A0A087XPG3_POEFO Loading...

Glucosidase 2 subunit beta

AlphaFold DB , UniProt , Accession A0A087XPG3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 532 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	43.5	Very low	235 Å²	235	152.1 Å²	152.1	100%	1.158	81%	0.807	S	S	*	*				0	139.2	0	-162.7	158.7	175.9	0	0	107
2	V	39.6	Very low	43.6	Very low	129 Å²	129	153.1 Å²	153.1	78%	0.782	81%	0.811	S	S	*	*			trans	-25.2	149.4	170	-111.6	0	0	0	0	115.4
3	M	39	Very low	44	Very low	169 Å²	169	153.1 Å²	153.1	83%	0.833	81%	0.809	S	S	*	*			cis	-142.6	152.1	28.1	-59	179.8	77.9	0	0	115.2
4	F	41.6	Very low	44.2	Very low	189 Å²	189	147.5 Å²	147.5	83%	0.829	81%	0.806	S	S	*	*			trans	-90.7	120.2	153.3	-98.4	-102.1	0	0	0	108.8	H6	F4-H6 PolarHBondContact O-N 3.3Å
5	G	43.6	Very low	44.2	Very low	75 Å²	75	141.7 Å²	141.7	77%	0.773	79%	0.794	S	S	*	*			trans	-79.5	111.2	172.6	0	0	0	0	0	111.2
6	H	44.9	Very low	44.3	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.745	80%	0.798	S	S	*	*			trans	-87.2	112	169.2	-78.7	44	0	0	0	109.4	F4 V8	F4-H6 PolarHBondContact O-N 3.3Å; H6-V8 PolarHBondContact O-N 2.81Å
7	F	47.9	Very low	44.2	Very low	202 Å²	202	141.7 Å²	141.7	89%	0.886	80%	0.803	S	S	*	*			trans	-88.2	94.6	173.4	-152.2	-89.1	0	0	0	108.9	L9	F7-L9 PolarHBondContact O-N 3.28Å
8	V	49	Very low	44.4	Very low	117 Å²	117	138.4 Å²	138.4	71%	0.709	79%	0.791	S	S	*	*			trans	-76.6	104.8	-179.8	178.9	0	0	0	0	109.2	H6 L10	H6-V8 PolarHBondContact O-N 2.81Å; V8-L10 PolarHBondContact O-N 3.18Å; V8-L10 VanDerWaalsContact O-N 3.17Å
9	L	45.1	Very low	44.8	Very low	141 Å²	141	135.6 Å²	135.6	74%	0.738	79%	0.786	S	S	*	*			trans	-75	101.2	172.3	-168.4	76.3	0	0	0	109.3	F7 V11	F7-L9 PolarHBondContact O-N 3.28Å; L9-V11 HydrophobicContact CD2-CG2 4.43Å; L9-V11 PolarHBondContact O-N 2.96Å
10	L	43.2	Very low	45.5	Very low	150 Å²	150	137.2 Å²	137.2	79%	0.785	79%	0.786	S	S	*	*			trans	-72.8	93.2	175.5	-109.8	165	0	0	0	109.9	V8 L12	V8-L10 PolarHBondContact O-N 3.18Å; V8-L10 VanDerWaalsContact O-N 3.17Å; L10-L12 PolarHBondContact O-N 3.08Å; L10-L12 VanDerWaalsContact O-N 3.1Å
11	V	46.8	Very low	46.7	Very low	105 Å²	105	133.2 Å²	133.2	64%	0.636	76%	0.764	S	S	*	*			trans	-71	101.5	170.3	-180	0	0	0	0	108.3	L9 I13	L9-V11 HydrophobicContact CD2-CG2 4.43Å; L9-V11 PolarHBondContact O-N 2.96Å; V11-I13 HydrophobicContact CG1-CG1 4.18Å; V11-I13 PolarHBondContact O-N 2.75Å
12	L	45.1	Very low	48.6	Very low	164 Å²	164	129 Å²	129	86%	0.859	74%	0.742	S	S	*	*			trans	-69.2	96.4	166.9	-79.7	167.6	0	0	0	108.7	L10 G14	L10-L12 PolarHBondContact O-N 3.08Å; L10-L12 VanDerWaalsContact O-N 3.1Å; L12-G14 PolarHBondContact O-N 2.78Å
13	I	49.2	Very low	50.9	Low	153 Å²	153	125.7 Å²	125.7	79%	0.785	72%	0.715	S	S	*	*			trans	-70.2	89.1	165.3	-56.8	177.6	0	0	0	106.7	V11 G15	V11-I13 HydrophobicContact CG1-CG1 4.18Å; V11-I13 PolarHBondContact O-N 2.75Å; I13-G15 VanDerWaalsContact C-N 3.25Å; I13-G15 PolarHBondContact O-N 3.34Å
14	G	46.7	Very low	53.3	Low	75 Å²	75	118.5 Å²	118.5	77%	0.773	68%	0.681	S	S	*	*			trans	-67.7	86.4	168.2	0	0	0	0	0	109.1	L12 A16	L12-G14 PolarHBondContact O-N 2.78Å; G14-A16 PolarHBondContact O-N 2.85Å; G14-A16 VanDerWaalsContact O-N 3.16Å
15	G	43.7	Very low	55.7	Low	60 Å²	60	114.4 Å²	114.4	62%	0.619	66%	0.66	S	S	*	*			trans	-62.6	114.1	172.8	0	0	0	0	0	109.4	I13 M17	I13-G15 VanDerWaalsContact C-N 3.25Å; I13-G15 PolarHBondContact O-N 3.34Å; G15-M17 PolarHBondContact O-N 3.11Å
16	A	45.5	Very low	57.9	Low	104 Å²	104	111.3 Å²	111.3	86%	0.86	63%	0.628	S	S	*	*			trans	-65.4	101.7	169.2	0	0	0	0	0	108.2	G14 S18	G14-A16 PolarHBondContact O-N 2.85Å; G14-A16 VanDerWaalsContact O-N 3.16Å; A16-S18 PolarHBondContact O-N 3.46Å
17	M	42.3	Very low	60.2	Low	180 Å²	180	103.7 Å²	103.7	89%	0.887	59%	0.593	S	S	*	*			trans	-75.2	109.2	166.9	-72.6	-171	154.4	0	0	107.4	G15 A19	G15-M17 PolarHBondContact O-N 3.11Å; M17-A19 PolarHBondContact O-N 3.31Å
18	S	48.3	Very low	62.3	Low	83 Å²	83	94.5 Å²	94.5	58%	0.58	55%	0.553	S	S	*	*			trans	-61.3	120.6	166.2	-159.6	0	0	0	0	107.4	A16 E20	A16-S18 PolarHBondContact O-N 3.46Å; S18-E20 VanDerWaalsContact C-N 3.28Å; S18-E20 PolarHBondContact O-N 3.15Å; S18-E20 VanDerWaalsContact O-N 3.09Å
19	A	52.5	Low	64.2	Low	85 Å²	85	91.7 Å²	91.7	70%	0.702	53%	0.534	S	S	*	.			trans	-87.1	73.8	-176.6	0	0	0	0	0	108.9	M17 V21	M17-A19 PolarHBondContact O-N 3.31Å; A19-V21 WeakPolarHBondContact O-CG2 3.42Å; A19-V21 PolarHBondContact O-N 3.37Å; A19-V21 VanDerWaalsContact O-N 3.16Å
20	E	58.2	Low	66.4	Low	166 Å²	166	89.5 Å²	89.5	78%	0.776	53%	0.53	S	S	*	.			trans	-52.5	120	-175	-169.3	175.1	177.5	0	0	111	S18 Q22	S18-E20 VanDerWaalsContact C-N 3.28Å; S18-E20 PolarHBondContact O-N 3.15Å; S18-E20 VanDerWaalsContact O-N 3.09Å; E20-Q22 PolarHBondContact O-N 2.84Å; E20-Q22 VanDerWaalsContact O-N 3.07Å
21	V	70.4	Confident	68.6	Low	54 Å²	54	86.3 Å²	86.3	33%	0.327	51%	0.51	S	S	.	.			trans	-84.1	91.8	-165.5	176.1	0	0	0	0	109.7	A19 R23 L29 R32	A19-V21 WeakPolarHBondContact O-CG2 3.42Å; A19-V21 PolarHBondContact O-N 3.37Å; A19-V21 VanDerWaalsContact O-N 3.16Å; V21-R23 WeakPolarHBondContact O-CG 3.25Å; V21-R23 PolarHBondContact O-N 2.64Å; V21-L29 HydrophobicContact CB-CD2 3.71Å; V21-L29 HydrophobicContact CG1-CD2 3.58Å; V21-L29 HydrophobicContact CG2-CD2 4.41Å; V21-R32 VanDerWaalsContact CG1-CD 3.42Å
22	Q	77.3	Confident	70.7	Confident	148 Å²	148	86.6 Å²	86.6	69%	0.692	50%	0.5	S	S	*	.			trans	-55.1	123.1	-178.4	-70.2	-169.1	-38.3	0	0	112.5	E20 R32	E20-Q22 PolarHBondContact O-N 2.84Å; E20-Q22 VanDerWaalsContact O-N 3.07Å; Q22-R32 PolarHBondContact O-NE 3.36Å; Q22-R32 PolarHBondContact O-NH2 2.97Å
23	R	87.9	Confident	72.9	Confident	58 Å²	58	85 Å²	85	22%	0.219	49%	0.488	C	S	.	.			trans	-152	154.2	-176.1	57.4	-176.7	163.8	167.5	-17.4	108.2	V21 V27 L29 R32 T82 E531	V21-R23 WeakPolarHBondContact O-CG 3.25Å; V21-R23 PolarHBondContact O-N 2.64Å; R23-V27 VanDerWaalsContact CD-O 3.3Å; R23-V27 WeakPolarHBondContact CD-O 3.43Å; R23-V27 PolarHBondContact NH1-O 3.36Å; R23-L29 VanDerWaalsContact NH1-N 3.16Å; R23-R32 HydrophobicContact CB-CG 4.24Å; R23-T82 PolarHBondContact NH2-OG1 3.03Å; R23-E531 IonicContact CZ-OE2 2.78Å; R23-E531 VanDerWaalsContact CZ-OE2 3.25Å; R23-E531 IonicContact NH1-OE1 3.58Å; R23-E531 IonicContact NH1-OE2 3.82Å; R23-E531 PolarHBondContact NH1-OE2 2.68Å; R23-E531 IonicContact NH2-OE2 3.34Å; R23-E531 PolarHBondContact NH2-OE2 2.92Å
24	P	90.6	Very high	74.8	Confident	19 Å²	19	82.4 Å²	82.4	12%	0.123	47%	0.471	C	S	.	.			trans	-60.1	156.1	169.1	-22.7	34.3	0	0	0	112.1	V27 Y35 F52 V55	P24-V27 HydrophobicContact CB-CG2 3.99Å; P24-V27 HydrophobicContact CG-CG2 4.39Å; P24-V27 PolarHBondContact O-N 2.9Å; P24-Y35 HydrophobicContact CG-CD1 4.16Å; P24-Y35 HydrophobicContact CG-CG 4.23Å; P24-F52 HydrophobicContact CG-CZ 4Å; P24-V55 HydrophobicContact CB-CG1 4.24Å; P24-V55 HydrophobicContact CG-CG1 4.2Å
25	R	91.3	Very high	77	Confident	103 Å²	103	79.5 Å²	79.5	39%	0.389	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	142.4	175.6	-171.7	-169.8	-66.3	-85.4	0.5	110.2	V27 G70 F79 T107 Y110	R25-V27 PolarHBondContact O-N 3.08Å; R25-G70 WeakPolarHBondContact CD-O 3.3Å; R25-G70 WeakPolarHBondContact O-CA 3.36Å; R25-G70 PolarHBondContact O-N 2.79Å; R25-F79 HydrophobicContact CG-CE2 3.6Å; R25-F79 HydrophobicContact CG-CZ 3.78Å; R25-T107 PolarHBondContact NH1-O 3.32Å; R25-Y110 VanDerWaalsContact CD-CD1 3.5Å; R25-Y110 VanDerWaalsContact NH1-CB 3.29Å
26	G	90.9	Very high	79.2	Confident	9 Å²	9	81 Å²	81	9%	0.093	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	5.8	175.4	0	0	0	0	0	115.7	P69 H80	G26-P69 WeakPolarHBondContact CA-O 3.5Å; G26-H80 WeakPolarHBondContact O-CB 3.36Å; G26-H80 PolarHBondContact O-N 3.24Å
27	V	92.8	Very high	81.1	Confident	2 Å²	2	82.7 Å²	82.7	1%	0.012	42%	0.418	C	S	.	.			trans	-92.4	130.7	174.5	-180	0	0	0	0	110.4	R23 P24 R25 K31 Y35 P69	R23-V27 VanDerWaalsContact CD-O 3.3Å; R23-V27 WeakPolarHBondContact CD-O 3.43Å; R23-V27 PolarHBondContact NH1-O 3.36Å; P24-V27 HydrophobicContact CB-CG2 3.99Å; P24-V27 HydrophobicContact CG-CG2 4.39Å; P24-V27 PolarHBondContact O-N 2.9Å; R25-V27 PolarHBondContact O-N 3.08Å; V27-K31 HydrophobicContact CG1-CB 3.94Å; V27-Y35 HydrophobicContact CB-CD2 4.46Å; V27-Y35 HydrophobicContact CB-CE2 4.45Å; V27-Y35 HydrophobicContact CG1-CD2 3.58Å; V27-Y35 HydrophobicContact CG1-CE2 3.66Å; V27-Y35 HydrophobicContact CG1-CG 4.37Å; V27-Y35 HydrophobicContact CG2-CD1 4.2Å; V27-Y35 HydrophobicContact CG2-CD2 3.95Å; V27-Y35 HydrophobicContact CG2-CE1 4.07Å; V27-Y35 HydrophobicContact CG2-CE2 3.85Å; V27-Y35 HydrophobicContact CG2-CG 4.12Å; V27-P69 HydrophobicContact CG2-CB 3.93Å; V27-P69 HydrophobicContact CG2-CG 3.55Å
28	P	91.9	Very high	83.3	Confident	8 Å²	8	80 Å²	80	5%	0.052	41%	0.407	C	S	.	.			trans	-74.2	154.3	171.2	32.2	-37.4	0	0	0	111.7	S30 K31 R32 F90	P28-S30 PolarHBondContact O-N 3.15Å; P28-S30 VanDerWaalsContact O-N 3.15Å; P28-K31 HydrophobicContact CG-CB 3.85Å; P28-K31 HydrophobicContact CG-CD 3.86Å; P28-K31 HydrophobicContact CG-CG 3.75Å; P28-K31 PolarHBondContact O-N 3.44Å; P28-R32 PolarHBondContact O-N 3.11Å; P28-F90 HydrophobicContact CB-CZ 4.15Å; P28-F90 HydrophobicContact CG-CE1 4.31Å; P28-F90 HydrophobicContact CG-CZ 3.97Å
29	L	89.3	Confident	85.4	Confident	59 Å²	59	80.3 Å²	80.3	31%	0.309	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-58.6	-35.3	-177.2	-70.6	177.5	0	0	0	112.1	V21 R23 K31 R32 E531	V21-L29 HydrophobicContact CB-CD2 3.71Å; V21-L29 HydrophobicContact CG1-CD2 3.58Å; V21-L29 HydrophobicContact CG2-CD2 4.41Å; R23-L29 VanDerWaalsContact NH1-N 3.16Å; L29-K31 PolarHBondContact O-N 3.07Å; L29-R32 WeakPolarHBondContact O-CB 3.32Å; L29-R32 PolarHBondContact O-N 3Å; L29-R32 VanDerWaalsContact O-N 3.11Å; L29-E531 VanDerWaalsContact CB-OE1 3.23Å; L29-E531 WeakPolarHBondContact CB-OE1 3.49Å; L29-E531 HydrophobicContact CD1-CB 3.99Å; L29-E531 HydrophobicContact CD1-CG 3.68Å; L29-E531 VanDerWaalsContact CG-CD 3.44Å; L29-E531 HydrophobicContact CG-CG 4.12Å; L29-E531 VanDerWaalsContact CG-OE1 3.27Å; L29-E531 WeakPolarHBondContact CG-OE1 3.25Å; L29-E531 PolarHBondContact N-OE1 2.66Å
30	S	89.6	Confident	87.3	Confident	94 Å²	94	80.4 Å²	80.4	66%	0.657	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-59.8	-22.8	175.9	58.5	0	0	0	0	114.6	P28	P28-S30 PolarHBondContact O-N 3.15Å; P28-S30 VanDerWaalsContact O-N 3.15Å
31	K	90.9	Very high	89	Confident	84 Å²	84	72.7 Å²	72.7	37%	0.365	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-100.6	-5.7	176	-71.2	-173.1	179.2	-177.2	0	114	V27 P28 L29 Q33 F34 Y35 L44	V27-K31 HydrophobicContact CG1-CB 3.94Å; P28-K31 HydrophobicContact CG-CB 3.85Å; P28-K31 HydrophobicContact CG-CD 3.86Å; P28-K31 HydrophobicContact CG-CG 3.75Å; P28-K31 PolarHBondContact O-N 3.44Å; L29-K31 PolarHBondContact O-N 3.07Å; K31-Q33 PolarHBondContact O-N 3.46Å; K31-F34 HydrophobicContact CB-CD2 4.07Å; K31-F34 HydrophobicContact CG-CD2 4.34Å; K31-F34 HydrophobicContact CG-CE2 4.49Å; K31-F34 VanDerWaalsContact O-CD2 3.25Å; K31-F34 WeakPolarHBondContact O-CD2 3.42Å; K31-F34 PolarHBondContact O-N 2.6Å; K31-Y35 HydrophobicContact CB-CE2 4.21Å; K31-Y35 WeakPolarHBondContact O-CD2 3.32Å; K31-L44 HydrophobicContact CD-CD1 4.19Å
32	R	89.9	Confident	90.2	Very high	110 Å²	110	73.1 Å²	73.1	42%	0.415	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-47.6	-42.7	-175	-172.6	-161.3	-169.7	-158.4	-0.8	113.6	V21 Q22 R23 P28 L29 F34 Y35	V21-R32 VanDerWaalsContact CG1-CD 3.42Å; Q22-R32 PolarHBondContact O-NE 3.36Å; Q22-R32 PolarHBondContact O-NH2 2.97Å; R23-R32 HydrophobicContact CB-CG 4.24Å; P28-R32 PolarHBondContact O-N 3.11Å; L29-R32 WeakPolarHBondContact O-CB 3.32Å; L29-R32 PolarHBondContact O-N 3Å; L29-R32 VanDerWaalsContact O-N 3.11Å; R32-F34 PolarHBondContact O-N 3.24Å; R32-Y35 PolarHBondContact O-N 3.42Å
33	Q	90.8	Very high	91	Very high	132 Å²	132	66.2 Å²	66.2	62%	0.617	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-59.4	-13.5	-178.1	68.1	-177.9	7.8	0	0	115.3	K31	K31-Q33 PolarHBondContact O-N 3.46Å
34	F	91.1	Very high	91.2	Very high	98 Å²	98	66.7 Å²	66.7	43%	0.43	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-91.9	-9.8	175.3	-53.1	-63.7	0	0	0	112.9	K31 R32 F41 L44	K31-F34 HydrophobicContact CB-CD2 4.07Å; K31-F34 HydrophobicContact CG-CD2 4.34Å; K31-F34 HydrophobicContact CG-CE2 4.49Å; K31-F34 VanDerWaalsContact O-CD2 3.25Å; K31-F34 WeakPolarHBondContact O-CD2 3.42Å; K31-F34 PolarHBondContact O-N 2.6Å; R32-F34 PolarHBondContact O-N 3.24Å; F34-F41 WeakPolarHBondContact O-CD2 3.23Å; F34-F41 WeakPolarHBondContact O-CE2 3.31Å; F34-L44 HydrophobicContact CB-CD2 3.67Å; F34-L44 HydrophobicContact CD1-CD2 4.14Å; F34-L44 HydrophobicContact CD2-CD2 3.9Å; F34-L44 HydrophobicContact CG-CD2 3.64Å
35	Y	92.1	Very high	91.2	Very high	13 Å²	13	69.5 Å²	69.5	5%	0.051	35%	0.347	C	S	.	.			trans	-120.5	64.2	-175.2	-59.7	-93	0	0	0	110.8	P24 V27 K31 R32 F41 V55 S66 P69	P24-Y35 HydrophobicContact CG-CD1 4.16Å; P24-Y35 HydrophobicContact CG-CG 4.23Å; V27-Y35 HydrophobicContact CB-CD2 4.46Å; V27-Y35 HydrophobicContact CB-CE2 4.45Å; V27-Y35 HydrophobicContact CG1-CD2 3.58Å; V27-Y35 HydrophobicContact CG1-CE2 3.66Å; V27-Y35 HydrophobicContact CG1-CG 4.37Å; V27-Y35 HydrophobicContact CG2-CD1 4.2Å; V27-Y35 HydrophobicContact CG2-CD2 3.95Å; V27-Y35 HydrophobicContact CG2-CE1 4.07Å; V27-Y35 HydrophobicContact CG2-CE2 3.85Å; V27-Y35 HydrophobicContact CG2-CG 4.12Å; K31-Y35 HydrophobicContact CB-CE2 4.21Å; K31-Y35 WeakPolarHBondContact O-CD2 3.32Å; R32-Y35 PolarHBondContact O-N 3.42Å; Y35-F41 AromaticContact CD1-CD2 3.99Å; Y35-F41 HydrophobicContact CD1-CD2 3.99Å; Y35-F41 AromaticContact CD1-CE2 3.61Å; Y35-F41 HydrophobicContact CD1-CE2 3.61Å; Y35-F41 HydrophobicContact CD1-CZ 4.31Å; Y35-F41 HydrophobicContact CE1-CD2 4.2Å; Y35-F41 AromaticContact CE1-CE2 3.42Å; Y35-F41 HydrophobicContact CE1-CE2 3.42Å; Y35-F41 VanDerWaalsContact CE1-CE2 3.42Å; Y35-F41 AromaticContact CE1-CZ 3.69Å; Y35-F41 HydrophobicContact CE1-CZ 3.69Å; Y35-F41 HydrophobicContact CE2-CE2 4.49Å; Y35-F41 HydrophobicContact CG-CE2 4.25Å; Y35-F41 AromaticContact CZ-CE2 3.91Å; Y35-V55 HydrophobicContact CD1-CG1 3.98Å; Y35-V55 HydrophobicContact CE1-CG1 4.26Å; Y35-S66 VanDerWaalsContact CE1-O 3.24Å; Y35-S66 WeakPolarHBondContact CE1-O 3.48Å; Y35-S66 PolarHBondContact OH-O 3.44Å; Y35-P69 HydrophobicContact CE1-CG 4.06Å
36	E	89.3	Confident	91.2	Very high	91 Å²	91	67.2 Å²	67.2	43%	0.425	36%	0.356	S	S	.	.			trans	-95.1	113.1	179.1	-58.2	-173.3	129.3	0	0	110.7	D38 K39	E36-D38 PolarHBondContact O-N 2.82Å; E36-K39 PolarHBondContact O-N 3.44Å; E36-K39 VanDerWaalsContact O-N 3.08Å; E36-K39 IonicContact OE1-NZ 3.77Å; E36-K39 WeakPolarHBondContact OE2-CD 3.39Å; E36-K39 WeakPolarHBondContact OE2-CE 3.2Å; E36-K39 IonicContact OE2-NZ 2.9Å; E36-K39 PolarHBondContact OE2-NZ 3.18Å
37	E	86.9	Confident	91.1	Very high	140 Å²	140	69.4 Å²	69.4	65%	0.654	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-20	-172.4	-54.3	-176.5	175.3	0	0	114.7	K39 F52	E37-K39 VanDerWaalsContact C-N 3.3Å; E37-K39 PolarHBondContact O-N 2.96Å; E37-F52 HydrophobicContact CB-CD1 4.32Å; E37-F52 HydrophobicContact CB-CE1 4.1Å; E37-F52 HydrophobicContact CB-CZ 4.38Å; E37-F52 HydrophobicContact CG-CD1 4.41Å; E37-F52 HydrophobicContact CG-CE1 3.72Å; E37-F52 HydrophobicContact CG-CZ 3.9Å
38	D	88.2	Confident	91	Very high	125 Å²	125	74 Å²	74	67%	0.668	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.2	-180	73	-51.4	0	0	0	114	E36	E36-D38 PolarHBondContact O-N 2.82Å
39	K	91	Very high	91.2	Very high	88 Å²	88	77.9 Å²	77.9	38%	0.383	41%	0.41	S	S	.	.	S	Bend	trans	-133.8	151.6	-171.1	-59.6	178.4	-166.2	82.7	0	112.4	E36 E37 F41	E36-K39 PolarHBondContact O-N 3.44Å; E36-K39 VanDerWaalsContact O-N 3.08Å; E36-K39 IonicContact OE1-NZ 3.77Å; E36-K39 WeakPolarHBondContact OE2-CD 3.39Å; E36-K39 WeakPolarHBondContact OE2-CE 3.2Å; E36-K39 IonicContact OE2-NZ 2.9Å; E36-K39 PolarHBondContact OE2-NZ 3.18Å; E37-K39 VanDerWaalsContact C-N 3.3Å; E37-K39 PolarHBondContact O-N 2.96Å; K39-F41 PolarHBondContact O-N 3.31Å
40	P	92.6	Very high	91.4	Very high	87 Å²	87	75.6 Å²	75.6	57%	0.565	40%	0.398	S	S	*	.			trans	-58.8	128.4	168.7	-22	34	0	0	0	111.1	T49 I50	P40-T49 HydrophobicContact CB-CG2 3.6Å; P40-I50 CarbonylContact C-O 3.39Å; P40-I50 WeakPolarHBondContact CA-O 3.27Å; P40-I50 WeakPolarHBondContact CB-O 3.41Å
41	F	95.1	Very high	91.7	Very high	4 Å²	4	74.2 Å²	74.2	2%	0.018	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	140.6	174.9	-178.9	-109.2	0	0	0	110.4	F34 Y35 K39 T49 I50 F52 V55 S66 D67	F34-F41 WeakPolarHBondContact O-CD2 3.23Å; F34-F41 WeakPolarHBondContact O-CE2 3.31Å; Y35-F41 AromaticContact CD1-CD2 3.99Å; Y35-F41 HydrophobicContact CD1-CD2 3.99Å; Y35-F41 AromaticContact CD1-CE2 3.61Å; Y35-F41 HydrophobicContact CD1-CE2 3.61Å; Y35-F41 HydrophobicContact CD1-CZ 4.31Å; Y35-F41 HydrophobicContact CE1-CD2 4.2Å; Y35-F41 AromaticContact CE1-CE2 3.42Å; Y35-F41 HydrophobicContact CE1-CE2 3.42Å; Y35-F41 VanDerWaalsContact CE1-CE2 3.42Å; Y35-F41 AromaticContact CE1-CZ 3.69Å; Y35-F41 HydrophobicContact CE1-CZ 3.69Å; Y35-F41 HydrophobicContact CE2-CE2 4.49Å; Y35-F41 HydrophobicContact CG-CE2 4.25Å; Y35-F41 AromaticContact CZ-CE2 3.91Å; K39-F41 PolarHBondContact O-N 3.31Å; F41-T49 CarbonylContact O-C 3.51Å; F41-T49 VanDerWaalsContact O-CA 3.3Å; F41-T49 WeakPolarHBondContact O-CA 3.37Å; F41-T49 WeakPolarHBondContact O-CG2 3.29Å; F41-I50 HydrophobicContact CB-CG1 4.1Å; F41-I50 HydrophobicContact CD1-CD1 3.97Å; F41-I50 HydrophobicContact CD1-CG1 3.98Å; F41-I50 PolarHBondContact N-O 3.45Å; F41-I50 PolarHBondContact O-N 3.44Å; F41-F52 HydrophobicContact CB-CD2 4.32Å; F41-V55 HydrophobicContact CB-CG2 3.77Å; F41-V55 HydrophobicContact CD1-CG2 4.06Å; F41-V55 HydrophobicContact CD2-CG2 4.32Å; F41-V55 HydrophobicContact CG-CG2 3.78Å; F41-S66 VanDerWaalsContact CZ-O 3.25Å; F41-S66 WeakPolarHBondContact CZ-O 3.48Å; F41-D67 HydrophobicContact CD1-CB 4.46Å; F41-D67 HydrophobicContact CE1-CB 4.17Å
42	T	94.9	Very high	91.8	Very high	63 Å²	63	72.1 Å²	72.1	39%	0.387	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.5	172.2	-60.8	0	0	0	0	107.4	R48 T49	T42-R48 WeakPolarHBondContact CA-O 3.38Å; T42-T49 WeakPolarHBondContact OG1-CG2 3.32Å; T42-T49 PolarHBondContact OG1-OG1 3Å
43	C	94.2	Very high	92	Very high	3 Å²	3	73 Å²	73	2%	0.02	39%	0.391	C	S	.	.			trans	-52.1	144.9	-179.9	-51.2	0	0	0	0	110.3	D45 G46 R48 C62 S66	C43-D45 WeakPolarHBondContact CB-OD1 3.29Å; C43-D45 PolarHBondContact O-N 3.31Å; C43-G46 WeakPolarHBondContact O-CA 3.47Å; C43-G46 PolarHBondContact O-N 2.69Å; C43-R48 PolarHBondContact N-O 3.03Å; C43-R48 WeakPolarHBondContact SG-CG 3.49Å; C43-R48 PolarHBondContact SG-O 2.92Å; C43-C62 HydrophobicContact CB-CB 3.74Å; C43-C62 WeakPolarHBondContact CB-SG 3.44Å; C43-C62 WeakPolarHBondContact SG-CB 3.41Å; C43-C62 CovalentContact SG-SG 2.03Å; C43-C62 PolarHBondContact SG-SG 3.04Å; C43-S66 WeakPolarHBondContact CA-OG 3.28Å
44	L	92.4	Very high	92.2	Very high	68 Å²	68	71.5 Å²	71.5	36%	0.356	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.4	-173.9	-58.9	175	0	0	0	112.3	K31 F34 G46 D64 S66	K31-L44 HydrophobicContact CD-CD1 4.19Å; F34-L44 HydrophobicContact CB-CD2 3.67Å; F34-L44 HydrophobicContact CD1-CD2 4.14Å; F34-L44 HydrophobicContact CD2-CD2 3.9Å; F34-L44 HydrophobicContact CG-CD2 3.64Å; L44-G46 VanDerWaalsContact C-N 3.29Å; L44-D64 WeakPolarHBondContact CA-OD2 3.47Å; L44-D64 WeakPolarHBondContact CB-OD2 3.3Å; L44-D64 PolarHBondContact N-OD2 2.83Å; L44-D64 VanDerWaalsContact N-OD2 3.12Å; L44-S66 PolarHBondContact N-OG 2.68Å
45	D	91.1	Very high	92.3	Very high	78 Å²	78	67.7 Å²	67.7	42%	0.417	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.2	166.9	74.4	-9	0	0	0	114.9	C43 S47 D64	C43-D45 WeakPolarHBondContact CB-OD1 3.29Å; C43-D45 PolarHBondContact O-N 3.31Å; D45-S47 VanDerWaalsContact C-N 3.3Å; D45-S47 VanDerWaalsContact CG-OG 3.28Å; D45-S47 PolarHBondContact O-N 3.45Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 2.82Å; D45-S47 PolarHBondContact OD1-OG 3.14Å; D45-S47 VanDerWaalsContact OD2-CB 3.31Å; D45-S47 WeakPolarHBondContact OD2-CB 3.21Å; D45-S47 PolarHBondContact OD2-OG 2.9Å; D45-S47 VanDerWaalsContact OD2-OG 3.13Å; D45-D64 HydrophobicContact CB-CB 4.01Å; D45-D64 PolarHBondContact N-OD2 2.84Å
