A0A3Q0KNW2_SCHMA Loading...

DUF659 domain-containing protein

AlphaFold DB (A0A5K4ERE2), UniProt , Accession A0A3Q0KNW2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 551 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	46.6	Very low	57.1	Low	211 Å²	211	141.5 Å²	141.5	100%	1.039	75%	0.754	S	S	*	*				0	-116.9	0	-62.6	145.4	-172.9	0	0	103.4	D3	M1-D3 VanDerWaalsContact C-CG 3.49Å; M1-D3 VanDerWaalsContact C-OD1 3.24Å; M1-D3 VanDerWaalsContact CA-OD2 3.25Å; M1-D3 WeakPolarHBondContact CA-OD2 3.21Å; M1-D3 WeakPolarHBondContact CB-OD2 3.25Å
2	T	48.1	Very low	59.1	Low	132 Å²	132	140 Å²	140	81%	0.81	74%	0.744	S	S	*	*			cis	-142.6	107.5	0	30.1	0	0	0	0	105.7
3	D	34.1	Very low	60.7	Low	131 Å²	131	136.8 Å²	136.8	70%	0.701	73%	0.725	S	S	*	*			trans	-129.3	94.6	-136.3	-43.9	-83.6	0	0	0	112.3	M1	M1-D3 VanDerWaalsContact C-CG 3.49Å; M1-D3 VanDerWaalsContact C-OD1 3.24Å; M1-D3 VanDerWaalsContact CA-OD2 3.25Å; M1-D3 WeakPolarHBondContact CA-OD2 3.21Å; M1-D3 WeakPolarHBondContact CB-OD2 3.25Å
4	S	46.6	Very low	61.8	Low	116 Å²	116	134.1 Å²	134.1	81%	0.811	72%	0.72	S	S	*	*			trans	-170.6	138.4	160.7	28.2	0	0	0	0	113.7	T6	S4-T6 PolarHBondContact O-N 3.26Å
5	E	48.7	Very low	62.7	Low	198 Å²	198	132.3 Å²	132.3	93%	0.925	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-59.5	121.6	175.5	-60.2	170.6	151.8	0	0	110.9
6	T	56.4	Low	63.6	Low	117 Å²	117	137.1 Å²	137.1	72%	0.718	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-87.6	132.7	174	44.2	0	0	0	0	110.7	S4	S4-T6 PolarHBondContact O-N 3.26Å
7	E	62.8	Low	64.4	Low	148 Å²	148	135.5 Å²	135.5	69%	0.692	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65.8	137.7	179.3	-65.1	-178.6	169.5	0	0	111.2	M9 D10	E7-M9 PolarHBondContact O-N 2.96Å; E7-D10 PolarHBondContact O-N 3.21Å; E7-D10 VanDerWaalsContact O-N 3.11Å
8	I	74	Confident	65.5	Low	128 Å²	128	133.2 Å²	133.2	66%	0.656	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.3	-25.5	178.8	-72.2	169.6	0	0	0	112.8	D10 L11 I12	I8-D10 VanDerWaalsContact C-N 3.34Å; I8-D10 PolarHBondContact O-N 3.4Å; I8-L11 PolarHBondContact O-N 3.37Å; I8-I12 HydrophobicContact CG2-CD1 3.59Å; I8-I12 HydrophobicContact CG2-CG1 4.2Å; I8-I12 PolarHBondContact O-N 2.96Å
9	M	70	Confident	66.6	Low	117 Å²	117	133.2 Å²	133.2	58%	0.576	71%	0.709	S	S	*	*	H	α-helix	trans	-56.8	-42.5	177.7	-93.8	-63.8	-151	0	0	113.3	E7 L11 I12 I13	E7-M9 PolarHBondContact O-N 2.96Å; M9-L11 PolarHBondContact O-N 3.23Å; M9-I12 PolarHBondContact O-N 3.11Å; M9-I13 HydrophobicContact CE-CD1 4.32Å; M9-I13 PolarHBondContact O-N 3.5Å; M9-I13 HydrophobicContact SD-CD1 3.73Å; M9-I13 HydrophobicContact SD-CG1 4.36Å
10	D	67.9	Low	67.6	Low	110 Å²	110	132.5 Å²	132.5	59%	0.588	70%	0.704	S	S	*	*	H	α-helix	trans	-69.4	-18.1	-176.4	-75	-14	0	0	0	112.9	E7 I8	E7-D10 PolarHBondContact O-N 3.21Å; E7-D10 VanDerWaalsContact O-N 3.11Å; I8-D10 VanDerWaalsContact C-N 3.34Å; I8-D10 PolarHBondContact O-N 3.4Å
11	L	73.3	Confident	68.6	Low	148 Å²	148	127.8 Å²	127.8	78%	0.775	68%	0.683	S	S	*	*	H	α-helix	trans	-87.5	-30.4	175	-72.5	168	0	0	0	113.1	I8 M9	I8-L11 PolarHBondContact O-N 3.37Å; M9-L11 PolarHBondContact O-N 3.23Å
12	I	81	Confident	70.6	Confident	124 Å²	124	122.2 Å²	122.2	64%	0.636	65%	0.654	S	S	*	*	H	α-helix	trans	-88.1	-36.7	-177.4	-61	176.3	0	0	0	110.7	I8 M9	I8-I12 HydrophobicContact CG2-CD1 3.59Å; I8-I12 HydrophobicContact CG2-CG1 4.2Å; I8-I12 PolarHBondContact O-N 2.96Å; M9-I12 PolarHBondContact O-N 3.11Å
13	I	80.1	Confident	72.6	Confident	98 Å²	98	119.8 Å²	119.8	50%	0.503	64%	0.635	S	S	.	*	S	Bend	trans	-122.2	102.7	-174.3	-53.2	-179.3	0	0	0	107.7	M9	M9-I13 HydrophobicContact CE-CD1 4.32Å; M9-I13 PolarHBondContact O-N 3.5Å; M9-I13 HydrophobicContact SD-CD1 3.73Å; M9-I13 HydrophobicContact SD-CG1 4.36Å
14	P	75.2	Confident	75.3	Confident	100 Å²	100	117.3 Å²	117.3	65%	0.649	62%	0.621	S	S	*	*			trans	-57.9	142.7	174.8	24.5	-32.6	0	0	0	109.4	K16	P14-K16 PolarHBondContact O-N 3.01Å
15	P	76.3	Confident	77.3	Confident	107 Å²	107	113.8 Å²	113.8	70%	0.695	59%	0.594	S	S	*	*			trans	-56.4	137.4	178.8	23.7	-33.2	0	0	0	109.6	E17	P15-E17 PolarHBondContact O-N 3.37Å
16	K	75.9	Confident	79.2	Confident	208 Å²	208	111.7 Å²	111.7	90%	0.904	58%	0.578	S	S	*	*			trans	-59	114.1	177.5	-174.6	177.6	-179.5	179.4	0	108.8	P14 T18	P14-K16 PolarHBondContact O-N 3.01Å; K16-T18 PolarHBondContact O-N 3.47Å
17	E	77.4	Confident	80.8	Confident	111 Å²	111	111.5 Å²	111.5	52%	0.519	57%	0.573	S	S	.	*			trans	-57	136.8	180	-74.5	-168.5	-171.2	0	0	111.5	P15 S21 E22	P15-E17 PolarHBondContact O-N 3.37Å; E17-S21 WeakPolarHBondContact CB-OG 3.33Å; E17-E22 WeakPolarHBondContact OE2-CA 3.33Å
18	T	84.7	Confident	82.1	Confident	94 Å²	94	110.6 Å²	110.6	58%	0.577	57%	0.568	S	S	*	*			trans	-67	152.9	166.3	53.4	0	0	0	0	110.4	K16 L20 S21 E22	K16-T18 PolarHBondContact O-N 3.47Å; T18-L20 PolarHBondContact O-N 2.97Å; T18-L20 VanDerWaalsContact O-N 3.1Å; T18-S21 PolarHBondContact N-OG 2.95Å; T18-S21 PolarHBondContact O-N 3Å; T18-S21 PolarHBondContact O-OG 3Å; T18-S21 PolarHBondContact OG1-N 2.86Å; T18-S21 PolarHBondContact OG1-OG 3.32Å; T18-E22 PolarHBondContact O-N 3.1Å
19	L	87	Confident	82.9	Confident	132 Å²	132	108.6 Å²	108.6	69%	0.691	56%	0.557	S	S	*	*	H	α-helix	trans	-57.3	-31	177.8	-163.2	146.4	0	0	0	112	I23	L19-I23 HydrophobicContact CD2-CD1 3.64Å; L19-I23 HydrophobicContact CD2-CG1 4.44Å; L19-I23 WeakPolarHBondContact O-CG1 3.5Å; L19-I23 PolarHBondContact O-N 2.78Å
20	L	86.9	Confident	83.7	Confident	119 Å²	119	105.3 Å²	105.3	62%	0.623	55%	0.548	S	S	*	.	H	α-helix	trans	-67.1	-45.2	173.4	-177.4	64.1	0	0	0	112.3	T18 I23 I24	T18-L20 PolarHBondContact O-N 2.97Å; T18-L20 VanDerWaalsContact O-N 3.1Å; L20-I23 PolarHBondContact O-N 2.99Å; L20-I24 HydrophobicContact CD1-CD1 4.33Å; L20-I24 HydrophobicContact CG-CD1 4Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.45Å; L20-I24 PolarHBondContact O-N 3.5Å
21	S	87.1	Confident	84.6	Confident	35 Å²	35	106.3 Å²	106.3	25%	0.245	55%	0.552	C	S	.	*	H	α-helix	trans	-65.2	-39.7	177.8	55.7	0	0	0	0	111.4	E17 T18 I23 I24 T25	E17-S21 WeakPolarHBondContact CB-OG 3.33Å; T18-S21 PolarHBondContact N-OG 2.95Å; T18-S21 PolarHBondContact O-N 3Å; T18-S21 PolarHBondContact O-OG 3Å; T18-S21 PolarHBondContact OG1-N 2.86Å; T18-S21 PolarHBondContact OG1-OG 3.32Å; S21-I23 VanDerWaalsContact C-N 3.33Å; S21-I23 PolarHBondContact O-N 3.14Å; S21-I24 PolarHBondContact O-N 3.37Å; S21-I24 VanDerWaalsContact O-N 3.14Å; S21-T25 PolarHBondContact O-N 2.96Å; S21-T25 PolarHBondContact O-OG1 3.25Å
22	E	88.1	Confident	85.2	Confident	93 Å²	93	105.8 Å²	105.8	44%	0.435	54%	0.541	S	S	.	.	H	α-helix	trans	-59.3	-44	176.1	-169.4	-168.8	156.8	0	0	111.3	E17 T18 I24 T25 R26	E17-E22 WeakPolarHBondContact OE2-CA 3.33Å; T18-E22 PolarHBondContact O-N 3.1Å; E22-I24 PolarHBondContact O-N 2.86Å; E22-T25 PolarHBondContact O-N 3.29Å; E22-R26 VanDerWaalsContact O-CB 3.23Å; E22-R26 WeakPolarHBondContact O-CB 3.5Å; E22-R26 PolarHBondContact O-N 3.45Å; E22-R26 IonicContact OE1-NH1 3Å; E22-R26 PolarHBondContact OE1-NH1 2.94Å
23	I	90.4	Very high	85.4	Confident	81 Å²	81	104.5 Å²	104.5	42%	0.415	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-40.8	177.1	-68.6	169.7	0	0	0	111.2	L19 L20 S21 R26 N27	L19-I23 HydrophobicContact CD2-CD1 3.64Å; L19-I23 HydrophobicContact CD2-CG1 4.44Å; L19-I23 WeakPolarHBondContact O-CG1 3.5Å; L19-I23 PolarHBondContact O-N 2.78Å; L20-I23 PolarHBondContact O-N 2.99Å; S21-I23 VanDerWaalsContact C-N 3.33Å; S21-I23 PolarHBondContact O-N 3.14Å; I23-R26 PolarHBondContact O-N 2.67Å; I23-N27 WeakPolarHBondContact O-CB 3.43Å; I23-N27 PolarHBondContact O-N 3.02Å; I23-N27 PolarHBondContact O-ND2 3.45Å
24	I	91.4	Very high	85.7	Confident	80 Å²	80	103.4 Å²	103.4	41%	0.41	54%	0.536	S	S	.	.	H	α-helix	trans	-63.7	-50	178	-68.3	165.7	0	0	0	110.2	L20 S21 E22 R26 N27 Q28	L20-I24 HydrophobicContact CD1-CD1 4.33Å; L20-I24 HydrophobicContact CG-CD1 4Å; L20-I24 VanDerWaalsContact O-CG1 3.28Å; L20-I24 WeakPolarHBondContact O-CG1 3.45Å; L20-I24 PolarHBondContact O-N 3.5Å; S21-I24 PolarHBondContact O-N 3.37Å; S21-I24 VanDerWaalsContact O-N 3.14Å; E22-I24 PolarHBondContact O-N 2.86Å; I24-R26 VanDerWaalsContact C-N 3.35Å; I24-R26 PolarHBondContact O-N 3Å; I24-N27 PolarHBondContact O-N 3.4Å; I24-Q28 WeakPolarHBondContact O-CG 3.36Å; I24-Q28 PolarHBondContact O-N 2.88Å
25	T	89.4	Confident	86.2	Confident	41 Å²	41	101 Å²	101	25%	0.252	52%	0.52	S	S	.	.	H	α-helix	trans	-57.1	-49	176.4	-52.8	0	0	0	0	110.1	S21 E22 N27 Q28 E29	S21-T25 PolarHBondContact O-N 2.96Å; S21-T25 PolarHBondContact O-OG1 3.25Å; E22-T25 PolarHBondContact O-N 3.29Å; T25-N27 VanDerWaalsContact C-N 3.29Å; T25-N27 PolarHBondContact O-N 3.06Å; T25-Q28 PolarHBondContact O-N 3.31Å; T25-Q28 VanDerWaalsContact O-N 3.08Å; T25-E29 HydrophobicContact CG2-CG 4.26Å; T25-E29 WeakPolarHBondContact O-CB 3.49Å; T25-E29 VanDerWaalsContact O-CG 3.3Å; T25-E29 WeakPolarHBondContact O-CG 3.48Å; T25-E29 PolarHBondContact O-N 3.2Å
26	R	87.8	Confident	86.4	Confident	154 Å²	154	101.8 Å²	101.8	58%	0.581	51%	0.512	S	S	*	.	H	α-helix	trans	-58.9	-37.8	178.3	-158	-172.7	-143.4	111.2	-0.6	112.9	E22 I23 I24 A30	E22-R26 VanDerWaalsContact O-CB 3.23Å; E22-R26 WeakPolarHBondContact O-CB 3.5Å; E22-R26 PolarHBondContact O-N 3.45Å; E22-R26 IonicContact OE1-NH1 3Å; E22-R26 PolarHBondContact OE1-NH1 2.94Å; I23-R26 PolarHBondContact O-N 2.67Å; I24-R26 VanDerWaalsContact C-N 3.35Å; I24-R26 PolarHBondContact O-N 3Å; R26-A30 PolarHBondContact O-N 3.28Å
27	N	89.4	Confident	86.7	Confident	114 Å²	114	98 Å²	98	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-71.4	-36.3	176.2	-79.4	-21.6	0	0	0	112.6	I23 I24 T25 A30	I23-N27 WeakPolarHBondContact O-CB 3.43Å; I23-N27 PolarHBondContact O-N 3.02Å; I23-N27 PolarHBondContact O-ND2 3.45Å; I24-N27 PolarHBondContact O-N 3.4Å; T25-N27 VanDerWaalsContact C-N 3.29Å; T25-N27 PolarHBondContact O-N 3.06Å; N27-A30 WeakPolarHBondContact O-CB 3.4Å
28	Q	89.8	Confident	87.1	Confident	128 Å²	128	103 Å²	103	60%	0.598	51%	0.51	S	S	*	.	H	α-helix	trans	-67.8	-42.5	174.4	-70.6	176.2	-5.1	0	0	111.3	I24 T25 A30	I24-Q28 WeakPolarHBondContact O-CG 3.36Å; I24-Q28 PolarHBondContact O-N 2.88Å; T25-Q28 PolarHBondContact O-N 3.31Å; T25-Q28 VanDerWaalsContact O-N 3.08Å; Q28-A30 VanDerWaalsContact C-N 3.29Å; Q28-A30 PolarHBondContact O-N 3.26Å
29	E	91.5	Very high	87	Confident	87 Å²	87	100.6 Å²	100.6	41%	0.407	50%	0.496	S	S	.	.	H	α-helix	trans	-74.5	-15	179.2	-64.7	-174.4	161.9	0	0	113.6	T25 I31 Y32 T35	T25-E29 HydrophobicContact CG2-CG 4.26Å; T25-E29 WeakPolarHBondContact O-CB 3.49Å; T25-E29 VanDerWaalsContact O-CG 3.3Å; T25-E29 WeakPolarHBondContact O-CG 3.48Å; T25-E29 PolarHBondContact O-N 3.2Å; E29-I31 PolarHBondContact O-N 2.95Å; E29-Y32 HydrophobicContact CB-CD2 3.88Å; E29-Y32 HydrophobicContact CB-CE2 4.04Å; E29-Y32 HydrophobicContact CG-CD2 4.14Å; E29-Y32 HydrophobicContact CG-CE2 3.81Å; E29-Y32 WeakPolarHBondContact O-CD2 3.3Å; E29-Y32 PolarHBondContact O-N 3.46Å; E29-T35 PolarHBondContact O-OG1 3.06Å
30	A	86	Confident	86.9	Confident	48 Å²	48	103.1 Å²	103.1	40%	0.397	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-17.6	178.4	0	0	0	0	0	113.4	R26 N27 Q28 K36	R26-A30 PolarHBondContact O-N 3.28Å; N27-A30 WeakPolarHBondContact O-CB 3.4Å; Q28-A30 VanDerWaalsContact C-N 3.29Å; Q28-A30 PolarHBondContact O-N 3.26Å; A30-K36 WeakPolarHBondContact O-CE 3.23Å
31	I	87	Confident	86.9	Confident	130 Å²	130	101.5 Å²	101.5	67%	0.667	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-32.6	174.7	-59.2	173.3	0	0	0	111.1	E29	E29-I31 PolarHBondContact O-N 2.95Å
32	Y	87.2	Confident	86.5	Confident	138 Å²	138	104.1 Å²	104.1	54%	0.541	54%	0.538	S	S	.	.	S	Bend	trans	-65.9	140.3	-172.7	-54.9	-46.1	0	0	0	112.7	E29 S34 T35 K36	E29-Y32 HydrophobicContact CB-CD2 3.88Å; E29-Y32 HydrophobicContact CB-CE2 4.04Å; E29-Y32 HydrophobicContact CG-CD2 4.14Å; E29-Y32 HydrophobicContact CG-CE2 3.81Å; E29-Y32 WeakPolarHBondContact O-CD2 3.3Å; E29-Y32 PolarHBondContact O-N 3.46Å; Y32-S34 WeakPolarHBondContact CB-OG 3.33Å; Y32-S34 PolarHBondContact O-N 3.47Å; Y32-T35 WeakPolarHBondContact CB-OG1 3.39Å; Y32-T35 PolarHBondContact O-N 3.5Å; Y32-T35 PolarHBondContact O-OG1 3.43Å; Y32-K36 PolarHBondContact O-N 3.36Å
33	D	84.9	Confident	85.9	Confident	96 Å²	96	104.2 Å²	104.2	51%	0.513	55%	0.549	S	S	.	.	H	α-helix	trans	-60.7	-32	176.1	-104.9	27.1	0	0	0	112.2	K37	D33-K37 VanDerWaalsContact O-CB 3.25Å; D33-K37 WeakPolarHBondContact O-CB 3.25Å; D33-K37 WeakPolarHBondContact O-CG 3.16Å; D33-K37 PolarHBondContact O-N 3.22Å; D33-K37 IonicContact OD2-NZ 2.74Å; D33-K37 PolarHBondContact OD2-NZ 2.74Å
34	S	86.6	Confident	85	Confident	75 Å²	75	103 Å²	103	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-62.5	-47.7	177.1	48.8	0	0	0	0	111.6	Y32 K36 K37 R38	Y32-S34 WeakPolarHBondContact CB-OG 3.33Å; Y32-S34 PolarHBondContact O-N 3.47Å; S34-K36 PolarHBondContact O-N 2.86Å; S34-K37 PolarHBondContact O-N 3.08Å; S34-R38 WeakPolarHBondContact O-CA 3.28Å; S34-R38 WeakPolarHBondContact O-CB 3.46Å; S34-R38 PolarHBondContact O-N 3.47Å
35	T	85.1	Confident	83.9	Confident	50 Å²	50	106.4 Å²	106.4	31%	0.307	57%	0.566	S	S	.	*	H	α-helix	trans	-63.7	-40.4	179.1	2.7	0	0	0	0	111.5	E29 Y32	E29-T35 PolarHBondContact O-OG1 3.06Å; Y32-T35 WeakPolarHBondContact CB-OG1 3.39Å; Y32-T35 PolarHBondContact O-N 3.5Å; Y32-T35 PolarHBondContact O-OG1 3.43Å
36	K	80.5	Confident	83.2	Confident	123 Å²	123	114.5 Å²	114.5	54%	0.535	59%	0.592	S	S	.	*	H	α-helix	trans	-71.3	-39.8	177.8	-66.9	177.8	-176.2	169.9	0	113.5	A30 Y32 S34 S44	A30-K36 WeakPolarHBondContact O-CE 3.23Å; Y32-K36 PolarHBondContact O-N 3.36Å; S34-K36 PolarHBondContact O-N 2.86Å; K36-S44 PolarHBondContact O-OG 3.42Å
37	K	83.2	Confident	82.6	Confident	130 Å²	130	115 Å²	115	57%	0.565	61%	0.606	S	S	*	*	H	α-helix	trans	-86.6	-26.5	-175.2	-70.5	170.6	176.3	161.4	0	113.2	D33 S34	D33-K37 VanDerWaalsContact O-CB 3.25Å; D33-K37 WeakPolarHBondContact O-CB 3.25Å; D33-K37 WeakPolarHBondContact O-CG 3.16Å; D33-K37 PolarHBondContact O-N 3.22Å; D33-K37 IonicContact OD2-NZ 2.74Å; D33-K37 PolarHBondContact OD2-NZ 2.74Å; S34-K37 PolarHBondContact O-N 3.08Å
38	R	84.7	Confident	82.2	Confident	215 Å²	215	113.2 Å²	113.2	81%	0.811	60%	0.596	S	S	*	*			trans	-136.1	54.3	-172	-55.2	-179.9	-177.9	173.7	0.2	112.8	S34 L40	S34-R38 WeakPolarHBondContact O-CA 3.28Å; S34-R38 WeakPolarHBondContact O-CB 3.46Å; S34-R38 PolarHBondContact O-N 3.47Å; R38-L40 PolarHBondContact O-N 2.96Å
39	P	83.9	Confident	81.9	Confident	44 Å²	44	110 Å²	110	29%	0.286	59%	0.587	S	S	.	*			trans	-64.9	133.7	173.9	28.4	-33.1	0	0	0	110.3	G41 C42	P39-G41 PolarHBondContact O-N 3.15Å; P39-C42 HydrophobicContact CB-CB 4.08Å; P39-C42 HydrophobicContact CG-CB 3.79Å; P39-C42 PolarHBondContact O-N 3.32Å
40	L	84.9	Confident	81.4	Confident	185 Å²	185	112.6 Å²	112.6	97%	0.969	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	123.8	178.8	-165.5	73.8	0	0	0	109.7	R38 C42	R38-L40 PolarHBondContact O-N 2.96Å; L40-C42 VanDerWaalsContact C-N 3.31Å; L40-C42 PolarHBondContact O-N 3.15Å
41	G	85.6	Confident	81.3	Confident	85 Å²	85	117 Å²	117	88%	0.876	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.7	-0.8	178	0	0	0	0	0	116.3	P39	P39-G41 PolarHBondContact O-N 3.15Å
42	C	78.4	Confident	81.2	Confident	90 Å²	90	113.2 Å²	113.2	61%	0.608	60%	0.604	S	S	*	*	S	Bend	trans	-125.2	151.8	180	-70	0	0	0	0	111.4	P39 L40	P39-C42 HydrophobicContact CB-CB 4.08Å; P39-C42 HydrophobicContact CG-CB 3.79Å; P39-C42 PolarHBondContact O-N 3.32Å; L40-C42 VanDerWaalsContact C-N 3.31Å; L40-C42 PolarHBondContact O-N 3.15Å
43	S	76	Confident	80.9	Confident	95 Å²	95	109.6 Å²	109.6	66%	0.664	59%	0.594	S	S	*	*			trans	-77.2	155.9	163.5	57.9	0	0	0	0	110.2	L45	S43-L45 PolarHBondContact O-N 2.96Å; S43-L45 VanDerWaalsContact O-N 3.15Å
44	S	72.4	Confident	80.6	Confident	54 Å²	54	110.8 Å²	110.8	38%	0.378	60%	0.595	S	S	.	*			trans	-60.6	118.2	173.1	-174.2	0	0	0	0	109.4	K36 R46	K36-S44 PolarHBondContact O-OG 3.42Å; S44-R46 PolarHBondContact O-N 3.26Å; S44-R46 VanDerWaalsContact O-N 3.15Å
45	L	68.6	Low	80.3	Confident	153 Å²	153	116.5 Å²	116.5	80%	0.801	61%	0.606	S	S	*	*			trans	-68.3	106.9	174.3	-80.8	152.8	0	0	0	108.4	S43	S43-L45 PolarHBondContact O-N 2.96Å; S43-L45 VanDerWaalsContact O-N 3.15Å
46	R	72.7	Confident	80.3	Confident	210 Å²	210	122.1 Å²	122.1	79%	0.792	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-97.1	146.7	162.2	-65.4	-173.1	-172.2	-171.3	2.9	108.3	S44 L48	S44-R46 PolarHBondContact O-N 3.26Å; S44-R46 VanDerWaalsContact O-N 3.15Å; R46-L48 PolarHBondContact O-N 3.21Å
47	D	77.2	Confident	80.3	Confident	164 Å²	164	118.5 Å²	118.5	88%	0.877	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-60.4	120.3	177	-59.1	-41.8	0	0	0	110
48	L	79.9	Confident	80.3	Confident	78 Å²	78	118.9 Å²	118.9	41%	0.408	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-77.2	144.6	169.1	-84	80.2	0	0	0	108.5	R46 L52 K54	R46-L48 PolarHBondContact O-N 3.21Å; L48-L52 HydrophobicContact CD2-CB 4.14Å; L48-K54 HydrophobicContact CD2-CB 4.43Å
49	P	83.1	Confident	80.1	Confident	61 Å²	61	115.7 Å²	115.7	40%	0.396	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-47.8	139.1	166.3	-26.8	33	0	0	0	110.9	H51 L52	P49-H51 WeakPolarHBondContact CB-CE1 3.35Å; P49-H51 PolarHBondContact O-N 3.19Å; P49-L52 HydrophobicContact CB-CD1 4.32Å; P49-L52 HydrophobicContact CB-CG 4.41Å; P49-L52 HydrophobicContact CG-CD1 3.99Å; P49-L52 PolarHBondContact O-N 2.96Å
50	P	81	Confident	80.1	Confident	141 Å²	141	116.8 Å²	116.8	92%	0.916	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-13.9	-169.9	21.8	-32.9	0	0	0	114.7
51	H	84.3	Confident	79.9	Confident	139 Å²	139	117.1 Å²	117.1	64%	0.644	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-9.2	176.4	63.9	-87.6	0	0	0	114	P49	P49-H51 WeakPolarHBondContact CB-CE1 3.35Å; P49-H51 PolarHBondContact O-N 3.19Å
52	L	84.7	Confident	79.6	Confident	52 Å²	52	120.4 Å²	120.4	27%	0.272	63%	0.634	S	S	.	*			trans	-99.9	104.3	179.5	-65.9	178.9	0	0	0	110.3	L48 P49 T57 F59	L48-L52 HydrophobicContact CD2-CB 4.14Å; P49-L52 HydrophobicContact CB-CD1 4.32Å; P49-L52 HydrophobicContact CB-CG 4.41Å; P49-L52 HydrophobicContact CG-CD1 3.99Å; P49-L52 PolarHBondContact O-N 2.96Å; L52-T57 HydrophobicContact CD2-CG2 4.06Å; L52-F59 HydrophobicContact CD1-CE1 4.43Å
53	D	81.2	Confident	79.6	Confident	62 Å²	62	125.5 Å²	125.5	33%	0.332	64%	0.642	S	S	.	*			trans	-85	116.4	172	-176.6	-9.7	0	0	0	109.4	Y55 K56 T57	D53-Y55 PolarHBondContact O-N 3.28Å; D53-Y55 PolarHBondContact OD1-N 3.48Å; D53-K56 HydrophobicContact CB-CB 4.03Å; D53-K56 HydrophobicContact CB-CG 4.45Å; D53-K56 PolarHBondContact O-N 3.26Å; D53-K56 WeakPolarHBondContact OD2-CD 3.29Å; D53-K56 WeakPolarHBondContact OD2-CE 3.32Å; D53-K56 VanDerWaalsContact OD2-CG 3.29Å; D53-K56 WeakPolarHBondContact OD2-CG 3.15Å; D53-K56 IonicContact OD2-NZ 2.73Å; D53-T57 PolarHBondContact O-N 3.27Å; D53-T57 PolarHBondContact O-OG1 3.01Å
54	K	78.9	Confident	79.8	Confident	121 Å²	121	129.1 Å²	129.1	53%	0.526	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48.7	-31.2	-177.9	-176.5	-180	178.6	-173.6	0	113.2	L48	L48-K54 HydrophobicContact CD2-CB 4.43Å
55	Y	80.6	Confident	79.9	Confident	195 Å²	195	135.8 Å²	135.8	77%	0.765	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-9.7	-176.2	-56.3	-69.5	0	0	0	114.1	D53	D53-Y55 PolarHBondContact O-N 3.28Å; D53-Y55 PolarHBondContact OD1-N 3.48Å
56	K	83.9	Confident	80.4	Confident	168 Å²	168	131 Å²	131	73%	0.73	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	-33.9	-177	-63	-177.3	-169.7	163.8	0	114.9	D53 T58	D53-K56 HydrophobicContact CB-CB 4.03Å; D53-K56 HydrophobicContact CB-CG 4.45Å; D53-K56 PolarHBondContact O-N 3.26Å; D53-K56 WeakPolarHBondContact OD2-CD 3.29Å; D53-K56 WeakPolarHBondContact OD2-CE 3.32Å; D53-K56 VanDerWaalsContact OD2-CG 3.29Å; D53-K56 WeakPolarHBondContact OD2-CG 3.15Å; D53-K56 IonicContact OD2-NZ 2.73Å; K56-T58 PolarHBondContact O-N 2.98Å
57	T	82.1	Confident	80.9	Confident	47 Å²	47	127.3 Å²	127.3	29%	0.288	65%	0.654	S	S	.	*			trans	-83.1	103.5	-176	54.2	0	0	0	0	111.4	L52 D53 F59	L52-T57 HydrophobicContact CD2-CG2 4.06Å; D53-T57 PolarHBondContact O-N 3.27Å; D53-T57 PolarHBondContact O-OG1 3.01Å; T57-F59 PolarHBondContact O-N 2.99Å
58	T	81.4	Confident	81.2	Confident	137 Å²	137	128.6 Å²	128.6	84%	0.84	65%	0.646	S	S	*	*			trans	-64.3	115.2	172.2	-47.5	0	0	0	0	110.3	K56	K56-T58 PolarHBondContact O-N 2.98Å
59	F	80.7	Confident	81.6	Confident	149 Å²	149	128 Å²	128	65%	0.654	65%	0.653	S	S	*	*			trans	-70.8	140.4	176	-62.9	-81.3	0	0	0	111.4	L52 T57	L52-F59 HydrophobicContact CD1-CE1 4.43Å; T57-F59 PolarHBondContact O-N 2.99Å
60	G	84.2	Confident	81.9	Confident	67 Å²	67	127.1 Å²	127.1	69%	0.691	66%	0.655	S	S	*	*	S	Bend	trans	141.6	171.5	179.5	0	0	0	0	0	111.8	I62	G60-I62 PolarHBondContact O-N 3.16Å
61	M	81.6	Confident	82.2	Confident	191 Å²	191	124.2 Å²	124.2	94%	0.941	63%	0.632	S	S	*	*			trans	-76.4	120.7	167.6	-74.3	174.6	46.1	0	0	108.7	Y63	M61-Y63 PolarHBondContact O-N 3.28Å
62	I	78.3	Confident	82.4	Confident	155 Å²	155	123.3 Å²	123.3	80%	0.795	63%	0.631	S	S	*	*			trans	-68.3	120	169.6	-57.8	172.5	0	0	0	106.6	G60 E64	G60-I62 PolarHBondContact O-N 3.16Å; I62-E64 PolarHBondContact O-N 2.91Å; I62-E64 VanDerWaalsContact O-N 3.16Å
63	Y	79.6	Confident	82.7	Confident	196 Å²	196	127.7 Å²	127.7	77%	0.769	65%	0.653	S	S	*	*			trans	-73.7	104.2	169.9	-174.4	-94.3	0	0	0	108.2	M61 K65	M61-Y63 PolarHBondContact O-N 3.28Å; Y63-K65 PolarHBondContact O-N 2.89Å
64	E	78.8	Confident	83	Confident	171 Å²	171	130.8 Å²	130.8	80%	0.799	67%	0.67	S	S	*	*			trans	-64.1	119.6	167	-66.7	-175.7	175.1	0	0	107.8	I62 G66	I62-E64 PolarHBondContact O-N 2.91Å; I62-E64 VanDerWaalsContact O-N 3.16Å; E64-G66 PolarHBondContact O-N 3.02Å
65	K	75.8	Confident	83.5	Confident	195 Å²	195	128.7 Å²	128.7	85%	0.848	67%	0.669	S	S	*	*			trans	-63.9	111.1	176.8	-69	-179.1	-178.9	177.3	0	107.9	Y63	Y63-K65 PolarHBondContact O-N 2.89Å
66	G	79.2	Confident	83.7	Confident	52 Å²	52	125 Å²	125	54%	0.536	67%	0.669	S	S	.	*			trans	-63.6	179.6	171.2	0	0	0	0	0	112.7	E64	E64-G66 PolarHBondContact O-N 3.02Å
67	D	82.2	Confident	83.8	Confident	132 Å²	132	122.7 Å²	122.7	71%	0.706	66%	0.655	S	S	*	*			trans	-55.6	143.5	-178.3	-59.5	-37.9	0	0	0	111.9	L72	D67-L72 HydrophobicContact CB-CD2 4.23Å; D67-L72 HydrophobicContact CB-CG 4.28Å
68	R	83.5	Confident	84	Confident	191 Å²	191	127.5 Å²	127.5	72%	0.721	67%	0.672	S	S	*	*			trans	-69.2	139.4	177.7	-60.4	177.6	169	-167.8	-1.9	108.5	G70 D71 L72	R68-G70 PolarHBondContact O-N 3.18Å; R68-D71 WeakPolarHBondContact CB-OD2 3.45Å; R68-D71 PolarHBondContact O-N 3.06Å; R68-L72 PolarHBondContact O-N 3.34Å
69	A	88.4	Confident	84.3	Confident	65 Å²	65	131.2 Å²	131.2	54%	0.537	67%	0.671	S	S	.	*	H	α-helix	trans	-53.4	-32	172.7	0	0	0	0	0	112.3	L72 I73	A69-L72 PolarHBondContact O-N 2.89Å; A69-I73 WeakPolarHBondContact O-CB 3.19Å; A69-I73 WeakPolarHBondContact O-CD1 3.45Å; A69-I73 WeakPolarHBondContact O-CG1 3.41Å; A69-I73 PolarHBondContact O-N 2.9Å
70	G	89.4	Confident	84.8	Confident	44 Å²	44	129.3 Å²	129.3	45%	0.454	67%	0.667	S	S	.	*	H	α-helix	trans	-62.5	-41.1	173.8	0	0	0	0	0	113.6	R68 L72 I73 N74	R68-G70 PolarHBondContact O-N 3.18Å; G70-L72 VanDerWaalsContact C-N 3.3Å; G70-L72 PolarHBondContact O-N 3.47Å; G70-I73 PolarHBondContact O-N 2.81Å; G70-N74 CarbonylContact O-C 3.56Å; G70-N74 WeakPolarHBondContact O-CA 3.23Å; G70-N74 PolarHBondContact O-N 3.49Å
71	D	88.2	Confident	85.2	Confident	79 Å²	79	129.3 Å²	129.3	42%	0.422	65%	0.65	S	S	.	*	H	α-helix	trans	-72.5	-26.9	179.1	-56	-30.2	0	0	0	111.2	R68 N74 P75	R68-D71 WeakPolarHBondContact CB-OD2 3.45Å; R68-D71 PolarHBondContact O-N 3.06Å; D71-N74 CarbonylContact O-C 3.59Å; D71-P75 VanDerWaalsContact O-CA 3.23Å; D71-P75 WeakPolarHBondContact O-CA 3.39Å
72	L	88.1	Confident	85.6	Confident	120 Å²	120	124 Å²	124	63%	0.628	63%	0.625	S	S	*	*	H	α-helix	trans	-77.4	-40.2	174	-63.3	174.2	0	0	0	112.7	D67 R68 A69 G70	D67-L72 HydrophobicContact CB-CD2 4.23Å; D67-L72 HydrophobicContact CB-CG 4.28Å; R68-L72 PolarHBondContact O-N 3.34Å; A69-L72 PolarHBondContact O-N 2.89Å; G70-L72 VanDerWaalsContact C-N 3.3Å; G70-L72 PolarHBondContact O-N 3.47Å
73	I	91	Very high	86.2	Confident	144 Å²	144	119.5 Å²	119.5	74%	0.738	61%	0.605	S	S	*	*	H	α-helix	trans	-75.5	-40.4	179.2	-67.8	165.7	0	0	0	110.7	A69 G70	A69-I73 WeakPolarHBondContact O-CB 3.19Å; A69-I73 WeakPolarHBondContact O-CD1 3.45Å; A69-I73 WeakPolarHBondContact O-CG1 3.41Å; A69-I73 PolarHBondContact O-N 2.9Å; G70-I73 PolarHBondContact O-N 2.81Å
74	N	87.9	Confident	86.8	Confident	128 Å²	128	114.1 Å²	114.1	68%	0.684	59%	0.589	S	S	*	*	S	Bend	trans	-130.1	80.7	-178.7	-169.8	22.1	0	0	0	109.8	G70 D71	G70-N74 CarbonylContact O-C 3.56Å; G70-N74 WeakPolarHBondContact O-CA 3.23Å; G70-N74 PolarHBondContact O-N 3.49Å; D71-N74 CarbonylContact O-C 3.59Å
75	P	87.9	Confident	87.4	Confident	76 Å²	76	109.8 Å²	109.8	49%	0.494	57%	0.569	S	S	.	*			trans	-53.1	136	179	-24.9	33.5	0	0	0	111.1	D71 R77	D71-P75 VanDerWaalsContact O-CA 3.23Å; D71-P75 WeakPolarHBondContact O-CA 3.39Å; P75-R77 PolarHBondContact O-N 2.76Å
76	P	85.2	Confident	88.1	Confident	118 Å²	118	104.9 Å²	104.9	77%	0.766	55%	0.549	S	S	*	.			trans	-75.1	39	-177.4	32.9	-37.7	0	0	0	112.8
77	R	87	Confident	88.6	Confident	120 Å²	120	108.3 Å²	108.3	45%	0.453	56%	0.555	S	S	.	*			trans	-88.5	132.5	179.7	-153.2	173.1	-154.5	-136.5	1.4	108.8	P75 D81 I82 E85	P75-R77 PolarHBondContact O-N 2.76Å; R77-D81 HydrophobicContact CG-CB 4.45Å; R77-I82 HydrophobicContact CB-CD1 4.35Å; R77-I82 HydrophobicContact CB-CG1 4.41Å; R77-I82 HydrophobicContact CG-CG1 4.18Å; R77-E85 IonicContact CZ-OE1 2.72Å; R77-E85 IonicContact CZ-OE2 3.95Å; R77-E85 VanDerWaalsContact CZ-OE2 3.23Å; R77-E85 IonicContact NH1-OE1 3.67Å; R77-E85 IonicContact NH1-OE2 3.66Å; R77-E85 PolarHBondContact NH1-OE2 2.98Å; R77-E85 IonicContact NH2-OE1 3.47Å; R77-E85 PolarHBondContact NH2-OE1 3.33Å; R77-E85 IonicContact NH2-OE2 2.74Å; R77-E85 PolarHBondContact NH2-OE2 3.11Å
78	K	86.5	Confident	89	Confident	148 Å²	148	108.8 Å²	108.8	64%	0.643	55%	0.553	S	S	*	*			trans	-69.5	142.5	-178.7	-62.1	176.4	-179.4	174.2	0	109.1	I80 D81 I82	K78-I80 HydrophobicContact CB-CG2 4.12Å; K78-I80 PolarHBondContact O-N 3.22Å; K78-I80 VanDerWaalsContact O-N 3.11Å; K78-D81 WeakPolarHBondContact CB-OD2 3.42Å; K78-D81 PolarHBondContact O-N 2.68Å; K78-I82 PolarHBondContact O-N 2.64Å
79	R	87.4	Confident	89.4	Confident	214 Å²	214	102.9 Å²	102.9	81%	0.808	54%	0.536	S	S	*	.	H	α-helix	trans	-53	-34.6	174.3	-174.7	172.5	-177.5	150.1	2.1	112	D81 I82 T83	R79-D81 VanDerWaalsContact C-N 3.34Å; R79-D81 PolarHBondContact O-N 2.92Å; R79-I82 PolarHBondContact O-N 3.34Å; R79-T83 WeakPolarHBondContact O-CB 3.47Å; R79-T83 PolarHBondContact O-N 3.28Å; R79-T83 PolarHBondContact O-OG1 3.4Å
80	I	91.4	Very high	89.4	Confident	110 Å²	110	101 Å²	101	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-60.9	-42	177.9	-144	83.9	0	0	0	111.7	K78 T83 N84	K78-I80 HydrophobicContact CB-CG2 4.12Å; K78-I80 PolarHBondContact O-N 3.22Å; K78-I80 VanDerWaalsContact O-N 3.11Å; I80-T83 PolarHBondContact O-N 3.39Å; I80-N84 WeakPolarHBondContact O-CB 3.43Å; I80-N84 PolarHBondContact O-N 3.44Å; I80-N84 PolarHBondContact O-ND2 3.45Å; I80-N84 PolarHBondContact O-OD1 2.9Å
81	D	92.6	Very high	89.3	Confident	66 Å²	66	105.8 Å²	105.8	35%	0.353	53%	0.526	S	S	.	.	H	α-helix	trans	-70.4	-41.4	-177.1	-54.4	-31.4	0	0	0	110.4	R77 K78 R79 T83 N84 E85	R77-D81 HydrophobicContact CG-CB 4.45Å; K78-D81 WeakPolarHBondContact CB-OD2 3.42Å; K78-D81 PolarHBondContact O-N 2.68Å; R79-D81 VanDerWaalsContact C-N 3.34Å; R79-D81 PolarHBondContact O-N 2.92Å; D81-T83 VanDerWaalsContact C-N 3.33Å; D81-T83 PolarHBondContact O-N 2.93Å; D81-N84 PolarHBondContact O-N 2.67Å; D81-E85 PolarHBondContact O-N 3.47Å
82	I	90.4	Very high	89.4	Confident	79 Å²	79	107.5 Å²	107.5	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-61	-45.5	174.8	-60.9	170.2	0	0	0	110.2	R77 K78 R79 N84 E85 E86	R77-I82 HydrophobicContact CB-CD1 4.35Å; R77-I82 HydrophobicContact CB-CG1 4.41Å; R77-I82 HydrophobicContact CG-CG1 4.18Å; K78-I82 PolarHBondContact O-N 2.64Å; R79-I82 PolarHBondContact O-N 3.34Å; I82-N84 VanDerWaalsContact C-N 3.31Å; I82-N84 PolarHBondContact O-N 2.97Å; I82-E85 PolarHBondContact O-N 3.5Å; I82-E86 VanDerWaalsContact O-CB 3.28Å; I82-E86 WeakPolarHBondContact O-CB 3.28Å; I82-E86 PolarHBondContact O-N 3.45Å
83	T	90.5	Very high	89.5	Confident	61 Å²	61	107.7 Å²	107.7	37%	0.374	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-38.1	-179.2	-45.3	0	0	0	0	110.8	R79 I80 D81 E86 L87	R79-T83 WeakPolarHBondContact O-CB 3.47Å; R79-T83 PolarHBondContact O-N 3.28Å; R79-T83 PolarHBondContact O-OG1 3.4Å; I80-T83 PolarHBondContact O-N 3.39Å; D81-T83 VanDerWaalsContact C-N 3.33Å; D81-T83 PolarHBondContact O-N 2.93Å; T83-E86 PolarHBondContact O-N 2.88Å; T83-L87 WeakPolarHBondContact O-CB 3.48Å; T83-L87 PolarHBondContact O-N 3.42Å
84	N	92.5	Very high	89.4	Confident	83 Å²	83	103.4 Å²	103.4	44%	0.444	50%	0.503	S	S	.	.	H	α-helix	trans	-65.1	-48.9	177.3	-70	-13.9	0	0	0	111.8	I80 D81 I82 E86 L87 E88	I80-N84 WeakPolarHBondContact O-CB 3.43Å; I80-N84 PolarHBondContact O-N 3.44Å; I80-N84 PolarHBondContact O-ND2 3.45Å; I80-N84 PolarHBondContact O-OD1 2.9Å; D81-N84 PolarHBondContact O-N 2.67Å; I82-N84 VanDerWaalsContact C-N 3.31Å; I82-N84 PolarHBondContact O-N 2.97Å; N84-E86 VanDerWaalsContact C-N 3.29Å; N84-E86 PolarHBondContact O-N 3.04Å; N84-L87 PolarHBondContact O-N 3.41Å; N84-E88 WeakPolarHBondContact O-CG 3.36Å; N84-E88 PolarHBondContact O-N 3.21Å
85	E	90.9	Very high	89.3	Confident	81 Å²	81	103.6 Å²	103.6	38%	0.379	50%	0.502	S	S	.	.	H	α-helix	trans	-68.2	-27.5	177.4	-74.2	-178	-169.3	0	0	112.9	R77 D81 I82 N89	R77-E85 IonicContact CZ-OE1 2.72Å; R77-E85 IonicContact CZ-OE2 3.95Å; R77-E85 VanDerWaalsContact CZ-OE2 3.23Å; R77-E85 IonicContact NH1-OE1 3.67Å; R77-E85 IonicContact NH1-OE2 3.66Å; R77-E85 PolarHBondContact NH1-OE2 2.98Å; R77-E85 IonicContact NH2-OE1 3.47Å; R77-E85 PolarHBondContact NH2-OE1 3.33Å; R77-E85 IonicContact NH2-OE2 2.74Å; R77-E85 PolarHBondContact NH2-OE2 3.11Å; D81-E85 PolarHBondContact O-N 3.47Å; I82-E85 PolarHBondContact O-N 3.5Å; E85-N89 VanDerWaalsContact O-CB 3.29Å; E85-N89 WeakPolarHBondContact O-CB 3.42Å; E85-N89 PolarHBondContact O-N 3.26Å; E85-N89 VanDerWaalsContact O-N 3.13Å; E85-N89 PolarHBondContact O-ND2 3.43Å
86	E	89.6	Confident	89.3	Confident	91 Å²	91	106.5 Å²	106.5	43%	0.425	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-40.4	171.5	-168.9	173.1	-162.7	0	0	110.9	I82 T83 N84 H90 F101	I82-E86 VanDerWaalsContact O-CB 3.28Å; I82-E86 WeakPolarHBondContact O-CB 3.28Å; I82-E86 PolarHBondContact O-N 3.45Å; T83-E86 PolarHBondContact O-N 2.88Å; N84-E86 VanDerWaalsContact C-N 3.29Å; N84-E86 PolarHBondContact O-N 3.04Å; E86-H90 WeakPolarHBondContact O-CA 3.47Å; E86-H90 WeakPolarHBondContact O-CB 3.24Å; E86-H90 PolarHBondContact O-N 3.16Å; E86-F101 HydrophobicContact CG-CE1 3.72Å; E86-F101 HydrophobicContact CG-CZ 3.9Å; E86-F101 WeakPolarHBondContact OE1-CE1 3.46Å
87	L	90.2	Very high	89.5	Confident	124 Å²	124	107.3 Å²	107.3	65%	0.649	51%	0.507	S	S	*	.	H	α-helix	trans	-72.5	-40.4	179.3	-152.1	152.2	0	0	0	112.1	T83 N84 H90	T83-L87 WeakPolarHBondContact O-CB 3.48Å; T83-L87 PolarHBondContact O-N 3.42Å; N84-L87 PolarHBondContact O-N 3.41Å; L87-H90 WeakPolarHBondContact O-CB 3.45Å; L87-H90 PolarHBondContact O-N 3.49Å
88	E	90.8	Very high	89.6	Confident	143 Å²	143	110 Å²	110	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-61.8	-42.8	173.7	-74.7	175.6	-174.3	0	0	111.8	N84	N84-E88 WeakPolarHBondContact O-CG 3.36Å; N84-E88 PolarHBondContact O-N 3.21Å
89	N	90.9	Very high	89.7	Confident	67 Å²	67	107.2 Å²	107.2	36%	0.358	51%	0.51	S	S	.	.	H	α-helix	trans	-87	-8.7	-178.5	-68.3	-51.2	0	0	0	113.9	E85 Q91 H92 Y93	E85-N89 VanDerWaalsContact O-CB 3.29Å; E85-N89 WeakPolarHBondContact O-CB 3.42Å; E85-N89 PolarHBondContact O-N 3.26Å; E85-N89 VanDerWaalsContact O-N 3.13Å; E85-N89 PolarHBondContact O-ND2 3.43Å; N89-Q91 VanDerWaalsContact C-N 3.28Å; N89-Q91 PolarHBondContact O-N 3.49Å; N89-H92 WeakPolarHBondContact O-CB 3.27Å; N89-H92 PolarHBondContact O-N 3.18Å; N89-Y93 HydrophobicContact CB-CD2 4.04Å; N89-Y93 HydrophobicContact CB-CE2 4.1Å; N89-Y93 WeakPolarHBondContact O-CD2 3.44Å; N89-Y93 PolarHBondContact O-N 2.86Å; N89-Y93 VanDerWaalsContact O-N 3.16Å
