 Å²	35.3	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-40.2	176.9	-68.5	178.3	0	0	0	111.3	I31 I74 L82 L91 F95	I31-I78 HydrophobicContact CD1-CD1 4.42Å; I31-I78 HydrophobicContact CD1-CG1 3.62Å; I31-I78 HydrophobicContact CG1-CG1 4.31Å; I74-I78 HydrophobicContact CG2-CD1 3.56Å; I74-I78 HydrophobicContact CG2-CG1 4.26Å; I74-I78 WeakPolarHBondContact O-CB 3.42Å; I74-I78 WeakPolarHBondContact O-CG1 3.45Å; I74-I78 PolarHBondContact O-N 3.46Å; I78-L82 HydrophobicContact CG2-CD1 4.31Å; I78-L82 PolarHBondContact O-N 3.07Å; I78-L91 HydrophobicContact CG2-CB 3.9Å; I78-L91 HydrophobicContact CG2-CD1 4.19Å; I78-F95 HydrophobicContact CD1-CD2 3.67Å; I78-F95 HydrophobicContact CD1-CE2 3.23Å; I78-F95 HydrophobicContact CD1-CZ 3.72Å
79	F	68.6	Low	68	Low	7 Å²	7	32.1 Å²	32.1	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-58.8	-49.3	176.3	-179.4	-124.9	0	0	0	111.2	V75 G76 L83 L92 I107 V109 I117	V75-F79 WeakPolarHBondContact O-CB 3.39Å; V75-F79 PolarHBondContact O-N 3.03Å; G76-F79 PolarHBondContact O-N 2.81Å; F79-L83 HydrophobicContact CD2-CD2 4.26Å; F79-L83 HydrophobicContact CE1-CD2 4.03Å; F79-L83 HydrophobicContact CE2-CD2 3.71Å; F79-L83 HydrophobicContact CZ-CD2 3.57Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.27Å; F79-L92 HydrophobicContact CB-CD2 4.11Å; F79-L92 HydrophobicContact CD2-CD1 3.89Å; F79-L92 HydrophobicContact CD2-CD2 4.13Å; F79-L92 HydrophobicContact CD2-CG 4.49Å; F79-L92 HydrophobicContact CE2-CD1 4.27Å; F79-L92 HydrophobicContact CG-CD2 4.5Å; F79-I107 HydrophobicContact CG-CG2 4.47Å; F79-V109 HydrophobicContact CZ-CG1 4.24Å; F79-V109 HydrophobicContact CZ-CG2 4.45Å; F79-I117 HydrophobicContact CE2-CD1 3.66Å; F79-I117 HydrophobicContact CE2-CG1 3.91Å; F79-I117 HydrophobicContact CZ-CD1 3.76Å; F79-I117 HydrophobicContact CZ-CG1 4.16Å
80	H	59.9	Low	69.3	Low	41 Å²	41	26.9 Å²	26.9	19%	0.19	13%	0.129	C	C	.	.	H	α-helix	trans	-75.4	-38.5	-175	-79.7	-72.5	0	0	0	114.4	G76 C77 L82 F161 D162	G76-H80 PolarHBondContact O-CD2 2.83Å; G76-H80 VanDerWaalsContact O-CD2 3.27Å; G76-H80 PolarHBondContact O-N 3.21Å; C77-H80 PolarHBondContact O-N 2.91Å; H80-L82 PolarHBondContact O-N 3.12Å; H80-F161 HydrophobicContact CB-CD1 3.97Å; H80-F161 HydrophobicContact CB-CE1 4.35Å; H80-F161 AromaticContact CD2-CD1 3.53Å; H80-F161 AromaticContact CG-CD1 3.54Å; H80-D162 IonicContact CE1-OD1 3.84Å; H80-D162 PolarHBondContact CE1-OD1 2.92Å; H80-D162 IonicContact ND1-OD1 3.96Å
81	R	57.8	Low	70.5	Confident	82 Å²	82	27.1 Å²	27.1	31%	0.309	13%	0.131	S	C	.	.	H	α-helix	trans	-65.9	-19.7	178.6	-171.5	167.5	177.6	116.4	8.6	112.9	D28 I31 E32 C77	D28-R81 VanDerWaalsContact CG-NH1 3.29Å; D28-R81 IonicContact OD1-CZ 3.87Å; D28-R81 IonicContact OD1-NE 3.86Å; D28-R81 IonicContact OD1-NH1 2.6Å; D28-R81 PolarHBondContact OD1-NH1 3.08Å; I31-R81 HydrophobicContact CG2-CG 4.4Å; E32-R81 IonicContact OE1-CZ 2.94Å; E32-R81 IonicContact OE1-NH2 3.74Å; E32-R81 PolarHBondContact OE1-NH2 3.41Å; E32-R81 IonicContact OE2-CZ 3.93Å; E32-R81 IonicContact OE2-NH2 2.74Å; E32-R81 PolarHBondContact OE2-NH2 2.87Å; C77-R81 WeakPolarHBondContact O-CB 3.28Å; C77-R81 PolarHBondContact O-N 3.47Å
82	L	59.9	Low	71.3	Confident	7 Å²	7	27.3 Å²	27.3	4%	0.037	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	16.1	-173.6	-55.2	176.1	0	0	0	114.4	I31 T35 I78 H80 V84 R85 A88 L91	I31-L82 HydrophobicContact CG2-CD1 4.02Å; I31-L82 HydrophobicContact CG2-CD2 4.14Å; I31-L82 HydrophobicContact CG2-CG 4.2Å; T35-L82 HydrophobicContact CG2-CD2 3.83Å; T35-L82 WeakPolarHBondContact OG1-CD2 3.29Å; I78-L82 HydrophobicContact CG2-CD1 4.31Å; I78-L82 PolarHBondContact O-N 3.07Å; H80-L82 PolarHBondContact O-N 3.12Å; L82-V84 PolarHBondContact O-N 3.49Å; L82-R85 PolarHBondContact O-N 3.46Å; L82-A88 HydrophobicContact CB-CB 3.5Å; L82-A88 WeakPolarHBondContact O-CB 3.22Å; L82-L91 HydrophobicContact CD1-CD1 3.25Å
83	L	55.2	Low	72.3	Confident	30 Å²	30	27.1 Å²	27.1	16%	0.157	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	139.5	168.3	-74.2	169.8	0	0	0	110.1	F79 W116 D162	F79-L83 HydrophobicContact CD2-CD2 4.26Å; F79-L83 HydrophobicContact CE1-CD2 4.03Å; F79-L83 HydrophobicContact CE2-CD2 3.71Å; F79-L83 HydrophobicContact CZ-CD2 3.57Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.27Å; L83-W116 HydrophobicContact CD1-CE3 4.19Å; L83-W116 HydrophobicContact CD1-CZ3 3.91Å; L83-W116 HydrophobicContact CD2-CE3 4.24Å; L83-D162 HydrophobicContact CD1-CB 4.25Å
84	V	55.8	Low	73.5	Confident	95 Å²	95	27.2 Å²	27.2	58%	0.576	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	20.2	-177.7	-153.1	0	0	0	0	115.3	L82	L82-V84 PolarHBondContact O-N 3.49Å
85	R	70.5	Confident	74.2	Confident	150 Å²	150	27.3 Å²	27.3	57%	0.566	13%	0.133	S	C	*	.			trans	-128.8	139.1	170.6	-65.7	-172.5	179.2	-177.5	1.3	114.2	L82 C87 A88	L82-R85 PolarHBondContact O-N 3.46Å; R85-C87 PolarHBondContact O-N 3.03Å; R85-A88 WeakPolarHBondContact O-CB 3.37Å; R85-A88 PolarHBondContact O-N 2.96Å
86	I	81.9	Confident	74.8	Confident	32 Å²	32	27.5 Å²	27.5	16%	0.164	13%	0.134	C	C	.	.	H	α-helix	trans	-51.9	-40.8	174	-70.9	172.6	0	0	0	112	P44 A88 L89 Y90 V120 A124 V132	P44-I86 HydrophobicContact CB-CD1 3.88Å; P44-I86 HydrophobicContact CB-CG2 4.24Å; I86-A88 PolarHBondContact O-N 3.37Å; I86-L89 PolarHBondContact O-N 2.84Å; I86-L89 VanDerWaalsContact O-N 3.08Å; I86-Y90 HydrophobicContact CG2-CD2 4.24Å; I86-Y90 HydrophobicContact CG2-CE2 3.85Å; I86-Y90 PolarHBondContact O-N 3.43Å; I86-V120 HydrophobicContact CG1-CG1 4.37Å; I86-A124 HydrophobicContact CD1-CB 4.5Å; I86-V132 HydrophobicContact CD1-CG2 4.35Å; I86-V132 HydrophobicContact CG1-CG1 4.27Å; I86-V132 HydrophobicContact CG1-CG2 4.45Å; I86-V132 HydrophobicContact CG2-CB 4.43Å; I86-V132 HydrophobicContact CG2-CG1 4.01Å; I86-V132 HydrophobicContact CG2-CG2 3.48Å; I86-V132 VanDerWaalsContact CG2-CG2 3.48Å
87	C	83.3	Confident	75.7	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.02	15%	0.147	C	C	.	.	H	α-helix	trans	-50.9	-39.6	175.9	-174.6	0	0	0	0	112.7	F38 R85 L89 Y90 L91	F38-C87 HydrophobicContact CD1-CB 3.63Å; F38-C87 HydrophobicContact CE1-CB 3.83Å; F38-C87 HydrophobicContact CG-CB 4.42Å; R85-C87 PolarHBondContact O-N 3.03Å; C87-L89 PolarHBondContact O-N 2.96Å; C87-Y90 PolarHBondContact O-N 3.03Å; C87-L91 WeakPolarHBondContact O-CG 3.47Å; C87-L91 PolarHBondContact O-N 3.34Å
88	A	82	Confident	76.7	Confident	9 Å²	9	34.9 Å²	34.9	7%	0.074	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-44.7	179.5	0	0	0	0	0	112.1	L82 R85 I86 Y90 L91 L92	L82-A88 HydrophobicContact CB-CB 3.5Å; L82-A88 WeakPolarHBondContact O-CB 3.22Å; R85-A88 WeakPolarHBondContact O-CB 3.37Å; R85-A88 PolarHBondContact O-N 2.96Å; I86-A88 PolarHBondContact O-N 3.37Å; A88-Y90 VanDerWaalsContact C-N 3.33Å; A88-Y90 PolarHBondContact O-N 3.04Å; A88-L91 PolarHBondContact O-N 3.07Å; A88-L92 WeakPolarHBondContact O-CB 3.49Å; A88-L92 VanDerWaalsContact O-CG 3.27Å; A88-L92 WeakPolarHBondContact O-CG 3.23Å; A88-L92 PolarHBondContact O-N 3.5Å
89	L	86.1	Confident	77.3	Confident	12 Å²	12	35.4 Å²	35.4	6%	0.063	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-39.5	-178.8	-170	78.7	0	0	0	111.3	I86 C87 Y93 I117 V132 V135 F136 L139	I86-L89 PolarHBondContact O-N 2.84Å; I86-L89 VanDerWaalsContact O-N 3.08Å; C87-L89 PolarHBondContact O-N 2.96Å; L89-Y93 WeakPolarHBondContact O-CB 3.23Å; L89-Y93 PolarHBondContact O-N 3.25Å; L89-I117 HydrophobicContact CD1-CG2 4.37Å; L89-V132 HydrophobicContact CD2-CG1 3.59Å; L89-V132 VanDerWaalsContact CD2-O 3.29Å; L89-V132 WeakPolarHBondContact CD2-O 3.37Å; L89-V135 HydrophobicContact CD2-CB 4.49Å; L89-V135 HydrophobicContact CD2-CG1 4.27Å; L89-V135 HydrophobicContact CG-CG1 4.11Å; L89-F136 HydrophobicContact CD1-CB 4.27Å; L89-F136 HydrophobicContact CD1-CD2 4.34Å; L89-F136 HydrophobicContact CD2-CB 3.83Å; L89-L139 HydrophobicContact CD1-CD1 3.82Å; L89-L139 HydrophobicContact CG-CD1 4.32Å
90	Y	89.7	Confident	77.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-41	172.4	-68.1	-26.3	0	0	0	112.6	F38 P44 F46 F49 I86 C87 A88 Y93 A94 D131 V132 V135	F38-Y90 HydrophobicContact CE2-CD2 4.5Å; F38-Y90 HydrophobicContact CZ-CD2 4.11Å; F38-Y90 HydrophobicContact CZ-CE2 4.05Å; P44-Y90 VanDerWaalsContact O-CE2 3.26Å; P44-Y90 WeakPolarHBondContact O-CE2 3.45Å; P44-Y90 PolarHBondContact O-OH 3.25Å; F46-Y90 HydrophobicContact CB-CE1 3.97Å; F46-Y90 HydrophobicContact CB-CE2 4.43Å; F46-Y90 AromaticContact CD2-CD1 3.6Å; F46-Y90 HydrophobicContact CD2-CD1 3.6Å; F46-Y90 HydrophobicContact CD2-CD2 4.39Å; F46-Y90 AromaticContact CD2-CE1 3.7Å; F46-Y90 HydrophobicContact CD2-CE1 3.7Å; F46-Y90 HydrophobicContact CD2-CE2 4.5Å; F46-Y90 AromaticContact CD2-CG 3.95Å; F46-Y90 HydrophobicContact CD2-CG 3.95Å; F46-Y90 HydrophobicContact CE2-CD1 4.25Å; F46-Y90 HydrophobicContact CG-CE1 4.27Å; F46-Y90 PolarHBondContact N-OH 3.34Å; F49-Y90 HydrophobicContact CB-CD2 3.76Å; F49-Y90 HydrophobicContact CB-CE2 4.21Å; F49-Y90 HydrophobicContact CB-CG 4.47Å; F49-Y90 HydrophobicContact CD1-CD2 4.38Å; F49-Y90 HydrophobicContact CD1-CG 4.27Å; F49-Y90 AromaticContact CD2-CD2 3.95Å; F49-Y90 HydrophobicContact CD2-CD2 3.95Å; F49-Y90 HydrophobicContact CD2-CG 4.24Å; F49-Y90 AromaticContact CG-CD2 3.75Å; F49-Y90 HydrophobicContact CG-CD2 3.75Å; F49-Y90 HydrophobicContact CG-CG 4.04Å; F49-Y90 WeakPolarHBondContact CZ-O 3.33Å; I86-Y90 HydrophobicContact CG2-CD2 4.24Å; I86-Y90 HydrophobicContact CG2-CE2 3.85Å; I86-Y90 PolarHBondContact O-N 3.43Å; C87-Y90 PolarHBondContact O-N 3.03Å; A88-Y90 VanDerWaalsContact C-N 3.33Å; A88-Y90 PolarHBondContact O-N 3.04Å; Y90-Y93 PolarHBondContact O-N 3.45Å; Y90-A94 VanDerWaalsContact O-CB 3.31Å; Y90-A94 WeakPolarHBondContact O-CB 3.44Å; Y90-A94 PolarHBondContact O-N 2.68Å; Y90-D131 VanDerWaalsContact OH-CG 3.27Å; Y90-D131 PolarHBondContact OH-OD1 3.22Å; Y90-D131 PolarHBondContact OH-OD2 2.82Å; Y90-V132 HydrophobicContact CE1-CB 4.47Å; Y90-V132 HydrophobicContact CE1-CG2 4.09Å; Y90-V132 WeakPolarHBondContact OH-CG2 3.44Å; Y90-V135 HydrophobicContact CD1-CB 4.32Å; Y90-V135 HydrophobicContact CD1-CG1 4.25Å; Y90-V135 HydrophobicContact CD1-CG2 4.09Å; Y90-V135 HydrophobicContact CE1-CB 4.43Å; Y90-V135 HydrophobicContact CE1-CG2 4.09Å
91	L	87	Confident	78	Confident	5 Å²	5	37 Å²	37	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-65.8	-46.2	175.3	-70.3	167	0	0	0	111.8	F34 F49 W53 I78 L82 C87 A88 Y93 A94 F95	F34-L91 HydrophobicContact CD1-CD1 4.28Å; F34-L91 HydrophobicContact CD1-CD2 4.28Å; F34-L91 HydrophobicContact CE1-CD1 4.14Å; F34-L91 HydrophobicContact CE1-CD2 3.72Å; F34-L91 HydrophobicContact CE1-CG 4.17Å; F34-L91 HydrophobicContact CZ-CD2 4.05Å; F49-L91 HydrophobicContact CE2-CD2 3.69Å; F49-L91 HydrophobicContact CE2-CG 3.81Å; F49-L91 HydrophobicContact CZ-CD2 3.89Å; F49-L91 HydrophobicContact CZ-CG 4.21Å; W53-L91 HydrophobicContact CE3-CD2 3.94Å; W53-L91 HydrophobicContact CZ3-CD2 3.76Å; I78-L91 HydrophobicContact CG2-CB 3.9Å; I78-L91 HydrophobicContact CG2-CD1 4.19Å; L82-L91 HydrophobicContact CD1-CD1 3.25Å; C87-L91 WeakPolarHBondContact O-CG 3.47Å; C87-L91 PolarHBondContact O-N 3.34Å; A88-L91 PolarHBondContact O-N 3.07Å; L91-Y93 VanDerWaalsContact C-N 3.27Å; L91-Y93 PolarHBondContact O-N 3.24Å; L91-A94 PolarHBondContact O-N 3.13Å; L91-A94 VanDerWaalsContact O-N 3.17Å; L91-F95 HydrophobicContact CB-CD2 4.32Å; L91-F95 HydrophobicContact CB-CE2 4.43Å; L91-F95 HydrophobicContact CD2-CE2 4.04Å; L91-F95 WeakPolarHBondContact O-CB 3.25Å; L91-F95 WeakPolarHBondContact O-CD2 3.39Å; L91-F95 PolarHBondContact O-N 3.18Å
92	L	86.6	Confident	78.6	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-53.2	-45.7	173.8	-72.2	177.1	0	0	0	111.4	V75 F79 A88 H96 I107 L139	V75-L92 HydrophobicContact CG1-CD2 4.37Å; F79-L92 HydrophobicContact CB-CD2 4.11Å; F79-L92 HydrophobicContact CD2-CD1 3.89Å; F79-L92 HydrophobicContact CD2-CD2 4.13Å; F79-L92 HydrophobicContact CD2-CG 4.49Å; F79-L92 HydrophobicContact CE2-CD1 4.27Å; F79-L92 HydrophobicContact CG-CD2 4.5Å; A88-L92 WeakPolarHBondContact O-CB 3.49Å; A88-L92 VanDerWaalsContact O-CG 3.27Å; A88-L92 WeakPolarHBondContact O-CG 3.23Å; A88-L92 PolarHBondContact O-N 3.5Å; L92-H96 WeakPolarHBondContact O-CB 3.44Å; L92-H96 PolarHBondContact O-N 2.84Å; L92-I107 HydrophobicContact CB-CD1 3.96Å; L92-I107 HydrophobicContact CD1-CD1 4.31Å; L92-I107 HydrophobicContact CD2-CD1 3.93Å; L92-I107 HydrophobicContact CD2-CG1 4.06Å; L92-I107 HydrophobicContact CD2-CG2 3.92Å; L92-I107 HydrophobicContact CG-CD1 4.29Å; L92-L139 HydrophobicContact CB-CD1 4.12Å
93	Y	89.8	Confident	79.1	Confident	50 Å²	50	50.3 Å²	50.3	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-42.6	176.9	172.9	-114.7	0	0	0	113.3	F46 L89 Y90 L91 G97 V135 K138 L139	F46-Y93 AromaticContact CE2-CD1 3.97Å; F46-Y93 HydrophobicContact CE2-CD1 3.97Å; F46-Y93 HydrophobicContact CE2-CE1 4.06Å; F46-Y93 HydrophobicContact CZ-CD1 4.09Å; F46-Y93 AromaticContact CZ-CE1 3.73Å; F46-Y93 HydrophobicContact CZ-CE1 3.73Å; L89-Y93 WeakPolarHBondContact O-CB 3.23Å; L89-Y93 PolarHBondContact O-N 3.25Å; Y90-Y93 PolarHBondContact O-N 3.45Å; L91-Y93 VanDerWaalsContact C-N 3.27Å; L91-Y93 PolarHBondContact O-N 3.24Å; Y93-G97 PolarHBondContact O-N 2.97Å; Y93-V135 HydrophobicContact CD1-CG1 3.86Å; Y93-V135 HydrophobicContact CD1-CG2 3.86Å; Y93-V135 HydrophobicContact CD2-CG1 4.17Å; Y93-V135 HydrophobicContact CE1-CG2 4Å; Y93-V135 HydrophobicContact CG-CG1 3.56Å; Y93-V135 HydrophobicContact CG-CG2 4.31Å; Y93-K138 HydrophobicContact CE2-CB 4.45Å; Y93-K138 HydrophobicContact CE2-CD 3.71Å; Y93-K138 HydrophobicContact CE2-CG 4Å; Y93-K138 WeakPolarHBondContact OH-CE 3.3Å; Y93-K138 PolarHBondContact OH-NZ 2.93Å; Y93-L139 HydrophobicContact CD2-CG 4.44Å
94	A	88.9	Confident	80.2	Confident	12 Å²	12	52.7 Å²	52.7	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-44.5	177.1	0	0	0	0	0	111.8	F49 W53 Y90 L91 K98	F49-A94 HydrophobicContact CE1-CB 4.03Å; F49-A94 HydrophobicContact CZ-CB 3.95Å; W53-A94 HydrophobicContact CD2-CB 4.06Å; W53-A94 HydrophobicContact CE3-CB 3.69Å; W53-A94 HydrophobicContact CH2-CB 3.56Å; W53-A94 HydrophobicContact CZ2-CB 3.94Å; W53-A94 HydrophobicContact CZ3-CB 3.43Å; W53-A94 VanDerWaalsContact CZ3-CB 3.43Å; Y90-A94 VanDerWaalsContact O-CB 3.31Å; Y90-A94 WeakPolarHBondContact O-CB 3.44Å; Y90-A94 PolarHBondContact O-N 2.68Å; L91-A94 PolarHBondContact O-N 3.13Å; L91-A94 VanDerWaalsContact O-N 3.17Å; A94-K98 VanDerWaalsContact O-CB 3.23Å; A94-K98 WeakPolarHBondContact O-CB 3.19Å; A94-K98 WeakPolarHBondContact O-CG 3.45Å; A94-K98 PolarHBondContact O-N 3.5Å
95	F	84.9	Confident	81.1	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-69.7	-50.1	176.8	-76.5	-67	0	0	0	112	W53 L61 I62 V75 I78 L91 G97 K98 Q99	W53-F95 AromaticContact CH2-CD1 3.86Å; W53-F95 HydrophobicContact CH2-CD1 3.86Å; W53-F95 AromaticContact CH2-CD2 3.97Å; W53-F95 HydrophobicContact CH2-CD2 3.97Å; W53-F95 AromaticContact CH2-CE1 3.6Å; W53-F95 HydrophobicContact CH2-CE1 3.6Å; W53-F95 AromaticContact CH2-CE2 3.68Å; W53-F95 HydrophobicContact CH2-CE2 3.68Å; W53-F95 HydrophobicContact CH2-CG 4.03Å; W53-F95 AromaticContact CH2-CZ 3.49Å; W53-F95 HydrophobicContact CH2-CZ 3.49Å; W53-F95 VanDerWaalsContact CH2-CZ 3.49Å; W53-F95 AromaticContact CZ3-CD2 3.99Å; W53-F95 HydrophobicContact CZ3-CD2 3.99Å; W53-F95 HydrophobicContact CZ3-CE1 4.24Å; W53-F95 AromaticContact CZ3-CE2 3.51Å; W53-F95 HydrophobicContact CZ3-CE2 3.51Å; W53-F95 AromaticContact CZ3-CZ 3.65Å; W53-F95 HydrophobicContact CZ3-CZ 3.65Å; L61-F95 HydrophobicContact CB-CE1 4.26Å; L61-F95 HydrophobicContact CB-CZ 4.46Å; L61-F95 HydrophobicContact CD1-CZ 4.14Å; I62-F95 HydrophobicContact CB-CD1 4.38Å; I62-F95 HydrophobicContact CD1-CD1 3.94Å; I62-F95 HydrophobicContact CG1-CD1 3.98Å; I62-F95 HydrophobicContact CG1-CE1 4.13Å; I62-F95 HydrophobicContact CG2-CD1 3.51Å; I62-F95 HydrophobicContact CG2-CE1 3.78Å; V75-F95 HydrophobicContact CG2-CB 4.44Å; I78-F95 HydrophobicContact CD1-CD2 3.67Å; I78-F95 HydrophobicContact CD1-CE2 3.23Å; I78-F95 HydrophobicContact CD1-CZ 3.72Å; L91-F95 HydrophobicContact CB-CD2 4.32Å; L91-F95 HydrophobicContact CB-CE2 4.43Å; L91-F95 HydrophobicContact CD2-CE2 4.04Å; L91-F95 WeakPolarHBondContact O-CB 3.25Å; L91-F95 WeakPolarHBondContact O-CD2 3.39Å; L91-F95 PolarHBondContact O-N 3.18Å; F95-G97 VanDerWaalsContact C-N 3.32Å; F95-G97 PolarHBondContact O-N 3.05Å; F95-K98 PolarHBondContact O-N 2.92Å; F95-K98 VanDerWaalsContact O-N 3.14Å; F95-Q99 WeakPolarHBondContact O-CG 3.47Å; F95-Q99 PolarHBondContact O-N 3.2Å
96	H	85	Confident	81.6	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-41.3	177.9	-175.5	-106.3	0	0	0	112.2	L92 K98 H104 L139 A144	L92-H96 WeakPolarHBondContact O-CB 3.44Å; L92-H96 PolarHBondContact O-N 2.84Å; H96-K98 VanDerWaalsContact C-N 3.27Å; H96-K98 PolarHBondContact O-N 3.08Å; H96-H104 AromaticContact CE1-ND1 3.95Å; H96-H104 AromaticContact NE2-ND1 3.85Å; H96-L139 HydrophobicContact CB-CD2 4.16Å; H96-A144 VanDerWaalsContact CE1-CB 3.44Å; H96-A144 WeakPolarHBondContact CE1-CB 3.27Å
97	G	84.9	Confident	81.6	Confident	45 Å²	45	43 Å²	43	46%	0.464	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	0.7	178.3	0	0	0	0	0	115.9	Y93 F95	Y93-G97 PolarHBondContact O-N 2.97Å; F95-G97 VanDerWaalsContact C-N 3.32Å; F95-G97 PolarHBondContact O-N 3.05Å
98	K	84.8	Confident	81.4	Confident	129 Å²	129	48.1 Å²	48.1	56%	0.561	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.2	5.9	-177.5	-61.9	-64.7	172.4	-158.7	0	114.9	I59 I62 A94 F95 H96	I59-K98 HydrophobicContact CD1-CB 3.69Å; I59-K98 HydrophobicContact CD1-CG 4.22Å; I62-K98 HydrophobicContact CD1-CB 3.97Å; I62-K98 WeakPolarHBondContact CD1-O 3.37Å; A94-K98 VanDerWaalsContact O-CB 3.23Å; A94-K98 WeakPolarHBondContact O-CB 3.19Å; A94-K98 WeakPolarHBondContact O-CG 3.45Å; A94-K98 PolarHBondContact O-N 3.5Å; F95-K98 PolarHBondContact O-N 2.92Å; F95-K98 VanDerWaalsContact O-N 3.14Å; H96-K98 VanDerWaalsContact C-N 3.27Å; H96-K98 PolarHBondContact O-N 3.08Å