46	G	89.7	Confident	92.4	Very high	56 Å²	56	69.2 Å²	69.2	58%	0.577	37%	0.374	S	S	*	.	S	Bend	trans	73.5	11.4	-176.5	0	0	0	0	0	115.2	C43 L44	C43-G46 WeakPolarHBondContact O-CA 3.47Å; C43-G46 PolarHBondContact O-N 2.69Å; L44-G46 VanDerWaalsContact C-N 3.29Å
47	S	89.1	Confident	92.7	Very high	54 Å²	54	68.1 Å²	68.1	38%	0.378	37%	0.371	S	S	.	.	S	Bend	trans	-69.4	-33.9	-171.9	60.7	0	0	0	0	114.5	D45	D45-S47 VanDerWaalsContact C-N 3.3Å; D45-S47 VanDerWaalsContact CG-OG 3.28Å; D45-S47 PolarHBondContact O-N 3.45Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 2.82Å; D45-S47 PolarHBondContact OD1-OG 3.14Å; D45-S47 VanDerWaalsContact OD2-CB 3.31Å; D45-S47 WeakPolarHBondContact OD2-CB 3.21Å; D45-S47 PolarHBondContact OD2-OG 2.9Å; D45-S47 VanDerWaalsContact OD2-OG 3.13Å
48	R	91.9	Very high	93	Very high	98 Å²	98	66.7 Å²	66.7	37%	0.37	37%	0.367	S	S	.	.			trans	-155.9	162.8	175.2	65.3	-177.9	75.4	169.3	17.2	112.3	T42 C43 I50 D61	T42-R48 WeakPolarHBondContact CA-O 3.38Å; C43-R48 PolarHBondContact N-O 3.03Å; C43-R48 WeakPolarHBondContact SG-CG 3.49Å; C43-R48 PolarHBondContact SG-O 2.92Å; R48-I50 HydrophobicContact CG-CG2 4.05Å; R48-D61 IonicContact CZ-OD1 3.79Å; R48-D61 PolarHBondContact NE-O 3.04Å; R48-D61 PolarHBondContact NH1-O 3.34Å; R48-D61 IonicContact NH1-OD1 2.68Å; R48-D61 PolarHBondContact NH1-OD1 3.12Å; R48-D61 PolarHBondContact NH2-O 3.22Å
49	T	95.3	Very high	93.3	Very high	91 Å²	91	67.6 Å²	67.6	56%	0.558	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.7	167.9	-57.8	0	0	0	0	108.5	P40 F41 T42	P40-T49 HydrophobicContact CB-CG2 3.6Å; F41-T49 CarbonylContact O-C 3.51Å; F41-T49 VanDerWaalsContact O-CA 3.3Å; F41-T49 WeakPolarHBondContact O-CA 3.37Å; F41-T49 WeakPolarHBondContact O-CG2 3.29Å; T42-T49 WeakPolarHBondContact OG1-CG2 3.32Å; T42-T49 PolarHBondContact OG1-OG1 3Å
50	I	93.8	Very high	93.5	Very high	10 Å²	10	65.5 Å²	65.5	5%	0.051	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.9	-179.5	64.5	-177.7	0	0	0	109.5	P40 F41 R48 R54 D61 D67	P40-I50 CarbonylContact C-O 3.39Å; P40-I50 WeakPolarHBondContact CA-O 3.27Å; P40-I50 WeakPolarHBondContact CB-O 3.41Å; F41-I50 HydrophobicContact CB-CG1 4.1Å; F41-I50 HydrophobicContact CD1-CD1 3.97Å; F41-I50 HydrophobicContact CD1-CG1 3.98Å; F41-I50 PolarHBondContact N-O 3.45Å; F41-I50 PolarHBondContact O-N 3.44Å; R48-I50 HydrophobicContact CG-CG2 4.05Å; I50-R54 HydrophobicContact CD1-CB 3.88Å; I50-R54 HydrophobicContact CG1-CB 4.38Å; I50-D61 HydrophobicContact CD1-CB 4.22Å; I50-D61 HydrophobicContact CG2-CB 4.36Å; I50-D67 HydrophobicContact CD1-CB 3.81Å
51	P	95.2	Very high	93.5	Very high	66 Å²	66	62 Å²	62	43%	0.429	34%	0.335	S	S	.	.			trans	-70.6	150.4	171.6	33.8	-36	0	0	0	110.2	D53 R54	P51-D53 WeakPolarHBondContact CB-OD1 3.44Å; P51-D53 WeakPolarHBondContact CG-OD1 3.37Å; P51-D53 PolarHBondContact O-N 3.15Å; P51-R54 HydrophobicContact CG-CG 4.35Å; P51-R54 PolarHBondContact O-N 3.14Å; P51-R54 VanDerWaalsContact O-N 3.14Å
52	F	94.1	Very high	93.4	Very high	39 Å²	39	62 Å²	62	17%	0.171	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-67	-19	-168.5	-163.4	-86.6	0	0	0	114.1	P24 E37 F41 R54 V55	P24-F52 HydrophobicContact CG-CZ 4Å; E37-F52 HydrophobicContact CB-CD1 4.32Å; E37-F52 HydrophobicContact CB-CE1 4.1Å; E37-F52 HydrophobicContact CB-CZ 4.38Å; E37-F52 HydrophobicContact CG-CD1 4.41Å; E37-F52 HydrophobicContact CG-CE1 3.72Å; E37-F52 HydrophobicContact CG-CZ 3.9Å; F41-F52 HydrophobicContact CB-CD2 4.32Å; F52-R54 PolarHBondContact O-N 3.44Å; F52-R54 VanDerWaalsContact O-N 3.1Å; F52-V55 HydrophobicContact CD2-CG2 4.25Å; F52-V55 HydrophobicContact CE2-CG2 4.34Å; F52-V55 HydrophobicContact CG-CG2 4.45Å; F52-V55 PolarHBondContact O-N 3.37Å; F52-V55 VanDerWaalsContact O-N 3.11Å
53	D	93.7	Very high	93.2	Very high	129 Å²	129	65 Å²	65	69%	0.69	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-65.9	-4.3	173.2	59	-32.7	0	0	0	113.9	P51	P51-D53 WeakPolarHBondContact CB-OD1 3.44Å; P51-D53 WeakPolarHBondContact CG-OD1 3.37Å; P51-D53 PolarHBondContact O-N 3.15Å
54	R	93.8	Very high	93.1	Very high	100 Å²	100	67.2 Å²	67.2	38%	0.377	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-102.3	16.2	170.9	-59.8	-166.6	177.8	-157.1	-12.1	115	I50 P51 F52 D61	I50-R54 HydrophobicContact CD1-CB 3.88Å; I50-R54 HydrophobicContact CG1-CB 4.38Å; P51-R54 HydrophobicContact CG-CG 4.35Å; P51-R54 PolarHBondContact O-N 3.14Å; P51-R54 VanDerWaalsContact O-N 3.14Å; F52-R54 PolarHBondContact O-N 3.44Å; F52-R54 VanDerWaalsContact O-N 3.1Å; R54-D61 VanDerWaalsContact CD-OD2 3.25Å; R54-D61 WeakPolarHBondContact CD-OD2 3.49Å; R54-D61 IonicContact CZ-OD2 2.66Å; R54-D61 IonicContact NE-OD2 3.86Å; R54-D61 IonicContact NH1-OD1 2.73Å; R54-D61 IonicContact NH1-OD2 3.88Å; R54-D61 PolarHBondContact NH1-OD2 3.5Å
55	V	94.8	Very high	93	Very high	19 Å²	19	64.2 Å²	64.2	12%	0.115	35%	0.346	C	S	.	.	S	Bend	trans	-97.4	111.7	174	176.5	0	0	0	0	108.3	P24 Y35 F41 F52 D67	P24-V55 HydrophobicContact CB-CG1 4.24Å; P24-V55 HydrophobicContact CG-CG1 4.2Å; Y35-V55 HydrophobicContact CD1-CG1 3.98Å; Y35-V55 HydrophobicContact CE1-CG1 4.26Å; F41-V55 HydrophobicContact CB-CG2 3.77Å; F41-V55 HydrophobicContact CD1-CG2 4.06Å; F41-V55 HydrophobicContact CD2-CG2 4.32Å; F41-V55 HydrophobicContact CG-CG2 3.78Å; F52-V55 HydrophobicContact CD2-CG2 4.25Å; F52-V55 HydrophobicContact CE2-CG2 4.34Å; F52-V55 HydrophobicContact CG-CG2 4.45Å; F52-V55 PolarHBondContact O-N 3.37Å; F52-V55 VanDerWaalsContact O-N 3.11Å; V55-D67 WeakPolarHBondContact CA-O 3.35Å; V55-D67 WeakPolarHBondContact CG1-O 3.49Å
56	N	94.3	Very high	93.2	Very high	44 Å²	44	60.9 Å²	60.9	24%	0.235	33%	0.328	C	S	.	.	S	Bend	trans	64.8	51.3	-167.5	-53.5	-56.8	0	0	0	113.5	D67 E68 P69 G70 T71	N56-D67 PolarHBondContact N-O 3.34Å; N56-D67 VanDerWaalsContact N-O 3.1Å; N56-E68 WeakPolarHBondContact CA-OE1 3.33Å; N56-E68 PolarHBondContact N-OE1 2.93Å; N56-P69 VanDerWaalsContact OD1-CD 3.32Å; N56-P69 WeakPolarHBondContact OD1-CD 3.45Å; N56-G70 WeakPolarHBondContact OD1-CA 3.49Å; N56-G70 PolarHBondContact OD1-N 3.05Å; N56-T71 HydrophobicContact CB-CG2 3.73Å
57	D	94.3	Very high	93.4	Very high	68 Å²	68	58.2 Å²	58.2	36%	0.364	30%	0.301	S	S	.	.	S	Bend	trans	-100.8	8.7	176.9	87.4	-11.5	0	0	0	115	Y59 E68	D57-Y59 VanDerWaalsContact C-N 3.25Å; D57-Y59 PolarHBondContact O-N 2.87Å; D57-Y59 WeakPolarHBondContact OD1-CA 3.43Å; D57-Y59 VanDerWaalsContact OD1-CB 3.27Å; D57-Y59 WeakPolarHBondContact OD1-CB 3.47Å; D57-Y59 PolarHBondContact OD1-N 3.13Å; D57-E68 PolarHBondContact N-OE1 2.93Å
58	D	93.1	Very high	93.7	Very high	110 Å²	110	55.6 Å²	55.6	59%	0.588	28%	0.283	S	S	*	.	S	Bend	trans	65.2	18.4	-173.5	-70.4	-48.7	0	0	0	114	E68 T71 A73	D58-E68 VanDerWaalsContact CA-OE2 3.3Å; D58-E68 WeakPolarHBondContact CA-OE2 3.27Å; D58-E68 PolarHBondContact N-OE2 3.28Å; D58-T71 WeakPolarHBondContact OD1-CB 3.45Å; D58-A73 WeakPolarHBondContact O-CB 3.47Å
59	Y	94.6	Very high	93.8	Very high	144 Å²	144	51.3 Å²	51.3	57%	0.565	27%	0.267	S	S	*	.	S	Bend	trans	-127.8	124.1	173.9	-176.8	-88.8	0	0	0	113.2	D57 D61	D57-Y59 VanDerWaalsContact C-N 3.25Å; D57-Y59 PolarHBondContact O-N 2.87Å; D57-Y59 WeakPolarHBondContact OD1-CA 3.43Å; D57-Y59 VanDerWaalsContact OD1-CB 3.27Å; D57-Y59 WeakPolarHBondContact OD1-CB 3.47Å; D57-Y59 PolarHBondContact OD1-N 3.13Å; Y59-D61 PolarHBondContact O-N 2.55Å; Y59-D61 VanDerWaalsContact O-N 3.09Å
60	C	95.1	Very high	93.8	Very high	44 Å²	44	47 Å²	47	30%	0.297	24%	0.241	S	C	.	.			trans	-77	99.1	179.2	-162.9	0	0	0	0	112.7	C62 C74	C60-C62 PolarHBondContact SG-O 3.41Å; C60-C74 WeakPolarHBondContact CA-SG 3.38Å; C60-C74 HydrophobicContact CB-CB 4.01Å; C60-C74 WeakPolarHBondContact CB-SG 3.31Å; C60-C74 WeakPolarHBondContact SG-CA 3.42Å; C60-C74 WeakPolarHBondContact SG-CB 3.47Å; C60-C74 CovalentContact SG-SG 2.03Å; C60-C74 PolarHBondContact SG-SG 3.24Å
61	D	93.9	Very high	93.7	Very high	14 Å²	14	46.5 Å²	46.5	8%	0.075	24%	0.239	C	C	.	.			trans	-86.7	-52	171.8	-122.7	-25.3	0	0	0	110.9	R48 I50 R54 Y59 D67	R48-D61 IonicContact CZ-OD1 3.79Å; R48-D61 PolarHBondContact NE-O 3.04Å; R48-D61 PolarHBondContact NH1-O 3.34Å; R48-D61 IonicContact NH1-OD1 2.68Å; R48-D61 PolarHBondContact NH1-OD1 3.12Å; R48-D61 PolarHBondContact NH2-O 3.22Å; I50-D61 HydrophobicContact CD1-CB 4.22Å; I50-D61 HydrophobicContact CG2-CB 4.36Å; R54-D61 VanDerWaalsContact CD-OD2 3.25Å; R54-D61 WeakPolarHBondContact CD-OD2 3.49Å; R54-D61 IonicContact CZ-OD2 2.66Å; R54-D61 IonicContact NE-OD2 3.86Å; R54-D61 IonicContact NH1-OD1 2.73Å; R54-D61 IonicContact NH1-OD2 3.88Å; R54-D61 PolarHBondContact NH1-OD2 3.5Å; Y59-D61 PolarHBondContact O-N 2.55Å; Y59-D61 VanDerWaalsContact O-N 3.09Å; D61-D67 WeakPolarHBondContact CA-OD2 3.41Å; D61-D67 WeakPolarHBondContact CB-OD2 3.35Å; D61-D67 PolarHBondContact N-OD2 2.85Å
62	C	92.5	Very high	93.7	Very high	4 Å²	4	45.7 Å²	45.7	3%	0.027	24%	0.237	C	C	.	.	S	Bend	trans	-76.2	143.3	-175.4	-64.1	0	0	0	0	113.3	C43 C60 D64 G65 D67	C43-C62 HydrophobicContact CB-CB 3.74Å; C43-C62 WeakPolarHBondContact CB-SG 3.44Å; C43-C62 WeakPolarHBondContact SG-CB 3.41Å; C43-C62 CovalentContact SG-SG 2.03Å; C43-C62 PolarHBondContact SG-SG 3.04Å; C60-C62 PolarHBondContact SG-O 3.41Å; C62-D64 VanDerWaalsContact C-N 3.34Å; C62-D64 VanDerWaalsContact CB-OD1 3.25Å; C62-D64 WeakPolarHBondContact CB-OD1 3.35Å; C62-G65 PolarHBondContact O-N 2.85Å; C62-D67 HydrophobicContact CB-CB 4.24Å; C62-D67 WeakPolarHBondContact CB-OD1 3.48Å; C62-D67 PolarHBondContact N-OD2 3.42Å
63	L	89.9	Confident	93.7	Very high	125 Å²	125	45.4 Å²	45.4	65%	0.654	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.1	179.2	-66.8	176	0	0	0	113.2
64	D	91.7	Very high	93.7	Very high	50 Å²	50	39.3 Å²	39.3	27%	0.267	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-5.2	172.4	68.4	-6.8	0	0	0	113.7	L44 D45 C62 S66	L44-D64 WeakPolarHBondContact CA-OD2 3.47Å; L44-D64 WeakPolarHBondContact CB-OD2 3.3Å; L44-D64 PolarHBondContact N-OD2 2.83Å; L44-D64 VanDerWaalsContact N-OD2 3.12Å; D45-D64 HydrophobicContact CB-CB 4.01Å; D45-D64 PolarHBondContact N-OD2 2.84Å; C62-D64 VanDerWaalsContact C-N 3.34Å; C62-D64 VanDerWaalsContact CB-OD1 3.25Å; C62-D64 WeakPolarHBondContact CB-OD1 3.35Å; D64-S66 VanDerWaalsContact C-N 3.29Å; D64-S66 PolarHBondContact O-N 2.92Å; D64-S66 VanDerWaalsContact OD1-CB 3.26Å; D64-S66 WeakPolarHBondContact OD1-CB 3.39Å; D64-S66 PolarHBondContact OD1-N 3.21Å; D64-S66 PolarHBondContact OD1-OG 2.91Å; D64-S66 WeakPolarHBondContact OD2-CB 3.48Å; D64-S66 PolarHBondContact OD2-OG 3.37Å; D64-S66 VanDerWaalsContact OD2-OG 3.05Å
65	G	91.9	Very high	93.4	Very high	5 Å²	5	40 Å²	40	5%	0.052	23%	0.227	C	C	.	.			trans	62.9	29.2	-175.4	0	0	0	0	0	115	C62 D67 C74	C62-G65 PolarHBondContact O-N 2.85Å; G65-D67 WeakPolarHBondContact CA-OD1 3.39Å; G65-C74 WeakPolarHBondContact CA-SG 3.42Å
66	S	94.3	Very high	93.2	Very high	8 Å²	8	44.6 Å²	44.6	6%	0.056	25%	0.251	C	S	.	.			trans	-81.1	-12.8	179.3	58.6	0	0	0	0	115	Y35 F41 C43 L44 D64	Y35-S66 VanDerWaalsContact CE1-O 3.24Å; Y35-S66 WeakPolarHBondContact CE1-O 3.48Å; Y35-S66 PolarHBondContact OH-O 3.44Å; F41-S66 VanDerWaalsContact CZ-O 3.25Å; F41-S66 WeakPolarHBondContact CZ-O 3.48Å; C43-S66 WeakPolarHBondContact CA-OG 3.28Å; L44-S66 PolarHBondContact N-OG 2.68Å; D64-S66 VanDerWaalsContact C-N 3.29Å; D64-S66 PolarHBondContact O-N 2.92Å; D64-S66 VanDerWaalsContact OD1-CB 3.26Å; D64-S66 WeakPolarHBondContact OD1-CB 3.39Å; D64-S66 PolarHBondContact OD1-N 3.21Å; D64-S66 PolarHBondContact OD1-OG 2.91Å; D64-S66 WeakPolarHBondContact OD2-CB 3.48Å; D64-S66 PolarHBondContact OD2-OG 3.37Å; D64-S66 VanDerWaalsContact OD2-OG 3.05Å
67	D	94.8	Very high	93	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-72.7	-34	168.7	50.8	-19.9	0	0	0	113.5	F41 I50 V55 N56 D61 C62 G65 P69 C74	F41-D67 HydrophobicContact CD1-CB 4.46Å; F41-D67 HydrophobicContact CE1-CB 4.17Å; I50-D67 HydrophobicContact CD1-CB 3.81Å; V55-D67 WeakPolarHBondContact CA-O 3.35Å; V55-D67 WeakPolarHBondContact CG1-O 3.49Å; N56-D67 PolarHBondContact N-O 3.34Å; N56-D67 VanDerWaalsContact N-O 3.1Å; D61-D67 WeakPolarHBondContact CA-OD2 3.41Å; D61-D67 WeakPolarHBondContact CB-OD2 3.35Å; D61-D67 PolarHBondContact N-OD2 2.85Å; C62-D67 HydrophobicContact CB-CB 4.24Å; C62-D67 WeakPolarHBondContact CB-OD1 3.48Å; C62-D67 PolarHBondContact N-OD2 3.42Å; G65-D67 WeakPolarHBondContact CA-OD1 3.39Å; D67-P69 WeakPolarHBondContact O-CD 3.39Å; D67-C74 PolarHBondContact OD1-SG 3.14Å; D67-C74 VanDerWaalsContact OD1-SG 3.38Å
68	E	95.3	Very high	92.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.248	C	C	.	.			trans	-110.9	55.5	-175.9	-64.3	-64.5	101.2	0	0	113.1	N56 D57 D58 G70 T71 A73 C74	N56-E68 WeakPolarHBondContact CA-OE1 3.33Å; N56-E68 PolarHBondContact N-OE1 2.93Å; D57-E68 PolarHBondContact N-OE1 2.93Å; D58-E68 VanDerWaalsContact CA-OE2 3.3Å; D58-E68 WeakPolarHBondContact CA-OE2 3.27Å; D58-E68 PolarHBondContact N-OE2 3.28Å; E68-G70 PolarHBondContact O-N 3.26Å; E68-T71 WeakPolarHBondContact OE2-CB 3.32Å; E68-T71 VanDerWaalsContact OE2-CG2 3.25Å; E68-T71 WeakPolarHBondContact OE2-CG2 3.29Å; E68-T71 PolarHBondContact OE2-OG1 2.92Å; E68-A73 HydrophobicContact CG-CB 4.05Å; E68-C74 HydrophobicContact CB-CB 4.19Å
69	P	94.3	Very high	93	Very high	7 Å²	7	38.7 Å²	38.7	5%	0.045	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.7	178.8	32.1	-36.5	0	0	0	113.1	G26 V27 Y35 N56 D67 F79	G26-P69 WeakPolarHBondContact CA-O 3.5Å; V27-P69 HydrophobicContact CG2-CB 3.93Å; V27-P69 HydrophobicContact CG2-CG 3.55Å; Y35-P69 HydrophobicContact CE1-CG 4.06Å; N56-P69 VanDerWaalsContact OD1-CD 3.32Å; N56-P69 WeakPolarHBondContact OD1-CD 3.45Å; D67-P69 WeakPolarHBondContact O-CD 3.39Å; P69-F79 WeakPolarHBondContact O-CA 3.42Å; P69-F79 WeakPolarHBondContact O-CD2 3.31Å
70	G	93.9	Very high	93.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	3.9	-171.2	0	0	0	0	0	115.1	R25 N56 E68 Y110	R25-G70 WeakPolarHBondContact CD-O 3.3Å; R25-G70 WeakPolarHBondContact O-CA 3.36Å; R25-G70 PolarHBondContact O-N 2.79Å; N56-G70 WeakPolarHBondContact OD1-CA 3.49Å; N56-G70 PolarHBondContact OD1-N 3.05Å; E68-G70 PolarHBondContact O-N 3.26Å; G70-Y110 WeakPolarHBondContact O-CE1 3.35Å; G70-Y110 PolarHBondContact O-OH 3Å
71	T	93.2	Very high	93	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	18%	0.182	C	C	.	.	S	Bend	trans	-129	-178.5	-178.6	81.2	0	0	0	0	111.5	N56 D58 E68 A73 S93	N56-T71 HydrophobicContact CB-CG2 3.73Å; D58-T71 WeakPolarHBondContact OD1-CB 3.45Å; E68-T71 WeakPolarHBondContact OE2-CB 3.32Å; E68-T71 VanDerWaalsContact OE2-CG2 3.25Å; E68-T71 WeakPolarHBondContact OE2-CG2 3.29Å; E68-T71 PolarHBondContact OE2-OG1 2.92Å; T71-A73 PolarHBondContact OG1-N 3.32Å; T71-A73 VanDerWaalsContact OG1-N 3.14Å; T71-S93 WeakPolarHBondContact O-CB 3.36Å
72	A	94.3	Very high	92.9	Very high	48 Å²	48	31.2 Å²	31.2	40%	0.397	19%	0.188	S	C	.	.	S	Bend	trans	-95.4	2	173.6	0	0	0	0	0	114.5	C74 S93 V96	A72-C74 PolarHBondContact O-N 2.92Å; A72-S93 VanDerWaalsContact CA-O 3.27Å; A72-S93 WeakPolarHBondContact CA-O 2.86Å; A72-S93 VanDerWaalsContact CB-O 3.28Å; A72-S93 WeakPolarHBondContact CB-O 3.46Å; A72-V96 HydrophobicContact CB-CB 4.43Å
73	A	94.1	Very high	92.8	Very high	34 Å²	34	31.6 Å²	31.6	28%	0.281	19%	0.19	S	C	.	.			trans	-70.6	-33.1	-164.3	0	0	0	0	0	114.7	D58 E68 T71	D58-A73 WeakPolarHBondContact O-CB 3.47Å; E68-A73 HydrophobicContact CG-CB 4.05Å; T71-A73 PolarHBondContact OG1-N 3.32Å; T71-A73 VanDerWaalsContact OG1-N 3.14Å
74	C	93	Very high	92.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	18%	0.177	C	C	.	.			trans	-94.6	123.1	177.8	-75.6	0	0	0	0	112.4	C60 G65 D67 E68 A72 N76 G77 S93	C60-C74 WeakPolarHBondContact CA-SG 3.38Å; C60-C74 HydrophobicContact CB-CB 4.01Å; C60-C74 WeakPolarHBondContact CB-SG 3.31Å; C60-C74 WeakPolarHBondContact SG-CA 3.42Å; C60-C74 WeakPolarHBondContact SG-CB 3.47Å; C60-C74 CovalentContact SG-SG 2.03Å; C60-C74 PolarHBondContact SG-SG 3.24Å; G65-C74 WeakPolarHBondContact CA-SG 3.42Å; D67-C74 PolarHBondContact OD1-SG 3.14Å; D67-C74 VanDerWaalsContact OD1-SG 3.38Å; E68-C74 HydrophobicContact CB-CB 4.19Å; A72-C74 PolarHBondContact O-N 2.92Å; C74-N76 VanDerWaalsContact C-N 3.26Å; C74-N76 PolarHBondContact O-N 3.36Å; C74-G77 PolarHBondContact O-N 2.71Å; C74-S93 WeakPolarHBondContact O-CB 3.21Å; C74-S93 PolarHBondContact O-OG 3.31Å
75	P	89.2	Confident	92.5	Very high	114 Å²	114	27.6 Å²	27.6	74%	0.74	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-14.8	-174.1	29.3	-36.5	0	0	0	114.8
76	N	89.6	Confident	92.4	Very high	116 Å²	116	29.8 Å²	29.8	62%	0.62	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.2	3.2	172.3	-61.9	-34.3	0	0	0	112.4	C74 N78	C74-N76 VanDerWaalsContact C-N 3.26Å; C74-N76 PolarHBondContact O-N 3.36Å; N76-N78 PolarHBondContact O-ND2 2.88Å
77	G	89.7	Confident	92.1	Very high	3 Å²	3	36.4 Å²	36.4	3%	0.031	22%	0.218	C	C	.	.			trans	-66.7	153.4	-177	0	0	0	0	0	112.8	C74 S93	C74-G77 PolarHBondContact O-N 2.71Å; G77-S93 WeakPolarHBondContact O-CB 3.48Å; G77-S93 PolarHBondContact O-N 3.29Å; G77-S93 PolarHBondContact O-OG 2.89Å
78	N	93.6	Very high	92	Very high	94 Å²	94	39.1 Å²	39.1	50%	0.503	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	119.7	178.5	-70.3	-97.3	0	0	0	109.3	N76 F90 I91	N76-N78 PolarHBondContact O-ND2 2.88Å; N78-F90 HydrophobicContact CB-CD1 4.26Å; N78-I91 CarbonylContact C-O 3.59Å; N78-I91 WeakPolarHBondContact CA-O 3.31Å
79	F	94.9	Very high	91.8	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.7	-178.2	-178.1	-79	0	0	0	110.8	R25 P69 F90 I91 V96 T107 D108	R25-F79 HydrophobicContact CG-CE2 3.6Å; R25-F79 HydrophobicContact CG-CZ 3.78Å; P69-F79 WeakPolarHBondContact O-CA 3.42Å; P69-F79 WeakPolarHBondContact O-CD2 3.31Å; F79-F90 VanDerWaalsContact O-CA 3.28Å; F79-F90 WeakPolarHBondContact O-CA 3.47Å; F79-I91 HydrophobicContact CB-CG1 3.86Å; F79-I91 HydrophobicContact CD1-CD1 4.21Å; F79-I91 HydrophobicContact CD1-CG1 4.11Å; F79-I91 HydrophobicContact CG-CG1 4.35Å; F79-I91 PolarHBondContact N-O 3.41Å; F79-I91 PolarHBondContact O-N 2.97Å; F79-V96 HydrophobicContact CB-CG2 3.62Å; F79-V96 HydrophobicContact CD2-CB 4.44Å; F79-V96 HydrophobicContact CD2-CG1 4.05Å; F79-V96 HydrophobicContact CD2-CG2 3.44Å; F79-V96 VanDerWaalsContact CD2-CG2 3.44Å; F79-V96 HydrophobicContact CE2-CG1 4.11Å; F79-V96 HydrophobicContact CE2-CG2 4.22Å; F79-V96 HydrophobicContact CG-CG2 3.65Å; F79-T107 VanDerWaalsContact CZ-O 3.31Å; F79-T107 WeakPolarHBondContact CZ-O 3.3Å; F79-D108 HydrophobicContact CE1-CB 4.48Å
80	H	95.4	Very high	91.8	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	107.7	175.4	-173.8	-102.6	0	0	0	112.7	G26 G89 F90 E531	G26-H80 WeakPolarHBondContact O-CB 3.36Å; G26-H80 PolarHBondContact O-N 3.24Å; H80-G89 CarbonylContact C-O 3.59Å; H80-G89 WeakPolarHBondContact CA-O 3.44Å; H80-F90 HydrophobicContact CB-CD1 4.09Å; H80-F90 HydrophobicContact CB-CE1 3.76Å; H80-F90 HydrophobicContact CB-CZ 4.43Å; H80-F90 AromaticContact CD2-CE1 3.72Å; H80-F90 AromaticContact CD2-CE2 3.88Å; H80-F90 AromaticContact CD2-CZ 3.54Å; H80-E531 IonicContact CE1-OE2 3.92Å; H80-E531 PolarHBondContact CE1-OE2 3.28Å
81	C	94.4	Very high	91.9	Very high	3 Å²	3	46 Å²	46	2%	0.02	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.3	161.5	-45.9	0	0	0	0	108.6	N83 G89 C103	C81-N83 VanDerWaalsContact C-N 3.34Å; C81-N83 VanDerWaalsContact CB-OD1 3.3Å; C81-N83 WeakPolarHBondContact CB-OD1 3.48Å; C81-G89 PolarHBondContact N-O 2.89Å; C81-G89 PolarHBondContact O-N 3.09Å; C81-G89 VanDerWaalsContact O-N 3.11Å; C81-C103 HydrophobicContact CB-CB 3.67Å; C81-C103 WeakPolarHBondContact CB-SG 3.13Å; C81-C103 VanDerWaalsContact SG-CA 3.55Å; C81-C103 WeakPolarHBondContact SG-CB 3.39Å; C81-C103 CovalentContact SG-SG 2.03Å; C81-C103 PolarHBondContact SG-SG 3.1Å
82	T	91.6	Very high	92	Very high	32 Å²	32	48.3 Å²	48.3	20%	0.196	29%	0.287	C	S	.	.			trans	-75.9	-31.2	176.8	-56.3	0	0	0	0	110.7	R23 A84 D105 E531	R23-T82 PolarHBondContact NH2-OG1 3.03Å; T82-A84 VanDerWaalsContact C-N 3.25Å; T82-A84 PolarHBondContact O-N 3.25Å; T82-D105 PolarHBondContact N-OD2 2.73Å; T82-E531 HydrophobicContact CG2-CB 3.82Å