90	H	90.2	Very high	89.9	Confident	25 Å²	25	99.7 Å²	99.7	12%	0.116	49%	0.486	C	S	.	.	H	α-helix	trans	-51.4	-46.1	-173.8	-177.1	50.2	0	0	0	112.7	E86 L87 H92 Y93 L94 F101 E104	E86-H90 WeakPolarHBondContact O-CA 3.47Å; E86-H90 WeakPolarHBondContact O-CB 3.24Å; E86-H90 PolarHBondContact O-N 3.16Å; L87-H90 WeakPolarHBondContact O-CB 3.45Å; L87-H90 PolarHBondContact O-N 3.49Å; H90-H92 VanDerWaalsContact C-N 3.31Å; H90-H92 PolarHBondContact O-N 3.16Å; H90-Y93 PolarHBondContact O-N 3.05Å; H90-L94 WeakPolarHBondContact O-CB 3.37Å; H90-L94 PolarHBondContact O-N 3.02Å; H90-F101 HydrophobicContact CB-CE2 4.2Å; H90-F101 HydrophobicContact CB-CZ 4.16Å; H90-F101 AromaticContact CD2-CE2 3.74Å; H90-F101 AromaticContact CE1-CD2 3.55Å; H90-F101 AromaticContact CE1-CE2 3.37Å; H90-F101 WeakPolarHBondContact CE1-CE2 3.37Å; H90-F101 AromaticContact CE1-CZ 3.88Å; H90-F101 AromaticContact CG-CE2 3.48Å; H90-F101 VanDerWaalsContact CG-CE2 3.48Å; H90-F101 AromaticContact CG-CZ 3.77Å; H90-F101 AromaticContact ND1-CD2 3.92Å; H90-F101 AromaticContact ND1-CE2 3.27Å; H90-F101 VanDerWaalsContact ND1-CE2 3.27Å; H90-F101 WeakPolarHBondContact ND1-CE2 3.46Å; H90-F101 AromaticContact ND1-CZ 3.37Å; H90-F101 WeakPolarHBondContact ND1-CZ 3.37Å; H90-F101 AromaticContact NE2-CD2 3.85Å; H90-F101 AromaticContact NE2-CE2 3.66Å; H90-E104 IonicContact CD2-OE1 3.37Å; H90-E104 IonicContact CE1-OE1 3.23Å; H90-E104 IonicContact CE1-OE2 3.52Å; H90-E104 PolarHBondContact CE1-OE2 3.03Å; H90-E104 VanDerWaalsContact NE2-CD 3.3Å; H90-E104 IonicContact NE2-OE1 3.73Å; H90-E104 PolarHBondContact NE2-OE1 2.86Å; H90-E104 IonicContact NE2-OE2 3.17Å; H90-E104 PolarHBondContact NE2-OE2 3.07Å
91	Q	86.9	Confident	89.8	Confident	145 Å²	145	97.5 Å²	97.5	68%	0.678	47%	0.473	S	S	*	.	H	α-helix	trans	-60	-39.2	180	-66.9	-174.5	-6.8	0	0	112.6	N89 L94 I95	N89-Q91 VanDerWaalsContact C-N 3.28Å; N89-Q91 PolarHBondContact O-N 3.49Å; Q91-L94 PolarHBondContact O-N 2.82Å; Q91-I95 VanDerWaalsContact O-CG1 3.3Å; Q91-I95 WeakPolarHBondContact O-CG1 3.41Å; Q91-I95 PolarHBondContact O-N 3.43Å; Q91-I95 VanDerWaalsContact O-N 3.16Å
92	H	90.1	Very high	89.6	Confident	115 Å²	115	100.9 Å²	100.9	53%	0.532	50%	0.498	S	S	.	.	H	α-helix	trans	-67.9	-40.8	177.9	-61.1	145.3	0	0	0	111.7	N89 H90 I95 L96	N89-H92 WeakPolarHBondContact O-CB 3.27Å; N89-H92 PolarHBondContact O-N 3.18Å; H90-H92 VanDerWaalsContact C-N 3.31Å; H90-H92 PolarHBondContact O-N 3.16Å; H92-I95 PolarHBondContact O-N 2.92Å; H92-L96 WeakPolarHBondContact O-CB 3.29Å; H92-L96 PolarHBondContact O-N 3.13Å
93	Y	89.9	Confident	89.6	Confident	123 Å²	123	101.1 Å²	101.1	48%	0.482	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-36.5	176.9	-85.1	-83.4	0	0	0	112.7	N89 H90 I95 H97 K98 H99	N89-Y93 HydrophobicContact CB-CD2 4.04Å; N89-Y93 HydrophobicContact CB-CE2 4.1Å; N89-Y93 WeakPolarHBondContact O-CD2 3.44Å; N89-Y93 PolarHBondContact O-N 2.86Å; N89-Y93 VanDerWaalsContact O-N 3.16Å; H90-Y93 PolarHBondContact O-N 3.05Å; Y93-I95 VanDerWaalsContact C-N 3.34Å; Y93-I95 PolarHBondContact O-N 3.2Å; Y93-H97 AromaticContact CD1-ND1 3.84Å; Y93-H97 WeakPolarHBondContact O-CA 3.37Å; Y93-H97 WeakPolarHBondContact O-CB 3.33Å; Y93-H97 PolarHBondContact O-N 2.86Å; Y93-K98 PolarHBondContact O-N 3.03Å; Y93-H99 PolarHBondContact O-N 2.98Å
94	L	88.6	Confident	89.6	Confident	54 Å²	54	101.3 Å²	101.3	28%	0.283	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-39.6	175.4	-170.8	143	0	0	0	111.5	H90 Q91 K98 L100	H90-L94 WeakPolarHBondContact O-CB 3.37Å; H90-L94 PolarHBondContact O-N 3.02Å; Q91-L94 PolarHBondContact O-N 2.82Å; L94-K98 VanDerWaalsContact O-CA 3.24Å; L94-K98 WeakPolarHBondContact O-CA 3.36Å; L94-K98 PolarHBondContact O-N 2.88Å; L94-L100 HydrophobicContact CD1-CD2 3.81Å
95	I	85.2	Confident	89.4	Confident	132 Å²	132	105.7 Å²	105.7	68%	0.677	53%	0.534	S	S	*	.	H	α-helix	trans	-72.2	-49	178.4	-66.3	166.2	0	0	0	111.9	Q91 H92 Y93	Q91-I95 VanDerWaalsContact O-CG1 3.3Å; Q91-I95 WeakPolarHBondContact O-CG1 3.41Å; Q91-I95 PolarHBondContact O-N 3.43Å; Q91-I95 VanDerWaalsContact O-N 3.16Å; H92-I95 PolarHBondContact O-N 2.92Å; Y93-I95 VanDerWaalsContact C-N 3.34Å; Y93-I95 PolarHBondContact O-N 3.2Å
96	L	88.1	Confident	89.3	Confident	138 Å²	138	104.6 Å²	104.6	72%	0.723	54%	0.539	S	S	*	.	H	α-helix	trans	-80.2	-42.5	-172.5	-71.7	168.7	0	0	0	113.2	H92	H92-L96 WeakPolarHBondContact O-CB 3.29Å; H92-L96 PolarHBondContact O-N 3.13Å
97	H	90.2	Very high	89.1	Confident	135 Å²	135	106.7 Å²	106.7	63%	0.625	55%	0.549	S	S	*	.	H	α-helix	trans	-111.5	-8	-170.7	-64.4	84.2	0	0	0	113.3	Y93 H99	Y93-H97 AromaticContact CD1-ND1 3.84Å; Y93-H97 WeakPolarHBondContact O-CA 3.37Å; Y93-H97 WeakPolarHBondContact O-CB 3.33Å; Y93-H97 PolarHBondContact O-N 2.86Å; H97-H99 HydrophobicContact CB-CB 4.2Å; H97-H99 PolarHBondContact O-N 2.92Å
98	K	88.2	Confident	88.9	Confident	175 Å²	175	109 Å²	109	76%	0.761	55%	0.549	S	S	*	.			trans	53.6	31.5	-168.1	-55.3	176.9	-179.1	175.2	0	111.6	Y93 L94 L100	Y93-K98 PolarHBondContact O-N 3.03Å; L94-K98 VanDerWaalsContact O-CA 3.24Å; L94-K98 WeakPolarHBondContact O-CA 3.36Å; L94-K98 PolarHBondContact O-N 2.88Å; K98-L100 PolarHBondContact O-N 3.18Å
99	H	90	Very high	88.7	Confident	90 Å²	90	108.2 Å²	108.2	42%	0.417	55%	0.549	S	S	.	.			trans	-73.9	120.6	178.2	-176.3	-91.6	0	0	0	108.7	Y93 H97	Y93-H99 PolarHBondContact O-N 2.98Å; H97-H99 HydrophobicContact CB-CB 4.2Å; H97-H99 PolarHBondContact O-N 2.92Å
100	L	89.8	Confident	88.5	Confident	57 Å²	57	111.8 Å²	111.8	30%	0.298	56%	0.559	S	S	.	*			trans	-116.6	144.3	178.5	-69.7	160.4	0	0	0	107.7	L94 K98 E104 A106	L94-L100 HydrophobicContact CD1-CD2 3.81Å; K98-L100 PolarHBondContact O-N 3.18Å; L100-E104 WeakPolarHBondContact CA-OE2 3.39Å; L100-E104 HydrophobicContact CB-CB 4.29Å; L100-E104 HydrophobicContact CD2-CB 4.35Å; L100-E104 HydrophobicContact CD2-CG 3.85Å; L100-A106 HydrophobicContact CD1-CB 3.7Å
101	F	89.6	Confident	88.5	Confident	64 Å²	64	119.9 Å²	119.9	28%	0.281	59%	0.593	S	S	.	*			trans	-65.2	154.5	171.8	-64.9	-54.7	0	0	0	111.1	E86 H90 G103 E104	E86-F101 HydrophobicContact CG-CE1 3.72Å; E86-F101 HydrophobicContact CG-CZ 3.9Å; E86-F101 WeakPolarHBondContact OE1-CE1 3.46Å; H90-F101 HydrophobicContact CB-CE2 4.2Å; H90-F101 HydrophobicContact CB-CZ 4.16Å; H90-F101 AromaticContact CD2-CE2 3.74Å; H90-F101 AromaticContact CE1-CD2 3.55Å; H90-F101 AromaticContact CE1-CE2 3.37Å; H90-F101 WeakPolarHBondContact CE1-CE2 3.37Å; H90-F101 AromaticContact CE1-CZ 3.88Å; H90-F101 AromaticContact CG-CE2 3.48Å; H90-F101 VanDerWaalsContact CG-CE2 3.48Å; H90-F101 AromaticContact CG-CZ 3.77Å; H90-F101 AromaticContact ND1-CD2 3.92Å; H90-F101 AromaticContact ND1-CE2 3.27Å; H90-F101 VanDerWaalsContact ND1-CE2 3.27Å; H90-F101 WeakPolarHBondContact ND1-CE2 3.46Å; H90-F101 AromaticContact ND1-CZ 3.37Å; H90-F101 WeakPolarHBondContact ND1-CZ 3.37Å; H90-F101 AromaticContact NE2-CD2 3.85Å; H90-F101 AromaticContact NE2-CE2 3.66Å; F101-G103 PolarHBondContact O-N 3.41Å; F101-E104 HydrophobicContact CB-CB 4.12Å; F101-E104 PolarHBondContact N-OE2 3.46Å; F101-E104 WeakPolarHBondContact O-CB 3.14Å; F101-E104 PolarHBondContact O-N 3.46Å
102	P	90	Very high	88.4	Confident	137 Å²	137	121 Å²	121	89%	0.89	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	116.2	170.3	-24.5	34.1	0	0	0	110.6
103	G	90.4	Very high	88.3	Confident	83 Å²	83	120.3 Å²	120.3	86%	0.856	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.9	-4.2	-178	0	0	0	0	0	115.7	F101	F101-G103 PolarHBondContact O-N 3.41Å
104	E	89.6	Confident	88	Confident	65 Å²	65	118.1 Å²	118.1	30%	0.304	60%	0.597	S	S	.	*			trans	-76.1	128.1	172.6	-173	-177.5	-175.1	0	0	110.6	H90 L100 F101	H90-E104 IonicContact CD2-OE1 3.37Å; H90-E104 IonicContact CE1-OE1 3.23Å; H90-E104 IonicContact CE1-OE2 3.52Å; H90-E104 PolarHBondContact CE1-OE2 3.03Å; H90-E104 VanDerWaalsContact NE2-CD 3.3Å; H90-E104 IonicContact NE2-OE1 3.73Å; H90-E104 PolarHBondContact NE2-OE1 2.86Å; H90-E104 IonicContact NE2-OE2 3.17Å; H90-E104 PolarHBondContact NE2-OE2 3.07Å; L100-E104 WeakPolarHBondContact CA-OE2 3.39Å; L100-E104 HydrophobicContact CB-CB 4.29Å; L100-E104 HydrophobicContact CD2-CB 4.35Å; L100-E104 HydrophobicContact CD2-CG 3.85Å; F101-E104 HydrophobicContact CB-CB 4.12Å; F101-E104 PolarHBondContact N-OE2 3.46Å; F101-E104 WeakPolarHBondContact O-CB 3.14Å; F101-E104 PolarHBondContact O-N 3.46Å
105	Q	88.7	Confident	87.8	Confident	175 Å²	175	121.6 Å²	121.6	82%	0.818	62%	0.615	S	S	*	*			trans	-79.8	134.9	173.7	-70.5	-174.4	-17.7	0	0	110.5	H107	Q105-H107 PolarHBondContact O-N 3.32Å
106	A	88	Confident	87.8	Confident	59 Å²	59	123.8 Å²	123.8	49%	0.488	62%	0.62	S	S	.	*			trans	-63.5	109.5	177.6	0	0	0	0	0	111.4	L100 R108	L100-A106 HydrophobicContact CD1-CB 3.7Å; A106-R108 PolarHBondContact O-N 2.99Å
107	H	86.2	Confident	87.8	Confident	135 Å²	135	122.1 Å²	122.1	63%	0.625	61%	0.608	S	S	*	*			trans	-81.1	116.6	174.6	-166.5	62.8	0	0	0	110.7	Q105 N109	Q105-H107 PolarHBondContact O-N 3.32Å; H107-N109 PolarHBondContact CD2-OD1 3.3Å; H107-N109 PolarHBondContact NE2-OD1 3.43Å
108	R	86.2	Confident	87.6	Confident	173 Å²	173	122.8 Å²	122.8	65%	0.653	62%	0.615	S	S	*	*			trans	-93.7	2.8	-172.4	-62.7	-179.4	-179.5	-114.1	2.5	114.4	A106 Y110	A106-R108 PolarHBondContact O-N 2.99Å; R108-Y110 HydrophobicContact CB-CD1 4.29Å; R108-Y110 HydrophobicContact CB-CD2 4.08Å; R108-Y110 HydrophobicContact CB-CE1 4.07Å; R108-Y110 HydrophobicContact CB-CE2 3.85Å; R108-Y110 HydrophobicContact CB-CG 4.3Å; R108-Y110 VanDerWaalsContact CD-CZ 3.42Å; R108-Y110 WeakPolarHBondContact CD-OH 3.3Å; R108-Y110 HydrophobicContact CG-CE2 4.28Å; R108-Y110 PolarHBondContact O-N 2.99Å
109	N	85.7	Confident	87.5	Confident	126 Å²	126	120.5 Å²	120.5	67%	0.674	61%	0.605	S	S	*	*			trans	53.1	39.2	-175.3	-60.2	-17.8	0	0	0	113.3	H107 K111	H107-N109 PolarHBondContact CD2-OD1 3.3Å; H107-N109 PolarHBondContact NE2-OD1 3.43Å; N109-K111 PolarHBondContact O-N 3.38Å
110	Y	87.9	Confident	87.3	Confident	142 Å²	142	118.9 Å²	118.9	56%	0.557	61%	0.613	S	S	*	*			trans	-64.1	128.9	174	-68.6	-41.8	0	0	0	110.5	R108 F113	R108-Y110 HydrophobicContact CB-CD1 4.29Å; R108-Y110 HydrophobicContact CB-CD2 4.08Å; R108-Y110 HydrophobicContact CB-CE1 4.07Å; R108-Y110 HydrophobicContact CB-CE2 3.85Å; R108-Y110 HydrophobicContact CB-CG 4.3Å; R108-Y110 VanDerWaalsContact CD-CZ 3.42Å; R108-Y110 WeakPolarHBondContact CD-OH 3.3Å; R108-Y110 HydrophobicContact CG-CE2 4.28Å; R108-Y110 PolarHBondContact O-N 2.99Å; Y110-F113 HydrophobicContact CD2-CD2 4.23Å
111	K	88.4	Confident	87.1	Confident	194 Å²	194	124.5 Å²	124.5	84%	0.843	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	142.5	171.7	-63.4	-175.5	-180	-178.1	0	109.2	N109 F113	N109-K111 PolarHBondContact O-N 3.38Å; K111-F113 VanDerWaalsContact C-N 3.27Å; K111-F113 PolarHBondContact O-N 3.04Å
112	N	86.4	Confident	86.7	Confident	169 Å²	169	128.6 Å²	128.6	90%	0.904	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.7	35.9	-180	-53.7	21.6	0	0	0	113.5
113	F	86.6	Confident	86.3	Confident	101 Å²	101	127 Å²	127	44%	0.443	65%	0.647	S	S	.	*			trans	-101	135.8	169.8	178	-83.5	0	0	0	109.4	Y110 K111 D115 F119	Y110-F113 HydrophobicContact CD2-CD2 4.23Å; K111-F113 VanDerWaalsContact C-N 3.27Å; K111-F113 PolarHBondContact O-N 3.04Å; F113-D115 HydrophobicContact CE1-CB 4.1Å; F113-F119 HydrophobicContact CD2-CE1 4.32Å; F113-F119 AromaticContact CD2-CZ 3.67Å; F113-F119 HydrophobicContact CD2-CZ 3.67Å; F113-F119 HydrophobicContact CE2-CE1 4.21Å; F113-F119 AromaticContact CE2-CE2 3.76Å; F113-F119 HydrophobicContact CE2-CE2 3.76Å; F113-F119 AromaticContact CE2-CZ 3.33Å; F113-F119 HydrophobicContact CE2-CZ 3.33Å; F113-F119 HydrophobicContact CG-CZ 4.5Å; F113-F119 AromaticContact CZ-CE2 3.97Å; F113-F119 HydrophobicContact CZ-CE2 3.97Å; F113-F119 AromaticContact CZ-CZ 3.92Å; F113-F119 HydrophobicContact CZ-CZ 3.92Å
114	D	85	Confident	85.7	Confident	77 Å²	77	130.3 Å²	130.3	41%	0.412	65%	0.646	S	S	.	*			trans	-122.1	121.9	173.2	179	5.5	0	0	0	108.2	K116 Q117	D114-K116 PolarHBondContact O-N 3.39Å; D114-K116 PolarHBondContact OD1-N 3.23Å; D114-Q117 HydrophobicContact CB-CB 3.95Å; D114-Q117 WeakPolarHBondContact O-CB 3.4Å; D114-Q117 PolarHBondContact O-N 3.1Å
115	D	82.8	Confident	85.2	Confident	127 Å²	127	132 Å²	132	68%	0.679	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-21	-178.5	64.1	-28.1	0	0	0	112.5	F113	F113-D115 HydrophobicContact CE1-CB 4.1Å
116	K	85.9	Confident	84.9	Confident	178 Å²	178	125.2 Å²	125.2	77%	0.774	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-10.5	177	-62.8	175	-172.9	176.2	0	112.8	D114 I118	D114-K116 PolarHBondContact O-N 3.39Å; D114-K116 PolarHBondContact OD1-N 3.23Å; K116-I118 PolarHBondContact O-N 3.5Å
117	Q	87.9	Confident	84.6	Confident	102 Å²	102	128.8 Å²	128.8	48%	0.477	65%	0.651	S	S	.	*	S	Bend	trans	-72.5	129.1	178.2	-174.4	174.7	2.4	0	0	110.3	D114 F119	D114-Q117 HydrophobicContact CB-CB 3.95Å; D114-Q117 WeakPolarHBondContact O-CB 3.4Å; D114-Q117 PolarHBondContact O-N 3.1Å; Q117-F119 VanDerWaalsContact O-CD2 3.29Å; Q117-F119 WeakPolarHBondContact O-CD2 3.29Å; Q117-F119 WeakPolarHBondContact O-CE2 3.42Å; Q117-F119 PolarHBondContact O-N 3.37Å
118	I	85.5	Confident	84.5	Confident	149 Å²	149	131.3 Å²	131.3	76%	0.764	66%	0.655	S	S	*	*			trans	-75.2	111.1	172.7	-56.4	172.1	0	0	0	107.7	K116	K116-I118 PolarHBondContact O-N 3.5Å
119	F	86.3	Confident	84.6	Confident	127 Å²	127	124.3 Å²	124.3	56%	0.557	64%	0.637	S	S	*	*			trans	-77.6	150.4	174.8	-63.3	-83.6	0	0	0	111.2	F113 Q117	F113-F119 HydrophobicContact CD2-CE1 4.32Å; F113-F119 AromaticContact CD2-CZ 3.67Å; F113-F119 HydrophobicContact CD2-CZ 3.67Å; F113-F119 HydrophobicContact CE2-CE1 4.21Å; F113-F119 AromaticContact CE2-CE2 3.76Å; F113-F119 HydrophobicContact CE2-CE2 3.76Å; F113-F119 AromaticContact CE2-CZ 3.33Å; F113-F119 HydrophobicContact CE2-CZ 3.33Å; F113-F119 HydrophobicContact CG-CZ 4.5Å; F113-F119 AromaticContact CZ-CE2 3.97Å; F113-F119 HydrophobicContact CZ-CE2 3.97Å; F113-F119 AromaticContact CZ-CZ 3.92Å; F113-F119 HydrophobicContact CZ-CZ 3.92Å; Q117-F119 VanDerWaalsContact O-CD2 3.29Å; Q117-F119 WeakPolarHBondContact O-CD2 3.29Å; Q117-F119 WeakPolarHBondContact O-CE2 3.42Å; Q117-F119 PolarHBondContact O-N 3.37Å
120	G	86.9	Confident	84.5	Confident	57 Å²	57	120.9 Å²	120.9	59%	0.588	62%	0.618	S	S	*	*	S	Bend	trans	118	166.9	179.1	0	0	0	0	0	113.5	H122	G120-H122 PolarHBondContact O-N 3.24Å; G120-H122 PolarHBondContact O-ND1 3.04Å
121	M	85.2	Confident	84.3	Confident	175 Å²	175	119.4 Å²	119.4	86%	0.862	62%	0.616	S	S	*	*			trans	-70.7	125.1	174.3	-175.2	176.3	66.2	0	0	108.9	T123	M121-T123 PolarHBondContact O-N 3.36Å; M121-T123 VanDerWaalsContact O-N 3.1Å
122	H	81.7	Confident	84.2	Confident	149 Å²	149	114.8 Å²	114.8	69%	0.69	60%	0.604	S	S	*	*			trans	-70.7	112.8	-178	-40.8	-0.4	0	0	0	106.3	G120 N124	G120-H122 PolarHBondContact O-N 3.24Å; G120-H122 PolarHBondContact O-ND1 3.04Å; H122-N124 PolarHBondContact O-N 2.73Å
123	T	80.9	Confident	84.1	Confident	103 Å²	103	114.1 Å²	114.1	63%	0.632	59%	0.589	S	S	*	*			trans	-69.7	125.4	166.4	45.3	0	0	0	0	106.9	M121 C125	M121-T123 PolarHBondContact O-N 3.36Å; M121-T123 VanDerWaalsContact O-N 3.1Å; T123-C125 PolarHBondContact O-N 3.39Å
124	N	77.9	Confident	83.9	Confident	153 Å²	153	117.1 Å²	117.1	82%	0.818	60%	0.597	S	S	*	*			trans	-69.7	38.5	177.6	-65.9	-8.8	0	0	0	112.5	H122	H122-N124 PolarHBondContact O-N 2.73Å
125	C	79.7	Confident	83.8	Confident	100 Å²	100	117.3 Å²	117.3	68%	0.676	61%	0.609	S	S	*	*			trans	-87.4	111.3	174.8	-65.1	0	0	0	0	108.1	T123 P127	T123-C125 PolarHBondContact O-N 3.39Å; C125-P127 WeakPolarHBondContact O-CD 3.39Å
126	D	81.5	Confident	83.9	Confident	34 Å²	34	118 Å²	118	18%	0.182	61%	0.61	C	S	.	*			trans	-79.6	115.7	169.6	-171.3	-20.5	0	0	0	108.5	R128 G129 I130	D126-R128 PolarHBondContact O-N 2.92Å; D126-R128 VanDerWaalsContact O-N 3.11Å; D126-R128 VanDerWaalsContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CB 3.25Å; D126-R128 WeakPolarHBondContact OD1-CG 3.42Å; D126-R128 IonicContact OD1-CZ 2.68Å; D126-R128 PolarHBondContact OD1-N 3.4Å; D126-R128 IonicContact OD1-NE 3.05Å; D126-R128 PolarHBondContact OD1-NE 3.11Å; D126-R128 IonicContact OD1-NH2 2.67Å; D126-R128 IonicContact OD2-CZ 2.9Å; D126-R128 IonicContact OD2-NE 3.74Å; D126-R128 PolarHBondContact OD2-NE 2.98Å; D126-R128 IonicContact OD2-NH2 3.55Å; D126-R128 PolarHBondContact OD2-NH2 3.28Å; D126-G129 PolarHBondContact O-N 3.4Å; D126-I130 WeakPolarHBondContact OD2-CB 3.36Å; D126-I130 VanDerWaalsContact OD2-CD1 3.27Å; D126-I130 WeakPolarHBondContact OD2-CD1 3.33Å; D126-I130 WeakPolarHBondContact OD2-CG1 3.5Å
127	P	81.9	Confident	83.5	Confident	133 Å²	133	111.8 Å²	111.8	86%	0.864	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-19.1	-179.7	25.8	-34.4	0	0	0	112.7	C125 G129	C125-P127 WeakPolarHBondContact O-CD 3.39Å; P127-G129 PolarHBondContact O-N 3.16Å
128	R	85.1	Confident	82.7	Confident	188 Å²	188	116.6 Å²	116.6	71%	0.709	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-6.7	174.9	-58.5	170.6	-65	-177.9	3.6	112.9	D126 I130	D126-R128 PolarHBondContact O-N 2.92Å; D126-R128 VanDerWaalsContact O-N 3.11Å; D126-R128 VanDerWaalsContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CB 3.25Å; D126-R128 WeakPolarHBondContact OD1-CG 3.42Å; D126-R128 IonicContact OD1-CZ 2.68Å; D126-R128 PolarHBondContact OD1-N 3.4Å; D126-R128 IonicContact OD1-NE 3.05Å; D126-R128 PolarHBondContact OD1-NE 3.11Å; D126-R128 IonicContact OD1-NH2 2.67Å; D126-R128 IonicContact OD2-CZ 2.9Å; D126-R128 IonicContact OD2-NE 3.74Å; D126-R128 PolarHBondContact OD2-NE 2.98Å; D126-R128 IonicContact OD2-NH2 3.55Å; D126-R128 PolarHBondContact OD2-NH2 3.28Å; R128-I130 VanDerWaalsContact C-N 3.26Å; R128-I130 HydrophobicContact CB-CD1 4.36Å; R128-I130 HydrophobicContact CB-CG1 3.9Å; R128-I130 VanDerWaalsContact NH2-CD1 3.33Å; R128-I130 PolarHBondContact O-N 2.9Å
129	G	86.7	Confident	81.9	Confident	27 Å²	27	112.7 Å²	112.7	28%	0.278	58%	0.583	S	S	.	*			trans	68.6	19.7	-179.1	0	0	0	0	0	114.3	D126 P127 H131 V132 R133	D126-G129 PolarHBondContact O-N 3.4Å; P127-G129 PolarHBondContact O-N 3.16Å; G129-H131 PolarHBondContact O-N 2.89Å; G129-V132 PolarHBondContact O-N 3.41Å; G129-R133 PolarHBondContact O-N 2.88Å
130	I	85.1	Confident	80.7	Confident	54 Å²	54	113.4 Å²	113.4	28%	0.277	59%	0.586	S	S	.	*	H	α-helix	trans	-56.5	-38.6	-174.9	-63.9	-173.1	0	0	0	112.1	D126 R128 R133 R134	D126-I130 WeakPolarHBondContact OD2-CB 3.36Å; D126-I130 VanDerWaalsContact OD2-CD1 3.27Å; D126-I130 WeakPolarHBondContact OD2-CD1 3.33Å; D126-I130 WeakPolarHBondContact OD2-CG1 3.5Å; R128-I130 VanDerWaalsContact C-N 3.26Å; R128-I130 HydrophobicContact CB-CD1 4.36Å; R128-I130 HydrophobicContact CB-CG1 3.9Å; R128-I130 VanDerWaalsContact NH2-CD1 3.33Å; R128-I130 PolarHBondContact O-N 2.9Å; I130-R133 PolarHBondContact O-N 3.04Å; I130-R134 HydrophobicContact CG2-CG 4.47Å; I130-R134 WeakPolarHBondContact O-CB 3.46Å; I130-R134 WeakPolarHBondContact O-CG 3.35Å; I130-R134 PolarHBondContact O-N 3.23Å
131	H	83.7	Confident	79.3	Confident	110 Å²	110	114 Å²	114	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-68.7	-38.9	178.6	-59.2	104.6	0	0	0	112.3	G129 R134 A135	G129-H131 PolarHBondContact O-N 2.89Å; H131-R134 PolarHBondContact O-N 3.34Å; H131-A135 WeakPolarHBondContact O-CB 3.47Å; H131-A135 PolarHBondContact O-N 3.41Å
132	V	86.2	Confident	77.9	Confident	97 Å²	97	110.5 Å²	110.5	59%	0.588	56%	0.56	S	S	*	*	H	α-helix	trans	-66	-43.5	174.6	179	0	0	0	0	109.8	G129 A135 M136	G129-V132 PolarHBondContact O-N 3.41Å; V132-A135 PolarHBondContact O-N 3.2Å; V132-M136 HydrophobicContact CG1-CG 4.41Å; V132-M136 WeakPolarHBondContact O-CB 3.27Å; V132-M136 WeakPolarHBondContact O-CG 3.5Å; V132-M136 PolarHBondContact O-N 3.32Å
133	R	84.3	Confident	76.8	Confident	156 Å²	156	108 Å²	108	59%	0.589	56%	0.56	S	S	*	*	H	α-helix	trans	-58.2	-49.8	173.3	179.8	179.5	171.7	-168.9	-1.7	111.5	G129 I130 A135 M136 D137	G129-R133 PolarHBondContact O-N 2.88Å; I130-R133 PolarHBondContact O-N 3.04Å; R133-A135 VanDerWaalsContact C-N 3.27Å; R133-A135 PolarHBondContact O-N 2.81Å; R133-M136 PolarHBondContact O-N 2.82Å; R133-M136 VanDerWaalsContact O-N 3.16Å; R133-D137 WeakPolarHBondContact CG-OD2 3.27Å; R133-D137 IonicContact CZ-OD2 2.69Å; R133-D137 IonicContact NE-OD2 3.29Å; R133-D137 PolarHBondContact NE-OD2 3.41Å; R133-D137 IonicContact NH2-OD2 3.02Å; R133-D137 VanDerWaalsContact O-CB 3.26Å; R133-D137 WeakPolarHBondContact O-CB 3.42Å; R133-D137 PolarHBondContact O-N 3.32Å
134	R	82.1	Confident	75.5	Confident	163 Å²	163	108.9 Å²	108.9	62%	0.615	56%	0.56	S	S	*	*	H	α-helix	trans	-61.2	-33.5	176.7	-82.8	-179.6	159.8	173.9	-6.3	113.1	I130 H131	I130-R134 HydrophobicContact CG2-CG 4.47Å; I130-R134 WeakPolarHBondContact O-CB 3.46Å; I130-R134 WeakPolarHBondContact O-CG 3.35Å; I130-R134 PolarHBondContact O-N 3.23Å; H131-R134 PolarHBondContact O-N 3.34Å
135	A	83.4	Confident	74.5	Confident	81 Å²	81	106.9 Å²	106.9	67%	0.669	55%	0.55	S	S	*	.	H	α-helix	trans	-72.7	-34.4	175.6	0	0	0	0	0	112.5	H131 V132 R133	H131-A135 WeakPolarHBondContact O-CB 3.47Å; H131-A135 PolarHBondContact O-N 3.41Å; V132-A135 PolarHBondContact O-N 3.2Å; R133-A135 VanDerWaalsContact C-N 3.27Å; R133-A135 PolarHBondContact O-N 2.81Å
136	M	83.2	Confident	73.2	Confident	142 Å²	142	108.2 Å²	108.2	70%	0.7	55%	0.546	S	S	*	.	H	α-helix	trans	-81.2	-39.4	177.7	-72.4	-70	173.4	0	0	112.8	V132 R133 W138	V132-M136 HydrophobicContact CG1-CG 4.41Å; V132-M136 WeakPolarHBondContact O-CB 3.27Å; V132-M136 WeakPolarHBondContact O-CG 3.5Å; V132-M136 PolarHBondContact O-N 3.32Å; R133-M136 PolarHBondContact O-N 2.82Å; R133-M136 VanDerWaalsContact O-N 3.16Å; M136-W138 PolarHBondContact O-N 3.11Å
137	D	77.4	Confident	71.9	Confident	48 Å²	48	112.8 Å²	112.8	26%	0.257	57%	0.566	S	S	.	*			trans	-80	61.6	176.3	-69.9	-15.9	0	0	0	109.7	R133 T139 F140	R133-D137 WeakPolarHBondContact CG-OD2 3.27Å; R133-D137 IonicContact CZ-OD2 2.69Å; R133-D137 IonicContact NE-OD2 3.29Å; R133-D137 PolarHBondContact NE-OD2 3.41Å; R133-D137 IonicContact NH2-OD2 3.02Å; R133-D137 VanDerWaalsContact O-CB 3.26Å; R133-D137 WeakPolarHBondContact O-CB 3.42Å; R133-D137 PolarHBondContact O-N 3.32Å; D137-T139 PolarHBondContact O-N 2.96Å; D137-F140 HydrophobicContact CB-CB 4.16Å; D137-F140 HydrophobicContact CB-CD2 4.22Å; D137-F140 PolarHBondContact O-N 3.38Å
138	W	73	Confident	70.8	Confident	202 Å²	202	113 Å²	113	77%	0.765	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-19.4	177	64.9	-77	0	0	0	113	M136	M136-W138 PolarHBondContact O-N 3.11Å
139	T	68.8	Low	69.9	Low	67 Å²	67	108.5 Å²	108.5	41%	0.411	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-23.9	175.9	57.3	0	0	0	0	114	D137 N145	D137-T139 PolarHBondContact O-N 2.96Å; T139-N145 PolarHBondContact O-ND2 3.21Å
140	F	60.8	Low	69.4	Low	143 Å²	143	115.5 Å²	115.5	63%	0.627	59%	0.588	S	S	*	*			trans	-89.7	-1.8	-177.8	-95.4	-79.9	0	0	0	114	D137 D142	D137-F140 HydrophobicContact CB-CB 4.16Å; D137-F140 HydrophobicContact CB-CD2 4.22Å; D137-F140 PolarHBondContact O-N 3.38Å; F140-D142 VanDerWaalsContact C-N 3.25Å; F140-D142 PolarHBondContact O-N 3.25Å
141	N	56.1	Low	69.1	Low	70 Å²	70	114.9 Å²	114.9	37%	0.374	58%	0.584	S	S	.	*			trans	-68.3	93.3	167.5	-83.7	-19.6	0	0	0	108.1	S143 N144 N145	N141-S143 PolarHBondContact O-N 3.38Å; N141-N144 PolarHBondContact O-N 2.98Å; N141-N145 PolarHBondContact O-N 3.45Å
142	D	57.1	Low	69.3	Low	101 Å²	101	114.5 Å²	114.5	54%	0.54	59%	0.586	S	S	.	*	H	α-helix	trans	-47	-31.3	175.3	-81.5	-38.9	0	0	0	112	F140 N144 N145 Q146	F140-D142 VanDerWaalsContact C-N 3.25Å; F140-D142 PolarHBondContact O-N 3.25Å; D142-N144 VanDerWaalsContact C-N 3.3Å; D142-N144 PolarHBondContact O-N 3.41Å; D142-N145 PolarHBondContact O-N 3.31Å; D142-Q146 VanDerWaalsContact O-CB 3.24Å; D142-Q146 WeakPolarHBondContact O-CB 3.36Å; D142-Q146 VanDerWaalsContact O-CG 3.25Å; D142-Q146 WeakPolarHBondContact O-CG 3.33Å; D142-Q146 PolarHBondContact O-N 3.46Å
143	S	57.7	Low	69.5	Low	96 Å²	96	117 Å²	117	67%	0.671	59%	0.589	S	S	*	*	H	α-helix	trans	-64.8	-25.5	176.1	33.4	0	0	0	0	114.8	N141	N141-S143 PolarHBondContact O-N 3.38Å
144	N	54.6	Low	69.8	Low	121 Å²	121	114.4 Å²	114.4	65%	0.647	59%	0.591	S	S	*	*	H	α-helix	trans	-97.6	-26.2	176.5	-78.5	-6.1	0	0	0	113.2	N141 D142	N141-N144 PolarHBondContact O-N 2.98Å; D142-N144 VanDerWaalsContact C-N 3.3Å; D142-N144 PolarHBondContact O-N 3.41Å
145	N	55.2	Low	70.1	Confident	111 Å²	111	111.6 Å²	111.6	59%	0.594	59%	0.585	S	S	*	*	H	α-helix	trans	-92.8	-18.8	-177.5	-88	-1.3	0	0	0	114.4	T139 N141 D142 H147	T139-N145 PolarHBondContact O-ND2 3.21Å; N141-N145 PolarHBondContact O-N 3.45Å; D142-N145 PolarHBondContact O-N 3.31Å; N145-H147 VanDerWaalsContact C-N 3.34Å; N145-H147 PolarHBondContact O-N 2.98Å
146	Q	54.3	Low	70.4	Confident	128 Å²	128	111.3 Å²	111.3	60%	0.598	57%	0.571	S	S	*	*	S	Bend	trans	-81.1	-6.7	-176.6	-75.9	179.7	-3.1	0	0	115.7	D142	D142-Q146 VanDerWaalsContact O-CB 3.24Å; D142-Q146 WeakPolarHBondContact O-CB 3.36Å; D142-Q146 VanDerWaalsContact O-CG 3.25Å; D142-Q146 WeakPolarHBondContact O-CG 3.33Å; D142-Q146 PolarHBondContact O-N 3.46Å
147	H	52.8	Low	70.6	Confident	131 Å²	131	108.3 Å²	108.3	61%	0.606	56%	0.557	S	S	*	*			trans	-132.2	106.1	173.9	-64.9	-67	0	0	0	109.3	N145 T149	N145-H147 VanDerWaalsContact C-N 3.34Å; N145-H147 PolarHBondContact O-N 2.98Å; H147-T149 PolarHBondContact O-N 3.06Å
148	T	59.3	Low	71.2	Confident	137 Å²	137	112.9 Å²	112.9	84%	0.84	57%	0.572	S	S	*	*				-50	100	129.3	40.7	0	0	0	0	104.8	I150	T148-I150 PolarHBondContact O-N 3.48Å
149	T	65.4	Low	71.9	Confident	94 Å²	94	108.1 Å²	108.1	58%	0.577	56%	0.557	S	S	*	*			trans	-47.7	126	178.1	42.9	0	0	0	0	106	H147 M151	H147-T149 PolarHBondContact O-N 3.06Å; T149-M151 VanDerWaalsContact O-CG 3.31Å; T149-M151 WeakPolarHBondContact O-CG 3.42Å; T149-M151 PolarHBondContact O-N 3.29Å; T149-M151 VanDerWaalsContact OG1-CG 3.31Å; T149-M151 WeakPolarHBondContact OG1-CG 3.22Å
150	I	77.4	Confident	72.7	Confident	173 Å²	173	108.5 Å²	108.5	89%	0.887	56%	0.559	S	S	*	*			trans	-59.7	99.1	171.6	-63.1	173.5	0	0	0	104.8	T148	T148-I150 PolarHBondContact O-N 3.48Å
151	M	78.3	Confident	74	Confident	42 Å²	42	106 Å²	106	21%	0.207	55%	0.548	C	S	.	.			trans	-94.7	150.7	-176.3	-77	173.5	74	0	0	108.2	T149 K153 Q155 I156 K159	T149-M151 VanDerWaalsContact O-CG 3.31Å; T149-M151 WeakPolarHBondContact O-CG 3.42Å; T149-M151 PolarHBondContact O-N 3.29Å; T149-M151 VanDerWaalsContact OG1-CG 3.31Å; T149-M151 WeakPolarHBondContact OG1-CG 3.22Å; M151-K153 PolarHBondContact O-N 3Å; M151-Q155 HydrophobicContact CE-CB 4.12Å; M151-Q155 HydrophobicContact CE-CG 3.51Å; M151-I156 HydrophobicContact CB-CD1 3.94Å; M151-I156 HydrophobicContact CB-CG1 3.63Å; M151-K159 HydrophobicContact CE-CD 4.04Å
152	N	88.1	Confident	75.5	Confident	102 Å²	102	106.5 Å²	106.5	55%	0.545	55%	0.548	S	S	.	.			trans	-56.8	133.6	169.7	-177.1	-13.3	0	0	0	108.8	T154 Q155 I156	N152-T154 PolarHBondContact O-N 2.95Å; N152-T154 VanDerWaalsContact O-N 3.16Å; N152-T154 PolarHBondContact OD1-N 3.46Å; N152-T154 VanDerWaalsContact OD1-N 3.16Å; N152-T154 PolarHBondContact OD1-OG1 3.44Å; N152-Q155 HydrophobicContact CB-CB 4.28Å; N152-Q155 WeakPolarHBondContact O-CA 3.47Å; N152-Q155 VanDerWaalsContact O-CB 3.28Å; N152-Q155 WeakPolarHBondContact O-CB 3.3Å; N152-Q155 PolarHBondContact O-N 2.83Å; N152-I156 PolarHBondContact O-N 2.82Å
153	K	90.1	Very high	76.9	Confident	150 Å²	150	105.3 Å²	105.3	65%	0.652	54%	0.542	S	S	*	.	H	α-helix	trans	-49.2	-42.9	177.8	-176.5	178.7	176.3	-179.5	0	111.7	M151 Q155 I156 D157	M151-K153 PolarHBondContact O-N 3Å; K153-Q155 PolarHBondContact O-N 3.28Å; K153-I156 PolarHBondContact O-N 3.18Å; K153-I156 VanDerWaalsContact O-N 3.13Å; K153-D157 WeakPolarHBondContact O-CB 3.48Å; K153-D157 VanDerWaalsContact O-CG 3.23Å; K153-D157 PolarHBondContact O-N 3.31Å
154	T	91.2	Very high	78.4	Confident	101 Å²	101	107 Å²	107	62%	0.62	54%	0.544	S	S	*	.	H	α-helix	trans	-60.2	-34.4	178.4	-29.7	0	0	0	0	112.5	N152 Y158	N152-T154 PolarHBondContact O-N 2.95Å; N152-T154 VanDerWaalsContact O-N 3.16Å; N152-T154 PolarHBondContact OD1-N 3.46Å; N152-T154 VanDerWaalsContact OD1-N 3.16Å; N152-T154 PolarHBondContact OD1-OG1 3.44Å; T154-Y158 WeakPolarHBondContact O-CB 3.25Å; T154-Y158 PolarHBondContact O-N 3.41Å
155	Q	88.8	Confident	80	Confident	104 Å²	104	105.4 Å²	105.4	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-75.7	-36	178.5	-162.5	-177.7	4.1	0	0	111.8	M151 N152 K153 K159	M151-Q155 HydrophobicContact CE-CB 4.12Å; M151-Q155 HydrophobicContact CE-CG 3.51Å; N152-Q155 HydrophobicContact CB-CB 4.28Å; N152-Q155 WeakPolarHBondContact O-CA 3.47Å; N152-Q155 VanDerWaalsContact O-CB 3.28Å; N152-Q155 WeakPolarHBondContact O-CB 3.3Å; N152-Q155 PolarHBondContact O-N 2.83Å; K153-Q155 PolarHBondContact O-N 3.28Å; Q155-K159 WeakPolarHBondContact O-CB 3.26Å; Q155-K159 PolarHBondContact O-N 2.95Å
156	I	88.3	Confident	81.5	Confident	75 Å²	75	108.7 Å²	108.7	39%	0.385	55%	0.55	S	S	.	*	H	α-helix	trans	-66.3	-47.8	173.1	-64.1	173.2	0	0	0	110.1	M151 N152 K153 Y158 K159 T160	M151-I156 HydrophobicContact CB-CD1 3.94Å; M151-I156 HydrophobicContact CB-CG1 3.63Å; N152-I156 PolarHBondContact O-N 2.82Å; K153-I156 PolarHBondContact O-N 3.18Å; K153-I156 VanDerWaalsContact O-N 3.13Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 2.91Å; I156-K159 PolarHBondContact O-N 2.99Å; I156-T160 WeakPolarHBondContact O-CB 3.21Å; I156-T160 PolarHBondContact O-N 2.89Å; I156-T160 PolarHBondContact O-OG1 3.13Å
157	D	88.4	Confident	83.2	Confident	78 Å²	78	106.6 Å²	106.6	42%	0.417	56%	0.563	S	S	.	*	H	α-helix	trans	-60.3	-42.9	179.2	-65.1	-13.8	0	0	0	110.2	K153 T160 K161	K153-D157 WeakPolarHBondContact O-CB 3.48Å; K153-D157 VanDerWaalsContact O-CG 3.23Å; K153-D157 PolarHBondContact O-N 3.31Å; D157-T160 PolarHBondContact O-N 3.39Å; D157-K161 VanDerWaalsContact O-CB 3.3Å; D157-K161 WeakPolarHBondContact O-CB 3.3Å; D157-K161 PolarHBondContact O-N 3.02Å; D157-K161 VanDerWaalsContact O-N 3.11Å
158	Y	88.9	Confident	84.8	Confident	144 Å²	144	107.1 Å²	107.1	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-61	-50.7	173.8	-177.9	-90	0	0	0	112.4	T154 I156 T160 K161 H162	T154-Y158 WeakPolarHBondContact O-CB 3.25Å; T154-Y158 PolarHBondContact O-N 3.41Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 2.91Å; Y158-T160 PolarHBondContact O-N 3.28Å; Y158-K161 PolarHBondContact O-N 2.9Å; Y158-H162 AromaticContact CD2-CD2 3.48Å; Y158-H162 VanDerWaalsContact CD2-CD2 3.48Å; Y158-H162 WeakPolarHBondContact CD2-CD2 3.24Å; Y158-H162 AromaticContact CD2-NE2 3.97Å; Y158-H162 HydrophobicContact CE1-CB 4.41Å; Y158-H162 AromaticContact CE2-CD2 3.42Å; Y158-H162 VanDerWaalsContact CE2-CD2 3.42Å; Y158-H162 WeakPolarHBondContact CE2-CD2 3.36Å; Y158-H162 AromaticContact CE2-NE2 3.8Å; Y158-H162 AromaticContact CG-CD2 3.96Å; Y158-H162 AromaticContact CZ-CD2 3.85Å; Y158-H162 WeakPolarHBondContact O-CB 3.26Å; Y158-H162 PolarHBondContact O-CD2 3.05Å; Y158-H162 VanDerWaalsContact O-CD2 3.28Å; Y158-H162 PolarHBondContact O-N 2.94Å
159	K	88	Confident	86.1	Confident	102 Å²	102	107.4 Å²	107.4	44%	0.443	57%	0.565	S	S	.	*	H	α-helix	trans	-58.8	-46.6	177.3	-87.9	-158.2	167.5	179.9	0	112	M151 Q155 I156 K161 H162 D163	M151-K159 HydrophobicContact CE-CD 4.04Å; Q155-K159 WeakPolarHBondContact O-CB 3.26Å; Q155-K159 PolarHBondContact O-N 2.95Å; I156-K159 PolarHBondContact O-N 2.99Å; K159-K161 PolarHBondContact O-N 2.74Å; K159-H162 PolarHBondContact O-N 2.81Å; K159-D163 WeakPolarHBondContact CD-OD2 3.3Å; K159-D163 WeakPolarHBondContact CG-OD2 3.2Å; K159-D163 VanDerWaalsContact O-CB 3.23Å; K159-D163 WeakPolarHBondContact O-CB 3.4Å; K159-D163 PolarHBondContact O-N 3.3Å
160	T	85.5	Confident	87.2	Confident	76 Å²	76	109.8 Å²	109.8	47%	0.466	56%	0.563	S	S	.	*	H	α-helix	trans	-62.6	-31.4	-177.6	-49.4	0	0	0	0	111.9	I156 D157 Y158	I156-T160 WeakPolarHBondContact O-CB 3.21Å; I156-T160 PolarHBondContact O-N 2.89Å; I156-T160 PolarHBondContact O-OG1 3.13Å; D157-T160 PolarHBondContact O-N 3.39Å; Y158-T160 PolarHBondContact O-N 3.28Å
161	K	87.9	Confident	87.5	Confident	90 Å²	90	104.6 Å²	104.6	39%	0.391	54%	0.537	S	S	.	.	H	α-helix	trans	-81.9	-33.3	179.6	-170.7	172.2	178.3	148.5	0	113.6	D157 Y158 K159 P172	D157-K161 VanDerWaalsContact O-CB 3.3Å; D157-K161 WeakPolarHBondContact O-CB 3.3Å; D157-K161 PolarHBondContact O-N 3.02Å; D157-K161 VanDerWaalsContact O-N 3.11Å; Y158-K161 PolarHBondContact O-N 2.9Å; K159-K161 PolarHBondContact O-N 2.74Å; K161-P172 WeakPolarHBondContact CE-O 3.19Å; K161-P172 HydrophobicContact CG-CB 4.04Å; K161-P172 PolarHBondContact NZ-O 3.03Å; K161-P172 VanDerWaalsContact NZ-O 3.15Å
162	H	87.6	Confident	87.9	Confident	80 Å²	80	105 Å²	105	37%	0.37	54%	0.543	S	S	.	.	H	α-helix	trans	-111.5	-26.2	-168	-69.8	-70.3	0	0	0	115	Y158 K159	Y158-H162 AromaticContact CD2-CD2 3.48Å; Y158-H162 VanDerWaalsContact CD2-CD2 3.48Å; Y158-H162 WeakPolarHBondContact CD2-CD2 3.24Å; Y158-H162 AromaticContact CD2-NE2 3.97Å; Y158-H162 HydrophobicContact CE1-CB 4.41Å; Y158-H162 AromaticContact CE2-CD2 3.42Å; Y158-H162 VanDerWaalsContact CE2-CD2 3.42Å; Y158-H162 WeakPolarHBondContact CE2-CD2 3.36Å; Y158-H162 AromaticContact CE2-NE2 3.8Å; Y158-H162 AromaticContact CG-CD2 3.96Å; Y158-H162 AromaticContact CZ-CD2 3.85Å; Y158-H162 WeakPolarHBondContact O-CB 3.26Å; Y158-H162 PolarHBondContact O-CD2 3.05Å; Y158-H162 VanDerWaalsContact O-CD2 3.28Å; Y158-H162 PolarHBondContact O-N 2.94Å; K159-H162 PolarHBondContact O-N 2.81Å