99	Q	81.1	Confident	81.3	Confident	14 Å²	14	47.8 Å²	47.8	7%	0.065	23%	0.228	C	C	.	.			trans	-58.4	132.9	-178.4	-55.2	-172.9	2	0	0	111.6	F95 I101 H104 V105	F95-Q99 WeakPolarHBondContact O-CG 3.47Å; F95-Q99 PolarHBondContact O-N 3.2Å; Q99-I101 HydrophobicContact CB-CG1 4.08Å; Q99-I101 PolarHBondContact O-N 3.12Å; Q99-H104 VanDerWaalsContact OE1-CA 3.26Å; Q99-V105 PolarHBondContact NE2-O 2.87Å
100	P	70.5	Confident	81	Confident	52 Å²	52	47.7 Å²	47.7	34%	0.338	23%	0.228	S	C	.	.	S	Bend	trans	-84	28.9	-173.6	37.6	-41.6	0	0	0	113.5	R65 Q66	R65-P100 WeakPolarHBondContact O-CG 3.47Å; Q66-P100 PolarHBondContact NE2-O 3.02Å; Q66-P100 VanDerWaalsContact NE2-O 3.12Å
101	I	73.3	Confident	80.4	Confident	29 Å²	29	52.1 Å²	52.1	15%	0.149	26%	0.257	C	S	.	.	S	Bend	trans	-130.1	153.5	-173.6	59.5	168.6	0	0	0	111	Q68 L71 Q99 N103 V105	Q68-I101 HydrophobicContact CG-CD1 3.62Å; L71-I101 HydrophobicContact CD1-CD1 3.77Å; L71-I101 HydrophobicContact CD1-CG1 4.03Å; L71-I101 HydrophobicContact CD1-CG2 4Å; Q99-I101 HydrophobicContact CB-CG1 4.08Å; Q99-I101 PolarHBondContact O-N 3.12Å; I101-N103 WeakPolarHBondContact CD1-O 3.46Å; I101-V105 HydrophobicContact CD1-CG2 4.03Å
102	R	68.7	Low	79.9	Confident	249 Å²	249	56.9 Å²	56.9	94%	0.94	28%	0.277	S	S	*	.	S	Bend	trans	-73.4	-33.9	-176.3	-72.9	-178	175.2	167	-2.8	114.5
103	N	71.3	Confident	79.5	Confident	121 Å²	121	56.7 Å²	56.7	65%	0.647	28%	0.277	S	S	*	.	S	Bend	trans	-110	99.7	179.3	-64.2	21.3	0	0	0	106.8	Q68 I101 V105	Q68-N103 PolarHBondContact NE2-O 2.83Å; I101-N103 WeakPolarHBondContact CD1-O 3.46Å; N103-V105 PolarHBondContact O-N 3.41Å
104	H	77.9	Confident	79.3	Confident	80 Å²	80	55.3 Å²	55.3	37%	0.37	27%	0.271	S	S	.	.			trans	-57.6	140.1	-175.6	-60.8	167.3	0	0	0	111.6	H96 Q99 H106	H96-H104 AromaticContact CE1-ND1 3.95Å; H96-H104 AromaticContact NE2-ND1 3.85Å; Q99-H104 VanDerWaalsContact OE1-CA 3.26Å; H104-H106 PolarHBondContact O-N 3.23Å
105	V	74.8	Confident	79.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.			trans	-65.9	115.5	164.8	159.6	0	0	0	0	108.5	Q68 L71 Y72 Q99 I101 N103	Q68-V105 HydrophobicContact CB-CG2 3.89Å; Q68-V105 HydrophobicContact CG-CG2 3.94Å; L71-V105 HydrophobicContact CB-CB 4.5Å; L71-V105 HydrophobicContact CB-CG2 4.03Å; Y72-V105 HydrophobicContact CD1-CG1 3.44Å; Y72-V105 VanDerWaalsContact CD1-CG1 3.44Å; Y72-V105 HydrophobicContact CD2-CG1 4.19Å; Y72-V105 HydrophobicContact CD2-CG2 3.81Å; Y72-V105 HydrophobicContact CE1-CB 4.44Å; Y72-V105 HydrophobicContact CE1-CG1 3.62Å; Y72-V105 HydrophobicContact CE2-CG1 4.34Å; Y72-V105 HydrophobicContact CE2-CG2 3.78Å; Y72-V105 HydrophobicContact CG-CG1 3.72Å; Y72-V105 HydrophobicContact CG-CG2 4.18Å; Q99-V105 PolarHBondContact NE2-O 2.87Å; I101-V105 HydrophobicContact CD1-CG2 4.03Å; N103-V105 PolarHBondContact O-N 3.41Å
106	H	81.5	Confident	79	Confident	72 Å²	72	60 Å²	60	33%	0.333	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-73.6	140.2	172.8	-58.1	-90.7	0	0	0	110.7	H104 R108 N143 A144 L146	H104-H106 PolarHBondContact O-N 3.23Å; H106-R108 PolarHBondContact O-N 3.42Å; H106-N143 PolarHBondContact CE1-O 3.39Å; H106-N143 PolarHBondContact ND1-O 3.31Å; H106-A144 CarbonylContact C-O 3.38Å; H106-A144 WeakPolarHBondContact CA-O 3.36Å; H106-L146 HydrophobicContact CB-CB 3.64Å
107	I	81.7	Confident	79	Confident	2 Å²	2	60 Å²	60	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	117	172.6	-54.6	157.7	0	0	0	107.3	V75 F79 L92 V109 L139 A144 F145 L146	V75-I107 HydrophobicContact CG1-CB 4.34Å; V75-I107 HydrophobicContact CG1-CG1 3.81Å; V75-I107 HydrophobicContact CG1-CG2 4.43Å; F79-I107 HydrophobicContact CG-CG2 4.47Å; L92-I107 HydrophobicContact CB-CD1 3.96Å; L92-I107 HydrophobicContact CD1-CD1 4.31Å; L92-I107 HydrophobicContact CD2-CD1 3.93Å; L92-I107 HydrophobicContact CD2-CG1 4.06Å; L92-I107 HydrophobicContact CD2-CG2 3.92Å; L92-I107 HydrophobicContact CG-CD1 4.29Å; I107-V109 HydrophobicContact CG2-CG2 4.1Å; I107-L139 HydrophobicContact CD1-CD2 3.98Å; I107-A144 HydrophobicContact CD1-CB 4.08Å; I107-A144 PolarHBondContact N-O 3.08Å; I107-F145 HydrophobicContact CB-CD1 3.93Å; I107-F145 HydrophobicContact CB-CE1 4.35Å; I107-F145 HydrophobicContact CD1-CD1 4.07Å; I107-F145 HydrophobicContact CD1-CE1 3.8Å; I107-F145 HydrophobicContact CG2-CD1 4.09Å; I107-F145 HydrophobicContact CG2-CE1 4.29Å; I107-F145 CarbonylContact O-C 3.56Å; I107-F145 WeakPolarHBondContact O-CA 3.42Å; I107-L146 PolarHBondContact O-N 3.45Å
108	R	78.7	Confident	79.1	Confident	109 Å²	109	60.9 Å²	60.9	41%	0.411	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.4	178.8	-68.5	-174.4	177.8	-157.2	7.4	110.3	H106 L146	H106-R108 PolarHBondContact O-N 3.42Å; R108-L146 WeakPolarHBondContact CA-O 3.32Å; R108-L146 HydrophobicContact CG-CD2 4.3Å
109	V	79.6	Confident	79.3	Confident	2 Å²	2	59 Å²	59	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.7	-177.3	-164.3	0	0	0	0	109.9	F79 I107 W114 I117 F145 L146 F147 C148	F79-V109 HydrophobicContact CZ-CG1 4.24Å; F79-V109 HydrophobicContact CZ-CG2 4.45Å; I107-V109 HydrophobicContact CG2-CG2 4.1Å; V109-W114 HydrophobicContact CG1-CB 3.74Å; V109-W114 HydrophobicContact CG1-CE3 4.28Å; V109-W114 VanDerWaalsContact CG1-N 3.34Å; V109-I117 HydrophobicContact CG1-CD1 3.8Å; V109-I117 HydrophobicContact CG2-CD1 3.94Å; V109-F145 HydrophobicContact CG2-CB 4.28Å; V109-F145 HydrophobicContact CG2-CD1 3.61Å; V109-F145 HydrophobicContact CG2-CE1 4.39Å; V109-F145 HydrophobicContact CG2-CG 4.33Å; V109-L146 PolarHBondContact N-O 3.18Å; V109-F147 WeakPolarHBondContact O-CA 3.43Å; V109-C148 PolarHBondContact O-N 2.93Å
110	C	79.7	Confident	79.5	Confident	10 Å²	10	59.3 Å²	59.3	7%	0.068	29%	0.285	C	S	.	.			trans	-94.5	166	170.4	89.2	0	0	0	0	111	K112 S113 W114 C148 R151	C110-K112 PolarHBondContact O-N 2.99Å; C110-S113 CarbonylContact O-C 3.59Å; C110-S113 PolarHBondContact O-N 3.31Å; C110-S113 PolarHBondContact SG-OG 3.21Å; C110-W114 PolarHBondContact O-N 2.95Å; C110-C148 WeakPolarHBondContact CA-O 3.41Å; C110-C148 WeakPolarHBondContact CB-O 3.13Å; C110-R151 HydrophobicContact CB-CG 4.28Å; C110-R151 PolarHBondContact SG-NH1 2.81Å
111	P	77.4	Confident	80.3	Confident	93 Å²	93	56.9 Å²	56.9	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-51.5	-45.4	-177.8	-29.4	36.5	0	0	0	115	W114 S115	P111-W114 PolarHBondContact O-N 3.26Å; P111-S115 PolarHBondContact O-N 3.46Å; P111-S115 PolarHBondContact O-OG 3.44Å
112	K	77.2	Confident	81	Confident	106 Å²	106	57.6 Å²	57.6	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-35.5	178.3	179.1	167.1	174.4	176.1	0	113	C110 S115 W116	C110-K112 PolarHBondContact O-N 2.99Å; K112-S115 WeakPolarHBondContact CA-OG 3.19Å; K112-S115 PolarHBondContact O-OG 3.21Å; K112-W116 HydrophobicContact CD-CH2 4.28Å; K112-W116 HydrophobicContact CD-CZ2 4.25Å; K112-W116 VanDerWaalsContact CE-CH2 3.49Å; K112-W116 HydrophobicContact CG-CH2 4.09Å; K112-W116 HydrophobicContact CG-CZ2 4.03Å; K112-W116 HydrophobicContact CG-CZ3 4.37Å; K112-W116 PolarHBondContact O-N 3.13Å
113	S	78.7	Confident	81.9	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-73.7	-29.6	174.1	-41	0	0	0	0	111.5	C110 W116 I117 R151 D162	C110-S113 CarbonylContact O-C 3.59Å; C110-S113 PolarHBondContact O-N 3.31Å; C110-S113 PolarHBondContact SG-OG 3.21Å; S113-W116 PolarHBondContact O-N 3.08Å; S113-I117 WeakPolarHBondContact O-CG1 3.49Å; S113-I117 PolarHBondContact O-N 2.95Å; S113-I117 VanDerWaalsContact O-N 3.13Å; S113-R151 PolarHBondContact OG-NH1 2.62Å; S113-D162 PolarHBondContact OG-OD1 3.24Å
114	W	85.7	Confident	82.7	Confident	20 Å²	20	44 Å²	44	8%	0.076	22%	0.219	C	C	.	.	H	α-helix	trans	-71.7	-42	175.9	179.8	-106.9	0	0	0	111.8	V109 C110 P111 W116 I117 L118 F136 F145 F147	V109-W114 HydrophobicContact CG1-CB 3.74Å; V109-W114 HydrophobicContact CG1-CE3 4.28Å; V109-W114 VanDerWaalsContact CG1-N 3.34Å; C110-W114 PolarHBondContact O-N 2.95Å; P111-W114 PolarHBondContact O-N 3.26Å; W114-W116 PolarHBondContact O-N 3.16Å; W114-I117 HydrophobicContact CE3-CD1 4.19Å; W114-I117 PolarHBondContact O-N 3.25Å; W114-L118 WeakPolarHBondContact O-CB 3.05Å; W114-L118 PolarHBondContact O-N 2.91Å; W114-F136 AromaticContact CH2-CE2 3.82Å; W114-F136 HydrophobicContact CH2-CE2 3.82Å; W114-F136 AromaticContact CH2-CZ 3.94Å; W114-F136 HydrophobicContact CH2-CZ 3.94Å; W114-F136 HydrophobicContact CZ2-CZ 4.26Å; W114-F136 HydrophobicContact CZ3-CE2 4.18Å; W114-F145 HydrophobicContact CH2-CD2 4.1Å; W114-F145 HydrophobicContact CH2-CE2 4.31Å; W114-F145 HydrophobicContact CZ3-CB 4.38Å; W114-F145 HydrophobicContact CZ3-CD1 4.35Å; W114-F145 AromaticContact CZ3-CD2 3.6Å; W114-F145 HydrophobicContact CZ3-CD2 3.6Å; W114-F145 AromaticContact CZ3-CE2 3.86Å; W114-F145 HydrophobicContact CZ3-CE2 3.86Å; W114-F145 AromaticContact CZ3-CG 3.86Å; W114-F145 HydrophobicContact CZ3-CG 3.86Å; W114-F145 HydrophobicContact CZ3-CZ 4.33Å; W114-F147 HydrophobicContact CB-CE1 4.42Å; W114-F147 AromaticContact CD2-CE1 3.57Å; W114-F147 HydrophobicContact CD2-CE1 3.57Å; W114-F147 AromaticContact CD2-CZ 3.92Å; W114-F147 HydrophobicContact CD2-CZ 3.92Å; W114-F147 AromaticContact CE2-CE1 3.87Å; W114-F147 AromaticContact CE2-CZ 3.94Å; W114-F147 AromaticContact CE3-CE1 3.89Å; W114-F147 HydrophobicContact CE3-CE1 3.89Å; W114-F147 AromaticContact CE3-CZ 3.95Å; W114-F147 HydrophobicContact CE3-CZ 3.95Å; W114-F147 AromaticContact CG-CE1 3.8Å; W114-F147 HydrophobicContact CG-CE1 3.8Å; W114-F147 HydrophobicContact CH2-CZ 4.07Å; W114-F147 HydrophobicContact CZ2-CE1 4.42Å; W114-F147 HydrophobicContact CZ2-CZ 4.03Å; W114-F147 HydrophobicContact CZ3-CE1 4.44Å; W114-F147 HydrophobicContact CZ3-CZ 4.04Å
115	S	83.1	Confident	83.2	Confident	58 Å²	58	44.9 Å²	44.9	41%	0.406	22%	0.219	S	C	.	.	H	α-helix	trans	-58.2	-36.6	173.3	49	0	0	0	0	112	P111 K112 L118 Q119	P111-S115 PolarHBondContact O-N 3.46Å; P111-S115 PolarHBondContact O-OG 3.44Å; K112-S115 WeakPolarHBondContact CA-OG 3.19Å; K112-S115 PolarHBondContact O-OG 3.21Å; S115-L118 PolarHBondContact O-N 3.46Å; S115-Q119 WeakPolarHBondContact O-CB 3.2Å; S115-Q119 PolarHBondContact O-N 2.87Å
116	W	82.7	Confident	83.9	Confident	54 Å²	54	50.3 Å²	50.3	21%	0.205	25%	0.247	C	C	.	.	H	α-helix	trans	-70.5	-40	173.9	-65.5	-36.2	0	0	0	114	L83 K112 S113 W114 L118 V120 D162	L83-W116 HydrophobicContact CD1-CE3 4.19Å; L83-W116 HydrophobicContact CD1-CZ3 3.91Å; L83-W116 HydrophobicContact CD2-CE3 4.24Å; K112-W116 HydrophobicContact CD-CH2 4.28Å; K112-W116 HydrophobicContact CD-CZ2 4.25Å; K112-W116 VanDerWaalsContact CE-CH2 3.49Å; K112-W116 HydrophobicContact CG-CH2 4.09Å; K112-W116 HydrophobicContact CG-CZ2 4.03Å; K112-W116 HydrophobicContact CG-CZ3 4.37Å; K112-W116 PolarHBondContact O-N 3.13Å; S113-W116 PolarHBondContact O-N 3.08Å; W114-W116 PolarHBondContact O-N 3.16Å; W116-L118 VanDerWaalsContact C-N 3.3Å; W116-L118 PolarHBondContact O-N 2.92Å; W116-V120 WeakPolarHBondContact O-CG2 3.28Å; W116-V120 PolarHBondContact O-N 3.24Å; W116-D162 VanDerWaalsContact CH2-OD2 3.28Å; W116-D162 WeakPolarHBondContact CH2-OD2 3.46Å; W116-D162 WeakPolarHBondContact CZ3-OD2 3.37Å
117	I	85.5	Confident	84.2	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.072	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-44.6	172.8	-63.6	170	0	0	0	109.9	F79 L89 V109 S113 W114 A121 F136 F145	F79-I117 HydrophobicContact CE2-CD1 3.66Å; F79-I117 HydrophobicContact CE2-CG1 3.91Å; F79-I117 HydrophobicContact CZ-CD1 3.76Å; F79-I117 HydrophobicContact CZ-CG1 4.16Å; L89-I117 HydrophobicContact CD1-CG2 4.37Å; V109-I117 HydrophobicContact CG1-CD1 3.8Å; V109-I117 HydrophobicContact CG2-CD1 3.94Å; S113-I117 WeakPolarHBondContact O-CG1 3.49Å; S113-I117 PolarHBondContact O-N 2.95Å; S113-I117 VanDerWaalsContact O-N 3.13Å; W114-I117 HydrophobicContact CE3-CD1 4.19Å; W114-I117 PolarHBondContact O-N 3.25Å; I117-A121 VanDerWaalsContact O-CB 3.26Å; I117-A121 WeakPolarHBondContact O-CB 3.3Å; I117-A121 PolarHBondContact O-N 2.88Å; I117-F136 HydrophobicContact CG2-CD2 3.78Å; I117-F136 HydrophobicContact CG2-CE2 3.62Å; I117-F145 HydrophobicContact CD1-CD1 4.42Å; I117-F145 HydrophobicContact CD1-CE1 3.95Å; I117-F145 HydrophobicContact CG2-CZ 4.47Å
118	L	88.2	Confident	84.5	Confident	62 Å²	62	54.9 Å²	54.9	33%	0.325	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-46.5	-179.3	-175.5	61.8	0	0	0	111	W114 S115 W116 A121 T122 F136	W114-L118 WeakPolarHBondContact O-CB 3.05Å; W114-L118 PolarHBondContact O-N 2.91Å; S115-L118 PolarHBondContact O-N 3.46Å; W116-L118 VanDerWaalsContact C-N 3.3Å; W116-L118 PolarHBondContact O-N 2.92Å; L118-A121 CarbonylContact O-C 3.51Å; L118-A121 PolarHBondContact O-N 2.89Å; L118-T122 PolarHBondContact O-N 2.99Å; L118-T122 PolarHBondContact O-OG1 3.08Å; L118-T122 VanDerWaalsContact O-OG1 3.07Å; L118-F136 HydrophobicContact CD1-CE1 4.39Å; L118-F136 HydrophobicContact CD1-CZ 4.17Å
119	Q	87.4	Confident	84.9	Confident	91 Å²	91	52.3 Å²	52.3	43%	0.425	27%	0.273	S	S	.	.	H	α-helix	trans	-54.9	-55.9	175.3	176.2	177.2	-0.9	0	0	111.4	S115 A121 T122 E123	S115-Q119 WeakPolarHBondContact O-CB 3.2Å; S115-Q119 PolarHBondContact O-N 2.87Å; Q119-A121 PolarHBondContact O-N 3.11Å; Q119-T122 WeakPolarHBondContact CA-OG1 3.43Å; Q119-T122 PolarHBondContact O-N 3.41Å; Q119-T122 PolarHBondContact O-OG1 3.47Å; Q119-E123 VanDerWaalsContact CG-CD 3.47Å; Q119-E123 HydrophobicContact CG-CG 4.32Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.26Å; Q119-E123 PolarHBondContact NE2-OE1 3.48Å; Q119-E123 WeakPolarHBondContact O-CB 3.18Å; Q119-E123 WeakPolarHBondContact O-CG 3.14Å; Q119-E123 PolarHBondContact O-N 2.9Å
120	V	85.6	Confident	85.4	Confident	19 Å²	19	57.5 Å²	57.5	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-60.6	-34	178.6	172.5	0	0	0	0	111.5	I86 W116 A124	I86-V120 HydrophobicContact CG1-CG1 4.37Å; W116-V120 WeakPolarHBondContact O-CG2 3.28Å; W116-V120 PolarHBondContact O-N 3.24Å; V120-A124 WeakPolarHBondContact O-CB 3.41Å; V120-A124 PolarHBondContact O-N 3.47Å
121	A	87.4	Confident	85.9	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-73.9	-28.2	175.9	0	0	0	0	0	113.6	I117 L118 Q119 R125 Y133 F136	I117-A121 VanDerWaalsContact O-CB 3.26Å; I117-A121 WeakPolarHBondContact O-CB 3.3Å; I117-A121 PolarHBondContact O-N 2.88Å; L118-A121 CarbonylContact O-C 3.51Å; L118-A121 PolarHBondContact O-N 2.89Å; Q119-A121 PolarHBondContact O-N 3.11Å; A121-R125 WeakPolarHBondContact O-CB 3.44Å; A121-R125 PolarHBondContact O-N 3.11Å; A121-Y133 WeakPolarHBondContact O-CD2 3.29Å; A121-F136 HydrophobicContact CB-CB 3.94Å; A121-F136 HydrophobicContact CB-CD1 3.5Å; A121-F136 HydrophobicContact CB-CD2 3.98Å; A121-F136 HydrophobicContact CB-CE1 3.92Å; A121-F136 HydrophobicContact CB-CE2 4.37Å; A121-F136 HydrophobicContact CB-CG 3.53Å; A121-F136 HydrophobicContact CB-CZ 4.34Å
122	T	88.4	Confident	86.5	Confident	44 Å²	44	55 Å²	55	27%	0.27	28%	0.281	S	S	.	.	H	α-helix	trans	-79.3	-42.8	172.1	43.9	0	0	0	0	112.3	L118 Q119 R125 D126	L118-T122 PolarHBondContact O-N 2.99Å; L118-T122 PolarHBondContact O-OG1 3.08Å; L118-T122 VanDerWaalsContact O-OG1 3.07Å; Q119-T122 WeakPolarHBondContact CA-OG1 3.43Å; Q119-T122 PolarHBondContact O-N 3.41Å; Q119-T122 PolarHBondContact O-OG1 3.47Å; T122-R125 WeakPolarHBondContact O-CB 3.41Å; T122-R125 PolarHBondContact O-N 2.89Å; T122-R125 VanDerWaalsContact O-N 3.12Å; T122-D126 VanDerWaalsContact O-CG 3.3Å; T122-D126 PolarHBondContact O-N 2.93Å
123	E	88.2	Confident	87.1	Confident	84 Å²	84	53.1 Å²	53.1	39%	0.393	27%	0.272	S	S	.	.	H	α-helix	trans	-57.9	-53.4	174.8	-70.9	163.4	167.8	0	0	109.7	Q119 R125 D126 E127	Q119-E123 VanDerWaalsContact CG-CD 3.47Å; Q119-E123 HydrophobicContact CG-CG 4.32Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.26Å; Q119-E123 PolarHBondContact NE2-OE1 3.48Å; Q119-E123 WeakPolarHBondContact O-CB 3.18Å; Q119-E123 WeakPolarHBondContact O-CG 3.14Å; Q119-E123 PolarHBondContact O-N 2.9Å; E123-R125 PolarHBondContact O-N 3.18Å; E123-D126 PolarHBondContact O-N 3.31Å; E123-E127 WeakPolarHBondContact O-CB 3.29Å; E123-E127 WeakPolarHBondContact O-CG 3.47Å; E123-E127 PolarHBondContact O-N 2.82Å
124	A	86.4	Confident	87.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-24.6	176.9	0	0	0	0	0	113.8	I86 V120 H129 V132	I86-A124 HydrophobicContact CD1-CB 4.5Å; V120-A124 WeakPolarHBondContact O-CB 3.41Å; V120-A124 PolarHBondContact O-N 3.47Å; A124-H129 HydrophobicContact CB-CB 4.14Å; A124-H129 CarbonylContact O-C 3.55Å; A124-H129 VanDerWaalsContact O-CA 3.26Å; A124-H129 WeakPolarHBondContact O-CA 3.35Å; A124-H129 WeakPolarHBondContact O-CB 3.41Å; A124-H129 PolarHBondContact O-N 3.06Å; A124-V132 HydrophobicContact CB-CB 3.84Å; A124-V132 HydrophobicContact CB-CG1 3.65Å; A124-V132 HydrophobicContact CB-CG2 4.37Å
125	R	89.4	Confident	88	Confident	98 Å²	98	57.8 Å²	57.8	37%	0.37	29%	0.29	S	S	.	.	H	α-helix	trans	-70.2	-43.6	171.6	179.4	-160.9	70.7	-162.4	-6.2	110.7	A121 T122 E123 G128 Y133	A121-R125 WeakPolarHBondContact O-CB 3.44Å; A121-R125 PolarHBondContact O-N 3.11Å; T122-R125 WeakPolarHBondContact O-CB 3.41Å; T122-R125 PolarHBondContact O-N 2.89Å; T122-R125 VanDerWaalsContact O-N 3.12Å; E123-R125 PolarHBondContact O-N 3.18Å; R125-G128 PolarHBondContact O-N 2.74Å; R125-Y133 HydrophobicContact CB-CD2 3.93Å; R125-Y133 HydrophobicContact CB-CE2 4.42Å; R125-Y133 HydrophobicContact CB-CG 4.02Å; R125-Y133 HydrophobicContact CG-CD1 4.26Å; R125-Y133 HydrophobicContact CG-CD2 4.3Å; R125-Y133 HydrophobicContact CG-CE1 4.41Å; R125-Y133 HydrophobicContact CG-CE2 4.47Å; R125-Y133 HydrophobicContact CG-CG 4.2Å
126	D	89.9	Confident	88.4	Confident	113 Å²	113	55.7 Å²	55.7	60%	0.604	27%	0.274	S	S	*	.	H	α-helix	trans	-82.5	-28.3	-171.5	-63.9	-20.2	0	0	0	112.4	T122 E123 G128	T122-D126 VanDerWaalsContact O-CG 3.3Å; T122-D126 PolarHBondContact O-N 2.93Å; E123-D126 PolarHBondContact O-N 3.31Å; D126-G128 PolarHBondContact O-N 2.6Å
127	E	88	Confident	88.8	Confident	127 Å²	127	60 Å²	60	59%	0.593	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.7	164.3	-67.3	175.2	152.6	0	0	113.3	E123 H129	E123-E127 WeakPolarHBondContact O-CB 3.29Å; E123-E127 WeakPolarHBondContact O-CG 3.47Å; E123-E127 PolarHBondContact O-N 2.82Å; E127-H129 IonicContact OE2-CD2 2.65Å; E127-H129 PolarHBondContact OE2-CD2 2.94Å; E127-H129 IonicContact OE2-NE2 3.42Å