83	N	90.8	Very high	91.9	Very high	13 Å²	13	46.2 Å²	46.2	7%	0.07	27%	0.269	C	S	.	.			trans	53.1	37.1	176.2	-70	-24.2	0	0	0	113.7	C81 G85 F86 R87 C104 D105 C120	C81-N83 VanDerWaalsContact C-N 3.34Å; C81-N83 VanDerWaalsContact CB-OD1 3.3Å; C81-N83 WeakPolarHBondContact CB-OD1 3.48Å; N83-G85 PolarHBondContact O-N 3.39Å; N83-G85 VanDerWaalsContact O-N 3.14Å; N83-F86 HydrophobicContact CB-CB 4.49Å; N83-F86 CarbonylContact O-C 3.54Å; N83-F86 WeakPolarHBondContact O-CA 3.39Å; N83-F86 PolarHBondContact O-N 2.78Å; N83-R87 WeakPolarHBondContact CB-O 3.48Å; N83-R87 PolarHBondContact ND2-O 2.89Å; N83-C104 PolarHBondContact OD1-N 2.89Å; N83-C104 PolarHBondContact OD1-SG 3.43Å; N83-D105 PolarHBondContact N-OD2 3.46Å; N83-C120 VanDerWaalsContact C-SG 3.59Å; N83-C120 WeakPolarHBondContact CA-SG 3.36Å
84	A	88.2	Confident	91.9	Very high	46 Å²	46	48.4 Å²	48.4	38%	0.38	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	117.1	-170.1	0	0	0	0	0	113.4	T82	T82-A84 VanDerWaalsContact C-N 3.25Å; T82-A84 PolarHBondContact O-N 3.25Å
85	G	85.7	Confident	91.9	Very high	44 Å²	44	52.9 Å²	52.9	45%	0.454	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	5.2	-172.1	0	0	0	0	0	115.3	N83 G124	N83-G85 PolarHBondContact O-N 3.39Å; N83-G85 VanDerWaalsContact O-N 3.14Å; G85-G124 WeakPolarHBondContact O-CA 3.43Å
86	F	90.6	Very high	92.2	Very high	52 Å²	52	47.6 Å²	47.6	23%	0.228	27%	0.265	C	S	.	.	S	Bend	trans	-139.3	-161.9	166.2	-175	-134	0	0	0	108	N83 C120 L123 E127	N83-F86 HydrophobicContact CB-CB 4.49Å; N83-F86 CarbonylContact O-C 3.54Å; N83-F86 WeakPolarHBondContact O-CA 3.39Å; N83-F86 PolarHBondContact O-N 2.78Å; F86-C120 HydrophobicContact CB-CB 3.75Å; F86-L123 HydrophobicContact CD1-CB 4.22Å; F86-L123 HydrophobicContact CD1-CD1 4.23Å; F86-L123 HydrophobicContact CD2-CB 3.92Å; F86-L123 HydrophobicContact CE1-CB 4.34Å; F86-L123 HydrophobicContact CE1-CD1 4.17Å; F86-L123 HydrophobicContact CE2-CB 4.04Å; F86-L123 HydrophobicContact CG-CB 3.99Å; F86-L123 HydrophobicContact CZ-CB 4.25Å; F86-E127 WeakPolarHBondContact CD2-OE2 3.37Å; F86-E127 HydrophobicContact CE2-CB 4.34Å; F86-E127 WeakPolarHBondContact CE2-OE2 3.22Å
87	R	88.8	Confident	92.4	Very high	146 Å²	146	44.1 Å²	44.1	55%	0.551	25%	0.247	S	C	*	.			trans	-86.1	133.3	178.8	69.9	-157.9	-170.2	-162.7	6.9	112.5	N83 E127	N83-R87 WeakPolarHBondContact CB-O 3.48Å; N83-R87 PolarHBondContact ND2-O 2.89Å; R87-E127 IonicContact CZ-OE1 3.25Å; R87-E127 IonicContact NH1-OE1 2.78Å; R87-E127 PolarHBondContact NH1-OE1 2.84Å
88	P	91.5	Very high	92.6	Very high	57 Å²	57	47.6 Å²	47.6	37%	0.37	27%	0.265	S	S	.	.			trans	-61.5	157.2	172.9	26.4	-34.1	0	0	0	111.3
89	G	92.3	Very high	92.5	Very high	23 Å²	23	44.9 Å²	44.9	24%	0.237	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	163.4	-175.4	0	0	0	0	0	113.8	H80 C81	H80-G89 CarbonylContact C-O 3.59Å; H80-G89 WeakPolarHBondContact CA-O 3.44Å; C81-G89 PolarHBondContact N-O 2.89Å; C81-G89 PolarHBondContact O-N 3.09Å; C81-G89 VanDerWaalsContact O-N 3.11Å
90	F	94.1	Very high	92.4	Very high	115 Å²	115	49.5 Å²	49.5	50%	0.504	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.8	174	-67.4	-86.2	0	0	0	110.6	P28 N78 F79 H80	P28-F90 HydrophobicContact CB-CZ 4.15Å; P28-F90 HydrophobicContact CG-CE1 4.31Å; P28-F90 HydrophobicContact CG-CZ 3.97Å; N78-F90 HydrophobicContact CB-CD1 4.26Å; F79-F90 VanDerWaalsContact O-CA 3.28Å; F79-F90 WeakPolarHBondContact O-CA 3.47Å; H80-F90 HydrophobicContact CB-CD1 4.09Å; H80-F90 HydrophobicContact CB-CE1 3.76Å; H80-F90 HydrophobicContact CB-CZ 4.43Å; H80-F90 AromaticContact CD2-CE1 3.72Å; H80-F90 AromaticContact CD2-CE2 3.88Å; H80-F90 AromaticContact CD2-CZ 3.54Å
91	I	94.8	Very high	92.3	Very high	13 Å²	13	52.1 Å²	52.1	7%	0.067	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154.3	168.4	65.8	176.4	0	0	0	109.5	N78 F79 R95 D102 D108	N78-I91 CarbonylContact C-O 3.59Å; N78-I91 WeakPolarHBondContact CA-O 3.31Å; F79-I91 HydrophobicContact CB-CG1 3.86Å; F79-I91 HydrophobicContact CD1-CD1 4.21Å; F79-I91 HydrophobicContact CD1-CG1 4.11Å; F79-I91 HydrophobicContact CG-CG1 4.35Å; F79-I91 PolarHBondContact N-O 3.41Å; F79-I91 PolarHBondContact O-N 2.97Å; I91-R95 HydrophobicContact CD1-CB 4.19Å; I91-D102 HydrophobicContact CD1-CB 4.07Å; I91-D102 HydrophobicContact CG2-CB 4.35Å; I91-D108 HydrophobicContact CD1-CB 3.85Å
92	P	95.1	Very high	92.2	Very high	50 Å²	50	54.9 Å²	54.9	33%	0.325	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	141.8	171.5	-19.5	32.6	0	0	0	110.4	S94 R95	P92-S94 PolarHBondContact O-N 3.08Å; P92-R95 PolarHBondContact O-N 3.46Å
93	S	93.8	Very high	92.3	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.028	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-50.4	-31.1	174.1	53.6	0	0	0	0	113.2	T71 A72 C74 G77 R95 V96	T71-S93 WeakPolarHBondContact O-CB 3.36Å; A72-S93 VanDerWaalsContact CA-O 3.27Å; A72-S93 WeakPolarHBondContact CA-O 2.86Å; A72-S93 VanDerWaalsContact CB-O 3.28Å; A72-S93 WeakPolarHBondContact CB-O 3.46Å; C74-S93 WeakPolarHBondContact O-CB 3.21Å; C74-S93 PolarHBondContact O-OG 3.31Å; G77-S93 WeakPolarHBondContact O-CB 3.48Å; G77-S93 PolarHBondContact O-N 3.29Å; G77-S93 PolarHBondContact O-OG 2.89Å; S93-R95 PolarHBondContact O-N 3.31Å; S93-V96 WeakPolarHBondContact O-CB 3.32Å; S93-V96 WeakPolarHBondContact O-CG2 3.42Å; S93-V96 PolarHBondContact O-N 3.31Å
94	S	92.9	Very high	92.4	Very high	81 Å²	81	53.6 Å²	53.6	57%	0.566	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-62.3	-7	177.5	73.6	0	0	0	0	115.4	P92	P92-S94 PolarHBondContact O-N 3.08Å
95	R	94.1	Very high	92.6	Very high	94 Å²	94	52.1 Å²	52.1	36%	0.355	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-109.7	20	174.8	-56.6	-168.1	-161.6	145.7	6.2	113.1	I91 P92 S93 D102	I91-R95 HydrophobicContact CD1-CB 4.19Å; P92-R95 PolarHBondContact O-N 3.46Å; S93-R95 PolarHBondContact O-N 3.31Å; R95-D102 WeakPolarHBondContact CD-OD1 3.46Å; R95-D102 WeakPolarHBondContact CD-OD2 3.36Å; R95-D102 IonicContact CZ-OD1 2.66Å; R95-D102 IonicContact NE-OD1 2.68Å; R95-D102 IonicContact NH1-OD1 3.65Å; R95-D102 PolarHBondContact NH1-OD1 3.19Å
96	V	95.1	Very high	92.9	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	28%	0.284	C	S	.	.	S	Bend	trans	-99.4	108.1	177	-178.6	0	0	0	0	108.2	A72 F79 S93 Y110	A72-V96 HydrophobicContact CB-CB 4.43Å; F79-V96 HydrophobicContact CB-CG2 3.62Å; F79-V96 HydrophobicContact CD2-CB 4.44Å; F79-V96 HydrophobicContact CD2-CG1 4.05Å; F79-V96 HydrophobicContact CD2-CG2 3.44Å; F79-V96 VanDerWaalsContact CD2-CG2 3.44Å; F79-V96 HydrophobicContact CE2-CG1 4.11Å; F79-V96 HydrophobicContact CE2-CG2 4.22Å; F79-V96 HydrophobicContact CG-CG2 3.65Å; S93-V96 WeakPolarHBondContact O-CB 3.32Å; S93-V96 WeakPolarHBondContact O-CG2 3.42Å; S93-V96 PolarHBondContact O-N 3.31Å; V96-Y110 HydrophobicContact CG1-CD1 4.46Å; V96-Y110 HydrophobicContact CG1-CE1 3.73Å
97	N	93.2	Very high	93	Very high	42 Å²	42	51.4 Å²	51.4	23%	0.225	29%	0.286	C	S	.	.	S	Bend	trans	66.9	33.2	-171.7	-51.6	-70.3	0	0	0	114.8	D108 E109 Y110 N111 S112	N97-D108 PolarHBondContact N-O 2.95Å; N97-D108 PolarHBondContact OD1-O 3.26Å; N97-E109 VanDerWaalsContact C-OE1 3.27Å; N97-E109 WeakPolarHBondContact CA-OE1 3.33Å; N97-E109 PolarHBondContact N-OE1 3.5Å; N97-Y110 WeakPolarHBondContact ND2-CE1 3.43Å; N97-Y110 VanDerWaalsContact ND2-CZ 3.28Å; N97-Y110 PolarHBondContact OD1-N 3.38Å; N97-Y110 VanDerWaalsContact OD1-N 3.08Å; N97-N111 WeakPolarHBondContact OD1-CA 3.46Å; N97-N111 WeakPolarHBondContact OD1-CB 3.45Å; N97-N111 PolarHBondContact OD1-N 2.68Å; N97-S112 PolarHBondContact OD1-N 3.49Å
98	D	93.6	Very high	93.2	Very high	77 Å²	77	44.5 Å²	44.5	41%	0.412	26%	0.26	S	S	.	.	S	Bend	trans	-87.1	-11.1	179	88.6	-9.6	0	0	0	113.9	I100 E109	D98-I100 VanDerWaalsContact OD1-CB 3.23Å; D98-I100 WeakPolarHBondContact OD1-CB 3.22Å; D98-I100 WeakPolarHBondContact OD1-CG1 3.4Å; D98-I100 PolarHBondContact OD1-N 2.79Å; D98-E109 PolarHBondContact N-OE1 3.43Å
99	G	91.7	Very high	93.4	Very high	36 Å²	36	42.3 Å²	42.3	37%	0.371	25%	0.245	S	C	.	.	S	Bend	trans	101.7	3.3	-177.3	0	0	0	0	0	114.5	E109	G99-E109 WeakPolarHBondContact CA-OE2 3.45Å; G99-E109 PolarHBondContact N-OE1 3.4Å; G99-E109 PolarHBondContact N-OE2 3.03Å
100	I	93.1	Very high	93.3	Very high	99 Å²	99	45 Å²	45	51%	0.508	25%	0.248	S	C	.	.	S	Bend	trans	-116.4	129.7	180	-53.5	175.9	0	0	0	109.5	D98 D102 E109	D98-I100 VanDerWaalsContact OD1-CB 3.23Å; D98-I100 WeakPolarHBondContact OD1-CB 3.22Å; D98-I100 WeakPolarHBondContact OD1-CG1 3.4Å; D98-I100 PolarHBondContact OD1-N 2.79Å; I100-D102 PolarHBondContact O-N 2.82Å; I100-D102 VanDerWaalsContact O-N 3.16Å; I100-E109 WeakPolarHBondContact O-CG 3.43Å
101	C	92.7	Very high	93.1	Very high	64 Å²	64	45.5 Å²	45.5	43%	0.432	26%	0.256	S	S	.	.			trans	-79.3	95.4	175.5	-41.5	0	0	0	0	109.9	C116	C101-C116 HydrophobicContact CB-CB 3.83Å; C101-C116 WeakPolarHBondContact CB-SG 3.47Å; C101-C116 VanDerWaalsContact SG-CA 3.57Å; C101-C116 WeakPolarHBondContact SG-CB 3.31Å; C101-C116 CovalentContact SG-SG 2.04Å; C101-C116 PolarHBondContact SG-SG 3.38Å
102	D	93.6	Very high	92.8	Very high	60 Å²	60	46.9 Å²	46.9	32%	0.321	27%	0.267	S	S	.	.			trans	-96.3	-39.7	-175.9	-115.4	-105.2	0	0	0	111.8	I91 R95 I100 D108	I91-D102 HydrophobicContact CD1-CB 4.07Å; I91-D102 HydrophobicContact CG2-CB 4.35Å; R95-D102 WeakPolarHBondContact CD-OD1 3.46Å; R95-D102 WeakPolarHBondContact CD-OD2 3.36Å; R95-D102 IonicContact CZ-OD1 2.66Å; R95-D102 IonicContact NE-OD1 2.68Å; R95-D102 IonicContact NH1-OD1 3.65Å; R95-D102 PolarHBondContact NH1-OD1 3.19Å; I100-D102 PolarHBondContact O-N 2.82Å; I100-D102 VanDerWaalsContact O-N 3.16Å; D102-D108 WeakPolarHBondContact CA-OD2 3.27Å; D102-D108 PolarHBondContact N-OD2 2.78Å
103	C	93.4	Very high	92.3	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.027	29%	0.29	C	S	.	.	S	Bend	trans	-77.7	133.6	170	-63.3	0	0	0	0	111	C81 D105 T106 D108	C81-C103 HydrophobicContact CB-CB 3.67Å; C81-C103 WeakPolarHBondContact CB-SG 3.13Å; C81-C103 VanDerWaalsContact SG-CA 3.55Å; C81-C103 WeakPolarHBondContact SG-CB 3.39Å; C81-C103 CovalentContact SG-SG 2.03Å; C81-C103 PolarHBondContact SG-SG 3.1Å; C103-D105 VanDerWaalsContact CB-OD1 3.25Å; C103-D105 WeakPolarHBondContact CB-OD1 3.45Å; C103-D105 PolarHBondContact O-N 3.13Å; C103-T106 PolarHBondContact O-N 2.87Å; C103-T106 VanDerWaalsContact O-N 3.17Å; C103-D108 HydrophobicContact CB-CB 4.33Å; C103-D108 PolarHBondContact N-OD2 3.21Å
104	C	92.9	Very high	92.2	Very high	14 Å²	14	51.1 Å²	51.1	10%	0.095	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.3	175.1	69.1	0	0	0	0	113.2	N83 N118 T119 C120 L123	N83-C104 PolarHBondContact OD1-N 2.89Å; N83-C104 PolarHBondContact OD1-SG 3.43Å; C104-N118 CarbonylContact O-C 3.59Å; C104-N118 VanDerWaalsContact O-CA 3.28Å; C104-N118 WeakPolarHBondContact O-CA 3.46Å; C104-T119 PolarHBondContact O-N 2.87Å; C104-C120 HydrophobicContact CB-CB 4.16Å; C104-C120 WeakPolarHBondContact CB-SG 3.11Å; C104-C120 PolarHBondContact O-SG 3.2Å; C104-C120 WeakPolarHBondContact SG-CA 3.36Å; C104-C120 WeakPolarHBondContact SG-CB 3.43Å; C104-C120 CovalentContact SG-SG 2.04Å; C104-C120 PolarHBondContact SG-SG 3.49Å; C104-L123 HydrophobicContact CB-CD1 3.8Å
105	D	92.2	Very high	92	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.08	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-5	176.7	67	10.6	0	0	0	114.1	T82 N83 C103 T107 N118 C120	T82-D105 PolarHBondContact N-OD2 2.73Å; N83-D105 PolarHBondContact N-OD2 3.46Å; C103-D105 VanDerWaalsContact CB-OD1 3.25Å; C103-D105 WeakPolarHBondContact CB-OD1 3.45Å; C103-D105 PolarHBondContact O-N 3.13Å; D105-T107 VanDerWaalsContact C-N 3.28Å; D105-T107 HydrophobicContact CB-CG2 4.27Å; D105-T107 VanDerWaalsContact CG-CG2 3.43Å; D105-T107 VanDerWaalsContact CG-OG1 3.31Å; D105-T107 PolarHBondContact O-N 3.3Å; D105-T107 VanDerWaalsContact OD1-CB 3.32Å; D105-T107 WeakPolarHBondContact OD1-CB 3.36Å; D105-T107 VanDerWaalsContact OD1-CG2 3.31Å; D105-T107 WeakPolarHBondContact OD1-CG2 3.31Å; D105-T107 PolarHBondContact OD1-N 3.48Å; D105-T107 PolarHBondContact OD1-OG1 2.81Å; D105-T107 PolarHBondContact OD2-OG1 2.65Å; D105-N118 WeakPolarHBondContact CA-ND2 3.49Å; D105-N118 PolarHBondContact O-ND2 2.84Å; D105-C120 PolarHBondContact N-SG 3.02Å
106	T	92.5	Very high	91.8	Very high	40 Å²	40	50.9 Å²	50.9	25%	0.245	31%	0.308	C	S	.	.			trans	59.2	30.2	-178.7	84.9	0	0	0	0	114.3	C103 D108 C116 N118	C103-T106 PolarHBondContact O-N 2.87Å; C103-T106 VanDerWaalsContact O-N 3.17Å; T106-D108 VanDerWaalsContact CA-OD1 3.3Å; T106-D108 WeakPolarHBondContact CA-OD1 3.25Å; T106-C116 HydrophobicContact CG2-CB 3.44Å; T106-C116 VanDerWaalsContact CG2-CB 3.44Å; T106-N118 HydrophobicContact CG2-CB 4.48Å
107	T	92.2	Very high	91.6	Very high	42 Å²	42	58 Å²	58	26%	0.258	34%	0.341	S	S	.	.			trans	-81.9	-16.1	-180	54.8	0	0	0	0	114.4	R25 F79 D105	R25-T107 PolarHBondContact NH1-O 3.32Å; F79-T107 VanDerWaalsContact CZ-O 3.31Å; F79-T107 WeakPolarHBondContact CZ-O 3.3Å; D105-T107 VanDerWaalsContact C-N 3.28Å; D105-T107 HydrophobicContact CB-CG2 4.27Å; D105-T107 VanDerWaalsContact CG-CG2 3.43Å; D105-T107 VanDerWaalsContact CG-OG1 3.31Å; D105-T107 PolarHBondContact O-N 3.3Å; D105-T107 VanDerWaalsContact OD1-CB 3.32Å; D105-T107 WeakPolarHBondContact OD1-CB 3.36Å; D105-T107 VanDerWaalsContact OD1-CG2 3.31Å; D105-T107 WeakPolarHBondContact OD1-CG2 3.31Å; D105-T107 PolarHBondContact OD1-N 3.48Å; D105-T107 PolarHBondContact OD1-OG1 2.81Å; D105-T107 PolarHBondContact OD2-OG1 2.65Å
108	D	93.4	Very high	91.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.353	C	S	.	.	S	Bend	trans	-69.7	-52.5	172	49.1	-10.2	0	0	0	113	F79 I91 N97 D102 C103 T106 Y110	F79-D108 HydrophobicContact CE1-CB 4.48Å; I91-D108 HydrophobicContact CD1-CB 3.85Å; N97-D108 PolarHBondContact N-O 2.95Å; N97-D108 PolarHBondContact OD1-O 3.26Å; D102-D108 WeakPolarHBondContact CA-OD2 3.27Å; D102-D108 PolarHBondContact N-OD2 2.78Å; C103-D108 HydrophobicContact CB-CB 4.33Å; C103-D108 PolarHBondContact N-OD2 3.21Å; T106-D108 VanDerWaalsContact CA-OD1 3.3Å; T106-D108 WeakPolarHBondContact CA-OD1 3.25Å; D108-Y110 WeakPolarHBondContact O-CD1 3.29Å; D108-Y110 PolarHBondContact O-N 3.35Å
109	E	94.1	Very high	91.5	Very high	12 Å²	12	59.6 Å²	59.6	6%	0.056	35%	0.351	C	S	.	.			trans	-87.6	46.5	-171.2	-69.7	-64.1	103.6	0	0	112.9	N97 D98 G99 I100 N111 S112	N97-E109 VanDerWaalsContact C-OE1 3.27Å; N97-E109 WeakPolarHBondContact CA-OE1 3.33Å; N97-E109 PolarHBondContact N-OE1 3.5Å; D98-E109 PolarHBondContact N-OE1 3.43Å; G99-E109 WeakPolarHBondContact CA-OE2 3.45Å; G99-E109 PolarHBondContact N-OE1 3.4Å; G99-E109 PolarHBondContact N-OE2 3.03Å; I100-E109 WeakPolarHBondContact O-CG 3.43Å; E109-N111 PolarHBondContact O-N 2.92Å; E109-S112 WeakPolarHBondContact OE2-CB 3.37Å; E109-S112 PolarHBondContact OE2-OG 2.66Å
110	Y	90.7	Very high	91.6	Very high	80 Å²	80	57.9 Å²	57.9	31%	0.314	33%	0.334	S	S	.	.	S	Bend	trans	-80.7	-11.4	-170.9	69	-93.8	0	0	0	115.6	R25 G70 V96 N97 D108	R25-Y110 VanDerWaalsContact CD-CD1 3.5Å; R25-Y110 VanDerWaalsContact NH1-CB 3.29Å; G70-Y110 WeakPolarHBondContact O-CE1 3.35Å; G70-Y110 PolarHBondContact O-OH 3Å; V96-Y110 HydrophobicContact CG1-CD1 4.46Å; V96-Y110 HydrophobicContact CG1-CE1 3.73Å; N97-Y110 WeakPolarHBondContact ND2-CE1 3.43Å; N97-Y110 VanDerWaalsContact ND2-CZ 3.28Å; N97-Y110 PolarHBondContact OD1-N 3.38Å; N97-Y110 VanDerWaalsContact OD1-N 3.08Å; D108-Y110 WeakPolarHBondContact O-CD1 3.29Å; D108-Y110 PolarHBondContact O-N 3.35Å
111	N	90.4	Very high	91.5	Very high	124 Å²	124	62.8 Å²	62.8	66%	0.663	35%	0.346	S	S	*	.	S	Bend	trans	-146.7	-1.4	-172	-164.3	39.4	0	0	0	113.6	N97 E109 G113	N97-N111 WeakPolarHBondContact OD1-CA 3.46Å; N97-N111 WeakPolarHBondContact OD1-CB 3.45Å; N97-N111 PolarHBondContact OD1-N 2.68Å; E109-N111 PolarHBondContact O-N 2.92Å; N111-G113 VanDerWaalsContact C-N 3.32Å
112	S	87.4	Confident	91.4	Very high	43 Å²	43	65.4 Å²	65.4	30%	0.301	35%	0.352	S	S	.	.	S	Bend	trans	-71	-26	175.7	63	0	0	0	0	113.6	N97 E109 V114	N97-S112 PolarHBondContact OD1-N 3.49Å; E109-S112 WeakPolarHBondContact OE2-CB 3.37Å; E109-S112 PolarHBondContact OE2-OG 2.66Å; S112-V114 PolarHBondContact OG-N 2.89Å
113	G	86	Confident	91.3	Very high	78 Å²	78	65.8 Å²	65.8	80%	0.804	35%	0.353	S	S	*	.			trans	87.2	12.7	-175.6	0	0	0	0	0	114.7	N111	N111-G113 VanDerWaalsContact C-N 3.32Å
114	V	90.6	Very high	91.2	Very high	64 Å²	64	66.1 Å²	66.1	39%	0.388	36%	0.358	S	S	.	.			trans	-84.2	140.7	172.4	-179.8	0	0	0	0	110.8	S112 C116	S112-V114 PolarHBondContact OG-N 2.89Å; V114-C116 PolarHBondContact O-N 3.47Å
115	D	89.4	Confident	91.1	Very high	151 Å²	151	72 Å²	72	81%	0.807	38%	0.378	S	S	*	.			trans	-90.5	76.4	177.2	-171.5	32.5	0	0	0	110.4
116	C	89.5	Confident	91.2	Very high	19 Å²	19	76.9 Å²	76.9	13%	0.128	40%	0.398	C	S	.	.			trans	-75.4	146.5	178.6	-67.3	0	0	0	0	112	C101 T106 V114	C101-C116 HydrophobicContact CB-CB 3.83Å; C101-C116 WeakPolarHBondContact CB-SG 3.47Å; C101-C116 VanDerWaalsContact SG-CA 3.57Å; C101-C116 WeakPolarHBondContact SG-CB 3.31Å; C101-C116 CovalentContact SG-SG 2.04Å; C101-C116 PolarHBondContact SG-SG 3.38Å; T106-C116 HydrophobicContact CG2-CB 3.44Å; T106-C116 VanDerWaalsContact CG2-CB 3.44Å; V114-C116 PolarHBondContact O-N 3.47Å
117	Q	91.6	Very high	91	Very high	155 Å²	155	77.8 Å²	77.8	72%	0.724	40%	0.4	S	S	*	.			trans	-107.6	126	179.2	-64.3	-173.9	1.4	0	0	111.8	T119	Q117-T119 PolarHBondContact O-N 3.39Å
118	N	91.4	Very high	90.9	Very high	90 Å²	90	82.3 Å²	82.3	48%	0.481	42%	0.416	S	S	.	.			trans	-68.2	117	176.4	-176.1	-52.4	0	0	0	110.7	C104 D105 T106 C120	C104-N118 CarbonylContact O-C 3.59Å; C104-N118 VanDerWaalsContact O-CA 3.28Å; C104-N118 WeakPolarHBondContact O-CA 3.46Å; D105-N118 WeakPolarHBondContact CA-ND2 3.49Å; D105-N118 PolarHBondContact O-ND2 2.84Å; T106-N118 HydrophobicContact CG2-CB 4.48Å; N118-C120 PolarHBondContact OD1-N 3.21Å
119	T	92.6	Very high	90.9	Very high	61 Å²	61	86.1 Å²	86.1	37%	0.374	43%	0.434	S	S	.	.			trans	-115.2	-6.4	-174.5	48.8	0	0	0	0	113.8	C104 Q117 R121 E122 L123	C104-T119 PolarHBondContact O-N 2.87Å; Q117-T119 PolarHBondContact O-N 3.39Å; T119-R121 VanDerWaalsContact C-N 3.29Å; T119-R121 PolarHBondContact O-N 3.4Å; T119-R121 VanDerWaalsContact O-N 3.15Å; T119-E122 PolarHBondContact O-N 2.84Å; T119-L123 PolarHBondContact O-N 2.83Å; T119-L123 VanDerWaalsContact O-N 3.15Å
120	C	92.8	Very high	90.8	Very high	0 Å²	0	89.5 Å²	89.5	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-51.9	-44.8	-173.3	-59.7	0	0	0	0	113.4	N83 F86 C104 D105 N118 E122 L123 G124	N83-C120 VanDerWaalsContact C-SG 3.59Å; N83-C120 WeakPolarHBondContact CA-SG 3.36Å; F86-C120 HydrophobicContact CB-CB 3.75Å; C104-C120 HydrophobicContact CB-CB 4.16Å; C104-C120 WeakPolarHBondContact CB-SG 3.11Å; C104-C120 PolarHBondContact O-SG 3.2Å; C104-C120 WeakPolarHBondContact SG-CA 3.36Å; C104-C120 WeakPolarHBondContact SG-CB 3.43Å; C104-C120 CovalentContact SG-SG 2.04Å; C104-C120 PolarHBondContact SG-SG 3.49Å; D105-C120 PolarHBondContact N-SG 3.02Å; N118-C120 PolarHBondContact OD1-N 3.21Å; C120-E122 PolarHBondContact O-N 3.13Å; C120-L123 PolarHBondContact O-N 3.22Å; C120-L123 VanDerWaalsContact O-N 3.12Å; C120-G124 PolarHBondContact O-N 3.21Å
121	R	91.2	Very high	90.7	Very high	202 Å²	202	90.8 Å²	90.8	76%	0.762	46%	0.461	S	S	*	.	H	α-helix	trans	-63	-26	-178.9	-66.4	-177.3	177.7	-178.3	-0.5	113.9	T119 R125	T119-R121 VanDerWaalsContact C-N 3.29Å; T119-R121 PolarHBondContact O-N 3.4Å; T119-R121 VanDerWaalsContact O-N 3.15Å; R121-R125 VanDerWaalsContact O-CB 3.24Å; R121-R125 WeakPolarHBondContact O-CB 3.5Å; R121-R125 PolarHBondContact O-N 2.94Å
122	E	92.1	Very high	90.7	Very high	119 Å²	119	90 Å²	90	56%	0.556	45%	0.454	S	S	*	.	H	α-helix	trans	-80.7	-43.5	172.7	178.6	153.4	-135.2	0	0	111.3	T119 C120 R125 K126	T119-E122 PolarHBondContact O-N 2.84Å; C120-E122 PolarHBondContact O-N 3.13Å; E122-R125 PolarHBondContact O-N 3.46Å; E122-R125 IonicContact OE1-NH2 3.23Å; E122-R125 PolarHBondContact OE1-NH2 3.48Å; E122-K126 WeakPolarHBondContact O-CB 3.34Å; E122-K126 PolarHBondContact O-N 3.35Å
123	L	90.8	Very high	90.9	Very high	68 Å²	68	92.9 Å²	92.9	36%	0.356	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-50.2	177.7	-63.5	174.6	0	0	0	112	F86 C104 T119 C120 K126 E127	F86-L123 HydrophobicContact CD1-CB 4.22Å; F86-L123 HydrophobicContact CD1-CD1 4.23Å; F86-L123 HydrophobicContact CD2-CB 3.92Å; F86-L123 HydrophobicContact CE1-CB 4.34Å; F86-L123 HydrophobicContact CE1-CD1 4.17Å; F86-L123 HydrophobicContact CE2-CB 4.04Å; F86-L123 HydrophobicContact CG-CB 3.99Å; F86-L123 HydrophobicContact CZ-CB 4.25Å; C104-L123 HydrophobicContact CB-CD1 3.8Å; T119-L123 PolarHBondContact O-N 2.83Å; T119-L123 VanDerWaalsContact O-N 3.15Å; C120-L123 PolarHBondContact O-N 3.22Å; C120-L123 VanDerWaalsContact O-N 3.12Å; L123-K126 WeakPolarHBondContact O-CB 3.46Å; L123-K126 PolarHBondContact O-N 3.48Å; L123-E127 PolarHBondContact O-N 2.99Å