163	D	87.9	Confident	87.8	Confident	76 Å²	76	104.8 Å²	104.8	41%	0.406	54%	0.541	S	S	.	.	S	Bend	trans	-84.1	145.6	179.5	-63.9	-11.3	0	0	0	111	K159	K159-D163 WeakPolarHBondContact CD-OD2 3.3Å; K159-D163 WeakPolarHBondContact CG-OD2 3.2Å; K159-D163 VanDerWaalsContact O-CB 3.23Å; K159-D163 WeakPolarHBondContact O-CB 3.4Å; K159-D163 PolarHBondContact O-N 3.3Å
164	D	89.5	Confident	87.5	Confident	133 Å²	133	105.2 Å²	105.2	71%	0.711	54%	0.538	S	S	*	.			trans	-81.7	129.4	174.4	-65.8	-38.3	0	0	0	110.5
165	I	86.5	Confident	86.9	Confident	87 Å²	87	106.8 Å²	106.8	45%	0.446	54%	0.543	S	S	.	.	B	Isolated β-bridge	trans	-110.9	127.3	177.3	-58.8	170.6	0	0	0	108.4	G167 K168	I165-G167 PolarHBondContact O-N 2.73Å; I165-K168 HydrophobicContact CB-CB 4.33Å; I165-K168 HydrophobicContact CG2-CD 4.41Å; I165-K168 PolarHBondContact O-N 2.74Å
166	L	87.7	Confident	86.8	Confident	179 Å²	179	107 Å²	107	94%	0.937	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	128.3	179.5	-166	72.9	0	0	0	110.9	K168	L166-K168 VanDerWaalsContact C-N 3.31Å; L166-K168 PolarHBondContact O-N 2.72Å
167	G	89	Confident	86.6	Confident	84 Å²	84	107 Å²	107	87%	0.866	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.5	-3.4	-179.4	0	0	0	0	0	115.5	I165	I165-G167 PolarHBondContact O-N 2.73Å
168	K	87.4	Confident	86.4	Confident	143 Å²	143	112.8 Å²	112.8	62%	0.622	57%	0.572	S	S	*	*	B	Isolated β-bridge	trans	-119.8	130.7	173	-66.7	-175.2	179.5	178.9	0	110.2	I165 L166	I165-K168 HydrophobicContact CB-CB 4.33Å; I165-K168 HydrophobicContact CG2-CD 4.41Å; I165-K168 PolarHBondContact O-N 2.74Å; L166-K168 VanDerWaalsContact C-N 3.31Å; L166-K168 PolarHBondContact O-N 2.72Å
169	V	86.6	Confident	86.3	Confident	142 Å²	142	109.1 Å²	109.1	86%	0.861	56%	0.562	S	S	*	*			trans	-70.4	138.2	172.6	-179.1	0	0	0	0	108.7	D171	V169-D171 PolarHBondContact O-N 3.24Å
170	R	88	Confident	86.4	Confident	145 Å²	145	109 Å²	109	55%	0.547	57%	0.571	S	S	.	*			trans	-64.6	114.2	177.5	-169.9	178.8	73.7	161.5	0.2	110.2
171	D	84.5	Confident	86.3	Confident	64 Å²	64	113.8 Å²	113.8	34%	0.342	59%	0.594	S	S	.	*			trans	-123	93.5	179.5	-176.8	2.3	0	0	0	111.4	V169 I173 R174	V169-D171 PolarHBondContact O-N 3.24Å; D171-I173 PolarHBondContact O-N 3.3Å; D171-I173 WeakPolarHBondContact OD1-CG1 3.19Å; D171-I173 PolarHBondContact OD1-N 3.12Å; D171-R174 HydrophobicContact CB-CB 4.46Å; D171-R174 PolarHBondContact OD1-N 3.48Å
172	P	85.5	Confident	86.3	Confident	50 Å²	50	116.7 Å²	116.7	33%	0.325	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	-15.2	-179.8	-18.8	32	0	0	0	114.9	K161	K161-P172 WeakPolarHBondContact CE-O 3.19Å; K161-P172 HydrophobicContact CG-CB 4.04Å; K161-P172 PolarHBondContact NZ-O 3.03Å; K161-P172 VanDerWaalsContact NZ-O 3.15Å
173	I	86.8	Confident	86.4	Confident	97 Å²	97	117.3 Å²	117.3	50%	0.497	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.9	3.6	-175	58.1	167.6	0	0	0	112.8	D171 D175 T176 M177	D171-I173 PolarHBondContact O-N 3.3Å; D171-I173 WeakPolarHBondContact OD1-CG1 3.19Å; D171-I173 PolarHBondContact OD1-N 3.12Å; I173-D175 VanDerWaalsContact C-N 3.28Å; I173-D175 PolarHBondContact O-N 2.89Å; I173-D175 VanDerWaalsContact O-N 3.15Å; I173-T176 CarbonylContact O-C 3.48Å; I173-T176 WeakPolarHBondContact O-CA 3.22Å; I173-T176 PolarHBondContact O-N 3.42Å; I173-T176 PolarHBondContact O-OG1 3.06Å; I173-M177 HydrophobicContact CD1-SD 4.34Å; I173-M177 PolarHBondContact O-N 2.85Å
174	R	83	Confident	86.3	Confident	159 Å²	159	120.7 Å²	120.7	60%	0.6	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-45.4	-48	-178.5	-175.3	178.6	179	-166.7	-4.9	113.8	D171 T176 M177	D171-R174 HydrophobicContact CB-CB 4.46Å; D171-R174 PolarHBondContact OD1-N 3.48Å; R174-T176 PolarHBondContact O-N 3.46Å; R174-M177 PolarHBondContact O-N 2.86Å
175	D	80	Confident	86.2	Confident	135 Å²	135	120.4 Å²	120.4	72%	0.722	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-70.1	-21.8	-177.1	-57.4	-24.3	0	0	0	113.2	I173	I173-D175 VanDerWaalsContact C-N 3.28Å; I173-D175 PolarHBondContact O-N 2.89Å; I173-D175 VanDerWaalsContact O-N 3.15Å
176	T	85.2	Confident	86.2	Confident	107 Å²	107	119.6 Å²	119.6	66%	0.656	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-95.3	-13.6	179.5	51.4	0	0	0	0	113.3	I173 R174 K178	I173-T176 CarbonylContact O-C 3.48Å; I173-T176 WeakPolarHBondContact O-CA 3.22Å; I173-T176 PolarHBondContact O-N 3.42Å; I173-T176 PolarHBondContact O-OG1 3.06Å; R174-T176 PolarHBondContact O-N 3.46Å; T176-K178 PolarHBondContact O-N 3.08Å; T176-K178 VanDerWaalsContact O-N 3.14Å
177	M	84.3	Confident	85.9	Confident	76 Å²	76	119.2 Å²	119.2	37%	0.374	64%	0.637	S	S	.	*			trans	-83.2	92	-175.4	-165.3	145.5	89	0	0	111.3	I173 R174 I179 F185	I173-M177 HydrophobicContact CD1-SD 4.34Å; I173-M177 PolarHBondContact O-N 2.85Å; R174-M177 PolarHBondContact O-N 2.86Å; M177-I179 HydrophobicContact CG-CB 4.3Å; M177-I179 HydrophobicContact CG-CD1 3.71Å; M177-I179 HydrophobicContact CG-CG1 3.92Å; M177-I179 PolarHBondContact O-N 3.44Å; M177-I179 HydrophobicContact SD-CD1 4.08Å; M177-F185 HydrophobicContact CE-CE2 4.23Å; M177-F185 HydrophobicContact CE-CZ 3.64Å; M177-F185 HydrophobicContact SD-CE1 4.02Å; M177-F185 HydrophobicContact SD-CZ 3.6Å; M177-F185 VanDerWaalsContact SD-CZ 3.6Å
178	K	85.4	Confident	85.1	Confident	200 Å²	200	123.4 Å²	123.4	87%	0.87	63%	0.632	S	S	*	*			trans	-94.6	66.6	176.3	-63.2	-177.7	-178.5	-179.2	0	111.3	T176	T176-K178 PolarHBondContact O-N 3.08Å; T176-K178 VanDerWaalsContact O-N 3.14Å
179	I	87.2	Confident	84.4	Confident	67 Å²	67	123.3 Å²	123.3	34%	0.344	64%	0.638	S	S	.	*			trans	-125.2	140	-176.4	-56.6	177.6	0	0	0	108	M177 H183 F185	M177-I179 HydrophobicContact CG-CB 4.3Å; M177-I179 HydrophobicContact CG-CD1 3.71Å; M177-I179 HydrophobicContact CG-CG1 3.92Å; M177-I179 PolarHBondContact O-N 3.44Å; M177-I179 HydrophobicContact SD-CD1 4.08Å; I179-H183 HydrophobicContact CG2-CB 3.12Å; I179-H183 VanDerWaalsContact CG2-CD2 3.44Å; I179-H183 WeakPolarHBondContact CG2-CD2 3.4Å; I179-F185 HydrophobicContact CD1-CE1 3.58Å; I179-F185 HydrophobicContact CD1-CZ 3.93Å
180	P	88.4	Confident	83.2	Confident	99 Å²	99	124.2 Å²	124.2	64%	0.643	63%	0.63	S	S	*	*			trans	-56.6	144.1	172.7	-22.5	33	0	0	0	111.6	D182 H183	P180-D182 PolarHBondContact O-N 3.35Å; P180-H183 VanDerWaalsContact O-CB 3.24Å; P180-H183 WeakPolarHBondContact O-CB 3.4Å; P180-H183 PolarHBondContact O-N 3.22Å
181	D	83.9	Confident	81.6	Confident	176 Å²	176	123 Å²	123	94%	0.941	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-22.9	-179.2	-65.4	-23.6	0	0	0	113.2	H183	D181-H183 VanDerWaalsContact C-N 3.3Å
182	D	87.6	Confident	80.2	Confident	152 Å²	152	126.2 Å²	126.2	81%	0.813	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	7.6	178.7	-156.8	26.5	0	0	0	113.4	P180 I184	P180-D182 PolarHBondContact O-N 3.35Å; D182-I184 PolarHBondContact O-N 2.6Å
183	H	89.9	Confident	79	Confident	92 Å²	92	131.1 Å²	131.1	43%	0.426	68%	0.68	S	S	.	*			trans	-75.6	125.6	177.4	179.1	73.9	0	0	0	112.1	I179 P180 D181 F185	I179-H183 HydrophobicContact CG2-CB 3.12Å; I179-H183 VanDerWaalsContact CG2-CD2 3.44Å; I179-H183 WeakPolarHBondContact CG2-CD2 3.4Å; P180-H183 VanDerWaalsContact O-CB 3.24Å; P180-H183 WeakPolarHBondContact O-CB 3.4Å; P180-H183 PolarHBondContact O-N 3.22Å; D181-H183 VanDerWaalsContact C-N 3.3Å; H183-F185 AromaticContact CD2-CD1 3.78Å; H183-F185 AromaticContact CD2-CE1 3.79Å; H183-F185 AromaticContact NE2-CD1 3.87Å
184	I	86.3	Confident	77.9	Confident	147 Å²	147	130.2 Å²	130.2	75%	0.754	68%	0.679	S	S	*	*			trans	-90.3	112.9	173.2	-55.2	173.5	0	0	0	108.8	D182	D182-I184 PolarHBondContact O-N 2.6Å
185	F	86.2	Confident	77.2	Confident	128 Å²	128	127.3 Å²	127.3	56%	0.561	68%	0.679	S	S	*	*			trans	-67	147.7	172.7	-64.4	-79.7	0	0	0	111.5	M177 I179 H183	M177-F185 HydrophobicContact CE-CE2 4.23Å; M177-F185 HydrophobicContact CE-CZ 3.64Å; M177-F185 HydrophobicContact SD-CE1 4.02Å; M177-F185 HydrophobicContact SD-CZ 3.6Å; M177-F185 VanDerWaalsContact SD-CZ 3.6Å; I179-F185 HydrophobicContact CD1-CE1 3.58Å; I179-F185 HydrophobicContact CD1-CZ 3.93Å; H183-F185 AromaticContact CD2-CD1 3.78Å; H183-F185 AromaticContact CD2-CE1 3.79Å; H183-F185 AromaticContact NE2-CD1 3.87Å
186	G	87.5	Confident	76.7	Confident	69 Å²	69	125.8 Å²	125.8	71%	0.711	67%	0.674	S	S	*	*	S	Bend	trans	126.1	170.7	178.4	0	0	0	0	0	112	F188	G186-F188 PolarHBondContact O-N 3.47Å
187	L	80.9	Confident	75.8	Confident	172 Å²	172	122 Å²	122	90%	0.901	66%	0.657	S	S	*	*			trans	-76.7	105.8	170.8	-70.1	165.8	0	0	0	107.8	N189	L187-N189 PolarHBondContact O-N 3.18Å
188	F	73.2	Confident	74.7	Confident	172 Å²	172	122.1 Å²	122.1	75%	0.754	66%	0.656	S	S	*	*			trans	-69.6	111.5	166.6	-174.2	-88.7	0	0	0	107.7	G186 K190	G186-F188 PolarHBondContact O-N 3.47Å; F188-K190 HydrophobicContact CD1-CB 4.12Å; F188-K190 HydrophobicContact CD1-CG 3.63Å; F188-K190 HydrophobicContact CE1-CB 4.28Å; F188-K190 HydrophobicContact CE1-CG 3.57Å; F188-K190 PolarHBondContact O-N 3.15Å
189	N	73.1	Confident	73.7	Confident	140 Å²	140	118.3 Å²	118.3	75%	0.749	65%	0.645	S	S	*	*			trans	-67.7	83.1	169.7	-85.7	-13.2	0	0	0	108.4	L187 T191	L187-N189 PolarHBondContact O-N 3.18Å; N189-T191 PolarHBondContact O-N 3.35Å
190	K	60.1	Low	72.8	Confident	162 Å²	162	121.3 Å²	121.3	70%	0.704	66%	0.661	S	S	*	*			trans	-64.9	89.1	159.4	-101.9	-178.1	-175.1	-176.9	0	106.1	F188 N192	F188-K190 HydrophobicContact CD1-CB 4.12Å; F188-K190 HydrophobicContact CD1-CG 3.63Å; F188-K190 HydrophobicContact CE1-CB 4.28Å; F188-K190 HydrophobicContact CE1-CG 3.57Å; F188-K190 PolarHBondContact O-N 3.15Å; K190-N192 VanDerWaalsContact C-N 3.28Å; K190-N192 PolarHBondContact O-N 3.35Å
191	T	54.9	Low	71.2	Confident	119 Å²	119	123.8 Å²	123.8	73%	0.73	66%	0.663	S	S	*	*			trans	-67	99	160.7	50.7	0	0	0	0	105.3	N189 D193	N189-T191 PolarHBondContact O-N 3.35Å; T191-D193 PolarHBondContact O-N 3.5Å; T191-D193 VanDerWaalsContact O-N 3.12Å
192	N	54.8	Low	69.5	Low	132 Å²	132	117 Å²	117	71%	0.706	64%	0.635	S	S	*	*			trans	-39.7	123.3	177.4	-78.8	-17.5	0	0	0	110.4	K190 T194	K190-N192 VanDerWaalsContact C-N 3.28Å; K190-N192 PolarHBondContact O-N 3.35Å; N192-T194 PolarHBondContact O-N 3.16Å; N192-T194 PolarHBondContact O-OG1 3.06Å
193	D	60.5	Low	67.4	Low	153 Å²	153	117 Å²	117	82%	0.818	63%	0.634	S	S	*	*	S	Bend	trans	-37.8	45.7	-171.6	-55.8	-34.2	0	0	0	119.2	T191 Q198	T191-D193 PolarHBondContact O-N 3.5Å; T191-D193 VanDerWaalsContact O-N 3.12Å; D193-Q198 PolarHBondContact O-OE1 3.23Å
194	T	63.1	Low	65.1	Low	78 Å²	78	118.8 Å²	118.8	48%	0.479	65%	0.646	S	S	.	*			trans	-131.2	99.2	174.3	15.7	0	0	0	0	109	N192 L199	N192-T194 PolarHBondContact O-N 3.16Å; N192-T194 PolarHBondContact O-OG1 3.06Å; T194-L199 HydrophobicContact CG2-CD2 4.15Å; T194-L199 HydrophobicContact CG2-CG 4.36Å
195	T	68	Low	62.9	Low	98 Å²	98	115.4 Å²	115.4	60%	0.601	63%	0.634	S	S	*	*			trans	-65.9	144.5	170.8	-53.8	0	0	0	0	108.3	G197 Q198 L199	T195-G197 PolarHBondContact O-N 3.14Å; T195-Q198 WeakPolarHBondContact O-CA 3.49Å; T195-Q198 WeakPolarHBondContact O-CB 3.3Å; T195-Q198 PolarHBondContact O-N 3.1Å; T195-L199 PolarHBondContact O-N 3.13Å
196	V	69.8	Low	60.8	Low	103 Å²	103	120.6 Å²	120.6	62%	0.624	65%	0.65	S	S	*	*	H	α-helix	trans	-50.8	-33.5	176.3	179.3	0	0	0	0	111.6	L199 L200	V196-L199 PolarHBondContact O-N 3.24Å; V196-L200 HydrophobicContact CG1-CD1 3.78Å; V196-L200 HydrophobicContact CG1-CG 4.19Å; V196-L200 WeakPolarHBondContact O-CB 3.43Å; V196-L200 VanDerWaalsContact O-CG 3.29Å; V196-L200 WeakPolarHBondContact O-CG 3.43Å; V196-L200 PolarHBondContact O-N 3.22Å
197	G	67	Low	58.7	Low	28 Å²	28	124.5 Å²	124.5	29%	0.289	65%	0.654	S	S	.	*	H	α-helix	trans	-64.7	-34.8	173.2	0	0	0	0	0	115.3	T195 L199 L200 H201	T195-G197 PolarHBondContact O-N 3.14Å; G197-L199 VanDerWaalsContact C-N 3.33Å; G197-L200 PolarHBondContact O-N 2.69Å; G197-H201 WeakPolarHBondContact O-CB 3.25Å; G197-H201 PolarHBondContact O-CD2 3.11Å; G197-H201 PolarHBondContact O-N 3.13Å
198	Q	61.1	Low	56.9	Low	77 Å²	77	119.7 Å²	119.7	36%	0.36	63%	0.629	S	S	.	*	H	α-helix	trans	-71.6	-29.8	173.4	-73.3	167.8	-35.4	0	0	111.7	D193 T195 G202	D193-Q198 PolarHBondContact O-OE1 3.23Å; T195-Q198 WeakPolarHBondContact O-CA 3.49Å; T195-Q198 WeakPolarHBondContact O-CB 3.3Å; T195-Q198 PolarHBondContact O-N 3.1Å; Q198-G202 CarbonylContact O-C 3.46Å; Q198-G202 WeakPolarHBondContact O-CA 3.45Å; Q198-G202 PolarHBondContact O-N 2.83Å; Q198-G202 VanDerWaalsContact O-N 3.07Å
199	L	65	Low	55.4	Low	120 Å²	120	114.1 Å²	114.1	63%	0.628	60%	0.604	S	S	*	*	H	α-helix	trans	-73.4	-36.6	172.6	-68	169.2	0	0	0	111.9	T194 T195 V196 G197	T194-L199 HydrophobicContact CG2-CD2 4.15Å; T194-L199 HydrophobicContact CG2-CG 4.36Å; T195-L199 PolarHBondContact O-N 3.13Å; V196-L199 PolarHBondContact O-N 3.24Å; G197-L199 VanDerWaalsContact C-N 3.33Å
200	L	67.2	Low	54	Low	131 Å²	131	111 Å²	111	69%	0.686	61%	0.606	S	S	*	*	H	α-helix	trans	-82.4	-37.2	-177.6	-71.7	174.5	0	0	0	114.1	V196 G197	V196-L200 HydrophobicContact CG1-CD1 3.78Å; V196-L200 HydrophobicContact CG1-CG 4.19Å; V196-L200 WeakPolarHBondContact O-CB 3.43Å; V196-L200 VanDerWaalsContact O-CG 3.29Å; V196-L200 WeakPolarHBondContact O-CG 3.43Å; V196-L200 PolarHBondContact O-N 3.22Å; G197-L200 PolarHBondContact O-N 2.69Å
201	H	55.2	Low	53	Low	150 Å²	150	109.7 Å²	109.7	69%	0.694	61%	0.606	S	S	*	*	H	α-helix	trans	-99.9	-3.3	179.9	-53.1	-48	0	0	0	113	G197	G197-H201 WeakPolarHBondContact O-CB 3.25Å; G197-H201 PolarHBondContact O-CD2 3.11Å; G197-H201 PolarHBondContact O-N 3.13Å
202	G	47.4	Very low	52.1	Low	34 Å²	34	114.6 Å²	114.6	35%	0.351	61%	0.612	S	S	.	*			trans	76.1	-178.1	-177.2	0	0	0	0	0	113.8	Q198 L204	Q198-G202 CarbonylContact O-C 3.46Å; Q198-G202 WeakPolarHBondContact O-CA 3.45Å; Q198-G202 PolarHBondContact O-N 2.83Å; Q198-G202 VanDerWaalsContact O-N 3.07Å; G202-L204 PolarHBondContact O-N 3.47Å; G202-L204 VanDerWaalsContact O-N 3.1Å
203	L	44.6	Very low	51.3	Low	151 Å²	151	114.7 Å²	114.7	79%	0.791	62%	0.618	S	S	*	*			trans	-79.2	88.3	178.5	-65.6	171.4	0	0	0	110.4
204	L	40.6	Very low	49.9	Very low	130 Å²	130	114.5 Å²	114.5	68%	0.681	62%	0.617	S	S	*	*			trans	-60.4	122.6	155.9	-94.3	98.3	0	0	0	107.8	G202 R206	G202-L204 PolarHBondContact O-N 3.47Å; G202-L204 VanDerWaalsContact O-N 3.1Å; L204-R206 PolarHBondContact O-N 3.48Å
205	P	40.2	Very low	48.5	Very low	77 Å²	77	118.1 Å²	118.1	50%	0.5	63%	0.633	S	S	.	*			trans	-68.1	129.5	-168.1	-14.4	28.1	0	0	0	110.6	N207 I208	P205-N207 PolarHBondContact O-N 3.17Å; P205-N207 VanDerWaalsContact O-N 3.14Å; P205-I208 WeakPolarHBondContact O-CG1 3.43Å
206	R	42.5	Very low	46.9	Very low	236 Å²	236	118.8 Å²	118.8	89%	0.891	64%	0.642	S	S	*	*	S	Bend	trans	-62.9	-6.9	163	-83.3	-178.8	169.1	-177.8	-4	113.1	L204	L204-R206 PolarHBondContact O-N 3.48Å
207	N	42.6	Very low	45.4	Very low	151 Å²	151	118.7 Å²	118.7	81%	0.807	65%	0.646	S	S	*	*			trans	-111.5	78.5	176.6	-68.8	-8.3	0	0	0	109.9	P205	P205-N207 PolarHBondContact O-N 3.17Å; P205-N207 VanDerWaalsContact O-N 3.14Å
208	I	44.6	Very low	43.8	Very low	72 Å²	72	124.6 Å²	124.6	37%	0.369	67%	0.669	S	S	.	*			trans	-100.2	112.4	172.3	-71.9	167.1	0	0	0	107.9	P205 V242	P205-I208 WeakPolarHBondContact O-CG1 3.43Å; I208-V242 HydrophobicContact CD1-CG2 4.23Å
209	F	40.2	Very low	42.5	Very low	54 Å²	54	129.1 Å²	129.1	24%	0.237	69%	0.69	C	S	.	*	S	Bend	trans	86.1	85.9	171.1	-58.7	-59.1	0	0	0	120.1	L211 I230 L238	F209-L211 VanDerWaalsContact C-N 3.26Å; F209-L211 PolarHBondContact O-N 3.24Å; F209-I230 HydrophobicContact CD1-CD1 3.18Å; F209-I230 HydrophobicContact CE1-CD1 3.47Å; F209-I230 VanDerWaalsContact CE1-CD1 3.47Å; F209-I230 HydrophobicContact CG-CD1 4.29Å; F209-L238 HydrophobicContact CE1-CD1 3.76Å; F209-L238 HydrophobicContact CE2-CB 3.68Å; F209-L238 HydrophobicContact CE2-CD1 4.32Å; F209-L238 HydrophobicContact CE2-CG 4.45Å; F209-L238 HydrophobicContact CZ-CB 3.46Å; F209-L238 VanDerWaalsContact CZ-CB 3.46Å; F209-L238 HydrophobicContact CZ-CD1 3.27Å; F209-L238 HydrophobicContact CZ-CD2 4.11Å; F209-L238 HydrophobicContact CZ-CG 3.73Å
210	G	43.7	Very low	41.4	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	70%	0.7	S	S	*	*				64.8	6.3	120.2	0	0	0	0	0	120.2
211	L	39.8	Very low	39.8	Very low	135 Å²	135	134.5 Å²	134.5	71%	0.707	71%	0.706	S	S	*	*			trans	-105.4	109.3	174.3	-66.5	173.3	0	0	0	108.7	F209 T213	F209-L211 VanDerWaalsContact C-N 3.26Å; F209-L211 PolarHBondContact O-N 3.24Å; L211-T213 PolarHBondContact O-N 3.2Å
212	Y	36.2	Very low	38.6	Very low	221 Å²	221	134.2 Å²	134.2	87%	0.867	71%	0.709	S	S	*	*			trans	-64.4	120.1	173.5	-70.4	-90.9	0	0	0	108.9	D214	Y212-D214 PolarHBondContact O-N 2.97Å
213	T	37.5	Very low	38.2	Very low	134 Å²	134	141.2 Å²	141.2	82%	0.822	73%	0.733	S	S	*	*			trans	-80.4	108.6	156	38.1	0	0	0	0	107.2	L211 N215	L211-T213 PolarHBondContact O-N 3.2Å; T213-N215 VanDerWaalsContact C-N 3.32Å; T213-N215 PolarHBondContact O-N 3.36Å
214	D	31.7	Very low	37.8	Very low	150 Å²	150	143.5 Å²	143.5	80%	0.802	74%	0.737	S	S	*	*			trans	-61.8	94.6	168.1	-82.4	-28.8	0	0	0	108.4	Y212	Y212-D214 PolarHBondContact O-N 2.97Å
215	N	33.4	Very low	37.5	Very low	153 Å²	153	143.7 Å²	143.7	82%	0.818	74%	0.738	S	S	*	*			trans	-157.9	120.9	156.5	-86.1	-38.6	0	0	0	109.9	T213	T213-N215 VanDerWaalsContact C-N 3.32Å; T213-N215 PolarHBondContact O-N 3.36Å
216	S	35.4	Very low	37.4	Very low	113 Å²	113	149.7 Å²	149.7	79%	0.79	76%	0.757	S	S	*	*	S	Bend	trans	93.8	108.5	165.5	75.5	0	0	0	0	119.2
217	S	37.7	Very low	37.2	Very low	101 Å²	101	147 Å²	147	71%	0.706	75%	0.751	S	S	*	*			trans	66.3	98.9	143.3	55.7	0	0	0	0	120.1
218	I	32.8	Very low	37.2	Very low	151 Å²	151	146.9 Å²	146.9	77%	0.774	75%	0.75	S	S	*	*				47.3	119.6	112.9	-57.1	165.2	0	0	0	116.6
219	H	34.7	Very low	37.1	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.796	77%	0.774	S	S	*	*			trans	74.5	92.4	162.6	-77.2	-53.5	0	0	0	117.8
220	K	40.4	Very low	37.8	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	78%	0.783	S	S	*	*				-173.8	110.2	110.4	-97.3	162	-175.7	-178.9	0	110.8
221	Q	35	Very low	38.6	Very low	173 Å²	173	153.9 Å²	153.9	81%	0.808	78%	0.777	S	S	*	*			trans	45.6	103.8	133.9	-59.3	-179.2	-13.8	0	0	116.5
222	N	29.7	Very low	39.9	Very low	143 Å²	143	152.7 Å²	152.7	77%	0.765	76%	0.764	S	S	*	*				45.2	96.4	94	-75.7	-10.5	0	0	0	112.6
223	E	38.2	Very low	41.4	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	74%	0.739	S	S	*	*			trans	166.1	-1.7	143.2	-96.7	-179.2	169.4	0	0	116	N225	E223-N225 PolarHBondContact N-OD1 3.23Å
224	F	36.4	Very low	42.8	Very low	200 Å²	200	141.5 Å²	141.5	88%	0.877	72%	0.718	S	S	*	*			trans	-105.4	16.1	-179.3	-81.9	-84	0	0	0	115.4	K226	F224-K226 PolarHBondContact O-N 3.1Å
225	N	34.8	Very low	44.6	Very low	133 Å²	133	137.7 Å²	137.7	71%	0.711	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	35	-167.7	-50.8	65.6	0	0	0	115.4	E223	E223-N225 PolarHBondContact N-OD1 3.23Å
226	K	37	Very low	46.6	Very low	204 Å²	204	131.8 Å²	131.8	89%	0.887	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.2	26.5	-172.3	-128.4	171.5	-167.9	174.3	0	118	F224	F224-K226 PolarHBondContact O-N 3.1Å
227	K	38.4	Very low	48.5	Very low	180 Å²	180	131.7 Å²	131.7	78%	0.783	65%	0.645	S	S	*	*			trans	-143.6	-173.8	176.4	-68.7	-172.8	175	178.9	0	111.4
228	N	42.4	Very low	50.1	Low	147 Å²	147	130.6 Å²	130.6	79%	0.786	63%	0.631	S	S	*	*			trans	78.2	13.3	160.7	-55.9	3.1	0	0	0	119	I230	N228-I230 PolarHBondContact O-N 3.45Å
229	C	43	Very low	52.2	Low	129 Å²	129	123.9 Å²	123.9	87%	0.872	60%	0.596	S	S	*	*			trans	-69.6	103.6	158.5	-64.9	0	0	0	0	108.8
230	I	55.1	Low	54.3	Low	81 Å²	81	117 Å²	117	42%	0.415	56%	0.564	S	S	.	*			trans	-68.2	130.5	173.7	-64	153.6	0	0	0	107.9	F209 N228 D234 R235	F209-I230 HydrophobicContact CD1-CD1 3.18Å; F209-I230 HydrophobicContact CE1-CD1 3.47Å; F209-I230 VanDerWaalsContact CE1-CD1 3.47Å; F209-I230 HydrophobicContact CG-CD1 4.29Å; N228-I230 PolarHBondContact O-N 3.45Å; I230-D234 HydrophobicContact CG2-CB 3.73Å; I230-R235 HydrophobicContact CG2-CB 4.11Å
231	Q	60.7	Low	56	Low	138 Å²	138	110.4 Å²	110.4	65%	0.645	54%	0.543	S	S	*	.			trans	-65.9	147.4	175.2	-67.3	-165.7	-8.7	0	0	110.2	S233 D234 R235	Q231-S233 PolarHBondContact O-N 3.34Å; Q231-S233 VanDerWaalsContact O-N 3.12Å; Q231-D234 PolarHBondContact O-N 2.91Å; Q231-R235 PolarHBondContact O-N 3.48Å
232	Y	66.5	Low	58.1	Low	110 Å²	110	104.3 Å²	104.3	43%	0.431	52%	0.517	S	S	.	.	H	α-helix	trans	-50.8	-39.2	179.4	174.5	-91.3	0	0	0	112.6	D234 R235 F236 L299 K345	Y232-D234 VanDerWaalsContact C-N 3.35Å; Y232-D234 PolarHBondContact O-N 2.99Å; Y232-R235 PolarHBondContact O-N 3.11Å; Y232-F236 WeakPolarHBondContact O-CB 3.01Å; Y232-F236 PolarHBondContact O-N 3.49Å; Y232-L299 HydrophobicContact CD2-CD2 4.4Å; Y232-L299 HydrophobicContact CE2-CD2 4.13Å; Y232-L299 WeakPolarHBondContact CE2-O 3.28Å; Y232-L299 PolarHBondContact OH-O 3.06Å; Y232-K345 WeakPolarHBondContact OH-CD 3.38Å; Y232-K345 PolarHBondContact OH-NZ 3.3Å
233	S	67.8	Low	60.6	Low	51 Å²	51	97.5 Å²	97.5	36%	0.357	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-40.7	175.6	45.5	0	0	0	0	113.4	Q231 K237	Q231-S233 PolarHBondContact O-N 3.34Å; Q231-S233 VanDerWaalsContact O-N 3.12Å; S233-K237 WeakPolarHBondContact O-CG 3.32Å; S233-K237 PolarHBondContact O-N 2.99Å; S233-K237 VanDerWaalsContact O-N 3.14Å
234	D	67.8	Low	62.7	Low	69 Å²	69	90 Å²	90	37%	0.369	45%	0.445	S	S	.	.	H	α-helix	trans	-76.3	-39.3	-179	-64.5	-26.6	0	0	0	110.6	I230 Q231 Y232 F236 K237 L238	I230-D234 HydrophobicContact CG2-CB 3.73Å; Q231-D234 PolarHBondContact O-N 2.91Å; Y232-D234 VanDerWaalsContact C-N 3.35Å; Y232-D234 PolarHBondContact O-N 2.99Å; D234-F236 VanDerWaalsContact C-N 3.33Å; D234-F236 PolarHBondContact O-N 3.07Å; D234-K237 PolarHBondContact O-N 3.09Å; D234-L238 WeakPolarHBondContact O-CB 3.43Å; D234-L238 WeakPolarHBondContact O-CD1 3.25Å; D234-L238 WeakPolarHBondContact O-CG 3.3Å; D234-L238 PolarHBondContact O-N 3.16Å
235	R	69.3	Low	64.9	Low	71 Å²	71	86.3 Å²	86.3	27%	0.268	43%	0.431	S	S	.	.	H	α-helix	trans	-60.8	-42.6	172.8	-168.8	-177.8	161.6	161.2	-6.9	111.1	I230 Q231 Y232 L238 M239 L299	I230-R235 HydrophobicContact CG2-CB 4.11Å; Q231-R235 PolarHBondContact O-N 3.48Å; Y232-R235 PolarHBondContact O-N 3.11Å; R235-L238 PolarHBondContact O-N 3.45Å; R235-M239 VanDerWaalsContact O-CB 3.28Å; R235-M239 WeakPolarHBondContact O-CB 3.47Å; R235-M239 PolarHBondContact O-N 3.46Å; R235-L299 HydrophobicContact CB-CD2 4.34Å; R235-L299 HydrophobicContact CG-CD2 3.9Å
236	F	74.8	Confident	67.1	Low	28 Å²	28	81 Å²	81	12%	0.123	41%	0.406	C	S	.	.	H	α-helix	trans	-62.7	-46.9	177.3	-173	-98.2	0	0	0	112.1	Y232 D234 L238 M239 M240 K345 E348 L349	Y232-F236 WeakPolarHBondContact O-CB 3.01Å; Y232-F236 PolarHBondContact O-N 3.49Å; D234-F236 VanDerWaalsContact C-N 3.33Å; D234-F236 PolarHBondContact O-N 3.07Å; F236-L238 PolarHBondContact O-N 3.2Å; F236-M239 PolarHBondContact O-N 3.06Å; F236-M240 HydrophobicContact CD1-CE 4.12Å; F236-M240 HydrophobicContact CE1-CE 3.25Å; F236-M240 HydrophobicContact CE2-CE 4.34Å; F236-M240 HydrophobicContact CZ-CE 3.38Å; F236-M240 WeakPolarHBondContact O-CB 3.36Å; F236-M240 PolarHBondContact O-N 3.21Å; F236-K345 HydrophobicContact CE2-CB 4.28Å; F236-E348 HydrophobicContact CZ-CB 4.3Å; F236-L349 HydrophobicContact CD2-CD1 4.49Å; F236-L349 HydrophobicContact CD2-CD2 4.35Å; F236-L349 HydrophobicContact CE2-CD1 3.77Å; F236-L349 HydrophobicContact CE2-CD2 3.89Å; F236-L349 HydrophobicContact CE2-CG 3.77Å; F236-L349 HydrophobicContact CZ-CD1 4.45Å; F236-L349 HydrophobicContact CZ-CD2 4.11Å; F236-L349 HydrophobicContact CZ-CG 3.98Å
237	K	75.2	Confident	69.3	Low	112 Å²	112	71.3 Å²	71.3	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-43.1	177.7	-72.8	171.2	-174.7	173.1	0	113	S233 D234 M240 S241	S233-K237 WeakPolarHBondContact O-CG 3.32Å; S233-K237 PolarHBondContact O-N 2.99Å; S233-K237 VanDerWaalsContact O-N 3.14Å; D234-K237 PolarHBondContact O-N 3.09Å; K237-M240 WeakPolarHBondContact O-CB 3.36Å; K237-S241 PolarHBondContact O-N 3.04Å
238	L	73.1	Confident	71.4	Confident	78 Å²	78	68.2 Å²	68.2	41%	0.408	35%	0.347	S	S	.	.	H	α-helix	trans	-66	-46.1	179.4	-74.5	150.6	0	0	0	110.2	F209 D234 R235 F236 M240 S241 V242	F209-L238 HydrophobicContact CE1-CD1 3.76Å; F209-L238 HydrophobicContact CE2-CB 3.68Å; F209-L238 HydrophobicContact CE2-CD1 4.32Å; F209-L238 HydrophobicContact CE2-CG 4.45Å; F209-L238 HydrophobicContact CZ-CB 3.46Å; F209-L238 VanDerWaalsContact CZ-CB 3.46Å; F209-L238 HydrophobicContact CZ-CD1 3.27Å; F209-L238 HydrophobicContact CZ-CD2 4.11Å; F209-L238 HydrophobicContact CZ-CG 3.73Å; D234-L238 WeakPolarHBondContact O-CB 3.43Å; D234-L238 WeakPolarHBondContact O-CD1 3.25Å; D234-L238 WeakPolarHBondContact O-CG 3.3Å; D234-L238 PolarHBondContact O-N 3.16Å; R235-L238 PolarHBondContact O-N 3.45Å; F236-L238 PolarHBondContact O-N 3.2Å; L238-M240 PolarHBondContact O-N 3.47Å; L238-S241 PolarHBondContact O-N 3.38Å; L238-S241 PolarHBondContact O-OG 3.49Å; L238-V242 WeakPolarHBondContact O-CG2 3.48Å; L238-V242 PolarHBondContact O-N 2.9Å
239	M	75.7	Confident	73.3	Confident	9 Å²	9	68.9 Å²	68.9	4%	0.044	34%	0.343	C	S	.	.	H	α-helix	trans	-64.4	-40.9	177.4	-163.8	61.6	66	0	0	112.5	R235 F236 S241 V242 I243 L292 H295 L299	R235-M239 VanDerWaalsContact O-CB 3.28Å; R235-M239 WeakPolarHBondContact O-CB 3.47Å; R235-M239 PolarHBondContact O-N 3.46Å; F236-M239 PolarHBondContact O-N 3.06Å; M239-S241 VanDerWaalsContact C-N 3.29Å; M239-S241 PolarHBondContact O-N 2.98Å; M239-V242 PolarHBondContact O-N 3.12Å; M239-V242 VanDerWaalsContact O-N 3.11Å; M239-I243 HydrophobicContact CG-CD1 3.6Å; M239-I243 HydrophobicContact CG-CG1 4.23Å; M239-I243 WeakPolarHBondContact O-CG1 3.21Å; M239-I243 PolarHBondContact O-N 3.37Å; M239-I243 HydrophobicContact SD-CD1 4.48Å; M239-L292 HydrophobicContact SD-CD1 3.4Å; M239-L292 WeakPolarHBondContact SD-CD1 3.42Å; M239-H295 HydrophobicContact CE-CB 3.74Å; M239-H295 HydrophobicContact SD-CB 4.35Å; M239-L299 HydrophobicContact CB-CD1 3.53Å; M239-L299 HydrophobicContact CG-CD1 3.58Å
240	M	78.7	Confident	75.2	Confident	27 Å²	27	65 Å²	65	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-51.6	-48.2	173.8	-176.7	71.1	70.6	0	0	111.3	F236 K237 L238 V242 I243 H244 E348 L349	F236-M240 HydrophobicContact CD1-CE 4.12Å; F236-M240 HydrophobicContact CE1-CE 3.25Å; F236-M240 HydrophobicContact CE2-CE 4.34Å; F236-M240 HydrophobicContact CZ-CE 3.38Å; F236-M240 WeakPolarHBondContact O-CB 3.36Å; F236-M240 PolarHBondContact O-N 3.21Å; K237-M240 WeakPolarHBondContact O-CB 3.36Å; L238-M240 PolarHBondContact O-N 3.47Å; M240-V242 VanDerWaalsContact C-N 3.34Å; M240-V242 PolarHBondContact O-N 3.28Å; M240-I243 PolarHBondContact O-N 2.69Å; M240-H244 VanDerWaalsContact O-CB 3.29Å; M240-H244 WeakPolarHBondContact O-CB 3.23Å; M240-H244 VanDerWaalsContact O-CG 3.3Å; M240-H244 PolarHBondContact O-N 3.34Å; M240-H244 PolarHBondContact SD-CE1 2.84Å; M240-H244 PolarHBondContact SD-NE2 3Å; M240-E348 HydrophobicContact CE-CB 3.81Å; M240-L349 HydrophobicContact CB-CD2 4.11Å; M240-L349 HydrophobicContact CE-CB 4.45Å; M240-L349 HydrophobicContact CE-CD2 3.49Å; M240-L349 VanDerWaalsContact CE-CD2 3.49Å; M240-L349 HydrophobicContact CE-CG 3.86Å; M240-L349 VanDerWaalsContact SD-CA 3.57Å; M240-L349 HydrophobicContact SD-CB 4.47Å; M240-L349 HydrophobicContact SD-CD2 3.74Å; M240-L349 HydrophobicContact SD-CG 4.34Å
241	S	75.7	Confident	76.3	Confident	55 Å²	55	68.2 Å²	68.2	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-37.5	179.8	71.9	0	0	0	0	113.2	K237 L238 M239 H245	K237-S241 PolarHBondContact O-N 3.04Å; L238-S241 PolarHBondContact O-N 3.38Å; L238-S241 PolarHBondContact O-OG 3.49Å; M239-S241 VanDerWaalsContact C-N 3.29Å; M239-S241 PolarHBondContact O-N 2.98Å; S241-H245 WeakPolarHBondContact O-CB 3.25Å; S241-H245 PolarHBondContact O-N 3.32Å
242	V	80.1	Confident	77.3	Confident	44 Å²	44	62.4 Å²	62.4	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-70.4	-46.4	178.3	176.6	0	0	0	0	110.8	I208 L238 M239 M240 H245 A246 L292	I208-V242 HydrophobicContact CD1-CG2 4.23Å; L238-V242 WeakPolarHBondContact O-CG2 3.48Å; L238-V242 PolarHBondContact O-N 2.9Å; M239-V242 PolarHBondContact O-N 3.12Å; M239-V242 VanDerWaalsContact O-N 3.11Å; M240-V242 VanDerWaalsContact C-N 3.34Å; M240-V242 PolarHBondContact O-N 3.28Å; V242-H245 WeakPolarHBondContact O-CB 3.24Å; V242-H245 PolarHBondContact O-N 3.04Å; V242-A246 PolarHBondContact O-N 3.03Å; V242-L292 HydrophobicContact CG1-CD1 3.92Å; V242-L292 HydrophobicContact CG1-CD2 4.3Å
243	I	80.9	Confident	77.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-47.8	177.9	-68.1	160.7	0	0	0	110.2	M239 M240 H245 A246 L247 L288 L292 L296 L349	M239-I243 HydrophobicContact CG-CD1 3.6Å; M239-I243 HydrophobicContact CG-CG1 4.23Å; M239-I243 WeakPolarHBondContact O-CG1 3.21Å; M239-I243 PolarHBondContact O-N 3.37Å; M239-I243 HydrophobicContact SD-CD1 4.48Å; M240-I243 PolarHBondContact O-N 2.69Å; I243-H245 VanDerWaalsContact C-N 3.26Å; I243-H245 PolarHBondContact O-N 3.04Å; I243-A246 PolarHBondContact O-N 3.47Å; I243-A246 VanDerWaalsContact O-N 3.1Å; I243-L247 HydrophobicContact CG2-CD1 3.71Å; I243-L247 HydrophobicContact CG2-CG 4.03Å; I243-L247 WeakPolarHBondContact O-CB 3.37Å; I243-L247 WeakPolarHBondContact O-CG 3.35Å; I243-L247 PolarHBondContact O-N 3.1Å; I243-L288 HydrophobicContact CG1-CD1 4.46Å; I243-L288 HydrophobicContact CG2-CD1 4.27Å; I243-L288 HydrophobicContact CG2-CD2 4.24Å; I243-L292 HydrophobicContact CG1-CD1 4.22Å; I243-L292 HydrophobicContact CG1-CD2 4.32Å; I243-L292 HydrophobicContact CG1-CG 4.26Å; I243-L296 HydrophobicContact CD1-CB 4.24Å; I243-L296 HydrophobicContact CD1-CD1 3.74Å; I243-L296 HydrophobicContact CD1-CG 4.22Å; I243-L296 HydrophobicContact CG1-CD1 4.44Å; I243-L349 HydrophobicContact CD1-CB 4.41Å; I243-L349 HydrophobicContact CD1-CD2 3.79Å; I243-L349 HydrophobicContact CD1-CG 4.49Å; I243-L349 WeakPolarHBondContact CG2-O 3.44Å
244	H	83.9	Confident	78.1	Confident	23 Å²	23	62.5 Å²	62.5	11%	0.106	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-37.8	177.4	-76.3	-170	0	0	0	111.8	M240 R248 E348 L349 W352	M240-H244 VanDerWaalsContact O-CB 3.29Å; M240-H244 WeakPolarHBondContact O-CB 3.23Å; M240-H244 VanDerWaalsContact O-CG 3.3Å; M240-H244 PolarHBondContact O-N 3.34Å; M240-H244 PolarHBondContact SD-CE1 2.84Å; M240-H244 PolarHBondContact SD-NE2 3Å; H244-R248 WeakPolarHBondContact O-CB 3.5Å; H244-R248 PolarHBondContact O-N 3.43Å; H244-E348 PolarHBondContact NE2-O 3.46Å; H244-L349 PolarHBondContact CD2-O 3.24Å; H244-L349 PolarHBondContact NE2-O 3.41Å; H244-W352 HydrophobicContact CB-CB 3.94Å
245	H	81.3	Confident	78.5	Confident	123 Å²	123	59.3 Å²	59.3	57%	0.569	29%	0.293	S	S	*	.	H	α-helix	trans	-63.4	-45.7	173.1	-179.7	76.7	0	0	0	112	S241 V242 I243 R248 K249	S241-H245 WeakPolarHBondContact O-CB 3.25Å; S241-H245 PolarHBondContact O-N 3.32Å; V242-H245 WeakPolarHBondContact O-CB 3.24Å; V242-H245 PolarHBondContact O-N 3.04Å; I243-H245 VanDerWaalsContact C-N 3.26Å; I243-H245 PolarHBondContact O-N 3.04Å; H245-R248 PolarHBondContact O-N 3.25Å; H245-K249 VanDerWaalsContact O-CB 3.25Å; H245-K249 WeakPolarHBondContact O-CB 3.28Å; H245-K249 PolarHBondContact O-N 3.22Å
246	A	82.1	Confident	78.8	Confident	23 Å²	23	57.7 Å²	57.7	19%	0.19	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-49.4	178.3	0	0	0	0	0	111.9	V242 I243 R248 K249 A250 L288 L292	V242-A246 PolarHBondContact O-N 3.03Å; I243-A246 PolarHBondContact O-N 3.47Å; I243-A246 VanDerWaalsContact O-N 3.1Å; A246-R248 PolarHBondContact O-N 3.08Å; A246-K249 PolarHBondContact O-N 3.45Å; A246-A250 WeakPolarHBondContact O-CB 3.45Å; A246-A250 PolarHBondContact O-N 3.26Å; A246-L288 HydrophobicContact CB-CD2 3.77Å; A246-L292 HydrophobicContact CB-CD2 4.25Å
247	L	83.6	Confident	78.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.4	-64.7	179.3	0	0	0	112.1	I243 A250 H251 Y252 V286 P287 L288 L350 W352	I243-L247 HydrophobicContact CG2-CD1 3.71Å; I243-L247 HydrophobicContact CG2-CG 4.03Å; I243-L247 WeakPolarHBondContact O-CB 3.37Å; I243-L247 WeakPolarHBondContact O-CG 3.35Å; I243-L247 PolarHBondContact O-N 3.1Å; L247-A250 PolarHBondContact O-N 3.28Å; L247-H251 PolarHBondContact O-N 3.18Å; L247-H251 VanDerWaalsContact O-N 3.12Å; L247-Y252 HydrophobicContact CD2-CD1 3.83Å; L247-Y252 HydrophobicContact CD2-CG 4.05Å; L247-Y252 PolarHBondContact O-N 2.86Å; L247-V286 HydrophobicContact CD2-CG1 3.63Å; L247-P287 HydrophobicContact CD2-CG 4.31Å; L247-L288 HydrophobicContact CD2-CD2 3.92Å; L247-L288 HydrophobicContact CD2-CG 4.45Å; L247-L288 HydrophobicContact CG-CD2 4.2Å; L247-L350 HydrophobicContact CD1-CD2 4.16Å; L247-W352 HydrophobicContact CB-CB 4.47Å; L247-W352 VanDerWaalsContact CB-CD1 3.47Å; L247-W352 HydrophobicContact CB-CG 4.01Å