128	G	86.7	Confident	89.1	Confident	44 Å²	44	63.1 Å²	63.1	45%	0.454	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	13.2	179.7	0	0	0	0	0	115.3	R125 D126 L130	R125-G128 PolarHBondContact O-N 2.74Å; D126-G128 PolarHBondContact O-N 2.6Å; G128-L130 PolarHBondContact O-N 2.94Å
129	H	87.7	Confident	89.2	Confident	54 Å²	54	60.2 Å²	60.2	25%	0.25	29%	0.288	C	S	.	.			trans	-75.8	64.3	170.5	-60.1	-44.4	0	0	0	111.2	P44 A124 E127 D131 V132 Y133	P44-H129 VanDerWaalsContact CG-CE1 3.44Å; P44-H129 WeakPolarHBondContact CG-CE1 3.47Å; P44-H129 WeakPolarHBondContact CG-NE2 3.45Å; A124-H129 HydrophobicContact CB-CB 4.14Å; A124-H129 CarbonylContact O-C 3.55Å; A124-H129 VanDerWaalsContact O-CA 3.26Å; A124-H129 WeakPolarHBondContact O-CA 3.35Å; A124-H129 WeakPolarHBondContact O-CB 3.41Å; A124-H129 PolarHBondContact O-N 3.06Å; E127-H129 IonicContact OE2-CD2 2.65Å; E127-H129 PolarHBondContact OE2-CD2 2.94Å; E127-H129 IonicContact OE2-NE2 3.42Å; H129-D131 PolarHBondContact O-N 3.19Å; H129-D131 VanDerWaalsContact O-N 3.16Å; H129-V132 HydrophobicContact CB-CB 4.28Å; H129-V132 HydrophobicContact CB-CG2 3.76Å; H129-V132 VanDerWaalsContact O-CB 3.31Å; H129-V132 WeakPolarHBondContact O-CB 3.36Å; H129-V132 PolarHBondContact O-N 3.28Å; H129-V132 VanDerWaalsContact O-N 3.08Å; H129-Y133 PolarHBondContact O-N 3.36Å
130	L	89.3	Confident	89.3	Confident	111 Å²	111	57.2 Å²	57.2	58%	0.581	28%	0.277	S	S	*	.	H	α-helix	trans	-62.7	-21.6	-173.5	-62.2	179.6	0	0	0	114.2	G128 Y134	G128-L130 PolarHBondContact O-N 2.94Å; L130-Y134 WeakPolarHBondContact O-CB 3.5Å; L130-Y134 PolarHBondContact O-N 2.99Å
131	D	91.3	Very high	89.5	Confident	51 Å²	51	60.4 Å²	60.4	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-73.5	-38.8	173.5	54.3	-16.9	0	0	0	112.2	R45 F46 Y90 H129 Y134 V135	R45-D131 WeakPolarHBondContact CA-OD2 3.33Å; F46-D131 HydrophobicContact CB-CB 4.23Å; F46-D131 PolarHBondContact N-OD2 3.48Å; Y90-D131 VanDerWaalsContact OH-CG 3.27Å; Y90-D131 PolarHBondContact OH-OD1 3.22Å; Y90-D131 PolarHBondContact OH-OD2 2.82Å; H129-D131 PolarHBondContact O-N 3.19Å; H129-D131 VanDerWaalsContact O-N 3.16Å; D131-Y134 PolarHBondContact O-N 3.34Å; D131-V135 WeakPolarHBondContact O-CB 3.5Å; D131-V135 VanDerWaalsContact O-CG2 3.3Å; D131-V135 WeakPolarHBondContact O-CG2 3.24Å; D131-V135 PolarHBondContact O-N 3.37Å
132	V	89	Confident	89.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-51.4	168.5	-173.1	0	0	0	0	110.2	I86 L89 Y90 A124 H129 Y134 V135 F136	I86-V132 HydrophobicContact CD1-CG2 4.35Å; I86-V132 HydrophobicContact CG1-CG1 4.27Å; I86-V132 HydrophobicContact CG1-CG2 4.45Å; I86-V132 HydrophobicContact CG2-CB 4.43Å; I86-V132 HydrophobicContact CG2-CG1 4.01Å; I86-V132 HydrophobicContact CG2-CG2 3.48Å; I86-V132 VanDerWaalsContact CG2-CG2 3.48Å; L89-V132 HydrophobicContact CD2-CG1 3.59Å; L89-V132 VanDerWaalsContact CD2-O 3.29Å; L89-V132 WeakPolarHBondContact CD2-O 3.37Å; Y90-V132 HydrophobicContact CE1-CB 4.47Å; Y90-V132 HydrophobicContact CE1-CG2 4.09Å; Y90-V132 WeakPolarHBondContact OH-CG2 3.44Å; A124-V132 HydrophobicContact CB-CB 3.84Å; A124-V132 HydrophobicContact CB-CG1 3.65Å; A124-V132 HydrophobicContact CB-CG2 4.37Å; H129-V132 HydrophobicContact CB-CB 4.28Å; H129-V132 HydrophobicContact CB-CG2 3.76Å; H129-V132 VanDerWaalsContact O-CB 3.31Å; H129-V132 WeakPolarHBondContact O-CB 3.36Å; H129-V132 PolarHBondContact O-N 3.28Å; H129-V132 VanDerWaalsContact O-N 3.08Å; V132-Y134 PolarHBondContact O-N 3.33Å; V132-V135 WeakPolarHBondContact O-CB 3.34Å; V132-V135 PolarHBondContact O-N 3.37Å; V132-V135 VanDerWaalsContact O-N 3.13Å; V132-F136 PolarHBondContact O-N 3.23Å
133	Y	90.4	Very high	89.5	Confident	66 Å²	66	66.4 Å²	66.4	26%	0.259	34%	0.343	S	S	.	.	H	α-helix	trans	-64.9	-39	179.8	-176.3	-112.6	0	0	0	112.5	A121 R125 H129 V135 F136 R137	A121-Y133 WeakPolarHBondContact O-CD2 3.29Å; R125-Y133 HydrophobicContact CB-CD2 3.93Å; R125-Y133 HydrophobicContact CB-CE2 4.42Å; R125-Y133 HydrophobicContact CB-CG 4.02Å; R125-Y133 HydrophobicContact CG-CD1 4.26Å; R125-Y133 HydrophobicContact CG-CD2 4.3Å; R125-Y133 HydrophobicContact CG-CE1 4.41Å; R125-Y133 HydrophobicContact CG-CE2 4.47Å; R125-Y133 HydrophobicContact CG-CG 4.2Å; H129-Y133 PolarHBondContact O-N 3.36Å; Y133-V135 VanDerWaalsContact C-N 3.31Å; Y133-V135 PolarHBondContact O-N 2.79Å; Y133-F136 HydrophobicContact CD2-CD1 4.29Å; Y133-F136 HydrophobicContact CE2-CD1 4.2Å; Y133-F136 PolarHBondContact O-N 3.47Å; Y133-R137 HydrophobicContact CD1-CG 4.21Å; Y133-R137 HydrophobicContact CD2-CG 4.42Å; Y133-R137 HydrophobicContact CE1-CG 3.85Å; Y133-R137 HydrophobicContact CE2-CG 4.06Å; Y133-R137 HydrophobicContact CG-CG 4.49Å; Y133-R137 WeakPolarHBondContact O-CB 3.17Å; Y133-R137 VanDerWaalsContact O-CG 3.29Å; Y133-R137 WeakPolarHBondContact O-CG 3.3Å; Y133-R137 PolarHBondContact O-N 3.23Å
134	Y	92.2	Very high	89.4	Confident	118 Å²	118	62.4 Å²	62.4	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-58.6	-43.1	171.5	171.9	-92.6	0	0	0	111.5	L130 D131 V132 R137 K138	L130-Y134 WeakPolarHBondContact O-CB 3.5Å; L130-Y134 PolarHBondContact O-N 2.99Å; D131-Y134 PolarHBondContact O-N 3.34Å; V132-Y134 PolarHBondContact O-N 3.33Å; Y134-R137 PolarHBondContact O-N 3.4Å; Y134-K138 HydrophobicContact CE1-CD 3.63Å; Y134-K138 VanDerWaalsContact O-CB 3.23Å; Y134-K138 WeakPolarHBondContact O-CB 3.47Å; Y134-K138 PolarHBondContact O-N 3.26Å; Y134-K138 PolarHBondContact OH-NZ 2.97Å
135	V	91.6	Very high	89.4	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-43.8	176.8	167.7	0	0	0	0	111.7	F46 L89 Y90 Y93 D131 V132 Y133 K138 L139	F46-V135 HydrophobicContact CD2-CG2 4.48Å; L89-V135 HydrophobicContact CD2-CB 4.49Å; L89-V135 HydrophobicContact CD2-CG1 4.27Å; L89-V135 HydrophobicContact CG-CG1 4.11Å; Y90-V135 HydrophobicContact CD1-CB 4.32Å; Y90-V135 HydrophobicContact CD1-CG1 4.25Å; Y90-V135 HydrophobicContact CD1-CG2 4.09Å; Y90-V135 HydrophobicContact CE1-CB 4.43Å; Y90-V135 HydrophobicContact CE1-CG2 4.09Å; Y93-V135 HydrophobicContact CD1-CG1 3.86Å; Y93-V135 HydrophobicContact CD1-CG2 3.86Å; Y93-V135 HydrophobicContact CD2-CG1 4.17Å; Y93-V135 HydrophobicContact CE1-CG2 4Å; Y93-V135 HydrophobicContact CG-CG1 3.56Å; Y93-V135 HydrophobicContact CG-CG2 4.31Å; D131-V135 WeakPolarHBondContact O-CB 3.5Å; D131-V135 VanDerWaalsContact O-CG2 3.3Å; D131-V135 WeakPolarHBondContact O-CG2 3.24Å; D131-V135 PolarHBondContact O-N 3.37Å; V132-V135 WeakPolarHBondContact O-CB 3.34Å; V132-V135 PolarHBondContact O-N 3.37Å; V132-V135 VanDerWaalsContact O-N 3.13Å; Y133-V135 VanDerWaalsContact C-N 3.31Å; Y133-V135 PolarHBondContact O-N 2.79Å; V135-K138 PolarHBondContact O-N 2.93Å; V135-L139 HydrophobicContact CG1-CD1 4.37Å; V135-L139 PolarHBondContact O-N 2.89Å
136	F	90.8	Very high	89.1	Confident	13 Å²	13	61.9 Å²	61.9	6%	0.057	33%	0.327	C	S	.	.	H	α-helix	trans	-58	-51.4	173.5	170.3	-114.4	0	0	0	111.7	L89 W114 I117 L118 A121 V132 Y133 K138 L139 C140 F145	L89-F136 HydrophobicContact CD1-CB 4.27Å; L89-F136 HydrophobicContact CD1-CD2 4.34Å; L89-F136 HydrophobicContact CD2-CB 3.83Å; W114-F136 AromaticContact CH2-CE2 3.82Å; W114-F136 HydrophobicContact CH2-CE2 3.82Å; W114-F136 AromaticContact CH2-CZ 3.94Å; W114-F136 HydrophobicContact CH2-CZ 3.94Å; W114-F136 HydrophobicContact CZ2-CZ 4.26Å; W114-F136 HydrophobicContact CZ3-CE2 4.18Å; I117-F136 HydrophobicContact CG2-CD2 3.78Å; I117-F136 HydrophobicContact CG2-CE2 3.62Å; L118-F136 HydrophobicContact CD1-CE1 4.39Å; L118-F136 HydrophobicContact CD1-CZ 4.17Å; A121-F136 HydrophobicContact CB-CB 3.94Å; A121-F136 HydrophobicContact CB-CD1 3.5Å; A121-F136 HydrophobicContact CB-CD2 3.98Å; A121-F136 HydrophobicContact CB-CE1 3.92Å; A121-F136 HydrophobicContact CB-CE2 4.37Å; A121-F136 HydrophobicContact CB-CG 3.53Å; A121-F136 HydrophobicContact CB-CZ 4.34Å; V132-F136 PolarHBondContact O-N 3.23Å; Y133-F136 HydrophobicContact CD2-CD1 4.29Å; Y133-F136 HydrophobicContact CE2-CD1 4.2Å; Y133-F136 PolarHBondContact O-N 3.47Å; F136-K138 PolarHBondContact O-N 2.74Å; F136-L139 PolarHBondContact O-N 3.42Å; F136-C140 VanDerWaalsContact CE2-SG 3.57Å; F136-C140 PolarHBondContact O-N 3.03Å; F136-C140 PolarHBondContact O-SG 3.21Å; F136-F145 HydrophobicContact CE2-CE2 4.42Å
137	R	91.8	Very high	88.7	Confident	145 Å²	145	59.2 Å²	59.2	55%	0.547	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-33.9	178.6	-69.4	-66.6	-63.4	-169.9	0.2	112.1	Y133 Y134 A141	Y133-R137 HydrophobicContact CD1-CG 4.21Å; Y133-R137 HydrophobicContact CD2-CG 4.42Å; Y133-R137 HydrophobicContact CE1-CG 3.85Å; Y133-R137 HydrophobicContact CE2-CG 4.06Å; Y133-R137 HydrophobicContact CG-CG 4.49Å; Y133-R137 WeakPolarHBondContact O-CB 3.17Å; Y133-R137 VanDerWaalsContact O-CG 3.29Å; Y133-R137 WeakPolarHBondContact O-CG 3.3Å; Y133-R137 PolarHBondContact O-N 3.23Å; Y134-R137 PolarHBondContact O-N 3.4Å; R137-A141 WeakPolarHBondContact O-CB 3.48Å; R137-A141 PolarHBondContact O-N 3.17Å
138	K	91.6	Very high	88.1	Confident	79 Å²	79	54.5 Å²	54.5	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-76.7	-34.4	178.3	-166.9	165.5	-176.5	178.3	0	113.5	Y93 Y134 V135 F136 A142	Y93-K138 HydrophobicContact CE2-CB 4.45Å; Y93-K138 HydrophobicContact CE2-CD 3.71Å; Y93-K138 HydrophobicContact CE2-CG 4Å; Y93-K138 WeakPolarHBondContact OH-CE 3.3Å; Y93-K138 PolarHBondContact OH-NZ 2.93Å; Y134-K138 HydrophobicContact CE1-CD 3.63Å; Y134-K138 VanDerWaalsContact O-CB 3.23Å; Y134-K138 WeakPolarHBondContact O-CB 3.47Å; Y134-K138 PolarHBondContact O-N 3.26Å; Y134-K138 PolarHBondContact OH-NZ 2.97Å; V135-K138 PolarHBondContact O-N 2.93Å; F136-K138 PolarHBondContact O-N 2.74Å; K138-A142 VanDerWaalsContact O-CB 3.3Å; K138-A142 WeakPolarHBondContact O-CB 3.45Å; K138-A142 PolarHBondContact O-N 2.89Å
139	L	90.8	Very high	87.2	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-44.7	167.7	-80.5	167.8	0	0	0	110.9	L89 L92 Y93 H96 I107 V135 F136 A142 N143 A144 F145	L89-L139 HydrophobicContact CD1-CD1 3.82Å; L89-L139 HydrophobicContact CG-CD1 4.32Å; L92-L139 HydrophobicContact CB-CD1 4.12Å; Y93-L139 HydrophobicContact CD2-CG 4.44Å; H96-L139 HydrophobicContact CB-CD2 4.16Å; I107-L139 HydrophobicContact CD1-CD2 3.98Å; V135-L139 HydrophobicContact CG1-CD1 4.37Å; V135-L139 PolarHBondContact O-N 2.89Å; F136-L139 PolarHBondContact O-N 3.42Å; L139-A142 PolarHBondContact O-N 2.9Å; L139-N143 PolarHBondContact O-N 2.7Å; L139-A144 HydrophobicContact CB-CB 4.12Å; L139-A144 HydrophobicContact CD2-CB 3.54Å; L139-A144 HydrophobicContact CG-CB 4.48Å; L139-A144 WeakPolarHBondContact O-CB 3.39Å; L139-A144 PolarHBondContact O-N 3.04Å; L139-F145 HydrophobicContact CB-CE2 3.67Å; L139-F145 HydrophobicContact CB-CZ 3.77Å; L139-F145 HydrophobicContact CD1-CZ 4.01Å; L139-F145 HydrophobicContact CG-CZ 4.42Å
140	C	90	Very high	85.8	Confident	29 Å²	29	59.8 Å²	59.8	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-50.6	174.7	-61.9	0	0	0	0	111.8	F136 A142 N143	F136-C140 VanDerWaalsContact CE2-SG 3.57Å; F136-C140 PolarHBondContact O-N 3.03Å; F136-C140 PolarHBondContact O-SG 3.21Å; C140-A142 PolarHBondContact O-N 3.03Å; C140-N143 PolarHBondContact O-N 2.97Å
141	A	89.7	Confident	84.4	Confident	85 Å²	85	58 Å²	58	70%	0.702	31%	0.306	S	S	*	.	H	α-helix	trans	-64	-24.8	179.7	0	0	0	0	0	113.8	R137 N143	R137-A141 WeakPolarHBondContact O-CB 3.48Å; R137-A141 PolarHBondContact O-N 3.17Å; A141-N143 VanDerWaalsContact C-N 3.26Å
142	A	87	Confident	82.6	Confident	54 Å²	54	60 Å²	60	45%	0.446	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	5	173.1	0	0	0	0	0	113.7	K138 L139 C140 A144	K138-A142 VanDerWaalsContact O-CB 3.3Å; K138-A142 WeakPolarHBondContact O-CB 3.45Å; K138-A142 PolarHBondContact O-N 2.89Å; L139-A142 PolarHBondContact O-N 2.9Å; C140-A142 PolarHBondContact O-N 3.03Å; A142-A144 PolarHBondContact O-N 3.06Å
143	N	87.1	Confident	80.6	Confident	119 Å²	119	62.7 Å²	62.7	64%	0.636	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	38.5	-170.2	-66.8	-34.3	0	0	0	112.6	H106 L139 C140 A141 F145	H106-N143 PolarHBondContact CE1-O 3.39Å; H106-N143 PolarHBondContact ND1-O 3.31Å; L139-N143 PolarHBondContact O-N 2.7Å; C140-N143 PolarHBondContact O-N 2.97Å; A141-N143 VanDerWaalsContact C-N 3.26Å; N143-F145 PolarHBondContact O-N 3.34Å
144	A	87.2	Confident	78.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.334	C	S	.	.			trans	-67.6	-20.1	-172.5	0	0	0	0	0	113.7	H96 H106 I107 L139 A142	H96-A144 VanDerWaalsContact CE1-CB 3.44Å; H96-A144 WeakPolarHBondContact CE1-CB 3.27Å; H106-A144 CarbonylContact C-O 3.38Å; H106-A144 WeakPolarHBondContact CA-O 3.36Å; I107-A144 HydrophobicContact CD1-CB 4.08Å; I107-A144 PolarHBondContact N-O 3.08Å; L139-A144 HydrophobicContact CB-CB 4.12Å; L139-A144 HydrophobicContact CD2-CB 3.54Å; L139-A144 HydrophobicContact CG-CB 4.48Å; L139-A144 WeakPolarHBondContact O-CB 3.39Å; L139-A144 PolarHBondContact O-N 3.04Å; A142-A144 PolarHBondContact O-N 3.06Å
145	F	86.8	Confident	76.5	Confident	19 Å²	19	58.4 Å²	58.4	8%	0.083	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.3	-174.4	-56	-69	0	0	0	112.3	I107 V109 W114 I117 F136 L139 N143 F147	I107-F145 HydrophobicContact CB-CD1 3.93Å; I107-F145 HydrophobicContact CB-CE1 4.35Å; I107-F145 HydrophobicContact CD1-CD1 4.07Å; I107-F145 HydrophobicContact CD1-CE1 3.8Å; I107-F145 HydrophobicContact CG2-CD1 4.09Å; I107-F145 HydrophobicContact CG2-CE1 4.29Å; I107-F145 CarbonylContact O-C 3.56Å; I107-F145 WeakPolarHBondContact O-CA 3.42Å; V109-F145 HydrophobicContact CG2-CB 4.28Å; V109-F145 HydrophobicContact CG2-CD1 3.61Å; V109-F145 HydrophobicContact CG2-CE1 4.39Å; V109-F145 HydrophobicContact CG2-CG 4.33Å; W114-F145 HydrophobicContact CH2-CD2 4.1Å; W114-F145 HydrophobicContact CH2-CE2 4.31Å; W114-F145 HydrophobicContact CZ3-CB 4.38Å; W114-F145 HydrophobicContact CZ3-CD1 4.35Å; W114-F145 AromaticContact CZ3-CD2 3.6Å; W114-F145 HydrophobicContact CZ3-CD2 3.6Å; W114-F145 AromaticContact CZ3-CE2 3.86Å; W114-F145 HydrophobicContact CZ3-CE2 3.86Å; W114-F145 AromaticContact CZ3-CG 3.86Å; W114-F145 HydrophobicContact CZ3-CG 3.86Å; W114-F145 HydrophobicContact CZ3-CZ 4.33Å; I117-F145 HydrophobicContact CD1-CD1 4.42Å; I117-F145 HydrophobicContact CD1-CE1 3.95Å; I117-F145 HydrophobicContact CG2-CZ 4.47Å; F136-F145 HydrophobicContact CE2-CE2 4.42Å; L139-F145 HydrophobicContact CB-CE2 3.67Å; L139-F145 HydrophobicContact CB-CZ 3.77Å; L139-F145 HydrophobicContact CD1-CZ 4.01Å; L139-F145 HydrophobicContact CG-CZ 4.42Å; N143-F145 PolarHBondContact O-N 3.34Å; F145-F147 HydrophobicContact CB-CE2 4.32Å
146	L	82.8	Confident	74.1	Confident	69 Å²	69	64.5 Å²	64.5	36%	0.361	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	106.5	173.6	176.3	61.6	0	0	0	109.5	H106 I107 R108 V109 C148	H106-L146 HydrophobicContact CB-CB 3.64Å; I107-L146 PolarHBondContact O-N 3.45Å; R108-L146 WeakPolarHBondContact CA-O 3.32Å; R108-L146 HydrophobicContact CG-CD2 4.3Å; V109-L146 PolarHBondContact N-O 3.18Å; L146-C148 PolarHBondContact O-N 2.79Å; L146-C148 PolarHBondContact O-SG 3.22Å
147	F	82.1	Confident	71.6	Confident	57 Å²	57	67.4 Å²	67.4	25%	0.25	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	123.3	-178.2	-66.9	-90.3	0	0	0	111.4	V109 W114 F145 P268	V109-F147 WeakPolarHBondContact O-CA 3.43Å; W114-F147 HydrophobicContact CB-CE1 4.42Å; W114-F147 AromaticContact CD2-CE1 3.57Å; W114-F147 HydrophobicContact CD2-CE1 3.57Å; W114-F147 AromaticContact CD2-CZ 3.92Å; W114-F147 HydrophobicContact CD2-CZ 3.92Å; W114-F147 AromaticContact CE2-CE1 3.87Å; W114-F147 AromaticContact CE2-CZ 3.94Å; W114-F147 AromaticContact CE3-CE1 3.89Å; W114-F147 HydrophobicContact CE3-CE1 3.89Å; W114-F147 AromaticContact CE3-CZ 3.95Å; W114-F147 HydrophobicContact CE3-CZ 3.95Å; W114-F147 AromaticContact CG-CE1 3.8Å; W114-F147 HydrophobicContact CG-CE1 3.8Å; W114-F147 HydrophobicContact CH2-CZ 4.07Å; W114-F147 HydrophobicContact CZ2-CE1 4.42Å; W114-F147 HydrophobicContact CZ2-CZ 4.03Å; W114-F147 HydrophobicContact CZ3-CE1 4.44Å; W114-F147 HydrophobicContact CZ3-CZ 4.04Å; F145-F147 HydrophobicContact CB-CE2 4.32Å; F147-P268 VanDerWaalsContact CE2-O 3.28Å; F147-P268 WeakPolarHBondContact CE2-O 3.05Å; F147-P268 WeakPolarHBondContact CZ-O 3.15Å
148	C	75	Confident	69.4	Low	28 Å²	28	61.1 Å²	61.1	19%	0.189	37%	0.37	C	S	.	.			trans	-121.5	114.3	-175.1	-66.4	0	0	0	0	109.8	V109 C110 L146 M150	V109-C148 PolarHBondContact O-N 2.93Å; C110-C148 WeakPolarHBondContact CA-O 3.41Å; C110-C148 WeakPolarHBondContact CB-O 3.13Å; L146-C148 PolarHBondContact O-N 2.79Å; L146-C148 PolarHBondContact O-SG 3.22Å; C148-M150 VanDerWaalsContact C-N 3.28Å; C148-M150 PolarHBondContact O-N 3.43Å
149	A	67.1	Low	67	Low	87 Å²	87	59.5 Å²	59.5	72%	0.719	37%	0.367	S	S	*	.	S	Bend	trans	-63	-32.5	-179.4	0	0	0	0	0	113.5
150	M	58.6	Low	64.7	Low	122 Å²	122	64.5 Å²	64.5	60%	0.601	39%	0.393	S	S	*	.	S	Bend	trans	-120	146.3	174.7	-71.2	-176.6	71.8	0	0	111.4	C148 C200	C148-M150 VanDerWaalsContact C-N 3.28Å; C148-M150 PolarHBondContact O-N 3.43Å; M150-C200 HydrophobicContact CE-CB 3.94Å; M150-C200 HydrophobicContact SD-CB 4.37Å
151	R	59.6	Low	62.6	Low	72 Å²	72	64 Å²	64	27%	0.272	39%	0.388	S	S	.	.			trans	-72.2	137.2	172.7	-60.5	170.3	174.2	-74.7	19.9	109.4	C110 S113 F161 D162	C110-R151 HydrophobicContact CB-CG 4.28Å; C110-R151 PolarHBondContact SG-NH1 2.81Å; S113-R151 PolarHBondContact OG-NH1 2.62Å; R151-F161 VanDerWaalsContact CB-O 3.28Å; R151-F161 WeakPolarHBondContact CB-O 3.5Å; R151-F161 WeakPolarHBondContact CD-O 3.33Å; R151-F161 WeakPolarHBondContact CG-O 3.45Å; R151-F161 VanDerWaalsContact NH1-C 3.33Å; R151-F161 PolarHBondContact NH1-O 3.22Å; R151-D162 IonicContact CZ-OD1 3.98Å; R151-D162 IonicContact CZ-OD2 3.45Å; R151-D162 VanDerWaalsContact CZ-OD2 3.31Å; R151-D162 IonicContact NH1-OD1 3.91Å; R151-D162 PolarHBondContact NH1-OD1 2.97Å; R151-D162 IonicContact NH1-OD2 2.59Å; R151-D162 PolarHBondContact NH1-OD2 2.95Å; R151-D162 PolarHBondContact NH2-O 3.46Å; R151-D162 IonicContact NH2-OD1 3.61Å; R151-D162 IonicContact NH2-OD2 3.31Å; R151-D162 PolarHBondContact NH2-OD2 3.32Å
152	Q	53.1	Low	59.9	Low	94 Å²	94	61 Å²	61	44%	0.439	36%	0.36	S	S	.	.			trans	-115.5	129.8	178.4	-69.9	-170.4	-17.5	0	0	110.7	L154	Q152-L154 PolarHBondContact O-N 3.48Å