124	G	91.1	Very high	91	Very high	12 Å²	12	95.1 Å²	95.1	12%	0.124	45%	0.452	C	S	.	.	H	α-helix	trans	-70.2	-30.8	178.5	0	0	0	0	0	113.8	G85 C120 K128	G85-G124 WeakPolarHBondContact O-CA 3.43Å; C120-G124 PolarHBondContact O-N 3.21Å; G124-K128 WeakPolarHBondContact O-CB 3.34Å; G124-K128 PolarHBondContact O-N 2.83Å
125	R	91.4	Very high	90.9	Very high	137 Å²	137	94.8 Å²	94.8	52%	0.517	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-47.3	166.9	174.8	-178.2	59.5	146.5	-2	110.6	R121 E122 K128 E129	R121-R125 VanDerWaalsContact O-CB 3.24Å; R121-R125 WeakPolarHBondContact O-CB 3.5Å; R121-R125 PolarHBondContact O-N 2.94Å; E122-R125 PolarHBondContact O-N 3.46Å; E122-R125 IonicContact OE1-NH2 3.23Å; E122-R125 PolarHBondContact OE1-NH2 3.48Å; R125-K128 PolarHBondContact O-N 2.85Å; R125-E129 HydrophobicContact CG-CG 4.47Å; R125-E129 WeakPolarHBondContact CG-OE1 3.38Å; R125-E129 WeakPolarHBondContact O-CB 3.41Å; R125-E129 WeakPolarHBondContact O-CG 3.37Å; R125-E129 PolarHBondContact O-N 2.97Å
126	K	93.1	Very high	91	Very high	117 Å²	117	93.7 Å²	93.7	51%	0.509	45%	0.446	S	S	.	.	H	α-helix	trans	-63.5	-48.6	179.9	-175.6	-169.9	163.9	-169.3	0	111.6	E122 L123 K128 E129 E130	E122-K126 WeakPolarHBondContact O-CB 3.34Å; E122-K126 PolarHBondContact O-N 3.35Å; L123-K126 WeakPolarHBondContact O-CB 3.46Å; L123-K126 PolarHBondContact O-N 3.48Å; K126-K128 VanDerWaalsContact C-N 3.3Å; K126-K128 PolarHBondContact O-N 3.14Å; K126-E129 PolarHBondContact O-N 3.01Å; K126-E130 WeakPolarHBondContact CE-OE1 3.3Å; K126-E130 IonicContact NZ-OE1 3.82Å; K126-E130 WeakPolarHBondContact O-CG 3.39Å; K126-E130 PolarHBondContact O-N 3.35Å
127	E	90	Very high	91.1	Very high	60 Å²	60	96.6 Å²	96.6	28%	0.28	46%	0.459	S	S	.	.	H	α-helix	trans	-58.6	-42.9	177.2	-169.5	174.1	-119.4	0	0	110.6	F86 R87 L123 E130 L131	F86-E127 WeakPolarHBondContact CD2-OE2 3.37Å; F86-E127 HydrophobicContact CE2-CB 4.34Å; F86-E127 WeakPolarHBondContact CE2-OE2 3.22Å; R87-E127 IonicContact CZ-OE1 3.25Å; R87-E127 IonicContact NH1-OE1 2.78Å; R87-E127 PolarHBondContact NH1-OE1 2.84Å; L123-E127 PolarHBondContact O-N 2.99Å; E127-E130 PolarHBondContact O-N 2.98Å; E127-L131 HydrophobicContact CG-CD1 4.18Å; E127-L131 WeakPolarHBondContact O-CB 3.43Å; E127-L131 VanDerWaalsContact O-CG 3.28Å; E127-L131 WeakPolarHBondContact O-CG 3.5Å; E127-L131 PolarHBondContact O-N 2.82Å
128	K	89.8	Confident	91.1	Very high	136 Å²	136	90.6 Å²	90.6	59%	0.591	44%	0.436	S	S	*	.	H	α-helix	trans	-65.5	-40.5	175.2	-168.8	162.7	-168.8	153.7	0	113.2	G124 R125 K126 E130 Q132	G124-K128 WeakPolarHBondContact O-CB 3.34Å; G124-K128 PolarHBondContact O-N 2.83Å; R125-K128 PolarHBondContact O-N 2.85Å; K126-K128 VanDerWaalsContact C-N 3.3Å; K126-K128 PolarHBondContact O-N 3.14Å; K128-E130 VanDerWaalsContact C-N 3.33Å; K128-Q132 VanDerWaalsContact O-CB 3.28Å; K128-Q132 WeakPolarHBondContact O-CB 3.27Å; K128-Q132 WeakPolarHBondContact O-CG 3.31Å; K128-Q132 PolarHBondContact O-N 2.96Å
129	E	93.1	Very high	91.1	Very high	80 Å²	80	92.6 Å²	92.6	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-66.1	-32.4	173.7	-79.6	-175.9	-145.4	0	0	112.7	R125 K126 K133	R125-E129 HydrophobicContact CG-CG 4.47Å; R125-E129 WeakPolarHBondContact CG-OE1 3.38Å; R125-E129 WeakPolarHBondContact O-CB 3.41Å; R125-E129 WeakPolarHBondContact O-CG 3.37Å; R125-E129 PolarHBondContact O-N 2.97Å; K126-E129 PolarHBondContact O-N 3.01Å; E129-K133 WeakPolarHBondContact O-CD 3.46Å; E129-K133 VanDerWaalsContact O-CE 3.28Å; E129-K133 WeakPolarHBondContact O-CE 3.44Å; E129-K133 WeakPolarHBondContact O-CG 3.32Å; E129-K133 PolarHBondContact O-N 3.04Å; E129-K133 PolarHBondContact O-NZ 2.75Å; E129-K133 IonicContact OE2-NZ 3.29Å
130	E	91	Very high	91.1	Very high	84 Å²	84	94 Å²	94	39%	0.393	44%	0.443	S	S	.	.	H	α-helix	trans	-75.5	-45.6	176.2	-73.9	174	168.8	0	0	111	K126 E127 K128 Q132 K133 M134	K126-E130 WeakPolarHBondContact CE-OE1 3.3Å; K126-E130 IonicContact NZ-OE1 3.82Å; K126-E130 WeakPolarHBondContact O-CG 3.39Å; K126-E130 PolarHBondContact O-N 3.35Å; E127-E130 PolarHBondContact O-N 2.98Å; K128-E130 VanDerWaalsContact C-N 3.33Å; E130-Q132 VanDerWaalsContact C-N 3.35Å; E130-Q132 PolarHBondContact O-N 3.04Å; E130-K133 PolarHBondContact O-N 3.1Å; E130-M134 WeakPolarHBondContact O-CG 3.46Å; E130-M134 PolarHBondContact O-N 3.03Å
131	L	89.3	Confident	91.1	Very high	106 Å²	106	94 Å²	94	56%	0.555	44%	0.443	S	S	*	.	H	α-helix	trans	-60.8	-39.9	173.4	-71.7	170.7	0	0	0	112.4	E127 M134 A135	E127-L131 HydrophobicContact CG-CD1 4.18Å; E127-L131 WeakPolarHBondContact O-CB 3.43Å; E127-L131 VanDerWaalsContact O-CG 3.28Å; E127-L131 WeakPolarHBondContact O-CG 3.5Å; E127-L131 PolarHBondContact O-N 2.82Å; L131-M134 PolarHBondContact O-N 3.42Å; L131-A135 WeakPolarHBondContact O-CB 3.02Å; L131-A135 PolarHBondContact O-N 3Å
132	Q	90.3	Very high	91.3	Very high	107 Å²	107	85.5 Å²	85.5	50%	0.5	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-44	175	-79.9	175.4	-17.6	0	0	112	K128 E130 M134 A135 E136	K128-Q132 VanDerWaalsContact O-CB 3.28Å; K128-Q132 WeakPolarHBondContact O-CB 3.27Å; K128-Q132 WeakPolarHBondContact O-CG 3.31Å; K128-Q132 PolarHBondContact O-N 2.96Å; E130-Q132 VanDerWaalsContact C-N 3.35Å; E130-Q132 PolarHBondContact O-N 3.04Å; Q132-M134 PolarHBondContact O-N 2.81Å; Q132-A135 PolarHBondContact O-N 3.08Å; Q132-E136 WeakPolarHBondContact O-CG 3.45Å; Q132-E136 PolarHBondContact O-N 2.8Å
133	K	91	Very high	91.3	Very high	104 Å²	104	85.7 Å²	85.7	45%	0.452	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-41.2	175.7	-69.1	158	-164.1	147.7	0	111.6	E129 E130 E136 I137	E129-K133 WeakPolarHBondContact O-CD 3.46Å; E129-K133 VanDerWaalsContact O-CE 3.28Å; E129-K133 WeakPolarHBondContact O-CE 3.44Å; E129-K133 WeakPolarHBondContact O-CG 3.32Å; E129-K133 PolarHBondContact O-N 3.04Å; E129-K133 PolarHBondContact O-NZ 2.75Å; E129-K133 IonicContact OE2-NZ 3.29Å; E130-K133 PolarHBondContact O-N 3.1Å; K133-E136 PolarHBondContact O-N 3.19Å; K133-I137 WeakPolarHBondContact O-CB 3.39Å; K133-I137 WeakPolarHBondContact O-CD1 3.01Å; K133-I137 VanDerWaalsContact O-CG1 3.26Å; K133-I137 WeakPolarHBondContact O-CG1 3.3Å; K133-I137 PolarHBondContact O-N 2.94Å
134	M	88.2	Confident	91.5	Very high	125 Å²	125	86.8 Å²	86.8	62%	0.616	42%	0.416	S	S	*	.	H	α-helix	trans	-64.4	-41.7	174.8	-66.1	-175	-155.8	0	0	112	E130 L131 Q132 I137 A138	E130-M134 WeakPolarHBondContact O-CG 3.46Å; E130-M134 PolarHBondContact O-N 3.03Å; L131-M134 PolarHBondContact O-N 3.42Å; Q132-M134 PolarHBondContact O-N 2.81Å; M134-I137 PolarHBondContact O-N 3.21Å; M134-A138 VanDerWaalsContact O-CB 3.31Å; M134-A138 WeakPolarHBondContact O-CB 3.45Å; M134-A138 PolarHBondContact O-N 2.85Å
135	A	89.6	Confident	91.6	Very high	57 Å²	57	87.4 Å²	87.4	47%	0.471	42%	0.415	S	S	.	.	H	α-helix	trans	-66.6	-37.1	177.2	0	0	0	0	0	112.7	L131 Q132 K139	L131-A135 WeakPolarHBondContact O-CB 3.02Å; L131-A135 PolarHBondContact O-N 3Å; Q132-A135 PolarHBondContact O-N 3.08Å; A135-K139 WeakPolarHBondContact O-CB 3.28Å; A135-K139 PolarHBondContact O-N 3.39Å
136	E	90.9	Very high	91.7	Very high	129 Å²	129	85.8 Å²	85.8	60%	0.603	41%	0.412	S	S	*	.	H	α-helix	trans	-64.3	-47.9	172.3	-74.7	179.6	163.6	0	0	111.5	Q132 K133 A138 K139 E140	Q132-E136 WeakPolarHBondContact O-CG 3.45Å; Q132-E136 PolarHBondContact O-N 2.8Å; K133-E136 PolarHBondContact O-N 3.19Å; E136-A138 PolarHBondContact O-N 2.79Å; E136-K139 PolarHBondContact O-N 3.26Å; E136-E140 PolarHBondContact O-N 2.88Å
137	I	91.3	Very high	91.8	Very high	79 Å²	79	85 Å²	85	41%	0.405	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-44.7	175.8	-70.1	165.2	0	0	0	111.2	K133 M134 E140 G141	K133-I137 WeakPolarHBondContact O-CB 3.39Å; K133-I137 WeakPolarHBondContact O-CD1 3.01Å; K133-I137 VanDerWaalsContact O-CG1 3.26Å; K133-I137 WeakPolarHBondContact O-CG1 3.3Å; K133-I137 PolarHBondContact O-N 2.94Å; M134-I137 PolarHBondContact O-N 3.21Å; I137-E140 PolarHBondContact O-N 2.84Å; I137-G141 PolarHBondContact O-N 3.14Å
138	A	91.4	Very high	92	Very high	29 Å²	29	83.1 Å²	83.1	24%	0.24	40%	0.402	C	S	.	.	H	α-helix	trans	-65.4	-40	178.9	0	0	0	0	0	112.2	M134 E136 F142	M134-A138 VanDerWaalsContact O-CB 3.31Å; M134-A138 WeakPolarHBondContact O-CB 3.45Å; M134-A138 PolarHBondContact O-N 2.85Å; E136-A138 PolarHBondContact O-N 2.79Å; A138-F142 WeakPolarHBondContact O-CB 3.48Å; A138-F142 PolarHBondContact O-N 2.77Å
139	K	91.8	Very high	92.2	Very high	133 Å²	133	78 Å²	78	58%	0.578	38%	0.381	S	S	*	.	H	α-helix	trans	-65.6	-42.7	175.5	-179.6	-179.6	177.6	-177.5	0	112.2	A135 E136 M143 P519	A135-K139 WeakPolarHBondContact O-CB 3.28Å; A135-K139 PolarHBondContact O-N 3.39Å; E136-K139 PolarHBondContact O-N 3.26Å; K139-M143 WeakPolarHBondContact O-CG 3.47Å; K139-M143 PolarHBondContact O-N 2.8Å; K139-P519 HydrophobicContact CB-CG 4.42Å; K139-P519 HydrophobicContact CG-CG 4.49Å
140	E	93	Very high	92.3	Very high	90 Å²	90	79.7 Å²	79.7	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-47.1	174.6	-72.3	-166.3	151.6	0	0	111.6	E136 I137 F142 M143 F144 K491	E136-E140 PolarHBondContact O-N 2.88Å; I137-E140 PolarHBondContact O-N 2.84Å; E140-F142 VanDerWaalsContact C-N 3.3Å; E140-F142 PolarHBondContact O-N 3.1Å; E140-M143 WeakPolarHBondContact O-CB 3.36Å; E140-M143 PolarHBondContact O-N 3Å; E140-M143 VanDerWaalsContact O-N 3.12Å; E140-F144 WeakPolarHBondContact O-CD2 3.42Å; E140-F144 PolarHBondContact O-N 3Å; E140-K491 IonicContact OE1-NZ 3.09Å; E140-K491 VanDerWaalsContact OE2-CD 3.27Å; E140-K491 WeakPolarHBondContact OE2-CD 3.34Å; E140-K491 WeakPolarHBondContact OE2-CE 3.49Å; E140-K491 IonicContact OE2-NZ 2.55Å; E140-K491 PolarHBondContact OE2-NZ 3.04Å
141	G	93.8	Very high	92.5	Very high	0 Å²	0	79.9 Å²	79.9	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-58.6	-39.7	176	0	0	0	0	0	112.7	I137 F144 K145 P513	I137-G141 PolarHBondContact O-N 3.14Å; G141-F144 WeakPolarHBondContact O-CB 3.24Å; G141-F144 PolarHBondContact O-N 3.46Å; G141-K145 PolarHBondContact O-N 2.81Å; G141-P513 VanDerWaalsContact O-CB 3.27Å; G141-P513 WeakPolarHBondContact O-CB 3.22Å
142	F	93.8	Very high	92.7	Very high	24 Å²	24	75.6 Å²	75.6	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-69.4	-32.6	174.9	-179.2	-119.1	0	0	0	113.9	A138 E140 K145 K146 C516 Q517 D518 P519	A138-F142 WeakPolarHBondContact O-CB 3.48Å; A138-F142 PolarHBondContact O-N 2.77Å; E140-F142 VanDerWaalsContact C-N 3.3Å; E140-F142 PolarHBondContact O-N 3.1Å; F142-K145 HydrophobicContact CD2-CD 4.36Å; F142-K145 WeakPolarHBondContact O-CB 3.41Å; F142-K145 PolarHBondContact O-N 3.07Å; F142-K146 HydrophobicContact CE1-CD 4.17Å; F142-K146 HydrophobicContact CZ-CD 4.24Å; F142-K146 VanDerWaalsContact CZ-NZ 3.3Å; F142-K146 PolarHBondContact O-N 3.24Å; F142-C516 HydrophobicContact CB-CB 4.14Å; F142-Q517 WeakPolarHBondContact CD2-O 3.31Å; F142-Q517 WeakPolarHBondContact CG-O 3.39Å; F142-D518 HydrophobicContact CD1-CB 4.48Å; F142-D518 HydrophobicContact CE1-CB 3.62Å; F142-D518 WeakPolarHBondContact CE1-OD2 3.48Å; F142-D518 HydrophobicContact CE2-CB 3.99Å; F142-D518 VanDerWaalsContact CZ-CA 3.47Å; F142-D518 HydrophobicContact CZ-CB 3.33Å; F142-D518 WeakPolarHBondContact CZ-OD2 3.45Å; F142-P519 VanDerWaalsContact CD1-CD 3.45Å; F142-P519 HydrophobicContact CD1-CG 4.48Å
143	M	93.1	Very high	92.8	Very high	123 Å²	123	75.3 Å²	75.3	61%	0.606	37%	0.366	S	S	*	.	H	α-helix	trans	-66.1	-40.6	170.1	-73	-63.9	-62.9	0	0	111.3	K139 E140 K146 Q147	K139-M143 WeakPolarHBondContact O-CG 3.47Å; K139-M143 PolarHBondContact O-N 2.8Å; E140-M143 WeakPolarHBondContact O-CB 3.36Å; E140-M143 PolarHBondContact O-N 3Å; E140-M143 VanDerWaalsContact O-N 3.12Å; M143-K146 PolarHBondContact O-N 3.38Å; M143-Q147 PolarHBondContact O-N 3.05Å
144	F	94	Very high	93	Very high	91 Å²	91	75.3 Å²	75.3	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-43.6	170.2	-87.3	-78.3	0	0	0	112.1	E140 G141 K146 Q147 L148 K491 P513	E140-F144 WeakPolarHBondContact O-CD2 3.42Å; E140-F144 PolarHBondContact O-N 3Å; G141-F144 WeakPolarHBondContact O-CB 3.24Å; G141-F144 PolarHBondContact O-N 3.46Å; F144-K146 VanDerWaalsContact C-N 3.26Å; F144-K146 PolarHBondContact O-N 2.93Å; F144-Q147 WeakPolarHBondContact O-CB 3.39Å; F144-Q147 PolarHBondContact O-N 2.81Å; F144-L148 WeakPolarHBondContact O-CG 3.4Å; F144-L148 PolarHBondContact O-N 3.47Å; F144-K491 HydrophobicContact CE2-CG 4.46Å; F144-P513 HydrophobicContact CB-CB 3.82Å; F144-P513 HydrophobicContact CB-CG 4.34Å
145	K	93.9	Very high	93.2	Very high	25 Å²	25	70.5 Å²	70.5	11%	0.109	35%	0.35	C	S	.	.	H	α-helix	trans	-53.6	-41.9	174.1	-177.6	174	-179.9	155.8	0	112.3	G141 F142 Q147 L148 I149 E411 A514 C516	G141-K145 PolarHBondContact O-N 2.81Å; F142-K145 HydrophobicContact CD2-CD 4.36Å; F142-K145 WeakPolarHBondContact O-CB 3.41Å; F142-K145 PolarHBondContact O-N 3.07Å; K145-Q147 VanDerWaalsContact C-N 3.34Å; K145-Q147 PolarHBondContact O-N 3.5Å; K145-L148 PolarHBondContact O-N 3.3Å; K145-I149 HydrophobicContact CD-CD1 4.43Å; K145-I149 HydrophobicContact CG-CD1 3.82Å; K145-I149 HydrophobicContact CG-CG1 4.38Å; K145-I149 WeakPolarHBondContact O-CB 3.43Å; K145-I149 VanDerWaalsContact O-CG1 3.27Å; K145-I149 WeakPolarHBondContact O-CG1 3.46Å; K145-I149 PolarHBondContact O-N 2.94Å; K145-E411 WeakPolarHBondContact CE-OE1 3.2Å; K145-E411 HydrophobicContact CG-CB 4.26Å; K145-E411 IonicContact NZ-OE1 4Å; K145-E411 PolarHBondContact NZ-OE1 3.05Å; K145-A514 VanDerWaalsContact CD-O 3.3Å; K145-A514 WeakPolarHBondContact CD-O 3.22Å; K145-A514 WeakPolarHBondContact CE-O 2.82Å; K145-A514 PolarHBondContact NZ-O 3.12Å; K145-C516 WeakPolarHBondContact CD-O 3.36Å
146	K	94.1	Very high	93.3	Very high	103 Å²	103	70 Å²	70	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-35.9	177	-78.9	176	171.8	165.2	0	113	F142 M143 F144 H150 D518	F142-K146 HydrophobicContact CE1-CD 4.17Å; F142-K146 HydrophobicContact CZ-CD 4.24Å; F142-K146 VanDerWaalsContact CZ-NZ 3.3Å; F142-K146 PolarHBondContact O-N 3.24Å; M143-K146 PolarHBondContact O-N 3.38Å; F144-K146 VanDerWaalsContact C-N 3.26Å; F144-K146 PolarHBondContact O-N 2.93Å; K146-H150 PolarHBondContact O-N 3.01Å; K146-D518 IonicContact NZ-OD2 3.5Å
147	Q	94.4	Very high	93.3	Very high	100 Å²	100	69.9 Å²	69.9	47%	0.467	34%	0.339	S	S	.	.	H	α-helix	trans	-69.3	-48.4	172.4	178.4	174.4	-17.3	0	0	111.4	M143 F144 K145 I149 H150 E151	M143-Q147 PolarHBondContact O-N 3.05Å; F144-Q147 WeakPolarHBondContact O-CB 3.39Å; F144-Q147 PolarHBondContact O-N 2.81Å; K145-Q147 VanDerWaalsContact C-N 3.34Å; K145-Q147 PolarHBondContact O-N 3.5Å; Q147-I149 VanDerWaalsContact C-N 3.3Å; Q147-I149 PolarHBondContact O-N 3.07Å; Q147-H150 WeakPolarHBondContact O-CA 3.5Å; Q147-H150 WeakPolarHBondContact O-CB 3.37Å; Q147-H150 PolarHBondContact O-N 3.19Å; Q147-E151 HydrophobicContact CG-CG 4.43Å; Q147-E151 VanDerWaalsContact CG-OE1 3.27Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.26Å; Q147-E151 PolarHBondContact NE2-OE1 3.39Å; Q147-E151 PolarHBondContact O-N 3.37Å
148	L	94.1	Very high	93.5	Very high	21 Å²	21	70.5 Å²	70.5	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-59.7	-38.1	180	-65.5	168.2	0	0	0	112.3	F144 K145 H150 E151 A152 Y414 P513	F144-L148 WeakPolarHBondContact O-CG 3.4Å; F144-L148 PolarHBondContact O-N 3.47Å; K145-L148 PolarHBondContact O-N 3.3Å; L148-H150 VanDerWaalsContact C-N 3.31Å; L148-H150 PolarHBondContact O-N 3.41Å; L148-E151 PolarHBondContact O-N 3.39Å; L148-A152 WeakPolarHBondContact O-CB 3.13Å; L148-A152 PolarHBondContact O-N 2.93Å; L148-Y414 HydrophobicContact CB-CD1 4.47Å; L148-Y414 HydrophobicContact CD1-CD1 3.92Å; L148-Y414 HydrophobicContact CD1-CE1 3.78Å; L148-Y414 HydrophobicContact CD1-CE2 4.4Å; L148-Y414 HydrophobicContact CD1-CG 4.3Å; L148-Y414 HydrophobicContact CD2-CD1 4.1Å; L148-Y414 HydrophobicContact CD2-CD2 4.05Å; L148-Y414 HydrophobicContact CD2-CG 3.75Å; L148-Y414 HydrophobicContact CG-CD1 4.39Å; L148-P513 HydrophobicContact CD1-CB 4.44Å; L148-P513 HydrophobicContact CD1-CG 3.78Å
149	I	94.7	Very high	93.6	Very high	29 Å²	29	71.8 Å²	71.8	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-34.3	172.5	-73.9	168.6	0	0	0	112.2	K145 Q147 K153 E411	K145-I149 HydrophobicContact CD-CD1 4.43Å; K145-I149 HydrophobicContact CG-CD1 3.82Å; K145-I149 HydrophobicContact CG-CG1 4.38Å; K145-I149 WeakPolarHBondContact O-CB 3.43Å; K145-I149 VanDerWaalsContact O-CG1 3.27Å; K145-I149 WeakPolarHBondContact O-CG1 3.46Å; K145-I149 PolarHBondContact O-N 2.94Å; Q147-I149 VanDerWaalsContact C-N 3.3Å; Q147-I149 PolarHBondContact O-N 3.07Å; I149-K153 HydrophobicContact CG2-CD 4.03Å; I149-K153 WeakPolarHBondContact O-CB 3.45Å; I149-K153 WeakPolarHBondContact O-CD 3.45Å; I149-K153 VanDerWaalsContact O-CG 3.25Å; I149-K153 WeakPolarHBondContact O-CG 3.46Å; I149-K153 PolarHBondContact O-N 3.47Å; I149-E411 HydrophobicContact CD1-CB 4.09Å; I149-E411 HydrophobicContact CG1-CB 3.7Å
150	H	94.8	Very high	93.7	Very high	115 Å²	115	70.3 Å²	70.3	53%	0.532	34%	0.337	S	S	.	.	H	α-helix	trans	-72.3	-47	178.2	-174.8	57.6	0	0	0	111.1	K146 Q147 L148 K153 Q154	K146-H150 PolarHBondContact O-N 3.01Å; Q147-H150 WeakPolarHBondContact O-CA 3.5Å; Q147-H150 WeakPolarHBondContact O-CB 3.37Å; Q147-H150 PolarHBondContact O-N 3.19Å; L148-H150 VanDerWaalsContact C-N 3.31Å; L148-H150 PolarHBondContact O-N 3.41Å; H150-K153 PolarHBondContact O-N 3.02Å; H150-Q154 PolarHBondContact CE1-NE2 3.14Å; H150-Q154 PolarHBondContact NE2-NE2 3.47Å; H150-Q154 VanDerWaalsContact NE2-NE2 3.16Å; H150-Q154 PolarHBondContact O-N 2.94Å; H150-Q154 VanDerWaalsContact O-N 3.07Å
151	E	94.3	Very high	93.8	Very high	88 Å²	88	69.3 Å²	69.3	41%	0.411	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-42.7	177.2	-68.2	170.7	-178.5	0	0	111.5	Q147 L148 K153 Q154 G155	Q147-E151 HydrophobicContact CG-CG 4.43Å; Q147-E151 VanDerWaalsContact CG-OE1 3.27Å; Q147-E151 WeakPolarHBondContact CG-OE1 3.26Å; Q147-E151 PolarHBondContact NE2-OE1 3.39Å; Q147-E151 PolarHBondContact O-N 3.37Å; L148-E151 PolarHBondContact O-N 3.39Å; E151-K153 VanDerWaalsContact C-N 3.34Å; E151-K153 PolarHBondContact O-N 3.33Å; E151-Q154 PolarHBondContact O-N 3.04Å; E151-G155 PolarHBondContact O-N 3.34Å
152	A	94.1	Very high	93.9	Very high	15 Å²	15	74.9 Å²	74.9	12%	0.124	36%	0.364	C	S	.	.	H	α-helix	trans	-61	-40.4	175.3	0	0	0	0	0	112.6	L148 G155 L156 S410 A413	L148-A152 WeakPolarHBondContact O-CB 3.13Å; L148-A152 PolarHBondContact O-N 2.93Å; A152-G155 PolarHBondContact O-N 2.55Å; A152-L156 VanDerWaalsContact O-CB 3.31Å; A152-L156 WeakPolarHBondContact O-CB 3.06Å; A152-L156 PolarHBondContact O-N 3.09Å; A152-S410 VanDerWaalsContact CB-O 3.31Å; A152-S410 WeakPolarHBondContact CB-O 3.3Å; A152-A413 HydrophobicContact CB-CB 3.91Å
153	K	93.4	Very high	94.1	Very high	102 Å²	102	74.8 Å²	74.8	44%	0.443	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-38.2	177.8	-75.9	170.1	-176.7	170.9	0	112.3	I149 H150 E151 E157 S409	I149-K153 HydrophobicContact CG2-CD 4.03Å; I149-K153 WeakPolarHBondContact O-CB 3.45Å; I149-K153 WeakPolarHBondContact O-CD 3.45Å; I149-K153 VanDerWaalsContact O-CG 3.25Å; I149-K153 WeakPolarHBondContact O-CG 3.46Å; I149-K153 PolarHBondContact O-N 3.47Å; H150-K153 PolarHBondContact O-N 3.02Å; E151-K153 VanDerWaalsContact C-N 3.34Å; E151-K153 PolarHBondContact O-N 3.33Å; K153-E157 PolarHBondContact O-N 3.01Å; K153-S409 WeakPolarHBondContact CE-O 3.42Å; K153-S409 PolarHBondContact NZ-OG 2.99Å
154	Q	94.1	Very high	94.2	Very high	103 Å²	103	70.1 Å²	70.1	48%	0.481	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-49.8	171.8	-73.2	174.1	-19.5	0	0	111.3	H150 E151 L156 E157 D158	H150-Q154 PolarHBondContact CE1-NE2 3.14Å; H150-Q154 PolarHBondContact NE2-NE2 3.47Å; H150-Q154 VanDerWaalsContact NE2-NE2 3.16Å; H150-Q154 PolarHBondContact O-N 2.94Å; H150-Q154 VanDerWaalsContact O-N 3.07Å; E151-Q154 PolarHBondContact O-N 3.04Å; Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 PolarHBondContact O-N 2.8Å; Q154-E157 PolarHBondContact O-N 3.38Å; Q154-E157 VanDerWaalsContact O-N 3.09Å; Q154-D158 PolarHBondContact O-N 2.86Å