248	R	82.6	Confident	78.8	Confident	114 Å²	114	52 Å²	52	43%	0.43	27%	0.267	S	S	.	.	H	α-helix	trans	-65.2	-42.8	175.3	-177.9	178.1	-71.4	-175.9	-4.8	111.5	H244 H245 A246 A250 H251 W352 D355	H244-R248 WeakPolarHBondContact O-CB 3.5Å; H244-R248 PolarHBondContact O-N 3.43Å; H245-R248 PolarHBondContact O-N 3.25Å; A246-R248 PolarHBondContact O-N 3.08Å; R248-A250 VanDerWaalsContact C-N 3.29Å; R248-A250 PolarHBondContact O-N 2.71Å; R248-H251 PolarHBondContact O-N 2.66Å; R248-H251 VanDerWaalsContact O-N 3.14Å; R248-W352 HydrophobicContact CB-CD2 4.14Å; R248-W352 HydrophobicContact CB-CE3 3.79Å; R248-W352 HydrophobicContact CB-CH2 4.33Å; R248-W352 HydrophobicContact CB-CZ3 3.91Å; R248-W352 HydrophobicContact CG-CE3 3.99Å; R248-W352 HydrophobicContact CG-CH2 4.09Å; R248-W352 HydrophobicContact CG-CZ3 3.63Å; R248-D355 IonicContact NH2-OD1 3.72Å
249	K	82.3	Confident	78.9	Confident	161 Å²	161	48.3 Å²	48.3	70%	0.7	25%	0.248	S	C	*	.	H	α-helix	trans	-63.5	-35.7	177.3	-175.8	-177.6	177.1	-172.1	0	111.9	H245 A246 H251	H245-K249 VanDerWaalsContact O-CB 3.25Å; H245-K249 WeakPolarHBondContact O-CB 3.28Å; H245-K249 PolarHBondContact O-N 3.22Å; A246-K249 PolarHBondContact O-N 3.45Å; K249-H251 VanDerWaalsContact C-N 3.29Å
250	A	81.4	Confident	78.7	Confident	48 Å²	48	48.4 Å²	48.4	40%	0.397	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	0.6	176.8	0	0	0	0	0	113.8	A246 L247 R248 Y252 P287	A246-A250 WeakPolarHBondContact O-CB 3.45Å; A246-A250 PolarHBondContact O-N 3.26Å; L247-A250 PolarHBondContact O-N 3.28Å; R248-A250 VanDerWaalsContact C-N 3.29Å; R248-A250 PolarHBondContact O-N 2.71Å; A250-Y252 PolarHBondContact O-N 3Å; A250-P287 HydrophobicContact CB-CB 3.63Å; A250-P287 HydrophobicContact CB-CG 3.28Å
251	H	79.4	Confident	78.5	Confident	149 Å²	149	48.7 Å²	48.7	69%	0.69	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	39.6	-174.1	-65.2	-74.5	0	0	0	113.3	L247 R248 K249 T253	L247-H251 PolarHBondContact O-N 3.18Å; L247-H251 VanDerWaalsContact O-N 3.12Å; R248-H251 PolarHBondContact O-N 2.66Å; R248-H251 VanDerWaalsContact O-N 3.14Å; K249-H251 VanDerWaalsContact C-N 3.29Å; H251-T253 PolarHBondContact O-N 2.88Å
252	Y	80.1	Confident	78.5	Confident	15 Å²	15	46.2 Å²	46.2	6%	0.059	23%	0.234	C	C	.	.			trans	-76.1	108.9	-173.4	-176	-101.9	0	0	0	111.8	L247 A250 H254 I258 F284 V286 P287 W352	L247-Y252 HydrophobicContact CD2-CD1 3.83Å; L247-Y252 HydrophobicContact CD2-CG 4.05Å; L247-Y252 PolarHBondContact O-N 2.86Å; A250-Y252 PolarHBondContact O-N 3Å; Y252-H254 HydrophobicContact CE1-CB 4.16Å; Y252-H254 HydrophobicContact CE2-CB 4.02Å; Y252-H254 WeakPolarHBondContact OH-CB 3Å; Y252-I258 HydrophobicContact CE1-CD1 4.26Å; Y252-I258 WeakPolarHBondContact OH-CD1 3.49Å; Y252-F284 WeakPolarHBondContact OH-CB 3.28Å; Y252-V286 HydrophobicContact CE1-CG1 4.28Å; Y252-V286 HydrophobicContact CE1-CG2 4.45Å; Y252-P287 HydrophobicContact CD2-CG 3.93Å; Y252-P287 HydrophobicContact CG-CG 4.1Å; Y252-W352 PolarHBondContact O-NE1 3.25Å
253	T	76.4	Confident	78.3	Confident	84 Å²	84	46.4 Å²	46.4	52%	0.515	24%	0.238	S	C	.	.			trans	-100.4	-6	-174.2	51.2	0	0	0	0	115	H251 G255 P256	H251-T253 PolarHBondContact O-N 2.88Å; T253-G255 VanDerWaalsContact C-N 3.29Å; T253-G255 PolarHBondContact O-N 2.97Å; T253-P256 WeakPolarHBondContact O-CD 3.32Å
254	H	76.1	Confident	77.9	Confident	80 Å²	80	50.6 Å²	50.6	37%	0.37	26%	0.258	S	S	.	.			trans	-84.5	5.3	-172.9	-61.9	-73.4	0	0	0	114.5	Y252 E257 I258 F284	Y252-H254 HydrophobicContact CE1-CB 4.16Å; Y252-H254 HydrophobicContact CE2-CB 4.02Å; Y252-H254 WeakPolarHBondContact OH-CB 3Å; H254-E257 IonicContact CE1-OE2 3.95Å; H254-E257 IonicContact CG-OE2 3.03Å; H254-E257 IonicContact ND1-OE2 3.97Å; H254-E257 PolarHBondContact ND1-OE2 3.35Å; H254-E257 PolarHBondContact O-N 3.25Å; H254-E257 VanDerWaalsContact O-N 3.11Å; H254-I258 PolarHBondContact O-N 3.41Å; H254-I258 VanDerWaalsContact O-N 3.17Å; H254-F284 HydrophobicContact CB-CD1 3.99Å
255	G	76.3	Confident	77.4	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-51	-50.4	177.3	0	0	0	0	0	114.1	T253 E257 I258 I259	T253-G255 VanDerWaalsContact C-N 3.29Å; T253-G255 PolarHBondContact O-N 2.97Å; G255-E257 VanDerWaalsContact C-N 3.25Å; G255-E257 PolarHBondContact O-N 2.72Å; G255-I258 PolarHBondContact O-N 2.85Å; G255-I259 WeakPolarHBondContact O-CD1 3.38Å; G255-I259 WeakPolarHBondContact O-CG1 3.36Å; G255-I259 PolarHBondContact O-N 3.46Å; G255-I259 VanDerWaalsContact O-N 3.12Å
256	P	74.8	Confident	76.8	Confident	36 Å²	36	47.3 Å²	47.3	23%	0.234	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-31.3	177.9	-24.2	35	0	0	0	114	T253 I259 A260	T253-P256 WeakPolarHBondContact O-CD 3.32Å; P256-I259 PolarHBondContact O-N 3.01Å; P256-A260 PolarHBondContact O-N 2.78Å
257	E	71.5	Confident	76	Confident	18 Å²	18	52.7 Å²	52.7	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-72.9	-42.1	-178.9	-53	-174.8	156.9	0	0	111	H254 G255 I259 A260 I261 F284 V388 R391	H254-E257 IonicContact CE1-OE2 3.95Å; H254-E257 IonicContact CG-OE2 3.03Å; H254-E257 IonicContact ND1-OE2 3.97Å; H254-E257 PolarHBondContact ND1-OE2 3.35Å; H254-E257 PolarHBondContact O-N 3.25Å; H254-E257 VanDerWaalsContact O-N 3.11Å; G255-E257 VanDerWaalsContact C-N 3.25Å; G255-E257 PolarHBondContact O-N 2.72Å; E257-I259 VanDerWaalsContact C-N 3.29Å; E257-I259 PolarHBondContact O-N 3.05Å; E257-A260 PolarHBondContact O-N 3Å; E257-I261 WeakPolarHBondContact O-CG1 3.46Å; E257-I261 PolarHBondContact O-N 3.29Å; E257-F284 HydrophobicContact CB-CE1 4.12Å; E257-F284 HydrophobicContact CB-CZ 4.37Å; E257-V388 HydrophobicContact CB-CG1 4.16Å; E257-V388 HydrophobicContact CG-CG1 4.05Å; E257-R391 IonicContact OE1-CZ 3.23Å; E257-R391 IonicContact OE1-NE 2.73Å; E257-R391 PolarHBondContact OE1-NE 3.47Å; E257-R391 IonicContact OE1-NH2 3.25Å
258	I	78.8	Confident	75.2	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-46.6	170.4	-68.3	171.3	0	0	0	110.1	Y252 H254 G255 A260 I261 L262 I280 F284 V286 L346 L350	Y252-I258 HydrophobicContact CE1-CD1 4.26Å; Y252-I258 WeakPolarHBondContact OH-CD1 3.49Å; H254-I258 PolarHBondContact O-N 3.41Å; H254-I258 VanDerWaalsContact O-N 3.17Å; G255-I258 PolarHBondContact O-N 2.85Å; I258-A260 PolarHBondContact O-N 3.03Å; I258-I261 PolarHBondContact O-N 3.4Å; I258-L262 HydrophobicContact CG2-CD1 3.58Å; I258-L262 HydrophobicContact CG2-CG 4.14Å; I258-L262 VanDerWaalsContact O-CG 3.27Å; I258-L262 WeakPolarHBondContact O-CG 3.5Å; I258-L262 PolarHBondContact O-N 3.23Å; I258-I280 HydrophobicContact CG1-CG2 4.36Å; I258-I280 HydrophobicContact CG2-CG2 3.98Å; I258-F284 HydrophobicContact CD1-CB 3.81Å; I258-F284 HydrophobicContact CD1-CD2 4.24Å; I258-F284 HydrophobicContact CD1-CG 4.03Å; I258-F284 HydrophobicContact CG1-CB 3.98Å; I258-F284 HydrophobicContact CG1-CD1 4.18Å; I258-F284 HydrophobicContact CG1-CD2 3.49Å; I258-F284 VanDerWaalsContact CG1-CD2 3.49Å; I258-F284 HydrophobicContact CG1-CE2 3.99Å; I258-F284 HydrophobicContact CG1-CG 3.61Å; I258-V286 HydrophobicContact CD1-CG2 3.78Å; I258-L346 HydrophobicContact CG2-CD2 4.47Å; I258-L350 HydrophobicContact CB-CD1 4.31Å; I258-L350 HydrophobicContact CD1-CD1 4.08Å; I258-L350 HydrophobicContact CG2-CD1 3.73Å
259	I	75.1	Confident	74.6	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-41.1	-175.6	-63.4	162.8	0	0	0	111.3	G255 P256 E257 I261 L262 S263 W343 N351 Y382	G255-I259 WeakPolarHBondContact O-CD1 3.38Å; G255-I259 WeakPolarHBondContact O-CG1 3.36Å; G255-I259 PolarHBondContact O-N 3.46Å; G255-I259 VanDerWaalsContact O-N 3.12Å; P256-I259 PolarHBondContact O-N 3.01Å; E257-I259 VanDerWaalsContact C-N 3.29Å; E257-I259 PolarHBondContact O-N 3.05Å; I259-I261 VanDerWaalsContact C-N 3.33Å; I259-I261 PolarHBondContact O-N 2.99Å; I259-L262 PolarHBondContact O-N 3.49Å; I259-S263 WeakPolarHBondContact O-CB 3.44Å; I259-S263 PolarHBondContact O-N 3.43Å; I259-W343 HydrophobicContact CG2-CZ3 4.25Å; I259-N351 HydrophobicContact CD1-CB 4.14Å; I259-Y382 HydrophobicContact CB-CE1 4.47Å; I259-Y382 HydrophobicContact CD1-CE1 4.01Å; I259-Y382 HydrophobicContact CG2-CD1 3.66Å; I259-Y382 HydrophobicContact CG2-CE1 3.54Å; I259-Y382 HydrophobicContact CG2-CG 4.29Å
260	A	72.3	Confident	74.3	Confident	10 Å²	10	56.2 Å²	56.2	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-42	175.9	0	0	0	0	0	112	P256 E257 I258 S263 Q264 V388	P256-A260 PolarHBondContact O-N 2.78Å; E257-A260 PolarHBondContact O-N 3Å; I258-A260 PolarHBondContact O-N 3.03Å; A260-S263 PolarHBondContact O-N 2.87Å; A260-Q264 WeakPolarHBondContact O-CG 3.22Å; A260-Q264 PolarHBondContact O-N 3.28Å; A260-Q264 VanDerWaalsContact O-N 3.12Å; A260-V388 HydrophobicContact CB-CB 4.15Å; A260-V388 HydrophobicContact CB-CG1 3.98Å; A260-V388 HydrophobicContact CB-CG2 4.08Å
261	I	72.9	Confident	74.3	Confident	33 Å²	33	56.7 Å²	56.7	17%	0.169	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-45.2	178.2	-67.9	165.5	0	0	0	110.9	E257 I258 I259 S263 Q264 L265 I280 F284	E257-I261 WeakPolarHBondContact O-CG1 3.46Å; E257-I261 PolarHBondContact O-N 3.29Å; I258-I261 PolarHBondContact O-N 3.4Å; I259-I261 VanDerWaalsContact C-N 3.33Å; I259-I261 PolarHBondContact O-N 2.99Å; I261-S263 VanDerWaalsContact C-N 3.32Å; I261-S263 PolarHBondContact O-N 2.95Å; I261-Q264 PolarHBondContact O-N 2.87Å; I261-L265 HydrophobicContact CG2-CD1 4.08Å; I261-L265 WeakPolarHBondContact O-CG 3.39Å; I261-L265 PolarHBondContact O-N 3.05Å; I261-I280 HydrophobicContact CG2-CD1 3.91Å; I261-I280 HydrophobicContact CG2-CG1 4.28Å; I261-F284 HydrophobicContact CD1-CE2 3.42Å; I261-F284 VanDerWaalsContact CD1-CE2 3.42Å; I261-F284 HydrophobicContact CD1-CZ 3.37Å
262	L	76.8	Confident	74.3	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-41.7	177.9	-68.3	170.7	0	0	0	111.4	I258 I259 Q264 L265 A266 I272 I280 W343 L346	I258-L262 HydrophobicContact CG2-CD1 3.58Å; I258-L262 HydrophobicContact CG2-CG 4.14Å; I258-L262 VanDerWaalsContact O-CG 3.27Å; I258-L262 WeakPolarHBondContact O-CG 3.5Å; I258-L262 PolarHBondContact O-N 3.23Å; I259-L262 PolarHBondContact O-N 3.49Å; L262-Q264 VanDerWaalsContact C-N 3.31Å; L262-Q264 PolarHBondContact O-N 3.31Å; L262-L265 PolarHBondContact O-N 3.46Å; L262-A266 WeakPolarHBondContact O-CB 3.49Å; L262-A266 PolarHBondContact O-N 3.02Å; L262-I272 HydrophobicContact CB-CD1 3.53Å; L262-I272 HydrophobicContact CD2-CD1 3.48Å; L262-I272 VanDerWaalsContact CD2-CD1 3.48Å; L262-I272 HydrophobicContact CG-CD1 4.06Å; L262-I272 WeakPolarHBondContact O-CD1 3.41Å; L262-I280 HydrophobicContact CD2-CD1 3.52Å; L262-I280 HydrophobicContact CG-CD1 4.35Å; L262-W343 HydrophobicContact CB-CB 4.15Å; L262-W343 HydrophobicContact CD1-CB 4.5Å; L262-L346 HydrophobicContact CD1-CD2 3.23Å
263	S	75	Confident	74.5	Confident	49 Å²	49	49.9 Å²	49.9	34%	0.343	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-41.2	176	-176.5	0	0	0	0	112.4	I259 A260 I261	I259-S263 WeakPolarHBondContact O-CB 3.44Å; I259-S263 PolarHBondContact O-N 3.43Å; A260-S263 PolarHBondContact O-N 2.87Å; I261-S263 VanDerWaalsContact C-N 3.32Å; I261-S263 PolarHBondContact O-N 2.95Å
264	Q	73.3	Confident	74.7	Confident	88 Å²	88	46.2 Å²	46.2	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-66.6	-43.7	176.5	-73.2	176.9	-7.8	0	0	112.2	A260 I261 L262 A266 N267	A260-Q264 WeakPolarHBondContact O-CG 3.22Å; A260-Q264 PolarHBondContact O-N 3.28Å; A260-Q264 VanDerWaalsContact O-N 3.12Å; I261-Q264 PolarHBondContact O-N 2.87Å; L262-Q264 VanDerWaalsContact C-N 3.31Å; L262-Q264 PolarHBondContact O-N 3.31Å; Q264-A266 VanDerWaalsContact C-N 3.28Å; Q264-A266 PolarHBondContact O-N 2.77Å; Q264-N267 PolarHBondContact O-N 3.45Å; Q264-N267 PolarHBondContact O-OD1 3.01Å
265	L	72.8	Confident	74.9	Confident	71 Å²	71	43.2 Å²	43.2	37%	0.372	23%	0.231	S	C	.	.	H	α-helix	trans	-65.4	-33.8	179.7	-73.3	170.5	0	0	0	112.6	I261 L262 N267 I280	I261-L265 HydrophobicContact CG2-CD1 4.08Å; I261-L265 WeakPolarHBondContact O-CG 3.39Å; I261-L265 PolarHBondContact O-N 3.05Å; L262-L265 PolarHBondContact O-N 3.46Å; L265-N267 PolarHBondContact O-N 3.42Å; L265-I280 HydrophobicContact CD1-CD1 3.42Å; L265-I280 VanDerWaalsContact CD1-CD1 3.42Å
266	A	69.4	Low	74.9	Confident	5 Å²	5	45.5 Å²	45.5	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-72	-14.6	-176.1	0	0	0	0	0	113.4	L262 Q264 K268 S269 I272	L262-A266 WeakPolarHBondContact O-CB 3.49Å; L262-A266 PolarHBondContact O-N 3.02Å; Q264-A266 VanDerWaalsContact C-N 3.28Å; Q264-A266 PolarHBondContact O-N 2.77Å; A266-K268 PolarHBondContact O-N 3.29Å; A266-S269 WeakPolarHBondContact CB-O 3.38Å; A266-S269 WeakPolarHBondContact O-CA 3.48Å; A266-S269 WeakPolarHBondContact O-CB 3.45Å; A266-S269 PolarHBondContact O-N 3.38Å; A266-S269 PolarHBondContact O-OG 3.29Å; A266-I272 HydrophobicContact CB-CD1 4.13Å; A266-I272 HydrophobicContact CB-CG1 3.84Å
267	N	65.1	Low	75.3	Confident	137 Å²	137	43.9 Å²	43.9	73%	0.733	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	38.7	59.8	172.9	-83.6	-31.7	0	0	0	113.8	Q264 L265 S269	Q264-N267 PolarHBondContact O-N 3.45Å; Q264-N267 PolarHBondContact O-OD1 3.01Å; L265-N267 PolarHBondContact O-N 3.42Å; N267-S269 VanDerWaalsContact C-N 3.31Å; N267-S269 PolarHBondContact O-N 3.02Å
268	K	67	Low	75.8	Confident	198 Å²	198	46 Å²	46	86%	0.861	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	-2.7	-177.7	-49.9	174.2	-179.1	174.6	0	116.6	A266	A266-K268 PolarHBondContact O-N 3.29Å
269	S	71	Confident	75.6	Confident	55 Å²	55	49.6 Å²	49.6	39%	0.385	25%	0.253	S	S	.	.			trans	-95.1	162	171.1	76.6	0	0	0	0	111.7	A266 N267 L271 W343	A266-S269 WeakPolarHBondContact CB-O 3.38Å; A266-S269 WeakPolarHBondContact O-CA 3.48Å; A266-S269 WeakPolarHBondContact O-CB 3.45Å; A266-S269 PolarHBondContact O-N 3.38Å; A266-S269 PolarHBondContact O-OG 3.29Å; N267-S269 VanDerWaalsContact C-N 3.31Å; N267-S269 PolarHBondContact O-N 3.02Å; S269-L271 PolarHBondContact OG-O 3.29Å; S269-W343 PolarHBondContact O-NE1 3.34Å
270	N	74.5	Confident	75.7	Confident	95 Å²	95	50.2 Å²	50.2	51%	0.508	26%	0.256	S	S	.	.	S	Bend	trans	-92.6	-0.7	176.2	-67.7	-5	0	0	0	112.8	W343	N270-W343 PolarHBondContact O-N 3.16Å
271	L	81.8	Confident	76.1	Confident	59 Å²	59	50.1 Å²	50.1	31%	0.309	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.7	-169.1	-67.3	164.3	0	0	0	110.3	S269 V302 M308 A340 V341	S269-L271 PolarHBondContact OG-O 3.29Å; L271-V302 HydrophobicContact CD2-CB 3.91Å; L271-V302 HydrophobicContact CD2-CG1 4.04Å; L271-V302 HydrophobicContact CD2-CG2 4.16Å; L271-M308 HydrophobicContact CB-CE 4.37Å; L271-A340 HydrophobicContact CB-CB 4.35Å; L271-A340 HydrophobicContact CD2-CB 4.14Å; L271-V341 WeakPolarHBondContact CA-O 3.34Å
272	I	80.2	Confident	76.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.6	177.6	-61.6	175.4	0	0	0	108.2	L262 A266 M274 D276 A340 V341 W343	L262-I272 HydrophobicContact CB-CD1 3.53Å; L262-I272 HydrophobicContact CD2-CD1 3.48Å; L262-I272 VanDerWaalsContact CD2-CD1 3.48Å; L262-I272 HydrophobicContact CG-CD1 4.06Å; L262-I272 WeakPolarHBondContact O-CD1 3.41Å; A266-I272 HydrophobicContact CB-CD1 4.13Å; A266-I272 HydrophobicContact CB-CG1 3.84Å; I272-M274 PolarHBondContact O-N 3.42Å; I272-D276 HydrophobicContact CG2-CB 4.12Å; I272-A340 CarbonylContact O-C 3.33Å; I272-A340 VanDerWaalsContact O-CA 3.26Å; I272-A340 WeakPolarHBondContact O-CA 3.4Å; I272-V341 PolarHBondContact N-O 3.15Å; I272-V341 PolarHBondContact O-N 3.43Å; I272-W343 HydrophobicContact CD1-CB 3.55Å; I272-W343 HydrophobicContact CD1-CG 3.95Å; I272-W343 HydrophobicContact CG1-CB 4.21Å; I272-W343 HydrophobicContact CG1-CG 4.46Å
273	P	82.7	Confident	76.2	Confident	20 Å²	20	59.8 Å²	59.8	13%	0.13	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	135.4	171.7	-24.4	33.8	0	0	0	111.7	I275 D276 A277 M308 V312	P273-I275 HydrophobicContact CB-CG2 4.17Å; P273-I275 PolarHBondContact O-N 3.07Å; P273-I275 VanDerWaalsContact O-N 3.14Å; P273-D276 HydrophobicContact CB-CB 4.49Å; P273-D276 WeakPolarHBondContact CG-OD2 3.37Å; P273-D276 PolarHBondContact O-N 3.41Å; P273-D276 VanDerWaalsContact O-N 3.08Å; P273-A277 PolarHBondContact O-N 3.43Å; P273-A277 VanDerWaalsContact O-N 3.15Å; P273-M308 HydrophobicContact CG-CG 3.75Å; P273-M308 HydrophobicContact CG-SD 3.74Å; P273-V312 HydrophobicContact CB-CG2 3.8Å; P273-V312 HydrophobicContact CG-CG2 3.82Å
274	M	82	Confident	76.2	Confident	6 Å²	6	59 Å²	59	3%	0.03	29%	0.291	C	S	.	.	H	α-helix	trans	-54.5	-36.4	178.7	174.5	59.1	77.6	0	0	112.5	I272 D276 A277 R278 F297 T301 V336 W339 V341	I272-M274 PolarHBondContact O-N 3.42Å; M274-D276 VanDerWaalsContact C-N 3.32Å; M274-D276 PolarHBondContact O-N 3.04Å; M274-A277 PolarHBondContact O-N 2.91Å; M274-R278 HydrophobicContact CG-CG 4.48Å; M274-R278 PolarHBondContact O-N 3.23Å; M274-R278 HydrophobicContact SD-CG 3.83Å; M274-R278 PolarHBondContact SD-NE 3.36Å; M274-F297 HydrophobicContact CE-CB 4.31Å; M274-F297 HydrophobicContact CE-CD1 3.84Å; M274-F297 HydrophobicContact CE-CG 4.44Å; M274-F297 HydrophobicContact SD-CD1 3.44Å; M274-F297 WeakPolarHBondContact SD-CD1 3.42Å; M274-F297 HydrophobicContact SD-CE1 3.85Å; M274-F297 HydrophobicContact SD-CG 4.16Å; M274-T301 HydrophobicContact CE-CG2 3.12Å; M274-V336 HydrophobicContact CB-CG1 4.03Å; M274-V336 HydrophobicContact CG-CG1 3.44Å; M274-V336 VanDerWaalsContact CG-CG1 3.44Å; M274-W339 HydrophobicContact CB-CB 4.04Å; M274-W339 WeakPolarHBondContact CB-O 3.49Å; M274-W339 HydrophobicContact CE-CB 4.42Å; M274-W339 HydrophobicContact CG-CB 4.48Å; M274-W339 PolarHBondContact N-O 3.08Å; M274-V341 HydrophobicContact CB-CG2 4.4Å; M274-V341 HydrophobicContact CE-CG2 3.43Å; M274-V341 VanDerWaalsContact CE-CG2 3.43Å; M274-V341 HydrophobicContact SD-CG2 3.56Å; M274-V341 VanDerWaalsContact SD-CG2 3.56Å
275	I	79.3	Confident	76.4	Confident	18 Å²	18	62.5 Å²	62.5	9%	0.092	31%	0.308	C	S	.	.	H	α-helix	trans	-63	-39.8	-179	-154.5	158.1	0	0	0	112	P273 R279 V312 I332	P273-I275 HydrophobicContact CB-CG2 4.17Å; P273-I275 PolarHBondContact O-N 3.07Å; P273-I275 VanDerWaalsContact O-N 3.14Å; I275-R279 WeakPolarHBondContact O-CB 3.42Å; I275-R279 WeakPolarHBondContact O-CD 3.43Å; I275-R279 WeakPolarHBondContact O-CG 3.48Å; I275-R279 PolarHBondContact O-N 3.05Å; I275-R279 VanDerWaalsContact O-N 3.09Å; I275-V312 HydrophobicContact CG2-CG1 4.23Å; I275-I332 HydrophobicContact CD1-CD1 3.91Å; I275-I332 HydrophobicContact CD1-CG1 4.13Å; I275-I332 HydrophobicContact CD1-CG2 3.8Å
276	D	77.5	Confident	76.7	Confident	49 Å²	49	59.8 Å²	59.8	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-75	-40.1	-179.4	-62.6	-31.9	0	0	0	110.3	I272 P273 M274 R279 I280	I272-D276 HydrophobicContact CG2-CB 4.12Å; P273-D276 HydrophobicContact CB-CB 4.49Å; P273-D276 WeakPolarHBondContact CG-OD2 3.37Å; P273-D276 PolarHBondContact O-N 3.41Å; P273-D276 VanDerWaalsContact O-N 3.08Å; M274-D276 VanDerWaalsContact C-N 3.32Å; M274-D276 PolarHBondContact O-N 3.04Å; D276-R279 PolarHBondContact O-N 3.23Å; D276-I280 WeakPolarHBondContact O-CD1 3.47Å; D276-I280 VanDerWaalsContact O-CG1 3.25Å; D276-I280 WeakPolarHBondContact O-CG1 3.34Å; D276-I280 PolarHBondContact O-N 3.25Å
277	A	82.3	Confident	77.3	Confident	3 Å²	3	62.1 Å²	62.1	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-47.8	175.5	0	0	0	0	0	112.3	P273 M274 R279 I280 F281 F297 V341	P273-A277 PolarHBondContact O-N 3.43Å; P273-A277 VanDerWaalsContact O-N 3.15Å; M274-A277 PolarHBondContact O-N 2.91Å; A277-R279 VanDerWaalsContact C-N 3.35Å; A277-R279 PolarHBondContact O-N 3.28Å; A277-I280 PolarHBondContact O-N 2.97Å; A277-F281 WeakPolarHBondContact O-CB 3.49Å; A277-F281 PolarHBondContact O-N 3.28Å; A277-F297 HydrophobicContact CB-CE1 4.16Å; A277-V341 HydrophobicContact CB-CB 4.03Å; A277-V341 HydrophobicContact CB-CG1 4.3Å; A277-V341 HydrophobicContact CB-CG2 3.84Å
278	R	81.8	Confident	78.1	Confident	61 Å²	61	56.5 Å²	56.5	23%	0.23	28%	0.279	C	S	.	.	H	α-helix	trans	-64.6	-37.3	176.6	-77	-177.5	175.6	-97	7	112.6	M274 F281 N282 E294 F297	M274-R278 HydrophobicContact CG-CG 4.48Å; M274-R278 PolarHBondContact O-N 3.23Å; M274-R278 HydrophobicContact SD-CG 3.83Å; M274-R278 PolarHBondContact SD-NE 3.36Å; R278-F281 PolarHBondContact O-N 3.31Å; R278-N282 WeakPolarHBondContact O-CB 3.31Å; R278-N282 VanDerWaalsContact O-CG 3.29Å; R278-N282 PolarHBondContact O-N 3.46Å; R278-E294 IonicContact CZ-OE1 3.3Å; R278-E294 IonicContact CZ-OE2 2.72Å; R278-E294 IonicContact NH1-OE1 3.97Å; R278-E294 PolarHBondContact NH1-OE1 2.72Å; R278-E294 IonicContact NH1-OE2 3.46Å; R278-E294 IonicContact NH2-OE1 2.7Å; R278-E294 PolarHBondContact NH2-OE1 3.32Å; R278-E294 IonicContact NH2-OE2 3.66Å; R278-E294 PolarHBondContact NH2-OE2 3.37Å; R278-F297 HydrophobicContact CB-CZ 4.38Å; R278-F297 HydrophobicContact CG-CD1 4.29Å; R278-F297 HydrophobicContact CG-CD2 4.27Å; R278-F297 HydrophobicContact CG-CE1 3.82Å; R278-F297 HydrophobicContact CG-CE2 3.81Å; R278-F297 HydrophobicContact CG-CZ 3.57Å
279	R	74.7	Confident	78.7	Confident	78 Å²	78	53.1 Å²	53.1	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-45.3	175.3	-79.7	168.9	167.2	-173	-10.6	111.9	I275 D276 A277 N282 H283 E327 N415	I275-R279 WeakPolarHBondContact O-CB 3.42Å; I275-R279 WeakPolarHBondContact O-CD 3.43Å; I275-R279 WeakPolarHBondContact O-CG 3.48Å; I275-R279 PolarHBondContact O-N 3.05Å; I275-R279 VanDerWaalsContact O-N 3.09Å; D276-R279 PolarHBondContact O-N 3.23Å; A277-R279 VanDerWaalsContact C-N 3.35Å; A277-R279 PolarHBondContact O-N 3.28Å; R279-N282 PolarHBondContact O-N 3.02Å; R279-H283 WeakPolarHBondContact O-CB 3.4Å; R279-H283 PolarHBondContact O-N 3.44Å; R279-E327 IonicContact NH2-OE1 3.64Å; R279-E327 PolarHBondContact NH2-OE1 2.8Å; R279-E327 IonicContact NH2-OE2 3.18Å; R279-N415 PolarHBondContact NH1-ND2 2.94Å
280	I	77.8	Confident	78.9	Confident	15 Å²	15	58.4 Å²	58.4	8%	0.077	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-45.5	176.3	-65.8	158.8	0	0	0	110	I258 I261 L262 L265 D276 A277 N282 H283 F284	I258-I280 HydrophobicContact CG1-CG2 4.36Å; I258-I280 HydrophobicContact CG2-CG2 3.98Å; I261-I280 HydrophobicContact CG2-CD1 3.91Å; I261-I280 HydrophobicContact CG2-CG1 4.28Å; L262-I280 HydrophobicContact CD2-CD1 3.52Å; L262-I280 HydrophobicContact CG-CD1 4.35Å; L265-I280 HydrophobicContact CD1-CD1 3.42Å; L265-I280 VanDerWaalsContact CD1-CD1 3.42Å; D276-I280 WeakPolarHBondContact O-CD1 3.47Å; D276-I280 VanDerWaalsContact O-CG1 3.25Å; D276-I280 WeakPolarHBondContact O-CG1 3.34Å; D276-I280 PolarHBondContact O-N 3.25Å; A277-I280 PolarHBondContact O-N 2.97Å; I280-N282 VanDerWaalsContact C-N 3.3Å; I280-N282 PolarHBondContact O-N 2.82Å; I280-H283 WeakPolarHBondContact O-CB 3.42Å; I280-H283 PolarHBondContact O-N 3.27Å; I280-H283 VanDerWaalsContact O-N 3.12Å; I280-F284 HydrophobicContact CG2-CD2 3.82Å; I280-F284 HydrophobicContact CG2-CE2 3.96Å; I280-F284 WeakPolarHBondContact O-CD2 3.29Å; I280-F284 PolarHBondContact O-N 2.84Å; I280-F284 VanDerWaalsContact O-N 3.08Å
281	F	81.1	Confident	78.8	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-43.8	178.7	-156.1	-90.3	0	0	0	112.3	A277 R278 Q285 V286 L288 T293 L296 F297 L350	A277-F281 WeakPolarHBondContact O-CB 3.49Å; A277-F281 PolarHBondContact O-N 3.28Å; R278-F281 PolarHBondContact O-N 3.31Å; F281-Q285 PolarHBondContact O-N 3.24Å; F281-V286 HydrophobicContact CD1-CB 4.05Å; F281-V286 HydrophobicContact CD1-CG2 4.02Å; F281-V286 HydrophobicContact CD2-CB 4.48Å; F281-V286 HydrophobicContact CD2-CG2 3.86Å; F281-V286 HydrophobicContact CE1-CB 3.54Å; F281-V286 HydrophobicContact CE1-CG1 4.12Å; F281-V286 HydrophobicContact CE1-CG2 3.93Å; F281-V286 HydrophobicContact CE2-CB 4.02Å; F281-V286 HydrophobicContact CE2-CG1 4.08Å; F281-V286 HydrophobicContact CE2-CG2 3.78Å; F281-V286 HydrophobicContact CG-CB 4.48Å; F281-V286 HydrophobicContact CG-CG2 3.97Å; F281-V286 HydrophobicContact CZ-CB 3.5Å; F281-V286 HydrophobicContact CZ-CG1 3.59Å; F281-V286 HydrophobicContact CZ-CG2 3.79Å; F281-L288 HydrophobicContact CE1-CD1 4.49Å; F281-L288 HydrophobicContact CZ-CD1 3.71Å; F281-L288 HydrophobicContact CZ-CG 4.32Å; F281-T293 HydrophobicContact CD1-CG2 3.97Å; F281-T293 HydrophobicContact CE1-CG2 3.6Å; F281-T293 HydrophobicContact CZ-CG2 4.34Å; F281-L296 HydrophobicContact CE2-CD1 4.28Å; F281-L296 HydrophobicContact CE2-CD2 4.33Å; F281-L296 HydrophobicContact CZ-CD1 4.35Å; F281-F297 HydrophobicContact CB-CE2 4.43Å; F281-F297 HydrophobicContact CB-CZ 4.03Å; F281-F297 HydrophobicContact CD1-CE2 4.33Å; F281-F297 HydrophobicContact CD2-CE2 4.42Å; F281-F297 HydrophobicContact CD2-CZ 4.18Å; F281-F297 HydrophobicContact CG-CE2 4.15Å; F281-F297 HydrophobicContact CG-CZ 4.07Å; F281-L350 HydrophobicContact CE2-CD2 4.01Å
282	N	78.7	Confident	78.7	Confident	100 Å²	100	59.2 Å²	59.2	54%	0.535	29%	0.288	S	S	.	.	H	α-helix	trans	-68.2	-37.9	175.7	-72.3	-10.7	0	0	0	112.6	R278 R279 I280 Q285	R278-N282 WeakPolarHBondContact O-CB 3.31Å; R278-N282 VanDerWaalsContact O-CG 3.29Å; R278-N282 PolarHBondContact O-N 3.46Å; R279-N282 PolarHBondContact O-N 3.02Å; I280-N282 VanDerWaalsContact C-N 3.3Å; I280-N282 PolarHBondContact O-N 2.82Å; N282-Q285 PolarHBondContact O-N 3.19Å
283	H	71.9	Confident	78.8	Confident	139 Å²	139	60 Å²	60	64%	0.644	29%	0.293	S	S	*	.	H	α-helix	trans	-62	-44.7	179.9	-179.1	79.8	0	0	0	112.1	R279 I280 Q285	R279-H283 WeakPolarHBondContact O-CB 3.4Å; R279-H283 PolarHBondContact O-N 3.44Å; I280-H283 WeakPolarHBondContact O-CB 3.42Å; I280-H283 PolarHBondContact O-N 3.27Å; I280-H283 VanDerWaalsContact O-N 3.12Å; H283-Q285 PolarHBondContact O-N 3.24Å
284	F	75.6	Confident	78.7	Confident	32 Å²	32	62.5 Å²	62.5	14%	0.14	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	1.1	179.8	-77.3	-82.8	0	0	0	114	Y252 H254 E257 I258 I261 I280 V286	Y252-F284 WeakPolarHBondContact OH-CB 3.28Å; H254-F284 HydrophobicContact CB-CD1 3.99Å; E257-F284 HydrophobicContact CB-CE1 4.12Å; E257-F284 HydrophobicContact CB-CZ 4.37Å; I258-F284 HydrophobicContact CD1-CB 3.81Å; I258-F284 HydrophobicContact CD1-CD2 4.24Å; I258-F284 HydrophobicContact CD1-CG 4.03Å; I258-F284 HydrophobicContact CG1-CB 3.98Å; I258-F284 HydrophobicContact CG1-CD1 4.18Å; I258-F284 HydrophobicContact CG1-CD2 3.49Å; I258-F284 VanDerWaalsContact CG1-CD2 3.49Å; I258-F284 HydrophobicContact CG1-CE2 3.99Å; I258-F284 HydrophobicContact CG1-CG 3.61Å; I261-F284 HydrophobicContact CD1-CE2 3.42Å; I261-F284 VanDerWaalsContact CD1-CE2 3.42Å; I261-F284 HydrophobicContact CD1-CZ 3.37Å; I280-F284 HydrophobicContact CG2-CD2 3.82Å; I280-F284 HydrophobicContact CG2-CE2 3.96Å; I280-F284 WeakPolarHBondContact O-CD2 3.29Å; I280-F284 PolarHBondContact O-N 2.84Å; I280-F284 VanDerWaalsContact O-N 3.08Å; F284-V286 VanDerWaalsContact C-N 3.3Å; F284-V286 HydrophobicContact CB-CG2 4.5Å; F284-V286 PolarHBondContact O-N 2.94Å
285	Q	77.4	Confident	78.5	Confident	163 Å²	163	64.7 Å²	64.7	76%	0.762	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	51.9	177.4	-60.7	-178.8	-1.2	0	0	112.1	F281 N282 H283 P287	F281-Q285 PolarHBondContact O-N 3.24Å; N282-Q285 PolarHBondContact O-N 3.19Å; H283-Q285 PolarHBondContact O-N 3.24Å; Q285-P287 WeakPolarHBondContact O-CD 3.4Å
286	V	80.1	Confident	78.8	Confident	13 Å²	13	63.8 Å²	63.8	8%	0.079	31%	0.309	C	S	.	.			trans	-59.8	125.6	-178.5	-170.3	0	0	0	0	108.7	L247 Y252 I258 F281 F284 L288 L350	L247-V286 HydrophobicContact CD2-CG1 3.63Å; Y252-V286 HydrophobicContact CE1-CG1 4.28Å; Y252-V286 HydrophobicContact CE1-CG2 4.45Å; I258-V286 HydrophobicContact CD1-CG2 3.78Å; F281-V286 HydrophobicContact CD1-CB 4.05Å; F281-V286 HydrophobicContact CD1-CG2 4.02Å; F281-V286 HydrophobicContact CD2-CB 4.48Å; F281-V286 HydrophobicContact CD2-CG2 3.86Å; F281-V286 HydrophobicContact CE1-CB 3.54Å; F281-V286 HydrophobicContact CE1-CG1 4.12Å; F281-V286 HydrophobicContact CE1-CG2 3.93Å; F281-V286 HydrophobicContact CE2-CB 4.02Å; F281-V286 HydrophobicContact CE2-CG1 4.08Å; F281-V286 HydrophobicContact CE2-CG2 3.78Å; F281-V286 HydrophobicContact CG-CB 4.48Å; F281-V286 HydrophobicContact CG-CG2 3.97Å; F281-V286 HydrophobicContact CZ-CB 3.5Å; F281-V286 HydrophobicContact CZ-CG1 3.59Å; F281-V286 HydrophobicContact CZ-CG2 3.79Å; F284-V286 VanDerWaalsContact C-N 3.3Å; F284-V286 HydrophobicContact CB-CG2 4.5Å; F284-V286 PolarHBondContact O-N 2.94Å; V286-L288 HydrophobicContact CG1-CD1 4.4Å; V286-L288 HydrophobicContact CG1-CG 4.01Å; V286-L288 PolarHBondContact O-N 3.33Å; V286-L350 HydrophobicContact CG1-CD2 4.17Å
287	P	81.3	Confident	79	Confident	54 Å²	54	61.6 Å²	61.6	35%	0.351	30%	0.297	S	S	.	.			trans	-81.1	63.3	-171.8	32.9	-36.6	0	0	0	111.3	L247 A250 Y252 Q285	L247-P287 HydrophobicContact CD2-CG 4.31Å; A250-P287 HydrophobicContact CB-CB 3.63Å; A250-P287 HydrophobicContact CB-CG 3.28Å; Y252-P287 HydrophobicContact CD2-CG 3.93Å; Y252-P287 HydrophobicContact CG-CG 4.1Å; Q285-P287 WeakPolarHBondContact O-CD 3.4Å
288	L	80.9	Confident	78.9	Confident	19 Å²	19	65.7 Å²	65.7	10%	0.099	32%	0.318	C	S	.	.			trans	-112.2	146.4	170.2	-57.9	-174.8	0	0	0	109.4	I243 A246 L247 F281 V286 L292 L296	I243-L288 HydrophobicContact CG1-CD1 4.46Å; I243-L288 HydrophobicContact CG2-CD1 4.27Å; I243-L288 HydrophobicContact CG2-CD2 4.24Å; A246-L288 HydrophobicContact CB-CD2 3.77Å; L247-L288 HydrophobicContact CD2-CD2 3.92Å; L247-L288 HydrophobicContact CD2-CG 4.45Å; L247-L288 HydrophobicContact CG-CD2 4.2Å; F281-L288 HydrophobicContact CE1-CD1 4.49Å; F281-L288 HydrophobicContact CZ-CD1 3.71Å; F281-L288 HydrophobicContact CZ-CG 4.32Å; V286-L288 HydrophobicContact CG1-CD1 4.4Å; V286-L288 HydrophobicContact CG1-CG 4.01Å; V286-L288 PolarHBondContact O-N 3.33Å; L288-L292 HydrophobicContact CB-CB 4.45Å; L288-L292 HydrophobicContact CB-CD2 4.22Å; L288-L292 HydrophobicContact CB-CG 4.48Å; L288-L292 HydrophobicContact CD2-CD2 3.77Å; L288-L292 HydrophobicContact CG-CD2 4.37Å; L288-L296 HydrophobicContact CD1-CD1 3.68Å
289	D	79.7	Confident	78.6	Confident	128 Å²	128	63 Å²	63	68%	0.684	31%	0.309	S	S	*	.			trans	-62.2	152.8	171.7	-64.9	-27.9	0	0	0	110.1	E291 L292 T293	D289-E291 VanDerWaalsContact C-N 3.28Å; D289-E291 PolarHBondContact O-N 2.91Å; D289-L292 HydrophobicContact CB-CB 4.32Å; D289-L292 PolarHBondContact O-N 2.91Å; D289-T293 PolarHBondContact O-N 2.88Å; D289-T293 PolarHBondContact O-OG1 3.15Å
290	E	75	Confident	78.9	Confident	165 Å²	165	59.3 Å²	59.3	77%	0.771	30%	0.295	S	S	*	.	H	α-helix	trans	-54.1	-46.2	-179.5	-176	174.4	-172.1	0	0	111.4	L292 T293 E294	E290-L292 PolarHBondContact O-N 3.4Å; E290-T293 WeakPolarHBondContact O-CB 3.49Å; E290-T293 PolarHBondContact O-N 2.89Å; E290-E294 PolarHBondContact O-N 3.42Å
291	E	72.9	Confident	79.1	Confident	147 Å²	147	60.9 Å²	60.9	69%	0.687	31%	0.305	S	S	*	.	H	α-helix	trans	-60	-45.6	176.2	-62.4	-177.3	174.5	0	0	111.9	D289 T293 E294 H295	D289-E291 VanDerWaalsContact C-N 3.28Å; D289-E291 PolarHBondContact O-N 2.91Å; E291-T293 VanDerWaalsContact C-N 3.26Å; E291-T293 PolarHBondContact O-N 3.41Å; E291-E294 PolarHBondContact O-N 3.43Å; E291-H295 PolarHBondContact O-N 3.14Å; E291-H295 PolarHBondContact O-ND1 3.15Å
292	L	80.3	Confident	79.1	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-33.2	-179	-172	64.2	0	0	0	111.4	M239 V242 I243 A246 L288 D289 E290 L296	M239-L292 HydrophobicContact SD-CD1 3.4Å; M239-L292 WeakPolarHBondContact SD-CD1 3.42Å; V242-L292 HydrophobicContact CG1-CD1 3.92Å; V242-L292 HydrophobicContact CG1-CD2 4.3Å; I243-L292 HydrophobicContact CG1-CD1 4.22Å; I243-L292 HydrophobicContact CG1-CD2 4.32Å; I243-L292 HydrophobicContact CG1-CG 4.26Å; A246-L292 HydrophobicContact CB-CD2 4.25Å; L288-L292 HydrophobicContact CB-CB 4.45Å; L288-L292 HydrophobicContact CB-CD2 4.22Å; L288-L292 HydrophobicContact CB-CG 4.48Å; L288-L292 HydrophobicContact CD2-CD2 3.77Å; L288-L292 HydrophobicContact CG-CD2 4.37Å; D289-L292 HydrophobicContact CB-CB 4.32Å; D289-L292 PolarHBondContact O-N 2.91Å; E290-L292 PolarHBondContact O-N 3.4Å; L292-L296 VanDerWaalsContact O-CB 3.28Å; L292-L296 WeakPolarHBondContact O-CB 3.44Å; L292-L296 PolarHBondContact O-N 2.84Å
293	T	81.3	Confident	79.2	Confident	17 Å²	17	62.2 Å²	62.2	10%	0.104	32%	0.319	C	S	.	.	H	α-helix	trans	-66.3	-45.1	175.7	-55.8	0	0	0	0	111	F281 D289 E290 E291 L296 F297	F281-T293 HydrophobicContact CD1-CG2 3.97Å; F281-T293 HydrophobicContact CE1-CG2 3.6Å; F281-T293 HydrophobicContact CZ-CG2 4.34Å; D289-T293 PolarHBondContact O-N 2.88Å; D289-T293 PolarHBondContact O-OG1 3.15Å; E290-T293 WeakPolarHBondContact O-CB 3.49Å; E290-T293 PolarHBondContact O-N 2.89Å; E291-T293 VanDerWaalsContact C-N 3.26Å; E291-T293 PolarHBondContact O-N 3.41Å; T293-L296 WeakPolarHBondContact O-CB 3.43Å; T293-L296 PolarHBondContact O-N 3.19Å; T293-F297 HydrophobicContact CG2-CD2 3.88Å; T293-F297 HydrophobicContact CG2-CE2 3.75Å; T293-F297 VanDerWaalsContact O-CD2 3.24Å; T293-F297 WeakPolarHBondContact O-CD2 3.33Å; T293-F297 PolarHBondContact O-N 3.47Å