153	V	47.2	Very low	57.1	Low	57 Å²	57	61.7 Å²	61.7	35%	0.345	36%	0.362	S	S	.	.			trans	-66.5	118.4	170.8	179.3	0	0	0	0	108.6	Y155 A158 L160	V153-Y155 WeakPolarHBondContact CG1-O 3.42Å; V153-A158 HydrophobicContact CG1-CB 4.39Å; V153-L160 HydrophobicContact CG2-CD2 3.39Å; V153-L160 HydrophobicContact CG2-CG 3.8Å
154	L	47.1	Very low	54.2	Low	63 Å²	63	59.7 Å²	59.7	33%	0.33	36%	0.355	S	S	.	.	S	Bend	trans	-68.4	-38.9	175.8	-68.6	177.7	0	0	0	112.5	Q152 F161	Q152-L154 PolarHBondContact O-N 3.48Å; L154-F161 HydrophobicContact CB-CE2 3.72Å; L154-F161 HydrophobicContact CB-CZ 4.15Å; L154-F161 HydrophobicContact CD1-CE1 4.4Å; L154-F161 HydrophobicContact CD1-CE2 4.05Å; L154-F161 HydrophobicContact CD1-CZ 3.87Å; L154-F161 HydrophobicContact CG-CD2 4.29Å; L154-F161 HydrophobicContact CG-CE2 3.78Å; L154-F161 HydrophobicContact CG-CZ 4.13Å
155	Y	49.9	Very low	51.5	Low	30 Å²	30	63.3 Å²	63.3	12%	0.118	39%	0.385	C	S	.	.	S	Bend	trans	-148.6	144.9	178.2	50.6	-84.7	0	0	0	111.4	Y16 Q18 V153 G157 A158 F161	Y16-Y155 PolarHBondContact O-OH 3.03Å; Q18-Y155 HydrophobicContact CB-CE2 4.26Å; Q18-Y155 WeakPolarHBondContact O-CD1 3.29Å; V153-Y155 WeakPolarHBondContact CG1-O 3.42Å; Y155-G157 PolarHBondContact O-N 2.91Å; Y155-A158 HydrophobicContact CD1-CB 3.95Å; Y155-A158 HydrophobicContact CD2-CB 3.68Å; Y155-A158 HydrophobicContact CE1-CB 3.8Å; Y155-A158 HydrophobicContact CE2-CB 3.55Å; Y155-A158 HydrophobicContact CG-CB 3.88Å; Y155-A158 WeakPolarHBondContact O-CB 3.27Å; Y155-A158 PolarHBondContact O-N 3.21Å; Y155-F161 HydrophobicContact CE1-CZ 4.29Å
156	P	40.5	Very low	48.7	Very low	132 Å²	132	68.1 Å²	68.1	86%	0.857	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	127.2	173.5	-23	33.9	0	0	0	110.8
157	G	38.9	Very low	46.2	Very low	74 Å²	74	70.4 Å²	70.4	76%	0.763	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.6	-13.5	-172.7	0	0	0	0	0	114.4	Y155	Y155-G157 PolarHBondContact O-N 2.91Å
158	A	44.5	Very low	43.8	Very low	13 Å²	13	76.3 Å²	76.3	11%	0.107	46%	0.457	C	S	.	.	S	Bend	trans	-64.2	142.1	161.2	0	0	0	0	0	109.9	V153 Y155 F161	V153-A158 HydrophobicContact CG1-CB 4.39Å; Y155-A158 HydrophobicContact CD1-CB 3.95Å; Y155-A158 HydrophobicContact CD2-CB 3.68Å; Y155-A158 HydrophobicContact CE1-CB 3.8Å; Y155-A158 HydrophobicContact CE2-CB 3.55Å; Y155-A158 HydrophobicContact CG-CB 3.88Å; Y155-A158 WeakPolarHBondContact O-CB 3.27Å; Y155-A158 PolarHBondContact O-N 3.21Å; A158-F161 HydrophobicContact CB-CE2 3.46Å; A158-F161 VanDerWaalsContact CB-CE2 3.46Å; A158-F161 HydrophobicContact CB-CZ 3.68Å
159	P	42.2	Very low	41.8	Very low	44 Å²	44	80.6 Å²	80.6	29%	0.286	48%	0.478	S	S	.	.			trans	-58.8	150	165.6	26.6	-33.4	0	0	0	110.1	Y15 F161	Y15-P159 HydrophobicContact CD1-CG 4.28Å; Y15-P159 HydrophobicContact CE1-CB 4.4Å; Y15-P159 HydrophobicContact CE1-CG 4.07Å; P159-F161 VanDerWaalsContact C-N 3.31Å; P159-F161 VanDerWaalsContact O-CD2 3.31Å; P159-F161 WeakPolarHBondContact O-CD2 3.43Å; P159-F161 PolarHBondContact O-N 2.8Å
160	L	42.9	Very low	40.2	Very low	106 Å²	106	83.8 Å²	83.8	56%	0.555	48%	0.483	S	S	*	.			trans	-67	91.9	173.9	-97	161.3	0	0	0	109.7	V153 D162 S163	V153-L160 HydrophobicContact CG2-CD2 3.39Å; V153-L160 HydrophobicContact CG2-CG 3.8Å; L160-D162 CarbonylContact O-C 3.58Å; L160-D162 WeakPolarHBondContact O-CA 3.39Å; L160-D162 PolarHBondContact O-N 2.77Å; L160-S163 PolarHBondContact O-N 2.86Å
161	F	46.1	Very low	38.9	Very low	19 Å²	19	87.7 Å²	87.7	8%	0.083	50%	0.497	C	S	.	.	S	Bend	trans	-42.4	91	176.5	-62.9	-77.6	0	0	0	113	H80 R151 L154 Y155 A158 P159	H80-F161 HydrophobicContact CB-CD1 3.97Å; H80-F161 HydrophobicContact CB-CE1 4.35Å; H80-F161 AromaticContact CD2-CD1 3.53Å; H80-F161 AromaticContact CG-CD1 3.54Å; R151-F161 VanDerWaalsContact CB-O 3.28Å; R151-F161 WeakPolarHBondContact CB-O 3.5Å; R151-F161 WeakPolarHBondContact CD-O 3.33Å; R151-F161 WeakPolarHBondContact CG-O 3.45Å; R151-F161 VanDerWaalsContact NH1-C 3.33Å; R151-F161 PolarHBondContact NH1-O 3.22Å; L154-F161 HydrophobicContact CB-CE2 3.72Å; L154-F161 HydrophobicContact CB-CZ 4.15Å; L154-F161 HydrophobicContact CD1-CE1 4.4Å; L154-F161 HydrophobicContact CD1-CE2 4.05Å; L154-F161 HydrophobicContact CD1-CZ 3.87Å; L154-F161 HydrophobicContact CG-CD2 4.29Å; L154-F161 HydrophobicContact CG-CE2 3.78Å; L154-F161 HydrophobicContact CG-CZ 4.13Å; Y155-F161 HydrophobicContact CE1-CZ 4.29Å; A158-F161 HydrophobicContact CB-CE2 3.46Å; A158-F161 VanDerWaalsContact CB-CE2 3.46Å; A158-F161 HydrophobicContact CB-CZ 3.68Å; P159-F161 VanDerWaalsContact C-N 3.31Å; P159-F161 VanDerWaalsContact O-CD2 3.31Å; P159-F161 WeakPolarHBondContact O-CD2 3.43Å; P159-F161 PolarHBondContact O-N 2.8Å
162	D	33.2	Very low	37.6	Very low	22 Å²	22	89.7 Å²	89.7	12%	0.118	52%	0.517	C	S	.	.	S	Bend	cis	-133.2	146.8	8.8	44.2	-99.4	0	0	0	111.1	H80 L83 S113 W116 R151 L160	H80-D162 IonicContact CE1-OD1 3.84Å; H80-D162 PolarHBondContact CE1-OD1 2.92Å; H80-D162 IonicContact ND1-OD1 3.96Å; L83-D162 HydrophobicContact CD1-CB 4.25Å; S113-D162 PolarHBondContact OG-OD1 3.24Å; W116-D162 VanDerWaalsContact CH2-OD2 3.28Å; W116-D162 WeakPolarHBondContact CH2-OD2 3.46Å; W116-D162 WeakPolarHBondContact CZ3-OD2 3.37Å; R151-D162 IonicContact CZ-OD1 3.98Å; R151-D162 IonicContact CZ-OD2 3.45Å; R151-D162 VanDerWaalsContact CZ-OD2 3.31Å; R151-D162 IonicContact NH1-OD1 3.91Å; R151-D162 PolarHBondContact NH1-OD1 2.97Å; R151-D162 IonicContact NH1-OD2 2.59Å; R151-D162 PolarHBondContact NH1-OD2 2.95Å; R151-D162 PolarHBondContact NH2-O 3.46Å; R151-D162 IonicContact NH2-OD1 3.61Å; R151-D162 IonicContact NH2-OD2 3.31Å; R151-D162 PolarHBondContact NH2-OD2 3.32Å; L160-D162 CarbonylContact O-C 3.58Å; L160-D162 WeakPolarHBondContact O-CA 3.39Å; L160-D162 PolarHBondContact O-N 2.77Å
163	S	26.4	Very low	36.6	Very low	69 Å²	69	94 Å²	94	48%	0.483	54%	0.537	S	S	.	.			trans	-143.4	78	174	179.9	0	0	0	0	110.3	L160 A165	L160-S163 PolarHBondContact O-N 2.86Å; S163-A165 PolarHBondContact O-N 3.38Å
164	P	27.5	Very low	35.8	Very low	76 Å²	76	97.6 Å²	97.6	49%	0.494	56%	0.555	S	S	.	*	S	Bend	trans	-58.1	129.9	149	29.7	-32.7	0	0	0	107.2
165	A	29.8	Very low	35.4	Very low	77 Å²	77	103 Å²	103	64%	0.636	58%	0.578	S	S	*	*			trans	15.2	108.8	-179.9	0	0	0	0	0	117.4	S163 N167	S163-A165 PolarHBondContact O-N 3.38Å; A165-N167 PolarHBondContact O-N 3Å
166	V	29.4	Very low	34.8	Very low	120 Å²	120	106.1 Å²	106.1	73%	0.727	61%	0.61	S	S	*	*			trans	-70.4	107.7	142.7	173.1	0	0	0	0	105.4
167	N	29.1	Very low	34.6	Very low	117 Å²	117	104 Å²	104	63%	0.626	60%	0.603	S	S	*	*			trans	-54.6	137.3	170.2	-63.4	-3.1	0	0	0	108.4	A165 D169	A165-N167 PolarHBondContact O-N 3Å; N167-D169 PolarHBondContact O-N 3.36Å
168	Q	32.7	Very low	34.4	Very low	181 Å²	181	108.7 Å²	108.7	85%	0.846	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-0.2	-171.3	-69.4	-170.9	-8.4	0	0	113.4
169	D	32.5	Very low	34	Very low	117 Å²	117	113.3 Å²	113.3	63%	0.626	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-7.2	-158.2	-43.8	-65.2	0	0	0	114.3	N167 F171 T172	N167-D169 PolarHBondContact O-N 3.36Å; D169-F171 PolarHBondContact O-N 2.81Å; D169-T172 PolarHBondContact O-OG1 3.24Å
170	D	32.6	Very low	33.6	Very low	155 Å²	155	118.6 Å²	118.6	83%	0.829	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	17.5	-176	-133.4	21.8	0	0	0	113.5
171	F	32.4	Very low	33.6	Very low	204 Å²	204	122.2 Å²	122.2	90%	0.895	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	47.6	173.4	-80.6	-74.1	0	0	0	111.6	D169	D169-F171 PolarHBondContact O-N 2.81Å
172	T	31.2	Very low	32.9	Very low	114 Å²	114	124.5 Å²	124.5	70%	0.699	71%	0.707	S	S	*	*			trans	-115.3	85.4	174.2	-30.9	0	0	0	0	110.9	D169	D169-T172 PolarHBondContact O-OG1 3.24Å
173	E	32.3	Very low	32.9	Very low	183 Å²	183	132.5 Å²	132.5	86%	0.855	75%	0.749	S	S	*	*			trans	-171	139.7	149.6	-108.1	160.7	-154.6	0	0	110.2
174	D	31.7	Very low	33.6	Very low	134 Å²	134	133.5 Å²	133.5	72%	0.717	76%	0.756	S	S	*	*			trans	47.5	118.5	162.4	-73.6	1.6	0	0	0	120
175	H	38.2	Very low	34.2	Very low	177 Å²	177	135.2 Å²	135.2	82%	0.819	76%	0.761	S	S	*	*			cis	-150.1	170.1	40.2	-77.2	-62.5	0	0	0	114.8
176	A	36.6	Very low	34.6	Very low	95 Å²	95	137.1 Å²	137.1	79%	0.785	77%	0.765	S	S	*	*			trans	-83.2	146.2	-164.9	0	0	0	0	0	117.5
177	A	36.6	Very low	34.8	Very low	87 Å²	87	136 Å²	136	72%	0.719	76%	0.762	S	S	*	*			trans	43.5	114.3	137	0	0	0	0	0	121.3
178	L	35.2	Very low	35.1	Very low	173 Å²	173	137.6 Å²	137.6	91%	0.906	76%	0.764	S	S	*	*				-174.4	163.5	100.6	-90.7	164.3	0	0	0	110
179	P	35.3	Very low	35.2	Very low	109 Å²	109	132 Å²	132	71%	0.708	75%	0.748	S	S	*	*			trans	-117.1	165.9	-155.8	42.8	-36.1	0	0	0	117.9
180	D	35.2	Very low	35.2	Very low	155 Å²	155	131.3 Å²	131.3	83%	0.829	75%	0.748	S	S	*	*			trans	72.4	169.1	151.5	-130.1	-24.9	0	0	0	120.7
181	E	41	Very low	35.1	Very low	182 Å²	182	130.6 Å²	130.6	85%	0.85	74%	0.738	S	S	*	*			trans	68	112.8	-177.7	-66.1	-70.3	158.3	0	0	116.6
182	G	32.7	Very low	35.2	Very low	67 Å²	67	123.5 Å²	123.5	69%	0.691	71%	0.714	S	S	*	*			trans	138.1	64.4	162.1	0	0	0	0	0	118.9	S184	G182-S184 PolarHBondContact O-N 2.98Å
183	L	33.2	Very low	35.2	Very low	190 Å²	190	124.7 Å²	124.7	100%	0.995	71%	0.711	S	S	*	*			trans	-74.5	85.9	172.3	-95	167.3	0	0	0	113.1
184	S	39.9	Very low	35.2	Very low	90 Å²	90	125.6 Å²	125.6	63%	0.629	71%	0.707	S	S	*	*	S	Bend	trans	-151.4	120	167.4	64	0	0	0	0	115.8	G182 V186	G182-S184 PolarHBondContact O-N 2.98Å; S184-V186 VanDerWaalsContact C-N 3.3Å; S184-V186 PolarHBondContact O-N 3.46Å
185	D	40	Very low	35.2	Very low	113 Å²	113	127.2 Å²	127.2	60%	0.604	70%	0.703	S	S	*	*	S	Bend	trans	49.6	-13.6	156.5	-89.4	-45.6	0	0	0	123.6	S187 K188	D185-S187 PolarHBondContact O-N 2.65Å; D185-K188 PolarHBondContact O-N 2.94Å; D185-K188 WeakPolarHBondContact OD1-CD 3.46Å; D185-K188 WeakPolarHBondContact OD1-CE 3.42Å; D185-K188 IonicContact OD1-NZ 2.67Å; D185-K188 PolarHBondContact OD1-NZ 3.33Å
186	V	39.1	Very low	34.9	Very low	117 Å²	117	123.1 Å²	123.1	71%	0.709	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-60.3	-32.4	-178.9	180	0	0	0	0	112.5	S184 K188 A189	S184-V186 VanDerWaalsContact C-N 3.3Å; S184-V186 PolarHBondContact O-N 3.46Å; V186-K188 PolarHBondContact O-N 3.44Å; V186-A189 WeakPolarHBondContact O-CB 3.31Å; V186-A189 PolarHBondContact O-N 3.03Å
187	S	34.2	Very low	34.7	Very low	95 Å²	95	125.1 Å²	125.1	66%	0.664	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-62.8	-9.7	-177.7	-42.7	0	0	0	0	115.3	D185 F191	D185-S187 PolarHBondContact O-N 2.65Å; S187-F191 WeakPolarHBondContact O-CD2 3.47Å
188	K	34.5	Very low	34.4	Very low	152 Å²	152	126.6 Å²	126.6	66%	0.661	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-83.2	-23.6	171.9	-70.4	170.4	-173.6	155.8	0	112.7	D185 V186	D185-K188 PolarHBondContact O-N 2.94Å; D185-K188 WeakPolarHBondContact OD1-CD 3.46Å; D185-K188 WeakPolarHBondContact OD1-CE 3.42Å; D185-K188 IonicContact OD1-NZ 2.67Å; D185-K188 PolarHBondContact OD1-NZ 3.33Å; V186-K188 PolarHBondContact O-N 3.44Å
189	A	34.7	Very low	34.3	Very low	63 Å²	63	122.1 Å²	122.1	52%	0.521	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-45.3	-177	0	0	0	0	0	112.4	V186 F191 S192	V186-A189 WeakPolarHBondContact O-CB 3.31Å; V186-A189 PolarHBondContact O-N 3.03Å; A189-F191 PolarHBondContact O-N 3.41Å; A189-F191 VanDerWaalsContact O-N 3.16Å; A189-S192 WeakPolarHBondContact O-CB 3.27Å; A189-S192 PolarHBondContact O-N 2.98Å; A189-S192 PolarHBondContact O-OG 3.2Å
190	T	33.1	Very low	34	Very low	103 Å²	103	120 Å²	120	63%	0.632	65%	0.646	S	S	*	*	H	α-helix	trans	-65.8	-16.5	178.3	27.2	0	0	0	0	114.1
191	F	31.1	Very low	33.9	Very low	139 Å²	139	115.1 Å²	115.1	61%	0.61	62%	0.624	S	S	*	*	H	α-helix	trans	-86.4	-1.9	172.4	-87.4	-89.1	0	0	0	114.7	S187 A189 R195	S187-F191 WeakPolarHBondContact O-CD2 3.47Å; A189-F191 PolarHBondContact O-N 3.41Å; A189-F191 VanDerWaalsContact O-N 3.16Å; F191-R195 PolarHBondContact O-NH1 3.48Å; F191-R195 VanDerWaalsContact O-NH1 3.1Å
192	S	33.3	Very low	33.8	Very low	56 Å²	56	109.5 Å²	109.5	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-76.4	-55.9	169.8	71.5	0	0	0	0	110.5	A189 R194 R195	A189-S192 WeakPolarHBondContact O-CB 3.27Å; A189-S192 PolarHBondContact O-N 2.98Å; A189-S192 PolarHBondContact O-OG 3.2Å; S192-R194 VanDerWaalsContact C-N 3.27Å; S192-R194 PolarHBondContact O-N 2.9Å; S192-R194 VanDerWaalsContact O-N 3.15Å; S192-R195 WeakPolarHBondContact O-CB 3.35Å; S192-R195 PolarHBondContact O-N 3.34Å
193	H	32.6	Very low	33.9	Very low	138 Å²	138	110 Å²	110	64%	0.639	59%	0.59	S	S	*	*	H	α-helix	trans	-64	-23.5	-173.9	-75	-42.4	0	0	0	115.3	R195 D196	H193-R195 PolarHBondContact O-N 2.93Å; H193-D196 WeakPolarHBondContact CA-OD2 3.43Å; H193-D196 IonicContact CE1-OD2 3.62Å; H193-D196 IonicContact CG-OD2 3.25Å; H193-D196 IonicContact ND1-OD2 2.68Å; H193-D196 PolarHBondContact ND1-OD2 2.95Å; H193-D196 PolarHBondContact O-N 3.39Å
194	R	31.7	Very low	34.2	Very low	203 Å²	203	101.9 Å²	101.9	77%	0.766	55%	0.549	S	S	*	.	H	α-helix	trans	-70.8	-14.8	170.4	-74.6	-167	174.4	-162.1	-0.4	113.9	S192	S192-R194 VanDerWaalsContact C-N 3.27Å; S192-R194 PolarHBondContact O-N 2.9Å; S192-R194 VanDerWaalsContact O-N 3.15Å
195	R	31.6	Very low	34.2	Very low	167 Å²	167	100.7 Å²	100.7	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-79.1	-27.8	170.4	-70	-176.1	166.8	86.9	-6.4	112.8	F191 S192 H193 L197 L198	F191-R195 PolarHBondContact O-NH1 3.48Å; F191-R195 VanDerWaalsContact O-NH1 3.1Å; S192-R195 WeakPolarHBondContact O-CB 3.35Å; S192-R195 PolarHBondContact O-N 3.34Å; H193-R195 PolarHBondContact O-N 2.93Å; R195-L197 PolarHBondContact O-N 2.89Å; R195-L198 WeakPolarHBondContact O-CB 3.25Å; R195-L198 PolarHBondContact O-N 3.5Å
196	D	31.3	Very low	34.1	Very low	92 Å²	92	101.3 Å²	101.3	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-31.6	-174.5	-65.8	-36.1	0	0	0	112.3	H193 L198 T199	H193-D196 WeakPolarHBondContact CA-OD2 3.43Å; H193-D196 IonicContact CE1-OD2 3.62Å; H193-D196 IonicContact CG-OD2 3.25Å; H193-D196 IonicContact ND1-OD2 2.68Å; H193-D196 PolarHBondContact ND1-OD2 2.95Å; H193-D196 PolarHBondContact O-N 3.39Å; D196-L198 VanDerWaalsContact C-N 3.29Å; D196-L198 PolarHBondContact O-N 3.45Å; D196-T199 WeakPolarHBondContact O-CA 3.18Å; D196-T199 WeakPolarHBondContact O-CB 3.37Å; D196-T199 PolarHBondContact O-N 2.87Å; D196-T199 PolarHBondContact O-OG1 3.35Å
197	L	31.8	Very low	34.2	Very low	136 Å²	136	96.2 Å²	96.2	71%	0.712	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-66.7	-22.2	175.6	-69.2	170.5	0	0	0	114.3	R195 T199 C200	R195-L197 PolarHBondContact O-N 2.89Å; L197-T199 PolarHBondContact O-N 2.89Å; L197-C200 PolarHBondContact O-N 3.03Å
198	L	31.9	Very low	34.4	Very low	118 Å²	118	97.3 Å²	97.3	62%	0.618	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-71	-15.3	171.2	-62.4	169.1	0	0	0	111.9	R195 D196 C200 S201	R195-L198 WeakPolarHBondContact O-CB 3.25Å; R195-L198 PolarHBondContact O-N 3.5Å; D196-L198 VanDerWaalsContact C-N 3.29Å; D196-L198 PolarHBondContact O-N 3.45Å; L198-C200 VanDerWaalsContact C-N 3.26Å; L198-C200 PolarHBondContact O-N 2.79Å; L198-S201 PolarHBondContact O-N 2.99Å; L198-S201 PolarHBondContact O-OG 3.3Å
199	T	31.4	Very low	35.2	Very low	79 Å²	79	97.5 Å²	97.5	49%	0.485	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-80.3	-2.3	177.1	-27.5	0	0	0	0	113.2	D196 L197 S201	D196-T199 WeakPolarHBondContact O-CA 3.18Å; D196-T199 WeakPolarHBondContact O-CB 3.37Å; D196-T199 PolarHBondContact O-N 2.87Å; D196-T199 PolarHBondContact O-OG1 3.35Å; L197-T199 PolarHBondContact O-N 2.89Å; T199-S201 PolarHBondContact O-N 3.18Å
200	C	30.2	Very low	35.5	Very low	64 Å²	64	96.5 Å²	96.5	43%	0.432	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-72.5	2.2	164.7	-71.1	0	0	0	0	113.3	M150 L197 L198 L202	M150-C200 HydrophobicContact CE-CB 3.94Å; M150-C200 HydrophobicContact SD-CB 4.37Å; L197-C200 PolarHBondContact O-N 3.03Å; L198-C200 VanDerWaalsContact C-N 3.26Å; L198-C200 PolarHBondContact O-N 2.79Å; C200-L202 PolarHBondContact O-N 2.95Å
201	S	33.6	Very low	36.2	Very low	54 Å²	54	98.4 Å²	98.4	38%	0.378	51%	0.512	S	S	.	.	S	Bend	trans	-59.4	101	152.5	45.1	0	0	0	0	109	L198 T199	L198-S201 PolarHBondContact O-N 2.99Å; L198-S201 PolarHBondContact O-OG 3.3Å; T199-S201 PolarHBondContact O-N 3.18Å
202	L	38.2	Very low	37	Very low	64 Å²	64	94.3 Å²	94.3	34%	0.335	50%	0.5	S	S	.	.			trans	-45.1	143	-160.5	-69.8	71.1	0	0	0	113.1	C200 V204 V205 K206	C200-L202 PolarHBondContact O-N 2.95Å; L202-V204 HydrophobicContact CB-CB 3.95Å; L202-V204 HydrophobicContact CB-CG2 4.31Å; L202-V204 HydrophobicContact CD2-CB 4.13Å; L202-V204 HydrophobicContact CD2-CG2 4.07Å; L202-V204 PolarHBondContact O-N 3.15Å; L202-V205 HydrophobicContact CB-CG2 4.28Å; L202-V205 PolarHBondContact O-N 3Å; L202-K206 PolarHBondContact O-N 2.87Å
203	P	35.3	Very low	38	Very low	76 Å²	76	94.1 Å²	94.1	49%	0.494	51%	0.507	S	S	.	.	H	α-helix	trans	-48	-34.2	164.2	-29.4	36.8	0	0	0	112.7	V205 K206 A207 C220	P203-V205 PolarHBondContact O-N 2.99Å; P203-K206 PolarHBondContact O-N 3.03Å; P203-A207 VanDerWaalsContact O-CB 3.24Å; P203-A207 WeakPolarHBondContact O-CB 3.27Å; P203-A207 PolarHBondContact O-N 3.16Å; P203-C220 HydrophobicContact CB-CB 4.15Å; P203-C220 VanDerWaalsContact CB-SG 3.58Å
204	V	38.6	Very low	39	Very low	20 Å²	20	91.2 Å²	91.2	12%	0.121	50%	0.496	C	S	.	.	H	α-helix	trans	-54	-44.4	171.5	-176.8	0	0	0	0	112.9	L202 A207 L208 C220	L202-V204 HydrophobicContact CB-CB 3.95Å; L202-V204 HydrophobicContact CB-CG2 4.31Å; L202-V204 HydrophobicContact CD2-CB 4.13Å; L202-V204 HydrophobicContact CD2-CG2 4.07Å; L202-V204 PolarHBondContact O-N 3.15Å; V204-A207 PolarHBondContact O-N 2.85Å; V204-L208 HydrophobicContact CG1-CD1 3.91Å; V204-L208 HydrophobicContact CG1-CG 4.41Å; V204-L208 WeakPolarHBondContact O-CB 3.24Å; V204-L208 VanDerWaalsContact O-CG 3.22Å; V204-L208 WeakPolarHBondContact O-CG 3.27Å; V204-L208 PolarHBondContact O-N 3.1Å; V204-C220 HydrophobicContact CB-CB 4.29Å; V204-C220 HydrophobicContact CG2-CB 3.57Å; V204-C220 WeakPolarHBondContact CG2-O 3.24Å