155	G	92.5	Very high	94.3	Very high	25 Å²	25	70.4 Å²	70.4	26%	0.258	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-31.7	178.8	0	0	0	0	0	113.9	E151 A152 K159	E151-G155 PolarHBondContact O-N 3.34Å; A152-G155 PolarHBondContact O-N 2.55Å; G155-K159 WeakPolarHBondContact O-CB 3.44Å; G155-K159 WeakPolarHBondContact O-CD 3.37Å; G155-K159 WeakPolarHBondContact O-CG 3.16Å; G155-K159 PolarHBondContact O-N 2.82Å
156	L	90.9	Very high	94.5	Very high	46 Å²	46	70.4 Å²	70.4	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-72.2	-37.2	174.1	-175.2	63.3	0	0	0	112.4	A152 Q154 K160 I402	A152-L156 VanDerWaalsContact O-CB 3.31Å; A152-L156 WeakPolarHBondContact O-CB 3.06Å; A152-L156 PolarHBondContact O-N 3.09Å; Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 PolarHBondContact O-N 2.8Å; L156-K160 VanDerWaalsContact O-CG 3.3Å; L156-K160 WeakPolarHBondContact O-CG 3.36Å; L156-K160 PolarHBondContact O-N 3.29Å; L156-I402 HydrophobicContact CD1-CG1 4.14Å; L156-I402 HydrophobicContact CD1-CG2 4.3Å
157	E	92.8	Very high	94.6	Very high	126 Å²	126	69 Å²	69	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-67.8	-44.7	174.7	-158	74.2	172.2	0	0	110.8	K153 Q154 K159 K160 S161	K153-E157 PolarHBondContact O-N 3.01Å; Q154-E157 PolarHBondContact O-N 3.38Å; Q154-E157 VanDerWaalsContact O-N 3.09Å; E157-K159 VanDerWaalsContact C-N 3.33Å; E157-K159 PolarHBondContact O-N 2.95Å; E157-K160 PolarHBondContact O-N 2.74Å; E157-K160 VanDerWaalsContact O-N 3.17Å; E157-S161 PolarHBondContact O-N 2.83Å
158	D	94.4	Very high	94.7	Very high	93 Å²	93	68.2 Å²	68.2	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-41.3	174.3	-75.9	-8.8	0	0	0	112	Q154 S161 K162	Q154-D158 PolarHBondContact O-N 2.86Å; D158-S161 PolarHBondContact O-N 2.79Å; D158-K162 WeakPolarHBondContact O-CB 3.34Å; D158-K162 VanDerWaalsContact O-CG 3.28Å; D158-K162 WeakPolarHBondContact O-CG 3.33Å; D158-K162 PolarHBondContact O-N 2.65Å
159	K	93.6	Very high	94.8	Very high	55 Å²	55	69.8 Å²	69.8	24%	0.239	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-39.4	175.6	-76.9	168.2	-170.3	-177.8	0	112.1	G155 E157 K162 L163 L398 E401 I402	G155-K159 WeakPolarHBondContact O-CB 3.44Å; G155-K159 WeakPolarHBondContact O-CD 3.37Å; G155-K159 WeakPolarHBondContact O-CG 3.16Å; G155-K159 PolarHBondContact O-N 2.82Å; E157-K159 VanDerWaalsContact C-N 3.33Å; E157-K159 PolarHBondContact O-N 2.95Å; K159-K162 PolarHBondContact O-N 2.81Å; K159-L163 WeakPolarHBondContact O-CB 3.4Å; K159-L163 PolarHBondContact O-N 3.07Å; K159-L398 HydrophobicContact CG-CD2 4.46Å; K159-E401 VanDerWaalsContact CD-OE2 3.31Å; K159-E401 WeakPolarHBondContact CD-OE2 3.42Å; K159-E401 WeakPolarHBondContact CE-OE2 3.3Å; K159-E401 IonicContact NZ-OE1 3.71Å; K159-E401 PolarHBondContact NZ-OE1 2.99Å; K159-E401 IonicContact NZ-OE2 2.81Å; K159-E401 PolarHBondContact NZ-OE2 2.73Å; K159-I402 HydrophobicContact CB-CD1 4.2Å; K159-I402 HydrophobicContact CB-CG1 4.27Å
160	K	94	Very high	94.9	Very high	103 Å²	103	70.6 Å²	70.6	45%	0.448	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-39	174.6	-73.2	167.9	-176.9	171	0	112.5	L156 E157 L163 G164 I402	L156-K160 VanDerWaalsContact O-CG 3.3Å; L156-K160 WeakPolarHBondContact O-CG 3.36Å; L156-K160 PolarHBondContact O-N 3.29Å; E157-K160 PolarHBondContact O-N 2.74Å; E157-K160 VanDerWaalsContact O-N 3.17Å; K160-L163 PolarHBondContact O-N 3.43Å; K160-G164 PolarHBondContact O-N 2.92Å; K160-I402 HydrophobicContact CG-CD1 4.34Å
161	S	96.1	Very high	95	Very high	69 Å²	69	70 Å²	70	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-52.7	172.8	-168.3	0	0	0	0	110.4	E157 D158 L163 G164 D165	E157-S161 PolarHBondContact O-N 2.83Å; D158-S161 PolarHBondContact O-N 2.79Å; S161-L163 VanDerWaalsContact C-N 3.31Å; S161-L163 PolarHBondContact O-N 3.05Å; S161-G164 CarbonylContact O-C 3.57Å; S161-G164 WeakPolarHBondContact O-CA 3.43Å; S161-G164 PolarHBondContact O-N 3.09Å; S161-D165 PolarHBondContact O-N 3.02Å; S161-D165 VanDerWaalsContact O-OD2 3.12Å
162	K	95.9	Very high	95.1	Very high	116 Å²	116	71.7 Å²	71.7	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-57.7	-41.5	177.5	-72.2	167.4	-175.7	171.8	0	112.5	D158 K159 G164 D165 V166	D158-K162 WeakPolarHBondContact O-CB 3.34Å; D158-K162 VanDerWaalsContact O-CG 3.28Å; D158-K162 WeakPolarHBondContact O-CG 3.33Å; D158-K162 PolarHBondContact O-N 2.65Å; K159-K162 PolarHBondContact O-N 2.81Å; K162-G164 VanDerWaalsContact C-N 3.32Å; K162-G164 PolarHBondContact O-N 3.08Å; K162-D165 PolarHBondContact O-N 3.34Å; K162-V166 WeakPolarHBondContact O-CB 3.28Å; K162-V166 VanDerWaalsContact O-CG2 3.24Å; K162-V166 WeakPolarHBondContact O-CG2 3.34Å; K162-V166 PolarHBondContact O-N 3.22Å
163	L	96.3	Very high	95.2	Very high	22 Å²	22	72.3 Å²	72.3	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-43.3	174.6	178.7	62.3	0	0	0	111.1	K159 K160 S161 Q167 I395 L398 E399 I402	K159-L163 WeakPolarHBondContact O-CB 3.4Å; K159-L163 PolarHBondContact O-N 3.07Å; K160-L163 PolarHBondContact O-N 3.43Å; S161-L163 VanDerWaalsContact C-N 3.31Å; S161-L163 PolarHBondContact O-N 3.05Å; L163-Q167 HydrophobicContact CD1-CG 4.11Å; L163-Q167 HydrophobicContact CG-CG 4.4Å; L163-Q167 WeakPolarHBondContact O-CB 3.43Å; L163-Q167 WeakPolarHBondContact O-CG 3.44Å; L163-Q167 PolarHBondContact O-N 3.36Å; L163-I395 HydrophobicContact CD1-CB 4.42Å; L163-I395 HydrophobicContact CD1-CG1 4.31Å; L163-I395 HydrophobicContact CD1-CG2 4.06Å; L163-L398 HydrophobicContact CB-CD1 4.45Å; L163-L398 HydrophobicContact CD1-CB 4.2Å; L163-E399 HydrophobicContact CD1-CG 3.76Å; L163-E399 HydrophobicContact CD2-CG 3.67Å; L163-E399 HydrophobicContact CG-CG 4.38Å; L163-I402 HydrophobicContact CB-CD1 4.47Å; L163-I402 HydrophobicContact CD2-CD1 3.9Å
164	G	96.3	Very high	95.4	Very high	26 Å²	26	71.4 Å²	71.4	27%	0.268	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-42.3	173.8	0	0	0	0	0	113.5	K160 S161 K162 Q167 N168	K160-G164 PolarHBondContact O-N 2.92Å; S161-G164 CarbonylContact O-C 3.57Å; S161-G164 WeakPolarHBondContact O-CA 3.43Å; S161-G164 PolarHBondContact O-N 3.09Å; K162-G164 VanDerWaalsContact C-N 3.32Å; K162-G164 PolarHBondContact O-N 3.08Å; G164-Q167 PolarHBondContact O-N 3.26Å; G164-N168 VanDerWaalsContact O-CG 3.25Å; G164-N168 PolarHBondContact O-N 2.88Å; G164-N168 PolarHBondContact O-ND2 3.36Å
165	D	96.4	Very high	95.5	Very high	97 Å²	97	69.5 Å²	69.5	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-46.6	177.3	-63.7	-43.5	0	0	0	111.4	S161 K162 N168 S169	S161-D165 PolarHBondContact O-N 3.02Å; S161-D165 VanDerWaalsContact O-OD2 3.12Å; K162-D165 PolarHBondContact O-N 3.34Å; D165-N168 PolarHBondContact O-N 3.02Å; D165-N168 VanDerWaalsContact O-N 3.14Å; D165-S169 PolarHBondContact O-N 3.03Å
166	V	96.8	Very high	95.7	Very high	25 Å²	25	72.5 Å²	72.5	15%	0.152	38%	0.379	C	S	.	.	H	α-helix	trans	-68.1	-38.9	177.3	178.4	0	0	0	0	111.2	K162 N168 S169 K170 V391 Q394 I395	K162-V166 WeakPolarHBondContact O-CB 3.28Å; K162-V166 VanDerWaalsContact O-CG2 3.24Å; K162-V166 WeakPolarHBondContact O-CG2 3.34Å; K162-V166 PolarHBondContact O-N 3.22Å; V166-N168 PolarHBondContact O-N 2.92Å; V166-S169 CarbonylContact O-C 3.51Å; V166-S169 PolarHBondContact O-N 3.37Å; V166-K170 PolarHBondContact O-N 2.73Å; V166-V391 HydrophobicContact CG1-CG1 3.86Å; V166-Q394 HydrophobicContact CG1-CB 4.26Å; V166-I395 HydrophobicContact CB-CG1 4.48Å; V166-I395 HydrophobicContact CG1-CD1 4.19Å; V166-I395 HydrophobicContact CG1-CG1 3.68Å
167	Q	96.5	Very high	96	Very high	73 Å²	73	71.2 Å²	71.2	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-20.2	171.7	-78.6	-179.2	0.2	0	0	113.1	L163 G164 K171 I395 E399	L163-Q167 HydrophobicContact CD1-CG 4.11Å; L163-Q167 HydrophobicContact CG-CG 4.4Å; L163-Q167 WeakPolarHBondContact O-CB 3.43Å; L163-Q167 WeakPolarHBondContact O-CG 3.44Å; L163-Q167 PolarHBondContact O-N 3.36Å; G164-Q167 PolarHBondContact O-N 3.26Å; Q167-K171 WeakPolarHBondContact O-CG 3.44Å; Q167-K171 PolarHBondContact O-NZ 3.17Å; Q167-I395 HydrophobicContact CG-CD1 4Å; Q167-I395 HydrophobicContact CG-CG1 4.29Å; Q167-E399 PolarHBondContact NE2-OE1 2.89Å
168	N	96.6	Very high	96.2	Very high	84 Å²	84	70.6 Å²	70.6	45%	0.449	37%	0.37	S	S	.	.	H	α-helix	trans	-83.6	-43.2	169.9	-67.9	-33.2	0	0	0	110.9	G164 D165 V166 K170 K171 D172	G164-N168 VanDerWaalsContact O-CG 3.25Å; G164-N168 PolarHBondContact O-N 2.88Å; G164-N168 PolarHBondContact O-ND2 3.36Å; D165-N168 PolarHBondContact O-N 3.02Å; D165-N168 VanDerWaalsContact O-N 3.14Å; V166-N168 PolarHBondContact O-N 2.92Å; N168-K170 PolarHBondContact O-N 3.16Å; N168-K171 WeakPolarHBondContact O-CB 3.35Å; N168-K171 PolarHBondContact O-N 2.98Å; N168-K171 PolarHBondContact OD1-NZ 3.4Å; N168-D172 PolarHBondContact O-N 3.34Å; N168-D172 VanDerWaalsContact O-N 3.12Å
169	S	96.1	Very high	96.3	Very high	54 Å²	54	68.7 Å²	68.7	38%	0.378	37%	0.367	S	S	.	.	H	α-helix	trans	-57.2	-33.5	171.5	-167.5	0	0	0	0	112.7	D165 V166 L173	D165-S169 PolarHBondContact O-N 3.03Å; V166-S169 CarbonylContact O-C 3.51Å; V166-S169 PolarHBondContact O-N 3.37Å; S169-L173 WeakPolarHBondContact O-CB 3.38Å; S169-L173 WeakPolarHBondContact O-CG 3.42Å; S169-L173 PolarHBondContact O-N 2.9Å
170	K	97.1	Very high	96.5	Very high	45 Å²	45	67.2 Å²	67.2	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-58	-51	171.1	172	165	171.3	167.6	0	111.2	V166 N168 D172 L173 E174 L388 V391 E392 I395	V166-K170 PolarHBondContact O-N 2.73Å; N168-K170 PolarHBondContact O-N 3.16Å; K170-D172 VanDerWaalsContact C-N 3.32Å; K170-D172 PolarHBondContact O-N 3.47Å; K170-L173 CarbonylContact O-C 3.57Å; K170-L173 PolarHBondContact O-N 2.9Å; K170-L173 VanDerWaalsContact O-N 3.1Å; K170-E174 WeakPolarHBondContact CE-OE1 3.47Å; K170-E174 HydrophobicContact CG-CG 4.08Å; K170-E174 IonicContact NZ-OE1 2.73Å; K170-E174 PolarHBondContact NZ-OE1 3.46Å; K170-E174 WeakPolarHBondContact O-CG 3.47Å; K170-E174 PolarHBondContact O-N 3.44Å; K170-L388 HydrophobicContact CG-CD1 3.96Å; K170-V391 HydrophobicContact CB-CG1 3.82Å; K170-E392 HydrophobicContact CD-CG 4.11Å; K170-E392 IonicContact NZ-OE1 3.19Å; K170-E392 PolarHBondContact NZ-OE1 2.9Å; K170-I395 HydrophobicContact CB-CD1 3.94Å; K170-I395 HydrophobicContact CD-CD1 3.81Å; K170-I395 HydrophobicContact CG-CD1 4.44Å
171	K	97.3	Very high	96.6	Very high	103 Å²	103	68.3 Å²	68.3	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-39.4	-178.5	-61.1	172.2	-166.5	97	0	112.4	Q167 N168 L173 E174 A175	Q167-K171 WeakPolarHBondContact O-CG 3.44Å; Q167-K171 PolarHBondContact O-NZ 3.17Å; N168-K171 WeakPolarHBondContact O-CB 3.35Å; N168-K171 PolarHBondContact O-N 2.98Å; N168-K171 PolarHBondContact OD1-NZ 3.4Å; K171-L173 VanDerWaalsContact C-N 3.33Å; K171-E174 WeakPolarHBondContact CA-OE2 3.4Å; K171-A175 WeakPolarHBondContact O-CB 3.26Å; K171-A175 PolarHBondContact O-N 3.47Å
172	D	96.1	Very high	96.6	Very high	123 Å²	123	68.3 Å²	68.3	66%	0.658	36%	0.36	S	S	*	.	H	α-helix	trans	-67.3	-34.9	176.1	-67.8	-25.5	0	0	0	111.5	N168 K170 K176	N168-D172 PolarHBondContact O-N 3.34Å; N168-D172 VanDerWaalsContact O-N 3.12Å; K170-D172 VanDerWaalsContact C-N 3.32Å; K170-D172 PolarHBondContact O-N 3.47Å; D172-K176 WeakPolarHBondContact O-CB 3.49Å; D172-K176 PolarHBondContact O-N 3.47Å; D172-K176 VanDerWaalsContact O-N 3.09Å
173	L	96.8	Very high	96.6	Very high	29 Å²	29	66 Å²	66	15%	0.152	36%	0.356	C	S	.	.	H	α-helix	trans	-74	-42.4	173.2	-75	170.3	0	0	0	113	S169 K170 K171 A175 K176 V177 A387 L388 V391	S169-L173 WeakPolarHBondContact O-CB 3.38Å; S169-L173 WeakPolarHBondContact O-CG 3.42Å; S169-L173 PolarHBondContact O-N 2.9Å; K170-L173 CarbonylContact O-C 3.57Å; K170-L173 PolarHBondContact O-N 2.9Å; K170-L173 VanDerWaalsContact O-N 3.1Å; K171-L173 VanDerWaalsContact C-N 3.33Å; L173-A175 VanDerWaalsContact C-N 3.28Å; L173-A175 PolarHBondContact O-N 2.85Å; L173-K176 HydrophobicContact CD2-CD 4.35Å; L173-K176 CarbonylContact O-C 3.59Å; L173-K176 WeakPolarHBondContact O-CA 3.27Å; L173-K176 WeakPolarHBondContact O-CB 3.31Å; L173-K176 PolarHBondContact O-N 3Å; L173-V177 WeakPolarHBondContact O-CB 3.46Å; L173-V177 WeakPolarHBondContact O-CG2 3.12Å; L173-V177 PolarHBondContact O-N 3.27Å; L173-A387 HydrophobicContact CD2-CB 4.33Å; L173-L388 HydrophobicContact CB-CB 4.48Å; L173-L388 HydrophobicContact CB-CD1 4.14Å; L173-V391 HydrophobicContact CD1-CB 4.15Å; L173-V391 HydrophobicContact CD1-CG1 4.47Å; L173-V391 HydrophobicContact CD1-CG2 3.73Å
174	E	97.1	Very high	96.6	Very high	82 Å²	82	66.5 Å²	66.5	38%	0.383	36%	0.357	S	S	.	.	H	α-helix	trans	-54.5	-46.5	172.9	-73.2	172	134.6	0	0	110.4	K170 K171 K176 V177 E178 L388	K170-E174 WeakPolarHBondContact CE-OE1 3.47Å; K170-E174 HydrophobicContact CG-CG 4.08Å; K170-E174 IonicContact NZ-OE1 2.73Å; K170-E174 PolarHBondContact NZ-OE1 3.46Å; K170-E174 WeakPolarHBondContact O-CG 3.47Å; K170-E174 PolarHBondContact O-N 3.44Å; K171-E174 WeakPolarHBondContact CA-OE2 3.4Å; E174-K176 VanDerWaalsContact C-N 3.35Å; E174-K176 PolarHBondContact O-N 2.81Å; E174-V177 PolarHBondContact O-N 2.88Å; E174-E178 PolarHBondContact O-N 3.02Å; E174-L388 HydrophobicContact CG-CD1 3.95Å; E174-L388 HydrophobicContact CG-CD2 4.16Å
175	A	96.9	Very high	96.6	Very high	63 Å²	63	69.8 Å²	69.8	52%	0.521	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-33.4	175.3	0	0	0	0	0	113.3	K171 L173 A179	K171-A175 WeakPolarHBondContact O-CB 3.26Å; K171-A175 PolarHBondContact O-N 3.47Å; L173-A175 VanDerWaalsContact C-N 3.28Å; L173-A175 PolarHBondContact O-N 2.85Å; A175-A179 VanDerWaalsContact O-CB 3.31Å; A175-A179 WeakPolarHBondContact O-CB 3.27Å; A175-A179 PolarHBondContact O-N 3.49Å; A175-A179 VanDerWaalsContact O-N 3.13Å
176	K	96.5	Very high	96.5	Very high	89 Å²	89	70 Å²	70	39%	0.387	37%	0.371	S	S	.	.	H	α-helix	trans	-70	-43.2	174.4	-168.1	-153.8	176.8	-150.2	0	111.6	D172 L173 E174 A179 L180 A384	D172-K176 WeakPolarHBondContact O-CB 3.49Å; D172-K176 PolarHBondContact O-N 3.47Å; D172-K176 VanDerWaalsContact O-N 3.09Å; L173-K176 HydrophobicContact CD2-CD 4.35Å; L173-K176 CarbonylContact O-C 3.59Å; L173-K176 WeakPolarHBondContact O-CA 3.27Å; L173-K176 WeakPolarHBondContact O-CB 3.31Å; L173-K176 PolarHBondContact O-N 3Å; E174-K176 VanDerWaalsContact C-N 3.35Å; E174-K176 PolarHBondContact O-N 2.81Å; K176-A179 PolarHBondContact O-N 3.49Å; K176-L180 HydrophobicContact CD-CD1 4.15Å; K176-L180 HydrophobicContact CG-CD1 3.98Å; K176-L180 WeakPolarHBondContact O-CB 3.34Å; K176-L180 WeakPolarHBondContact O-CG 3.45Å; K176-L180 PolarHBondContact O-N 3.11Å; K176-A384 HydrophobicContact CD-CB 4.06Å
177	V	97.4	Very high	96.4	Very high	19 Å²	19	69.8 Å²	69.8	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-64.3	-47.3	179.4	169.6	0	0	0	0	110.2	L173 E174 A179 L180 R181 F381 A384 L388	L173-V177 WeakPolarHBondContact O-CB 3.46Å; L173-V177 WeakPolarHBondContact O-CG2 3.12Å; L173-V177 PolarHBondContact O-N 3.27Å; E174-V177 PolarHBondContact O-N 2.88Å; V177-A179 PolarHBondContact O-N 3.04Å; V177-L180 PolarHBondContact O-N 3.02Å; V177-R181 WeakPolarHBondContact O-CB 3.2Å; V177-R181 PolarHBondContact O-N 3.04Å; V177-F381 HydrophobicContact CG1-CD2 4.49Å; V177-F381 HydrophobicContact CG1-CE2 3.73Å; V177-F381 HydrophobicContact CG1-CZ 4.27Å; V177-A384 HydrophobicContact CG2-CB 3.85Å; V177-A384 WeakPolarHBondContact CG2-O 3.44Å; V177-L388 HydrophobicContact CG2-CB 4.31Å; V177-L388 HydrophobicContact CG2-CD2 4.17Å
178	E	96.4	Very high	96.3	Very high	113 Å²	113	68.7 Å²	68.7	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-64	-39.7	176.2	-178.5	63.3	-175.7	0	0	112	E174 R181 T182	E174-E178 PolarHBondContact O-N 3.02Å; E178-R181 WeakPolarHBondContact O-CB 3.47Å; E178-R181 PolarHBondContact O-N 3.01Å; E178-T182 PolarHBondContact O-N 2.84Å
179	A	96.7	Very high	96.2	Very high	52 Å²	52	70.5 Å²	70.5	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-46.5	173.3	0	0	0	0	0	111.8	A175 K176 V177 R181 T182 V183	A175-A179 VanDerWaalsContact O-CB 3.31Å; A175-A179 WeakPolarHBondContact O-CB 3.27Å; A175-A179 PolarHBondContact O-N 3.49Å; A175-A179 VanDerWaalsContact O-N 3.13Å; K176-A179 PolarHBondContact O-N 3.49Å; V177-A179 PolarHBondContact O-N 3.04Å; A179-R181 VanDerWaalsContact C-N 3.34Å; A179-R181 PolarHBondContact O-N 2.97Å; A179-T182 PolarHBondContact O-N 3.42Å; A179-T182 PolarHBondContact O-OG1 2.63Å; A179-V183 PolarHBondContact O-N 2.73Å
180	L	97.1	Very high	96.1	Very high	25 Å²	25	70.1 Å²	70.1	13%	0.131	37%	0.368	C	S	.	.	H	α-helix	trans	-68	-31.2	178.5	-75.8	168.3	0	0	0	113	K176 V177 T182 V183 K184 E380 F381 A384	K176-L180 HydrophobicContact CD-CD1 4.15Å; K176-L180 HydrophobicContact CG-CD1 3.98Å; K176-L180 WeakPolarHBondContact O-CB 3.34Å; K176-L180 WeakPolarHBondContact O-CG 3.45Å; K176-L180 PolarHBondContact O-N 3.11Å; V177-L180 PolarHBondContact O-N 3.02Å; L180-T182 VanDerWaalsContact C-N 3.34Å; L180-T182 PolarHBondContact O-N 3.31Å; L180-V183 CarbonylContact O-C 3.56Å; L180-V183 WeakPolarHBondContact O-CA 3.19Å; L180-V183 WeakPolarHBondContact O-CB 3.31Å; L180-V183 PolarHBondContact O-N 3.49Å; L180-V183 VanDerWaalsContact O-N 3.08Å; L180-K184 PolarHBondContact O-N 3.03Å; L180-E380 WeakPolarHBondContact CD1-O 3.49Å; L180-E380 HydrophobicContact CD2-CB 4.15Å; L180-F381 HydrophobicContact CB-CB 4.34Å; L180-F381 HydrophobicContact CB-CD2 4.13Å; L180-A384 HydrophobicContact CD1-CB 3.52Å
181	R	96.3	Very high	96	Very high	125 Å²	125	68.2 Å²	68.2	47%	0.472	36%	0.36	S	S	.	.	H	α-helix	trans	-55.1	-50.1	171.4	-174.2	-170.3	179.6	126.6	15.4	110.8	V177 E178 A179 V183 K184 E185 F381	V177-R181 WeakPolarHBondContact O-CB 3.2Å; V177-R181 PolarHBondContact O-N 3.04Å; E178-R181 WeakPolarHBondContact O-CB 3.47Å; E178-R181 PolarHBondContact O-N 3.01Å; A179-R181 VanDerWaalsContact C-N 3.34Å; A179-R181 PolarHBondContact O-N 2.97Å; R181-V183 PolarHBondContact O-N 2.88Å; R181-K184 PolarHBondContact O-N 3.07Å; R181-E185 WeakPolarHBondContact CG-OE1 3.07Å; R181-E185 IonicContact CZ-OE1 2.66Å; R181-E185 IonicContact NE-OE1 3.21Å; R181-E185 PolarHBondContact NE-OE1 2.55Å; R181-E185 IonicContact NH2-OE1 3.28Å; R181-E185 PolarHBondContact NH2-OE1 3.14Å; R181-E185 WeakPolarHBondContact O-CG 3.16Å; R181-E185 PolarHBondContact O-N 3.27Å; R181-F381 HydrophobicContact CB-CD2 4.22Å; R181-F381 HydrophobicContact CB-CE2 3.82Å; R181-F381 HydrophobicContact CG-CE2 4.36Å
182	T	96.3	Very high	95.8	Very high	69 Å²	69	70.3 Å²	70.3	42%	0.423	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-28.3	177.8	68.5	0	0	0	0	112.9	E178 A179 L180 T186	E178-T182 PolarHBondContact O-N 2.84Å; A179-T182 PolarHBondContact O-N 3.42Å; A179-T182 PolarHBondContact O-OG1 2.63Å; L180-T182 VanDerWaalsContact C-N 3.34Å; L180-T182 PolarHBondContact O-N 3.31Å; T182-T186 WeakPolarHBondContact O-CB 3.25Å; T182-T186 VanDerWaalsContact O-CG2 3.3Å; T182-T186 WeakPolarHBondContact O-CG2 3.31Å; T182-T186 PolarHBondContact O-N 3.31Å; T182-T186 VanDerWaalsContact O-N 3.1Å; T182-T186 PolarHBondContact O-OG1 3.17Å
183	V	96.1	Very high	95.7	Very high	67 Å²	67	69.1 Å²	69.1	41%	0.406	36%	0.359	S	S	.	.	H	α-helix	trans	-73	-41.9	173.4	177.2	0	0	0	0	111.5	A179 L180 R181 T186 A187 A377	A179-V183 PolarHBondContact O-N 2.73Å; L180-V183 CarbonylContact O-C 3.56Å; L180-V183 WeakPolarHBondContact O-CA 3.19Å; L180-V183 WeakPolarHBondContact O-CB 3.31Å; L180-V183 PolarHBondContact O-N 3.49Å; L180-V183 VanDerWaalsContact O-N 3.08Å; R181-V183 PolarHBondContact O-N 2.88Å; V183-T186 PolarHBondContact O-OG1 2.83Å; V183-A187 VanDerWaalsContact O-CB 3.29Å; V183-A187 WeakPolarHBondContact O-CB 3.31Å; V183-A187 PolarHBondContact O-N 3.11Å; V183-A377 HydrophobicContact CG1-CB 4.21Å
184	K	96.4	Very high	95.6	Very high	34 Å²	34	67.7 Å²	67.7	15%	0.148	35%	0.352	C	S	.	.	H	α-helix	trans	-57.9	-58.6	171.9	177	171.2	175.1	167.8	0	109.9	L180 R181 T186 A187 E188 R378 F381	L180-K184 PolarHBondContact O-N 3.03Å; R181-K184 PolarHBondContact O-N 3.07Å; K184-T186 VanDerWaalsContact C-N 3.29Å; K184-T186 PolarHBondContact O-N 3.22Å; K184-A187 PolarHBondContact O-N 3.47Å; K184-E188 HydrophobicContact CG-CG 4.1Å; K184-E188 WeakPolarHBondContact CG-OE2 3.41Å; K184-E188 VanDerWaalsContact O-CG 3.3Å; K184-E188 WeakPolarHBondContact O-CG 3.45Å; K184-E188 PolarHBondContact O-N 2.86Å; K184-R378 HydrophobicContact CD-CG 4.34Å; K184-R378 HydrophobicContact CG-CG 4.48Å; K184-F381 HydrophobicContact CD-CB 4.15Å; K184-F381 HydrophobicContact CD-CD1 3.88Å; K184-F381 HydrophobicContact CD-CG 4.01Å