294	E	80.5	Confident	79.5	Confident	74 Å²	74	56.4 Å²	56.4	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-63	-45.4	174.8	-67.8	-52	130.6	0	0	111.8	R278 E290 E291 L296 F297 D298	R278-E294 IonicContact CZ-OE1 3.3Å; R278-E294 IonicContact CZ-OE2 2.72Å; R278-E294 IonicContact NH1-OE1 3.97Å; R278-E294 PolarHBondContact NH1-OE1 2.72Å; R278-E294 IonicContact NH1-OE2 3.46Å; R278-E294 IonicContact NH2-OE1 2.7Å; R278-E294 PolarHBondContact NH2-OE1 3.32Å; R278-E294 IonicContact NH2-OE2 3.66Å; R278-E294 PolarHBondContact NH2-OE2 3.37Å; E290-E294 PolarHBondContact O-N 3.42Å; E291-E294 PolarHBondContact O-N 3.43Å; E294-L296 VanDerWaalsContact C-N 3.25Å; E294-L296 PolarHBondContact O-N 2.87Å; E294-F297 PolarHBondContact O-N 2.9Å; E294-F297 VanDerWaalsContact O-N 3.13Å; E294-D298 PolarHBondContact O-N 3.41Å
295	H	78.7	Confident	79.7	Confident	51 Å²	51	57.7 Å²	57.7	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-32.5	176.5	-74.3	84	0	0	0	113.1	M239 E291 L299	M239-H295 HydrophobicContact CE-CB 3.74Å; M239-H295 HydrophobicContact SD-CB 4.35Å; E291-H295 PolarHBondContact O-N 3.14Å; E291-H295 PolarHBondContact O-ND1 3.15Å; H295-L299 WeakPolarHBondContact O-CG 3.45Å; H295-L299 PolarHBondContact O-N 2.95Å
296	L	84.7	Confident	79.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-49.8	173	175.9	154.5	0	0	0	110.2	I243 F281 L288 L292 T293 E294 D298 L299 I300 L346 L349	I243-L296 HydrophobicContact CD1-CB 4.24Å; I243-L296 HydrophobicContact CD1-CD1 3.74Å; I243-L296 HydrophobicContact CD1-CG 4.22Å; I243-L296 HydrophobicContact CG1-CD1 4.44Å; F281-L296 HydrophobicContact CE2-CD1 4.28Å; F281-L296 HydrophobicContact CE2-CD2 4.33Å; F281-L296 HydrophobicContact CZ-CD1 4.35Å; L288-L296 HydrophobicContact CD1-CD1 3.68Å; L292-L296 VanDerWaalsContact O-CB 3.28Å; L292-L296 WeakPolarHBondContact O-CB 3.44Å; L292-L296 PolarHBondContact O-N 2.84Å; T293-L296 WeakPolarHBondContact O-CB 3.43Å; T293-L296 PolarHBondContact O-N 3.19Å; E294-L296 VanDerWaalsContact C-N 3.25Å; E294-L296 PolarHBondContact O-N 2.87Å; L296-D298 PolarHBondContact O-N 2.87Å; L296-L299 PolarHBondContact O-N 3.13Å; L296-I300 HydrophobicContact CD2-CD1 3.62Å; L296-I300 WeakPolarHBondContact O-CG1 3.4Å; L296-I300 PolarHBondContact O-N 2.93Å; L296-L346 HydrophobicContact CD2-CD1 4.19Å; L296-L349 HydrophobicContact CG-CD1 4.25Å
297	F	82.9	Confident	79.6	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.009	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-40.6	179.4	-81.9	-69.7	0	0	0	112	M274 A277 R278 F281 T293 E294 L299 I300 T301 V341 L346	M274-F297 HydrophobicContact CE-CB 4.31Å; M274-F297 HydrophobicContact CE-CD1 3.84Å; M274-F297 HydrophobicContact CE-CG 4.44Å; M274-F297 HydrophobicContact SD-CD1 3.44Å; M274-F297 WeakPolarHBondContact SD-CD1 3.42Å; M274-F297 HydrophobicContact SD-CE1 3.85Å; M274-F297 HydrophobicContact SD-CG 4.16Å; A277-F297 HydrophobicContact CB-CE1 4.16Å; R278-F297 HydrophobicContact CB-CZ 4.38Å; R278-F297 HydrophobicContact CG-CD1 4.29Å; R278-F297 HydrophobicContact CG-CD2 4.27Å; R278-F297 HydrophobicContact CG-CE1 3.82Å; R278-F297 HydrophobicContact CG-CE2 3.81Å; R278-F297 HydrophobicContact CG-CZ 3.57Å; F281-F297 HydrophobicContact CB-CE2 4.43Å; F281-F297 HydrophobicContact CB-CZ 4.03Å; F281-F297 HydrophobicContact CD1-CE2 4.33Å; F281-F297 HydrophobicContact CD2-CE2 4.42Å; F281-F297 HydrophobicContact CD2-CZ 4.18Å; F281-F297 HydrophobicContact CG-CE2 4.15Å; F281-F297 HydrophobicContact CG-CZ 4.07Å; T293-F297 HydrophobicContact CG2-CD2 3.88Å; T293-F297 HydrophobicContact CG2-CE2 3.75Å; T293-F297 VanDerWaalsContact O-CD2 3.24Å; T293-F297 WeakPolarHBondContact O-CD2 3.33Å; T293-F297 PolarHBondContact O-N 3.47Å; E294-F297 PolarHBondContact O-N 2.9Å; E294-F297 VanDerWaalsContact O-N 3.13Å; F297-L299 PolarHBondContact O-N 3.32Å; F297-I300 HydrophobicContact CD1-CD1 3.74Å; F297-I300 HydrophobicContact CD1-CG1 4.26Å; F297-I300 HydrophobicContact CE1-CD1 4.12Å; F297-I300 HydrophobicContact CG-CD1 4.44Å; F297-I300 VanDerWaalsContact O-CG1 3.22Å; F297-I300 WeakPolarHBondContact O-CG1 3.41Å; F297-I300 PolarHBondContact O-N 3.23Å; F297-T301 WeakPolarHBondContact O-CG2 3.27Å; F297-T301 PolarHBondContact O-N 3.42Å; F297-T301 PolarHBondContact O-OG1 3.27Å; F297-V341 HydrophobicContact CD1-CG2 4.11Å; F297-V341 HydrophobicContact CE1-CG2 4.22Å; F297-L346 HydrophobicContact CE1-CD1 4.37Å
298	D	79.3	Confident	79.4	Confident	89 Å²	89	62.7 Å²	62.7	48%	0.476	33%	0.331	S	S	.	.	H	α-helix	trans	-57.1	-32.1	175	-77.9	-8.7	0	0	0	113.8	E294 L296 T301	E294-D298 PolarHBondContact O-N 3.41Å; L296-D298 PolarHBondContact O-N 2.87Å; D298-T301 PolarHBondContact O-OG1 3.05Å; D298-T301 VanDerWaalsContact O-OG1 3.06Å
299	L	76.5	Confident	79.2	Confident	5 Å²	5	63 Å²	63	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-75.6	-29.3	179.2	-75.9	172.4	0	0	0	112.6	Y232 R235 M239 H295 L296 F297	Y232-L299 HydrophobicContact CD2-CD2 4.4Å; Y232-L299 HydrophobicContact CE2-CD2 4.13Å; Y232-L299 WeakPolarHBondContact CE2-O 3.28Å; Y232-L299 PolarHBondContact OH-O 3.06Å; R235-L299 HydrophobicContact CB-CD2 4.34Å; R235-L299 HydrophobicContact CG-CD2 3.9Å; M239-L299 HydrophobicContact CB-CD1 3.53Å; M239-L299 HydrophobicContact CG-CD1 3.58Å; H295-L299 WeakPolarHBondContact O-CG 3.45Å; H295-L299 PolarHBondContact O-N 2.95Å; L296-L299 PolarHBondContact O-N 3.13Å; F297-L299 PolarHBondContact O-N 3.32Å
300	I	80.2	Confident	79.3	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-105.4	-8.5	-172.1	61.8	-175.7	0	0	0	113.1	L296 F297 V341 D342 K345 L346 L349	L296-I300 HydrophobicContact CD2-CD1 3.62Å; L296-I300 WeakPolarHBondContact O-CG1 3.4Å; L296-I300 PolarHBondContact O-N 2.93Å; F297-I300 HydrophobicContact CD1-CD1 3.74Å; F297-I300 HydrophobicContact CD1-CG1 4.26Å; F297-I300 HydrophobicContact CE1-CD1 4.12Å; F297-I300 HydrophobicContact CG-CD1 4.44Å; F297-I300 VanDerWaalsContact O-CG1 3.22Å; F297-I300 WeakPolarHBondContact O-CG1 3.41Å; F297-I300 PolarHBondContact O-N 3.23Å; I300-V341 HydrophobicContact CB-CG1 4.24Å; I300-V341 HydrophobicContact CD1-CG1 3.61Å; I300-V341 HydrophobicContact CD1-CG2 4.48Å; I300-V341 HydrophobicContact CG1-CG1 3.91Å; I300-V341 HydrophobicContact CG1-CG2 4.46Å; I300-D342 PolarHBondContact O-N 2.81Å; I300-D342 VanDerWaalsContact O-N 3.15Å; I300-K345 HydrophobicContact CG2-CB 3.88Å; I300-L346 HydrophobicContact CD1-CB 3.9Å; I300-L346 HydrophobicContact CD1-CD1 3.35Å; I300-L346 HydrophobicContact CD1-CG 4.09Å; I300-L346 HydrophobicContact CG2-CB 4.4Å; I300-L349 HydrophobicContact CG2-CD1 3.76Å
301	T	82.1	Confident	79.4	Confident	47 Å²	47	61.7 Å²	61.7	29%	0.288	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	130.8	177	45.2	0	0	0	0	112.1	M274 F297 D298 A340	M274-T301 HydrophobicContact CE-CG2 3.12Å; F297-T301 WeakPolarHBondContact O-CG2 3.27Å; F297-T301 PolarHBondContact O-N 3.42Å; F297-T301 PolarHBondContact O-OG1 3.27Å; D298-T301 PolarHBondContact O-OG1 3.05Å; D298-T301 VanDerWaalsContact O-OG1 3.06Å; T301-A340 CarbonylContact C-O 3.59Å; T301-A340 WeakPolarHBondContact CA-O 3.05Å
302	V	81.3	Confident	79.4	Confident	43 Å²	43	55.1 Å²	55.1	26%	0.261	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.9	171.7	-179.9	0	0	0	0	107.4	L271 A304 A340 D342	L271-V302 HydrophobicContact CD2-CB 3.91Å; L271-V302 HydrophobicContact CD2-CG1 4.04Å; L271-V302 HydrophobicContact CD2-CG2 4.16Å; V302-A304 PolarHBondContact O-N 3.28Å; V302-A340 PolarHBondContact N-O 3.1Å; V302-A340 WeakPolarHBondContact O-CA 3.45Å; V302-A340 WeakPolarHBondContact O-CB 3.24Å; V302-A340 PolarHBondContact O-N 2.88Å; V302-A340 VanDerWaalsContact O-O 3.08Å; V302-D342 HydrophobicContact CG2-CB 4.37Å
303	P	81.3	Confident	79.3	Confident	94 Å²	94	59.1 Å²	59.1	61%	0.61	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	133.3	173.4	23.4	-34.4	0	0	0	111.3	W339	P303-W339 HydrophobicContact CB-CZ3 4.47Å
304	A	77.6	Confident	79.2	Confident	16 Å²	16	63.1 Å²	63.1	13%	0.132	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-72.4	148.6	-179.4	0	0	0	0	0	112.2	V302 M308 I309 N338 A340	V302-A304 PolarHBondContact O-N 3.28Å; A304-M308 HydrophobicContact CB-CE 3.9Å; A304-I309 HydrophobicContact CB-CD1 4.26Å; A304-I309 HydrophobicContact CB-CG1 3.9Å; A304-N338 WeakPolarHBondContact CB-O 3.5Å; A304-N338 PolarHBondContact N-O 3.11Å; A304-A340 HydrophobicContact CB-CB 4.12Å
305	S	79.2	Confident	78.8	Confident	59 Å²	59	61.7 Å²	61.7	41%	0.413	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-70.8	151.6	171.8	70.2	0	0	0	0	111.1	E307 M308 I309	S305-E307 PolarHBondContact O-N 3.2Å; S305-M308 PolarHBondContact O-N 3.45Å; S305-M308 VanDerWaalsContact O-N 3.08Å; S305-M308 WeakPolarHBondContact OG-CB 3.3Å; S305-M308 PolarHBondContact OG-N 3.17Å; S305-I309 WeakPolarHBondContact O-CG1 3.37Å; S305-I309 PolarHBondContact O-N 2.66Å
306	N	77.1	Confident	78.4	Confident	142 Å²	142	61.1 Å²	61.1	76%	0.759	32%	0.319	S	S	*	.	H	α-helix	trans	-57.7	-33.2	178.4	-70.4	-24.4	0	0	0	112.8	K310	N306-K310 PolarHBondContact O-N 2.99Å; N306-K310 VanDerWaalsContact O-N 3.12Å
307	E	78.7	Confident	77.8	Confident	165 Å²	165	67.9 Å²	67.9	77%	0.771	35%	0.349	S	S	*	.	H	α-helix	trans	-65.3	-43.6	176.8	-64.7	179.2	173.2	0	0	111.5	S305 K310 H311	S305-E307 PolarHBondContact O-N 3.2Å; E307-K310 PolarHBondContact O-N 3.14Å; E307-H311 PolarHBondContact O-N 3.46Å
308	M	77.2	Confident	76.9	Confident	29 Å²	29	72.6 Å²	72.6	14%	0.143	37%	0.371	C	S	.	.	H	α-helix	trans	-68.3	-40.8	179.8	-167.6	152	68.2	0	0	111.7	L271 P273 A304 S305 K310 H311 V312 A340	L271-M308 HydrophobicContact CB-CE 4.37Å; P273-M308 HydrophobicContact CG-CG 3.75Å; P273-M308 HydrophobicContact CG-SD 3.74Å; A304-M308 HydrophobicContact CB-CE 3.9Å; S305-M308 PolarHBondContact O-N 3.45Å; S305-M308 VanDerWaalsContact O-N 3.08Å; S305-M308 WeakPolarHBondContact OG-CB 3.3Å; S305-M308 PolarHBondContact OG-N 3.17Å; M308-K310 VanDerWaalsContact C-N 3.27Å; M308-K310 PolarHBondContact O-N 3.13Å; M308-H311 PolarHBondContact O-N 3.12Å; M308-V312 WeakPolarHBondContact O-CG2 3.31Å; M308-V312 PolarHBondContact O-N 3.39Å; M308-A340 HydrophobicContact CE-CB 3.3Å
309	I	77.8	Confident	76.1	Confident	25 Å²	25	71.7 Å²	71.7	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-59.1	-41.4	174	-65.3	168.7	0	0	0	110.7	A304 S305 K313 I337	A304-I309 HydrophobicContact CB-CD1 4.26Å; A304-I309 HydrophobicContact CB-CG1 3.9Å; S305-I309 WeakPolarHBondContact O-CG1 3.37Å; S305-I309 PolarHBondContact O-N 2.66Å; I309-K313 HydrophobicContact CG2-CD 4.18Å; I309-K313 WeakPolarHBondContact O-CB 3.03Å; I309-K313 VanDerWaalsContact O-CG 3.32Å; I309-K313 WeakPolarHBondContact O-CG 3.46Å; I309-K313 PolarHBondContact O-N 3.14Å; I309-K313 VanDerWaalsContact O-N 3.13Å; I309-I337 HydrophobicContact CG2-CG2 4.19Å
310	K	80.2	Confident	75.2	Confident	147 Å²	147	79.2 Å²	79.2	64%	0.639	40%	0.398	S	S	*	.	H	α-helix	trans	-65.9	-46.2	178.3	-170.2	-177.6	176.3	-171	0	111.4	N306 E307 M308 K313 E314	N306-K310 PolarHBondContact O-N 2.99Å; N306-K310 VanDerWaalsContact O-N 3.12Å; E307-K310 PolarHBondContact O-N 3.14Å; M308-K310 VanDerWaalsContact C-N 3.27Å; M308-K310 PolarHBondContact O-N 3.13Å; K310-K313 PolarHBondContact O-N 3.08Å; K310-E314 PolarHBondContact O-N 3.27Å
311	H	77	Confident	74.1	Confident	118 Å²	118	86.9 Å²	86.9	55%	0.546	43%	0.434	S	S	.	.	H	α-helix	trans	-59.1	-48.2	178.3	-175.2	-88.5	0	0	0	111.8	E307 M308 K313 E314 C315	E307-H311 PolarHBondContact O-N 3.46Å; M308-H311 PolarHBondContact O-N 3.12Å; H311-K313 VanDerWaalsContact C-N 3.34Å; H311-K313 PolarHBondContact O-N 3.39Å; H311-E314 WeakPolarHBondContact O-CB 3.23Å; H311-E314 PolarHBondContact O-N 2.72Å; H311-E314 VanDerWaalsContact O-N 3.12Å; H311-C315 PolarHBondContact CE1-SG 3.24Å; H311-C315 PolarHBondContact O-N 3.47Å; H311-C315 PolarHBondContact O-SG 2.85Å; H311-C315 VanDerWaalsContact O-SG 3.33Å
312	V	74	Confident	72.8	Confident	10 Å²	10	89.6 Å²	89.6	6%	0.061	45%	0.447	C	S	.	.	H	α-helix	trans	-60.8	-43.1	178.4	173.4	0	0	0	0	111.4	P273 I275 M308 E314 C315 I316 I337	P273-V312 HydrophobicContact CB-CG2 3.8Å; P273-V312 HydrophobicContact CG-CG2 3.82Å; I275-V312 HydrophobicContact CG2-CG1 4.23Å; M308-V312 WeakPolarHBondContact O-CG2 3.31Å; M308-V312 PolarHBondContact O-N 3.39Å; V312-E314 VanDerWaalsContact C-N 3.29Å; V312-E314 PolarHBondContact O-N 3.36Å; V312-C315 PolarHBondContact O-N 3.08Å; V312-I316 HydrophobicContact CG1-CD1 3.84Å; V312-I316 HydrophobicContact CG1-CG1 4.47Å; V312-I316 VanDerWaalsContact O-CG1 3.28Å; V312-I316 WeakPolarHBondContact O-CG1 3.46Å; V312-I316 PolarHBondContact O-N 3.16Å; V312-I337 HydrophobicContact CG1-CG2 4.32Å
313	K	78.9	Confident	71.1	Confident	107 Å²	107	93.8 Å²	93.8	47%	0.465	47%	0.468	S	S	.	.	H	α-helix	trans	-63	-35.1	176.4	-76	177.3	179.7	178	0	112.5	I309 K310 H311 K317 I337	I309-K313 HydrophobicContact CG2-CD 4.18Å; I309-K313 WeakPolarHBondContact O-CB 3.03Å; I309-K313 VanDerWaalsContact O-CG 3.32Å; I309-K313 WeakPolarHBondContact O-CG 3.46Å; I309-K313 PolarHBondContact O-N 3.14Å; I309-K313 VanDerWaalsContact O-N 3.13Å; K310-K313 PolarHBondContact O-N 3.08Å; H311-K313 VanDerWaalsContact C-N 3.34Å; H311-K313 PolarHBondContact O-N 3.39Å; K313-K317 WeakPolarHBondContact O-CG 3.48Å; K313-K317 PolarHBondContact O-N 3.15Å; K313-K317 VanDerWaalsContact O-N 3.15Å; K313-I337 HydrophobicContact CG-CG2 4.47Å
314	E	78	Confident	69.5	Low	102 Å²	102	96.3 Å²	96.3	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-71.4	-43.8	177.6	-163.5	162.9	-167.9	0	0	111.5	K310 H311 V312 I316 K317 Q318	K310-E314 PolarHBondContact O-N 3.27Å; H311-E314 WeakPolarHBondContact O-CB 3.23Å; H311-E314 PolarHBondContact O-N 2.72Å; H311-E314 VanDerWaalsContact O-N 3.12Å; V312-E314 VanDerWaalsContact C-N 3.29Å; V312-E314 PolarHBondContact O-N 3.36Å; E314-I316 PolarHBondContact O-N 3.06Å; E314-K317 WeakPolarHBondContact O-CB 3.37Å; E314-K317 PolarHBondContact O-N 3.41Å; E314-K317 VanDerWaalsContact O-N 3.14Å; E314-Q318 WeakPolarHBondContact O-CG 3.49Å; E314-Q318 PolarHBondContact O-N 3.11Å
315	C	71.5	Confident	67.5	Low	43 Å²	43	101 Å²	101	29%	0.291	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-43.3	172.7	-64.2	0	0	0	0	112.3	H311 V312 K317 Q318 N319	H311-C315 PolarHBondContact CE1-SG 3.24Å; H311-C315 PolarHBondContact O-N 3.47Å; H311-C315 PolarHBondContact O-SG 2.85Å; H311-C315 VanDerWaalsContact O-SG 3.33Å; V312-C315 PolarHBondContact O-N 3.08Å; C315-K317 VanDerWaalsContact C-N 3.28Å; C315-K317 PolarHBondContact O-N 3.31Å; C315-Q318 PolarHBondContact O-N 3.38Å; C315-N319 WeakPolarHBondContact O-CB 3.27Å; C315-N319 VanDerWaalsContact O-CG 3.3Å; C315-N319 PolarHBondContact O-N 3.04Å
316	I	71.6	Confident	65.8	Low	40 Å²	40	105.7 Å²	105.7	21%	0.205	52%	0.518	C	S	.	.	H	α-helix	trans	-62.5	-36.6	176.5	-68.5	167.3	0	0	0	111.1	V312 E314 K320 I337	V312-I316 HydrophobicContact CG1-CD1 3.84Å; V312-I316 HydrophobicContact CG1-CG1 4.47Å; V312-I316 VanDerWaalsContact O-CG1 3.28Å; V312-I316 WeakPolarHBondContact O-CG1 3.46Å; V312-I316 PolarHBondContact O-N 3.16Å; E314-I316 PolarHBondContact O-N 3.06Å; I316-K320 WeakPolarHBondContact O-CG 3.43Å; I316-K320 PolarHBondContact O-N 2.83Å; I316-I337 HydrophobicContact CD1-CD1 4.35Å
317	K	71.3	Confident	64	Low	142 Å²	142	102.7 Å²	102.7	62%	0.617	50%	0.5	S	S	*	.	H	α-helix	trans	-68.1	-47.1	176	-76.1	176.4	178.8	-172	0	111.9	K313 E314 C315 N319 K320 E321	K313-K317 WeakPolarHBondContact O-CG 3.48Å; K313-K317 PolarHBondContact O-N 3.15Å; K313-K317 VanDerWaalsContact O-N 3.15Å; E314-K317 WeakPolarHBondContact O-CB 3.37Å; E314-K317 PolarHBondContact O-N 3.41Å; E314-K317 VanDerWaalsContact O-N 3.14Å; C315-K317 VanDerWaalsContact C-N 3.28Å; C315-K317 PolarHBondContact O-N 3.31Å; K317-N319 VanDerWaalsContact C-N 3.28Å; K317-N319 PolarHBondContact O-N 2.7Å; K317-K320 WeakPolarHBondContact O-CB 3.29Å; K317-K320 PolarHBondContact O-N 3.13Å; K317-E321 PolarHBondContact O-N 3.07Å; K317-E321 VanDerWaalsContact O-N 3.15Å
318	Q	64.3	Low	62.2	Low	101 Å²	101	103.9 Å²	103.9	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-60.2	-39	177.5	-71.1	179.7	-0.9	0	0	111.9	E314 C315 K320 E321 N322	E314-Q318 WeakPolarHBondContact O-CG 3.49Å; E314-Q318 PolarHBondContact O-N 3.11Å; C315-Q318 PolarHBondContact O-N 3.38Å; Q318-K320 VanDerWaalsContact C-N 3.27Å; Q318-K320 PolarHBondContact O-N 2.72Å; Q318-E321 PolarHBondContact O-N 3.06Å; Q318-N322 PolarHBondContact O-N 3.49Å; Q318-N322 VanDerWaalsContact O-N 3.08Å; Q318-N322 PolarHBondContact O-ND2 2.85Å
319	N	61.5	Low	60.2	Low	70 Å²	70	109.6 Å²	109.6	37%	0.374	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-22.1	175.8	-72.5	-2.1	0	0	0	113.7	C315 K317 N322 N415	C315-N319 WeakPolarHBondContact O-CB 3.27Å; C315-N319 VanDerWaalsContact O-CG 3.3Å; C315-N319 PolarHBondContact O-N 3.04Å; K317-N319 VanDerWaalsContact C-N 3.28Å; K317-N319 PolarHBondContact O-N 2.7Å; N319-N322 VanDerWaalsContact O-O 3.11Å; N319-N415 PolarHBondContact ND2-OD1 2.92Å
320	K	58.9	Low	58.5	Low	163 Å²	163	116.8 Å²	116.8	71%	0.709	56%	0.555	S	S	*	*	H	α-helix	trans	-82.3	-29.9	173.5	-75.5	-179.8	179.2	-173.1	0	112.9	I316 K317 Q318	I316-K320 WeakPolarHBondContact O-CG 3.43Å; I316-K320 PolarHBondContact O-N 2.83Å; K317-K320 WeakPolarHBondContact O-CB 3.29Å; K317-K320 PolarHBondContact O-N 3.13Å; Q318-K320 VanDerWaalsContact C-N 3.27Å; Q318-K320 PolarHBondContact O-N 2.72Å
321	E	56.8	Low	56.8	Low	161 Å²	161	118.2 Å²	118.2	75%	0.752	56%	0.564	S	S	*	*	H	α-helix	trans	-77.5	-32.7	176.9	-73.2	176	175.4	0	0	112	K317 Q318 D323	K317-E321 PolarHBondContact O-N 3.07Å; K317-E321 VanDerWaalsContact O-N 3.15Å; Q318-E321 PolarHBondContact O-N 3.06Å; E321-D323 PolarHBondContact O-N 3.31Å
322	N	54.7	Low	55.6	Low	104 Å²	104	115.8 Å²	115.8	56%	0.556	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	92.3	171	-63.8	-32.8	0	0	0	109.1	Q318 N319 I324	Q318-N322 PolarHBondContact O-N 3.49Å; Q318-N322 VanDerWaalsContact O-N 3.08Å; Q318-N322 PolarHBondContact O-ND2 2.85Å; N319-N322 VanDerWaalsContact O-O 3.11Å; N322-I324 PolarHBondContact O-N 3.31Å
323	D	45.2	Very low	54.6	Low	131 Å²	131	121.5 Å²	121.5	70%	0.701	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.3	62.3	-174.8	-152.4	2.3	0	0	0	116.1	E321 N325	E321-D323 PolarHBondContact O-N 3.31Å; D323-N325 VanDerWaalsContact C-N 3.34Å; D323-N325 PolarHBondContact O-N 3.18Å; D323-N325 PolarHBondContact OD1-ND2 2.92Å
324	I	48.5	Very low	53.6	Low	147 Å²	147	122.6 Å²	122.6	75%	0.754	59%	0.591	S	S	*	*			trans	-99.4	65.8	170.6	-50.6	175.5	0	0	0	107.4	N322 N326	N322-I324 PolarHBondContact O-N 3.31Å; I324-N326 VanDerWaalsContact C-N 3.28Å; I324-N326 PolarHBondContact O-N 2.85Å
325	N	35.9	Very low	52.9	Low	115 Å²	115	122.8 Å²	122.8	62%	0.615	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	82.6	171.3	-85.9	-43.5	0	0	0	109.9	D323	D323-N325 VanDerWaalsContact C-N 3.34Å; D323-N325 PolarHBondContact O-N 3.18Å; D323-N325 PolarHBondContact OD1-ND2 2.92Å
326	N	41.8	Very low	52.8	Low	158 Å²	158	122.5 Å²	122.5	85%	0.845	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.6	6	162.2	-93.1	-25.1	0	0	0	115.1	I324 K328	I324-N326 VanDerWaalsContact C-N 3.28Å; I324-N326 PolarHBondContact O-N 2.85Å; N326-K328 PolarHBondContact O-N 3.49Å
327	E	41.1	Very low	52.8	Low	79 Å²	79	121.5 Å²	121.5	37%	0.369	59%	0.587	S	S	.	*			trans	-62.1	118.2	158.8	-88.7	-155.8	-119.3	0	0	108.2	R279 H329 L414	R279-E327 IonicContact NH2-OE1 3.64Å; R279-E327 PolarHBondContact NH2-OE1 2.8Å; R279-E327 IonicContact NH2-OE2 3.18Å; E327-H329 VanDerWaalsContact C-N 3.29Å; E327-H329 PolarHBondContact O-N 2.65Å; E327-H329 PolarHBondContact O-ND1 3.48Å; E327-L414 HydrophobicContact CG-CD2 4.34Å
328	K	39.3	Very low	53.1	Low	189 Å²	189	118.4 Å²	118.4	82%	0.822	58%	0.577	S	S	*	*			trans	-51.5	104.8	150.4	-79.6	-179	178.5	178.3	0	105.2	N326 Y330	N326-K328 PolarHBondContact O-N 3.49Å; K328-Y330 VanDerWaalsContact C-N 3.31Å; K328-Y330 PolarHBondContact O-N 3.38Å
329	H	36.8	Very low	53.9	Low	149 Å²	149	119.1 Å²	119.1	69%	0.69	58%	0.575	S	S	*	*			trans	-59.2	98.2	179.1	-76.9	54.1	0	0	0	107.6	E327 H331	E327-H329 VanDerWaalsContact C-N 3.29Å; E327-H329 PolarHBondContact O-N 2.65Å; E327-H329 PolarHBondContact O-ND1 3.48Å; H329-H331 PolarHBondContact O-N 3.31Å
330	Y	41.8	Very low	54.8	Low	176 Å²	176	115.8 Å²	115.8	69%	0.69	56%	0.558	S	S	*	*			trans	-57.6	123.8	149.8	-71.1	-82.4	0	0	0	104.3	K328 I332	K328-Y330 VanDerWaalsContact C-N 3.31Å; K328-Y330 PolarHBondContact O-N 3.38Å; Y330-I332 PolarHBondContact O-N 2.91Å
331	H	43	Very low	55.9	Low	178 Å²	178	108.1 Å²	108.1	82%	0.824	52%	0.524	S	S	*	.			trans	-52	99	164	-81.5	-83.5	0	0	0	105.9	H329 E333	H329-H331 PolarHBondContact O-N 3.31Å; H331-E333 PolarHBondContact O-N 3.23Å
332	I	52	Low	57.2	Low	67 Å²	67	101.9 Å²	101.9	34%	0.344	50%	0.496	S	S	.	.			trans	-68	88.1	167.1	-59.5	168.9	0	0	0	102.4	I275 Y330 N334 I337	I275-I332 HydrophobicContact CD1-CD1 3.91Å; I275-I332 HydrophobicContact CD1-CG1 4.13Å; I275-I332 HydrophobicContact CD1-CG2 3.8Å; Y330-I332 PolarHBondContact O-N 2.91Å; I332-N334 PolarHBondContact O-N 3.44Å; I332-N334 VanDerWaalsContact O-N 3.14Å; I332-I337 HydrophobicContact CG2-CD1 4.22Å; I332-I337 HydrophobicContact CG2-CG1 4.11Å
333	E	54.3	Low	58.4	Low	130 Å²	130	97.6 Å²	97.6	61%	0.607	47%	0.472	S	S	*	.			trans	-52	124.1	168.7	-72.8	-178.4	165.3	0	0	105.5	H331 D335 V336	H331-E333 PolarHBondContact O-N 3.23Å; E333-D335 PolarHBondContact O-N 2.86Å; E333-V336 HydrophobicContact CB-CG2 4.45Å; E333-V336 PolarHBondContact O-N 3.23Å
334	N	57.4	Low	59.9	Low	130 Å²	130	93 Å²	93	70%	0.695	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-18.2	-176.3	-73.1	-52.1	0	0	0	112.3	I332	I332-N334 PolarHBondContact O-N 3.44Å; I332-N334 VanDerWaalsContact O-N 3.14Å
335	D	63.6	Low	61.4	Low	106 Å²	106	89 Å²	89	57%	0.567	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.1	179.1	-63.7	-11.5	0	0	0	112.8	E333 I337 N338 W339	E333-D335 PolarHBondContact O-N 2.86Å; D335-I337 VanDerWaalsContact C-N 3.29Å; D335-I337 PolarHBondContact O-N 3.25Å; D335-N338 PolarHBondContact O-N 3.49Å; D335-W339 PolarHBondContact O-NE1 3.42Å
336	V	68.7	Low	63.7	Low	37 Å²	37	83.7 Å²	83.7	22%	0.224	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-69.4	-27.1	-176.5	-170.3	0	0	0	0	112.3	M274 E333 N338 W339	M274-V336 HydrophobicContact CB-CG1 4.03Å; M274-V336 HydrophobicContact CG-CG1 3.44Å; M274-V336 VanDerWaalsContact CG-CG1 3.44Å; E333-V336 HydrophobicContact CB-CG2 4.45Å; E333-V336 PolarHBondContact O-N 3.23Å; V336-N338 PolarHBondContact O-N 3Å; V336-W339 PolarHBondContact O-N 2.85Å
337	I	71.9	Confident	65.3	Low	19 Å²	19	76.1 Å²	76.1	10%	0.097	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-66.9	-25.9	-178.1	-58.6	173.7	0	0	0	111.6	I309 V312 K313 I316 I332 D335 W339	I309-I337 HydrophobicContact CG2-CG2 4.19Å; V312-I337 HydrophobicContact CG1-CG2 4.32Å; K313-I337 HydrophobicContact CG-CG2 4.47Å; I316-I337 HydrophobicContact CD1-CD1 4.35Å; I332-I337 HydrophobicContact CG2-CD1 4.22Å; I332-I337 HydrophobicContact CG2-CG1 4.11Å; D335-I337 VanDerWaalsContact C-N 3.29Å; D335-I337 PolarHBondContact O-N 3.25Å; I337-W339 VanDerWaalsContact C-N 3.27Å; I337-W339 PolarHBondContact O-N 3.43Å
338	N	76.9	Confident	67.1	Low	76 Å²	76	76.1 Å²	76.1	41%	0.406	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-82.7	-4.2	-176.4	-60.6	-33.8	0	0	0	113.2	A304 D335 V336	A304-N338 WeakPolarHBondContact CB-O 3.5Å; A304-N338 PolarHBondContact N-O 3.11Å; D335-N338 PolarHBondContact O-N 3.49Å; V336-N338 PolarHBondContact O-N 3Å
339	W	81.2	Confident	69.1	Low	117 Å²	117	67.1 Å²	67.1	44%	0.443	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.4	-174.7	-58.2	106.6	0	0	0	112.3	M274 P303 D335 V336 I337	M274-W339 HydrophobicContact CB-CB 4.04Å; M274-W339 WeakPolarHBondContact CB-O 3.49Å; M274-W339 HydrophobicContact CE-CB 4.42Å; M274-W339 HydrophobicContact CG-CB 4.48Å; M274-W339 PolarHBondContact N-O 3.08Å; P303-W339 HydrophobicContact CB-CZ3 4.47Å; D335-W339 PolarHBondContact O-NE1 3.42Å; V336-W339 PolarHBondContact O-N 2.85Å; I337-W339 VanDerWaalsContact C-N 3.27Å; I337-W339 PolarHBondContact O-N 3.43Å
340	A	82.2	Confident	71.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	160	172.1	0	0	0	0	0	109.8	L271 I272 T301 V302 A304 M308	L271-A340 HydrophobicContact CB-CB 4.35Å; L271-A340 HydrophobicContact CD2-CB 4.14Å; I272-A340 CarbonylContact O-C 3.33Å; I272-A340 VanDerWaalsContact O-CA 3.26Å; I272-A340 WeakPolarHBondContact O-CA 3.4Å; T301-A340 CarbonylContact C-O 3.59Å; T301-A340 WeakPolarHBondContact CA-O 3.05Å; V302-A340 PolarHBondContact N-O 3.1Å; V302-A340 WeakPolarHBondContact O-CA 3.45Å; V302-A340 WeakPolarHBondContact O-CB 3.24Å; V302-A340 PolarHBondContact O-N 2.88Å; V302-A340 VanDerWaalsContact O-O 3.08Å; A304-A340 HydrophobicContact CB-CB 4.12Å; M308-A340 HydrophobicContact CE-CB 3.3Å
341	V	81.6	Confident	72.6	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.8	176.1	171.4	0	0	0	0	108.9	L271 I272 M274 A277 F297 I300 W343 L346	L271-V341 WeakPolarHBondContact CA-O 3.34Å; I272-V341 PolarHBondContact N-O 3.15Å; I272-V341 PolarHBondContact O-N 3.43Å; M274-V341 HydrophobicContact CB-CG2 4.4Å; M274-V341 HydrophobicContact CE-CG2 3.43Å; M274-V341 VanDerWaalsContact CE-CG2 3.43Å; M274-V341 HydrophobicContact SD-CG2 3.56Å; M274-V341 VanDerWaalsContact SD-CG2 3.56Å; A277-V341 HydrophobicContact CB-CB 4.03Å; A277-V341 HydrophobicContact CB-CG1 4.3Å; A277-V341 HydrophobicContact CB-CG2 3.84Å; F297-V341 HydrophobicContact CD1-CG2 4.11Å; F297-V341 HydrophobicContact CE1-CG2 4.22Å; I300-V341 HydrophobicContact CB-CG1 4.24Å; I300-V341 HydrophobicContact CD1-CG1 3.61Å; I300-V341 HydrophobicContact CD1-CG2 4.48Å; I300-V341 HydrophobicContact CG1-CG1 3.91Å; I300-V341 HydrophobicContact CG1-CG2 4.46Å; V341-W343 PolarHBondContact O-N 2.96Å; V341-L346 HydrophobicContact CG1-CB 4.35Å; V341-L346 HydrophobicContact CG1-CD1 4.15Å
342	D	82.7	Confident	74.1	Confident	29 Å²	29	46 Å²	46	16%	0.155	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	104	167.3	-174	-18	0	0	0	109.2	I300 V302 C344 K345 L346	I300-D342 PolarHBondContact O-N 2.81Å; I300-D342 VanDerWaalsContact O-N 3.15Å; V302-D342 HydrophobicContact CG2-CB 4.37Å; D342-C344 VanDerWaalsContact C-N 3.26Å; D342-C344 PolarHBondContact O-N 2.64Å; D342-C344 WeakPolarHBondContact OD1-CB 3.48Å; D342-C344 PolarHBondContact OD1-N 2.72Å; D342-K345 HydrophobicContact CB-CB 4.35Å; D342-K345 HydrophobicContact CB-CD 4.14Å; D342-K345 HydrophobicContact CB-CG 4.28Å; D342-K345 PolarHBondContact O-N 3.15Å; D342-K345 PolarHBondContact OD1-N 2.87Å; D342-K345 WeakPolarHBondContact OD2-CD 3.33Å; D342-K345 VanDerWaalsContact OD2-CE 3.28Å; D342-K345 WeakPolarHBondContact OD2-CE 3.37Å; D342-K345 IonicContact OD2-NZ 3.84Å; D342-L346 PolarHBondContact O-N 3.06Å
343	W	81.2	Confident	74.8	Confident	15 Å²	15	46.5 Å²	46.5	6%	0.057	23%	0.23	C	C	.	.	H	α-helix	trans	-70.7	-24.7	-173.2	73.3	-99.7	0	0	0	112.6	I259 L262 S269 N270 I272 V341 L346 S347 P379	I259-W343 HydrophobicContact CG2-CZ3 4.25Å; L262-W343 HydrophobicContact CB-CB 4.15Å; L262-W343 HydrophobicContact CD1-CB 4.5Å; S269-W343 PolarHBondContact O-NE1 3.34Å; N270-W343 PolarHBondContact O-N 3.16Å; I272-W343 HydrophobicContact CD1-CB 3.55Å; I272-W343 HydrophobicContact CD1-CG 3.95Å; I272-W343 HydrophobicContact CG1-CB 4.21Å; I272-W343 HydrophobicContact CG1-CG 4.46Å; V341-W343 PolarHBondContact O-N 2.96Å; W343-L346 PolarHBondContact O-N 3.32Å; W343-S347 WeakPolarHBondContact O-CB 3.43Å; W343-S347 PolarHBondContact O-N 3.15Å; W343-S347 PolarHBondContact O-OG 3.47Å; W343-P379 HydrophobicContact CH2-CG 4.25Å
344	C	77.1	Confident	75.1	Confident	35 Å²	35	44.4 Å²	44.4	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-68.2	-39.6	175.9	-66.6	0	0	0	0	111.2	D342 S347 E348	D342-C344 VanDerWaalsContact C-N 3.26Å; D342-C344 PolarHBondContact O-N 2.64Å; D342-C344 WeakPolarHBondContact OD1-CB 3.48Å; D342-C344 PolarHBondContact OD1-N 2.72Å; C344-S347 WeakPolarHBondContact CA-OG 3.36Å; C344-S347 PolarHBondContact O-N 3.23Å; C344-S347 PolarHBondContact O-OG 2.95Å; C344-E348 WeakPolarHBondContact O-CG 3.49Å; C344-E348 PolarHBondContact O-N 2.78Å
345	K	80.2	Confident	74.7	Confident	63 Å²	63	42.4 Å²	42.4	27%	0.274	21%	0.212	S	C	.	.	H	α-helix	trans	-70.4	-38.4	175	-68.2	-179.2	-176.1	176.3	0	112	Y232 F236 I300 D342 S347 E348 L349	Y232-K345 WeakPolarHBondContact OH-CD 3.38Å; Y232-K345 PolarHBondContact OH-NZ 3.3Å; F236-K345 HydrophobicContact CE2-CB 4.28Å; I300-K345 HydrophobicContact CG2-CB 3.88Å; D342-K345 HydrophobicContact CB-CB 4.35Å; D342-K345 HydrophobicContact CB-CD 4.14Å; D342-K345 HydrophobicContact CB-CG 4.28Å; D342-K345 PolarHBondContact O-N 3.15Å; D342-K345 PolarHBondContact OD1-N 2.87Å; D342-K345 WeakPolarHBondContact OD2-CD 3.33Å; D342-K345 VanDerWaalsContact OD2-CE 3.28Å; D342-K345 WeakPolarHBondContact OD2-CE 3.37Å; D342-K345 IonicContact OD2-NZ 3.84Å; K345-S347 VanDerWaalsContact C-N 3.32Å; K345-E348 PolarHBondContact O-N 2.86Å; K345-L349 WeakPolarHBondContact O-CG 3.43Å; K345-L349 PolarHBondContact O-N 3.12Å
346	L	82.8	Confident	74.1	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-35.6	175.3	178.5	143.2	0	0	0	111.6	I258 L262 L296 F297 I300 V341 D342 W343 L349 L350	I258-L346 HydrophobicContact CG2-CD2 4.47Å; L262-L346 HydrophobicContact CD1-CD2 3.23Å; L296-L346 HydrophobicContact CD2-CD1 4.19Å; F297-L346 HydrophobicContact CE1-CD1 4.37Å; I300-L346 HydrophobicContact CD1-CB 3.9Å; I300-L346 HydrophobicContact CD1-CD1 3.35Å; I300-L346 HydrophobicContact CD1-CG 4.09Å; I300-L346 HydrophobicContact CG2-CB 4.4Å; V341-L346 HydrophobicContact CG1-CB 4.35Å; V341-L346 HydrophobicContact CG1-CD1 4.15Å; D342-L346 PolarHBondContact O-N 3.06Å; W343-L346 PolarHBondContact O-N 3.32Å; L346-L349 PolarHBondContact O-N 3.14Å; L346-L350 HydrophobicContact CD2-CD1 3.47Å; L346-L350 VanDerWaalsContact CD2-CD1 3.47Å; L346-L350 HydrophobicContact CD2-CG 4.31Å; L346-L350 HydrophobicContact CG-CD1 4.03Å; L346-L350 HydrophobicContact CG-CG 4.44Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.19Å
347	S	75.9	Confident	72.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-37	176.4	70.4	0	0	0	0	112.2	W343 C344 K345 L350 N351 Y382	W343-S347 WeakPolarHBondContact O-CB 3.43Å; W343-S347 PolarHBondContact O-N 3.15Å; W343-S347 PolarHBondContact O-OG 3.47Å; C344-S347 WeakPolarHBondContact CA-OG 3.36Å; C344-S347 PolarHBondContact O-N 3.23Å; C344-S347 PolarHBondContact O-OG 2.95Å; K345-S347 VanDerWaalsContact C-N 3.32Å; S347-L350 PolarHBondContact O-N 3.45Å; S347-N351 WeakPolarHBondContact O-CB 3.29Å; S347-N351 PolarHBondContact O-N 2.92Å; S347-N351 VanDerWaalsContact O-N 3.09Å; S347-Y382 WeakPolarHBondContact CB-OH 3.35Å; S347-Y382 PolarHBondContact OG-OH 3.06Å
348	E	78.9	Confident	71.2	Confident	79 Å²	79	54 Å²	54	37%	0.369	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-43.4	171.4	-71.3	176.5	-172.7	0	0	111.7	F236 M240 H244 C344 K345	F236-E348 HydrophobicContact CZ-CB 4.3Å; M240-E348 HydrophobicContact CE-CB 3.81Å; H244-E348 PolarHBondContact NE2-O 3.46Å; C344-E348 WeakPolarHBondContact O-CG 3.49Å; C344-E348 PolarHBondContact O-N 2.78Å; K345-E348 PolarHBondContact O-N 2.86Å
349	L	80.4	Confident	69.4	Low	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.1	-37.1	179.9	-69.6	166	0	0	0	113.1	F236 M240 I243 H244 L296 I300 K345 L346	F236-L349 HydrophobicContact CD2-CD1 4.49Å; F236-L349 HydrophobicContact CD2-CD2 4.35Å; F236-L349 HydrophobicContact CE2-CD1 3.77Å; F236-L349 HydrophobicContact CE2-CD2 3.89Å; F236-L349 HydrophobicContact CE2-CG 3.77Å; F236-L349 HydrophobicContact CZ-CD1 4.45Å; F236-L349 HydrophobicContact CZ-CD2 4.11Å; F236-L349 HydrophobicContact CZ-CG 3.98Å; M240-L349 HydrophobicContact CB-CD2 4.11Å; M240-L349 HydrophobicContact CE-CB 4.45Å; M240-L349 HydrophobicContact CE-CD2 3.49Å; M240-L349 VanDerWaalsContact CE-CD2 3.49Å; M240-L349 HydrophobicContact CE-CG 3.86Å; M240-L349 VanDerWaalsContact SD-CA 3.57Å; M240-L349 HydrophobicContact SD-CB 4.47Å; M240-L349 HydrophobicContact SD-CD2 3.74Å; M240-L349 HydrophobicContact SD-CG 4.34Å; I243-L349 HydrophobicContact CD1-CB 4.41Å; I243-L349 HydrophobicContact CD1-CD2 3.79Å; I243-L349 HydrophobicContact CD1-CG 4.49Å; I243-L349 WeakPolarHBondContact CG2-O 3.44Å; H244-L349 PolarHBondContact CD2-O 3.24Å; H244-L349 PolarHBondContact NE2-O 3.41Å; L296-L349 HydrophobicContact CG-CD1 4.25Å; I300-L349 HydrophobicContact CG2-CD1 3.76Å; K345-L349 WeakPolarHBondContact O-CG 3.43Å; K345-L349 PolarHBondContact O-N 3.12Å; L346-L349 PolarHBondContact O-N 3.14Å