205	V	40.3	Very low	40.5	Very low	66 Å²	66	84.7 Å²	84.7	40%	0.4	48%	0.476	S	S	.	.	H	α-helix	trans	-71.7	-37.7	-176.2	176.5	0	0	0	0	111.2	L202 P203 Q209	L202-V205 HydrophobicContact CB-CG2 4.28Å; L202-V205 PolarHBondContact O-N 3Å; P203-V205 PolarHBondContact O-N 2.99Å; V205-Q209 WeakPolarHBondContact O-CG 3.47Å; V205-Q209 PolarHBondContact O-N 2.83Å
206	K	38.4	Very low	41.8	Very low	126 Å²	126	80.9 Å²	80.9	55%	0.548	47%	0.466	S	S	.	.	H	α-helix	trans	-71.4	-37.9	172.4	-72.5	-178.1	178.4	174.6	0	112	L202 P203 L208 Q209 A210	L202-K206 PolarHBondContact O-N 2.87Å; P203-K206 PolarHBondContact O-N 3.03Å; K206-L208 VanDerWaalsContact C-N 3.34Å; K206-L208 PolarHBondContact O-N 3.38Å; K206-Q209 PolarHBondContact O-N 2.79Å; K206-Q209 VanDerWaalsContact O-N 3.12Å; K206-A210 PolarHBondContact O-N 3.42Å
207	A	39.6	Very low	42.7	Very low	9 Å²	9	78 Å²	78	7%	0.074	45%	0.451	C	S	.	.	H	α-helix	trans	-64.1	-35.7	174.6	0	0	0	0	0	112.7	P203 V204 Q209	P203-A207 VanDerWaalsContact O-CB 3.24Å; P203-A207 WeakPolarHBondContact O-CB 3.27Å; P203-A207 PolarHBondContact O-N 3.16Å; V204-A207 PolarHBondContact O-N 2.85Å; A207-Q209 PolarHBondContact O-N 2.97Å
208	L	40	Very low	44.3	Very low	119 Å²	119	72.9 Å²	72.9	62%	0.623	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.4	173.3	-75	168.9	0	0	0	114.2	V204 K206 T217	V204-L208 HydrophobicContact CG1-CD1 3.91Å; V204-L208 HydrophobicContact CG1-CG 4.41Å; V204-L208 WeakPolarHBondContact O-CB 3.24Å; V204-L208 VanDerWaalsContact O-CG 3.22Å; V204-L208 WeakPolarHBondContact O-CG 3.27Å; V204-L208 PolarHBondContact O-N 3.1Å; K206-L208 VanDerWaalsContact C-N 3.34Å; K206-L208 PolarHBondContact O-N 3.38Å; L208-T217 HydrophobicContact CD2-CG2 3.82Å; L208-T217 HydrophobicContact CG-CG2 4.06Å
209	Q	49.9	Very low	45.7	Very low	156 Å²	156	73.5 Å²	73.5	73%	0.729	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-17.5	177.9	-69.5	177.5	-5.6	0	0	113.1	V205 K206 A207	V205-Q209 WeakPolarHBondContact O-CG 3.47Å; V205-Q209 PolarHBondContact O-N 2.83Å; K206-Q209 PolarHBondContact O-N 2.79Å; K206-Q209 VanDerWaalsContact O-N 3.12Å; A207-Q209 PolarHBondContact O-N 2.97Å
210	A	41.7	Very low	46.8	Very low	42 Å²	42	70.7 Å²	70.7	35%	0.347	41%	0.409	S	S	.	.	S	Bend	trans	-84.1	144.8	173.6	0	0	0	0	0	111	K206 S212	K206-A210 PolarHBondContact O-N 3.42Å; A210-S212 VanDerWaalsContact CB-OG 3.32Å; A210-S212 WeakPolarHBondContact CB-OG 3.19Å; A210-S212 PolarHBondContact O-N 3.23Å
211	P	47.2	Very low	48.3	Very low	143 Å²	143	71.6 Å²	71.6	93%	0.929	41%	0.409	S	S	*	.	S	Bend	trans	-72.9	11.8	173.9	31.2	-35.7	0	0	0	113.7	G213	P211-G213 PolarHBondContact O-N 3.46Å
212	S	49.5	Very low	49.9	Very low	52 Å²	52	73.7 Å²	73.7	36%	0.364	42%	0.416	S	S	.	.	S	Bend	trans	-94.4	75.1	-170.3	52.2	0	0	0	0	113.6	A210 Q216	A210-S212 VanDerWaalsContact CB-OG 3.32Å; A210-S212 WeakPolarHBondContact CB-OG 3.19Å; A210-S212 PolarHBondContact O-N 3.23Å; S212-Q216 WeakPolarHBondContact O-CB 3.48Å; S212-Q216 PolarHBondContact O-OE1 3.23Å; S212-Q216 PolarHBondContact OG-OE1 3.05Å
213	G	52.6	Low	51.1	Low	52 Å²	52	75.6 Å²	75.6	54%	0.536	43%	0.425	S	S	.	.			trans	62.6	120.8	150.8	0	0	0	0	0	118.3	P211 N215 Q216	P211-G213 PolarHBondContact O-N 3.46Å; G213-N215 PolarHBondContact O-N 2.69Å; G213-Q216 WeakPolarHBondContact O-CB 3.49Å; G213-Q216 PolarHBondContact O-N 2.91Å
214	L	54.8	Low	52	Low	78 Å²	78	74 Å²	74	41%	0.408	42%	0.415	S	S	.	.	H	α-helix	trans	-36.3	-44.6	176.6	-170.1	70.3	0	0	0	115.4	Q216 T217 V218 L289 T293	L214-Q216 PolarHBondContact O-N 3.08Å; L214-T217 WeakPolarHBondContact O-CB 3.31Å; L214-T217 PolarHBondContact O-N 2.97Å; L214-T217 VanDerWaalsContact O-N 3.13Å; L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.22Å; L214-L289 HydrophobicContact CD1-CD2 4.18Å; L214-L289 HydrophobicContact CD2-CB 4.12Å; L214-L289 HydrophobicContact CD2-CD2 3.9Å; L214-L289 HydrophobicContact CD2-CG 3.92Å; L214-L289 HydrophobicContact CG-CD2 4.31Å; L214-T293 WeakPolarHBondContact CD2-OG1 3.26Å
215	N	62.4	Low	53.3	Low	65 Å²	65	75.3 Å²	75.3	35%	0.348	42%	0.421	S	S	.	.	H	α-helix	trans	-54.8	-35.5	179	-61.6	13.6	0	0	0	113.3	G213 V218 Q219	G213-N215 PolarHBondContact O-N 2.69Å; N215-V218 PolarHBondContact O-N 3.3Å; N215-Q219 WeakPolarHBondContact O-CB 3.22Å; N215-Q219 VanDerWaalsContact O-CG 3.29Å; N215-Q219 WeakPolarHBondContact O-CG 3.38Å; N215-Q219 PolarHBondContact O-N 3.29Å
216	Q	59	Low	54.5	Low	88 Å²	88	75.1 Å²	75.1	41%	0.411	42%	0.422	S	S	.	.	H	α-helix	trans	-71.1	-38.5	-179.5	-163.3	167.7	48.3	0	0	111.1	S212 G213 L214 Q219 C220	S212-Q216 WeakPolarHBondContact O-CB 3.48Å; S212-Q216 PolarHBondContact O-OE1 3.23Å; S212-Q216 PolarHBondContact OG-OE1 3.05Å; G213-Q216 WeakPolarHBondContact O-CB 3.49Å; G213-Q216 PolarHBondContact O-N 2.91Å; L214-Q216 PolarHBondContact O-N 3.08Å; Q216-Q219 PolarHBondContact O-N 3.44Å; Q216-C220 WeakPolarHBondContact O-CB 3.11Å; Q216-C220 PolarHBondContact O-N 3.27Å; Q216-C220 PolarHBondContact O-SG 2.97Å
217	T	50.8	Low	55.3	Low	30 Å²	30	76.9 Å²	76.9	18%	0.184	43%	0.426	C	S	.	.	H	α-helix	trans	-64.8	-41.7	171.5	-54.8	0	0	0	0	111.4	L208 L214 C220 L221	L208-T217 HydrophobicContact CD2-CG2 3.82Å; L208-T217 HydrophobicContact CG-CG2 4.06Å; L214-T217 WeakPolarHBondContact O-CB 3.31Å; L214-T217 PolarHBondContact O-N 2.97Å; L214-T217 VanDerWaalsContact O-N 3.13Å; T217-C220 PolarHBondContact O-N 3Å; T217-L221 WeakPolarHBondContact O-CB 3.38Å; T217-L221 PolarHBondContact O-N 3.19Å
218	V	64.5	Low	56.1	Low	29 Å²	29	80.4 Å²	80.4	18%	0.176	44%	0.438	C	S	.	.	H	α-helix	trans	-62.1	-45.3	174.8	169.6	0	0	0	0	111.4	L214 N215 C220 L221 N222 S286	L214-V218 WeakPolarHBondContact O-CG2 3.46Å; L214-V218 PolarHBondContact O-N 3.22Å; N215-V218 PolarHBondContact O-N 3.3Å; V218-C220 PolarHBondContact O-N 3.34Å; V218-L221 PolarHBondContact O-N 3.3Å; V218-N222 PolarHBondContact O-N 2.93Å; V218-S286 VanDerWaalsContact CG1-OG 3.24Å; V218-S286 WeakPolarHBondContact CG1-OG 3.46Å
219	Q	61	Low	57.2	Low	131 Å²	131	77.5 Å²	77.5	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-61	-42.1	174.7	-75.9	172.1	-6.7	0	0	112	N215 Q216 L221 N222 M223	N215-Q219 WeakPolarHBondContact O-CB 3.22Å; N215-Q219 VanDerWaalsContact O-CG 3.29Å; N215-Q219 WeakPolarHBondContact O-CG 3.38Å; N215-Q219 PolarHBondContact O-N 3.29Å; Q216-Q219 PolarHBondContact O-N 3.44Å; Q219-L221 VanDerWaalsContact C-N 3.33Å; Q219-L221 PolarHBondContact O-N 3.26Å; Q219-N222 PolarHBondContact O-N 3.42Å; Q219-M223 VanDerWaalsContact O-CB 3.3Å; Q219-M223 WeakPolarHBondContact O-CB 3.46Å; Q219-M223 PolarHBondContact O-N 3.4Å
220	C	54.3	Low	57.9	Low	20 Å²	20	76 Å²	76	14%	0.135	42%	0.424	C	S	.	.	H	α-helix	trans	-65.3	-35.4	175.8	-67.3	0	0	0	0	112.5	P203 V204 Q216 T217 V218 S224	P203-C220 HydrophobicContact CB-CB 4.15Å; P203-C220 VanDerWaalsContact CB-SG 3.58Å; V204-C220 HydrophobicContact CB-CB 4.29Å; V204-C220 HydrophobicContact CG2-CB 3.57Å; V204-C220 WeakPolarHBondContact CG2-O 3.24Å; Q216-C220 WeakPolarHBondContact O-CB 3.11Å; Q216-C220 PolarHBondContact O-N 3.27Å; Q216-C220 PolarHBondContact O-SG 2.97Å; T217-C220 PolarHBondContact O-N 3Å; V218-C220 PolarHBondContact O-N 3.34Å; C220-S224 WeakPolarHBondContact O-CB 3.35Å; C220-S224 PolarHBondContact O-N 3.04Å; C220-S224 VanDerWaalsContact O-N 3.12Å; C220-S224 PolarHBondContact O-OG 3.44Å
221	L	62	Low	58.6	Low	83 Å²	83	76.2 Å²	76.2	44%	0.435	43%	0.426	S	S	.	.	H	α-helix	trans	-68.1	-47.2	174.1	-175.6	119.9	0	0	0	111.3	T217 V218 Q219 M223 S224 L225 I282	T217-L221 WeakPolarHBondContact O-CB 3.38Å; T217-L221 PolarHBondContact O-N 3.19Å; V218-L221 PolarHBondContact O-N 3.3Å; Q219-L221 VanDerWaalsContact C-N 3.33Å; Q219-L221 PolarHBondContact O-N 3.26Å; L221-M223 PolarHBondContact O-N 2.82Å; L221-S224 WeakPolarHBondContact O-CB 3.19Å; L221-S224 PolarHBondContact O-N 3.37Å; L221-S224 VanDerWaalsContact O-N 3.08Å; L221-L225 HydrophobicContact CD2-CD1 3.78Å; L221-L225 HydrophobicContact CG-CD1 4.3Å; L221-L225 PolarHBondContact O-N 3.36Å; L221-I282 HydrophobicContact CD2-CG2 4.39Å
222	N	68.2	Low	59.3	Low	99 Å²	99	74.5 Å²	74.5	53%	0.529	40%	0.404	S	S	.	.	H	α-helix	trans	-59.5	-48.9	177.3	-167.8	7.3	0	0	0	111.1	V218 Q219 S224 L225 S226	V218-N222 PolarHBondContact O-N 2.93Å; Q219-N222 PolarHBondContact O-N 3.42Å; N222-S224 PolarHBondContact O-N 2.83Å; N222-L225 PolarHBondContact O-N 2.8Å; N222-S226 PolarHBondContact O-N 3.17Å; N222-S226 PolarHBondContact O-OG 2.85Å
223	M	62.9	Low	60.2	Low	104 Å²	104	81 Å²	81	51%	0.512	42%	0.42	S	S	.	.	H	α-helix	trans	-54.8	-36.5	173.1	-179.1	62.2	58.5	0	0	113.1	Q219 L221 R227	Q219-M223 VanDerWaalsContact O-CB 3.3Å; Q219-M223 WeakPolarHBondContact O-CB 3.46Å; Q219-M223 PolarHBondContact O-N 3.4Å; L221-M223 PolarHBondContact O-N 2.82Å; M223-R227 WeakPolarHBondContact O-CG 3.46Å; M223-R227 PolarHBondContact O-N 3.41Å
224	S	54.9	Low	61	Low	41 Å²	41	83.5 Å²	83.5	29%	0.287	42%	0.42	S	S	.	.	H	α-helix	trans	-72.6	-38.9	177.2	-56.5	0	0	0	0	112	C220 L221 N222 Y228	C220-S224 WeakPolarHBondContact O-CB 3.35Å; C220-S224 PolarHBondContact O-N 3.04Å; C220-S224 VanDerWaalsContact O-N 3.12Å; C220-S224 PolarHBondContact O-OG 3.44Å; L221-S224 WeakPolarHBondContact O-CB 3.19Å; L221-S224 PolarHBondContact O-N 3.37Å; L221-S224 VanDerWaalsContact O-N 3.08Å; N222-S224 PolarHBondContact O-N 2.83Å; S224-Y228 PolarHBondContact O-N 3.2Å; S224-Y228 VanDerWaalsContact O-N 3.13Å
225	L	65.3	Low	61.2	Low	49 Å²	49	85.2 Å²	85.2	26%	0.257	43%	0.43	S	S	.	.	H	α-helix	trans	-67.1	-41.9	174.6	-72	168.8	0	0	0	111.9	L221 N222 R227 Y228 A229 I282	L221-L225 HydrophobicContact CD2-CD1 3.78Å; L221-L225 HydrophobicContact CG-CD1 4.3Å; L221-L225 PolarHBondContact O-N 3.36Å; N222-L225 PolarHBondContact O-N 2.8Å; L225-R227 PolarHBondContact O-N 3.3Å; L225-Y228 PolarHBondContact O-N 3.27Å; L225-A229 PolarHBondContact O-N 2.81Å; L225-I282 HydrophobicContact CD1-CG2 4.39Å
226	S	64.4	Low	61.2	Low	61 Å²	61	85.2 Å²	85.2	43%	0.427	43%	0.432	S	S	.	.	H	α-helix	trans	-59.1	-47.4	176.5	-48.6	0	0	0	0	111.5	N222 Y228 A229 E230	N222-S226 PolarHBondContact O-N 3.17Å; N222-S226 PolarHBondContact O-OG 2.85Å; S226-Y228 VanDerWaalsContact C-N 3.32Å; S226-Y228 PolarHBondContact O-N 3.31Å; S226-A229 PolarHBondContact O-N 3.18Å; S226-E230 WeakPolarHBondContact O-CB 3.46Å; S226-E230 PolarHBondContact O-N 3.05Å
227	R	56.6	Low	61.7	Low	164 Å²	164	86 Å²	86	62%	0.619	44%	0.436	S	S	*	.	H	α-helix	trans	-62.5	-36.7	176.5	-72	175.7	-179.2	-154.5	-3	112.8	M223 L225 A231	M223-R227 WeakPolarHBondContact O-CG 3.46Å; M223-R227 PolarHBondContact O-N 3.41Å; L225-R227 PolarHBondContact O-N 3.3Å; R227-A231 WeakPolarHBondContact O-CB 3.34Å; R227-A231 PolarHBondContact O-N 3.18Å
228	Y	56	Low	62.1	Low	83 Å²	83	92.4 Å²	92.4	33%	0.325	46%	0.461	S	S	.	.	H	α-helix	trans	-67	-43.3	174.3	174.5	-97.2	0	0	0	112.1	S224 L225 S226 A231 K232 V273	S224-Y228 PolarHBondContact O-N 3.2Å; S224-Y228 VanDerWaalsContact O-N 3.13Å; L225-Y228 PolarHBondContact O-N 3.27Å; S226-Y228 VanDerWaalsContact C-N 3.32Å; S226-Y228 PolarHBondContact O-N 3.31Å; Y228-A231 PolarHBondContact O-N 3.12Å; Y228-K232 WeakPolarHBondContact O-CB 3.34Å; Y228-K232 PolarHBondContact O-N 3.45Å; Y228-V273 HydrophobicContact CD1-CG1 4.13Å; Y228-V273 HydrophobicContact CE1-CB 4.15Å; Y228-V273 HydrophobicContact CE1-CG1 3.71Å
229	A	62.4	Low	61.7	Low	58 Å²	58	95.9 Å²	95.9	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-40.2	177.1	0	0	0	0	0	112.1	L225 S226 K232 R233	L225-A229 PolarHBondContact O-N 2.81Å; S226-A229 PolarHBondContact O-N 3.18Å; A229-K232 PolarHBondContact O-N 2.89Å; A229-R233 WeakPolarHBondContact O-CB 3.43Å; A229-R233 PolarHBondContact O-N 3.37Å
230	E	66.2	Low	61.3	Low	124 Å²	124	99 Å²	99	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-62.4	-49.3	172.7	-177.2	175.4	-151.7	0	0	111.7	S226 K232 R233 L234	S226-E230 WeakPolarHBondContact O-CB 3.46Å; S226-E230 PolarHBondContact O-N 3.05Å; E230-K232 VanDerWaalsContact C-N 3.34Å; E230-K232 PolarHBondContact O-N 3.4Å; E230-R233 WeakPolarHBondContact O-CB 3.16Å; E230-R233 PolarHBondContact O-N 2.96Å; E230-R233 VanDerWaalsContact O-N 3.14Å; E230-L234 HydrophobicContact CG-CD1 4.27Å; E230-L234 WeakPolarHBondContact O-CG 3.4Å; E230-L234 PolarHBondContact O-N 2.87Å
231	A	55.9	Low	61.3	Low	47 Å²	47	102.5 Å²	102.5	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-40.6	176.4	0	0	0	0	0	112.5	R227 Y228 L234 L235	R227-A231 WeakPolarHBondContact O-CB 3.34Å; R227-A231 PolarHBondContact O-N 3.18Å; Y228-A231 PolarHBondContact O-N 3.12Å; A231-L234 PolarHBondContact O-N 3.22Å; A231-L235 WeakPolarHBondContact O-CG 3.48Å; A231-L235 PolarHBondContact O-N 2.92Å
232	K	62.4	Low	60.7	Low	107 Å²	107	104.7 Å²	104.7	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-45.3	173.2	-173	-180	179.7	-175.9	0	111	Y228 A229 E230 L234 L235 T236	Y228-K232 WeakPolarHBondContact O-CB 3.34Å; Y228-K232 PolarHBondContact O-N 3.45Å; A229-K232 PolarHBondContact O-N 2.89Å; E230-K232 VanDerWaalsContact C-N 3.34Å; E230-K232 PolarHBondContact O-N 3.4Å; K232-L234 PolarHBondContact O-N 2.85Å; K232-L235 PolarHBondContact O-N 3.06Å; K232-T236 PolarHBondContact O-N 3.14Å; K232-T236 PolarHBondContact O-OG1 3.4Å
233	R	67.6	Low	59.7	Low	189 Å²	189	105 Å²	105	71%	0.713	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-43.6	177	-178.7	178	176.9	166.5	0.6	111.9	A229 E230 T236 Q237	A229-R233 WeakPolarHBondContact O-CB 3.43Å; A229-R233 PolarHBondContact O-N 3.37Å; E230-R233 WeakPolarHBondContact O-CB 3.16Å; E230-R233 PolarHBondContact O-N 2.96Å; E230-R233 VanDerWaalsContact O-N 3.14Å; R233-T236 PolarHBondContact O-N 2.89Å; R233-Q237 VanDerWaalsContact O-CB 3.29Å; R233-Q237 WeakPolarHBondContact O-CB 3.41Å; R233-Q237 PolarHBondContact O-N 3.39Å
234	L	69.4	Low	58.7	Low	103 Å²	103	102.8 Å²	102.8	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-38	177.3	-70	171.3	0	0	0	112.3	E230 A231 K232 Q237 K238	E230-L234 HydrophobicContact CG-CD1 4.27Å; E230-L234 WeakPolarHBondContact O-CG 3.4Å; E230-L234 PolarHBondContact O-N 2.87Å; A231-L234 PolarHBondContact O-N 3.22Å; K232-L234 PolarHBondContact O-N 2.85Å; L234-Q237 PolarHBondContact O-N 3.13Å; L234-K238 PolarHBondContact O-N 3.07Å
235	L	59.3	Low	58	Low	115 Å²	115	107.9 Å²	107.9	60%	0.602	55%	0.546	S	S	*	.	H	α-helix	trans	-63.8	-51.5	172.8	-78.9	164	0	0	0	111.7	A231 K232 Q237 K238 I239	A231-L235 WeakPolarHBondContact O-CG 3.48Å; A231-L235 PolarHBondContact O-N 2.92Å; K232-L235 PolarHBondContact O-N 3.06Å; L235-Q237 VanDerWaalsContact C-N 3.25Å; L235-Q237 PolarHBondContact O-N 2.72Å; L235-K238 PolarHBondContact O-N 3.27Å; L235-K238 VanDerWaalsContact O-N 3.15Å; L235-I239 WeakPolarHBondContact O-CG1 3.3Å; L235-I239 PolarHBondContact O-N 2.93Å
236	T	62.8	Low	56.8	Low	65 Å²	65	112.5 Å²	112.5	40%	0.399	57%	0.57	S	S	.	*	H	α-helix	trans	-61.3	-34.2	177.3	-55.1	0	0	0	0	112.2	K232 R233 R240	K232-T236 PolarHBondContact O-N 3.14Å; K232-T236 PolarHBondContact O-OG1 3.4Å; R233-T236 PolarHBondContact O-N 2.89Å; T236-R240 PolarHBondContact O-N 3.32Å
237	Q	68.3	Low	55.1	Low	105 Å²	105	114.3 Å²	114.3	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-69.9	-41	174.3	-174.3	171.1	-11.4	0	0	112.2	R233 L234 L235 I239 R240 V241	R233-Q237 VanDerWaalsContact O-CB 3.29Å; R233-Q237 WeakPolarHBondContact O-CB 3.41Å; R233-Q237 PolarHBondContact O-N 3.39Å; L234-Q237 PolarHBondContact O-N 3.13Å; L235-Q237 VanDerWaalsContact C-N 3.25Å; L235-Q237 PolarHBondContact O-N 2.72Å; Q237-I239 PolarHBondContact O-N 2.99Å; Q237-R240 PolarHBondContact O-N 2.86Å; Q237-V241 HydrophobicContact CG-CG2 4.48Å; Q237-V241 VanDerWaalsContact O-CG2 3.3Å; Q237-V241 WeakPolarHBondContact O-CG2 3.44Å; Q237-V241 PolarHBondContact O-N 3.4Å
238	K	59.5	Low	54.1	Low	164 Å²	164	114 Å²	114	71%	0.713	60%	0.598	S	S	*	*	H	α-helix	trans	-61	-41.8	174.4	-94.3	-164.7	170	-167.8	0	112.5	L234 L235 V241 N242	L234-K238 PolarHBondContact O-N 3.07Å; L235-K238 PolarHBondContact O-N 3.27Å; L235-K238 VanDerWaalsContact O-N 3.15Å; K238-V241 PolarHBondContact O-N 2.92Å; K238-N242 PolarHBondContact O-N 3.01Å; K238-N242 VanDerWaalsContact O-N 3.07Å
239	I	56.4	Low	52.8	Low	102 Å²	102	116.8 Å²	116.8	52%	0.523	62%	0.619	S	S	.	*	H	α-helix	trans	-58.7	-55.6	176.1	-66.1	163.9	0	0	0	109.7	L235 Q237 V241 N242 D243	L235-I239 WeakPolarHBondContact O-CG1 3.3Å; L235-I239 PolarHBondContact O-N 2.93Å; Q237-I239 PolarHBondContact O-N 2.99Å; I239-V241 PolarHBondContact O-N 2.89Å; I239-V241 VanDerWaalsContact O-N 3.12Å; I239-N242 WeakPolarHBondContact O-CB 3.33Å; I239-N242 PolarHBondContact O-N 3.48Å; I239-D243 WeakPolarHBondContact CG2-OD2 3.44Å; I239-D243 PolarHBondContact O-N 3.01Å; I239-D243 VanDerWaalsContact O-N 3.11Å
240	R	53.2	Low	51.5	Low	196 Å²	196	118.4 Å²	118.4	74%	0.74	63%	0.626	S	S	*	*	H	α-helix	trans	-59.3	-27.1	178.7	-72.9	-174.8	176.6	-162.9	-2	115	T236 Q237 G244	T236-R240 PolarHBondContact O-N 3.32Å; Q237-R240 PolarHBondContact O-N 2.86Å; R240-G244 PolarHBondContact O-N 3.23Å
241	V	54.1	Low	49.9	Very low	93 Å²	93	118.1 Å²	118.1	56%	0.564	64%	0.638	S	S	*	*	H	α-helix	trans	-79.2	-31.7	175.9	169.4	0	0	0	0	111.7	Q237 K238 I239	Q237-V241 HydrophobicContact CG-CG2 4.48Å; Q237-V241 VanDerWaalsContact O-CG2 3.3Å; Q237-V241 WeakPolarHBondContact O-CG2 3.44Å; Q237-V241 PolarHBondContact O-N 3.4Å; K238-V241 PolarHBondContact O-N 2.92Å; I239-V241 PolarHBondContact O-N 2.89Å; I239-V241 VanDerWaalsContact O-N 3.12Å
242	N	48.4	Very low	48.7	Very low	130 Å²	130	125.2 Å²	125.2	70%	0.695	66%	0.66	S	S	*	*	H	α-helix	trans	-69.7	-44.9	174.6	-111.2	45.8	0	0	0	111.8	K238 I239 G244	K238-N242 PolarHBondContact O-N 3.01Å; K238-N242 VanDerWaalsContact O-N 3.07Å; I239-N242 WeakPolarHBondContact O-CB 3.33Å; I239-N242 PolarHBondContact O-N 3.48Å; N242-G244 PolarHBondContact O-N 3.36Å
243	D	48.6	Very low	47.5	Very low	104 Å²	104	128.2 Å²	128.2	56%	0.556	68%	0.68	S	S	*	*	H	α-helix	trans	-69.9	-23.6	-178.8	-55.4	-34.9	0	0	0	112.4	I239 N245 I246	I239-D243 WeakPolarHBondContact CG2-OD2 3.44Å; I239-D243 PolarHBondContact O-N 3.01Å; I239-D243 VanDerWaalsContact O-N 3.11Å; D243-N245 PolarHBondContact O-N 2.99Å; D243-N245 VanDerWaalsContact O-N 3.1Å; D243-I246 PolarHBondContact O-N 3.33Å