185	E	95.1	Very high	95.3	Very high	94 Å²	94	66.9 Å²	66.9	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-56.2	-38.9	-179	-68.8	174.5	-174.9	0	0	112.8	R181 Q189	R181-E185 WeakPolarHBondContact CG-OE1 3.07Å; R181-E185 IonicContact CZ-OE1 2.66Å; R181-E185 IonicContact NE-OE1 3.21Å; R181-E185 PolarHBondContact NE-OE1 2.55Å; R181-E185 IonicContact NH2-OE1 3.28Å; R181-E185 PolarHBondContact NH2-OE1 3.14Å; R181-E185 WeakPolarHBondContact O-CG 3.16Å; R181-E185 PolarHBondContact O-N 3.27Å; E185-Q189 PolarHBondContact O-N 3.11Å
186	T	95.3	Very high	95.2	Very high	102 Å²	102	70.1 Å²	70.1	63%	0.626	35%	0.352	S	S	*	.	H	α-helix	trans	-78.9	-17.8	177.6	54	0	0	0	0	115.2	T182 V183 K184 P190	T182-T186 WeakPolarHBondContact O-CB 3.25Å; T182-T186 VanDerWaalsContact O-CG2 3.3Å; T182-T186 WeakPolarHBondContact O-CG2 3.31Å; T182-T186 PolarHBondContact O-N 3.31Å; T182-T186 VanDerWaalsContact O-N 3.1Å; T182-T186 PolarHBondContact O-OG1 3.17Å; V183-T186 PolarHBondContact O-OG1 2.83Å; K184-T186 VanDerWaalsContact C-N 3.29Å; K184-T186 PolarHBondContact O-N 3.22Å; T186-P190 WeakPolarHBondContact O-CD 3.16Å
187	A	94.9	Very high	95	Very high	20 Å²	20	73.3 Å²	73.3	17%	0.165	36%	0.361	C	S	.	.	H	α-helix	trans	-90.9	-36.7	174.2	0	0	0	0	0	112.5	V183 K184 P190 E191 A374 A377	V183-A187 VanDerWaalsContact O-CB 3.29Å; V183-A187 WeakPolarHBondContact O-CB 3.31Å; V183-A187 PolarHBondContact O-N 3.11Å; K184-A187 PolarHBondContact O-N 3.47Å; A187-P190 VanDerWaalsContact O-CD 3.32Å; A187-P190 WeakPolarHBondContact O-CD 3.22Å; A187-P190 WeakPolarHBondContact O-CG 3.4Å; A187-E191 PolarHBondContact O-N 3.26Å; A187-A374 HydrophobicContact CB-CB 4.35Å; A187-A377 HydrophobicContact CB-CB 3.98Å
188	E	94.2	Very high	94.7	Very high	51 Å²	51	74 Å²	74	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-68.7	-31.9	178.7	-67.6	-171.9	126.7	0	0	113	K184 E191 K192 A374 R378	K184-E188 HydrophobicContact CG-CG 4.1Å; K184-E188 WeakPolarHBondContact CG-OE2 3.41Å; K184-E188 VanDerWaalsContact O-CG 3.3Å; K184-E188 WeakPolarHBondContact O-CG 3.45Å; K184-E188 PolarHBondContact O-N 2.86Å; E188-E191 WeakPolarHBondContact O-CB 3.47Å; E188-E191 PolarHBondContact O-N 3.45Å; E188-K192 WeakPolarHBondContact O-CB 3.36Å; E188-K192 PolarHBondContact O-N 2.92Å; E188-A374 HydrophobicContact CG-CB 4.42Å; E188-R378 IonicContact OE1-CZ 2.68Å; E188-R378 IonicContact OE1-NE 2.65Å; E188-R378 PolarHBondContact OE1-NE 2.86Å; E188-R378 IonicContact OE1-NH2 2.68Å; E188-R378 PolarHBondContact OE1-NH2 2.87Å
189	Q	94.2	Very high	94.4	Very high	122 Å²	122	73 Å²	73	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-62.2	-53.4	179.4	-176.9	164.8	-10.1	0	0	113.6	E185 E191 K192 E193	E185-Q189 PolarHBondContact O-N 3.11Å; Q189-E191 VanDerWaalsContact C-N 3.32Å; Q189-E191 PolarHBondContact O-N 3.47Å; Q189-K192 PolarHBondContact O-N 3.01Å; Q189-E193 WeakPolarHBondContact CG-OE1 3.41Å; Q189-E193 PolarHBondContact NE2-OE1 3.32Å; Q189-E193 WeakPolarHBondContact O-CG 3.44Å; Q189-E193 PolarHBondContact O-N 3.27Å
190	P	93.9	Very high	94.2	Very high	45 Å²	45	76.7 Å²	76.7	29%	0.292	37%	0.367	S	S	.	.	H	α-helix	trans	-67.4	-29.4	176.4	26.9	-35.3	0	0	0	113.1	T186 A187 A194 L370	T186-P190 WeakPolarHBondContact O-CD 3.16Å; A187-P190 VanDerWaalsContact O-CD 3.32Å; A187-P190 WeakPolarHBondContact O-CD 3.22Å; A187-P190 WeakPolarHBondContact O-CG 3.4Å; P190-A194 VanDerWaalsContact O-CB 3.27Å; P190-A194 WeakPolarHBondContact O-CB 3.25Å; P190-A194 PolarHBondContact O-N 3.14Å; P190-L370 HydrophobicContact CB-CD1 4.4Å; P190-L370 HydrophobicContact CB-CD2 4.13Å; P190-L370 HydrophobicContact CG-CD2 4.34Å
191	E	94.5	Very high	93.9	Very high	6 Å²	6	77.5 Å²	77.5	3%	0.028	38%	0.377	C	S	.	.	H	α-helix	trans	-58.7	-50.4	169.4	-179.7	-156.7	-168.5	0	0	110.8	A187 E188 Q189 A194 K195 I371 A374 R378	A187-E191 PolarHBondContact O-N 3.26Å; E188-E191 WeakPolarHBondContact O-CB 3.47Å; E188-E191 PolarHBondContact O-N 3.45Å; Q189-E191 VanDerWaalsContact C-N 3.32Å; Q189-E191 PolarHBondContact O-N 3.47Å; E191-A194 PolarHBondContact O-N 2.85Å; E191-K195 HydrophobicContact CG-CD 4.15Å; E191-K195 WeakPolarHBondContact O-CB 3.11Å; E191-K195 PolarHBondContact O-N 2.95Å; E191-K195 IonicContact OE1-NZ 3.58Å; E191-K195 PolarHBondContact OE1-NZ 2.95Å; E191-I371 HydrophobicContact CG-CB 4.49Å; E191-I371 HydrophobicContact CG-CG1 3.84Å; E191-A374 HydrophobicContact CB-CB 3.81Å; E191-A374 HydrophobicContact CG-CB 4.04Å; E191-A374 VanDerWaalsContact OE2-CB 3.28Å; E191-A374 WeakPolarHBondContact OE2-CB 3.34Å; E191-R378 IonicContact OE1-NH1 2.72Å; E191-R378 PolarHBondContact OE1-NH1 3.32Å; E191-R378 IonicContact OE1-NH2 3.42Å; E191-R378 IonicContact OE2-CZ 2.71Å; E191-R378 IonicContact OE2-NH1 3.82Å; E191-R378 PolarHBondContact OE2-NH1 2.85Å; E191-R378 IonicContact OE2-NH2 3.97Å; E191-R378 PolarHBondContact OE2-NH2 2.81Å
192	K	93.9	Very high	93.5	Very high	147 Å²	147	72.6 Å²	72.6	64%	0.639	36%	0.359	S	S	*	.	H	α-helix	trans	-61.8	-46.6	179.3	-175.4	175	-179.6	174.9	0	111.7	E188 Q189 A194 K195 E196	E188-K192 WeakPolarHBondContact O-CB 3.36Å; E188-K192 PolarHBondContact O-N 2.92Å; Q189-K192 PolarHBondContact O-N 3.01Å; K192-A194 PolarHBondContact O-N 3.32Å; K192-K195 PolarHBondContact O-N 3.48Å; K192-E196 WeakPolarHBondContact O-CB 3.46Å; K192-E196 PolarHBondContact O-N 2.72Å
193	E	94.4	Very high	93.2	Very high	97 Å²	97	73 Å²	73	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-27	176.1	-70.6	176.5	-159.5	0	0	112.7	Q189 R197	Q189-E193 WeakPolarHBondContact CG-OE1 3.41Å; Q189-E193 PolarHBondContact NE2-OE1 3.32Å; Q189-E193 WeakPolarHBondContact O-CG 3.44Å; Q189-E193 PolarHBondContact O-N 3.27Å; E193-R197 VanDerWaalsContact O-CG 3.29Å; E193-R197 WeakPolarHBondContact O-CG 3.36Å; E193-R197 PolarHBondContact O-N 3.43Å; E193-R197 PolarHBondContact O-NE 3.07Å
194	A	93.3	Very high	93	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-79.1	-46.9	173.2	0	0	0	0	0	112.4	P190 E191 K192 E196 R197 H198 T367 L370	P190-A194 VanDerWaalsContact O-CB 3.27Å; P190-A194 WeakPolarHBondContact O-CB 3.25Å; P190-A194 PolarHBondContact O-N 3.14Å; E191-A194 PolarHBondContact O-N 2.85Å; K192-A194 PolarHBondContact O-N 3.32Å; A194-E196 VanDerWaalsContact C-N 3.34Å; A194-E196 PolarHBondContact O-N 3.44Å; A194-R197 PolarHBondContact O-N 3.27Å; A194-H198 PolarHBondContact O-N 2.78Å; A194-T367 HydrophobicContact CB-CG2 3.79Å; A194-L370 HydrophobicContact CB-CD1 3.84Å
195	K	91.5	Very high	92.6	Very high	65 Å²	65	78.2 Å²	78.2	28%	0.283	38%	0.377	S	S	.	.	H	α-helix	trans	-57.6	-43.2	174.6	-80.6	177.3	164.5	165.9	0	112.2	E191 K192 H198 L199 Y363 I371	E191-K195 HydrophobicContact CG-CD 4.15Å; E191-K195 WeakPolarHBondContact O-CB 3.11Å; E191-K195 PolarHBondContact O-N 2.95Å; E191-K195 IonicContact OE1-NZ 3.58Å; E191-K195 PolarHBondContact OE1-NZ 2.95Å; K192-K195 PolarHBondContact O-N 3.48Å; K195-H198 PolarHBondContact O-N 2.99Å; K195-L199 WeakPolarHBondContact O-CB 3.36Å; K195-L199 PolarHBondContact O-N 3.26Å; K195-Y363 HydrophobicContact CG-CE1 4.11Å; K195-I371 HydrophobicContact CG-CD1 4.37Å
196	E	93.9	Very high	92.2	Very high	131 Å²	131	75.3 Å²	75.3	61%	0.612	36%	0.362	S	S	*	.	H	α-helix	trans	-64.6	-41.9	177.5	-171.1	-179.3	153.5	0	0	111.9	K192 A194 K200	K192-E196 WeakPolarHBondContact O-CB 3.46Å; K192-E196 PolarHBondContact O-N 2.72Å; A194-E196 VanDerWaalsContact C-N 3.34Å; A194-E196 PolarHBondContact O-N 3.44Å; E196-K200 VanDerWaalsContact O-CB 3.29Å; E196-K200 WeakPolarHBondContact O-CB 3.49Å; E196-K200 PolarHBondContact O-N 2.92Å
197	R	92.3	Very high	91.9	Very high	156 Å²	156	72.1 Å²	72.1	59%	0.589	35%	0.346	S	S	*	.	H	α-helix	trans	-62.4	-42.6	174.5	-78.9	179.4	-70	148.2	-2	112.3	E193 A194 A201	E193-R197 VanDerWaalsContact O-CG 3.29Å; E193-R197 WeakPolarHBondContact O-CG 3.36Å; E193-R197 PolarHBondContact O-N 3.43Å; E193-R197 PolarHBondContact O-NE 3.07Å; A194-R197 PolarHBondContact O-N 3.27Å; R197-A201 WeakPolarHBondContact O-CB 3.47Å; R197-A201 PolarHBondContact O-N 3.42Å
198	H	91.1	Very high	91.6	Very high	32 Å²	32	74.9 Å²	74.9	15%	0.148	36%	0.361	C	S	.	.	H	α-helix	trans	-66.2	-47.5	177.8	-170.6	79.3	0	0	0	111.9	A194 K195 K200 A201 W202 P361 P362 Y363	A194-H198 PolarHBondContact O-N 2.78Å; K195-H198 PolarHBondContact O-N 2.99Å; H198-K200 VanDerWaalsContact C-N 3.33Å; H198-K200 PolarHBondContact O-N 3.48Å; H198-A201 PolarHBondContact O-N 3.31Å; H198-W202 WeakPolarHBondContact O-CB 3.32Å; H198-W202 PolarHBondContact O-N 3.09Å; H198-P361 PolarHBondContact NE2-O 3.02Å; H198-P362 PolarHBondContact CE1-O 2.94Å; H198-Y363 HydrophobicContact CB-CD1 3.98Å; H198-Y363 HydrophobicContact CB-CE1 4.02Å; H198-Y363 AromaticContact CD2-CD1 3.43Å; H198-Y363 VanDerWaalsContact CD2-CD1 3.43Å; H198-Y363 WeakPolarHBondContact CD2-CD1 3.21Å; H198-Y363 AromaticContact CD2-CE1 3.45Å; H198-Y363 VanDerWaalsContact CD2-CE1 3.45Å; H198-Y363 WeakPolarHBondContact CD2-CE1 3.45Å; H198-Y363 AromaticContact CG-CD1 3.61Å; H198-Y363 AromaticContact CG-CE1 3.87Å; H198-Y363 AromaticContact NE2-CD1 3.88Å
199	L	90.4	Very high	91.2	Very high	93 Å²	93	75.5 Å²	75.5	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-42.8	177	179.3	61.8	0	0	0	111.7	K195 W202 E203	K195-L199 WeakPolarHBondContact O-CB 3.36Å; K195-L199 PolarHBondContact O-N 3.26Å; L199-W202 PolarHBondContact O-N 3.18Å; L199-E203 PolarHBondContact O-N 3.27Å
200	K	93	Very high	90.8	Very high	130 Å²	130	74.7 Å²	74.7	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-64.2	-44.9	176.1	178.5	172.2	172	174	0	112.2	E196 H198 W202 E203 E204	E196-K200 VanDerWaalsContact O-CB 3.29Å; E196-K200 WeakPolarHBondContact O-CB 3.49Å; E196-K200 PolarHBondContact O-N 2.92Å; H198-K200 VanDerWaalsContact C-N 3.33Å; H198-K200 PolarHBondContact O-N 3.48Å; K200-W202 PolarHBondContact O-N 3.05Å; K200-E203 PolarHBondContact O-N 3.17Å; K200-E204 WeakPolarHBondContact CE-OE1 3.48Å; K200-E204 IonicContact NZ-OE1 2.65Å; K200-E204 WeakPolarHBondContact O-CB 3.48Å; K200-E204 WeakPolarHBondContact O-CG 3.34Å; K200-E204 PolarHBondContact O-N 3.27Å
201	A	90.1	Very high	90.4	Very high	41 Å²	41	79.1 Å²	79.1	34%	0.339	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-32.6	176.1	0	0	0	0	0	112.1	R197 H198 Q205	R197-A201 WeakPolarHBondContact O-CB 3.47Å; R197-A201 PolarHBondContact O-N 3.42Å; H198-A201 PolarHBondContact O-N 3.31Å; A201-Q205 WeakPolarHBondContact O-CG 3.32Å; A201-Q205 PolarHBondContact O-N 3.16Å
202	W	89.5	Confident	90	Very high	23 Å²	23	85.2 Å²	85.2	9%	0.087	40%	0.404	C	S	.	.	H	α-helix	trans	-70.4	-44.9	174	175.1	-127	0	0	0	112.8	H198 L199 K200 E204 Q205 K206 G358 M360 P361	H198-W202 WeakPolarHBondContact O-CB 3.32Å; H198-W202 PolarHBondContact O-N 3.09Å; L199-W202 PolarHBondContact O-N 3.18Å; K200-W202 PolarHBondContact O-N 3.05Å; W202-E204 VanDerWaalsContact C-N 3.33Å; W202-E204 PolarHBondContact O-N 3.02Å; W202-Q205 HydrophobicContact CE3-CB 4.14Å; W202-Q205 HydrophobicContact CZ3-CB 4.46Å; W202-Q205 WeakPolarHBondContact O-CB 3.34Å; W202-Q205 PolarHBondContact O-N 2.82Å; W202-Q205 VanDerWaalsContact O-N 3.14Å; W202-K206 HydrophobicContact CD2-CG 4.16Å; W202-K206 HydrophobicContact CE3-CG 4.41Å; W202-K206 HydrophobicContact CH2-CG 4.03Å; W202-K206 HydrophobicContact CZ2-CD 3.96Å; W202-K206 HydrophobicContact CZ2-CG 3.76Å; W202-K206 HydrophobicContact CZ3-CG 4.34Å; W202-K206 PolarHBondContact O-N 2.86Å; W202-G358 WeakPolarHBondContact CZ2-O 3.15Å; W202-M360 HydrophobicContact CB-CG 4.28Å; W202-M360 HydrophobicContact CD2-CB 4.41Å; W202-M360 HydrophobicContact CD2-CG 4.23Å; W202-M360 HydrophobicContact CG-CB 4.32Å; W202-M360 HydrophobicContact CG-CG 3.77Å; W202-M360 HydrophobicContact CG-SD 4.45Å; W202-P361 HydrophobicContact CE3-CG 3.97Å; W202-P361 HydrophobicContact CZ3-CG 4.19Å
203	E	89.4	Confident	89.6	Confident	78 Å²	78	82.1 Å²	82.1	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-66.6	-32.9	174.4	-77.3	-57.1	140.2	0	0	112.7	L199 K200 K206 A207 R210	L199-E203 PolarHBondContact O-N 3.27Å; K200-E203 PolarHBondContact O-N 3.17Å; E203-K206 PolarHBondContact O-N 2.91Å; E203-K206 WeakPolarHBondContact OE1-CD 3.3Å; E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.44Å; E203-A207 PolarHBondContact O-N 2.97Å; E203-R210 IonicContact OE2-CZ 2.55Å; E203-R210 IonicContact OE2-NH2 3.21Å; E203-R210 PolarHBondContact OE2-NH2 2.88Å
204	E	91	Very high	89.1	Confident	111 Å²	111	80.2 Å²	80.2	52%	0.519	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-39.6	169.7	-74.4	175.8	-175.6	0	0	111.5	K200 W202 A207 V208	K200-E204 WeakPolarHBondContact CE-OE1 3.48Å; K200-E204 IonicContact NZ-OE1 2.65Å; K200-E204 WeakPolarHBondContact O-CB 3.48Å; K200-E204 WeakPolarHBondContact O-CG 3.34Å; K200-E204 PolarHBondContact O-N 3.27Å; W202-E204 VanDerWaalsContact C-N 3.33Å; W202-E204 PolarHBondContact O-N 3.02Å; E204-A207 PolarHBondContact O-N 3.27Å; E204-V208 WeakPolarHBondContact O-CG2 3.26Å; E204-V208 PolarHBondContact O-N 3.11Å; E204-V208 VanDerWaalsContact O-N 3.14Å
205	Q	88	Confident	88.8	Confident	99 Å²	99	85.8 Å²	85.8	46%	0.463	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-46	172.6	-74.7	173.1	16.9	0	0	112.5	A201 W202 A207 V208 I209	A201-Q205 WeakPolarHBondContact O-CG 3.32Å; A201-Q205 PolarHBondContact O-N 3.16Å; W202-Q205 HydrophobicContact CE3-CB 4.14Å; W202-Q205 HydrophobicContact CZ3-CB 4.46Å; W202-Q205 WeakPolarHBondContact O-CB 3.34Å; W202-Q205 PolarHBondContact O-N 2.82Å; W202-Q205 VanDerWaalsContact O-N 3.14Å; Q205-A207 VanDerWaalsContact C-N 3.28Å; Q205-A207 PolarHBondContact O-N 2.98Å; Q205-V208 PolarHBondContact O-N 3.26Å; Q205-V208 VanDerWaalsContact O-N 3.15Å; Q205-I209 WeakPolarHBondContact O-CG1 3.28Å; Q205-I209 PolarHBondContact O-N 3.49Å
206	K	87.9	Confident	88.5	Confident	33 Å²	33	85 Å²	85	14%	0.143	41%	0.414	C	S	.	.	H	α-helix	trans	-59.4	-37.4	173.9	-78.6	-173.6	154.8	-157.5	0	112.1	W202 E203 I209 R210 E357	W202-K206 HydrophobicContact CD2-CG 4.16Å; W202-K206 HydrophobicContact CE3-CG 4.41Å; W202-K206 HydrophobicContact CH2-CG 4.03Å; W202-K206 HydrophobicContact CZ2-CD 3.96Å; W202-K206 HydrophobicContact CZ2-CG 3.76Å; W202-K206 HydrophobicContact CZ3-CG 4.34Å; W202-K206 PolarHBondContact O-N 2.86Å; E203-K206 PolarHBondContact O-N 2.91Å; E203-K206 WeakPolarHBondContact OE1-CD 3.3Å; K206-I209 PolarHBondContact O-N 2.95Å; K206-R210 VanDerWaalsContact O-CB 3.3Å; K206-R210 WeakPolarHBondContact O-CB 3.31Å; K206-R210 VanDerWaalsContact O-CG 3.31Å; K206-R210 WeakPolarHBondContact O-CG 3.46Å; K206-R210 PolarHBondContact O-N 3.32Å; K206-R210 PolarHBondContact O-NE 3.2Å; K206-E357 HydrophobicContact CD-CG 4.29Å; K206-E357 WeakPolarHBondContact CD-OE2 3.49Å; K206-E357 WeakPolarHBondContact CE-OE2 3.27Å; K206-E357 HydrophobicContact CG-CG 4.27Å; K206-E357 IonicContact NZ-OE2 2.68Å; K206-E357 PolarHBondContact NZ-OE2 3.03Å
207	A	88.3	Confident	88	Confident	35 Å²	35	83.8 Å²	83.8	29%	0.289	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-42.4	174.8	0	0	0	0	0	111.9	E203 E204 Q205 R210 M211	E203-A207 VanDerWaalsContact O-CB 3.31Å; E203-A207 WeakPolarHBondContact O-CB 3.44Å; E203-A207 PolarHBondContact O-N 2.97Å; E204-A207 PolarHBondContact O-N 3.27Å; Q205-A207 VanDerWaalsContact C-N 3.28Å; Q205-A207 PolarHBondContact O-N 2.98Å; A207-R210 PolarHBondContact O-N 3.21Å; A207-M211 VanDerWaalsContact O-CG 3.29Å; A207-M211 WeakPolarHBondContact O-CG 3.34Å; A207-M211 PolarHBondContact O-N 3Å
208	V	89.1	Confident	87.7	Confident	78 Å²	78	77 Å²	77	47%	0.473	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-47	173.8	173.3	0	0	0	0	111.3	E204 Q205 R210 M211 E212	E204-V208 WeakPolarHBondContact O-CG2 3.26Å; E204-V208 PolarHBondContact O-N 3.11Å; E204-V208 VanDerWaalsContact O-N 3.14Å; Q205-V208 PolarHBondContact O-N 3.26Å; Q205-V208 VanDerWaalsContact O-N 3.15Å; V208-R210 VanDerWaalsContact C-N 3.33Å; V208-R210 PolarHBondContact O-N 3.02Å; V208-M211 PolarHBondContact O-N 2.85Å; V208-M211 VanDerWaalsContact O-N 3.13Å; V208-E212 HydrophobicContact CG1-CG 4.46Å; V208-E212 PolarHBondContact O-N 3.37Å
209	I	86.4	Confident	87.4	Confident	64 Å²	64	77.6 Å²	77.6	33%	0.328	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-42.7	178.2	-66.8	164.6	0	0	0	110.9	Q205 K206 E212 K213	Q205-I209 WeakPolarHBondContact O-CG1 3.28Å; Q205-I209 PolarHBondContact O-N 3.49Å; K206-I209 PolarHBondContact O-N 2.95Å; I209-E212 PolarHBondContact O-N 3.13Å; I209-K213 WeakPolarHBondContact O-CB 3.43Å; I209-K213 WeakPolarHBondContact O-CG 3.4Å; I209-K213 PolarHBondContact O-N 3Å
210	R	85	Confident	87.2	Confident	105 Å²	105	77.6 Å²	77.6	40%	0.396	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-42.8	173.5	-79.5	179	-81.4	-138.1	8.4	112.2	E203 K206 A207 V208 K213 D214 E357	E203-R210 IonicContact OE2-CZ 2.55Å; E203-R210 IonicContact OE2-NH2 3.21Å; E203-R210 PolarHBondContact OE2-NH2 2.88Å; K206-R210 VanDerWaalsContact O-CB 3.3Å; K206-R210 WeakPolarHBondContact O-CB 3.31Å; K206-R210 VanDerWaalsContact O-CG 3.31Å; K206-R210 WeakPolarHBondContact O-CG 3.46Å; K206-R210 PolarHBondContact O-N 3.32Å; K206-R210 PolarHBondContact O-NE 3.2Å; A207-R210 PolarHBondContact O-N 3.21Å; V208-R210 VanDerWaalsContact C-N 3.33Å; V208-R210 PolarHBondContact O-N 3.02Å; R210-K213 PolarHBondContact O-N 3.03Å; R210-D214 VanDerWaalsContact O-CB 3.27Å; R210-D214 WeakPolarHBondContact O-CB 3.39Å; R210-D214 PolarHBondContact O-N 3.11Å; R210-E357 WeakPolarHBondContact CD-OE1 3.28Å; R210-E357 VanDerWaalsContact CG-OE1 3.25Å; R210-E357 WeakPolarHBondContact CG-OE1 3.23Å; R210-E357 IonicContact CZ-OE1 2.79Å; R210-E357 IonicContact NE-OE1 3.92Å; R210-E357 PolarHBondContact NE-OE1 3.34Å; R210-E357 IonicContact NH1-OE1 2.66Å; R210-E357 PolarHBondContact NH1-OE1 3.1Å; R210-E357 IonicContact NH1-OE2 3.55Å
211	M	85.8	Confident	86.8	Confident	137 Å²	137	71.6 Å²	71.6	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-66.9	-38.8	176.7	-72	176.4	-172.9	0	0	112.7	A207 V208 K215	A207-M211 VanDerWaalsContact O-CG 3.29Å; A207-M211 WeakPolarHBondContact O-CG 3.34Å; A207-M211 PolarHBondContact O-N 3Å; V208-M211 PolarHBondContact O-N 2.85Å; V208-M211 VanDerWaalsContact O-N 3.13Å; M211-K215 WeakPolarHBondContact O-CB 3.36Å; M211-K215 PolarHBondContact O-N 2.93Å
212	E	86.6	Confident	86.5	Confident	134 Å²	134	70 Å²	70	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-68	-40.9	175.2	-71.4	-172.2	159.2	0	0	111.6	V208 I209 K215 A216	V208-E212 HydrophobicContact CG1-CG 4.46Å; V208-E212 PolarHBondContact O-N 3.37Å; I209-E212 PolarHBondContact O-N 3.13Å; E212-K215 PolarHBondContact O-N 3.31Å; E212-A216 WeakPolarHBondContact O-CB 3.36Å; E212-A216 PolarHBondContact O-N 3.02Å
213	K	84.4	Confident	86.2	Confident	83 Å²	83	74.8 Å²	74.8	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-45.8	172.6	-76.6	-167	-177.2	-173.8	0	112.9	I209 R210 K215 A216 R217 E356	I209-K213 WeakPolarHBondContact O-CB 3.43Å; I209-K213 WeakPolarHBondContact O-CG 3.4Å; I209-K213 PolarHBondContact O-N 3Å; R210-K213 PolarHBondContact O-N 3.03Å; K213-K215 VanDerWaalsContact C-N 3.27Å; K213-K215 PolarHBondContact O-N 3Å; K213-A216 PolarHBondContact O-N 3.47Å; K213-R217 WeakPolarHBondContact O-CB 3.3Å; K213-R217 PolarHBondContact O-N 2.85Å; K213-E356 PolarHBondContact NZ-O 2.79Å; K213-E356 IonicContact NZ-OE2 2.64Å; K213-E356 PolarHBondContact NZ-OE2 2.75Å
214	D	84.4	Confident	85.8	Confident	56 Å²	56	74.8 Å²	74.8	30%	0.299	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-38.1	178.6	-168	35.2	0	0	0	110.8	R210 M218 W276 K280	R210-D214 VanDerWaalsContact O-CB 3.27Å; R210-D214 WeakPolarHBondContact O-CB 3.39Å; R210-D214 PolarHBondContact O-N 3.11Å; D214-M218 VanDerWaalsContact O-CB 3.22Å; D214-M218 WeakPolarHBondContact O-CB 3.14Å; D214-M218 PolarHBondContact O-N 2.96Å; D214-W276 PolarHBondContact O-NE1 2.9Å; D214-W276 PolarHBondContact OD1-NE1 3.36Å; D214-K280 WeakPolarHBondContact OD1-CD 3.48Å; D214-K280 IonicContact OD1-NZ 3.36Å; D214-K280 PolarHBondContact OD1-NZ 3Å; D214-K280 IonicContact OD2-NZ 3.19Å; D214-K280 PolarHBondContact OD2-NZ 2.88Å
215	K	85.8	Confident	85.4	Confident	117 Å²	117	69.5 Å²	69.5	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-72.4	-36.5	174.1	-168.4	-176.2	179.2	76.1	0	113.5	M211 E212 K213 M218 A219 E273	M211-K215 WeakPolarHBondContact O-CB 3.36Å; M211-K215 PolarHBondContact O-N 2.93Å; E212-K215 PolarHBondContact O-N 3.31Å; K213-K215 VanDerWaalsContact C-N 3.27Å; K213-K215 PolarHBondContact O-N 3Å; K215-M218 HydrophobicContact CG-CE 3.95Å; K215-A219 PolarHBondContact O-N 3.44Å; K215-A219 VanDerWaalsContact O-N 3.13Å; K215-E273 IonicContact NZ-OE1 3.54Å; K215-E273 PolarHBondContact NZ-OE1 3.17Å