350	L	78.8	Confident	67.2	Low	1 Å²	1	57.6 Å²	57.6	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-82.9	-23.8	-177.7	-71.9	178.6	0	0	0	114	L247 I258 F281 V286 L346 S347 W352	L247-L350 HydrophobicContact CD1-CD2 4.16Å; I258-L350 HydrophobicContact CB-CD1 4.31Å; I258-L350 HydrophobicContact CD1-CD1 4.08Å; I258-L350 HydrophobicContact CG2-CD1 3.73Å; F281-L350 HydrophobicContact CE2-CD2 4.01Å; V286-L350 HydrophobicContact CG1-CD2 4.17Å; L346-L350 HydrophobicContact CD2-CD1 3.47Å; L346-L350 VanDerWaalsContact CD2-CD1 3.47Å; L346-L350 HydrophobicContact CD2-CG 4.31Å; L346-L350 HydrophobicContact CG-CD1 4.03Å; L346-L350 HydrophobicContact CG-CG 4.44Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.19Å; S347-L350 PolarHBondContact O-N 3.45Å; L350-W352 VanDerWaalsContact C-N 3.35Å; L350-W352 PolarHBondContact O-N 3.09Å
351	N	74.9	Confident	64.7	Low	22 Å²	22	61 Å²	61	12%	0.118	30%	0.297	C	S	.	.			trans	-88.4	68.1	-174	-163.4	0.6	0	0	0	112.9	I259 S347 N353 N354	I259-N351 HydrophobicContact CD1-CB 4.14Å; S347-N351 WeakPolarHBondContact O-CB 3.29Å; S347-N351 PolarHBondContact O-N 2.92Å; S347-N351 VanDerWaalsContact O-N 3.09Å; N351-N353 VanDerWaalsContact C-N 3.26Å; N351-N353 PolarHBondContact O-N 3.21Å; N351-N354 PolarHBondContact ND2-ND2 3.34Å
352	W	73.3	Confident	62.1	Low	35 Å²	35	67.3 Å²	67.3	13%	0.133	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-20.4	179	73.4	-90.2	0	0	0	113.9	H244 L247 R248 Y252 L350 N354	H244-W352 HydrophobicContact CB-CB 3.94Å; L247-W352 HydrophobicContact CB-CB 4.47Å; L247-W352 VanDerWaalsContact CB-CD1 3.47Å; L247-W352 HydrophobicContact CB-CG 4.01Å; R248-W352 HydrophobicContact CB-CD2 4.14Å; R248-W352 HydrophobicContact CB-CE3 3.79Å; R248-W352 HydrophobicContact CB-CH2 4.33Å; R248-W352 HydrophobicContact CB-CZ3 3.91Å; R248-W352 HydrophobicContact CG-CE3 3.99Å; R248-W352 HydrophobicContact CG-CH2 4.09Å; R248-W352 HydrophobicContact CG-CZ3 3.63Å; Y252-W352 PolarHBondContact O-NE1 3.25Å; L350-W352 VanDerWaalsContact C-N 3.35Å; L350-W352 PolarHBondContact O-N 3.09Å; W352-N354 PolarHBondContact O-N 3.01Å
353	N	66.1	Low	59.5	Low	78 Å²	78	70 Å²	70	42%	0.417	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.8	-179	-83.7	-20.1	0	0	0	113.2	N351 D355	N351-N353 VanDerWaalsContact C-N 3.26Å; N351-N353 PolarHBondContact O-N 3.21Å; N353-D355 PolarHBondContact O-N 2.77Å; N353-D355 VanDerWaalsContact O-N 3.12Å
354	N	60.6	Low	56.8	Low	86 Å²	86	72.8 Å²	72.8	46%	0.46	39%	0.394	S	S	.	.			trans	-84.9	87	177.4	-94.2	-15.8	0	0	0	111.4	N351 W352 K356 F357	N351-N354 PolarHBondContact ND2-ND2 3.34Å; W352-N354 PolarHBondContact O-N 3.01Å; N354-K356 PolarHBondContact O-N 3.23Å; N354-F357 PolarHBondContact O-N 3.13Å
355	D	50.8	Low	54.4	Low	89 Å²	89	78.5 Å²	78.5	48%	0.476	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-4.2	-178.2	-137.7	27.3	0	0	0	114.5	R248 N353	R248-D355 IonicContact NH2-OD1 3.72Å; N353-D355 PolarHBondContact O-N 2.77Å; N353-D355 VanDerWaalsContact O-N 3.12Å
356	K	50.4	Low	51.8	Low	171 Å²	171	81.2 Å²	81.2	74%	0.743	44%	0.437	S	S	*	.	H	α-helix	trans	-76.9	-29.3	179.9	-77.1	-175.6	179.4	177.6	0	113.7	N354 R359	N354-K356 PolarHBondContact O-N 3.23Å; K356-R359 PolarHBondContact O-N 3Å
357	F	41.3	Very low	49.1	Very low	113 Å²	113	87.8 Å²	87.8	50%	0.496	48%	0.478	S	S	.	.	H	α-helix	trans	-71	-35.5	-177.6	-116.8	-89.9	0	0	0	112.3	N354 R359 S360 C361	N354-F357 PolarHBondContact O-N 3.13Å; F357-R359 VanDerWaalsContact C-N 3.29Å; F357-R359 PolarHBondContact O-N 2.73Å; F357-S360 PolarHBondContact O-N 2.85Å; F357-C361 PolarHBondContact O-SG 3.47Å
358	M	38.4	Very low	46.8	Very low	122 Å²	122	95.7 Å²	95.7	60%	0.601	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-24.6	178.3	-82.6	-70.1	-138.1	0	0	114.1
359	R	38.1	Very low	44.4	Very low	213 Å²	213	95.6 Å²	95.6	80%	0.804	53%	0.531	S	S	*	.	H	α-helix	trans	-85.6	-14.1	179.2	-71.8	-174.9	-167.5	-167.1	3.6	114.3	K356 F357	K356-R359 PolarHBondContact O-N 3Å; F357-R359 VanDerWaalsContact C-N 3.29Å; F357-R359 PolarHBondContact O-N 2.73Å
360	S	35.2	Very low	41.8	Very low	55 Å²	55	100.1 Å²	100.1	39%	0.385	56%	0.562	S	S	.	*	H	α-helix	trans	-103.1	-12.1	-175.3	-176	0	0	0	0	114.2	F357 C362 S363	F357-S360 PolarHBondContact O-N 2.85Å; S360-C362 PolarHBondContact O-N 3.18Å; S360-C362 VanDerWaalsContact O-N 3.07Å; S360-S363 PolarHBondContact O-N 3.22Å
361	C	29.8	Very low	39.3	Very low	71 Å²	71	106.8 Å²	106.8	48%	0.48	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	9.5	-174.2	-71.3	0	0	0	0	115.5	F357	F357-C361 PolarHBondContact O-SG 3.47Å
362	C	28.1	Very low	37	Very low	135 Å²	135	110.6 Å²	110.6	91%	0.912	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	5.7	173.4	-68.1	0	0	0	0	114.6	S360	S360-C362 PolarHBondContact O-N 3.18Å; S360-C362 VanDerWaalsContact O-N 3.07Å
363	S	27.1	Very low	34.8	Very low	85 Å²	85	114.7 Å²	114.7	59%	0.594	66%	0.655	S	S	*	*	S	Bend	trans	-133.9	131.7	173.7	52.2	0	0	0	0	110.6	S360	S360-S363 PolarHBondContact O-N 3.22Å
364	G	24.7	Very low	32.9	Very low	74 Å²	74	117.2 Å²	117.2	76%	0.763	68%	0.679	S	S	*	*			trans	-56.8	133.7	-156.9	0	0	0	0	0	116.8	T366	G364-T366 PolarHBondContact O-N 3.42Å
365	F	27	Very low	31.3	Very low	155 Å²	155	117.8 Å²	117.8	68%	0.68	69%	0.69	S	S	*	*			trans	-80.8	92.4	157.7	-82.3	-84.8	0	0	0	108.3	T367	F365-T367 PolarHBondContact O-N 3.34Å
366	T	25.9	Very low	30.4	Very low	120 Å²	120	118.9 Å²	118.9	74%	0.736	70%	0.699	S	S	*	*			trans	-64.4	122.2	160.7	37.2	0	0	0	0	109.1	G364 I368	G364-T366 PolarHBondContact O-N 3.42Å; T366-I368 PolarHBondContact O-N 2.88Å
367	T	24.9	Very low	29.5	Very low	140 Å²	140	116.6 Å²	116.6	86%	0.859	70%	0.7	S	S	*	*			trans	-38.7	116	160.6	39.1	0	0	0	0	111.6	F365	F365-T367 PolarHBondContact O-N 3.34Å
368	I	29.2	Very low	29.1	Very low	166 Å²	166	118.4 Å²	118.4	85%	0.851	71%	0.71	S	S	*	*			trans	-95.5	108.2	159.9	-62.8	178	0	0	0	106.8	T366	T366-I368 PolarHBondContact O-N 2.88Å
369	A	26.7	Very low	29.1	Very low	77 Å²	77	115.5 Å²	115.5	64%	0.636	70%	0.7	S	S	*	*			trans	-60.3	150.1	170.8	0	0	0	0	0	111.2
370	S	26.4	Very low	29.1	Very low	94 Å²	94	113 Å²	113	66%	0.657	70%	0.698	S	S	*	*			trans	0.2	121.7	149	54.2	0	0	0	0	116.1
371	N	26.3	Very low	29.8	Very low	142 Å²	142	118.6 Å²	118.6	76%	0.759	71%	0.711	S	S	*	*				179	131.3	116.3	-83.1	-19.3	0	0	0	111.8
372	S	26.8	Very low	30.9	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	71%	0.705	S	S	*	*			trans	62.7	132	144.7	52.8	0	0	0	0	121
373	T	27	Very low	32.3	Very low	121 Å²	121	117.6 Å²	117.6	74%	0.742	68%	0.683	S	S	*	*			trans	76.7	98.2	148.9	51.1	0	0	0	0	118.9	S375	T373-S375 PolarHBondContact O-N 2.96Å
374	S	27.1	Very low	34	Very low	131 Å²	131	118.1 Å²	118.1	92%	0.916	68%	0.679	S	S	*	*				34.1	80.1	129.8	-50.9	0	0	0	0	117.2
375	S	27.2	Very low	35.8	Very low	99 Å²	99	116.7 Å²	116.7	69%	0.692	66%	0.656	S	S	*	*			trans	-155.8	121.4	146.3	52.2	0	0	0	0	108.6	T373 V377	T373-S375 PolarHBondContact O-N 2.96Å; S375-V377 PolarHBondContact O-N 3.16Å
376	V	30.4	Very low	37.6	Very low	111 Å²	111	113.9 Å²	113.9	67%	0.673	65%	0.645	S	S	*	*			trans	-65.5	105.2	173	174.9	0	0	0	0	106.4	Q378	V376-Q378 PolarHBondContact O-N 2.89Å; V376-Q378 VanDerWaalsContact O-N 3.07Å
377	V	31.7	Very low	39.7	Very low	124 Å²	124	112.7 Å²	112.7	75%	0.752	63%	0.634	S	S	*	*			trans	-68.3	105.1	176.7	179	0	0	0	0	107.4	S375 P379	S375-V377 PolarHBondContact O-N 3.16Å; V377-P379 WeakPolarHBondContact O-CD 3.45Å
378	Q	33.9	Very low	41.6	Very low	150 Å²	150	106.2 Å²	106.2	70%	0.701	59%	0.594	S	S	*	*			trans	-63.6	122.2	168.6	-71.1	-79.7	-12.2	0	0	108	V376 E380	V376-Q378 PolarHBondContact O-N 2.89Å; V376-Q378 VanDerWaalsContact O-N 3.07Å; Q378-E380 PolarHBondContact O-N 3.11Å; Q378-E380 VanDerWaalsContact O-N 3.08Å
379	P	38.6	Very low	43.3	Very low	61 Å²	61	105.2 Å²	105.2	40%	0.396	58%	0.579	S	S	.	*			trans	-73.3	104.7	174	26.7	-28.6	0	0	0	109.2	W343 V377 Y381 Y382	W343-P379 HydrophobicContact CH2-CG 4.25Å; V377-P379 WeakPolarHBondContact O-CD 3.45Å; P379-Y381 PolarHBondContact O-N 3.14Å; P379-Y382 HydrophobicContact CB-CD2 3.93Å; P379-Y382 HydrophobicContact CB-CE2 3.62Å; P379-Y382 HydrophobicContact CG-CD2 3.85Å; P379-Y382 HydrophobicContact CG-CE2 3.76Å
380	E	37.5	Very low	45.3	Very low	162 Å²	162	103.5 Å²	103.5	76%	0.757	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	16.5	-173.3	-70.7	-178.1	153.5	0	0	116.5	Q378	Q378-E380 PolarHBondContact O-N 3.11Å; Q378-E380 VanDerWaalsContact O-N 3.08Å
381	Y	48.7	Very low	47.5	Very low	171 Å²	171	103.2 Å²	103.2	67%	0.671	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.9	38.2	-165.4	-68.9	-79.8	0	0	0	116	P379	P379-Y381 PolarHBondContact O-N 3.14Å
382	Y	54.1	Low	49.3	Very low	87 Å²	87	98.8 Å²	98.8	34%	0.341	52%	0.524	S	S	.	.	S	Bend	trans	-119.9	146.7	172.7	-66.3	-69.1	0	0	0	111.7	I259 S347 P379 D384	I259-Y382 HydrophobicContact CB-CE1 4.47Å; I259-Y382 HydrophobicContact CD1-CE1 4.01Å; I259-Y382 HydrophobicContact CG2-CD1 3.66Å; I259-Y382 HydrophobicContact CG2-CE1 3.54Å; I259-Y382 HydrophobicContact CG2-CG 4.29Å; S347-Y382 WeakPolarHBondContact CB-OH 3.35Å; S347-Y382 PolarHBondContact OG-OH 3.06Å; P379-Y382 HydrophobicContact CB-CD2 3.93Å; P379-Y382 HydrophobicContact CB-CE2 3.62Å; P379-Y382 HydrophobicContact CG-CD2 3.85Å; P379-Y382 HydrophobicContact CG-CE2 3.76Å; Y382-D384 PolarHBondContact O-N 3.39Å
383	E	57	Low	51.2	Low	99 Å²	99	98.9 Å²	98.9	46%	0.463	51%	0.513	S	S	.	.			trans	-55.5	136.4	169.4	-78.8	-172.8	156.2	0	0	109.1	T385 V388 R391	E383-T385 PolarHBondContact O-N 3.22Å; E383-V388 HydrophobicContact CB-CG2 3.94Å; E383-R391 IonicContact OE1-NH1 3.85Å; E383-R391 PolarHBondContact OE1-NH1 2.98Å; E383-R391 IonicContact OE2-CZ 2.85Å; E383-R391 VanDerWaalsContact OE2-CZ 3.25Å; E383-R391 IonicContact OE2-NH1 3.83Å; E383-R391 PolarHBondContact OE2-NH1 3.26Å; E383-R391 IonicContact OE2-NH2 3.18Å; E383-R391 PolarHBondContact OE2-NH2 2.68Å
384	D	64	Low	53.3	Low	96 Å²	96	101 Å²	101	51%	0.513	51%	0.507	S	S	.	.			trans	-53.8	131.5	178	-170.6	7.4	0	0	0	110.2	Y382 E386 N387 V388	Y382-D384 PolarHBondContact O-N 3.39Å; D384-E386 PolarHBondContact O-N 3.12Å; D384-E386 VanDerWaalsContact O-N 3.11Å; D384-N387 HydrophobicContact CB-CB 4.45Å; D384-N387 WeakPolarHBondContact O-CA 3.25Å; D384-N387 WeakPolarHBondContact O-CB 3.47Å; D384-N387 PolarHBondContact O-N 3.25Å; D384-V388 PolarHBondContact O-N 3.01Å
385	T	60.9	Low	55.1	Low	44 Å²	44	97 Å²	97	27%	0.27	48%	0.483	S	S	.	.	H	α-helix	trans	-55.5	-33.8	-174.2	55.4	0	0	0	0	112.2	E383 V388 R389	E383-T385 PolarHBondContact O-N 3.22Å; T385-V388 PolarHBondContact O-N 2.92Å; T385-R389 WeakPolarHBondContact O-CB 3.46Å; T385-R389 PolarHBondContact O-N 3.43Å
386	E	65.6	Low	56.7	Low	95 Å²	95	96.2 Å²	96.2	44%	0.444	47%	0.469	S	S	.	.	H	α-helix	trans	-71.1	-30.7	177.1	-70.8	-59	148.8	0	0	113.2	D384 S390	D384-E386 PolarHBondContact O-N 3.12Å; D384-E386 VanDerWaalsContact O-N 3.11Å; E386-S390 VanDerWaalsContact O-CB 3.29Å; E386-S390 WeakPolarHBondContact O-CB 3.31Å; E386-S390 PolarHBondContact O-N 3.21Å; E386-S390 PolarHBondContact O-OG 2.88Å
387	N	70.5	Confident	58.2	Low	96 Å²	96	95.6 Å²	95.6	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-70.1	-42.8	174.6	-74.8	-30.2	0	0	0	111.2	D384 R389 S390 R391	D384-N387 HydrophobicContact CB-CB 4.45Å; D384-N387 WeakPolarHBondContact O-CA 3.25Å; D384-N387 WeakPolarHBondContact O-CB 3.47Å; D384-N387 PolarHBondContact O-N 3.25Å; N387-R389 VanDerWaalsContact C-N 3.35Å; N387-S390 PolarHBondContact O-N 2.8Å; N387-R391 WeakPolarHBondContact O-CB 3.07Å; N387-R391 PolarHBondContact O-N 3.27Å
388	V	64.8	Low	59.7	Low	3 Å²	3	91.9 Å²	91.9	2%	0.018	44%	0.442	C	S	.	.	H	α-helix	trans	-61.7	-45.9	174.2	177.6	0	0	0	0	110.2	E257 A260 E383 D384 T385 S390 R391 L392	E257-V388 HydrophobicContact CB-CG1 4.16Å; E257-V388 HydrophobicContact CG-CG1 4.05Å; A260-V388 HydrophobicContact CB-CB 4.15Å; A260-V388 HydrophobicContact CB-CG1 3.98Å; A260-V388 HydrophobicContact CB-CG2 4.08Å; E383-V388 HydrophobicContact CB-CG2 3.94Å; D384-V388 PolarHBondContact O-N 3.01Å; T385-V388 PolarHBondContact O-N 2.92Å; V388-S390 VanDerWaalsContact C-N 3.34Å; V388-S390 PolarHBondContact O-N 2.88Å; V388-R391 PolarHBondContact O-N 3.45Å; V388-R391 VanDerWaalsContact O-N 3.15Å; V388-L392 HydrophobicContact CG1-CD1 4.02Å; V388-L392 HydrophobicContact CG1-CG 4.44Å; V388-L392 WeakPolarHBondContact O-CG 3.06Å; V388-L392 PolarHBondContact O-N 2.98Å
389	R	63.6	Low	60.7	Low	145 Å²	145	89.2 Å²	89.2	55%	0.547	43%	0.432	S	S	.	.	H	α-helix	trans	-58.8	-44.7	176.4	-174.8	179.9	165.7	149.4	-0.2	112	T385 N387 R391 L392 Q393	T385-R389 WeakPolarHBondContact O-CB 3.46Å; T385-R389 PolarHBondContact O-N 3.43Å; N387-R389 VanDerWaalsContact C-N 3.35Å; R389-R391 VanDerWaalsContact C-N 3.31Å; R389-R391 PolarHBondContact O-N 3.47Å; R389-L392 PolarHBondContact O-N 3.46Å; R389-Q393 VanDerWaalsContact O-CB 3.27Å; R389-Q393 WeakPolarHBondContact O-CB 3.38Å; R389-Q393 PolarHBondContact O-N 3.22Å
390	S	70	Confident	61.4	Low	42 Å²	42	91.2 Å²	91.2	29%	0.294	44%	0.438	S	S	.	.	H	α-helix	trans	-64.9	-33.7	177.1	-64.6	0	0	0	0	112.9	E386 N387 V388 R394	E386-S390 VanDerWaalsContact O-CB 3.29Å; E386-S390 WeakPolarHBondContact O-CB 3.31Å; E386-S390 PolarHBondContact O-N 3.21Å; E386-S390 PolarHBondContact O-OG 2.88Å; N387-S390 PolarHBondContact O-N 2.8Å; V388-S390 VanDerWaalsContact C-N 3.34Å; V388-S390 PolarHBondContact O-N 2.88Å; S390-R394 WeakPolarHBondContact O-CB 3.47Å; S390-R394 PolarHBondContact O-N 3.4Å; S390-R394 VanDerWaalsContact O-N 3.11Å; S390-R394 PolarHBondContact O-NE 2.75Å
391	R	71	Confident	62.1	Low	88 Å²	88	91.2 Å²	91.2	33%	0.332	44%	0.438	S	S	.	.	H	α-helix	trans	-72.4	-46.3	176	-176.3	169	63.3	-131.4	-4.9	111.3	E257 E383 N387 V388 R389 Q393 R394 A395	E257-R391 IonicContact OE1-CZ 3.23Å; E257-R391 IonicContact OE1-NE 2.73Å; E257-R391 PolarHBondContact OE1-NE 3.47Å; E257-R391 IonicContact OE1-NH2 3.25Å; E383-R391 IonicContact OE1-NH1 3.85Å; E383-R391 PolarHBondContact OE1-NH1 2.98Å; E383-R391 IonicContact OE2-CZ 2.85Å; E383-R391 VanDerWaalsContact OE2-CZ 3.25Å; E383-R391 IonicContact OE2-NH1 3.83Å; E383-R391 PolarHBondContact OE2-NH1 3.26Å; E383-R391 IonicContact OE2-NH2 3.18Å; E383-R391 PolarHBondContact OE2-NH2 2.68Å; N387-R391 WeakPolarHBondContact O-CB 3.07Å; N387-R391 PolarHBondContact O-N 3.27Å; V388-R391 PolarHBondContact O-N 3.45Å; V388-R391 VanDerWaalsContact O-N 3.15Å; R389-R391 VanDerWaalsContact C-N 3.31Å; R389-R391 PolarHBondContact O-N 3.47Å; R391-Q393 VanDerWaalsContact C-N 3.34Å; R391-Q393 PolarHBondContact O-N 2.96Å; R391-R394 PolarHBondContact O-N 3.4Å; R391-A395 PolarHBondContact O-N 3.08Å
392	L	65.1	Low	62.1	Low	49 Å²	49	88.6 Å²	88.6	26%	0.257	43%	0.432	S	S	.	.	H	α-helix	trans	-60.6	-43.4	174.3	-73.2	171.5	0	0	0	111.2	V388 R389 R394 A395 I396	V388-L392 HydrophobicContact CG1-CD1 4.02Å; V388-L392 HydrophobicContact CG1-CG 4.44Å; V388-L392 WeakPolarHBondContact O-CG 3.06Å; V388-L392 PolarHBondContact O-N 2.98Å; R389-L392 PolarHBondContact O-N 3.46Å; L392-R394 PolarHBondContact O-N 2.91Å; L392-A395 PolarHBondContact O-N 3.25Å; L392-I396 WeakPolarHBondContact O-CB 3.33Å; L392-I396 VanDerWaalsContact O-CG1 3.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.44Å; L392-I396 PolarHBondContact O-N 3.29Å
393	Q	66.4	Low	61.7	Low	102 Å²	102	96.2 Å²	96.2	48%	0.477	46%	0.46	S	S	.	.	H	α-helix	trans	-59.3	-44.9	175.5	-176.1	176.7	-3.9	0	0	111.8	R389 R391 I396 Q397	R389-Q393 VanDerWaalsContact O-CB 3.27Å; R389-Q393 WeakPolarHBondContact O-CB 3.38Å; R389-Q393 PolarHBondContact O-N 3.22Å; R391-Q393 VanDerWaalsContact C-N 3.34Å; R391-Q393 PolarHBondContact O-N 2.96Å; Q393-I396 PolarHBondContact O-N 3.12Å; Q393-Q397 WeakPolarHBondContact O-CB 3.1Å; Q393-Q397 VanDerWaalsContact O-CG 3.29Å; Q393-Q397 WeakPolarHBondContact O-CG 3.36Å; Q393-Q397 PolarHBondContact O-N 3.38Å
394	R	71.2	Confident	61.4	Low	166 Å²	166	95 Å²	95	63%	0.626	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-41.3	175.3	-93.4	178.8	-83.9	164.3	-11	112.7	S390 R391 L392 Q397 A398	S390-R394 WeakPolarHBondContact O-CB 3.47Å; S390-R394 PolarHBondContact O-N 3.4Å; S390-R394 VanDerWaalsContact O-N 3.11Å; S390-R394 PolarHBondContact O-NE 2.75Å; R391-R394 PolarHBondContact O-N 3.4Å; L392-R394 PolarHBondContact O-N 2.91Å; R394-Q397 PolarHBondContact O-N 3.35Å; R394-A398 WeakPolarHBondContact O-CB 3.39Å; R394-A398 PolarHBondContact O-N 3.16Å
395	A	64.5	Low	61	Low	48 Å²	48	94.8 Å²	94.8	40%	0.397	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-41.6	177.2	0	0	0	0	0	111.8	R391 L392 A398 N399	R391-A395 PolarHBondContact O-N 3.08Å; L392-A395 PolarHBondContact O-N 3.25Å; A395-A398 PolarHBondContact O-N 3.21Å; A395-N399 WeakPolarHBondContact O-CB 3.21Å; A395-N399 PolarHBondContact O-N 3.34Å
396	I	61.4	Low	60.8	Low	81 Å²	81	98.2 Å²	98.2	42%	0.415	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-47.5	174.5	-68.2	164.4	0	0	0	110.2	L392 Q393 A398 N399 I400	L392-I396 WeakPolarHBondContact O-CB 3.33Å; L392-I396 VanDerWaalsContact O-CG1 3.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.44Å; L392-I396 PolarHBondContact O-N 3.29Å; Q393-I396 PolarHBondContact O-N 3.12Å; I396-A398 VanDerWaalsContact C-N 3.32Å; I396-A398 PolarHBondContact O-N 3.35Å; I396-N399 PolarHBondContact O-N 3.17Å; I396-N399 VanDerWaalsContact O-N 3.14Å; I396-I400 HydrophobicContact CG2-CD1 3.94Å; I396-I400 HydrophobicContact CG2-CG1 4.46Å; I396-I400 VanDerWaalsContact O-CG1 3.28Å; I396-I400 WeakPolarHBondContact O-CG1 3.41Å; I396-I400 PolarHBondContact O-N 3.43Å
397	Q	62	Low	60.2	Low	99 Å²	99	99.4 Å²	99.4	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-59.3	-40.9	176.4	-76.3	174.7	-23.2	0	0	112.4	Q393 R394 I400 H401	Q393-Q397 WeakPolarHBondContact O-CB 3.1Å; Q393-Q397 VanDerWaalsContact O-CG 3.29Å; Q393-Q397 WeakPolarHBondContact O-CG 3.36Å; Q393-Q397 PolarHBondContact O-N 3.38Å; R394-Q397 PolarHBondContact O-N 3.35Å; Q397-I400 PolarHBondContact O-N 3.4Å; Q397-H401 PolarHBondContact O-CD2 3.12Å; Q397-H401 VanDerWaalsContact O-CD2 3.26Å
398	A	62.7	Low	59.5	Low	46 Å²	46	97.1 Å²	97.1	38%	0.38	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-42.7	174.2	0	0	0	0	0	111.8	R394 A395 I396 I400 H401 H402	R394-A398 WeakPolarHBondContact O-CB 3.39Å; R394-A398 PolarHBondContact O-N 3.16Å; A395-A398 PolarHBondContact O-N 3.21Å; I396-A398 VanDerWaalsContact C-N 3.32Å; I396-A398 PolarHBondContact O-N 3.35Å; A398-I400 VanDerWaalsContact C-N 3.33Å; A398-I400 PolarHBondContact O-N 3.17Å; A398-H401 WeakPolarHBondContact O-CB 3.14Å; A398-H401 PolarHBondContact O-N 3.28Å; A398-H401 VanDerWaalsContact O-N 3.15Å; A398-H402 PolarHBondContact O-CD2 3.22Å; A398-H402 VanDerWaalsContact O-CD2 3.24Å; A398-H402 PolarHBondContact O-NE2 3.02Å
399	N	54.9	Low	59	Low	94 Å²	94	100.3 Å²	100.3	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-27.3	178.2	-78	-18.6	0	0	0	113.6	A395 I396 H401 H402	A395-N399 WeakPolarHBondContact O-CB 3.21Å; A395-N399 PolarHBondContact O-N 3.34Å; I396-N399 PolarHBondContact O-N 3.17Å; I396-N399 VanDerWaalsContact O-N 3.14Å; N399-H401 PolarHBondContact O-N 3.11Å; N399-H402 PolarHBondContact O-N 3.19Å; N399-H402 VanDerWaalsContact O-N 3.1Å
400	I	54.3	Low	58.4	Low	103 Å²	103	102.7 Å²	102.7	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-26.8	173	-70.6	163.9	0	0	0	111.3	I396 Q397 A398 H402	I396-I400 HydrophobicContact CG2-CD1 3.94Å; I396-I400 HydrophobicContact CG2-CG1 4.46Å; I396-I400 VanDerWaalsContact O-CG1 3.28Å; I396-I400 WeakPolarHBondContact O-CG1 3.41Å; I396-I400 PolarHBondContact O-N 3.43Å; Q397-I400 PolarHBondContact O-N 3.4Å; A398-I400 VanDerWaalsContact C-N 3.33Å; A398-I400 PolarHBondContact O-N 3.17Å; I400-H402 VanDerWaalsContact C-N 3.31Å
401	H	51.6	Low	57.6	Low	161 Å²	161	104.8 Å²	104.8	75%	0.745	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.6	175.4	-70.8	-62.9	0	0	0	114	Q397 A398 N399	Q397-H401 PolarHBondContact O-CD2 3.12Å; Q397-H401 VanDerWaalsContact O-CD2 3.26Å; A398-H401 WeakPolarHBondContact O-CB 3.14Å; A398-H401 PolarHBondContact O-N 3.28Å; A398-H401 VanDerWaalsContact O-N 3.15Å; N399-H401 PolarHBondContact O-N 3.11Å
402	H	48.9	Very low	56.8	Low	116 Å²	116	102.2 Å²	102.2	54%	0.537	53%	0.526	S	S	.	.	S	Bend	trans	-111	142.5	177.6	-53.2	-37.4	0	0	0	109.2	A398 N399 I400 T404	A398-H402 PolarHBondContact O-CD2 3.22Å; A398-H402 VanDerWaalsContact O-CD2 3.24Å; A398-H402 PolarHBondContact O-NE2 3.02Å; N399-H402 PolarHBondContact O-N 3.19Å; N399-H402 VanDerWaalsContact O-N 3.1Å; I400-H402 VanDerWaalsContact C-N 3.31Å; H402-T404 PolarHBondContact O-N 3.42Å
403	W	45.3	Very low	56.1	Low	248 Å²	248	102.3 Å²	102.3	94%	0.939	53%	0.527	S	S	*	.			trans	-61.5	109.1	-176.2	52.6	-81.9	0	0	0	109.8
404	T	51.6	Low	55.2	Low	72 Å²	72	101.6 Å²	101.6	44%	0.442	53%	0.526	S	S	.	.			trans	-113	141.1	173.2	43.9	0	0	0	0	107.7	H402	H402-T404 PolarHBondContact O-N 3.42Å
405	T	55.7	Low	54.1	Low	92 Å²	92	97.5 Å²	97.5	56%	0.564	52%	0.516	S	S	*	.			trans	-64.5	142.1	-177.9	60.6	0	0	0	0	110	N407 S408	T405-N407 PolarHBondContact O-N 2.83Å; T405-S408 PolarHBondContact N-OG 3.31Å; T405-S408 WeakPolarHBondContact O-CB 3.48Å; T405-S408 PolarHBondContact O-N 3.45Å; T405-S408 PolarHBondContact O-OG 3.07Å
406	T	54.9	Low	53.4	Low	116 Å²	116	97.8 Å²	97.8	71%	0.712	52%	0.524	S	S	*	.	H	α-helix	trans	-50.9	-26.8	178.5	-10.9	0	0	0	0	113.1	T409 Y410	T406-T409 WeakPolarHBondContact CA-OG1 3.35Å; T406-T409 PolarHBondContact O-OG1 2.89Å; T406-Y410 PolarHBondContact O-N 3.1Å
407	N	53.4	Low	52.9	Low	120 Å²	120	99.6 Å²	99.6	64%	0.642	53%	0.534	S	S	*	.	H	α-helix	trans	-71	-39.1	177.4	-138.8	8.7	0	0	0	112.6	T405 T409 Y410 T411	T405-N407 PolarHBondContact O-N 2.83Å; N407-T409 PolarHBondContact O-N 3Å; N407-Y410 PolarHBondContact O-N 3.17Å; N407-T411 PolarHBondContact O-N 2.92Å; N407-T411 PolarHBondContact O-OG1 3.28Å; N407-T411 VanDerWaalsContact O-OG1 3.09Å
408	S	56.1	Low	52.2	Low	48 Å²	48	98.3 Å²	98.3	34%	0.336	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-35.8	178.5	63.9	0	0	0	0	113.2	T405 T411 G412	T405-S408 PolarHBondContact N-OG 3.31Å; T405-S408 WeakPolarHBondContact O-CB 3.48Å; T405-S408 PolarHBondContact O-N 3.45Å; T405-S408 PolarHBondContact O-OG 3.07Å; S408-T411 WeakPolarHBondContact CA-OG1 3.33Å; S408-T411 PolarHBondContact O-OG1 3.04Å; S408-G412 PolarHBondContact O-N 3.32Å
409	T	54.2	Low	51.7	Low	71 Å²	71	101.3 Å²	101.3	44%	0.436	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-37.6	172.6	33.3	0	0	0	0	112.4	T406 N407 G412	T406-T409 WeakPolarHBondContact CA-OG1 3.35Å; T406-T409 PolarHBondContact O-OG1 2.89Å; N407-T409 PolarHBondContact O-N 3Å; T409-G412 PolarHBondContact O-N 2.92Å
410	Y	52	Low	51.7	Low	195 Å²	195	99.2 Å²	99.2	77%	0.765	53%	0.529	S	S	*	.	H	α-helix	trans	-66.9	-39.4	175.7	-111.1	-80.9	0	0	0	112.1	T406 N407 G412	T406-Y410 PolarHBondContact O-N 3.1Å; N407-Y410 PolarHBondContact O-N 3.17Å; Y410-G412 VanDerWaalsContact C-N 3.3Å; Y410-G412 PolarHBondContact O-N 2.83Å
411	T	53.5	Low	51.7	Low	85 Å²	85	102.4 Å²	102.4	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-74.7	-16.5	178.2	48.8	0	0	0	0	114.2	N407 S408 N413 L414	N407-T411 PolarHBondContact O-N 2.92Å; N407-T411 PolarHBondContact O-OG1 3.28Å; N407-T411 VanDerWaalsContact O-OG1 3.09Å; S408-T411 WeakPolarHBondContact CA-OG1 3.33Å; S408-T411 PolarHBondContact O-OG1 3.04Å; T411-N413 PolarHBondContact O-N 2.72Å; T411-N413 VanDerWaalsContact O-N 3.16Å; T411-L414 VanDerWaalsContact O-CD1 3.31Å; T411-L414 WeakPolarHBondContact O-CD1 3.43Å
412	G	52.3	Low	51.7	Low	35 Å²	35	101.4 Å²	101.4	36%	0.361	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.6	-179.3	0	0	0	0	0	114.3	S408 T409 Y410	S408-G412 PolarHBondContact O-N 3.32Å; T409-G412 PolarHBondContact O-N 2.92Å; Y410-G412 VanDerWaalsContact C-N 3.3Å; Y410-G412 PolarHBondContact O-N 2.83Å
413	N	50.3	Low	52.1	Low	51 Å²	51	102.1 Å²	102.1	27%	0.273	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	37.6	-178.1	-172.1	32.3	0	0	0	113.7	T411 N415 T420 W423	T411-N413 PolarHBondContact O-N 2.72Å; T411-N413 VanDerWaalsContact O-N 3.16Å; N413-N415 PolarHBondContact O-N 3.1Å; N413-T420 HydrophobicContact CB-CG2 4.23Å; N413-T420 WeakPolarHBondContact ND2-CG2 3.49Å; N413-W423 HydrophobicContact CB-CH2 3.58Å; N413-W423 HydrophobicContact CB-CZ2 4.21Å; N413-W423 HydrophobicContact CB-CZ3 4.2Å
414	L	47.6	Very low	52.6	Low	87 Å²	87	98.4 Å²	98.4	46%	0.455	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-60.3	126.4	162.5	-92.7	72.4	0	0	0	109	E327 T411 G416	E327-L414 HydrophobicContact CG-CD2 4.34Å; T411-L414 VanDerWaalsContact O-CD1 3.31Å; T411-L414 WeakPolarHBondContact O-CD1 3.43Å; L414-G416 VanDerWaalsContact C-N 3.35Å; L414-G416 PolarHBondContact O-N 3.12Å
415	N	48.3	Very low	53.1	Low	79 Å²	79	101.4 Å²	101.4	42%	0.422	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	62	24.8	166.8	-56.9	-20.3	0	0	0	117.2	R279 N319 N413 L417	R279-N415 PolarHBondContact NH1-ND2 2.94Å; N319-N415 PolarHBondContact ND2-OD1 2.92Å; N413-N415 PolarHBondContact O-N 3.1Å; N415-L417 VanDerWaalsContact C-N 3.25Å; N415-L417 PolarHBondContact O-N 3.36Å
416	G	50.8	Low	53.1	Low	54 Å²	54	104.7 Å²	104.7	56%	0.557	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	68.3	21	169.7	0	0	0	0	0	115	L414 I418	L414-G416 VanDerWaalsContact C-N 3.35Å; L414-G416 PolarHBondContact O-N 3.12Å; G416-I418 PolarHBondContact O-N 3.43Å
417	L	50	Low	53.5	Low	120 Å²	120	101.5 Å²	101.5	63%	0.628	55%	0.548	S	S	*	.	S	Bend	trans	-62.1	-18.1	174.4	-83.3	149.3	0	0	0	113	N415	N415-L417 VanDerWaalsContact C-N 3.25Å; N415-L417 PolarHBondContact O-N 3.36Å
418	I	48.8	Very low	53.9	Low	71 Å²	71	103.1 Å²	103.1	36%	0.364	55%	0.552	S	S	.	*	S	Bend	trans	-125.2	123.7	174.4	-56.3	173.4	0	0	0	107.5	G416 T420	G416-I418 PolarHBondContact O-N 3.43Å; I418-T420 WeakPolarHBondContact O-CG2 3.44Å; I418-T420 PolarHBondContact O-N 3.44Å
419	N	51.7	Low	54.7	Low	110 Å²	110	105.2 Å²	105.2	59%	0.588	56%	0.555	S	S	*	*			trans	-64.6	106.6	-180	-171.4	-8.7	0	0	0	110.6	H421	N419-H421 VanDerWaalsContact C-N 3.34Å; N419-H421 WeakPolarHBondContact OD1-CB 3.29Å; N419-H421 PolarHBondContact OD1-N 3.27Å; N419-H421 VanDerWaalsContact OD1-N 3.16Å
420	T	55.4	Low	55.9	Low	49 Å²	49	107.4 Å²	107.4	30%	0.301	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-84.9	-1.7	-176.8	58.5	0	0	0	0	114.4	N413 I418 N422 W423	N413-T420 HydrophobicContact CB-CG2 4.23Å; N413-T420 WeakPolarHBondContact ND2-CG2 3.49Å; I418-T420 WeakPolarHBondContact O-CG2 3.44Å; I418-T420 PolarHBondContact O-N 3.44Å; T420-N422 PolarHBondContact O-N 2.66Å; T420-N422 VanDerWaalsContact O-N 3.13Å; T420-W423 HydrophobicContact CG2-CD2 3.6Å; T420-W423 VanDerWaalsContact CG2-CE2 3.45Å; T420-W423 HydrophobicContact CG2-CE3 3.87Å; T420-W423 HydrophobicContact CG2-CG 4.22Å; T420-W423 HydrophobicContact CG2-CH2 3.98Å; T420-W423 HydrophobicContact CG2-CZ2 3.66Å; T420-W423 HydrophobicContact CG2-CZ3 4.06Å; T420-W423 WeakPolarHBondContact O-CB 3.45Å; T420-W423 PolarHBondContact O-N 3.2Å
421	H	53.1	Low	57.3	Low	171 Å²	171	101.3 Å²	101.3	79%	0.792	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-61.3	-20.5	173.3	-90.8	46.5	0	0	0	113	N419	N419-H421 VanDerWaalsContact C-N 3.34Å; N419-H421 WeakPolarHBondContact OD1-CB 3.29Å; N419-H421 PolarHBondContact OD1-N 3.27Å; N419-H421 VanDerWaalsContact OD1-N 3.16Å
422	N	51.3	Low	58.7	Low	140 Å²	140	98.1 Å²	98.1	75%	0.749	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-98.3	6.8	177.2	-63.3	-3.2	0	0	0	112.9	T420 E424	T420-N422 PolarHBondContact O-N 2.66Å; T420-N422 VanDerWaalsContact O-N 3.13Å; N422-E424 PolarHBondContact O-N 3.27Å
423	W	57.7	Low	59.9	Low	130 Å²	130	101.7 Å²	101.7	49%	0.492	54%	0.543	S	S	.	.			trans	-77.5	107.1	174.5	-69.8	12.3	0	0	0	108.2	N413 T420 I425	N413-W423 HydrophobicContact CB-CH2 3.58Å; N413-W423 HydrophobicContact CB-CZ2 4.21Å; N413-W423 HydrophobicContact CB-CZ3 4.2Å; T420-W423 HydrophobicContact CG2-CD2 3.6Å; T420-W423 VanDerWaalsContact CG2-CE2 3.45Å; T420-W423 HydrophobicContact CG2-CE3 3.87Å; T420-W423 HydrophobicContact CG2-CG 4.22Å; T420-W423 HydrophobicContact CG2-CH2 3.98Å; T420-W423 HydrophobicContact CG2-CZ2 3.66Å; T420-W423 HydrophobicContact CG2-CZ3 4.06Å; T420-W423 WeakPolarHBondContact O-CB 3.45Å; T420-W423 PolarHBondContact O-N 3.2Å; W423-I425 PolarHBondContact O-N 2.87Å
424	E	56.5	Low	61.3	Low	170 Å²	170	105 Å²	105	79%	0.794	56%	0.561	S	S	*	*			trans	-59.2	134.1	161.8	-73.1	-174.8	163.5	0	0	108.1	N422 L426	N422-E424 PolarHBondContact O-N 3.27Å; E424-L426 PolarHBondContact O-N 2.94Å
425	I	61	Low	62.9	Low	136 Å²	136	105 Å²	105	70%	0.697	56%	0.557	S	S	*	*			trans	-58.9	106.8	172.8	-62.2	170.5	0	0	0	106.6	W423 G427	W423-I425 PolarHBondContact O-N 2.87Å; I425-G427 PolarHBondContact O-N 3.35Å
426	L	57	Low	64.7	Low	161 Å²	161	109.2 Å²	109.2	84%	0.843	58%	0.579	S	S	*	*	S	Bend	trans	-73	78.7	176.8	-72.3	164.1	0	0	0	108.5	E424	E424-L426 PolarHBondContact O-N 2.94Å
427	G	62	Low	66.3	Low	48 Å²	48	109 Å²	109	50%	0.495	57%	0.567	S	S	.	*	S	Bend	trans	-172.5	148.7	-180	0	0	0	0	0	110.4	I425 K429	I425-G427 PolarHBondContact O-N 3.35Å; G427-K429 PolarHBondContact O-N 2.98Å; G427-K429 VanDerWaalsContact O-N 3.08Å
428	E	62.9	Low	68.1	Low	154 Å²	154	105.4 Å²	105.4	72%	0.72	55%	0.55	S	S	*	*			trans	-69.6	108.9	175.2	-165.9	167	-158.7	0	0	109	S430 K435	E428-S430 PolarHBondContact O-N 3.38Å; E428-K435 IonicContact OE1-NZ 3.62Å; E428-K435 PolarHBondContact OE1-NZ 2.99Å
429	K	71.6	Confident	69.9	Low	92 Å²	92	111.7 Å²	111.7	40%	0.4	58%	0.575	S	S	.	*			trans	-60.3	134.5	173	-62.6	174.2	-173.6	164.2	0	108.6	G427 L431 Q432 D434	G427-K429 PolarHBondContact O-N 2.98Å; G427-K429 VanDerWaalsContact O-N 3.08Å; K429-L431 VanDerWaalsContact CB-O 3.28Å; K429-L431 WeakPolarHBondContact CB-O 3.4Å; K429-L431 PolarHBondContact O-N 3.45Å; K429-Q432 PolarHBondContact O-NE2 3.3Å; K429-D434 IonicContact NZ-OD1 2.96Å; K429-D434 IonicContact NZ-OD2 3.32Å; K429-D434 PolarHBondContact NZ-OD2 3.39Å
430	S	79.1	Confident	71.6	Confident	118 Å²	118	115.4 Å²	115.4	83%	0.825	59%	0.586	S	S	*	*	S	Bend	trans	-59	-32.2	174.6	52.3	0	0	0	0	112.1	E428	E428-S430 PolarHBondContact O-N 3.38Å
431	L	81.7	Confident	73	Confident	67 Å²	67	117.7 Å²	117.7	35%	0.351	59%	0.589	S	S	.	*	B	Isolated β-bridge	trans	-104.7	115.6	172.8	-179.2	67.7	0	0	0	109.8	K429 L433 H448	K429-L431 VanDerWaalsContact CB-O 3.28Å; K429-L431 WeakPolarHBondContact CB-O 3.4Å; K429-L431 PolarHBondContact O-N 3.45Å; L431-L433 HydrophobicContact CD1-CD2 4.38Å; L431-L433 HydrophobicContact CD2-CD1 3.94Å; L431-L433 HydrophobicContact CD2-CD2 4.01Å; L431-L433 HydrophobicContact CD2-CG 3.81Å; L431-L433 HydrophobicContact CG-CD2 4.1Å; L431-L433 HydrophobicContact CG-CG 3.88Å; L431-L433 PolarHBondContact O-N 3.14Å; L431-H448 WeakPolarHBondContact CD1-ND1 3.47Å
432	Q	83.2	Confident	74.8	Confident	17 Å²	17	118.8 Å²	118.8	8%	0.079	59%	0.587	C	S	.	*			trans	-96.8	62.4	-173.3	-69	-73.3	-38.6	0	0	111.9	K429 D434 K435 T447 H448	K429-Q432 PolarHBondContact O-NE2 3.3Å; Q432-D434 PolarHBondContact O-N 3.07Å; Q432-K435 HydrophobicContact CB-CB 4.27Å; Q432-K435 HydrophobicContact CB-CD 4.02Å; Q432-K435 HydrophobicContact CB-CG 4.26Å; Q432-K435 HydrophobicContact CG-CD 4.17Å; Q432-K435 PolarHBondContact O-N 3.09Å; Q432-K435 VanDerWaalsContact OE1-CD 3.32Å; Q432-T447 HydrophobicContact CB-CG2 4.03Å; Q432-T447 HydrophobicContact CG-CG2 3.74Å; Q432-H448 PolarHBondContact N-O 3.45Å
433	L	78.6	Confident	76.5	Confident	110 Å²	110	118.1 Å²	118.1	58%	0.576	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-25	178.1	-66.6	176.9	0	0	0	113.2	L431 K435	L431-L433 HydrophobicContact CD1-CD2 4.38Å; L431-L433 HydrophobicContact CD2-CD1 3.94Å; L431-L433 HydrophobicContact CD2-CD2 4.01Å; L431-L433 HydrophobicContact CD2-CG 3.81Å; L431-L433 HydrophobicContact CG-CD2 4.1Å; L431-L433 HydrophobicContact CG-CG 3.88Å; L431-L433 PolarHBondContact O-N 3.14Å; L433-K435 VanDerWaalsContact C-N 3.27Å; L433-K435 PolarHBondContact O-N 3.49Å
434	D	78	Confident	78.2	Confident	120 Å²	120	116.5 Å²	116.5	64%	0.642	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-15.3	-177	-48.4	-28.4	0	0	0	111.6	K429 Q432	K429-D434 IonicContact NZ-OD1 2.96Å; K429-D434 IonicContact NZ-OD2 3.32Å; K429-D434 PolarHBondContact NZ-OD2 3.39Å; Q432-D434 PolarHBondContact O-N 3.07Å
435	K	82.9	Confident	79.7	Confident	89 Å²	89	110 Å²	110	39%	0.387	57%	0.568	S	S	.	*	S	Bend	trans	-94.1	133.5	177.9	-67.9	-178.9	-178.3	162.5	0	110.1	E428 Q432 L433 Y449	E428-K435 IonicContact OE1-NZ 3.62Å; E428-K435 PolarHBondContact OE1-NZ 2.99Å; Q432-K435 HydrophobicContact CB-CB 4.27Å; Q432-K435 HydrophobicContact CB-CD 4.02Å; Q432-K435 HydrophobicContact CB-CG 4.26Å; Q432-K435 HydrophobicContact CG-CD 4.17Å; Q432-K435 PolarHBondContact O-N 3.09Å; Q432-K435 VanDerWaalsContact OE1-CD 3.32Å; L433-K435 VanDerWaalsContact C-N 3.27Å; L433-K435 PolarHBondContact O-N 3.49Å; K435-Y449 HydrophobicContact CB-CD1 3.85Å; K435-Y449 HydrophobicContact CB-CE1 3.85Å; K435-Y449 HydrophobicContact CD-CE1 4.31Å
436	L	84.3	Confident	81	Confident	166 Å²	166	111.8 Å²	111.8	87%	0.869	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-65.9	136.9	170.9	-68.3	169.2	0	0	0	110.3