244	G	41.7	Very low	45.9	Very low	59 Å²	59	128.7 Å²	128.7	61%	0.608	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-6	-177.7	0	0	0	0	0	116.2	R240 N242	R240-G244 PolarHBondContact O-N 3.23Å; N242-G244 PolarHBondContact O-N 3.36Å
245	N	40.3	Very low	44	Very low	148 Å²	148	127.1 Å²	127.1	79%	0.791	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	3	179.6	-79.9	-24.7	0	0	0	114.4	D243	D243-N245 PolarHBondContact O-N 2.99Å; D243-N245 VanDerWaalsContact O-N 3.1Å
246	I	39.6	Very low	42.7	Very low	145 Å²	145	129.1 Å²	129.1	74%	0.744	71%	0.71	S	S	*	*			trans	-101	91	173.5	-54.1	-178.2	0	0	0	109.7	D243 L248	D243-I246 PolarHBondContact O-N 3.33Å; I246-L248 PolarHBondContact O-N 2.59Å
247	A	28.6	Very low	41.2	Very low	99 Å²	99	135 Å²	135	82%	0.818	73%	0.733	S	S	*	*			trans	-81.4	106.8	176.4	0	0	0	0	0	111.4
248	L	35.6	Very low	39.4	Very low	157 Å²	157	133.5 Å²	133.5	82%	0.822	75%	0.746	S	S	*	*			trans	-139.6	81	168.6	-110.6	169.7	0	0	0	111.8	I246	I246-L248 PolarHBondContact O-N 2.59Å
249	D	28.9	Very low	38.1	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	76%	0.756	S	S	*	*			trans	30.6	155.2	137	-161.4	32	0	0	0	123.3
250	S	35.7	Very low	37	Very low	92 Å²	92	138.4 Å²	138.4	64%	0.643	77%	0.771	S	S	*	*			trans	76.3	93.3	152.4	-82.6	0	0	0	0	118.8	K252	S250-K252 PolarHBondContact O-N 2.89Å
251	S	30.8	Very low	36	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	78%	0.777	S	S	*	*			trans	-52	110.6	155.7	54.8	0	0	0	0	113.3
252	K	31.8	Very low	35.2	Very low	197 Å²	197	137.2 Å²	137.2	86%	0.857	78%	0.782	S	S	*	*			trans	-173.8	114.1	149.4	-107.8	161.4	-174.5	173.3	0	111.2	S250	S250-K252 PolarHBondContact O-N 2.89Å
253	I	37.5	Very low	34.5	Very low	170 Å²	170	140 Å²	140	87%	0.872	79%	0.791	S	S	*	*			trans	176.1	123.1	137.2	-91.6	151.8	0	0	0	105.7
254	Q	34.1	Very low	33.9	Very low	198 Å²	198	142 Å²	142	93%	0.925	80%	0.797	S	S	*	*			trans	-119.7	117.8	178.4	-166.8	177	23.1	0	0	107.4
255	G	29.3	Very low	33.5	Very low	70 Å²	70	147 Å²	147	72%	0.722	81%	0.805	S	S	*	*			trans	87.8	99.7	178.3	0	0	0	0	0	115.1
256	N	31.3	Very low	33.2	Very low	158 Å²	158	148.5 Å²	148.5	85%	0.845	80%	0.801	S	S	*	*				-147.9	167.6	108.1	-154.9	9.5	0	0	0	110
257	E	31.5	Very low	32.9	Very low	187 Å²	187	145.7 Å²	145.7	87%	0.874	79%	0.787	S	S	*	*	S	Bend	trans	-75.6	147.3	175.9	-59.7	-179.3	135.6	0	0	111.5
258	G	30.8	Very low	33.2	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	77%	0.772	S	S	*	*			trans	104.1	74.9	174.4	0	0	0	0	0	115.1
259	M	31.8	Very low	33.1	Very low	185 Å²	185	139.4 Å²	139.4	91%	0.911	76%	0.755	S	S	*	*			trans	-85.9	110.1	157.3	-79.3	-72.8	-73.5	0	0	108.5
260	E	34.3	Very low	33.6	Very low	183 Å²	183	135.1 Å²	135.1	86%	0.855	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-74.3	122.4	163	-63.6	-175.7	128.2	0	0	108	P262	E260-P262 WeakPolarHBondContact O-CD 2.98Å
261	D	32.1	Very low	33.8	Very low	160 Å²	160	135.2 Å²	135.2	86%	0.856	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-72.8	121.4	178.6	-131	-19.5	0	0	0	108.9	E263	D261-E263 PolarHBondContact O-N 2.86Å
262	P	36.8	Very low	34.3	Very low	104 Å²	104	136 Å²	136	68%	0.675	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-76.8	116.7	-169.4	28.7	-34	0	0	0	112.5	E260 E264	E260-P262 WeakPolarHBondContact O-CD 2.98Å; P262-E264 PolarHBondContact O-N 3.04Å
263	E	34.3	Very low	34.8	Very low	188 Å²	188	128.8 Å²	128.8	88%	0.879	69%	0.692	S	S	*	*			trans	56.2	54.8	153.5	-53.5	-166.7	150.1	0	0	117	D261 E265	D261-E263 PolarHBondContact O-N 2.86Å; E263-E265 PolarHBondContact O-N 3.28Å
264	E	34.4	Very low	34.9	Very low	147 Å²	147	124.3 Å²	124.3	69%	0.687	67%	0.673	S	S	*	*			trans	-64.4	86.1	150.3	-86.1	-148.2	137.5	0	0	109.8	P262 Y266	P262-E264 PolarHBondContact O-N 3.04Å; E264-Y266 HydrophobicContact CB-CE2 4.36Å; E264-Y266 WeakPolarHBondContact O-CD2 3.44Å; E264-Y266 PolarHBondContact O-N 2.65Å; E264-Y266 PolarHBondContact OE2-OH 2.84Å
265	E	33.5	Very low	35	Very low	164 Å²	164	120.6 Å²	120.6	77%	0.766	65%	0.653	S	S	*	*			trans	-68.8	95.8	171.5	-166.8	-178.5	-148.4	0	0	109.9	E263 L267	E263-E265 PolarHBondContact O-N 3.28Å; E265-L267 PolarHBondContact O-N 2.92Å
266	Y	33.9	Very low	35.9	Very low	180 Å²	180	122.1 Å²	122.1	71%	0.706	65%	0.651	S	S	*	*			trans	-60.8	88.3	-176.3	-74.9	-73	0	0	0	113.7	E264 P268	E264-Y266 HydrophobicContact CB-CE2 4.36Å; E264-Y266 WeakPolarHBondContact O-CD2 3.44Å; E264-Y266 PolarHBondContact O-N 2.65Å; E264-Y266 PolarHBondContact OE2-OH 2.84Å; Y266-P268 WeakPolarHBondContact O-CD 3.37Å; Y266-P268 WeakPolarHBondContact O-CG 3.19Å; Y266-P268 VanDerWaalsContact O-N 3.1Å
267	L	34.7	Very low	36.5	Very low	86 Å²	86	119.5 Å²	119.5	45%	0.45	64%	0.637	S	S	.	*			trans	-55.5	107.4	172.1	-75.1	173.4	0	0	0	111.8	E265 G269 L270	E265-L267 PolarHBondContact O-N 2.92Å; L267-G269 PolarHBondContact O-N 2.65Å; L267-G269 VanDerWaalsContact O-N 3.08Å; L267-L270 HydrophobicContact CB-CD1 4.23Å; L267-L270 HydrophobicContact CD1-CD1 3.95Å
268	P	34.1	Very low	37.3	Very low	78 Å²	78	111.3 Å²	111.3	51%	0.506	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	108.2	-172.4	-16.1	31.8	0	0	0	111.3	F147 Y266	F147-P268 VanDerWaalsContact CE2-O 3.28Å; F147-P268 WeakPolarHBondContact CE2-O 3.05Å; F147-P268 WeakPolarHBondContact CZ-O 3.15Å; Y266-P268 WeakPolarHBondContact O-CD 3.37Å; Y266-P268 WeakPolarHBondContact O-CG 3.19Å; Y266-P268 VanDerWaalsContact O-N 3.1Å
269	G	33.4	Very low	38.3	Very low	46 Å²	46	111.8 Å²	111.8	47%	0.474	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	128.5	-7.6	174.8	0	0	0	0	0	115.7	L267 N271	L267-G269 PolarHBondContact O-N 2.65Å; L267-G269 VanDerWaalsContact O-N 3.08Å; G269-N271 VanDerWaalsContact C-N 3.28Å; G269-N271 PolarHBondContact O-N 2.67Å
270	L	39.1	Very low	39.6	Very low	51 Å²	51	107.2 Å²	107.2	27%	0.267	56%	0.564	S	S	.	*			trans	-87.4	11.3	174.1	-88.3	156.7	0	0	0	114.3	L267 L272 V273 T274	L267-L270 HydrophobicContact CB-CD1 4.23Å; L267-L270 HydrophobicContact CD1-CD1 3.95Å; L270-L272 PolarHBondContact O-N 2.78Å; L270-V273 PolarHBondContact O-N 3.36Å; L270-T274 HydrophobicContact CB-CG2 4.12Å; L270-T274 PolarHBondContact O-N 2.84Å
271	N	40.2	Very low	40.4	Very low	95 Å²	95	106.8 Å²	106.8	51%	0.508	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	3.9	-172.7	-79.2	-2.6	0	0	0	117.4	G269 T274 F275	G269-N271 VanDerWaalsContact C-N 3.28Å; G269-N271 PolarHBondContact O-N 2.67Å; N271-T274 WeakPolarHBondContact CA-OG1 3.08Å; N271-F275 HydrophobicContact CB-CE2 4.19Å
272	L	41	Very low	41.7	Very low	135 Å²	135	102 Å²	102	71%	0.707	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-7.2	170.9	-80.8	167.9	0	0	0	114	L270 S278	L270-L272 PolarHBondContact O-N 2.78Å; L272-S278 PolarHBondContact O-OG 3.35Å; L272-S278 VanDerWaalsContact O-OG 3.12Å
273	V	42.9	Very low	42.7	Very low	45 Å²	45	102.9 Å²	102.9	27%	0.273	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.2	8.3	-179.9	-149	0	0	0	0	113.1	Y228 L270 L279	Y228-V273 HydrophobicContact CD1-CG1 4.13Å; Y228-V273 HydrophobicContact CE1-CB 4.15Å; Y228-V273 HydrophobicContact CE1-CG1 3.71Å; L270-V273 PolarHBondContact O-N 3.36Å; V273-L279 HydrophobicContact CG1-CD2 4.32Å
274	T	39.9	Very low	44.2	Very low	76 Å²	76	100.3 Å²	100.3	47%	0.466	51%	0.513	S	S	.	.	S	Bend	trans	-92.5	-31.6	172.7	49.3	0	0	0	0	113	L270 N271	L270-T274 HydrophobicContact CB-CG2 4.12Å; L270-T274 PolarHBondContact O-N 2.84Å; N271-T274 WeakPolarHBondContact CA-OG1 3.08Å
275	F	36.4	Very low	45.5	Very low	119 Å²	119	97.9 Å²	97.9	52%	0.522	50%	0.504	S	S	.	.	S	Bend	trans	-79.8	126.9	176	-68.2	-84.8	0	0	0	111	N271 D277 S278	N271-F275 HydrophobicContact CB-CE2 4.19Å; F275-D277 VanDerWaalsContact C-N 3.26Å; F275-D277 PolarHBondContact O-N 2.99Å; F275-S278 WeakPolarHBondContact O-CB 3.09Å; F275-S278 PolarHBondContact O-N 2.91Å; F275-S278 PolarHBondContact O-OG 2.96Å
276	P	46.5	Very low	46.8	Very low	102 Å²	102	91.8 Å²	91.8	66%	0.662	48%	0.479	S	S	*	.	H	α-helix	trans	-58.6	-38	178	21.4	-31.6	0	0	0	112.4	S278 L279	P276-S278 PolarHBondContact O-N 3.21Å; P276-L279 PolarHBondContact O-N 3.13Å
277	D	44.2	Very low	48.5	Very low	103 Å²	103	88.5 Å²	88.5	55%	0.551	47%	0.472	S	S	*	.	H	α-helix	trans	-66.1	-17.3	176	-73	-29.5	0	0	0	114.8	F275 L279 N280 R281	F275-D277 VanDerWaalsContact C-N 3.26Å; F275-D277 PolarHBondContact O-N 2.99Å; D277-L279 VanDerWaalsContact C-N 3.33Å; D277-L279 PolarHBondContact O-N 3.33Å; D277-N280 PolarHBondContact O-N 3.28Å; D277-R281 WeakPolarHBondContact O-CG 3.37Å; D277-R281 PolarHBondContact O-N 3.42Å
278	S	49.1	Very low	50.1	Low	16 Å²	16	90.4 Å²	90.4	11%	0.112	48%	0.479	C	S	.	.	H	α-helix	trans	-67.6	-35.8	-179.5	65.6	0	0	0	0	111.9	L272 F275 P276 R281 I282	L272-S278 PolarHBondContact O-OG 3.35Å; L272-S278 VanDerWaalsContact O-OG 3.12Å; F275-S278 WeakPolarHBondContact O-CB 3.09Å; F275-S278 PolarHBondContact O-N 2.91Å; F275-S278 PolarHBondContact O-OG 2.96Å; P276-S278 PolarHBondContact O-N 3.21Å; S278-R281 PolarHBondContact O-N 2.8Å; S278-I282 WeakPolarHBondContact O-CD1 3.4Å; S278-I282 VanDerWaalsContact O-CG1 3.28Å; S278-I282 WeakPolarHBondContact O-CG1 3.4Å; S278-I282 PolarHBondContact O-N 3.06Å
279	L	52.4	Low	51.4	Low	84 Å²	84	90.3 Å²	90.3	44%	0.44	47%	0.473	S	S	.	.	H	α-helix	trans	-67.6	-47.2	173.8	-65	177.4	0	0	0	111	V273 P276 D277 R281 I282 E283	V273-L279 HydrophobicContact CG1-CD2 4.32Å; P276-L279 PolarHBondContact O-N 3.13Å; D277-L279 VanDerWaalsContact C-N 3.33Å; D277-L279 PolarHBondContact O-N 3.33Å; L279-R281 VanDerWaalsContact C-N 3.26Å; L279-R281 PolarHBondContact O-N 2.99Å; L279-I282 PolarHBondContact O-N 2.87Å; L279-E283 PolarHBondContact O-N 3.27Å
280	N	57.5	Low	52.9	Low	89 Å²	89	91.5 Å²	91.5	48%	0.476	47%	0.466	S	S	.	.	H	α-helix	trans	-55.9	-40	175.4	-65.2	-20.5	0	0	0	111.9	D277 E283 M284	D277-N280 PolarHBondContact O-N 3.28Å; N280-E283 PolarHBondContact O-N 2.91Å; N280-M284 WeakPolarHBondContact O-CG 3.41Å; N280-M284 PolarHBondContact O-N 2.88Å
281	R	52.4	Low	54.3	Low	174 Å²	174	93.2 Å²	93.2	66%	0.657	48%	0.476	S	S	*	.	H	α-helix	trans	-68.2	-40.3	175.5	-74.3	179.8	-178	-157.1	1.8	112.9	D277 S278 L279 E283 L285	D277-R281 WeakPolarHBondContact O-CG 3.37Å; D277-R281 PolarHBondContact O-N 3.42Å; S278-R281 PolarHBondContact O-N 2.8Å; L279-R281 VanDerWaalsContact C-N 3.26Å; L279-R281 PolarHBondContact O-N 2.99Å; R281-E283 VanDerWaalsContact C-N 3.32Å; R281-L285 WeakPolarHBondContact O-CB 3.34Å; R281-L285 VanDerWaalsContact O-CG 3.25Å; R281-L285 WeakPolarHBondContact O-CG 3.42Å; R281-L285 PolarHBondContact O-N 3.44Å
282	I	58.1	Low	55.3	Low	59 Å²	59	92.1 Å²	92.1	30%	0.303	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-40.7	175.2	-70.6	163.8	0	0	0	110.3	L221 L225 S278 L279 L285 S286	L221-I282 HydrophobicContact CD2-CG2 4.39Å; L225-I282 HydrophobicContact CD1-CG2 4.39Å; S278-I282 WeakPolarHBondContact O-CD1 3.4Å; S278-I282 VanDerWaalsContact O-CG1 3.28Å; S278-I282 WeakPolarHBondContact O-CG1 3.4Å; S278-I282 PolarHBondContact O-N 3.06Å; L279-I282 PolarHBondContact O-N 2.87Å; I282-L285 PolarHBondContact O-N 3.46Å; I282-S286 WeakPolarHBondContact O-CB 3.3Å; I282-S286 PolarHBondContact O-N 3.4Å
283	E	59.6	Low	56	Low	123 Å²	123	87.3 Å²	87.3	58%	0.575	45%	0.452	S	S	*	.	H	α-helix	trans	-65	-48	176.4	-173.7	165.5	-152.3	0	0	112	L279 N280 R281 L285 S286 M287	L279-E283 PolarHBondContact O-N 3.27Å; N280-E283 PolarHBondContact O-N 2.91Å; R281-E283 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.67Å; E283-S286 WeakPolarHBondContact O-CB 3.29Å; E283-S286 PolarHBondContact O-N 2.99Å; E283-S286 VanDerWaalsContact O-N 3.11Å; E283-M287 WeakPolarHBondContact O-CG 3.46Å; E283-M287 PolarHBondContact O-N 3.12Å
284	M	64.8	Low	56.7	Low	134 Å²	134	90.1 Å²	90.1	66%	0.66	46%	0.461	S	S	*	.	H	α-helix	trans	-58.5	-45.1	174.5	-71.7	-142.9	-53.3	0	0	112.5	N280 S286 M287 E288	N280-M284 WeakPolarHBondContact O-CG 3.41Å; N280-M284 PolarHBondContact O-N 2.88Å; M284-S286 VanDerWaalsContact C-N 3.28Å; M284-S286 PolarHBondContact O-N 3.48Å; M284-M287 PolarHBondContact O-N 3.12Å; M284-E288 WeakPolarHBondContact O-CB 3.42Å; M284-E288 PolarHBondContact O-N 3.47Å
285	L	60.8	Low	57.4	Low	97 Å²	97	92.4 Å²	92.4	51%	0.508	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-34.7	176.7	-72.6	168.7	0	0	0	111.8	R281 I282 E283 E288 L289	R281-L285 WeakPolarHBondContact O-CB 3.34Å; R281-L285 VanDerWaalsContact O-CG 3.25Å; R281-L285 WeakPolarHBondContact O-CG 3.42Å; R281-L285 PolarHBondContact O-N 3.44Å; I282-L285 PolarHBondContact O-N 3.46Å; E283-L285 PolarHBondContact O-N 2.67Å; L285-E288 PolarHBondContact O-N 2.82Å; L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 PolarHBondContact O-N 2.84Å
286	S	62.8	Low	57.9	Low	35 Å²	35	90.2 Å²	90.2	25%	0.245	46%	0.462	C	S	.	.	H	α-helix	trans	-66.7	-42.8	173.9	-170.5	0	0	0	0	111.9	V218 I282 E283 M284 L289 E290	V218-S286 VanDerWaalsContact CG1-OG 3.24Å; V218-S286 WeakPolarHBondContact CG1-OG 3.46Å; I282-S286 WeakPolarHBondContact O-CB 3.3Å; I282-S286 PolarHBondContact O-N 3.4Å; E283-S286 WeakPolarHBondContact O-CB 3.29Å; E283-S286 PolarHBondContact O-N 2.99Å; E283-S286 VanDerWaalsContact O-N 3.11Å; M284-S286 VanDerWaalsContact C-N 3.28Å; M284-S286 PolarHBondContact O-N 3.48Å; S286-L289 PolarHBondContact O-N 2.97Å; S286-E290 PolarHBondContact O-N 3.45Å
287	M	67.9	Low	57.8	Low	112 Å²	112	89 Å²	89	55%	0.552	46%	0.455	S	S	*	.	H	α-helix	trans	-64.6	-40.1	174.6	-68.3	-179.7	73.3	0	0	111.9	E283 M284 E290 N291	E283-M287 WeakPolarHBondContact O-CG 3.46Å; E283-M287 PolarHBondContact O-N 3.12Å; M284-M287 PolarHBondContact O-N 3.12Å; M287-E290 PolarHBondContact O-N 3.5Å; M287-N291 WeakPolarHBondContact O-CB 3.07Å; M287-N291 PolarHBondContact O-N 3.01Å; M287-N291 PolarHBondContact O-ND2 2.99Å
288	E	68.3	Low	57.7	Low	126 Å²	126	89.2 Å²	89.2	59%	0.589	46%	0.456	S	S	*	.	H	α-helix	trans	-64.7	-43.3	176.1	-170.2	173.4	-159	0	0	111.5	M284 L285 N291 S292	M284-E288 WeakPolarHBondContact O-CB 3.42Å; M284-E288 PolarHBondContact O-N 3.47Å; L285-E288 PolarHBondContact O-N 2.82Å; E288-N291 PolarHBondContact O-N 3.48Å; E288-S292 WeakPolarHBondContact O-CB 3.42Å; E288-S292 PolarHBondContact O-N 2.98Å
289	L	63	Low	57.5	Low	76 Å²	76	95.5 Å²	95.5	40%	0.398	48%	0.482	S	S	.	.	H	α-helix	trans	-59.6	-46.7	172	-105.9	63	0	0	0	112.2	L214 L285 S286 N291 S292 T293	L214-L289 HydrophobicContact CD1-CD2 4.18Å; L214-L289 HydrophobicContact CD2-CB 4.12Å; L214-L289 HydrophobicContact CD2-CD2 3.9Å; L214-L289 HydrophobicContact CD2-CG 3.92Å; L214-L289 HydrophobicContact CG-CD2 4.31Å; L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 PolarHBondContact O-N 2.84Å; S286-L289 PolarHBondContact O-N 2.97Å; L289-N291 PolarHBondContact O-N 3.1Å; L289-S292 PolarHBondContact O-N 3.33Å; L289-T293 WeakPolarHBondContact O-CB 3.08Å; L289-T293 PolarHBondContact O-N 3.03Å; L289-T293 PolarHBondContact O-OG1 3.37Å
290	E	64.5	Low	57	Low	70 Å²	70	97.8 Å²	97.8	33%	0.327	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-43.8	176.6	-90.6	-153.6	-168.9	0	0	111.9	S286 M287 T293 K294	S286-E290 PolarHBondContact O-N 3.45Å; M287-E290 PolarHBondContact O-N 3.5Å; E290-T293 PolarHBondContact O-N 3.36Å; E290-K294 WeakPolarHBondContact O-CB 3.12Å; E290-K294 WeakPolarHBondContact O-CD 3.31Å; E290-K294 WeakPolarHBondContact O-CG 3.48Å; E290-K294 PolarHBondContact O-N 3.32Å; E290-K294 VanDerWaalsContact OE2-CE 3.27Å; E290-K294 WeakPolarHBondContact OE2-CE 3.29Å; E290-K294 IonicContact OE2-NZ 3.54Å; E290-K294 PolarHBondContact OE2-NZ 3.4Å
291	N	68.7	Low	56.2	Low	87 Å²	87	103.2 Å²	103.2	47%	0.465	51%	0.508	S	S	.	.	H	α-helix	trans	-68.6	-39.5	-178.9	-70.8	-23.2	0	0	0	112.1	M287 E288 L289 T293 K294 Q295	M287-N291 WeakPolarHBondContact O-CB 3.07Å; M287-N291 PolarHBondContact O-N 3.01Å; M287-N291 PolarHBondContact O-ND2 2.99Å; E288-N291 PolarHBondContact O-N 3.48Å; L289-N291 PolarHBondContact O-N 3.1Å; N291-T293 VanDerWaalsContact C-N 3.35Å; N291-K294 PolarHBondContact O-N 3.3Å; N291-Q295 PolarHBondContact O-N 3.31Å
292	S	60.9	Low	55.6	Low	72 Å²	72	103.6 Å²	103.6	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-39.2	172.3	-171.5	0	0	0	0	112.2	E288 L289 Q295 T296	E288-S292 WeakPolarHBondContact O-CB 3.42Å; E288-S292 PolarHBondContact O-N 2.98Å; L289-S292 PolarHBondContact O-N 3.33Å; S292-Q295 PolarHBondContact O-N 3.34Å; S292-T296 PolarHBondContact O-N 2.74Å; S292-T296 PolarHBondContact O-OG1 3.27Å
293	T	56	Low	54.6	Low	35 Å²	35	106.7 Å²	106.7	22%	0.215	54%	0.537	C	S	.	.	H	α-helix	trans	-66.1	-44.8	175.1	-55.5	0	0	0	0	111.3	L214 L289 E290 N291 Q295 T296 C297	L214-T293 WeakPolarHBondContact CD2-OG1 3.26Å; L289-T293 WeakPolarHBondContact O-CB 3.08Å; L289-T293 PolarHBondContact O-N 3.03Å; L289-T293 PolarHBondContact O-OG1 3.37Å; E290-T293 PolarHBondContact O-N 3.36Å; N291-T293 VanDerWaalsContact C-N 3.35Å; T293-Q295 VanDerWaalsContact C-N 3.33Å; T293-Q295 PolarHBondContact O-N 3.39Å; T293-T296 WeakPolarHBondContact CA-OG1 3.23Å; T293-T296 PolarHBondContact O-N 3.49Å; T293-T296 PolarHBondContact O-OG1 3.21Å; T293-T296 VanDerWaalsContact O-OG1 3.07Å; T293-C297 WeakPolarHBondContact O-CB 3.32Å; T293-C297 PolarHBondContact O-N 3.14Å; T293-C297 PolarHBondContact O-SG 3.41Å; T293-C297 VanDerWaalsContact O-SG 3.34Å
294	K	56.2	Low	53.3	Low	103 Å²	103	106 Å²	106	45%	0.448	55%	0.545	S	S	.	.	H	α-helix	trans	-59.5	-41.9	174.9	-69.6	160	-165	168.1	0	111.4	E290 N291 L298	E290-K294 WeakPolarHBondContact O-CB 3.12Å; E290-K294 WeakPolarHBondContact O-CD 3.31Å; E290-K294 WeakPolarHBondContact O-CG 3.48Å; E290-K294 PolarHBondContact O-N 3.32Å; E290-K294 VanDerWaalsContact OE2-CE 3.27Å; E290-K294 WeakPolarHBondContact OE2-CE 3.29Å; E290-K294 IonicContact OE2-NZ 3.54Å; E290-K294 PolarHBondContact OE2-NZ 3.4Å; N291-K294 PolarHBondContact O-N 3.3Å; K294-L298 WeakPolarHBondContact O-CG 3.43Å; K294-L298 PolarHBondContact O-N 2.99Å; K294-L298 VanDerWaalsContact O-N 3.14Å
295	Q	54.8	Low	51.8	Low	124 Å²	124	105.1 Å²	105.1	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-66.1	-40.3	175.6	-76.6	-164.5	7.4	0	0	113.7	N291 S292 T293 L298 K299	N291-Q295 PolarHBondContact O-N 3.31Å; S292-Q295 PolarHBondContact O-N 3.34Å; T293-Q295 VanDerWaalsContact C-N 3.33Å; T293-Q295 PolarHBondContact O-N 3.39Å; Q295-L298 PolarHBondContact O-N 3.08Å; Q295-K299 PolarHBondContact O-N 3.25Å; Q295-K299 VanDerWaalsContact O-N 3.08Å