216	A	86.3	Confident	85.2	Confident	50 Å²	50	66 Å²	66	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-52.1	173.9	0	0	0	0	0	110.2	E212 K213 M218 A219 D220	E212-A216 WeakPolarHBondContact O-CB 3.36Å; E212-A216 PolarHBondContact O-N 3.02Å; K213-A216 PolarHBondContact O-N 3.47Å; A216-M218 VanDerWaalsContact C-N 3.26Å; A216-M218 PolarHBondContact O-N 3.32Å; A216-A219 WeakPolarHBondContact O-CA 3.19Å; A216-A219 WeakPolarHBondContact O-CB 3.27Å; A216-A219 PolarHBondContact O-N 3.49Å; A216-D220 PolarHBondContact O-N 3.09Å
217	R	84.2	Confident	84.7	Confident	104 Å²	104	70.1 Å²	70.1	39%	0.392	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-34	177.5	-150	-170.1	81.5	150.5	15.5	112.4	K213 V221 W276 K280	K213-R217 WeakPolarHBondContact O-CB 3.3Å; K213-R217 PolarHBondContact O-N 2.85Å; R217-V221 HydrophobicContact CG-CG2 4.46Å; R217-V221 VanDerWaalsContact O-CB 3.31Å; R217-V221 WeakPolarHBondContact O-CB 3.36Å; R217-V221 VanDerWaalsContact O-CG2 3.22Å; R217-V221 WeakPolarHBondContact O-CG2 3.42Å; R217-V221 PolarHBondContact O-N 3.42Å; R217-W276 HydrophobicContact CB-CH2 4.45Å; R217-W276 HydrophobicContact CB-CZ2 4.16Å; R217-W276 HydrophobicContact CG-CH2 4.45Å; R217-K280 PolarHBondContact NH2-O 2.73Å
218	M	85.9	Confident	84.3	Confident	15 Å²	15	74.2 Å²	74.2	7%	0.074	38%	0.376	C	S	.	.	H	α-helix	trans	-61.1	-44	170.9	-179.3	-81.9	-58.2	0	0	112.2	D214 K215 A216 F222 F272 E273 W276	D214-M218 VanDerWaalsContact O-CB 3.22Å; D214-M218 WeakPolarHBondContact O-CB 3.14Å; D214-M218 PolarHBondContact O-N 2.96Å; K215-M218 HydrophobicContact CG-CE 3.95Å; A216-M218 VanDerWaalsContact C-N 3.26Å; A216-M218 PolarHBondContact O-N 3.32Å; M218-F222 WeakPolarHBondContact O-CB 3.21Å; M218-F222 PolarHBondContact O-N 3.22Å; M218-F272 HydrophobicContact CG-CD1 3.9Å; M218-F272 HydrophobicContact CG-CE1 4.03Å; M218-F272 HydrophobicContact SD-CD1 3.74Å; M218-F272 HydrophobicContact SD-CE1 4.3Å; M218-E273 HydrophobicContact CE-CG 3.83Å; M218-E273 WeakPolarHBondContact CE-OE1 3.1Å; M218-E273 HydrophobicContact SD-CG 4.16Å; M218-W276 HydrophobicContact CB-CD2 3.63Å; M218-W276 HydrophobicContact CB-CE3 4.17Å; M218-W276 HydrophobicContact CB-CG 3.88Å; M218-W276 HydrophobicContact CB-CH2 4.48Å; M218-W276 HydrophobicContact CB-CZ2 3.99Å; M218-W276 HydrophobicContact CG-CB 3.9Å; M218-W276 HydrophobicContact CG-CD2 3.64Å; M218-W276 HydrophobicContact CG-CE3 4.1Å; M218-W276 HydrophobicContact CG-CG 3.54Å
219	A	84.9	Confident	83.8	Confident	44 Å²	44	73.2 Å²	73.2	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-72.8	-37.3	179.5	0	0	0	0	0	112.6	K215 A216 F222 L223	K215-A219 PolarHBondContact O-N 3.44Å; K215-A219 VanDerWaalsContact O-N 3.13Å; A216-A219 WeakPolarHBondContact O-CA 3.19Å; A216-A219 WeakPolarHBondContact O-CB 3.27Å; A216-A219 PolarHBondContact O-N 3.49Å; A219-F222 PolarHBondContact O-N 2.65Å; A219-L223 WeakPolarHBondContact O-CG 3.25Å; A219-L223 PolarHBondContact O-N 2.97Å
220	D	84.9	Confident	83.6	Confident	93 Å²	93	74.1 Å²	74.1	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-66.2	-48.2	175.3	-63.4	-36.6	0	0	0	110.4	A216 F222 L223 E224	A216-D220 PolarHBondContact O-N 3.09Å; D220-F222 VanDerWaalsContact C-N 3.32Å; D220-F222 PolarHBondContact O-N 2.68Å; D220-L223 CarbonylContact O-C 3.54Å; D220-L223 WeakPolarHBondContact O-CA 3.34Å; D220-L223 WeakPolarHBondContact O-CB 3.27Å; D220-L223 PolarHBondContact O-N 3.31Å; D220-E224 PolarHBondContact O-N 2.86Å
221	V	84.5	Confident	83.4	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.024	38%	0.381	C	S	.	.	H	α-helix	trans	-67.7	-29.2	177.1	174.7	0	0	0	0	112.5	R217 L223 E224 L225 W276 Y283	R217-V221 HydrophobicContact CG-CG2 4.46Å; R217-V221 VanDerWaalsContact O-CB 3.31Å; R217-V221 WeakPolarHBondContact O-CB 3.36Å; R217-V221 VanDerWaalsContact O-CG2 3.22Å; R217-V221 WeakPolarHBondContact O-CG2 3.42Å; R217-V221 PolarHBondContact O-N 3.42Å; V221-L223 VanDerWaalsContact C-N 3.29Å; V221-L223 PolarHBondContact O-N 2.9Å; V221-E224 PolarHBondContact O-N 3.49Å; V221-L225 HydrophobicContact CG1-CD1 3.77Å; V221-L225 HydrophobicContact CG1-CG 4.18Å; V221-L225 WeakPolarHBondContact O-CB 3.17Å; V221-L225 VanDerWaalsContact O-CG 3.27Å; V221-L225 WeakPolarHBondContact O-CG 3.09Å; V221-L225 PolarHBondContact O-N 3.3Å; V221-W276 HydrophobicContact CB-CH2 3.98Å; V221-W276 HydrophobicContact CB-CZ3 3.73Å; V221-W276 HydrophobicContact CG1-CH2 4.41Å; V221-W276 HydrophobicContact CG1-CZ3 3.79Å; V221-W276 HydrophobicContact CG2-CH2 3.94Å; V221-W276 HydrophobicContact CG2-CZ3 4.16Å; V221-Y283 HydrophobicContact CB-CD1 4.14Å; V221-Y283 HydrophobicContact CB-CE1 4.18Å; V221-Y283 HydrophobicContact CG1-CD1 3.51Å; V221-Y283 HydrophobicContact CG1-CD2 3.98Å; V221-Y283 HydrophobicContact CG1-CE1 3.66Å; V221-Y283 HydrophobicContact CG1-CE2 4.11Å; V221-Y283 HydrophobicContact CG1-CG 3.66Å; V221-Y283 HydrophobicContact CG2-CD1 3.43Å; V221-Y283 VanDerWaalsContact CG2-CD1 3.43Å; V221-Y283 HydrophobicContact CG2-CE1 3.57Å; V221-Y283 HydrophobicContact CG2-CG 4.33Å
222	F	84.6	Confident	83.3	Confident	8 Å²	8	67.5 Å²	67.5	4%	0.035	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-40.9	168.8	-176.7	-84.4	0	0	0	111.3	M218 A219 D220 L225 D226 V233 T269 F272	M218-F222 WeakPolarHBondContact O-CB 3.21Å; M218-F222 PolarHBondContact O-N 3.22Å; A219-F222 PolarHBondContact O-N 2.65Å; D220-F222 VanDerWaalsContact C-N 3.32Å; D220-F222 PolarHBondContact O-N 2.68Å; F222-L225 PolarHBondContact O-N 3.37Å; F222-D226 HydrophobicContact CD1-CB 4.45Å; F222-D226 HydrophobicContact CE1-CB 4.13Å; F222-D226 VanDerWaalsContact O-CB 3.3Å; F222-D226 WeakPolarHBondContact O-CB 3.11Å; F222-D226 PolarHBondContact O-N 2.92Å; F222-V233 HydrophobicContact CD2-CG2 3.82Å; F222-V233 HydrophobicContact CE2-CG2 3.73Å; F222-V233 HydrophobicContact CG-CG2 4.43Å; F222-V233 HydrophobicContact CZ-CG2 4.23Å; F222-T269 HydrophobicContact CD1-CG2 3.82Å; F222-T269 HydrophobicContact CD2-CG2 4.39Å; F222-T269 HydrophobicContact CE1-CG2 3.4Å; F222-T269 VanDerWaalsContact CE1-CG2 3.4Å; F222-T269 HydrophobicContact CE2-CG2 4Å; F222-T269 HydrophobicContact CG-CG2 4.31Å; F222-T269 HydrophobicContact CZ-CG2 3.49Å; F222-T269 VanDerWaalsContact CZ-CG2 3.49Å; F222-F272 HydrophobicContact CB-CD1 4.11Å; F222-F272 HydrophobicContact CB-CE1 4.02Å; F222-F272 HydrophobicContact CD2-CB 3.69Å; F222-F272 AromaticContact CD2-CD1 3.79Å; F222-F272 HydrophobicContact CD2-CD1 3.79Å; F222-F272 AromaticContact CD2-CD2 3.81Å; F222-F272 HydrophobicContact CD2-CD2 3.81Å; F222-F272 HydrophobicContact CD2-CE1 4.31Å; F222-F272 HydrophobicContact CD2-CE2 4.34Å; F222-F272 AromaticContact CD2-CG 3.51Å; F222-F272 HydrophobicContact CD2-CG 3.51Å; F222-F272 HydrophobicContact CE2-CB 3.95Å; F222-F272 HydrophobicContact CE2-CD2 4.33Å; F222-F272 HydrophobicContact CE2-CG 4.17Å; F222-F272 HydrophobicContact CG-CD1 4.44Å
223	L	83.1	Confident	83.1	Confident	122 Å²	122	61.1 Å²	61.1	64%	0.639	34%	0.335	S	S	*	.	H	α-helix	trans	-75.3	-24.4	177.9	-67.3	169.4	0	0	0	113.4	A219 D220 V221 L225	A219-L223 WeakPolarHBondContact O-CG 3.25Å; A219-L223 PolarHBondContact O-N 2.97Å; D220-L223 CarbonylContact O-C 3.54Å; D220-L223 WeakPolarHBondContact O-CA 3.34Å; D220-L223 WeakPolarHBondContact O-CB 3.27Å; D220-L223 PolarHBondContact O-N 3.31Å; V221-L223 VanDerWaalsContact C-N 3.29Å; V221-L223 PolarHBondContact O-N 2.9Å; L223-L225 VanDerWaalsContact C-N 3.35Å
224	E	81.3	Confident	83	Confident	79 Å²	79	58 Å²	58	37%	0.369	32%	0.324	S	S	.	.	H	α-helix	trans	-79.2	-16.2	170.8	-65.7	-178.1	143.6	0	0	112.6	D220 V221 Y283 S285	D220-E224 PolarHBondContact O-N 2.86Å; V221-E224 PolarHBondContact O-N 3.49Å; E224-Y283 WeakPolarHBondContact CB-OH 3.43Å; E224-S285 WeakPolarHBondContact OE2-CB 3.48Å
225	L	81.6	Confident	82.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-105	-14.2	177.9	-69.5	174.6	0	0	0	114.9	V221 F222 L223 D227 V233 L238 H241 L244 F272 I279 Y283	V221-L225 HydrophobicContact CG1-CD1 3.77Å; V221-L225 HydrophobicContact CG1-CG 4.18Å; V221-L225 WeakPolarHBondContact O-CB 3.17Å; V221-L225 VanDerWaalsContact O-CG 3.27Å; V221-L225 WeakPolarHBondContact O-CG 3.09Å; V221-L225 PolarHBondContact O-N 3.3Å; F222-L225 PolarHBondContact O-N 3.37Å; L223-L225 VanDerWaalsContact C-N 3.35Å; L225-D227 PolarHBondContact O-N 2.95Å; L225-D227 VanDerWaalsContact O-N 3.14Å; L225-V233 HydrophobicContact CB-CB 4.49Å; L225-V233 HydrophobicContact CB-CG1 3.94Å; L225-V233 HydrophobicContact CB-CG2 3.67Å; L225-V233 HydrophobicContact CD1-CG1 4.46Å; L225-L238 HydrophobicContact CD1-CD2 4.09Å; L225-L238 HydrophobicContact CD2-CD2 4.21Å; L225-H241 WeakPolarHBondContact CD2-CD2 3.22Å; L225-L244 HydrophobicContact CD2-CD1 4.24Å; L225-F272 HydrophobicContact CD1-CE2 4.06Å; L225-F272 HydrophobicContact CD1-CZ 3.96Å; L225-I279 HydrophobicContact CD1-CG2 4.38Å; L225-Y283 HydrophobicContact CD2-CD2 4.47Å; L225-Y283 HydrophobicContact CD2-CE2 3.79Å; L225-Y283 HydrophobicContact CG-CE2 4.16Å
226	D	84.8	Confident	82.2	Confident	26 Å²	26	56 Å²	56	14%	0.139	32%	0.319	C	S	.	.			trans	-85.2	61.8	174.8	-174.9	17.3	0	0	0	109.4	F222 D228 G229 D230 G231	F222-D226 HydrophobicContact CD1-CB 4.45Å; F222-D226 HydrophobicContact CE1-CB 4.13Å; F222-D226 VanDerWaalsContact O-CB 3.3Å; F222-D226 WeakPolarHBondContact O-CB 3.11Å; F222-D226 PolarHBondContact O-N 2.92Å; D226-D228 VanDerWaalsContact C-N 3.32Å; D226-D228 PolarHBondContact O-N 3.29Å; D226-G229 PolarHBondContact O-N 3.5Å; D226-G229 VanDerWaalsContact OD1-CA 3.31Å; D226-G229 WeakPolarHBondContact OD1-CA 3.27Å; D226-G229 PolarHBondContact OD1-N 2.81Å; D226-D230 PolarHBondContact OD1-N 2.95Å; D226-G231 PolarHBondContact OD1-N 3.04Å; D226-G231 VanDerWaalsContact OD2-CA 3.31Å; D226-G231 WeakPolarHBondContact OD2-CA 3.17Å; D226-G231 PolarHBondContact OD2-N 3.32Å
227	D	77.4	Confident	81.9	Confident	118 Å²	118	54.7 Å²	54.7	63%	0.631	31%	0.305	S	S	*	.	S	Bend	trans	-66.8	-29.2	-165.4	-152.2	15	0	0	0	112.4	L225 E237	L225-D227 PolarHBondContact O-N 2.95Å; L225-D227 VanDerWaalsContact O-N 3.14Å; D227-E237 HydrophobicContact CB-CG 4.1Å; D227-E237 PolarHBondContact N-OE1 3.45Å
228	D	79.8	Confident	81.5	Confident	122 Å²	122	49.7 Å²	49.7	65%	0.652	29%	0.286	S	S	*	.	S	Bend	trans	-93.9	-17.1	174.4	107.8	-16.2	0	0	0	114.5	D226 D230 E237	D226-D228 VanDerWaalsContact C-N 3.32Å; D226-D228 PolarHBondContact O-N 3.29Å; D228-D230 WeakPolarHBondContact OD1-CB 3.05Å; D228-D230 PolarHBondContact OD1-N 2.7Å; D228-E237 PolarHBondContact N-OE1 3.39Å
229	G	79.3	Confident	81.1	Confident	56 Å²	56	52.6 Å²	52.6	58%	0.577	30%	0.299	S	S	*	.			trans	77.5	20.3	175.6	0	0	0	0	0	115.6	D226 G231	D226-G229 PolarHBondContact O-N 3.5Å; D226-G229 VanDerWaalsContact OD1-CA 3.31Å; D226-G229 WeakPolarHBondContact OD1-CA 3.27Å; D226-G229 PolarHBondContact OD1-N 2.81Å; G229-G231 PolarHBondContact O-N 3.23Å
230	D	81.8	Confident	80.6	Confident	84 Å²	84	53.6 Å²	53.6	45%	0.449	30%	0.304	S	S	.	.	S	Bend	trans	-74.1	-9.2	171.7	110.9	-32.9	0	0	0	114.3	D226 D228 F232 K266	D226-D230 PolarHBondContact OD1-N 2.95Å; D228-D230 WeakPolarHBondContact OD1-CB 3.05Å; D228-D230 PolarHBondContact OD1-N 2.7Å; D230-F232 WeakPolarHBondContact OD1-CB 3.27Å; D230-F232 WeakPolarHBondContact OD1-CD2 3.43Å; D230-F232 PolarHBondContact OD1-N 3.4Å; D230-K266 IonicContact OD1-NZ 2.97Å; D230-K266 PolarHBondContact OD1-NZ 2.83Å; D230-K266 IonicContact OD2-NZ 3.09Å; D230-K266 PolarHBondContact OD2-NZ 2.57Å
231	G	81.2	Confident	80.1	Confident	26 Å²	26	50.7 Å²	50.7	27%	0.268	29%	0.287	S	S	.	.	S	Bend	trans	92.3	19.3	175.4	0	0	0	0	0	114.1	D226 G229	D226-G231 PolarHBondContact OD1-N 3.04Å; D226-G231 VanDerWaalsContact OD2-CA 3.31Å; D226-G231 WeakPolarHBondContact OD2-CA 3.17Å; D226-G231 PolarHBondContact OD2-N 3.32Å; G229-G231 PolarHBondContact O-N 3.23Å
232	F	83.6	Confident	79.4	Confident	76 Å²	76	54.7 Å²	54.7	33%	0.333	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	124.6	178.3	-57.5	-111.8	0	0	0	111.2	D230 S234 K266 V267 D268	D230-F232 WeakPolarHBondContact OD1-CB 3.27Å; D230-F232 WeakPolarHBondContact OD1-CD2 3.43Å; D230-F232 PolarHBondContact OD1-N 3.4Å; F232-S234 PolarHBondContact O-N 3.26Å; F232-K266 HydrophobicContact CB-CB 4.42Å; F232-K266 HydrophobicContact CB-CD 3.62Å; F232-K266 VanDerWaalsContact CB-CE 3.45Å; F232-K266 HydrophobicContact CB-CG 3.99Å; F232-K266 HydrophobicContact CD1-CD 4.32Å; F232-K266 HydrophobicContact CD1-CG 4.19Å; F232-K266 HydrophobicContact CG-CD 4.09Å; F232-K266 HydrophobicContact CG-CG 4.39Å; F232-V267 CarbonylContact C-O 3.58Å; F232-V267 WeakPolarHBondContact CA-O 3.48Å; F232-V267 WeakPolarHBondContact CB-O 3.43Å; F232-D268 HydrophobicContact CD1-CB 3.74Å; F232-D268 HydrophobicContact CE1-CB 3.8Å
233	V	82.4	Confident	78.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.3	172.8	178.1	0	0	0	0	109.9	F222 L225 L238 K266 V267 F272	F222-V233 HydrophobicContact CD2-CG2 3.82Å; F222-V233 HydrophobicContact CE2-CG2 3.73Å; F222-V233 HydrophobicContact CG-CG2 4.43Å; F222-V233 HydrophobicContact CZ-CG2 4.23Å; L225-V233 HydrophobicContact CB-CB 4.49Å; L225-V233 HydrophobicContact CB-CG1 3.94Å; L225-V233 HydrophobicContact CB-CG2 3.67Å; L225-V233 HydrophobicContact CD1-CG1 4.46Å; V233-L238 HydrophobicContact CG1-CD1 4.27Å; V233-L238 HydrophobicContact CG1-CD2 4.2Å; V233-L238 HydrophobicContact CG1-CG 3.89Å; V233-K266 VanDerWaalsContact O-CA 3.3Å; V233-K266 WeakPolarHBondContact O-CA 3.41Å; V233-K266 WeakPolarHBondContact O-CB 3.44Å; V233-V267 HydrophobicContact CB-CG2 4.21Å; V233-V267 PolarHBondContact N-O 3.1Å; V233-V267 PolarHBondContact O-N 3.28Å; V233-F272 HydrophobicContact CB-CD2 4.49Å; V233-F272 HydrophobicContact CG2-CD2 4.36Å; V233-F272 HydrophobicContact CG2-CE2 4.25Å
234	S	81.1	Confident	78.3	Confident	19 Å²	19	52.3 Å²	52.3	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	165.5	176.3	77.4	0	0	0	0	113.8	F232 T236 E237 L238	F232-S234 PolarHBondContact O-N 3.26Å; S234-T236 PolarHBondContact O-N 3.25Å; S234-T236 PolarHBondContact OG-N 3.35Å; S234-E237 WeakPolarHBondContact CA-OE2 3.04Å; S234-E237 WeakPolarHBondContact CB-OE2 3.06Å; S234-E237 PolarHBondContact N-OE2 3.2Å; S234-E237 PolarHBondContact O-N 2.63Å; S234-E237 PolarHBondContact OG-N 3.07Å; S234-E237 PolarHBondContact OG-OE2 3.42Å; S234-L238 PolarHBondContact O-N 2.98Å; S234-L238 VanDerWaalsContact O-N 3.14Å
235	F	77.9	Confident	78	Confident	47 Å²	47	49.4 Å²	49.4	21%	0.206	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-25.1	173.2	80.2	-95.7	0	0	0	113.2	Q239 E254 A257 D265	F235-Q239 VanDerWaalsContact O-CG 3.27Å; F235-Q239 WeakPolarHBondContact O-CG 3.21Å; F235-Q239 PolarHBondContact O-N 3.28Å; F235-E254 HydrophobicContact CD2-CB 4.49Å; F235-E254 HydrophobicContact CD2-CG 3.97Å; F235-E254 HydrophobicContact CE2-CG 3.84Å; F235-E254 HydrophobicContact CZ-CG 4.35Å; F235-A257 HydrophobicContact CB-CB 3.94Å; F235-D265 PolarHBondContact N-O 3.29Å
236	T	75.6	Confident	77.4	Confident	83 Å²	83	51.2 Å²	51.2	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-79.9	-29.5	-178	-53.8	0	0	0	0	112	S234	S234-T236 PolarHBondContact O-N 3.25Å; S234-T236 PolarHBondContact OG-N 3.35Å
237	E	81.2	Confident	76.6	Confident	22 Å²	22	55.3 Å²	55.3	10%	0.103	32%	0.322	C	S	.	.	H	α-helix	trans	-78.8	-40.5	173.5	-68.4	148.5	124.1	0	0	110.6	D227 D228 S234 Q239 S240	D227-E237 HydrophobicContact CB-CG 4.1Å; D227-E237 PolarHBondContact N-OE1 3.45Å; D228-E237 PolarHBondContact N-OE1 3.39Å; S234-E237 WeakPolarHBondContact CA-OE2 3.04Å; S234-E237 WeakPolarHBondContact CB-OE2 3.06Å; S234-E237 PolarHBondContact N-OE2 3.2Å; S234-E237 PolarHBondContact O-N 2.63Å; S234-E237 PolarHBondContact OG-N 3.07Å; S234-E237 PolarHBondContact OG-OE2 3.42Å; E237-Q239 PolarHBondContact O-N 3Å; E237-S240 WeakPolarHBondContact O-CB 3.09Å; E237-S240 PolarHBondContact O-N 3.33Å; E237-S240 PolarHBondContact O-OG 2.82Å
238	L	75.9	Confident	76.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-53.9	-39.8	169.7	-73.4	165.5	0	0	0	111.8	L225 V233 S234 S240 H241 L244 F252 A257 L261	L225-L238 HydrophobicContact CD1-CD2 4.09Å; L225-L238 HydrophobicContact CD2-CD2 4.21Å; V233-L238 HydrophobicContact CG1-CD1 4.27Å; V233-L238 HydrophobicContact CG1-CD2 4.2Å; V233-L238 HydrophobicContact CG1-CG 3.89Å; S234-L238 PolarHBondContact O-N 2.98Å; S234-L238 VanDerWaalsContact O-N 3.14Å; L238-S240 PolarHBondContact O-N 3.12Å; L238-S240 VanDerWaalsContact O-N 3.13Å; L238-H241 PolarHBondContact O-N 3.38Å; L238-L244 HydrophobicContact CD2-CD1 3.41Å; L238-L244 VanDerWaalsContact CD2-CD1 3.41Å; L238-F252 HydrophobicContact CB-CE1 4.13Å; L238-F252 HydrophobicContact CB-CZ 4.32Å; L238-F252 VanDerWaalsContact O-CE1 3.26Å; L238-F252 WeakPolarHBondContact O-CE1 3.48Å; L238-A257 HydrophobicContact CB-CB 4.33Å; L238-L261 HydrophobicContact CD1-CD1 3.75Å; L238-L261 HydrophobicContact CD1-CD2 3.62Å; L238-L261 HydrophobicContact CD1-CG 3.42Å; L238-L261 VanDerWaalsContact CD1-CG 3.42Å
239	Q	75.7	Confident	75.8	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-9	176.3	-81.5	175.3	-17	0	0	115.5	F235 E237 T253 E254 A257	F235-Q239 VanDerWaalsContact O-CG 3.27Å; F235-Q239 WeakPolarHBondContact O-CG 3.21Å; F235-Q239 PolarHBondContact O-N 3.28Å; E237-Q239 PolarHBondContact O-N 3Å; Q239-T253 VanDerWaalsContact NE2-C 3.33Å; Q239-E254 VanDerWaalsContact NE2-CA 3.35Å; Q239-A257 HydrophobicContact CG-CB 4.33Å
240	S	74.7	Confident	75.1	Confident	66 Å²	66	55.1 Å²	55.1	46%	0.462	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-25.8	169.6	77.3	0	0	0	0	112.5	E237 L238 S242	E237-S240 WeakPolarHBondContact O-CB 3.09Å; E237-S240 PolarHBondContact O-N 3.33Å; E237-S240 PolarHBondContact O-OG 2.82Å; L238-S240 PolarHBondContact O-N 3.12Å; L238-S240 VanDerWaalsContact O-N 3.13Å; S240-S242 PolarHBondContact O-N 3.05Å
241	H	74.8	Confident	74.3	Confident	31 Å²	31	54.3 Å²	54.3	14%	0.144	33%	0.328	C	S	.	.			trans	-94	96	-177.5	-72.1	-81.2	0	0	0	111.8	L225 L238 E243 L244 Y283	L225-H241 WeakPolarHBondContact CD2-CD2 3.22Å; L238-H241 PolarHBondContact O-N 3.38Å; H241-E243 WeakPolarHBondContact CA-OE2 3.32Å; H241-E243 IonicContact CG-OE2 3.05Å; H241-E243 IonicContact ND1-OE2 3.28Å; H241-E243 PolarHBondContact O-N 3.25Å; H241-E243 VanDerWaalsContact O-N 3.11Å; H241-L244 HydrophobicContact CB-CD1 4.29Å; H241-L244 HydrophobicContact CB-CG 4.43Å; H241-L244 PolarHBondContact O-N 3.27Å; H241-Y283 AromaticContact ND1-CE2 3.99Å
242	S	70.8	Confident	74.1	Confident	88 Å²	88	54.3 Å²	54.3	62%	0.615	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-59.3	-18.9	175.7	29.2	0	0	0	0	114.2	S240 L244 D245	S240-S242 PolarHBondContact O-N 3.05Å; S242-L244 PolarHBondContact O-N 2.98Å; S242-D245 WeakPolarHBondContact O-CB 3.3Å; S242-D245 PolarHBondContact O-N 3.14Å
243	E	70.8	Confident	73.7	Confident	81 Å²	81	53.5 Å²	53.5	38%	0.379	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-74.9	-18.1	-175.4	-55	63.1	-118.5	0	0	111.5	H241	H241-E243 WeakPolarHBondContact CA-OE2 3.32Å; H241-E243 IonicContact CG-OE2 3.05Å; H241-E243 IonicContact ND1-OE2 3.28Å; H241-E243 PolarHBondContact O-N 3.25Å; H241-E243 VanDerWaalsContact O-N 3.11Å
244	L	72.8	Confident	73.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-91.4	-0.8	179.9	-70.6	-179.5	0	0	0	114.4	L225 L238 H241 S242 P246 F252 L260 I279 K282 Y283	L225-L244 HydrophobicContact CD2-CD1 4.24Å; L238-L244 HydrophobicContact CD2-CD1 3.41Å; L238-L244 VanDerWaalsContact CD2-CD1 3.41Å; H241-L244 HydrophobicContact CB-CD1 4.29Å; H241-L244 HydrophobicContact CB-CG 4.43Å; H241-L244 PolarHBondContact O-N 3.27Å; S242-L244 PolarHBondContact O-N 2.98Å; L244-P246 WeakPolarHBondContact O-CD 3.39Å; L244-P246 WeakPolarHBondContact O-CG 3.38Å; L244-P246 VanDerWaalsContact O-N 3.1Å; L244-F252 HydrophobicContact CB-CE1 4.01Å; L244-F252 HydrophobicContact CB-CZ 4.23Å; L244-L260 HydrophobicContact CB-CD1 4.11Å; L244-I279 HydrophobicContact CD1-CG2 4.3Å; L244-I279 HydrophobicContact CD2-CG2 3.92Å; L244-K282 HydrophobicContact CD2-CB 4.07Å; L244-Y283 HydrophobicContact CD1-CD2 3.98Å; L244-Y283 HydrophobicContact CD2-CD2 3.9Å; L244-Y283 HydrophobicContact CD2-CG 4.42Å; L244-Y283 HydrophobicContact CG-CD2 3.98Å