437	V	85.6	Confident	82.5	Confident	51 Å²	51	105.9 Å²	105.9	31%	0.309	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-61.9	127.1	174.4	-178	0	0	0	0	109.3	K439 Y449 D451	V437-K439 PolarHBondContact O-N 3.39Å; V437-Y449 HydrophobicContact CG2-CG 4.42Å; V437-D451 HydrophobicContact CG1-CB 4.5Å; V437-D451 WeakPolarHBondContact CG1-OD2 3.2Å; V437-D451 HydrophobicContact CG2-CB 3.89Å
438	P	87.4	Confident	83.8	Confident	43 Å²	43	107 Å²	107	28%	0.279	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-59.7	134.6	177.1	-22.8	32.3	0	0	0	111.8	F440 Y449	P438-F440 PolarHBondContact O-N 3.45Å; P438-Y449 VanDerWaalsContact CD-CZ 3.49Å; P438-Y449 HydrophobicContact CG-CE1 4.35Å; P438-Y449 HydrophobicContact CG-CE2 3.92Å
439	K	86.2	Confident	85	Confident	204 Å²	204	101.1 Å²	101.1	89%	0.887	51%	0.507	S	S	*	.	S	Bend	trans	-57.7	-36.4	174.1	-69	-174.5	178.9	-177.9	0	112.5	V437	V437-K439 PolarHBondContact O-N 3.39Å
440	F	87.2	Confident	85.5	Confident	188 Å²	188	98.3 Å²	98.3	83%	0.825	51%	0.505	S	S	*	.	S	Bend	trans	-124.6	109.9	174.2	-60.1	-75.3	0	0	0	108.3	P438	P438-F440 PolarHBondContact O-N 3.45Å
441	R	85.7	Confident	85.6	Confident	96 Å²	96	93.9 Å²	93.9	36%	0.362	47%	0.472	S	S	.	.			trans	-79.6	135.6	178.9	-167.2	-179.2	-86	-161.5	-5.4	110	D445 D451 E452	R441-D445 HydrophobicContact CG-CB 3.87Å; R441-D451 IonicContact CZ-OD1 2.77Å; R441-D451 IonicContact CZ-OD2 3.02Å; R441-D451 IonicContact NH2-OD1 3.71Å; R441-D451 PolarHBondContact NH2-OD1 3.38Å; R441-D451 IonicContact NH2-OD2 2.82Å; R441-D451 PolarHBondContact NH2-OD2 2.95Å; R441-E452 IonicContact CZ-OE1 2.72Å; R441-E452 IonicContact NH1-OE1 3.74Å; R441-E452 PolarHBondContact NH1-OE1 3.45Å; R441-E452 IonicContact NH2-OE1 3.74Å
442	R	89.7	Confident	85.5	Confident	195 Å²	195	95.2 Å²	95.2	74%	0.736	48%	0.476	S	S	*	.			trans	-77.3	150.5	174.4	-63	-178.8	-180	-176.6	0.4	109.5	T444 D445	R442-T444 PolarHBondContact O-N 3.23Å; R442-D445 HydrophobicContact CB-CB 4.28Å; R442-D445 WeakPolarHBondContact O-CB 3.27Å; R442-D445 PolarHBondContact O-N 3.46Å; R442-D445 VanDerWaalsContact O-N 3.11Å
443	S	88.7	Confident	85.4	Confident	125 Å²	125	96 Å²	96	87%	0.874	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.2	173.3	53.6	0	0	0	0	113.4
444	T	91.8	Very high	85.6	Confident	96 Å²	96	93.2 Å²	93.2	59%	0.589	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	9.9	178.3	64.1	0	0	0	0	113.1	R442 H446	R442-T444 PolarHBondContact O-N 3.23Å; T444-H446 PolarHBondContact O-CD2 3.3Å; T444-H446 PolarHBondContact O-N 3.46Å
445	D	89.5	Confident	86	Confident	33 Å²	33	92.9 Å²	92.9	18%	0.176	49%	0.485	C	S	.	.			trans	-82.5	110.8	178.1	-168.1	-1.8	0	0	0	109.7	R441 R442 T447 Y449	R441-D445 HydrophobicContact CG-CB 3.87Å; R442-D445 HydrophobicContact CB-CB 4.28Å; R442-D445 WeakPolarHBondContact O-CB 3.27Å; R442-D445 PolarHBondContact O-N 3.46Å; R442-D445 VanDerWaalsContact O-N 3.11Å; D445-T447 VanDerWaalsContact OD1-CB 3.26Å; D445-T447 WeakPolarHBondContact OD1-CB 3.35Å; D445-T447 PolarHBondContact OD1-N 2.96Å; D445-T447 PolarHBondContact OD1-OG1 2.91Å; D445-Y449 WeakPolarHBondContact OD2-CE2 3.49Å; D445-Y449 PolarHBondContact OD2-OH 2.96Å
446	H	88	Confident	86.2	Confident	174 Å²	174	91.2 Å²	91.2	81%	0.806	49%	0.494	S	S	*	.			trans	-100.2	5.1	179.2	-58.1	-58.8	0	0	0	112.3	T444 H448	T444-H446 PolarHBondContact O-CD2 3.3Å; T444-H446 PolarHBondContact O-N 3.46Å; H446-H448 PolarHBondContact O-N 3.38Å
447	T	88.4	Confident	86.1	Confident	38 Å²	38	85 Å²	85	23%	0.233	46%	0.464	C	S	.	.			trans	-78.2	123.6	-175.2	-40.5	0	0	0	0	110	Q432 D445 Y449	Q432-T447 HydrophobicContact CB-CG2 4.03Å; Q432-T447 HydrophobicContact CG-CG2 3.74Å; D445-T447 VanDerWaalsContact OD1-CB 3.26Å; D445-T447 WeakPolarHBondContact OD1-CB 3.35Å; D445-T447 PolarHBondContact OD1-N 2.96Å; D445-T447 PolarHBondContact OD1-OG1 2.91Å; T447-Y449 HydrophobicContact CG2-CD1 4.44Å; T447-Y449 HydrophobicContact CG2-CE1 4.04Å; T447-Y449 HydrophobicContact CG2-CE2 4.24Å; T447-Y449 WeakPolarHBondContact O-CD2 3.44Å; T447-Y449 WeakPolarHBondContact O-CE2 3.41Å; T447-Y449 PolarHBondContact O-N 2.82Å
448	H	88.9	Confident	86	Confident	70 Å²	70	88.4 Å²	88.4	32%	0.324	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-86.3	99.1	175.1	-169.4	-70.2	0	0	0	110.3	L431 Q432 H446 G450 E452	L431-H448 WeakPolarHBondContact CD1-ND1 3.47Å; Q432-H448 PolarHBondContact N-O 3.45Å; H446-H448 PolarHBondContact O-N 3.38Å; H448-G450 PolarHBondContact ND1-N 3.12Å; H448-G450 PolarHBondContact O-N 3.25Å; H448-E452 IonicContact CD2-OE2 3.58Å; H448-E452 PolarHBondContact CD2-OE2 3.43Å; H448-E452 IonicContact NE2-OE2 3.86Å
449	Y	88.2	Confident	86.3	Confident	31 Å²	31	93.3 Å²	93.3	12%	0.122	50%	0.5	C	S	.	.			trans	-78.9	-2.2	-179.3	-61.2	-84.2	0	0	0	114	K435 V437 P438 D445 T447 D451	K435-Y449 HydrophobicContact CB-CD1 3.85Å; K435-Y449 HydrophobicContact CB-CE1 3.85Å; K435-Y449 HydrophobicContact CD-CE1 4.31Å; V437-Y449 HydrophobicContact CG2-CG 4.42Å; P438-Y449 VanDerWaalsContact CD-CZ 3.49Å; P438-Y449 HydrophobicContact CG-CE1 4.35Å; P438-Y449 HydrophobicContact CG-CE2 3.92Å; D445-Y449 WeakPolarHBondContact OD2-CE2 3.49Å; D445-Y449 PolarHBondContact OD2-OH 2.96Å; T447-Y449 HydrophobicContact CG2-CD1 4.44Å; T447-Y449 HydrophobicContact CG2-CE1 4.04Å; T447-Y449 HydrophobicContact CG2-CE2 4.24Å; T447-Y449 WeakPolarHBondContact O-CD2 3.44Å; T447-Y449 WeakPolarHBondContact O-CE2 3.41Å; T447-Y449 PolarHBondContact O-N 2.82Å; Y449-D451 VanDerWaalsContact C-N 3.33Å
450	G	81.9	Confident	86.4	Confident	34 Å²	34	88 Å²	88	35%	0.351	49%	0.489	S	S	.	.	S	Bend	trans	81.7	13.7	-175.6	0	0	0	0	0	114.1	H448	H448-G450 PolarHBondContact ND1-N 3.12Å; H448-G450 PolarHBondContact O-N 3.25Å
451	D	81.2	Confident	86.4	Confident	25 Å²	25	82.7 Å²	82.7	13%	0.134	47%	0.473	C	S	.	.			trans	-92.7	-9	173.9	59.8	-26.3	0	0	0	113.8	V437 R441 Y449	V437-D451 HydrophobicContact CG1-CB 4.5Å; V437-D451 WeakPolarHBondContact CG1-OD2 3.2Å; V437-D451 HydrophobicContact CG2-CB 3.89Å; R441-D451 IonicContact CZ-OD1 2.77Å; R441-D451 IonicContact CZ-OD2 3.02Å; R441-D451 IonicContact NH2-OD1 3.71Å; R441-D451 PolarHBondContact NH2-OD1 3.38Å; R441-D451 IonicContact NH2-OD2 2.82Å; R441-D451 PolarHBondContact NH2-OD2 2.95Å; Y449-D451 VanDerWaalsContact C-N 3.33Å
452	E	80.5	Confident	86.4	Confident	94 Å²	94	79.9 Å²	79.9	44%	0.439	47%	0.468	S	S	.	.	S	Bend	trans	-83	149.5	-179.1	-57.7	-175	173.7	0	0	112.2	R441 H448	R441-E452 IonicContact CZ-OE1 2.72Å; R441-E452 IonicContact NH1-OE1 3.74Å; R441-E452 PolarHBondContact NH1-OE1 3.45Å; R441-E452 IonicContact NH2-OE1 3.74Å; H448-E452 IonicContact CD2-OE2 3.58Å; H448-E452 PolarHBondContact CD2-OE2 3.43Å; H448-E452 IonicContact NE2-OE2 3.86Å
453	A	80.7	Confident	86.4	Confident	35 Å²	35	76.7 Å²	76.7	29%	0.289	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-77.3	145.9	176.8	0	0	0	0	0	110.9
454	G	82.6	Confident	86.4	Confident	50 Å²	50	74.4 Å²	74.4	52%	0.515	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-62.6	157.2	174.7	0	0	0	0	0	112.2	G456 S457 I458	G454-G456 PolarHBondContact O-N 3.04Å; G454-G456 VanDerWaalsContact O-N 3.07Å; G454-S457 WeakPolarHBondContact O-CB 3.48Å; G454-S457 PolarHBondContact O-N 2.83Å; G454-I458 PolarHBondContact O-N 3.39Å
455	V	87.2	Confident	86.2	Confident	113 Å²	113	72.2 Å²	72.2	69%	0.685	43%	0.426	S	S	*	.	H	α-helix	trans	-50.5	-39.1	-177.2	177	0	0	0	0	112.8	S457 I458 M459	V455-S457 VanDerWaalsContact C-N 3.3Å; V455-S457 PolarHBondContact O-N 3.14Å; V455-I458 PolarHBondContact O-N 3.08Å; V455-I458 VanDerWaalsContact O-N 3.1Å; V455-M459 HydrophobicContact CG1-CG 4.15Å; V455-M459 WeakPolarHBondContact O-CG 3.4Å; V455-M459 PolarHBondContact O-N 3.26Å
456	G	86.3	Confident	86.1	Confident	55 Å²	55	77 Å²	77	57%	0.567	45%	0.451	S	S	*	.	H	α-helix	trans	-60.8	-35.2	178.4	0	0	0	0	0	113.9	G454 I458 S460	G454-G456 PolarHBondContact O-N 3.04Å; G454-G456 VanDerWaalsContact O-N 3.07Å; G456-I458 VanDerWaalsContact C-N 3.33Å; G456-S460 PolarHBondContact O-N 3.38Å; G456-S460 VanDerWaalsContact O-N 3.11Å
457	S	82.4	Confident	86.2	Confident	35 Å²	35	77.6 Å²	77.6	25%	0.245	45%	0.448	C	S	.	.	H	α-helix	trans	-74.3	-24.1	176.4	-58.7	0	0	0	0	112.9	G454 V455 S460 P461 N471	G454-S457 WeakPolarHBondContact O-CB 3.48Å; G454-S457 PolarHBondContact O-N 2.83Å; V455-S457 VanDerWaalsContact C-N 3.3Å; V455-S457 PolarHBondContact O-N 3.14Å; S457-S460 CarbonylContact O-C 3.21Å; S457-P461 VanDerWaalsContact O-CA 3.3Å; S457-P461 WeakPolarHBondContact O-CA 3.39Å; S457-N471 PolarHBondContact OG-ND2 2.82Å
458	I	84.5	Confident	86.1	Confident	122 Å²	122	78.6 Å²	78.6	63%	0.626	47%	0.466	S	S	*	.	H	α-helix	trans	-79.8	-42.4	176.6	-60.4	172.3	0	0	0	110.3	G454 V455 G456 S460	G454-I458 PolarHBondContact O-N 3.39Å; V455-I458 PolarHBondContact O-N 3.08Å; V455-I458 VanDerWaalsContact O-N 3.1Å; G456-I458 VanDerWaalsContact C-N 3.33Å; I458-S460 VanDerWaalsContact C-N 3.29Å; I458-S460 PolarHBondContact O-N 3.24Å
459	M	92.4	Very high	86	Confident	147 Å²	147	78.8 Å²	78.8	72%	0.724	47%	0.469	S	S	*	.	H	α-helix	trans	-67.1	-33.5	178	-69.7	-62.4	-63.4	0	0	112.3	V455	V455-M459 HydrophobicContact CG1-CG 4.15Å; V455-M459 WeakPolarHBondContact O-CG 3.4Å; V455-M459 PolarHBondContact O-N 3.26Å
460	S	89	Confident	85.7	Confident	93 Å²	93	80.4 Å²	80.4	65%	0.65	48%	0.479	S	S	*	.	S	Bend	trans	-129.9	77	-179.6	-59.9	0	0	0	0	109.5	G456 S457 I458	G456-S460 PolarHBondContact O-N 3.38Å; G456-S460 VanDerWaalsContact O-N 3.11Å; S457-S460 CarbonylContact O-C 3.21Å; I458-S460 VanDerWaalsContact C-N 3.29Å; I458-S460 PolarHBondContact O-N 3.24Å
461	P	87.5	Confident	85.7	Confident	76 Å²	76	82 Å²	82	49%	0.494	48%	0.479	S	S	.	.			trans	-62.7	145.3	-178.6	26.5	-33.6	0	0	0	111	S457 T465	S457-P461 VanDerWaalsContact O-CA 3.3Å; S457-P461 WeakPolarHBondContact O-CA 3.39Å; P461-T465 HydrophobicContact CB-CG2 4.16Å
462	S	85.4	Confident	85.7	Confident	36 Å²	36	87.2 Å²	87.2	25%	0.252	50%	0.498	S	S	.	.			trans	-82.5	160.8	172.9	75.2	0	0	0	0	110	F464 T465	S462-F464 PolarHBondContact O-N 2.88Å; S462-F464 WeakPolarHBondContact OG-CB 3.28Å; S462-F464 PolarHBondContact OG-N 3.38Å; S462-T465 PolarHBondContact N-OG1 3.03Å; S462-T465 VanDerWaalsContact O-CB 3.22Å; S462-T465 WeakPolarHBondContact O-CB 3.2Å; S462-T465 PolarHBondContact O-N 3.22Å; S462-T465 PolarHBondContact O-OG1 2.8Å; S462-T465 PolarHBondContact OG-N 3.05Å; S462-T465 PolarHBondContact OG-OG1 3.28Å; S462-T465 VanDerWaalsContact OG-OG1 3.12Å
463	I	90.3	Very high	86	Confident	128 Å²	128	85.4 Å²	85.4	66%	0.656	49%	0.491	S	S	*	.	H	α-helix	trans	-55.4	-28.9	173.5	-60.3	165.1	0	0	0	111.1	T465 D466 Y467	I463-T465 VanDerWaalsContact C-N 3.28Å; I463-T465 PolarHBondContact O-N 3.43Å; I463-D466 PolarHBondContact O-N 3.42Å; I463-Y467 HydrophobicContact CG2-CE2 4.1Å; I463-Y467 VanDerWaalsContact O-CD2 3.22Å; I463-Y467 WeakPolarHBondContact O-CD2 3.43Å
464	F	88	Confident	86.3	Confident	77 Å²	77	84.2 Å²	84.2	34%	0.338	48%	0.48	S	S	.	.	H	α-helix	trans	-68.2	-27.5	177.5	-52.2	-65.1	0	0	0	113	S462 D466 Y467 G468 L469 L474	S462-F464 PolarHBondContact O-N 2.88Å; S462-F464 WeakPolarHBondContact OG-CB 3.28Å; S462-F464 PolarHBondContact OG-N 3.38Å; F464-D466 VanDerWaalsContact C-N 3.28Å; F464-D466 PolarHBondContact O-N 3.11Å; F464-Y467 CarbonylContact O-C 3.59Å; F464-Y467 PolarHBondContact O-N 2.68Å; F464-G468 PolarHBondContact O-N 2.87Å; F464-L469 CarbonylContact C-O 3.56Å; F464-L469 HydrophobicContact CB-CB 3.95Å; F464-L469 HydrophobicContact CB-CD1 4.47Å; F464-L469 WeakPolarHBondContact O-CB 3.41Å; F464-L469 PolarHBondContact O-N 2.91Å; F464-L474 HydrophobicContact CD2-CD1 4.07Å; F464-L474 HydrophobicContact CE2-CD1 4.38Å
465	T	87.5	Confident	86.6	Confident	51 Å²	51	85.5 Å²	85.5	31%	0.313	47%	0.474	S	S	.	.	H	α-helix	trans	-67.1	-32.2	-179.3	-48.7	0	0	0	0	111.3	P461 S462 I463 Y467 G468 L469	P461-T465 HydrophobicContact CB-CG2 4.16Å; S462-T465 PolarHBondContact N-OG1 3.03Å; S462-T465 VanDerWaalsContact O-CB 3.22Å; S462-T465 WeakPolarHBondContact O-CB 3.2Å; S462-T465 PolarHBondContact O-N 3.22Å; S462-T465 PolarHBondContact O-OG1 2.8Å; S462-T465 PolarHBondContact OG-N 3.05Å; S462-T465 PolarHBondContact OG-OG1 3.28Å; S462-T465 VanDerWaalsContact OG-OG1 3.12Å; I463-T465 VanDerWaalsContact C-N 3.28Å; I463-T465 PolarHBondContact O-N 3.43Å; T465-Y467 PolarHBondContact O-N 2.89Å; T465-G468 PolarHBondContact O-N 3.45Å; T465-L469 WeakPolarHBondContact CA-O 3.45Å; T465-L469 PolarHBondContact N-O 3.31Å
466	D	87.9	Confident	86.6	Confident	134 Å²	134	82.5 Å²	82.5	72%	0.717	46%	0.456	S	S	*	.	H	α-helix	trans	-64.7	-26.5	173.4	-67.9	-15.6	0	0	0	112.5	I463 F464 G468	I463-D466 PolarHBondContact O-N 3.42Å; F464-D466 VanDerWaalsContact C-N 3.28Å; F464-D466 PolarHBondContact O-N 3.11Å; D466-G468 VanDerWaalsContact C-N 3.31Å
467	Y	89.8	Confident	86.7	Confident	186 Å²	186	82.8 Å²	82.8	73%	0.729	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	7.1	174.3	-62.4	-79.1	0	0	0	113	I463 F464 T465 L469	I463-Y467 HydrophobicContact CG2-CE2 4.1Å; I463-Y467 VanDerWaalsContact O-CD2 3.22Å; I463-Y467 WeakPolarHBondContact O-CD2 3.43Å; F464-Y467 CarbonylContact O-C 3.59Å; F464-Y467 PolarHBondContact O-N 2.68Å; T465-Y467 PolarHBondContact O-N 2.89Å; Y467-L469 VanDerWaalsContact C-N 3.34Å
468	G	85.8	Confident	87.1	Confident	59 Å²	59	84.5 Å²	84.5	61%	0.608	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	16.8	-179	0	0	0	0	0	114.5	F464 T465 D466	F464-G468 PolarHBondContact O-N 2.87Å; T465-G468 PolarHBondContact O-N 3.45Å; D466-G468 VanDerWaalsContact C-N 3.31Å
469	L	87.8	Confident	87.4	Confident	74 Å²	74	81.8 Å²	81.8	39%	0.387	43%	0.432	S	S	.	.			trans	-96.7	131.1	175.8	-65.2	170.6	0	0	0	110.7	F464 T465 Y467 D473	F464-L469 CarbonylContact C-O 3.56Å; F464-L469 HydrophobicContact CB-CB 3.95Å; F464-L469 HydrophobicContact CB-CD1 4.47Å; F464-L469 WeakPolarHBondContact O-CB 3.41Å; F464-L469 PolarHBondContact O-N 2.91Å; T465-L469 WeakPolarHBondContact CA-O 3.45Å; T465-L469 PolarHBondContact N-O 3.31Å; Y467-L469 VanDerWaalsContact C-N 3.34Å; L469-D473 HydrophobicContact CD2-CB 4.29Å
470	N	82	Confident	87.2	Confident	65 Å²	65	78.7 Å²	78.7	35%	0.348	42%	0.415	S	S	.	.			trans	-101	161.9	177.9	-73.8	-17.7	0	0	0	111.5	R472 D473 L474	N470-R472 PolarHBondContact O-N 3.35Å; N470-R472 VanDerWaalsContact O-N 3.08Å; N470-D473 PolarHBondContact N-OD2 3.15Å; N470-D473 WeakPolarHBondContact O-CB 3.14Å; N470-D473 PolarHBondContact O-N 2.96Å; N470-L474 PolarHBondContact O-N 3.18Å
471	N	81.2	Confident	87.3	Confident	66 Å²	66	79.5 Å²	79.5	35%	0.353	41%	0.408	S	S	.	.	H	α-helix	trans	-58.1	-23.9	173.3	-80	-36.8	0	0	0	112.8	S457 L474 L475	S457-N471 PolarHBondContact OG-ND2 2.82Å; N471-L474 PolarHBondContact O-N 3.18Å; N471-L475 WeakPolarHBondContact O-CG 3.34Å; N471-L475 PolarHBondContact O-N 3.32Å
472	R	82	Confident	87.4	Confident	136 Å²	136	79.1 Å²	79.1	51%	0.513	40%	0.402	S	S	.	.	H	α-helix	trans	-59.7	-43.1	169.1	-175.7	178.7	-177	-152.7	1.7	112.1	N470 L474 L475 T476	N470-R472 PolarHBondContact O-N 3.35Å; N470-R472 VanDerWaalsContact O-N 3.08Å; R472-L474 VanDerWaalsContact C-N 3.31Å; R472-L474 PolarHBondContact O-N 3.48Å; R472-L475 CarbonylContact O-C 3.45Å; R472-L475 PolarHBondContact O-N 3.3Å; R472-L475 VanDerWaalsContact O-N 3.16Å; R472-T476 PolarHBondContact O-N 3.09Å; R472-T476 VanDerWaalsContact O-N 3.09Å
473	D	86.4	Confident	87.7	Confident	55 Å²	55	77.4 Å²	77.4	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-69.2	-31	-177.2	-57.3	-45.7	0	0	0	112	L469 N470 L475 T476	L469-D473 HydrophobicContact CD2-CB 4.29Å; N470-D473 PolarHBondContact N-OD2 3.15Å; N470-D473 WeakPolarHBondContact O-CB 3.14Å; N470-D473 PolarHBondContact O-N 2.96Å; D473-L475 VanDerWaalsContact C-N 3.35Å; D473-T476 PolarHBondContact O-N 3.39Å; D473-T476 PolarHBondContact O-OG1 3.38Å
474	L	87.5	Confident	87.6	Confident	11 Å²	11	73.8 Å²	73.8	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-72.7	-29.6	173.3	-60.5	177.8	0	0	0	112.5	F464 N470 N471 R472 T476 L530 Q531	F464-L474 HydrophobicContact CD2-CD1 4.07Å; F464-L474 HydrophobicContact CE2-CD1 4.38Å; N470-L474 PolarHBondContact O-N 3.18Å; N471-L474 PolarHBondContact O-N 3.18Å; R472-L474 VanDerWaalsContact C-N 3.31Å; R472-L474 PolarHBondContact O-N 3.48Å; L474-T476 VanDerWaalsContact C-N 3.34Å; L474-L530 HydrophobicContact CD2-CD2 4Å; L474-L530 PolarHBondContact O-N 3.08Å; L474-Q531 HydrophobicContact CB-CB 4.13Å; L474-Q531 PolarHBondContact O-N 3.39Å
475	L	86.9	Confident	87.8	Confident	77 Å²	77	73.1 Å²	73.1	40%	0.403	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1.4	176.8	-67.1	171.9	0	0	0	113.3	N471 R472 D473 L477 T529 Q531	N471-L475 WeakPolarHBondContact O-CG 3.34Å; N471-L475 PolarHBondContact O-N 3.32Å; R472-L475 CarbonylContact O-C 3.45Å; R472-L475 PolarHBondContact O-N 3.3Å; R472-L475 VanDerWaalsContact O-N 3.16Å; D473-L475 VanDerWaalsContact C-N 3.35Å; L475-L477 PolarHBondContact O-N 2.95Å; L475-T529 WeakPolarHBondContact O-CG2 3.37Å; L475-Q531 HydrophobicContact CD2-CB 4.21Å
476	T	87.6	Confident	88	Confident	49 Å²	49	73.5 Å²	73.5	30%	0.301	37%	0.372	S	S	.	.	S	Bend	trans	-64.1	130.1	170.6	54.1	0	0	0	0	109.7	R472 D473 L474 R478	R472-T476 PolarHBondContact O-N 3.09Å; R472-T476 VanDerWaalsContact O-N 3.09Å; D473-T476 PolarHBondContact O-N 3.39Å; D473-T476 PolarHBondContact O-OG1 3.38Å; L474-T476 VanDerWaalsContact C-N 3.34Å; T476-R478 PolarHBondContact O-N 3.43Å; T476-R478 PolarHBondContact OG1-NE 3.35Å; T476-R478 PolarHBondContact OG1-NH2 3.15Å
477	L	88.6	Confident	88	Confident	62 Å²	62	68.5 Å²	68.5	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	125.1	174.1	-72.3	171.1	0	0	0	109.1	L475 L517 P522 Q527 T529	L475-L477 PolarHBondContact O-N 2.95Å; L477-L517 HydrophobicContact CD2-CD1 4.13Å; L477-P522 HydrophobicContact CD1-CB 4.02Å; L477-P522 HydrophobicContact CD1-CG 4.13Å; L477-P522 HydrophobicContact CD2-CG 3.96Å; L477-Q527 HydrophobicContact CB-CB 4.12Å; L477-Q527 HydrophobicContact CD2-CB 4.27Å; L477-T529 HydrophobicContact CD2-CG2 3.91Å
478	R	90.4	Very high	88	Confident	70 Å²	70	62.8 Å²	62.8	26%	0.264	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.1	-176.8	-66.7	176.3	-173.5	-98.8	0.3	110.6	T476 D482 I483 Q527 V528	T476-R478 PolarHBondContact O-N 3.43Å; T476-R478 PolarHBondContact OG1-NE 3.35Å; T476-R478 PolarHBondContact OG1-NH2 3.15Å; R478-D482 HydrophobicContact CB-CB 4.39Å; R478-I483 HydrophobicContact CB-CD1 4.06Å; R478-I483 HydrophobicContact CB-CG1 3.93Å; R478-Q527 WeakPolarHBondContact O-CA 3.35Å; R478-V528 PolarHBondContact N-O 2.76Å; R478-V528 PolarHBondContact O-N 3.3Å
479	N	90.9	Very high	88.2	Confident	65 Å²	65	67.2 Å²	67.2	35%	0.348	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	161.3	177.2	-61.6	-28.5	0	0	0	110.7	Q481 D482 I483 Q527	N479-Q481 VanDerWaalsContact C-N 3.27Å; N479-Q481 PolarHBondContact O-N 3.37Å; N479-D482 PolarHBondContact N-OD2 3.37Å; N479-D482 PolarHBondContact O-N 3.26Å; N479-D482 VanDerWaalsContact O-N 3.16Å; N479-I483 PolarHBondContact O-N 3.33Å; N479-I483 VanDerWaalsContact O-N 3.15Å; N479-Q527 WeakPolarHBondContact OD1-CG 3.46Å; N479-Q527 PolarHBondContact OD1-NE2 3.27Å; N479-Q527 VanDerWaalsContact OD1-NE2 3.12Å
480	K	89.9	Confident	88.2	Confident	82 Å²	82	66 Å²	66	36%	0.357	33%	0.334	S	S	.	.	H	α-helix	trans	-53.9	-43.3	177.3	-165.2	-178.6	-176.9	-179.4	0	113.1	I483 L484 F502 D503 W506	K480-I483 PolarHBondContact O-N 3.08Å; K480-L484 WeakPolarHBondContact O-CG 3.25Å; K480-L484 PolarHBondContact O-N 3.23Å; K480-L484 VanDerWaalsContact O-N 3.1Å; K480-F502 HydrophobicContact CD-CE1 4.24Å; K480-F502 VanDerWaalsContact CE-CE1 3.46Å; K480-F502 HydrophobicContact CG-CE1 3.71Å; K480-F502 HydrophobicContact CG-CZ 4.28Å; K480-D503 WeakPolarHBondContact CE-OD1 3.43Å; K480-D503 IonicContact NZ-OD1 3.77Å; K480-D503 PolarHBondContact NZ-OD1 3.03Å; K480-W506 HydrophobicContact CB-CH2 3.76Å; K480-W506 HydrophobicContact CB-CZ2 3.89Å; K480-W506 HydrophobicContact CB-CZ3 4.07Å; K480-W506 HydrophobicContact CG-CD2 4.19Å; K480-W506 HydrophobicContact CG-CE3 4.04Å; K480-W506 HydrophobicContact CG-CH2 4.18Å; K480-W506 HydrophobicContact CG-CZ2 4.28Å; K480-W506 HydrophobicContact CG-CZ3 4.04Å
481	Q	89.4	Confident	88.4	Confident	110 Å²	110	69.3 Å²	69.3	51%	0.514	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-42	179.3	-169.7	61.2	35.1	0	0	112.1	N479 I483 L484 D485	N479-Q481 VanDerWaalsContact C-N 3.27Å; N479-Q481 PolarHBondContact O-N 3.37Å; Q481-I483 VanDerWaalsContact C-N 3.29Å; Q481-I483 PolarHBondContact O-N 3.32Å; Q481-L484 WeakPolarHBondContact O-CB 3.38Å; Q481-L484 PolarHBondContact O-N 3.18Å; Q481-L484 VanDerWaalsContact O-N 3.14Å; Q481-D485 PolarHBondContact NE2-OD1 2.77Å; Q481-D485 WeakPolarHBondContact O-CB 3.33Å; Q481-D485 VanDerWaalsContact O-CG 3.24Å; Q481-D485 PolarHBondContact O-N 2.82Å
482	D	90.8	Very high	88.6	Confident	69 Å²	69	70.5 Å²	70.5	37%	0.369	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-39.5	179.5	-59.2	-23.4	0	0	0	111.5	R478 N479 D485 L486	R478-D482 HydrophobicContact CB-CB 4.39Å; N479-D482 PolarHBondContact N-OD2 3.37Å; N479-D482 PolarHBondContact O-N 3.26Å; N479-D482 VanDerWaalsContact O-N 3.16Å; D482-D485 PolarHBondContact O-N 3.17Å; D482-L486 VanDerWaalsContact O-CG 3.3Å; D482-L486 WeakPolarHBondContact O-CG 3.18Å; D482-L486 PolarHBondContact O-N 3.39Å
483	I	90.6	Very high	88.4	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-67.5	-43.1	175.9	-70.6	173.2	0	0	0	110.2	R478 N479 K480 Q481 D485 L486 F487 F502 W506 V528 F533	R478-I483 HydrophobicContact CB-CD1 4.06Å; R478-I483 HydrophobicContact CB-CG1 3.93Å; N479-I483 PolarHBondContact O-N 3.33Å; N479-I483 VanDerWaalsContact O-N 3.15Å; K480-I483 PolarHBondContact O-N 3.08Å; Q481-I483 VanDerWaalsContact C-N 3.29Å; Q481-I483 PolarHBondContact O-N 3.32Å; I483-D485 VanDerWaalsContact C-N 3.31Å; I483-D485 PolarHBondContact O-N 3.44Å; I483-L486 PolarHBondContact O-N 3.19Å; I483-F487 HydrophobicContact CG2-CD2 3.91Å; I483-F487 HydrophobicContact CG2-CE2 3.92Å; I483-F487 VanDerWaalsContact O-CD2 3.25Å; I483-F487 WeakPolarHBondContact O-CD2 3.48Å; I483-F487 PolarHBondContact O-N 3Å; I483-F502 HydrophobicContact CG2-CE2 4.23Å; I483-F502 HydrophobicContact CG2-CZ 4.19Å; I483-W506 HydrophobicContact CB-CZ3 4.24Å; I483-W506 HydrophobicContact CD1-CH2 4.01Å; I483-W506 HydrophobicContact CD1-CZ3 3.55Å; I483-W506 HydrophobicContact CG1-CZ3 4.38Å; I483-V528 HydrophobicContact CD1-CB 4.4Å; I483-F533 HydrophobicContact CG2-CD1 4.05Å; I483-F533 HydrophobicContact CG2-CD2 4.26Å; I483-F533 HydrophobicContact CG2-CE1 3.94Å; I483-F533 HydrophobicContact CG2-CE2 4.16Å; I483-F533 HydrophobicContact CG2-CG 4.21Å; I483-F533 HydrophobicContact CG2-CZ 4Å
484	L	89	Confident	88	Confident	52 Å²	52	70.6 Å²	70.6	27%	0.272	36%	0.359	S	S	.	.	H	α-helix	trans	-58.5	-44.1	174	-76.2	165.6	0	0	0	111.8	K480 Q481 L486 F487 T488 F502	K480-L484 WeakPolarHBondContact O-CG 3.25Å; K480-L484 PolarHBondContact O-N 3.23Å; K480-L484 VanDerWaalsContact O-N 3.1Å; Q481-L484 WeakPolarHBondContact O-CB 3.38Å; Q481-L484 PolarHBondContact O-N 3.18Å; Q481-L484 VanDerWaalsContact O-N 3.14Å; L484-L486 PolarHBondContact O-N 3.05Å; L484-F487 PolarHBondContact O-N 3.42Å; L484-T488 WeakPolarHBondContact O-CG2 3.43Å; L484-T488 PolarHBondContact O-N 3.18Å; L484-T488 PolarHBondContact O-OG1 3.45Å; L484-F502 HydrophobicContact CD1-CE1 4.35Å; L484-F502 HydrophobicContact CD1-CZ 4.35Å; L484-F502 HydrophobicContact CD2-CD1 4.23Å; L484-F502 HydrophobicContact CD2-CD2 3.56Å; L484-F502 HydrophobicContact CD2-CE1 4.1Å; L484-F502 HydrophobicContact CD2-CE2 3.39Å; L484-F502 HydrophobicContact CD2-CG 3.99Å; L484-F502 HydrophobicContact CD2-CZ 3.69Å; L484-F502 HydrophobicContact CG-CD2 4.42Å; L484-F502 HydrophobicContact CG-CE1 4.07Å; L484-F502 HydrophobicContact CG-CE2 3.8Å; L484-F502 HydrophobicContact CG-CZ 3.61Å
485	D	91.2	Very high	87.4	Confident	62 Å²	62	72.1 Å²	72.1	33%	0.332	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-39.4	179.4	-68.4	-7.8	0	0	0	111.4	Q481 D482 I483 T488 Q489	Q481-D485 PolarHBondContact NE2-OD1 2.77Å; Q481-D485 WeakPolarHBondContact O-CB 3.33Å; Q481-D485 VanDerWaalsContact O-CG 3.24Å; Q481-D485 PolarHBondContact O-N 2.82Å; D482-D485 PolarHBondContact O-N 3.17Å; I483-D485 VanDerWaalsContact C-N 3.31Å; I483-D485 PolarHBondContact O-N 3.44Å; D485-T488 VanDerWaalsContact CA-OG1 3.3Å; D485-T488 WeakPolarHBondContact CA-OG1 3.47Å; D485-T488 PolarHBondContact O-N 3.41Å; D485-T488 PolarHBondContact O-OG1 3.07Å; D485-Q489 WeakPolarHBondContact O-CB 3.44Å; D485-Q489 VanDerWaalsContact O-CG 3.25Å; D485-Q489 WeakPolarHBondContact O-CG 3.37Å; D485-Q489 PolarHBondContact O-N 3.32Å
486	L	91.5	Very high	86.9	Confident	60 Å²	60	70.2 Å²	70.2	31%	0.314	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-45.5	173.6	-76.8	170.5	0	0	0	112.2	D482 I483 L484 A490	D482-L486 VanDerWaalsContact O-CG 3.3Å; D482-L486 WeakPolarHBondContact O-CG 3.18Å; D482-L486 PolarHBondContact O-N 3.39Å; I483-L486 PolarHBondContact O-N 3.19Å; L484-L486 PolarHBondContact O-N 3.05Å; L486-A490 VanDerWaalsContact O-CB 3.25Å; L486-A490 WeakPolarHBondContact O-CB 3.47Å; L486-A490 PolarHBondContact O-N 3.18Å
487	F	89.8	Confident	85.8	Confident	29 Å²	29	73.4 Å²	73.4	13%	0.127	37%	0.37	C	S	.	.	H	α-helix	trans	-72.3	-32.1	-178.9	-84.5	-102.8	0	0	0	112.6	I483 L484 N491 F492 F496 L530 F533 L537	I483-F487 HydrophobicContact CG2-CD2 3.91Å; I483-F487 HydrophobicContact CG2-CE2 3.92Å; I483-F487 VanDerWaalsContact O-CD2 3.25Å; I483-F487 WeakPolarHBondContact O-CD2 3.48Å; I483-F487 PolarHBondContact O-N 3Å; L484-F487 PolarHBondContact O-N 3.42Å; F487-N491 PolarHBondContact O-N 2.81Å; F487-F492 HydrophobicContact CD1-CB 3.69Å; F487-F492 HydrophobicContact CE1-CB 4.38Å; F487-F492 PolarHBondContact O-N 3.4Å; F487-F496 HydrophobicContact CB-CE2 4Å; F487-F496 AromaticContact CD1-CE2 3.68Å; F487-F496 HydrophobicContact CD1-CE2 3.68Å; F487-F496 AromaticContact CD1-CZ 3.62Å; F487-F496 HydrophobicContact CD1-CZ 3.62Å; F487-F496 HydrophobicContact CE1-CE2 4.44Å; F487-F496 AromaticContact CE1-CZ 3.95Å; F487-F496 HydrophobicContact CE1-CZ 3.95Å; F487-F496 AromaticContact CG-CE2 3.99Å; F487-F496 HydrophobicContact CG-CE2 3.99Å; F487-F496 HydrophobicContact CG-CZ 4.08Å; F487-L530 HydrophobicContact CE2-CD1 4.18Å; F487-F533 HydrophobicContact CD2-CE1 4.31Å; F487-F533 HydrophobicContact CE1-CE1 4.19Å; F487-F533 AromaticContact CE2-CD1 3.71Å; F487-F533 HydrophobicContact CE2-CD1 3.71Å; F487-F533 AromaticContact CE2-CE1 3.54Å; F487-F533 HydrophobicContact CE2-CE1 3.54Å; F487-F533 AromaticContact CZ-CD1 3.7Å; F487-F533 HydrophobicContact CZ-CD1 3.7Å; F487-F533 AromaticContact CZ-CE1 3.47Å; F487-F533 HydrophobicContact CZ-CE1 3.47Å; F487-F533 VanDerWaalsContact CZ-CE1 3.47Å; F487-L537 HydrophobicContact CE1-CD1 4.07Å; F487-L537 HydrophobicContact CZ-CD1 4.48Å
488	T	89.3	Confident	84.5	Confident	65 Å²	65	75.1 Å²	75.1	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-67.3	-46	173.2	56.9	0	0	0	0	111.5	L484 D485 A490 N491 C493	L484-T488 WeakPolarHBondContact O-CG2 3.43Å; L484-T488 PolarHBondContact O-N 3.18Å; L484-T488 PolarHBondContact O-OG1 3.45Å; D485-T488 VanDerWaalsContact CA-OG1 3.3Å; D485-T488 WeakPolarHBondContact CA-OG1 3.47Å; D485-T488 PolarHBondContact O-N 3.41Å; D485-T488 PolarHBondContact O-OG1 3.07Å; T488-A490 VanDerWaalsContact C-N 3.28Å; T488-A490 PolarHBondContact O-N 2.68Å; T488-N491 PolarHBondContact O-N 3.43Å; T488-N491 VanDerWaalsContact O-N 3.13Å; T488-C493 WeakPolarHBondContact CA-SG 3.43Å; T488-C493 WeakPolarHBondContact CG2-SG 3.09Å
489	Q	90.4	Very high	83.3	Confident	152 Å²	152	76.7 Å²	76.7	71%	0.71	41%	0.413	S	S	*	.	H	α-helix	trans	-64.6	-33.5	176.7	-71.1	174.6	14.8	0	0	112.6	D485 N491	D485-Q489 WeakPolarHBondContact O-CB 3.44Å; D485-Q489 VanDerWaalsContact O-CG 3.25Å; D485-Q489 WeakPolarHBondContact O-CG 3.37Å; D485-Q489 PolarHBondContact O-N 3.32Å; Q489-N491 PolarHBondContact O-N 3.27Å
490	A	87.6	Confident	82.3	Confident	49 Å²	49	74.6 Å²	74.6	41%	0.405	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2.8	177.1	0	0	0	0	0	113.9	L486 T488 F492	L486-A490 VanDerWaalsContact O-CB 3.25Å; L486-A490 WeakPolarHBondContact O-CB 3.47Å; L486-A490 PolarHBondContact O-N 3.18Å; T488-A490 VanDerWaalsContact C-N 3.28Å; T488-A490 PolarHBondContact O-N 2.68Å; A490-F492 HydrophobicContact CB-CD2 3.42Å; A490-F492 VanDerWaalsContact CB-CD2 3.42Å; A490-F492 HydrophobicContact CB-CE2 3.81Å; A490-F492 HydrophobicContact CB-CG 4.43Å; A490-F492 PolarHBondContact O-N 3.07Å
491	N	86.1	Confident	81.9	Confident	135 Å²	135	73.5 Å²	73.5	72%	0.722	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	29	-176.1	-70.1	-36	0	0	0	114.5	F487 T488 Q489 Y494	F487-N491 PolarHBondContact O-N 2.81Å; T488-N491 PolarHBondContact O-N 3.43Å; T488-N491 VanDerWaalsContact O-N 3.13Å; Q489-N491 PolarHBondContact O-N 3.27Å; N491-Y494 VanDerWaalsContact O-CD1 3.24Å; N491-Y494 WeakPolarHBondContact O-CD1 3.4Å; N491-Y494 VanDerWaalsContact O-CE1 3.3Å; N491-Y494 WeakPolarHBondContact O-CE1 3.43Å
492	F	84.3	Confident	81.7	Confident	90 Å²	90	69.5 Å²	69.5	40%	0.395	39%	0.385	S	S	.	.			trans	-96.7	10.2	179.2	-72.4	-56.4	0	0	0	114	F487 A490 Y494 L495	F487-F492 HydrophobicContact CD1-CB 3.69Å; F487-F492 HydrophobicContact CE1-CB 4.38Å; F487-F492 PolarHBondContact O-N 3.4Å; A490-F492 HydrophobicContact CB-CD2 3.42Å; A490-F492 VanDerWaalsContact CB-CD2 3.42Å; A490-F492 HydrophobicContact CB-CE2 3.81Å; A490-F492 HydrophobicContact CB-CG 4.43Å; A490-F492 PolarHBondContact O-N 3.07Å; F492-Y494 AromaticContact CD1-CE1 3.75Å; F492-Y494 HydrophobicContact CD1-CE1 3.75Å; F492-Y494 AromaticContact CD1-CZ 3.94Å; F492-Y494 HydrophobicContact CE1-CE1 4.46Å; F492-Y494 PolarHBondContact O-N 3.14Å; F492-Y494 VanDerWaalsContact O-N 3.11Å; F492-L495 HydrophobicContact CB-CD1 4.07Å; F492-L495 HydrophobicContact CD1-CD1 4.09Å; F492-L495 HydrophobicContact CG-CD1 4.34Å; F492-L495 WeakPolarHBondContact O-CB 3.39Å; F492-L495 PolarHBondContact O-N 2.71Å; F492-L495 VanDerWaalsContact O-N 3.13Å
493	C	77.9	Confident	81.5	Confident	55 Å²	55	70.6 Å²	70.6	37%	0.372	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-58.9	-24.7	179.1	-68.8	0	0	0	0	114.2	T488 L495 F496	T488-C493 WeakPolarHBondContact CA-SG 3.43Å; T488-C493 WeakPolarHBondContact CG2-SG 3.09Å; C493-L495 PolarHBondContact O-N 3.3Å; C493-F496 PolarHBondContact O-N 2.72Å; C493-F496 VanDerWaalsContact O-N 3.13Å
494	Y	79.1	Confident	81.3	Confident	139 Å²	139	76.4 Å²	76.4	55%	0.545	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-62.9	-24.5	178.7	68.1	-92.5	0	0	0	113.1	N491 F492 F496 N497	N491-Y494 VanDerWaalsContact O-CD1 3.24Å; N491-Y494 WeakPolarHBondContact O-CD1 3.4Å; N491-Y494 VanDerWaalsContact O-CE1 3.3Å; N491-Y494 WeakPolarHBondContact O-CE1 3.43Å; F492-Y494 AromaticContact CD1-CE1 3.75Å; F492-Y494 HydrophobicContact CD1-CE1 3.75Å; F492-Y494 AromaticContact CD1-CZ 3.94Å; F492-Y494 HydrophobicContact CE1-CE1 4.46Å; F492-Y494 PolarHBondContact O-N 3.14Å; F492-Y494 VanDerWaalsContact O-N 3.11Å; Y494-F496 PolarHBondContact O-N 3.3Å; Y494-N497 PolarHBondContact O-N 2.99Å
495	L	74.9	Confident	81.3	Confident	43 Å²	43	74 Å²	74	23%	0.225	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-67.3	-15.1	177.2	-64.6	174.3	0	0	0	113	F492 C493 L537	F492-L495 HydrophobicContact CB-CD1 4.07Å; F492-L495 HydrophobicContact CD1-CD1 4.09Å; F492-L495 HydrophobicContact CG-CD1 4.34Å; F492-L495 WeakPolarHBondContact O-CB 3.39Å; F492-L495 PolarHBondContact O-N 2.71Å; F492-L495 VanDerWaalsContact O-N 3.13Å; C493-L495 PolarHBondContact O-N 3.3Å; L495-L537 HydrophobicContact CD1-CD1 4.38Å; L495-L537 HydrophobicContact CD1-CD2 4.4Å
496	F	75	Confident	81.3	Confident	36 Å²	36	71.7 Å²	71.7	16%	0.158	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-103.2	9.3	179.1	-50.8	-63.7	0	0	0	113.1	F487 C493 Y494 L500 F502 F533 L537	F487-F496 HydrophobicContact CB-CE2 4Å; F487-F496 AromaticContact CD1-CE2 3.68Å; F487-F496 HydrophobicContact CD1-CE2 3.68Å; F487-F496 AromaticContact CD1-CZ 3.62Å; F487-F496 HydrophobicContact CD1-CZ 3.62Å; F487-F496 HydrophobicContact CE1-CE2 4.44Å; F487-F496 AromaticContact CE1-CZ 3.95Å; F487-F496 HydrophobicContact CE1-CZ 3.95Å; F487-F496 AromaticContact CG-CE2 3.99Å; F487-F496 HydrophobicContact CG-CE2 3.99Å; F487-F496 HydrophobicContact CG-CZ 4.08Å; C493-F496 PolarHBondContact O-N 2.72Å; C493-F496 VanDerWaalsContact O-N 3.13Å; Y494-F496 PolarHBondContact O-N 3.3Å; F496-L500 CarbonylContact C-O 3.43Å; F496-L500 WeakPolarHBondContact CA-O 3.24Å; F496-F502 HydrophobicContact CD1-CB 4.06Å; F496-F502 AromaticContact CD1-CD2 3.99Å; F496-F502 HydrophobicContact CD1-CD2 3.99Å; F496-F502 HydrophobicContact CD2-CD2 4.36Å; F496-F502 AromaticContact CE1-CD2 3.71Å; F496-F502 HydrophobicContact CE1-CD2 3.71Å; F496-F502 HydrophobicContact CE1-CE2 4.45Å; F496-F502 HydrophobicContact CE2-CD2 4.11Å; F496-F502 HydrophobicContact CG-CB 4.35Å; F496-F502 HydrophobicContact CG-CD2 4.31Å; F496-F502 AromaticContact CZ-CD2 3.77Å; F496-F502 HydrophobicContact CZ-CD2 3.77Å; F496-F502 HydrophobicContact CZ-CE2 4.2Å; F496-F533 HydrophobicContact CE1-CE1 4.46Å; F496-F533 HydrophobicContact CE1-CZ 4.17Å; F496-F533 HydrophobicContact CZ-CE1 4.19Å; F496-F533 HydrophobicContact CZ-CZ 4.16Å; F496-L537 HydrophobicContact CE1-CD1 4.06Å; F496-L537 HydrophobicContact CZ-CD1 4.26Å