296	T	48	Very low	50.7	Low	73 Å²	73	105.5 Å²	105.5	45%	0.448	56%	0.56	S	S	.	*	H	α-helix	trans	-70.9	-37.7	178.1	38.7	0	0	0	0	112.3	S292 T293 L298 K299 N300	S292-T296 PolarHBondContact O-N 2.74Å; S292-T296 PolarHBondContact O-OG1 3.27Å; T293-T296 WeakPolarHBondContact CA-OG1 3.23Å; T293-T296 PolarHBondContact O-N 3.49Å; T293-T296 PolarHBondContact O-OG1 3.21Å; T293-T296 VanDerWaalsContact O-OG1 3.07Å; T296-L298 VanDerWaalsContact C-N 3.3Å; T296-L298 PolarHBondContact O-N 3.33Å; T296-K299 PolarHBondContact O-N 3.39Å; T296-N300 PolarHBondContact O-N 3.18Å
297	C	43	Very low	49.4	Very low	76 Å²	76	113.5 Å²	113.5	51%	0.514	59%	0.591	S	S	.	*	H	α-helix	trans	-63.4	-31.4	172.1	-69.8	0	0	0	0	113.6	T293	T293-C297 WeakPolarHBondContact O-CB 3.32Å; T293-C297 PolarHBondContact O-N 3.14Å; T293-C297 PolarHBondContact O-SG 3.41Å; T293-C297 VanDerWaalsContact O-SG 3.34Å
298	L	43	Very low	47.9	Very low	108 Å²	108	120.5 Å²	120.5	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-75	-43.8	175	-73.8	169.5	0	0	0	112.3	K294 Q295 T296 N300 R301	K294-L298 WeakPolarHBondContact O-CG 3.43Å; K294-L298 PolarHBondContact O-N 2.99Å; K294-L298 VanDerWaalsContact O-N 3.14Å; Q295-L298 PolarHBondContact O-N 3.08Å; T296-L298 VanDerWaalsContact C-N 3.3Å; T296-L298 PolarHBondContact O-N 3.33Å; L298-N300 VanDerWaalsContact C-N 3.27Å; L298-N300 PolarHBondContact O-N 3.28Å; L298-R301 PolarHBondContact O-N 2.99Å
299	K	45.2	Very low	46.3	Very low	149 Å²	149	119.3 Å²	119.3	65%	0.648	62%	0.616	S	S	*	*	H	α-helix	trans	-61.2	-34.7	178.3	-75.5	175.7	177.7	172.7	0	112.6	Q295 T296 R301	Q295-K299 PolarHBondContact O-N 3.25Å; Q295-K299 VanDerWaalsContact O-N 3.08Å; T296-K299 PolarHBondContact O-N 3.39Å; K299-R301 VanDerWaalsContact C-N 3.34Å; K299-R301 PolarHBondContact O-N 2.78Å
300	N	42.3	Very low	45	Very low	132 Å²	132	122.3 Å²	122.3	71%	0.706	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	6.4	-179.5	-68.8	-1.5	0	0	0	114.8	T296 L298	T296-N300 PolarHBondContact O-N 3.18Å; L298-N300 VanDerWaalsContact C-N 3.27Å; L298-N300 PolarHBondContact O-N 3.28Å
301	R	40	Very low	43.7	Very low	203 Å²	203	127.8 Å²	127.8	77%	0.766	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-7.6	176.1	-91.9	-173.6	175.4	177.7	0.6	115.4	L298 K299	L298-R301 PolarHBondContact O-N 2.99Å; K299-R301 VanDerWaalsContact C-N 3.34Å; K299-R301 PolarHBondContact O-N 2.78Å
302	F	39.5	Very low	42.2	Very low	182 Å²	182	128.9 Å²	128.9	80%	0.798	67%	0.671	S	S	*	*	S	Bend	trans	-104.5	34.7	-176.5	-81.9	-81.1	0	0	0	114.4
303	T	37.1	Very low	41	Very low	124 Å²	124	131.4 Å²	131.4	76%	0.761	69%	0.686	S	S	*	*			trans	-136.1	45.7	178.5	47.3	0	0	0	0	113.2
304	S	32.8	Very low	40	Very low	107 Å²	107	135 Å²	135	75%	0.748	71%	0.713	S	S	*	*			trans	-139.9	93.6	179.6	62.9	0	0	0	0	114.7
305	S	33.5	Very low	39	Very low	116 Å²	116	136 Å²	136	81%	0.811	73%	0.727	S	S	*	*			trans	-170.1	153.3	164.6	-151.1	0	0	0	0	111
306	P	36.2	Very low	37.9	Very low	105 Å²	105	137.6 Å²	137.6	68%	0.682	74%	0.739	S	S	*	*				-134.2	160.6	-52.1	38.4	-25.4	0	0	0	114.4
307	K	36.6	Very low	37	Very low	203 Å²	203	139.4 Å²	139.4	88%	0.883	75%	0.75	S	S	*	*			trans	20.7	113	149.3	-58.7	177.9	-179.2	179	0	119.3
308	R	37	Very low	36.5	Very low	260 Å²	260	144.3 Å²	144.3	98%	0.981	76%	0.763	S	S	*	*			trans	-136.9	159	138.7	-90.5	-168.4	174.4	-175	-1.9	110.3
309	S	33.9	Very low	35.9	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	76%	0.761	S	S	*	*			trans	-122.6	144.4	-157.5	55.1	0	0	0	0	114.5
310	I	35.7	Very low	35.2	Very low	140 Å²	140	140.5 Å²	140.5	72%	0.718	76%	0.758	S	S	*	*			trans	53.1	101.2	149.3	-53.1	160.6	0	0	0	116.2
311	H	38	Very low	34.7	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.856	75%	0.753	S	S	*	*				-167.9	160	109	-99	-71.2	0	0	0	110.1
312	S	37.4	Very low	34.4	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	76%	0.757	S	S	*	*			trans	-129.5	178.6	-167	-51.2	0	0	0	0	110.5
313	P	36	Very low	34	Very low	124 Å²	124	136.8 Å²	136.8	81%	0.805	76%	0.755	S	S	*	*				-134.3	160.5	-52.7	36.7	-21.9	0	0	0	113.5
314	S	33.7	Very low	33.8	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	75%	0.749	S	S	*	*			trans	-166.6	104.3	161.5	-155.7	0	0	0	0	109.4
315	V	34.7	Very low	33.6	Very low	123 Å²	123	138.2 Å²	138.2	75%	0.745	75%	0.748	S	S	*	*				96.4	127.6	81.4	164.5	0	0	0	0	113.9
316	D	32.1	Very low	33.4	Very low	157 Å²	157	139 Å²	139	84%	0.84	74%	0.742	S	S	*	*			trans	69.3	153.3	164.8	-73.7	-23.2	0	0	0	123.5
317	V	29.3	Very low	33.1	Very low	112 Å²	112	141.4 Å²	141.4	68%	0.679	74%	0.744	S	S	*	*			trans	-142.7	134.4	-156.8	171.7	0	0	0	0	111.5
318	K	33.1	Very low	32.7	Very low	179 Å²	179	137.8 Å²	137.8	78%	0.778	74%	0.739	S	S	*	*			trans	-168.6	115.2	140.8	-97.5	135.7	-167.5	169.3	0	113.8	V340	K318-V340 HydrophobicContact CB-CG1 3.74Å; K318-V340 HydrophobicContact CG-CG1 3.35Å
319	V	29.9	Very low	32.3	Very low	85 Å²	85	130.4 Å²	130.4	52%	0.515	72%	0.724	S	S	.	*	P	Polyproline II helix	trans	-75.4	172.8	-179.4	176.3	0	0	0	0	113	V340 G341 G342	V319-V340 CarbonylContact C-O 3.54Å; V319-V340 HydrophobicContact CB-CB 4.25Å; V319-V340 HydrophobicContact CB-CG1 4.15Å; V319-V340 VanDerWaalsContact N-CG1 3.28Å; V319-V340 CarbonylContact O-C 3.28Å; V319-V340 VanDerWaalsContact O-C 3.28Å; V319-G341 CarbonylContact O-C 2.78Å; V319-G341 VanDerWaalsContact O-CA 3.25Å; V319-G341 WeakPolarHBondContact O-CA 3.42Å; V319-G341 PolarHBondContact O-N 2.91Å; V319-G341 VanDerWaalsContact O-O 3.11Å; V319-G342 WeakPolarHBondContact O-CA 3.21Å; V319-G342 PolarHBondContact O-N 2.76Å
320	P	30.6	Very low	32	Very low	92 Å²	92	137 Å²	137	60%	0.597	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-92.5	154.7	175.9	-9.9	29.7	0	0	0	118.5	V340	P320-V340 CarbonylContact C-O 3.06Å; P320-V340 VanDerWaalsContact O-O 3.08Å
321	D	32.4	Very low	31.5	Very low	113 Å²	113	137.4 Å²	137.4	60%	0.604	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-97.7	157.2	166.5	-90	-47.6	0	0	0	111.7	G341	D321-G341 WeakPolarHBondContact OD2-CA 3.03Å
322	I	32.5	Very low	31	Very low	164 Å²	164	132 Å²	132	84%	0.841	74%	0.737	S	S	*	*			trans	-135.3	148.4	-175.4	-60.6	174.1	0	0	0	110.9
323	E	31.6	Very low	30.6	Very low	161 Å²	161	134.8 Å²	134.8	75%	0.752	74%	0.742	S	S	*	*			trans	-134.3	150.4	171.2	-140.8	-173.8	-127.2	0	0	111.2
324	N	32.9	Very low	30	Very low	120 Å²	120	135.5 Å²	135.5	64%	0.642	74%	0.743	S	S	*	*			trans	73.3	138.6	164.4	-59.8	-44.2	0	0	0	118.6
325	I	29.6	Very low	29.9	Very low	141 Å²	141	136.9 Å²	136.9	72%	0.723	75%	0.747	S	S	*	*			cis	-166.7	166.9	-16	-138.3	168.3	0	0	0	111.5
326	I	27.6	Very low	29.5	Very low	133 Å²	133	134.1 Å²	134.1	68%	0.682	74%	0.743	S	S	*	*			trans	86.5	124.7	157.4	-90.7	168.6	0	0	0	122.9
327	E	30	Very low	29.3	Very low	156 Å²	156	132.2 Å²	132.2	73%	0.729	75%	0.749	S	S	*	*			trans	66.2	92.9	144.3	-67.8	165.5	-159	0	0	125.5
328	T	29.9	Very low	29.3	Very low	126 Å²	126	130.6 Å²	130.6	77%	0.773	76%	0.755	S	S	*	*				48.2	157.2	114.7	56.1	0	0	0	0	123.7
329	P	27.4	Very low	29	Very low	105 Å²	105	129 Å²	129	68%	0.682	75%	0.753	S	S	*	*			cis	-140.3	155.5	-32.5	37.5	-21.1	0	0	0	115
330	R	27	Very low	29.1	Very low	238 Å²	238	127.2 Å²	127.2	90%	0.898	74%	0.743	S	S	*	*			trans	161.3	149.3	135.9	-90.7	160.9	-179.7	-171.7	0.2	112.2
331	V	26.1	Very low	29.1	Very low	150 Å²	150	124.6 Å²	124.6	91%	0.909	73%	0.733	S	S	*	*			trans	29.8	99.6	158.4	-170.5	0	0	0	0	116.9
332	G	26.9	Very low	29	Very low	70 Å²	70	120.7 Å²	120.7	72%	0.722	72%	0.719	S	S	*	*			trans	-149.5	133.9	172.5	0	0	0	0	0	112.7
333	I	28.6	Very low	29.1	Very low	170 Å²	170	122.5 Å²	122.5	87%	0.872	72%	0.721	S	S	*	*			trans	-80.4	145.1	178	-67.1	164	0	0	0	109.6
334	V	24.4	Very low	29.2	Very low	138 Å²	138	120.5 Å²	120.5	84%	0.836	72%	0.719	S	S	*	*			trans	-106.9	115.9	178.6	179.2	0	0	0	0	111.4
335	V	30.5	Very low	29.4	Very low	142 Å²	142	124 Å²	124	86%	0.861	73%	0.729	S	S	*	*			trans	-133.6	144.1	151.6	-176.4	0	0	0	0	105.3
336	G	27	Very low	29.5	Very low	64 Å²	64	121.1 Å²	121.1	66%	0.66	72%	0.72	S	S	*	*			trans	-150	-154.5	-166.9	0	0	0	0	0	116
337	A	27.4	Very low	30	Very low	117 Å²	117	125.9 Å²	125.9	97%	0.967	73%	0.73	S	S	*	*			trans	82.1	132	-173.7	0	0	0	0	0	116.4
338	G	29.4	Very low	30.3	Very low	79 Å²	79	127 Å²	127	81%	0.814	73%	0.732	S	S	*	*			trans	144.7	93.2	179.2	0	0	0	0	0	112.3
339	I	26.7	Very low	30.6	Very low	144 Å²	144	125.9 Å²	125.9	74%	0.738	73%	0.73	S	S	*	*			trans	-122	163.7	-177.9	-61.1	164.2	0	0	0	108.3
340	V	32.2	Very low	31.1	Very low	49 Å²	49	124.3 Å²	124.3	30%	0.297	73%	0.726	S	S	.	*			trans	-177	146.2	132.5	150.2	0	0	0	0	109.7	K318 V319 P320	K318-V340 HydrophobicContact CB-CG1 3.74Å; K318-V340 HydrophobicContact CG-CG1 3.35Å; V319-V340 CarbonylContact C-O 3.54Å; V319-V340 HydrophobicContact CB-CB 4.25Å; V319-V340 HydrophobicContact CB-CG1 4.15Å; V319-V340 VanDerWaalsContact N-CG1 3.28Å; V319-V340 CarbonylContact O-C 3.28Å; V319-V340 VanDerWaalsContact O-C 3.28Å; P320-V340 CarbonylContact C-O 3.06Å; P320-V340 VanDerWaalsContact O-O 3.08Å
341	G	31.5	Very low	31.6	Very low	37 Å²	37	120.9 Å²	120.9	38%	0.381	72%	0.72	S	S	.	*			trans	-105.5	145.4	-167.6	0	0	0	0	0	117.1	V319 D321	V319-G341 CarbonylContact O-C 2.78Å; V319-G341 VanDerWaalsContact O-CA 3.25Å; V319-G341 WeakPolarHBondContact O-CA 3.42Å; V319-G341 PolarHBondContact O-N 2.91Å; V319-G341 VanDerWaalsContact O-O 3.11Å; D321-G341 WeakPolarHBondContact OD2-CA 3.03Å
342	G	30.3	Very low	32.2	Very low	30 Å²	30	120.1 Å²	120.1	31%	0.309	71%	0.711	S	S	.	*			trans	-148.1	-178	-163.7	0	0	0	0	0	111.7	V319	V319-G342 WeakPolarHBondContact O-CA 3.21Å; V319-G342 PolarHBondContact O-N 2.76Å
343	K	33.9	Very low	32.7	Very low	203 Å²	203	122.2 Å²	122.2	88%	0.883	71%	0.714	S	S	*	*			trans	-165	-172.1	-172.5	-111.4	128.8	179.9	165.5	0	114.8
344	V	34.1	Very low	33.3	Very low	118 Å²	118	119.5 Å²	119.5	72%	0.715	71%	0.708	S	S	*	*			trans	89.9	118.9	165.1	-173.7	0	0	0	0	112.5
345	K	35.8	Very low	33.7	Very low	195 Å²	195	118.8 Å²	118.8	85%	0.848	70%	0.703	S	S	*	*			cis	-163.2	-177.1	14	-110.9	167.2	-167	159.7	0	107.6
346	S	33.5	Very low	34.2	Very low	79 Å²	79	117.7 Å²	117.7	55%	0.552	70%	0.702	S	S	*	*			cis	-175.7	134.6	-7.3	149.5	0	0	0	0	111.6
347	R	36.8	Very low	34.7	Very low	233 Å²	233	123.4 Å²	123.4	88%	0.879	71%	0.711	S	S	*	*			trans	67.8	154.7	158.8	-65.7	167.5	-177	175.3	-0.4	116.8
348	K	36	Very low	35.8	Very low	180 Å²	180	123.3 Å²	123.3	78%	0.783	70%	0.701	S	S	*	*			cis	-156.6	154.9	-1.2	-134.3	-167.6	174	-170.2	0	110.6
349	S	36	Very low	36.3	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	70%	0.697	S	S	*	*			trans	40.9	147.9	138.8	-65.1	0	0	0	0	122.7
350	A	38.5	Very low	36.7	Very low	73 Å²	73	124.8 Å²	124.8	60%	0.603	70%	0.698	S	S	*	*			cis	-172.6	170.3	-6.6	0	0	0	0	0	111.6
351	E	37.9	Very low	36.8	Very low	165 Å²	165	128.9 Å²	128.9	77%	0.771	72%	0.718	S	S	*	*			trans	66.3	151.9	154.7	-70.8	176.2	111.2	0	0	119.5
352	N	38.7	Very low	37.1	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	74%	0.737	S	S	*	*			cis	-146.9	170.2	-8.6	-120.5	-26.8	0	0	0	114.7
353	S	37.3	Very low	37.3	Very low	113 Å²	113	142 Å²	142	79%	0.79	76%	0.762	S	S	*	*			trans	-89.8	-179.4	-163.8	-106.5	0	0	0	0	116.3
354	P	41.4	Very low	37.3	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	75%	0.749	S	S	*	*			trans	-131.1	-146.5	-145.2	38.5	-16	0	0	0	115.1
355	V	33.7	Very low	37.4	Very low	123 Å²	123	139.9 Å²	139.9	75%	0.745	75%	0.754	S	S	*	*			trans	88.8	123.4	163	-175.7	0	0	0	0	118.8
356	S	39.4	Very low	37.5	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	75%	0.751	S	S	*	*				-168.1	163.1	129	-82.1	0	0	0	0	111.8
357	Q	39	Very low	37.8	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	76%	0.761	S	S	*	*			trans	-117.5	163.7	-166.9	-85.7	-179.1	-39.5	0	0	113.9
358	P	49.4	Very low	37.9	Very low	115 Å²	115	133.3 Å²	133.3	75%	0.747	75%	0.751	S	S	*	*			trans	-82.7	177.6	179.1	36.8	-38.5	0	0	0	113.3
359	P	40.1	Very low	38	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	75%	0.745	S	S	*	*				-149.8	155.6	112	39.2	-23.6	0	0	0	117.7
360	D	35.8	Very low	38.2	Very low	143 Å²	143	132.6 Å²	132.6	77%	0.765	75%	0.749	S	S	*	*			trans	44.9	134.4	136.3	-58.2	-6.8	0	0	0	126.1
361	N	34.3	Very low	38.3	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	76%	0.756	S	S	*	*				113.4	146.7	118.7	-110.4	-49.1	0	0	0	123.1
362	K	37.6	Very low	38.8	Very low	177 Å²	177	131.7 Å²	131.7	77%	0.77	75%	0.754	S	S	*	*			trans	72.7	90.9	158.7	-67.1	173.2	-177.7	174.7	0	122.4
363	I	33.7	Very low	39	Very low	164 Å²	164	130.4 Å²	130.4	84%	0.841	76%	0.756	S	S	*	*				26.1	123.5	111.5	-53.2	166.2	0	0	0	118.4
364	S	34.8	Very low	39.1	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	76%	0.756	S	S	*	*				165.6	113.5	121.8	172	0	0	0	0	116.9
365	K	35.2	Very low	39.1	Very low	189 Å²	189	134.5 Å²	134.5	82%	0.822	75%	0.753	S	S	*	*			trans	63.3	166.2	147.7	-55.3	172.7	-174.5	174.5	0	116.2
366	Q	38.5	Very low	39.3	Very low	166 Å²	166	134 Å²	134	78%	0.776	75%	0.75	S	S	*	*			cis	-167.3	134.2	26.7	-158.7	168.8	-15.8	0	0	113.8
367	S	38.7	Very low	39.2	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	74%	0.742	S	S	*	*			trans	59.9	165.6	146.7	72.3	0	0	0	0	121.3
368	S	39	Very low	39.3	Very low	96 Å²	96	129.6 Å²	129.6	67%	0.671	74%	0.735	S	S	*	*			cis	-157.9	161.9	11.3	56.7	0	0	0	0	114.8
369	S	38.6	Very low	38.9	Very low	95 Å²	95	130.8 Å²	130.8	66%	0.664	74%	0.735	S	S	*	*			trans	59.2	153	148.5	48.2	0	0	0	0	121.4
370	Q	41.2	Very low	38.9	Very low	171 Å²	171	131.1 Å²	131.1	80%	0.799	74%	0.74	S	S	*	*			cis	-162.7	138.8	-9.5	-103.6	161	6.5	0	0	106.5
371	S	39.9	Very low	39.1	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	73%	0.731	S	S	*	*				86	157.1	63.8	-57.9	0	0	0	0	115
372	P	49.5	Very low	39.3	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	74%	0.738	S	S	*	*				-146.4	-165.5	-50.7	43.8	-26.4	0	0	0	115.4
373	S	41.2	Very low	39.4	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	74%	0.737	S	S	*	*			trans	85.9	146.8	156.8	82.2	0	0	0	0	118.2
374	K	41.3	Very low	39.5	Very low	183 Å²	183	126.8 Å²	126.8	80%	0.796	72%	0.721	S	S	*	*			cis	-157.2	-172	-0.8	-123.4	169.1	178.3	179.9	0	107.3
375	I	40.1	Very low	39.5	Very low	130 Å²	130	130.5 Å²	130.5	67%	0.667	73%	0.729	S	S	*	*			cis	-156.6	133.8	8	-131.5	153.4	0	0	0	105
376	T	38	Very low	39.3	Very low	112 Å²	112	129.8 Å²	129.8	69%	0.687	73%	0.729	S	S	*	*				65.9	122.8	80.1	-45.8	0	0	0	0	114.3
377	T	38.5	Very low	38.9	Very low	109 Å²	109	127.4 Å²	127.4	67%	0.669	73%	0.726	S	S	*	*			cis	-122.8	-121.5	5	-37.3	0	0	0	0	110.5
378	S	40.5	Very low	38.5	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	73%	0.733	S	S	*	*			cis	-172.7	162.4	-12.7	16.7	0	0	0	0	109.3
379	N	39.9	Very low	38.1	Very low	141 Å²	141	130.6 Å²	130.6	75%	0.754	74%	0.737	S	S	*	*			cis	-174.4	141	-28.6	-94.9	-14.4	0	0	0	110.7
380	S	40.1	Very low	38	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	75%	0.746	S	S	*	*			trans	69.4	139.6	154.1	-160.6	0	0	0	0	120.9
381	S	39.9	Very low	37.7	Very low	85 Å²	85	132.7 Å²	132.7	59%	0.594	75%	0.745	S	S	*	*			cis	-169.4	162.3	-20	61.9	0	0	0	0	113.1
382	K	40.2	Very low	37.9	Very low	199 Å²	199	136.8 Å²	136.8	87%	0.865	75%	0.749	S	S	*	*			trans	67.8	152.5	159.9	-66.5	169.6	-177.4	175.1	0	118.5
383	K	37.9	Very low	37.7	Very low	172 Å²	172	140 Å²	140	75%	0.748	75%	0.754	S	S	*	*			cis	-167.1	148.8	-27.1	-169.2	-155	167.6	-127.4	0	108.8
384	S	37.7	Very low	37.7	Very low	73 Å²	73	139.4 Å²	139.4	51%	0.51	76%	0.756	S	S	.	*			trans	68	116.6	153.5	35.5	0	0	0	0	121.3
385	E	33.9	Very low	38.5	Very low	167 Å²	167	134.1 Å²	134.1	78%	0.78	74%	0.739	S	S	*	*				78	108.5	125.2	-69	154	152	0	0	122.1
386	E	31.4	Very low	39.7	Very low	173 Å²	173	131.5 Å²	131.5	81%	0.808	73%	0.731	S	S	*	*				85.7	138.3	125.6	-162.8	152.4	-135.2	0	0	121.6
387	T	29	Very low	39.8	Very low	117 Å²	117	135.7 Å²	135.7	72%	0.718	74%	0.735	S	S	*	*			trans	51.3	111.3	170.3	46.9	0	0	0	0	119.4
388	T	32.1	Very low	40.9	Very low	147 Å²	147	132.4 Å²	132.4	90%	0.902	72%	0.722	S	S	*	*				-175.3	164	103.9	24.6	0	0	0	0	113.1
389	T	30.3	Very low	41.8	Very low	124 Å²	124	132.3 Å²	132.3	76%	0.761	71%	0.711	S	S	*	*			trans	-71.8	130.4	-176.3	47.3	0	0	0	0	114.7
390	E	35.7	Very low	42.1	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	70%	0.697	S	S	*	*			trans	-89.7	107.9	156.7	-77.3	-165.6	154.8	0	0	110.8
391	V	34.4	Very low	42.4	Very low	126 Å²	126	129.4 Å²	129.4	76%	0.764	68%	0.676	S	S	*	*			trans	-83.1	111.9	169.6	177.2	0	0	0	0	108.3	E393	V391-E393 PolarHBondContact O-N 2.85Å
392	K	45.4	Very low	43	Very low	192 Å²	192	134.3 Å²	134.3	84%	0.835	68%	0.682	S	S	*	*			trans	-71.6	129.5	172.9	-72.5	-170.7	174.8	-177.3	0	110.3
393	E	45.2	Very low	43.5	Very low	182 Å²	182	129.7 Å²	129.7	85%	0.85	67%	0.666	S	S	*	*			trans	-60.7	151.5	-168	-65.4	174.9	103	0	0	114.1	V391 V395	V391-E393 PolarHBondContact O-N 2.85Å; E393-V395 PolarHBondContact O-N 3.29Å; E393-V395 VanDerWaalsContact O-N 3.11Å
394	A	41	Very low	43.8	Very low	94 Å²	94	128.4 Å²	128.4	78%	0.777	67%	0.666	S	S	*	*			trans	-72.3	104.3	179.7	0	0	0	0	0	111.2	S396	A394-S396 PolarHBondContact O-N 3.38Å
395	V	57.6	Low	44.1	Very low	72 Å²	72	133.6 Å²	133.6	44%	0.436	68%	0.68	S	S	.	*			trans	-47.1	123.3	174.4	176.7	0	0	0	0	110.9	E393 E399 R400	E393-V395 PolarHBondContact O-N 3.29Å; E393-V395 VanDerWaalsContact O-N 3.11Å; V395-E399 HydrophobicContact CG1-CB 4.17Å; V395-E399 HydrophobicContact CG1-CG 4.28Å; V395-R400 PolarHBondContact O-NH2 2.59Å
396	S	64.7	Low	44.5	Very low	74 Å²	74	134.2 Å²	134.2	52%	0.517	68%	0.675	S	S	.	*			trans	-50.4	139.7	-175.4	176.8	0	0	0	0	112.9	A394 G398 E399 R400	A394-S396 PolarHBondContact O-N 3.38Å; S396-G398 VanDerWaalsContact C-N 3.3Å; S396-G398 PolarHBondContact O-N 3.04Å; S396-E399 WeakPolarHBondContact O-CB 3.32Å; S396-E399 PolarHBondContact O-N 2.83Å; S396-R400 PolarHBondContact O-N 3.09Å
397	W	41.6	Very low	45	Very low	201 Å²	201	132 Å²	132	76%	0.761	68%	0.675	S	S	*	*	H	α-helix	trans	-54.5	-43.5	-178.3	-116.9	94.5	0	0	0	112.6	E399 R400 I401	W397-E399 VanDerWaalsContact C-N 3.29Å; W397-E399 PolarHBondContact O-N 2.96Å; W397-R400 WeakPolarHBondContact O-CB 3.33Å; W397-R400 PolarHBondContact O-N 2.89Å; W397-I401 HydrophobicContact CE3-CD1 3.89Å; W397-I401 HydrophobicContact CE3-CG1 4.32Å; W397-I401 HydrophobicContact CZ3-CD1 4.18Å; W397-I401 WeakPolarHBondContact O-CG1 3.37Å; W397-I401 PolarHBondContact O-N 3.28Å
398	G	60.8	Low	45.9	Very low	39 Å²	39	130.2 Å²	130.2	40%	0.402	67%	0.668	S	S	.	*	H	α-helix	trans	-67.2	-28.3	177.8	0	0	0	0	0	113.7	S396 R402	S396-G398 VanDerWaalsContact C-N 3.3Å; S396-G398 PolarHBondContact O-N 3.04Å; G398-R402 WeakPolarHBondContact O-CG 3.17Å; G398-R402 PolarHBondContact O-N 3.39Å
399	E	59	Low	46.7	Very low	100 Å²	100	128.1 Å²	128.1	47%	0.467	66%	0.655	S	S	.	*	H	α-helix	trans	-77.8	-37.1	176.4	-166.7	154.2	-117	0	0	111.5	V395 S396 W397 I401 R402 L403	V395-E399 HydrophobicContact CG1-CB 4.17Å; V395-E399 HydrophobicContact CG1-CG 4.28Å; S396-E399 WeakPolarHBondContact O-CB 3.32Å; S396-E399 PolarHBondContact O-N 2.83Å; W397-E399 VanDerWaalsContact C-N 3.29Å; W397-E399 PolarHBondContact O-N 2.96Å; E399-I401 VanDerWaalsContact C-N 3.3Å; E399-I401 PolarHBondContact O-N 3.47Å; E399-R402 WeakPolarHBondContact O-CB 3.38Å; E399-R402 PolarHBondContact O-N 3.44Å; E399-R402 VanDerWaalsContact O-N 3.16Å; E399-L403 WeakPolarHBondContact O-CG 3.14Å; E399-L403 PolarHBondContact O-N 3.03Å
400	R	45.5	Very low	47.5	Very low	121 Å²	121	129.9 Å²	129.9	46%	0.457	65%	0.648	S	S	.	*	H	α-helix	trans	-60.3	-39.2	170.3	-155.3	173.8	-61.3	-172.8	3.8	111.8	V395 S396 W397 L403 L404	V395-R400 PolarHBondContact O-NH2 2.59Å; S396-R400 PolarHBondContact O-N 3.09Å; W397-R400 WeakPolarHBondContact O-CB 3.33Å; W397-R400 PolarHBondContact O-N 2.89Å; R400-L403 PolarHBondContact O-N 3.05Å; R400-L404 WeakPolarHBondContact O-CG 3.48Å; R400-L404 PolarHBondContact O-N 3.29Å
401	I	46.9	Very low	48.4	Very low	76 Å²	76	124.6 Å²	124.6	39%	0.39	64%	0.636	S	S	.	*	H	α-helix	trans	-66.3	-43.2	172	-68	169.2	0	0	0	111.7	W397 E399 L403 L404 K405	W397-I401 HydrophobicContact CE3-CD1 3.89Å; W397-I401 HydrophobicContact CE3-CG1 4.32Å; W397-I401 HydrophobicContact CZ3-CD1 4.18Å; W397-I401 WeakPolarHBondContact O-CG1 3.37Å; W397-I401 PolarHBondContact O-N 3.28Å; E399-I401 VanDerWaalsContact C-N 3.3Å; E399-I401 PolarHBondContact O-N 3.47Å; I401-L403 VanDerWaalsContact C-N 3.27Å; I401-L403 PolarHBondContact O-N 2.82Å; I401-L404 PolarHBondContact O-N 2.94Å; I401-L404 VanDerWaalsContact O-N 3.14Å; I401-K405 PolarHBondContact O-N 3.18Å
402	R	52.9	Low	49.9	Very low	187 Å²	187	125.2 Å²	125.2	71%	0.706	63%	0.629	S	S	*	*	H	α-helix	trans	-60.3	-34.6	175.9	-77	173.9	177.4	168.6	-0.2	112.8	G398 E399	G398-R402 WeakPolarHBondContact O-CG 3.17Å; G398-R402 PolarHBondContact O-N 3.39Å; E399-R402 WeakPolarHBondContact O-CB 3.38Å; E399-R402 PolarHBondContact O-N 3.44Å; E399-R402 VanDerWaalsContact O-N 3.16Å
403	L	51.2	Low	50.6	Low	103 Å²	103	120.4 Å²	120.4	54%	0.539	61%	0.609	S	S	.	*	H	α-helix	trans	-69.5	-37.1	174.7	-70.2	170.7	0	0	0	112.3	E399 R400 I401 R406	E399-L403 WeakPolarHBondContact O-CG 3.14Å; E399-L403 PolarHBondContact O-N 3.03Å; R400-L403 PolarHBondContact O-N 3.05Å; I401-L403 VanDerWaalsContact C-N 3.27Å; I401-L403 PolarHBondContact O-N 2.82Å; L403-R406 PolarHBondContact O-N 3.1Å
404	L	43.2	Very low	51.1	Low	144 Å²	144	116.7 Å²	116.7	75%	0.754	59%	0.594	S	S	*	*	H	α-helix	trans	-71.7	-28	176.2	-70.5	164.8	0	0	0	113.6	R400 I401 R406	R400-L404 WeakPolarHBondContact O-CG 3.48Å; R400-L404 PolarHBondContact O-N 3.29Å; I401-L404 PolarHBondContact O-N 2.94Å; I401-L404 VanDerWaalsContact O-N 3.14Å; L404-R406 VanDerWaalsContact C-N 3.32Å; L404-R406 PolarHBondContact O-N 3.29Å
405	K	44.1	Very low	52.5	Low	183 Å²	183	115 Å²	115	80%	0.796	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-1.3	175.9	-76.1	-161.6	173.7	-167.4	0	114.7	I401	I401-K405 PolarHBondContact O-N 3.18Å
406	R	43.2	Very low	53.2	Low	180 Å²	180	116.3 Å²	116.3	68%	0.679	58%	0.582	S	S	*	*	S	Bend	trans	-82.7	137.2	172.6	-76.8	-178.4	170.8	165.1	-1.3	110.7	L403 L404 S408	L403-R406 PolarHBondContact O-N 3.1Å; L404-R406 VanDerWaalsContact C-N 3.32Å; L404-R406 PolarHBondContact O-N 3.29Å; R406-S408 PolarHBondContact O-N 2.84Å
407	P	41.5	Very low	52.7	Low	125 Å²	125	117.9 Å²	117.9	81%	0.812	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-58.4	127.4	170.4	25.8	-33.5	0	0	0	108.9	T409	P407-T409 PolarHBondContact O-N 3.17Å
408	S	47.3	Very low	53.7	Low	81 Å²	81	110.6 Å²	110.6	57%	0.566	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.2	-158.9	60.5	0	0	0	0	113	R406 W410 A411	R406-S408 PolarHBondContact O-N 2.84Å; S408-W410 PolarHBondContact O-N 3.39Å; S408-A411 PolarHBondContact O-N 3.16Å
409	T	48.9	Very low	54.1	Low	103 Å²	103	113.8 Å²	113.8	63%	0.632	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-21	168.7	51.4	0	0	0	0	113.1	P407 A411 K412 E413	P407-T409 PolarHBondContact O-N 3.17Å; T409-A411 PolarHBondContact O-N 2.93Å; T409-A411 VanDerWaalsContact O-N 3.08Å; T409-K412 WeakPolarHBondContact O-CB 3.37Å; T409-K412 PolarHBondContact O-N 3.19Å; T409-E413 PolarHBondContact O-N 3.04Å; T409-E413 VanDerWaalsContact O-N 3.11Å
410	W	48.4	Very low	54.5	Low	160 Å²	160	111.7 Å²	111.7	61%	0.606	56%	0.564	S	S	*	*	H	α-helix	trans	-51.7	-28.5	178.1	-70.5	48.9	0	0	0	113.6	S408 K412 E413 L414	S408-W410 PolarHBondContact O-N 3.39Å; W410-K412 VanDerWaalsContact C-N 3.34Å; W410-E413 PolarHBondContact O-N 3.2Å; W410-L414 WeakPolarHBondContact O-CB 3.29Å; W410-L414 WeakPolarHBondContact O-CD1 3.44Å; W410-L414 VanDerWaalsContact O-CG 3.23Å; W410-L414 WeakPolarHBondContact O-CG 3.02Å; W410-L414 PolarHBondContact O-N 3Å
411	A	52.8	Low	54.9	Low	74 Å²	74	110.6 Å²	110.6	61%	0.612	57%	0.571	S	S	*	*	H	α-helix	trans	-65.1	-37.8	175.5	0	0	0	0	0	112.4	S408 T409 A415	S408-A411 PolarHBondContact O-N 3.16Å; T409-A411 PolarHBondContact O-N 2.93Å; T409-A411 VanDerWaalsContact O-N 3.08Å; A411-A415 WeakPolarHBondContact O-CB 3.43Å; A411-A415 PolarHBondContact O-N 3.15Å
412	K	67.2	Low	55.7	Low	139 Å²	139	116.5 Å²	116.5	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-76.1	-42	174.7	-175.7	173.9	-178.9	-72.5	0	111	T409 W410 A415 E416	T409-K412 WeakPolarHBondContact O-CB 3.37Å; T409-K412 PolarHBondContact O-N 3.19Å; W410-K412 VanDerWaalsContact C-N 3.34Å; K412-A415 WeakPolarHBondContact O-CB 3.12Å; K412-A415 PolarHBondContact O-N 3.45Å; K412-E416 WeakPolarHBondContact CE-OE1 3.35Å; K412-E416 IonicContact NZ-OE1 2.65Å; K412-E416 PolarHBondContact NZ-OE1 3.27Å; K412-E416 IonicContact NZ-OE2 2.65Å; K412-E416 WeakPolarHBondContact O-CG 3.34Å; K412-E416 PolarHBondContact O-N 3.45Å
413	E	59.1	Low	56.2	Low	91 Å²	91	114.5 Å²	114.5	43%	0.425	59%	0.586	S	S	.	*	H	α-helix	trans	-65.6	-38.9	-179.9	-160.6	173.4	172.3	0	0	112.4	T409 W410 E416 Q417	T409-E413 PolarHBondContact O-N 3.04Å; T409-E413 VanDerWaalsContact O-N 3.11Å; W410-E413 PolarHBondContact O-N 3.2Å; E413-E416 PolarHBondContact O-N 3.13Å; E413-Q417 WeakPolarHBondContact O-CB 3.4Å; E413-Q417 VanDerWaalsContact O-CG 3.29Å; E413-Q417 WeakPolarHBondContact O-CG 3.35Å; E413-Q417 PolarHBondContact O-N 3.13Å
414	L	57	Low	56.1	Low	103 Å²	103	115.4 Å²	115.4	54%	0.539	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-34.4	171.6	-75.5	167.3	0	0	0	112.5	W410 A418	W410-L414 WeakPolarHBondContact O-CB 3.29Å; W410-L414 WeakPolarHBondContact O-CD1 3.44Å; W410-L414 VanDerWaalsContact O-CG 3.23Å; W410-L414 WeakPolarHBondContact O-CG 3.02Å; W410-L414 PolarHBondContact O-N 3Å; L414-A418 VanDerWaalsContact O-CB 3.27Å; L414-A418 WeakPolarHBondContact O-CB 3.47Å; L414-A418 PolarHBondContact O-N 3.44Å
415	A	70.2	Confident	55.8	Low	59 Å²	59	110.9 Å²	110.9	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-66.8	-42.9	173.8	0	0	0	0	0	111.2	A411 K412 A418 E419	A411-A415 WeakPolarHBondContact O-CB 3.43Å; A411-A415 PolarHBondContact O-N 3.15Å; K412-A415 WeakPolarHBondContact O-CB 3.12Å; K412-A415 PolarHBondContact O-N 3.45Å; A415-A418 PolarHBondContact O-N 3.22Å; A415-E419 WeakPolarHBondContact O-CB 3.08Å; A415-E419 PolarHBondContact O-N 2.8Å
416	E	71.2	Confident	55.5	Low	99 Å²	99	107 Å²	107	46%	0.463	57%	0.574	S	S	.	*	H	α-helix	trans	-65.7	-40.8	175.4	-73.8	169.8	179.6	0	0	112.1	K412 E413 E419 S420	K412-E416 WeakPolarHBondContact CE-OE1 3.35Å; K412-E416 IonicContact NZ-OE1 2.65Å; K412-E416 PolarHBondContact NZ-OE1 3.27Å; K412-E416 IonicContact NZ-OE2 2.65Å; K412-E416 WeakPolarHBondContact O-CG 3.34Å; K412-E416 PolarHBondContact O-N 3.45Å; E413-E416 PolarHBondContact O-N 3.13Å; E416-E419 PolarHBondContact O-N 3.32Å; E416-S420 PolarHBondContact O-N 2.83Å
417	Q	55.5	Low	55.1	Low	108 Å²	108	109.7 Å²	109.7	51%	0.505	58%	0.584	S	S	.	*	H	α-helix	trans	-64.4	-42	172.6	-74.4	176.8	17.5	0	0	112.2	E413 E419 S420 V421	E413-Q417 WeakPolarHBondContact O-CB 3.4Å; E413-Q417 VanDerWaalsContact O-CG 3.29Å; E413-Q417 WeakPolarHBondContact O-CG 3.35Å; E413-Q417 PolarHBondContact O-N 3.13Å; Q417-E419 VanDerWaalsContact C-N 3.34Å; Q417-S420 WeakPolarHBondContact O-CB 3.38Å; Q417-S420 PolarHBondContact O-N 3.06Å; Q417-V421 WeakPolarHBondContact O-CG2 3.47Å; Q417-V421 PolarHBondContact O-N 2.85Å
418	A	61.9	Low	55	Low	47 Å²	47	114.2 Å²	114.2	39%	0.388	59%	0.585	S	S	.	*	H	α-helix	trans	-62.7	-42.2	174.7	0	0	0	0	0	111.4	L414 A415 V421 Y422	L414-A418 VanDerWaalsContact O-CB 3.27Å; L414-A418 WeakPolarHBondContact O-CB 3.47Å; L414-A418 PolarHBondContact O-N 3.44Å; A415-A418 PolarHBondContact O-N 3.22Å; A418-V421 PolarHBondContact O-N 3.24Å; A418-Y422 WeakPolarHBondContact O-CD2 3.37Å; A418-Y422 PolarHBondContact O-N 3.31Å
419	E	70.1	Confident	54.2	Low	107 Å²	107	115.1 Å²	115.1	50%	0.5	59%	0.591	S	S	.	*	H	α-helix	trans	-67	-35.5	176.8	-153.9	-171.1	-123.5	0	0	112.2	A415 E416 Q417 Y422 K423	A415-E419 WeakPolarHBondContact O-CB 3.08Å; A415-E419 PolarHBondContact O-N 2.8Å; E416-E419 PolarHBondContact O-N 3.32Å; Q417-E419 VanDerWaalsContact C-N 3.34Å; E419-Y422 PolarHBondContact O-N 3.4Å; E419-K423 HydrophobicContact CG-CD 4.41Å; E419-K423 WeakPolarHBondContact O-CB 3.42Å; E419-K423 VanDerWaalsContact O-CG 3.3Å; E419-K423 WeakPolarHBondContact O-CG 3.41Å; E419-K423 PolarHBondContact O-N 3.31Å; E419-K423 WeakPolarHBondContact OE2-CE 3.35Å; E419-K423 IonicContact OE2-NZ 2.78Å; E419-K423 PolarHBondContact OE2-NZ 2.91Å
420	S	66.2	Low	53.7	Low	55 Å²	55	121.5 Å²	121.5	39%	0.385	60%	0.604	S	S	.	*	H	α-helix	trans	-59.8	-47.3	169.2	-160.8	0	0	0	0	111.1	E416 Q417 Y422 K423 D424	E416-S420 PolarHBondContact O-N 2.83Å; Q417-S420 WeakPolarHBondContact O-CB 3.38Å; Q417-S420 PolarHBondContact O-N 3.06Å; S420-Y422 PolarHBondContact O-N 3.21Å; S420-K423 CarbonylContact O-C 3.04Å; S420-K423 WeakPolarHBondContact O-CA 3.25Å; S420-K423 PolarHBondContact O-N 3.41Å; S420-D424 WeakPolarHBondContact O-CB 3.36Å; S420-D424 PolarHBondContact O-N 3.12Å; S420-D424 VanDerWaalsContact O-OD2 3.12Å; S420-D424 PolarHBondContact OG-OD2 3.27Å; S420-D424 VanDerWaalsContact OG-OD2 3.04Å
421	V	54.3	Low	53.2	Low	99 Å²	99	124.6 Å²	124.6	60%	0.6	62%	0.615	S	S	*	*	H	α-helix	trans	-63.2	-29.1	178	172	0	0	0	0	112.5	Q417 A418	Q417-V421 WeakPolarHBondContact O-CG2 3.47Å; Q417-V421 PolarHBondContact O-N 2.85Å; A418-V421 PolarHBondContact O-N 3.24Å
422	Y	63.8	Low	52.5	Low	199 Å²	199	131.4 Å²	131.4	78%	0.78	63%	0.625	S	S	*	*	H	α-helix	trans	-74.1	-37.3	169.4	-78.9	-66.3	0	0	0	113.1	A418 E419 S420	A418-Y422 WeakPolarHBondContact O-CD2 3.37Å; A418-Y422 PolarHBondContact O-N 3.31Å; E419-Y422 PolarHBondContact O-N 3.4Å; S420-Y422 PolarHBondContact O-N 3.21Å
423	K	62.6	Low	51	Low	146 Å²	146	131.2 Å²	131.2	64%	0.635	64%	0.638	S	S	*	*	H	α-helix	trans	-70.8	-40.6	177.8	-76	164.6	173.3	170.2	0	112.6	E419 S420 G425	E419-K423 HydrophobicContact CG-CD 4.41Å; E419-K423 WeakPolarHBondContact O-CB 3.42Å; E419-K423 VanDerWaalsContact O-CG 3.3Å; E419-K423 WeakPolarHBondContact O-CG 3.41Å; E419-K423 PolarHBondContact O-N 3.31Å; E419-K423 WeakPolarHBondContact OE2-CE 3.35Å; E419-K423 IonicContact OE2-NZ 2.78Å; E419-K423 PolarHBondContact OE2-NZ 2.91Å; S420-K423 CarbonylContact O-C 3.04Å; S420-K423 WeakPolarHBondContact O-CA 3.25Å; S420-K423 PolarHBondContact O-N 3.41Å; K423-G425 PolarHBondContact O-N 2.98Å
424	D	49.9	Very low	50	Low	122 Å²	122	131.9 Å²	131.9	65%	0.652	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	19.6	178.4	-67	-45.2	0	0	0	113.8	S420 C426	S420-D424 WeakPolarHBondContact O-CB 3.36Å; S420-D424 PolarHBondContact O-N 3.12Å; S420-D424 VanDerWaalsContact O-OD2 3.12Å; S420-D424 PolarHBondContact OG-OD2 3.27Å; S420-D424 VanDerWaalsContact OG-OD2 3.04Å; D424-C426 PolarHBondContact O-N 2.87Å; D424-C426 VanDerWaalsContact O-N 3.13Å
425	G	36.8	Very low	49.2	Very low	48 Å²	48	135.8 Å²	135.8	50%	0.495	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	67.3	29.1	148.4	0	0	0	0	0	116	K423 R427	K423-G425 PolarHBondContact O-N 2.98Å; G425-R427 PolarHBondContact O-N 2.71Å
426	C	37.4	Very low	47.6	Very low	101 Å²	101	138.4 Å²	138.4	68%	0.682	68%	0.676	S	S	*	*			trans	-72.4	52.1	-177.5	-147.6	0	0	0	0	113.9	D424 R428	D424-C426 PolarHBondContact O-N 2.87Å; D424-C426 VanDerWaalsContact O-N 3.13Å; C426-R428 PolarHBondContact O-N 2.8Å
427	R	35.6	Very low	46.1	Very low	237 Å²	237	143.1 Å²	143.1	89%	0.894	70%	0.695	S	S	*	*			trans	-69.9	56.9	177.2	-70.3	-171.6	170.4	-149.5	-0.3	112.3	G425 S429	G425-R427 PolarHBondContact O-N 2.71Å; R427-S429 PolarHBondContact O-N 3.44Å
428	R	38.6	Very low	45.6	Very low	220 Å²	220	143.7 Å²	143.7	83%	0.83	71%	0.706	S	S	*	*			trans	-73.7	71.2	169.7	-76	-170.2	169.9	-169.4	-3.3	111	C426 R430	C426-R428 PolarHBondContact O-N 2.8Å; R428-R430 VanDerWaalsContact C-N 3.32Å; R428-R430 PolarHBondContact O-N 2.89Å
429	S	31.5	Very low	44.4	Very low	100 Å²	100	148.6 Å²	148.6	70%	0.699	72%	0.724	S	S	*	*			trans	-62.3	87.8	172.2	-174.3	0	0	0	0	110.4	R427 R431	R427-S429 PolarHBondContact O-N 3.44Å; S429-R431 PolarHBondContact O-N 2.98Å
430	R	38.6	Very low	43.2	Very low	238 Å²	238	149.7 Å²	149.7	90%	0.898	74%	0.738	S	S	*	*			trans	-73.9	69.8	171.7	-77.3	-175.6	166.5	-180	-3.8	110.5	R428 R432	R428-R430 VanDerWaalsContact C-N 3.32Å; R428-R430 PolarHBondContact O-N 2.89Å; R430-R432 PolarHBondContact O-N 3.27Å
431	R	37.2	Very low	41.7	Very low	225 Å²	225	151.7 Å²	151.7	85%	0.849	76%	0.758	S	S	*	*			trans	-58.8	130.4	153.7	-76	-169.9	171.7	-160.1	-2.1	107.3	S429	S429-R431 PolarHBondContact O-N 2.98Å
432	R	37.5	Very low	41.1	Very low	217 Å²	217	152 Å²	152	82%	0.819	76%	0.764	S	S	*	*			trans	-70.1	137.6	179	-68.3	179.8	172.4	177.1	-4	109.6	R430 T434	R430-R432 PolarHBondContact O-N 3.27Å; R432-T434 HydrophobicContact CB-CG2 4.03Å; R432-T434 PolarHBondContact O-N 3.35Å
433	P	35.5	Very low	40	Very low	135 Å²	135	148.7 Å²	148.7	88%	0.877	77%	0.765	S	S	*	*			trans	-73.4	105.8	158	-5.8	23.3	0	0	0	107.8
434	T	38.6	Very low	38.9	Very low	105 Å²	105	146.5 Å²	146.5	64%	0.644	77%	0.768	S	S	*	*			trans	-125.6	90.4	172.8	45.9	0	0	0	0	109.3	R432	R432-T434 HydrophobicContact CB-CG2 4.03Å; R432-T434 PolarHBondContact O-N 3.35Å
435	E	40.5	Very low	38.5	Very low	184 Å²	184	147.5 Å²	147.5	86%	0.86	77%	0.769	S	S	*	*			trans	178.4	128.3	140.7	-102.5	166	-146.2	0	0	110.2
436	P	37.4	Very low	38.5	Very low	115 Å²	115	152.8 Å²	152.8	75%	0.747	78%	0.778	S	S	*	*			trans	-80.3	128	170.7	31.8	-31	0	0	0	110.2	V438	P436-V438 PolarHBondContact O-N 3Å
437	K	38.4	Very low	38.7	Very low	198 Å²	198	155.7 Å²	155.7	86%	0.861	78%	0.782	S	S	*	*			trans	-68.2	99.1	171.6	-76.6	-173.9	175.7	-178.3	0	110.4	I439	K437-I439 PolarHBondContact O-N 3.25Å
438	V	44.8	Very low	39.1	Very low	119 Å²	119	152.2 Å²	152.2	72%	0.721	78%	0.776	S	S	*	*			trans	-71.4	109.5	168.3	176.1	0	0	0	0	108.7	P436 T440	P436-V438 PolarHBondContact O-N 3Å; V438-T440 HydrophobicContact CG1-CG2 3.84Å
439	I	37.4	Very low	39.2	Very low	150 Å²	150	151.5 Å²	151.5	77%	0.769	77%	0.773	S	S	*	*			trans	-100.1	98.7	172.9	-57.8	174.9	0	0	0	107.7	K437	K437-I439 PolarHBondContact O-N 3.25Å
440	T	44	Very low	39.7	Very low	130 Å²	130	156.1 Å²	156.1	80%	0.798	78%	0.781	S	S	*	*			trans	-103.5	102.5	172.3	44.7	0	0	0	0	110.4	V438	V438-T440 HydrophobicContact CG1-CG2 3.84Å
441	A	34.9	Very low	39.8	Very low	98 Å²	98	150 Å²	150	81%	0.81	77%	0.774	S	S	*	*			trans	-102.7	111.9	169.7	0	0	0	0	0	110
442	S	41.4	Very low	40.2	Very low	104 Å²	104	148.9 Å²	148.9	73%	0.727	78%	0.776	S	S	*	*			trans	-162.2	96.4	168.1	-174.8	0	0	0	0	106.9
443	T	41	Very low	40.6	Very low	130 Å²	130	153.4 Å²	153.4	80%	0.798	79%	0.793	S	S	*	*				60.4	130	83.8	62.9	0	0	0	0	116.2
444	S	39.3	Very low	40.9	Very low	100 Å²	100	154.4 Å²	154.4	70%	0.699	79%	0.789	S	S	*	*			trans	96	100	154.3	-141.2	0	0	0	0	120.8
445	Q	41.6	Very low	41	Very low	144 Å²	144	156.9 Å²	156.9	67%	0.673	80%	0.796	S	S	*	*				65.2	120.9	126.8	-66.2	-168.5	31.4	0	0	122.9
446	K	38	Very low	41	Very low	158 Å²	158	155.4 Å²	155.4	69%	0.687	79%	0.793	S	S	*	*				100.1	142.3	120.9	-87.4	173.3	-179.6	154.8	0	121.2
447	Q	41.9	Very low	41.2	Very low	163 Å²	163	157.8 Å²	157.8	76%	0.762	80%	0.796	S	S	*	*			trans	66.5	111.2	155.4	-71.7	159.7	-79.6	0	0	115.5
448	Q	43.5	Very low	41.4	Very low	163 Å²	163	155.3 Å²	155.3	76%	0.762	79%	0.791	S	S	*	*				45.9	123.6	71.7	-66.9	-159.3	20.3	0	0	111.8
449	R	41.3	Very low	41.2	Very low	205 Å²	205	157.7 Å²	157.7	77%	0.774	80%	0.796	S	S	*	*			cis	-167.7	153.2	44.6	-131.2	163.1	-176	-152.7	1.3	111.3
450	K	40.4	Very low	41.5	Very low	198 Å²	198	158.3 Å²	158.3	86%	0.861	80%	0.798	S	S	*	*			trans	19.5	124.9	149.1	-62.3	-178.6	176.2	-168.8	0	119.4
451	S	42.2	Very low	41.3	Very low	108 Å²	108	160.5 Å²	160.5	76%	0.755	80%	0.798	S	S	*	*			trans	-147.2	148.1	130.8	67.6	0	0	0	0	111.5
452	F	43.9	Very low	41.8	Very low	203 Å²	203	165.7 Å²	165.7	89%	0.89	80%	0.797	S	S	*	*			trans	-18.7	145.4	170.1	-57.8	-98.7	0	0	0	117
453	R	47.3	Very low	41.8	Very low	312 Å²	312	171.3 Å²	171.3	100%	1.177	80%	0.803	S	S	*	*			cis	-146.4	0	33.3	-162.9	-177.6	-160.2	179.2	6.4	112.9

Retrieved 453 of 453 residues in 322.5 ms (Link to these results)

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