497	N	65.1	Low	81.1	Confident	117 Å²	117	74.8 Å²	74.8	63%	0.626	40%	0.403	S	S	*	.	S	Bend	trans	-81.1	138.6	166	-67.4	-25.4	0	0	0	108.1	Y494	Y494-N497 PolarHBondContact O-N 2.99Å
498	A	61.6	Low	81.1	Confident	98 Å²	98	76.1 Å²	76.1	81%	0.81	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.9	133.9	-172.1	0	0	0	0	0	112.7
499	P	64.4	Low	81.1	Confident	103 Å²	103	73 Å²	73	67%	0.669	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	cis	-96	-8.7	28.1	32.7	-32.9	0	0	0	117.2
500	L	69.9	Low	81.1	Confident	20 Å²	20	67 Å²	67	11%	0.105	36%	0.364	C	S	.	.			trans	-90.5	116.3	179.9	-86.5	86.3	0	0	0	111.5	F496 V505 L540	F496-L500 CarbonylContact C-O 3.43Å; F496-L500 WeakPolarHBondContact CA-O 3.24Å; L500-V505 HydrophobicContact CD2-CG2 4.09Å; L500-L540 HydrophobicContact CD2-CB 3.63Å; L500-L540 HydrophobicContact CG-CB 4.36Å
501	S	81.9	Confident	81.1	Confident	60 Å²	60	67.4 Å²	67.4	42%	0.42	36%	0.364	S	S	.	.			trans	-88	140.6	168.4	64.9	0	0	0	0	111	D503 K504 V505	S501-D503 PolarHBondContact O-N 2.7Å; S501-K504 WeakPolarHBondContact O-CB 3.49Å; S501-K504 PolarHBondContact O-N 2.77Å; S501-K504 WeakPolarHBondContact OG-CB 3.35Å; S501-V505 PolarHBondContact O-N 3.28Å
502	F	85.9	Confident	81.2	Confident	25 Å²	25	62 Å²	62	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-53.2	-41	177.4	-178.1	-87.5	0	0	0	112.3	K480 I483 L484 F496 K504 V505 W506 F533	K480-F502 HydrophobicContact CD-CE1 4.24Å; K480-F502 VanDerWaalsContact CE-CE1 3.46Å; K480-F502 HydrophobicContact CG-CE1 3.71Å; K480-F502 HydrophobicContact CG-CZ 4.28Å; I483-F502 HydrophobicContact CG2-CE2 4.23Å; I483-F502 HydrophobicContact CG2-CZ 4.19Å; L484-F502 HydrophobicContact CD1-CE1 4.35Å; L484-F502 HydrophobicContact CD1-CZ 4.35Å; L484-F502 HydrophobicContact CD2-CD1 4.23Å; L484-F502 HydrophobicContact CD2-CD2 3.56Å; L484-F502 HydrophobicContact CD2-CE1 4.1Å; L484-F502 HydrophobicContact CD2-CE2 3.39Å; L484-F502 HydrophobicContact CD2-CG 3.99Å; L484-F502 HydrophobicContact CD2-CZ 3.69Å; L484-F502 HydrophobicContact CG-CD2 4.42Å; L484-F502 HydrophobicContact CG-CE1 4.07Å; L484-F502 HydrophobicContact CG-CE2 3.8Å; L484-F502 HydrophobicContact CG-CZ 3.61Å; F496-F502 HydrophobicContact CD1-CB 4.06Å; F496-F502 AromaticContact CD1-CD2 3.99Å; F496-F502 HydrophobicContact CD1-CD2 3.99Å; F496-F502 HydrophobicContact CD2-CD2 4.36Å; F496-F502 AromaticContact CE1-CD2 3.71Å; F496-F502 HydrophobicContact CE1-CD2 3.71Å; F496-F502 HydrophobicContact CE1-CE2 4.45Å; F496-F502 HydrophobicContact CE2-CD2 4.11Å; F496-F502 HydrophobicContact CG-CB 4.35Å; F496-F502 HydrophobicContact CG-CD2 4.31Å; F496-F502 AromaticContact CZ-CD2 3.77Å; F496-F502 HydrophobicContact CZ-CD2 3.77Å; F496-F502 HydrophobicContact CZ-CE2 4.2Å; F502-K504 VanDerWaalsContact C-N 3.3Å; F502-K504 PolarHBondContact O-N 2.72Å; F502-V505 PolarHBondContact O-N 3.48Å; F502-W506 HydrophobicContact CE1-CB 4.47Å; F502-W506 HydrophobicContact CE1-CD2 4.46Å; F502-W506 AromaticContact CE1-CE3 3.88Å; F502-W506 HydrophobicContact CE1-CE3 3.88Å; F502-W506 AromaticContact CZ-CE3 3.92Å; F502-W506 HydrophobicContact CZ-CE3 3.92Å; F502-W506 HydrophobicContact CZ-CZ3 4.37Å; F502-W506 WeakPolarHBondContact O-CB 3.28Å; F502-W506 PolarHBondContact O-N 2.88Å; F502-F533 HydrophobicContact CD2-CZ 4.02Å; F502-F533 HydrophobicContact CE2-CE1 4.5Å; F502-F533 AromaticContact CE2-CE2 3.99Å; F502-F533 HydrophobicContact CE2-CE2 3.99Å; F502-F533 AromaticContact CE2-CZ 3.52Å; F502-F533 HydrophobicContact CE2-CZ 3.52Å; F502-F533 HydrophobicContact CZ-CE2 4.03Å; F502-F533 HydrophobicContact CZ-CZ 4.05Å
503	D	86.7	Confident	81.4	Confident	92 Å²	92	58 Å²	58	49%	0.492	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-33.2	179.7	-68.3	-38.1	0	0	0	113.1	K480 S501 W506 Q507	K480-D503 WeakPolarHBondContact CE-OD1 3.43Å; K480-D503 IonicContact NZ-OD1 3.77Å; K480-D503 PolarHBondContact NZ-OD1 3.03Å; S501-D503 PolarHBondContact O-N 2.7Å; D503-W506 PolarHBondContact O-N 3.13Å; D503-Q507 WeakPolarHBondContact O-CG 3.42Å; D503-Q507 PolarHBondContact O-N 3.41Å
504	K	86.3	Confident	81.6	Confident	123 Å²	123	61 Å²	61	54%	0.535	32%	0.324	S	S	.	.	H	α-helix	trans	-69.1	-40.7	176.5	-170.1	179	-178.7	-173.7	0	111.2	S501 F502 M508 L540	S501-K504 WeakPolarHBondContact O-CB 3.49Å; S501-K504 PolarHBondContact O-N 2.77Å; S501-K504 WeakPolarHBondContact OG-CB 3.35Å; F502-K504 VanDerWaalsContact C-N 3.3Å; F502-K504 PolarHBondContact O-N 2.72Å; K504-M508 PolarHBondContact O-N 2.95Å; K504-M508 VanDerWaalsContact O-N 3.14Å; K504-L540 HydrophobicContact CD-CD2 4.44Å; K504-L540 HydrophobicContact CG-CD1 4.32Å
505	V	89.4	Confident	81.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64	-43.4	174.2	-175.7	0	0	0	0	110.4	L500 S501 F502 Q507 M508 A509 F533 A536 L537 L540	L500-V505 HydrophobicContact CD2-CG2 4.09Å; S501-V505 PolarHBondContact O-N 3.28Å; F502-V505 PolarHBondContact O-N 3.48Å; V505-Q507 PolarHBondContact O-N 3.29Å; V505-M508 PolarHBondContact O-N 3.27Å; V505-A509 WeakPolarHBondContact O-CB 3.38Å; V505-A509 PolarHBondContact O-N 3.4Å; V505-F533 HydrophobicContact CB-CE2 4.17Å; V505-F533 HydrophobicContact CB-CZ 4.2Å; V505-F533 HydrophobicContact CG1-CD1 4.43Å; V505-F533 HydrophobicContact CG1-CD2 4.08Å; V505-F533 HydrophobicContact CG1-CE1 4.05Å; V505-F533 HydrophobicContact CG1-CE2 3.67Å; V505-F533 HydrophobicContact CG1-CG 4.45Å; V505-F533 HydrophobicContact CG1-CZ 3.65Å; V505-A536 HydrophobicContact CG1-CB 4.05Å; V505-L537 HydrophobicContact CG1-CB 4.01Å; V505-L540 HydrophobicContact CB-CD1 4.24Å; V505-L540 HydrophobicContact CG2-CD1 3.79Å
506	W	89.9	Confident	82.2	Confident	14 Å²	14	62.2 Å²	62.2	5%	0.053	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-46	178.2	-170.7	-91.9	0	0	0	112.8	K480 I483 F502 D503 A509 L510 V528 F533	K480-W506 HydrophobicContact CB-CH2 3.76Å; K480-W506 HydrophobicContact CB-CZ2 3.89Å; K480-W506 HydrophobicContact CB-CZ3 4.07Å; K480-W506 HydrophobicContact CG-CD2 4.19Å; K480-W506 HydrophobicContact CG-CE3 4.04Å; K480-W506 HydrophobicContact CG-CH2 4.18Å; K480-W506 HydrophobicContact CG-CZ2 4.28Å; K480-W506 HydrophobicContact CG-CZ3 4.04Å; I483-W506 HydrophobicContact CB-CZ3 4.24Å; I483-W506 HydrophobicContact CD1-CH2 4.01Å; I483-W506 HydrophobicContact CD1-CZ3 3.55Å; I483-W506 HydrophobicContact CG1-CZ3 4.38Å; F502-W506 HydrophobicContact CE1-CB 4.47Å; F502-W506 HydrophobicContact CE1-CD2 4.46Å; F502-W506 AromaticContact CE1-CE3 3.88Å; F502-W506 HydrophobicContact CE1-CE3 3.88Å; F502-W506 AromaticContact CZ-CE3 3.92Å; F502-W506 HydrophobicContact CZ-CE3 3.92Å; F502-W506 HydrophobicContact CZ-CZ3 4.37Å; F502-W506 WeakPolarHBondContact O-CB 3.28Å; F502-W506 PolarHBondContact O-N 2.88Å; D503-W506 PolarHBondContact O-N 3.13Å; W506-A509 WeakPolarHBondContact O-CB 3.22Å; W506-A509 PolarHBondContact O-N 2.98Å; W506-L510 PolarHBondContact O-N 3.49Å; W506-V528 HydrophobicContact CD2-CG2 4.19Å; W506-V528 HydrophobicContact CE3-CG2 4.47Å; W506-V528 HydrophobicContact CH2-CB 3.8Å; W506-V528 HydrophobicContact CH2-CG2 3.77Å; W506-V528 HydrophobicContact CZ2-CB 4.03Å; W506-V528 HydrophobicContact CZ2-CG2 3.46Å; W506-V528 VanDerWaalsContact CZ2-CG2 3.46Å; W506-V528 HydrophobicContact CZ3-CB 4.17Å; W506-V528 HydrophobicContact CZ3-CG2 4.29Å; W506-F533 HydrophobicContact CE3-CD2 4.08Å; W506-F533 AromaticContact CE3-CE2 3.92Å; W506-F533 HydrophobicContact CE3-CE2 3.92Å; W506-F533 HydrophobicContact CZ3-CD2 4.49Å
507	Q	88.4	Confident	82.4	Confident	126 Å²	126	62.4 Å²	62.4	59%	0.589	35%	0.347	S	S	*	.	H	α-helix	trans	-66.4	-40.4	178.1	-70.3	-64	-23.1	0	0	112.6	D503 V505 A509 L510 S511	D503-Q507 WeakPolarHBondContact O-CG 3.42Å; D503-Q507 PolarHBondContact O-N 3.41Å; V505-Q507 PolarHBondContact O-N 3.29Å; Q507-A509 VanDerWaalsContact C-N 3.34Å; Q507-L510 PolarHBondContact O-N 3.02Å; Q507-S511 PolarHBondContact O-N 3.39Å
508	M	88.4	Confident	83	Confident	57 Å²	57	58.7 Å²	58.7	28%	0.281	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-44	172.6	176.3	64.8	71.5	0	0	110.7	K504 V505 S511 L512 A536 L540	K504-M508 PolarHBondContact O-N 2.95Å; K504-M508 VanDerWaalsContact O-N 3.14Å; V505-M508 PolarHBondContact O-N 3.27Å; M508-S511 PolarHBondContact O-N 3.14Å; M508-S511 PolarHBondContact O-OG 3.48Å; M508-L512 HydrophobicContact CG-CD1 4.38Å; M508-L512 WeakPolarHBondContact O-CG 3.44Å; M508-L512 PolarHBondContact O-N 3.47Å; M508-L512 VanDerWaalsContact O-N 3.1Å; M508-A536 HydrophobicContact CB-CB 3.81Å; M508-A536 HydrophobicContact CG-CB 3.44Å; M508-A536 VanDerWaalsContact CG-CB 3.44Å; M508-L540 HydrophobicContact CB-CD1 4.19Å; M508-L540 HydrophobicContact CE-CD2 4.32Å; M508-L540 HydrophobicContact CG-CD1 4.49Å
509	A	90.6	Very high	83.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-44.8	178	0	0	0	0	0	112.6	V505 W506 Q507 S511 L512 D513 V528 F533 A536	V505-A509 WeakPolarHBondContact O-CB 3.38Å; V505-A509 PolarHBondContact O-N 3.4Å; W506-A509 WeakPolarHBondContact O-CB 3.22Å; W506-A509 PolarHBondContact O-N 2.98Å; Q507-A509 VanDerWaalsContact C-N 3.34Å; A509-S511 VanDerWaalsContact C-N 3.26Å; A509-S511 PolarHBondContact O-N 3.5Å; A509-L512 PolarHBondContact O-N 3.22Å; A509-D513 PolarHBondContact O-N 2.91Å; A509-V528 HydrophobicContact CB-CG1 3.54Å; A509-F533 HydrophobicContact CB-CB 4.22Å; A509-F533 HydrophobicContact CB-CD2 4.1Å; A509-A536 HydrophobicContact CB-CB 3.93Å
510	L	89	Confident	83.5	Confident	26 Å²	26	65.6 Å²	65.6	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-55.6	-40.2	173.5	-79.4	169.3	0	0	0	112.3	W506 Q507 K514 V528	W506-L510 PolarHBondContact O-N 3.49Å; Q507-L510 PolarHBondContact O-N 3.02Å; L510-K514 WeakPolarHBondContact O-CG 3.19Å; L510-K514 PolarHBondContact O-N 3.39Å; L510-V528 HydrophobicContact CD2-CG2 3.56Å; L510-V528 HydrophobicContact CG-CG2 3.74Å
511	S	87.7	Confident	83.3	Confident	57 Å²	57	68.6 Å²	68.6	40%	0.399	36%	0.359	S	S	.	.	H	α-helix	trans	-67.4	-37.2	177.1	79.3	0	0	0	0	112.6	Q507 M508 A509	Q507-S511 PolarHBondContact O-N 3.39Å; M508-S511 PolarHBondContact O-N 3.14Å; M508-S511 PolarHBondContact O-OG 3.48Å; A509-S511 VanDerWaalsContact C-N 3.26Å; A509-S511 PolarHBondContact O-N 3.5Å
512	L	89	Confident	82.5	Confident	22 Å²	22	66.8 Å²	66.8	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-71.7	-38.6	177.5	-67	174.9	0	0	0	111.6	M508 A509 K514 T515 L516 D535 A536	M508-L512 HydrophobicContact CG-CD1 4.38Å; M508-L512 WeakPolarHBondContact O-CG 3.44Å; M508-L512 PolarHBondContact O-N 3.47Å; M508-L512 VanDerWaalsContact O-N 3.1Å; A509-L512 PolarHBondContact O-N 3.22Å; L512-K514 VanDerWaalsContact C-N 3.31Å; L512-K514 PolarHBondContact O-N 3.14Å; L512-T515 PolarHBondContact O-N 3.49Å; L512-T515 PolarHBondContact O-OG1 3.15Å; L512-L516 PolarHBondContact O-N 3.14Å; L512-D535 HydrophobicContact CD1-CB 4.15Å; L512-A536 HydrophobicContact CD1-CB 4.07Å
513	D	87.5	Confident	81.5	Confident	6 Å²	6	72.7 Å²	72.7	3%	0.032	38%	0.384	C	S	.	.	H	α-helix	trans	-62.5	-37.8	175.7	-94.9	-1.7	0	0	0	112.5	A509 T515 L516 L517 V528 T529 S532	A509-D513 PolarHBondContact O-N 2.91Å; D513-T515 PolarHBondContact O-N 3.07Å; D513-L516 PolarHBondContact O-N 2.97Å; D513-L516 VanDerWaalsContact O-N 3.13Å; D513-L517 HydrophobicContact CB-CD1 4.15Å; D513-L517 WeakPolarHBondContact O-CB 3.28Å; D513-L517 PolarHBondContact O-N 3.44Å; D513-V528 VanDerWaalsContact OD2-CA 3.32Å; D513-V528 WeakPolarHBondContact OD2-CA 3.33Å; D513-T529 PolarHBondContact OD1-OG1 3.33Å; D513-T529 PolarHBondContact OD2-N 2.98Å; D513-S532 WeakPolarHBondContact OD1-CB 3.09Å; D513-S532 PolarHBondContact OD1-OG 3.18Å; D513-S532 PolarHBondContact OD2-OG 3.04Å
514	K	83.6	Confident	80.5	Confident	117 Å²	117	71.8 Å²	71.8	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-56.6	-37.9	172.5	-73.4	176.4	-178	-177.8	0	111.8	L510 L512	L510-K514 WeakPolarHBondContact O-CG 3.19Å; L510-K514 PolarHBondContact O-N 3.39Å; L512-K514 VanDerWaalsContact C-N 3.31Å; L512-K514 PolarHBondContact O-N 3.14Å
515	T	84.2	Confident	79.6	Confident	113 Å²	113	71.4 Å²	71.4	69%	0.693	39%	0.386	S	S	*	.	H	α-helix	trans	-77.2	-33.2	176.8	62.3	0	0	0	0	113.4	L512 D513	L512-T515 PolarHBondContact O-N 3.49Å; L512-T515 PolarHBondContact O-OG1 3.15Å; D513-T515 PolarHBondContact O-N 3.07Å
516	L	82.2	Confident	79.1	Confident	94 Å²	94	78 Å²	78	49%	0.492	42%	0.417	S	S	.	.	H	α-helix	trans	-81	-42.1	-175.9	-102.7	157	0	0	0	113.6	L512 D513	L512-L516 PolarHBondContact O-N 3.14Å; D513-L516 PolarHBondContact O-N 2.97Å; D513-L516 VanDerWaalsContact O-N 3.13Å
517	L	78.9	Confident	79	Confident	41 Å²	41	80 Å²	80	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-93.8	-20	-170.6	-69.1	164	0	0	0	113.7	L477 D513 N519 K520 T529	L477-L517 HydrophobicContact CD2-CD1 4.13Å; D513-L517 HydrophobicContact CB-CD1 4.15Å; D513-L517 WeakPolarHBondContact O-CB 3.28Å; D513-L517 PolarHBondContact O-N 3.44Å; L517-N519 PolarHBondContact O-N 3.39Å; L517-K520 WeakPolarHBondContact O-CB 3.33Å; L517-K520 PolarHBondContact O-N 3.39Å; L517-T529 HydrophobicContact CD1-CG2 4.06Å
518	G	78.5	Confident	79	Confident	39 Å²	39	74 Å²	74	40%	0.402	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	50.5	-121.5	-178.8	0	0	0	0	0	112.2	K520 Q521	G518-K520 PolarHBondContact O-N 2.95Å; G518-K520 VanDerWaalsContact O-N 3.15Å; G518-Q521 PolarHBondContact O-N 3.37Å
519	N	69.7	Low	79.1	Confident	180 Å²	180	71.3 Å²	71.3	96%	0.963	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-67.5	-10.5	-179.5	-61.3	-6.9	0	0	0	114.4	L517 Q521	L517-N519 PolarHBondContact O-N 3.39Å; N519-Q521 VanDerWaalsContact C-N 3.32Å
520	K	66.6	Low	79.1	Confident	165 Å²	165	73.1 Å²	73.1	72%	0.717	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-93	14.2	179.8	-62	-173.9	177.7	-178.7	0	113.3	L517 G518	L517-K520 WeakPolarHBondContact O-CB 3.33Å; L517-K520 PolarHBondContact O-N 3.39Å; G518-K520 PolarHBondContact O-N 2.95Å; G518-K520 VanDerWaalsContact O-N 3.15Å
521	Q	65.6	Low	79.2	Confident	84 Å²	84	73.7 Å²	73.7	39%	0.393	40%	0.397	S	S	.	.			trans	-58	140.4	179.2	-168.5	-173.6	-30.5	0	0	111	G518 N519 T523	G518-Q521 PolarHBondContact O-N 3.37Å; N519-Q521 VanDerWaalsContact C-N 3.32Å; Q521-T523 PolarHBondContact O-N 3.15Å
522	P	64.6	Low	79.4	Confident	21 Å²	21	71 Å²	71	14%	0.136	38%	0.378	C	S	.	.			trans	-59.2	137.2	167.3	23.8	-32.3	0	0	0	110.4	L477 T524 Q527	L477-P522 HydrophobicContact CD1-CB 4.02Å; L477-P522 HydrophobicContact CD1-CG 4.13Å; L477-P522 HydrophobicContact CD2-CG 3.96Å; P522-T524 PolarHBondContact O-N 3.32Å; P522-Q527 HydrophobicContact CB-CB 4.42Å; P522-Q527 HydrophobicContact CG-CB 4.33Å
523	T	64	Low	79.5	Confident	150 Å²	150	69.9 Å²	69.9	92%	0.92	37%	0.372	S	S	*	.	S	Bend	trans	-68	-16.3	174.3	35.1	0	0	0	0	113	Q521	Q521-T523 PolarHBondContact O-N 3.15Å
524	T	67	Low	79.6	Confident	73 Å²	73	72.5 Å²	72.5	45%	0.448	38%	0.383	S	S	.	.	S	Bend	trans	-110.4	125	178.5	36.6	0	0	0	0	110.5	P522 E526	P522-T524 PolarHBondContact O-N 3.32Å; T524-E526 PolarHBondContact O-N 2.94Å
525	D	66.7	Low	79.9	Confident	114 Å²	114	69.3 Å²	69.3	61%	0.61	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	9.5	-179.3	-73.9	-28	0	0	0	115
526	E	79.3	Confident	80.3	Confident	140 Å²	140	63.9 Å²	63.9	65%	0.654	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.6	-171.6	-62.6	-173.1	165.1	0	0	114	T524	T524-E526 PolarHBondContact O-N 2.94Å
527	Q	87	Confident	80.6	Confident	56 Å²	56	60.4 Å²	60.4	26%	0.262	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136.6	-172.7	-65.9	-173.6	-20.7	0	0	112.7	L477 R478 N479 P522	L477-Q527 HydrophobicContact CB-CB 4.12Å; L477-Q527 HydrophobicContact CD2-CB 4.27Å; R478-Q527 WeakPolarHBondContact O-CA 3.35Å; N479-Q527 WeakPolarHBondContact OD1-CG 3.46Å; N479-Q527 PolarHBondContact OD1-NE2 3.27Å; N479-Q527 VanDerWaalsContact OD1-NE2 3.12Å; P522-Q527 HydrophobicContact CB-CB 4.42Å; P522-Q527 HydrophobicContact CG-CB 4.33Å
528	V	89	Confident	81	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	146.1	-179.2	174.2	0	0	0	0	109.3	R478 I483 W506 A509 L510 D513 S532 F533	R478-V528 PolarHBondContact N-O 2.76Å; R478-V528 PolarHBondContact O-N 3.3Å; I483-V528 HydrophobicContact CD1-CB 4.4Å; W506-V528 HydrophobicContact CD2-CG2 4.19Å; W506-V528 HydrophobicContact CE3-CG2 4.47Å; W506-V528 HydrophobicContact CH2-CB 3.8Å; W506-V528 HydrophobicContact CH2-CG2 3.77Å; W506-V528 HydrophobicContact CZ2-CB 4.03Å; W506-V528 HydrophobicContact CZ2-CG2 3.46Å; W506-V528 VanDerWaalsContact CZ2-CG2 3.46Å; W506-V528 HydrophobicContact CZ3-CB 4.17Å; W506-V528 HydrophobicContact CZ3-CG2 4.29Å; A509-V528 HydrophobicContact CB-CG1 3.54Å; L510-V528 HydrophobicContact CD2-CG2 3.56Å; L510-V528 HydrophobicContact CG-CG2 3.74Å; D513-V528 VanDerWaalsContact OD2-CA 3.32Å; D513-V528 WeakPolarHBondContact OD2-CA 3.33Å; V528-S532 WeakPolarHBondContact CG1-OG 3.26Å; V528-F533 HydrophobicContact CG1-CB 4.25Å
529	T	91	Very high	81.5	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	142.2	172.3	71.4	0	0	0	0	111.4	L475 L477 D513 L517 Q531 S532 F533	L475-T529 WeakPolarHBondContact O-CG2 3.37Å; L477-T529 HydrophobicContact CD2-CG2 3.91Å; D513-T529 PolarHBondContact OD1-OG1 3.33Å; D513-T529 PolarHBondContact OD2-N 2.98Å; L517-T529 HydrophobicContact CD1-CG2 4.06Å; T529-Q531 PolarHBondContact O-N 3.5Å; T529-S532 PolarHBondContact O-N 2.79Å; T529-S532 PolarHBondContact O-OG 3.14Å; T529-S532 WeakPolarHBondContact OG1-CB 3.47Å; T529-S532 PolarHBondContact OG1-N 3.46Å; T529-S532 PolarHBondContact OG1-OG 2.94Å; T529-F533 PolarHBondContact O-N 3.49Å
530	L	91.2	Very high	82.3	Confident	38 Å²	38	60.1 Å²	60.1	20%	0.199	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-30.5	177	-173.5	63.3	0	0	0	111.4	L474 F487 F533 K534	L474-L530 HydrophobicContact CD2-CD2 4Å; L474-L530 PolarHBondContact O-N 3.08Å; F487-L530 HydrophobicContact CE2-CD1 4.18Å; L530-F533 PolarHBondContact O-N 3.12Å; L530-K534 VanDerWaalsContact O-CB 3.3Å; L530-K534 WeakPolarHBondContact O-CB 3.45Å; L530-K534 PolarHBondContact O-N 3Å
531	Q	89.7	Confident	83	Confident	37 Å²	37	56 Å²	56	17%	0.173	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-49.4	176.9	-176.9	50.8	31.1	0	0	112.5	L474 L475 T529 F533 K534 D535	L474-Q531 HydrophobicContact CB-CB 4.13Å; L474-Q531 PolarHBondContact O-N 3.39Å; L475-Q531 HydrophobicContact CD2-CB 4.21Å; T529-Q531 PolarHBondContact O-N 3.5Å; Q531-F533 VanDerWaalsContact C-N 3.3Å; Q531-F533 PolarHBondContact O-N 3.23Å; Q531-K534 PolarHBondContact O-N 3.21Å; Q531-D535 PolarHBondContact NE2-OD1 3.05Å; Q531-D535 PolarHBondContact NE2-OD2 3.4Å; Q531-D535 WeakPolarHBondContact O-CB 3.45Å; Q531-D535 PolarHBondContact O-N 3.05Å
532	S	91.5	Very high	83.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-33.8	177.3	62.9	0	0	0	0	112	D513 V528 T529 D535 A536	D513-S532 WeakPolarHBondContact OD1-CB 3.09Å; D513-S532 PolarHBondContact OD1-OG 3.18Å; D513-S532 PolarHBondContact OD2-OG 3.04Å; V528-S532 WeakPolarHBondContact CG1-OG 3.26Å; T529-S532 PolarHBondContact O-N 2.79Å; T529-S532 PolarHBondContact O-OG 3.14Å; T529-S532 WeakPolarHBondContact OG1-CB 3.47Å; T529-S532 PolarHBondContact OG1-N 3.46Å; T529-S532 PolarHBondContact OG1-OG 2.94Å; S532-D535 PolarHBondContact O-N 3.32Å; S532-A536 WeakPolarHBondContact O-CB 3.43Å; S532-A536 PolarHBondContact O-N 3.47Å
533	F	91.9	Very high	84.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-45.6	174	-168.1	-90.2	0	0	0	112.1	I483 F487 F496 F502 V505 W506 A509 V528 T529 L530 Q531 A536 L537	I483-F533 HydrophobicContact CG2-CD1 4.05Å; I483-F533 HydrophobicContact CG2-CD2 4.26Å; I483-F533 HydrophobicContact CG2-CE1 3.94Å; I483-F533 HydrophobicContact CG2-CE2 4.16Å; I483-F533 HydrophobicContact CG2-CG 4.21Å; I483-F533 HydrophobicContact CG2-CZ 4Å; F487-F533 HydrophobicContact CD2-CE1 4.31Å; F487-F533 HydrophobicContact CE1-CE1 4.19Å; F487-F533 AromaticContact CE2-CD1 3.71Å; F487-F533 HydrophobicContact CE2-CD1 3.71Å; F487-F533 AromaticContact CE2-CE1 3.54Å; F487-F533 HydrophobicContact CE2-CE1 3.54Å; F487-F533 AromaticContact CZ-CD1 3.7Å; F487-F533 HydrophobicContact CZ-CD1 3.7Å; F487-F533 AromaticContact CZ-CE1 3.47Å; F487-F533 HydrophobicContact CZ-CE1 3.47Å; F487-F533 VanDerWaalsContact CZ-CE1 3.47Å; F496-F533 HydrophobicContact CE1-CE1 4.46Å; F496-F533 HydrophobicContact CE1-CZ 4.17Å; F496-F533 HydrophobicContact CZ-CE1 4.19Å; F496-F533 HydrophobicContact CZ-CZ 4.16Å; F502-F533 HydrophobicContact CD2-CZ 4.02Å; F502-F533 HydrophobicContact CE2-CE1 4.5Å; F502-F533 AromaticContact CE2-CE2 3.99Å; F502-F533 HydrophobicContact CE2-CE2 3.99Å; F502-F533 AromaticContact CE2-CZ 3.52Å; F502-F533 HydrophobicContact CE2-CZ 3.52Å; F502-F533 HydrophobicContact CZ-CE2 4.03Å; F502-F533 HydrophobicContact CZ-CZ 4.05Å; V505-F533 HydrophobicContact CB-CE2 4.17Å; V505-F533 HydrophobicContact CB-CZ 4.2Å; V505-F533 HydrophobicContact CG1-CD1 4.43Å; V505-F533 HydrophobicContact CG1-CD2 4.08Å; V505-F533 HydrophobicContact CG1-CE1 4.05Å; V505-F533 HydrophobicContact CG1-CE2 3.67Å; V505-F533 HydrophobicContact CG1-CG 4.45Å; V505-F533 HydrophobicContact CG1-CZ 3.65Å; W506-F533 HydrophobicContact CE3-CD2 4.08Å; W506-F533 AromaticContact CE3-CE2 3.92Å; W506-F533 HydrophobicContact CE3-CE2 3.92Å; W506-F533 HydrophobicContact CZ3-CD2 4.49Å; A509-F533 HydrophobicContact CB-CB 4.22Å; A509-F533 HydrophobicContact CB-CD2 4.1Å; V528-F533 HydrophobicContact CG1-CB 4.25Å; T529-F533 PolarHBondContact O-N 3.49Å; L530-F533 PolarHBondContact O-N 3.12Å; Q531-F533 VanDerWaalsContact C-N 3.3Å; Q531-F533 PolarHBondContact O-N 3.23Å; F533-A536 WeakPolarHBondContact O-CB 3.33Å; F533-A536 PolarHBondContact O-N 2.92Å; F533-L537 HydrophobicContact CE1-CD1 4.4Å; F533-L537 WeakPolarHBondContact O-CB 3.5Å; F533-L537 PolarHBondContact O-N 2.97Å
534	K	89.7	Confident	84.9	Confident	61 Å²	61	55 Å²	55	27%	0.265	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-47.9	174.2	-172.6	-164.2	81	-166	0	111.2	L530 Q531 A536 L537 F538	L530-K534 VanDerWaalsContact O-CB 3.3Å; L530-K534 WeakPolarHBondContact O-CB 3.45Å; L530-K534 PolarHBondContact O-N 3Å; Q531-K534 PolarHBondContact O-N 3.21Å; K534-A536 VanDerWaalsContact C-N 3.33Å; K534-A536 PolarHBondContact O-N 3.44Å; K534-L537 PolarHBondContact O-N 3.35Å; K534-F538 HydrophobicContact CD-CE2 4.1Å; K534-F538 HydrophobicContact CG-CD2 3.87Å; K534-F538 HydrophobicContact CG-CE2 3.65Å; K534-F538 VanDerWaalsContact O-CD2 3.25Å; K534-F538 WeakPolarHBondContact O-CD2 3.32Å; K534-F538 PolarHBondContact O-N 3.33Å
535	D	90.9	Very high	85	Confident	49 Å²	49	55 Å²	55	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-35.9	-177.8	-65.8	-11	0	0	0	111.7	L512 Q531 S532 K539	L512-D535 HydrophobicContact CD1-CB 4.15Å; Q531-D535 PolarHBondContact NE2-OD1 3.05Å; Q531-D535 PolarHBondContact NE2-OD2 3.4Å; Q531-D535 WeakPolarHBondContact O-CB 3.45Å; Q531-D535 PolarHBondContact O-N 3.05Å; S532-D535 PolarHBondContact O-N 3.32Å; D535-K539 WeakPolarHBondContact O-CB 3.28Å; D535-K539 WeakPolarHBondContact O-CG 3.19Å; D535-K539 PolarHBondContact O-N 2.82Å
536	A	91.1	Very high	84.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-44.3	171.8	0	0	0	0	0	112	V505 M508 A509 L512 S532 F533 K534 K539 L540	V505-A536 HydrophobicContact CG1-CB 4.05Å; M508-A536 HydrophobicContact CB-CB 3.81Å; M508-A536 HydrophobicContact CG-CB 3.44Å; M508-A536 VanDerWaalsContact CG-CB 3.44Å; A509-A536 HydrophobicContact CB-CB 3.93Å; L512-A536 HydrophobicContact CD1-CB 4.07Å; S532-A536 WeakPolarHBondContact O-CB 3.43Å; S532-A536 PolarHBondContact O-N 3.47Å; F533-A536 WeakPolarHBondContact O-CB 3.33Å; F533-A536 PolarHBondContact O-N 2.92Å; K534-A536 VanDerWaalsContact C-N 3.33Å; K534-A536 PolarHBondContact O-N 3.44Å; A536-K539 PolarHBondContact O-N 3.43Å; A536-L540 WeakPolarHBondContact O-CB 3.48Å; A536-L540 WeakPolarHBondContact O-CG 3.39Å; A536-L540 PolarHBondContact O-N 2.91Å
537	L	88.9	Confident	84	Confident	20 Å²	20	53.8 Å²	53.8	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-46.4	179.1	-171.4	143.2	0	0	0	111.3	F487 L495 F496 V505 F533 K534 K539 L540 H541	F487-L537 HydrophobicContact CE1-CD1 4.07Å; F487-L537 HydrophobicContact CZ-CD1 4.48Å; L495-L537 HydrophobicContact CD1-CD1 4.38Å; L495-L537 HydrophobicContact CD1-CD2 4.4Å; F496-L537 HydrophobicContact CE1-CD1 4.06Å; F496-L537 HydrophobicContact CZ-CD1 4.26Å; V505-L537 HydrophobicContact CG1-CB 4.01Å; F533-L537 HydrophobicContact CE1-CD1 4.4Å; F533-L537 WeakPolarHBondContact O-CB 3.5Å; F533-L537 PolarHBondContact O-N 2.97Å; K534-L537 PolarHBondContact O-N 3.35Å; L537-K539 PolarHBondContact O-N 3.32Å; L537-L540 PolarHBondContact O-N 2.58Å; L537-H541 WeakPolarHBondContact O-CB 3.32Å; L537-H541 PolarHBondContact O-N 2.74Å
538	F	87.5	Confident	82.6	Confident	133 Å²	133	57.8 Å²	57.8	58%	0.583	27%	0.274	S	S	*	.	H	α-helix	trans	-63.4	-40.6	176.7	-82.7	-66.1	0	0	0	113.1	K534 K542	K534-F538 HydrophobicContact CD-CE2 4.1Å; K534-F538 HydrophobicContact CG-CD2 3.87Å; K534-F538 HydrophobicContact CG-CE2 3.65Å; K534-F538 VanDerWaalsContact O-CD2 3.25Å; K534-F538 WeakPolarHBondContact O-CD2 3.32Å; K534-F538 PolarHBondContact O-N 3.33Å; F538-K542 WeakPolarHBondContact O-CB 3.4Å; F538-K542 PolarHBondContact O-N 3.06Å
539	K	88.5	Confident	81.1	Confident	106 Å²	106	64.8 Å²	64.8	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-48	176.7	-79.8	-179.7	177.7	178.5	0	111.5	D535 A536 L537 H541 K542 D543	D535-K539 WeakPolarHBondContact O-CB 3.28Å; D535-K539 WeakPolarHBondContact O-CG 3.19Å; D535-K539 PolarHBondContact O-N 2.82Å; A536-K539 PolarHBondContact O-N 3.43Å; L537-K539 PolarHBondContact O-N 3.32Å; K539-H541 PolarHBondContact O-N 3.38Å; K539-K542 PolarHBondContact O-N 3.07Å; K539-D543 VanDerWaalsContact O-CG 3.29Å; K539-D543 PolarHBondContact O-N 3.29Å
540	L	86.4	Confident	79.4	Confident	15 Å²	15	74.9 Å²	74.9	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-35.7	-178.8	-74	169.3	0	0	0	112.8	L500 K504 V505 M508 A536 L537 D543 S544	L500-L540 HydrophobicContact CD2-CB 3.63Å; L500-L540 HydrophobicContact CG-CB 4.36Å; K504-L540 HydrophobicContact CD-CD2 4.44Å; K504-L540 HydrophobicContact CG-CD1 4.32Å; V505-L540 HydrophobicContact CB-CD1 4.24Å; V505-L540 HydrophobicContact CG2-CD1 3.79Å; M508-L540 HydrophobicContact CB-CD1 4.19Å; M508-L540 HydrophobicContact CE-CD2 4.32Å; M508-L540 HydrophobicContact CG-CD1 4.49Å; A536-L540 WeakPolarHBondContact O-CB 3.48Å; A536-L540 WeakPolarHBondContact O-CG 3.39Å; A536-L540 PolarHBondContact O-N 2.91Å; L537-L540 PolarHBondContact O-N 2.58Å; L540-D543 PolarHBondContact O-N 2.99Å; L540-S544 PolarHBondContact O-N 2.82Å; L540-S544 PolarHBondContact O-OG 3.38Å
541	H	81.9	Confident	77.2	Confident	78 Å²	78	80.4 Å²	80.4	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-67.8	-40.7	175.1	-162.5	-49.6	0	0	0	111.8	L537 K539 D543 S544 D545	L537-H541 WeakPolarHBondContact O-CB 3.32Å; L537-H541 PolarHBondContact O-N 2.74Å; K539-H541 PolarHBondContact O-N 3.38Å; H541-D543 VanDerWaalsContact C-N 3.28Å; H541-D543 PolarHBondContact O-N 3.29Å; H541-S544 WeakPolarHBondContact CA-OG 3.46Å; H541-S544 PolarHBondContact O-N 3Å; H541-S544 PolarHBondContact O-OG 3.08Å; H541-D545 IonicContact CE1-OD1 3.48Å; H541-D545 PolarHBondContact CE1-OD1 3.13Å; H541-D545 IonicContact CE1-OD2 3.93Å; H541-D545 IonicContact ND1-OD1 3.66Å; H541-D545 PolarHBondContact ND1-OD1 3.12Å; H541-D545 IonicContact ND1-OD2 2.82Å; H541-D545 PolarHBondContact ND1-OD2 3.27Å; H541-D545 PolarHBondContact O-N 3.37Å; H541-D545 VanDerWaalsContact O-N 3.08Å
542	K	82.1	Confident	76.6	Confident	132 Å²	132	82.6 Å²	82.6	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-63.5	-37.5	175.2	-172.3	179.1	179.6	179.9	0	111.7	F538 K539 Q546	F538-K542 WeakPolarHBondContact O-CB 3.4Å; F538-K542 PolarHBondContact O-N 3.06Å; K539-K542 PolarHBondContact O-N 3.07Å; K542-Q546 WeakPolarHBondContact O-CG 3.47Å; K542-Q546 PolarHBondContact O-N 3.3Å; K542-Q546 VanDerWaalsContact O-N 3.13Å
543	D	79.5	Confident	75.8	Confident	84 Å²	84	86.9 Å²	86.9	45%	0.449	42%	0.424	S	S	.	.	H	α-helix	trans	-69.1	-34.7	177.4	-69.9	-17.5	0	0	0	112.1	K539 L540 H541 Q547	K539-D543 VanDerWaalsContact O-CG 3.29Å; K539-D543 PolarHBondContact O-N 3.29Å; L540-D543 PolarHBondContact O-N 2.99Å; H541-D543 VanDerWaalsContact C-N 3.28Å; H541-D543 PolarHBondContact O-N 3.29Å; D543-Q547 WeakPolarHBondContact O-CG 3.43Å; D543-Q547 PolarHBondContact O-N 3.44Å; D543-Q547 VanDerWaalsContact O-N 3.14Å
544	S	72.9	Confident	74.9	Confident	19 Å²	19	91.8 Å²	91.8	13%	0.133	45%	0.447	C	S	.	.	H	α-helix	trans	-68.3	-43.3	174.1	51.1	0	0	0	0	112.4	L540 H541 Q546 Q547 E548	L540-S544 PolarHBondContact O-N 2.82Å; L540-S544 PolarHBondContact O-OG 3.38Å; H541-S544 WeakPolarHBondContact CA-OG 3.46Å; H541-S544 PolarHBondContact O-N 3Å; H541-S544 PolarHBondContact O-OG 3.08Å; S544-Q546 VanDerWaalsContact C-N 3.3Å; S544-Q546 PolarHBondContact O-N 3.34Å; S544-Q547 PolarHBondContact O-N 3.47Å; S544-Q547 VanDerWaalsContact O-N 3.12Å; S544-E548 PolarHBondContact O-N 3.2Å; S544-E548 VanDerWaalsContact O-N 3.08Å
545	D	68.7	Low	74	Confident	72 Å²	72	93.6 Å²	93.6	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-38.8	179	-58.7	-20.5	0	0	0	110.8	H541 Q547 E548 D549	H541-D545 IonicContact CE1-OD1 3.48Å; H541-D545 PolarHBondContact CE1-OD1 3.13Å; H541-D545 IonicContact CE1-OD2 3.93Å; H541-D545 IonicContact ND1-OD1 3.66Å; H541-D545 PolarHBondContact ND1-OD1 3.12Å; H541-D545 IonicContact ND1-OD2 2.82Å; H541-D545 PolarHBondContact ND1-OD2 3.27Å; H541-D545 PolarHBondContact O-N 3.37Å; H541-D545 VanDerWaalsContact O-N 3.08Å; D545-Q547 VanDerWaalsContact C-N 3.34Å; D545-Q547 PolarHBondContact O-N 3.34Å; D545-E548 PolarHBondContact O-N 3.24Å; D545-D549 PolarHBondContact O-N 3.24Å; D545-D549 VanDerWaalsContact O-N 3.08Å
546	Q	65.5	Low	73	Confident	90 Å²	90	96.4 Å²	96.4	42%	0.421	47%	0.47	S	S	.	.	H	α-helix	trans	-72.3	-22.6	175.8	-71.7	-157.6	-2.5	0	0	114.5	K542 S544 R550	K542-Q546 WeakPolarHBondContact O-CG 3.47Å; K542-Q546 PolarHBondContact O-N 3.3Å; K542-Q546 VanDerWaalsContact O-N 3.13Å; S544-Q546 VanDerWaalsContact C-N 3.3Å; S544-Q546 PolarHBondContact O-N 3.34Å; Q546-R550 WeakPolarHBondContact O-CB 3.37Å; Q546-R550 VanDerWaalsContact O-CG 3.27Å; Q546-R550 WeakPolarHBondContact O-CG 3.44Å; Q546-R550 PolarHBondContact O-N 2.9Å
547	Q	58.4	Low	71.7	Confident	140 Å²	140	102.8 Å²	102.8	65%	0.654	50%	0.502	S	S	*	.	H	α-helix	trans	-77.5	-33.6	172.4	-80.7	-177.3	-36.9	0	0	111.6	D543 S544 D545 R550 S551	D543-Q547 WeakPolarHBondContact O-CG 3.43Å; D543-Q547 PolarHBondContact O-N 3.44Å; D543-Q547 VanDerWaalsContact O-N 3.14Å; S544-Q547 PolarHBondContact O-N 3.47Å; S544-Q547 VanDerWaalsContact O-N 3.12Å; D545-Q547 VanDerWaalsContact C-N 3.34Å; D545-Q547 PolarHBondContact O-N 3.34Å; Q547-R550 PolarHBondContact O-N 3.07Å; Q547-S551 PolarHBondContact O-N 3.12Å; Q547-S551 PolarHBondContact O-OG 2.92Å
548	E	58.5	Low	70.5	Confident	139 Å²	139	108.7 Å²	108.7	65%	0.65	53%	0.53	S	S	*	.	H	α-helix	trans	-68.4	-40	172.3	-72.5	-173.7	170.8	0	0	112	S544 D545 R550 S551	S544-E548 PolarHBondContact O-N 3.2Å; S544-E548 VanDerWaalsContact O-N 3.08Å; D545-E548 PolarHBondContact O-N 3.24Å; E548-R550 VanDerWaalsContact C-N 3.25Å; E548-R550 PolarHBondContact O-N 2.86Å; E548-S551 PolarHBondContact O-N 3.43Å
549	D	58.4	Low	69.2	Low	147 Å²	147	106.8 Å²	106.8	79%	0.786	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.8	176.6	-82	-18.2	0	0	0	114.4	D545	D545-D549 PolarHBondContact O-N 3.24Å; D545-D549 VanDerWaalsContact O-N 3.08Å
550	R	54.2	Low	67.6	Low	212 Å²	212	106.9 Å²	106.9	80%	0.8	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-6.6	178.4	-75.2	-178	-179.9	-170.3	4	113.7	Q546 Q547 E548	Q546-R550 WeakPolarHBondContact O-CB 3.37Å; Q546-R550 VanDerWaalsContact O-CG 3.27Å; Q546-R550 WeakPolarHBondContact O-CG 3.44Å; Q546-R550 PolarHBondContact O-N 2.9Å; Q547-R550 PolarHBondContact O-N 3.07Å; E548-R550 VanDerWaalsContact C-N 3.25Å; E548-R550 PolarHBondContact O-N 2.86Å
551	S	44.9	Very low	65.9	Low	155 Å²	155	115.3 Å²	115.3	100%	1.084	57%	0.572	S	S	*	*			trans	-96.2	0	175.5	-56.3	0	0	0	0	109.9	Q547 E548	Q547-S551 PolarHBondContact O-N 3.12Å; Q547-S551 PolarHBondContact O-OG 2.92Å; E548-S551 PolarHBondContact O-N 3.43Å

Retrieved 551 of 551 residues in 171.2 ms (Link to these results)

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