245	D	74.4	Confident	73	Confident	18 Å²	18	61.5 Å²	61.5	10%	0.096	37%	0.369	C	S	.	.			trans	-47.9	112.2	175.5	-177.3	-19.7	0	0	0	111.3	S242 D247 S248 D249 A250 F252	S242-D245 WeakPolarHBondContact O-CB 3.3Å; S242-D245 PolarHBondContact O-N 3.14Å; D245-D247 PolarHBondContact O-N 3Å; D245-D247 PolarHBondContact OD1-N 3.15Å; D245-S248 VanDerWaalsContact CG-CA 3.48Å; D245-S248 WeakPolarHBondContact OD1-CA 3.29Å; D245-S248 PolarHBondContact OD1-N 3.05Å; D245-S248 WeakPolarHBondContact OD2-CA 3.26Å; D245-D249 PolarHBondContact OD2-N 3.07Å; D245-A250 VanDerWaalsContact OD2-CA 3.3Å; D245-A250 WeakPolarHBondContact OD2-CA 3.47Å; D245-A250 PolarHBondContact OD2-N 3.13Å; D245-F252 HydrophobicContact CB-CB 4.46Å
246	P	69	Low	72.9	Confident	38 Å²	38	62.1 Å²	62.1	25%	0.247	37%	0.372	C	S	.	.	S	Bend	trans	-72	-24.1	-170.4	-27.3	39.7	0	0	0	116.2	L244 F252 E256 L260 K282	L244-P246 WeakPolarHBondContact O-CD 3.39Å; L244-P246 WeakPolarHBondContact O-CG 3.38Å; L244-P246 VanDerWaalsContact O-N 3.1Å; P246-F252 HydrophobicContact CG-CD2 4.41Å; P246-F252 HydrophobicContact CG-CE2 4.04Å; P246-E256 HydrophobicContact CG-CB 3.92Å; P246-E256 HydrophobicContact CG-CG 4.18Å; P246-L260 HydrophobicContact CG-CD1 4.28Å; P246-L260 HydrophobicContact CG-CD2 4.11Å; P246-L260 HydrophobicContact CG-CG 4.16Å; P246-K282 VanDerWaalsContact CA-NZ 3.29Å; P246-K282 PolarHBondContact O-NZ 2.88Å
247	D	68.1	Low	72.9	Confident	112 Å²	112	58.1 Å²	58.1	60%	0.599	35%	0.348	S	S	*	.	S	Bend	trans	-124.7	0.5	179.7	70	3.2	0	0	0	114.5	D245 D249	D245-D247 PolarHBondContact O-N 3Å; D245-D247 PolarHBondContact OD1-N 3.15Å; D247-D249 VanDerWaalsContact C-N 3.32Å; D247-D249 PolarHBondContact O-N 3.35Å; D247-D249 PolarHBondContact OD1-N 3.21Å
248	S	67.4	Low	72.7	Confident	101 Å²	101	60.2 Å²	60.2	71%	0.706	36%	0.358	S	S	*	.			trans	65.4	30.4	173.9	-50.8	0	0	0	0	113.8	D245 A250	D245-S248 VanDerWaalsContact CG-CA 3.48Å; D245-S248 WeakPolarHBondContact OD1-CA 3.29Å; D245-S248 PolarHBondContact OD1-N 3.05Å; D245-S248 WeakPolarHBondContact OD2-CA 3.26Å; S248-A250 PolarHBondContact O-N 2.96Å
249	D	74.2	Confident	72.8	Confident	100 Å²	100	62.3 Å²	62.3	54%	0.535	38%	0.38	S	S	.	.	S	Bend	trans	-75.8	-7.5	173.2	109.2	-29.6	0	0	0	113.6	D245 D247 S251	D245-D249 PolarHBondContact OD2-N 3.07Å; D247-D249 VanDerWaalsContact C-N 3.32Å; D247-D249 PolarHBondContact O-N 3.35Å; D247-D249 PolarHBondContact OD1-N 3.21Å; D249-S251 VanDerWaalsContact CG-OG 3.31Å; D249-S251 WeakPolarHBondContact OD1-CA 3.4Å; D249-S251 WeakPolarHBondContact OD1-CB 3.47Å; D249-S251 PolarHBondContact OD1-N 2.98Å; D249-S251 PolarHBondContact OD1-OG 3.21Å; D249-S251 PolarHBondContact OD2-OG 2.78Å
250	A	63.9	Low	73	Confident	91 Å²	91	59.5 Å²	59.5	75%	0.752	37%	0.367	S	S	*	.	S	Bend	trans	70.4	24.5	-177.6	0	0	0	0	0	114.9	D245 S248	D245-A250 VanDerWaalsContact OD2-CA 3.3Å; D245-A250 WeakPolarHBondContact OD2-CA 3.47Å; D245-A250 PolarHBondContact OD2-N 3.13Å; S248-A250 PolarHBondContact O-N 2.96Å
251	S	64.9	Low	73.2	Confident	66 Å²	66	56.4 Å²	56.4	46%	0.462	35%	0.345	S	S	.	.			trans	-140.9	44.3	177.8	71.6	0	0	0	0	115.7	D249 T253	D249-S251 VanDerWaalsContact CG-OG 3.31Å; D249-S251 WeakPolarHBondContact OD1-CA 3.4Å; D249-S251 WeakPolarHBondContact OD1-CB 3.47Å; D249-S251 PolarHBondContact OD1-N 2.98Å; D249-S251 PolarHBondContact OD1-OG 3.21Å; D249-S251 PolarHBondContact OD2-OG 2.78Å; S251-T253 WeakPolarHBondContact O-CG2 3.26Å; S251-T253 PolarHBondContact O-N 2.67Å
252	F	76.1	Confident	73.3	Confident	27 Å²	27	57.7 Å²	57.7	12%	0.118	37%	0.367	C	S	.	.			trans	-35.2	103.9	178	-171.8	-153.9	0	0	0	114.8	L238 L244 D245 P246 E256 A257 L260	L238-F252 HydrophobicContact CB-CE1 4.13Å; L238-F252 HydrophobicContact CB-CZ 4.32Å; L238-F252 VanDerWaalsContact O-CE1 3.26Å; L238-F252 WeakPolarHBondContact O-CE1 3.48Å; L244-F252 HydrophobicContact CB-CE1 4.01Å; L244-F252 HydrophobicContact CB-CZ 4.23Å; D245-F252 HydrophobicContact CB-CB 4.46Å; P246-F252 HydrophobicContact CG-CD2 4.41Å; P246-F252 HydrophobicContact CG-CE2 4.04Å; F252-E256 HydrophobicContact CD2-CB 3.6Å; F252-E256 HydrophobicContact CE2-CB 3.62Å; F252-A257 HydrophobicContact CE1-CB 4.35Å; F252-A257 HydrophobicContact CE2-CB 3.89Å; F252-A257 HydrophobicContact CZ-CB 3.71Å; F252-L260 HydrophobicContact CE2-CD1 4.24Å; F252-L260 HydrophobicContact CZ-CD1 3.85Å
253	T	76.1	Confident	73.4	Confident	59 Å²	59	55.9 Å²	55.9	36%	0.362	36%	0.362	S	S	.	.			trans	-93.7	170.9	-171.7	82.5	0	0	0	0	113.7	Q239 S251 A255 E256 A257	Q239-T253 VanDerWaalsContact NE2-C 3.33Å; S251-T253 WeakPolarHBondContact O-CG2 3.26Å; S251-T253 PolarHBondContact O-N 2.67Å; T253-A255 PolarHBondContact O-N 3.07Å; T253-A255 PolarHBondContact OG1-N 2.9Å; T253-E256 WeakPolarHBondContact CA-OE2 3.35Å; T253-E256 WeakPolarHBondContact CB-OE2 3.23Å; T253-E256 VanDerWaalsContact CG2-OE2 3.25Å; T253-E256 WeakPolarHBondContact CG2-OE2 3.32Å; T253-E256 PolarHBondContact N-OE2 2.89Å; T253-E256 PolarHBondContact O-N 2.95Å; T253-E256 PolarHBondContact OG1-OE1 3.43Å; T253-E256 PolarHBondContact OG1-OE2 3.4Å; T253-A257 WeakPolarHBondContact O-CB 3.38Å; T253-A257 PolarHBondContact O-N 3.44Å
254	E	74	Confident	73.8	Confident	121 Å²	121	55.4 Å²	55.4	57%	0.565	37%	0.365	S	S	*	.	H	α-helix	trans	-56.4	-33.1	175.2	-176.7	177.1	-176.6	0	0	112	F235 Q239 Q258	F235-E254 HydrophobicContact CD2-CB 4.49Å; F235-E254 HydrophobicContact CD2-CG 3.97Å; F235-E254 HydrophobicContact CE2-CG 3.84Å; F235-E254 HydrophobicContact CZ-CG 4.35Å; Q239-E254 VanDerWaalsContact NE2-CA 3.35Å; E254-Q258 WeakPolarHBondContact O-CB 3.31Å; E254-Q258 PolarHBondContact O-N 2.62Å
255	A	74.6	Confident	73.9	Confident	65 Å²	65	60.4 Å²	60.4	54%	0.537	39%	0.392	S	S	.	.	H	α-helix	trans	-75.5	-37.9	180	0	0	0	0	0	112.8	T253 G259	T253-A255 PolarHBondContact O-N 3.07Å; T253-A255 PolarHBondContact OG1-N 2.9Å; A255-G259 PolarHBondContact O-N 3.27Å
256	E	76	Confident	74.2	Confident	60 Å²	60	63.5 Å²	63.5	28%	0.28	40%	0.404	S	S	.	.	H	α-helix	trans	-69.5	-43.8	173.2	-74.9	84.5	-118.3	0	0	111.4	P246 F252 T253 G259 L260	P246-E256 HydrophobicContact CG-CB 3.92Å; P246-E256 HydrophobicContact CG-CG 4.18Å; F252-E256 HydrophobicContact CD2-CB 3.6Å; F252-E256 HydrophobicContact CE2-CB 3.62Å; T253-E256 WeakPolarHBondContact CA-OE2 3.35Å; T253-E256 WeakPolarHBondContact CB-OE2 3.23Å; T253-E256 VanDerWaalsContact CG2-OE2 3.25Å; T253-E256 WeakPolarHBondContact CG2-OE2 3.32Å; T253-E256 PolarHBondContact N-OE2 2.89Å; T253-E256 PolarHBondContact O-N 2.95Å; T253-E256 PolarHBondContact OG1-OE1 3.43Å; T253-E256 PolarHBondContact OG1-OE2 3.4Å; E256-G259 CarbonylContact O-C 3.45Å; E256-G259 VanDerWaalsContact O-CA 3.31Å; E256-G259 WeakPolarHBondContact O-CA 3.32Å; E256-G259 PolarHBondContact O-N 3.46Å; E256-L260 PolarHBondContact O-N 3.02Å
257	A	74.9	Confident	74.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-63.9	-45.3	179.5	0	0	0	0	0	111.8	F235 L238 Q239 F252 T253 G259 L260 L261	F235-A257 HydrophobicContact CB-CB 3.94Å; L238-A257 HydrophobicContact CB-CB 4.33Å; Q239-A257 HydrophobicContact CG-CB 4.33Å; F252-A257 HydrophobicContact CE1-CB 4.35Å; F252-A257 HydrophobicContact CE2-CB 3.89Å; F252-A257 HydrophobicContact CZ-CB 3.71Å; T253-A257 WeakPolarHBondContact O-CB 3.38Å; T253-A257 PolarHBondContact O-N 3.44Å; A257-G259 PolarHBondContact O-N 3.5Å; A257-L260 PolarHBondContact O-N 2.81Å; A257-L261 PolarHBondContact O-N 2.04Å; A257-L261 VanDerWaalsContact O-N 3.14Å
258	Q	76.9	Confident	75.5	Confident	65 Å²	65	59.7 Å²	59.7	30%	0.304	38%	0.382	S	S	.	.	H	α-helix	trans	-63.9	-29.7	171	-165.3	-179.9	45.7	0	0	111.7	E254 L261 G262 G263 D265	E254-Q258 WeakPolarHBondContact O-CB 3.31Å; E254-Q258 PolarHBondContact O-N 2.62Å; Q258-L261 CarbonylContact O-C 3.55Å; Q258-L261 PolarHBondContact O-N 3.3Å; Q258-G262 PolarHBondContact O-N 2.9Å; Q258-G263 WeakPolarHBondContact O-CA 3.1Å; Q258-G263 PolarHBondContact O-N 3.42Å; Q258-D265 PolarHBondContact NE2-OD1 2.82Å
259	G	78.7	Confident	76.1	Confident	45 Å²	45	58.6 Å²	58.6	46%	0.464	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-47.2	173.1	0	0	0	0	0	113.4	A255 E256 A257 L261 G262	A255-G259 PolarHBondContact O-N 3.27Å; E256-G259 CarbonylContact O-C 3.45Å; E256-G259 VanDerWaalsContact O-CA 3.31Å; E256-G259 WeakPolarHBondContact O-CA 3.32Å; E256-G259 PolarHBondContact O-N 3.46Å; A257-G259 PolarHBondContact O-N 3.5Å; G259-L261 VanDerWaalsContact C-N 3.31Å; G259-L261 PolarHBondContact O-N 3.45Å; G259-G262 PolarHBondContact O-N 2.86Å
260	L	79.1	Confident	76.5	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-41.6	173.5	-66.9	-172.9	0	0	0	111.2	L244 P246 F252 E256 A257 G262 V275 N278 I279	L244-L260 HydrophobicContact CB-CD1 4.11Å; P246-L260 HydrophobicContact CG-CD1 4.28Å; P246-L260 HydrophobicContact CG-CD2 4.11Å; P246-L260 HydrophobicContact CG-CG 4.16Å; F252-L260 HydrophobicContact CE2-CD1 4.24Å; F252-L260 HydrophobicContact CZ-CD1 3.85Å; E256-L260 PolarHBondContact O-N 3.02Å; A257-L260 PolarHBondContact O-N 2.81Å; L260-G262 PolarHBondContact O-N 2.66Å; L260-G262 VanDerWaalsContact O-N 3.11Å; L260-V275 WeakPolarHBondContact O-CB 3.27Å; L260-N278 HydrophobicContact CD2-CB 4.22Å; L260-N278 PolarHBondContact O-ND2 2.81Å; L260-I279 HydrophobicContact CB-CG1 4.34Å
261	L	78.9	Confident	77.3	Confident	2 Å²	2	56 Å²	56	1%	0.01	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	7.7	172.7	-66.9	-173.2	0	0	0	114.9	L238 A257 Q258 G259 G263 V264 V267 V275	L238-L261 HydrophobicContact CD1-CD1 3.75Å; L238-L261 HydrophobicContact CD1-CD2 3.62Å; L238-L261 HydrophobicContact CD1-CG 3.42Å; L238-L261 VanDerWaalsContact CD1-CG 3.42Å; A257-L261 PolarHBondContact O-N 2.04Å; A257-L261 VanDerWaalsContact O-N 3.14Å; Q258-L261 CarbonylContact O-C 3.55Å; Q258-L261 PolarHBondContact O-N 3.3Å; G259-L261 VanDerWaalsContact C-N 3.31Å; G259-L261 PolarHBondContact O-N 3.45Å; L261-G263 VanDerWaalsContact C-N 3.27Å; L261-G263 PolarHBondContact O-N 2.74Å; L261-V264 WeakPolarHBondContact CB-O 3.49Å; L261-V264 WeakPolarHBondContact O-CG2 3.33Å; L261-V267 HydrophobicContact CB-CG1 4.38Å; L261-V267 HydrophobicContact CD2-CB 4.42Å; L261-V267 HydrophobicContact CD2-CG1 3.98Å; L261-V267 HydrophobicContact CD2-CG2 3.56Å; L261-V275 HydrophobicContact CD2-CG2 4.37Å
262	G	77.4	Confident	78.2	Confident	58 Å²	58	52.9 Å²	52.9	60%	0.598	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	20.7	174.6	0	0	0	0	0	114.6	Q258 G259 L260	Q258-G262 PolarHBondContact O-N 2.9Å; G259-G262 PolarHBondContact O-N 2.86Å; L260-G262 PolarHBondContact O-N 2.66Å; L260-G262 VanDerWaalsContact O-N 3.11Å
263	G	74.1	Confident	78.5	Confident	50 Å²	50	55.8 Å²	55.8	52%	0.515	35%	0.345	S	S	.	.	S	Bend	trans	98.6	18.1	174.3	0	0	0	0	0	115.8	Q258 L261	Q258-G263 WeakPolarHBondContact O-CA 3.1Å; Q258-G263 PolarHBondContact O-N 3.42Å; L261-G263 VanDerWaalsContact C-N 3.27Å; L261-G263 PolarHBondContact O-N 2.74Å
264	V	77.9	Confident	78.8	Confident	71 Å²	71	58.2 Å²	58.2	43%	0.43	36%	0.36	S	S	.	.			trans	-126.4	151.2	177.8	-61.6	0	0	0	0	112.9	L261 K266 V267	L261-V264 WeakPolarHBondContact CB-O 3.49Å; L261-V264 WeakPolarHBondContact O-CG2 3.33Å; V264-K266 PolarHBondContact O-N 3.14Å; V264-V267 HydrophobicContact CG2-CG1 3.6Å
265	D	75.8	Confident	79.1	Confident	105 Å²	105	53 Å²	53	56%	0.561	34%	0.336	S	S	*	.	S	Bend	trans	-68.8	-31.4	-170.5	-44.4	-15.7	0	0	0	113.2	F235 Q258	F235-D265 PolarHBondContact N-O 3.29Å; Q258-D265 PolarHBondContact NE2-OD1 2.82Å
266	K	79.2	Confident	79.6	Confident	82 Å²	82	50.3 Å²	50.3	36%	0.357	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	156.7	168.7	76.9	-179.8	-159	157.2	0	112.8	D230 F232 V233 V264	D230-K266 IonicContact OD1-NZ 2.97Å; D230-K266 PolarHBondContact OD1-NZ 2.83Å; D230-K266 IonicContact OD2-NZ 3.09Å; D230-K266 PolarHBondContact OD2-NZ 2.57Å; F232-K266 HydrophobicContact CB-CB 4.42Å; F232-K266 HydrophobicContact CB-CD 3.62Å; F232-K266 VanDerWaalsContact CB-CE 3.45Å; F232-K266 HydrophobicContact CB-CG 3.99Å; F232-K266 HydrophobicContact CD1-CD 4.32Å; F232-K266 HydrophobicContact CD1-CG 4.19Å; F232-K266 HydrophobicContact CG-CD 4.09Å; F232-K266 HydrophobicContact CG-CG 4.39Å; V233-K266 VanDerWaalsContact O-CA 3.3Å; V233-K266 WeakPolarHBondContact O-CA 3.41Å; V233-K266 WeakPolarHBondContact O-CB 3.44Å; V264-K266 PolarHBondContact O-N 3.14Å
267	V	84.4	Confident	79.8	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.024	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.1	-178.9	-65.4	0	0	0	0	111.6	F232 V233 L261 V264 A271 F272 V275	F232-V267 CarbonylContact C-O 3.58Å; F232-V267 WeakPolarHBondContact CA-O 3.48Å; F232-V267 WeakPolarHBondContact CB-O 3.43Å; V233-V267 HydrophobicContact CB-CG2 4.21Å; V233-V267 PolarHBondContact N-O 3.1Å; V233-V267 PolarHBondContact O-N 3.28Å; L261-V267 HydrophobicContact CB-CG1 4.38Å; L261-V267 HydrophobicContact CD2-CB 4.42Å; L261-V267 HydrophobicContact CD2-CG1 3.98Å; L261-V267 HydrophobicContact CD2-CG2 3.56Å; V264-V267 HydrophobicContact CG2-CG1 3.6Å; V267-A271 HydrophobicContact CB-CB 3.8Å; V267-A271 HydrophobicContact CG1-CB 4.04Å; V267-F272 HydrophobicContact CG2-CB 4.18Å; V267-F272 HydrophobicContact CG2-CD2 3.82Å; V267-V275 HydrophobicContact CG1-CG2 4.46Å; V267-V275 HydrophobicContact CG2-CG2 4.38Å
268	D	81.5	Confident	80	Confident	66 Å²	66	55.1 Å²	55.1	35%	0.353	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	172.3	167.4	67.5	25.7	0	0	0	111.4	F232 V270 A271 F272	F232-D268 HydrophobicContact CD1-CB 3.74Å; F232-D268 HydrophobicContact CE1-CB 3.8Å; D268-V270 PolarHBondContact O-N 2.93Å; D268-V270 WeakPolarHBondContact OD1-CA 3.35Å; D268-V270 PolarHBondContact OD1-N 3.36Å; D268-A271 PolarHBondContact O-N 2.86Å; D268-A271 VanDerWaalsContact O-N 3.14Å; D268-A271 PolarHBondContact OD1-N 3.06Å; D268-F272 WeakPolarHBondContact O-CB 3.48Å; D268-F272 PolarHBondContact O-N 3.47Å
269	T	79.6	Confident	80	Confident	78 Å²	78	52 Å²	52	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-49.7	-26.8	176.7	49.1	0	0	0	0	115.4	F222	F222-T269 HydrophobicContact CD1-CG2 3.82Å; F222-T269 HydrophobicContact CD2-CG2 4.39Å; F222-T269 HydrophobicContact CE1-CG2 3.4Å; F222-T269 VanDerWaalsContact CE1-CG2 3.4Å; F222-T269 HydrophobicContact CE2-CG2 4Å; F222-T269 HydrophobicContact CG-CG2 4.31Å; F222-T269 HydrophobicContact CZ-CG2 3.49Å; F222-T269 VanDerWaalsContact CZ-CG2 3.49Å
270	V	81.4	Confident	80	Confident	101 Å²	101	52 Å²	52	61%	0.612	31%	0.312	S	S	*	.	H	α-helix	trans	-90.8	-37.4	-178.2	-177.3	0	0	0	0	110.9	D268 F272	D268-V270 PolarHBondContact O-N 2.93Å; D268-V270 WeakPolarHBondContact OD1-CA 3.35Å; D268-V270 PolarHBondContact OD1-N 3.36Å; V270-F272 VanDerWaalsContact C-N 3.32Å
271	A	81.8	Confident	79.7	Confident	37 Å²	37	59.3 Å²	59.3	31%	0.306	35%	0.346	S	S	.	.	H	α-helix	trans	-67.1	-33.9	169.9	0	0	0	0	0	111.7	V267 D268 E273 T274 V275	V267-A271 HydrophobicContact CB-CB 3.8Å; V267-A271 HydrophobicContact CG1-CB 4.04Å; D268-A271 PolarHBondContact O-N 2.86Å; D268-A271 VanDerWaalsContact O-N 3.14Å; D268-A271 PolarHBondContact OD1-N 3.06Å; A271-E273 VanDerWaalsContact C-N 3.31Å; A271-E273 PolarHBondContact O-N 3.2Å; A271-T274 WeakPolarHBondContact O-CB 3.09Å; A271-T274 PolarHBondContact O-N 3.25Å; A271-V275 PolarHBondContact O-N 3.06Å
272	F	83.6	Confident	79.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-36.1	178	-166	-98.7	0	0	0	112.7	M218 F222 L225 V233 V267 D268 V270 T274 V275 W276 I279	M218-F272 HydrophobicContact CG-CD1 3.9Å; M218-F272 HydrophobicContact CG-CE1 4.03Å; M218-F272 HydrophobicContact SD-CD1 3.74Å; M218-F272 HydrophobicContact SD-CE1 4.3Å; F222-F272 HydrophobicContact CB-CD1 4.11Å; F222-F272 HydrophobicContact CB-CE1 4.02Å; F222-F272 HydrophobicContact CD2-CB 3.69Å; F222-F272 AromaticContact CD2-CD1 3.79Å; F222-F272 HydrophobicContact CD2-CD1 3.79Å; F222-F272 AromaticContact CD2-CD2 3.81Å; F222-F272 HydrophobicContact CD2-CD2 3.81Å; F222-F272 HydrophobicContact CD2-CE1 4.31Å; F222-F272 HydrophobicContact CD2-CE2 4.34Å; F222-F272 AromaticContact CD2-CG 3.51Å; F222-F272 HydrophobicContact CD2-CG 3.51Å; F222-F272 HydrophobicContact CE2-CB 3.95Å; F222-F272 HydrophobicContact CE2-CD2 4.33Å; F222-F272 HydrophobicContact CE2-CG 4.17Å; F222-F272 HydrophobicContact CG-CD1 4.44Å; L225-F272 HydrophobicContact CD1-CE2 4.06Å; L225-F272 HydrophobicContact CD1-CZ 3.96Å; V233-F272 HydrophobicContact CB-CD2 4.49Å; V233-F272 HydrophobicContact CG2-CD2 4.36Å; V233-F272 HydrophobicContact CG2-CE2 4.25Å; V267-F272 HydrophobicContact CG2-CB 4.18Å; V267-F272 HydrophobicContact CG2-CD2 3.82Å; D268-F272 WeakPolarHBondContact O-CB 3.48Å; D268-F272 PolarHBondContact O-N 3.47Å; V270-F272 VanDerWaalsContact C-N 3.32Å; F272-T274 PolarHBondContact O-N 3.07Å; F272-V275 HydrophobicContact CD2-CG2 4.17Å; F272-V275 HydrophobicContact CG-CG2 4.48Å; F272-V275 WeakPolarHBondContact O-CG2 3.36Å; F272-V275 PolarHBondContact O-N 3.36Å; F272-V275 VanDerWaalsContact O-N 3.08Å; F272-W276 AromaticContact CE1-CE3 3.72Å; F272-W276 HydrophobicContact CE1-CE3 3.72Å; F272-W276 HydrophobicContact CE1-CZ3 4.3Å; F272-W276 HydrophobicContact CZ-CE3 4.14Å; F272-W276 WeakPolarHBondContact O-CB 3.13Å; F272-W276 PolarHBondContact O-N 2.74Å; F272-I279 HydrophobicContact CD2-CD1 4.33Å; F272-I279 HydrophobicContact CE2-CD1 3.58Å; F272-I279 HydrophobicContact CZ-CD1 4.01Å
273	E	82.3	Confident	79	Confident	88 Å²	88	61 Å²	61	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-56.7	-27	173.5	-58.6	-159.2	137.8	0	0	113.2	K215 M218 A271	K215-E273 IonicContact NZ-OE1 3.54Å; K215-E273 PolarHBondContact NZ-OE1 3.17Å; M218-E273 HydrophobicContact CE-CG 3.83Å; M218-E273 WeakPolarHBondContact CE-OE1 3.1Å; M218-E273 HydrophobicContact SD-CG 4.16Å; A271-E273 VanDerWaalsContact C-N 3.31Å; A271-E273 PolarHBondContact O-N 3.2Å
274	T	81.8	Confident	78.3	Confident	110 Å²	110	63 Å²	63	68%	0.675	34%	0.339	S	S	*	.	H	α-helix	trans	-81.7	-32.4	179.7	-54.2	0	0	0	0	112.3	A271 F272	A271-T274 WeakPolarHBondContact O-CB 3.09Å; A271-T274 PolarHBondContact O-N 3.25Å; F272-T274 PolarHBondContact O-N 3.07Å
275	V	81.4	Confident	77.3	Confident	10 Å²	10	61 Å²	61	6%	0.061	33%	0.328	C	S	.	.	H	α-helix	trans	-97	-10.9	-179.6	-65.4	0	0	0	0	113.6	L260 L261 V267 A271 F272 N277 N278 I279	L260-V275 WeakPolarHBondContact O-CB 3.27Å; L261-V275 HydrophobicContact CD2-CG2 4.37Å; V267-V275 HydrophobicContact CG1-CG2 4.46Å; V267-V275 HydrophobicContact CG2-CG2 4.38Å; A271-V275 PolarHBondContact O-N 3.06Å; F272-V275 HydrophobicContact CD2-CG2 4.17Å; F272-V275 HydrophobicContact CG-CG2 4.48Å; F272-V275 WeakPolarHBondContact O-CG2 3.36Å; F272-V275 PolarHBondContact O-N 3.36Å; F272-V275 VanDerWaalsContact O-N 3.08Å; V275-N277 PolarHBondContact O-N 3.43Å; V275-N277 VanDerWaalsContact O-N 3.09Å; V275-N278 VanDerWaalsContact O-CB 3.3Å; V275-N278 WeakPolarHBondContact O-CB 3.39Å; V275-N278 PolarHBondContact O-N 2.7Å; V275-I279 HydrophobicContact CG2-CD1 4.27Å; V275-I279 PolarHBondContact O-N 2.97Å
276	W	84.4	Confident	76.1	Confident	9 Å²	9	64.1 Å²	64.1	3%	0.034	34%	0.339	C	S	.	.	H	α-helix	trans	-48.6	-39.9	178.4	174.2	-124.7	0	0	0	113.2	D214 R217 M218 V221 F272 N278 I279 K280	D214-W276 PolarHBondContact O-NE1 2.9Å; D214-W276 PolarHBondContact OD1-NE1 3.36Å; R217-W276 HydrophobicContact CB-CH2 4.45Å; R217-W276 HydrophobicContact CB-CZ2 4.16Å; R217-W276 HydrophobicContact CG-CH2 4.45Å; M218-W276 HydrophobicContact CB-CD2 3.63Å; M218-W276 HydrophobicContact CB-CE3 4.17Å; M218-W276 HydrophobicContact CB-CG 3.88Å; M218-W276 HydrophobicContact CB-CH2 4.48Å; M218-W276 HydrophobicContact CB-CZ2 3.99Å; M218-W276 HydrophobicContact CG-CB 3.9Å; M218-W276 HydrophobicContact CG-CD2 3.64Å; M218-W276 HydrophobicContact CG-CE3 4.1Å; M218-W276 HydrophobicContact CG-CG 3.54Å; V221-W276 HydrophobicContact CB-CH2 3.98Å; V221-W276 HydrophobicContact CB-CZ3 3.73Å; V221-W276 HydrophobicContact CG1-CH2 4.41Å; V221-W276 HydrophobicContact CG1-CZ3 3.79Å; V221-W276 HydrophobicContact CG2-CH2 3.94Å; V221-W276 HydrophobicContact CG2-CZ3 4.16Å; F272-W276 AromaticContact CE1-CE3 3.72Å; F272-W276 HydrophobicContact CE1-CE3 3.72Å; F272-W276 HydrophobicContact CE1-CZ3 4.3Å; F272-W276 HydrophobicContact CZ-CE3 4.14Å; F272-W276 WeakPolarHBondContact O-CB 3.13Å; F272-W276 PolarHBondContact O-N 2.74Å; W276-N278 PolarHBondContact O-N 2.85Å; W276-I279 PolarHBondContact O-N 3.06Å; W276-I279 VanDerWaalsContact O-N 3.11Å; W276-K280 HydrophobicContact CD2-CB 3.74Å; W276-K280 HydrophobicContact CD2-CD 4.2Å; W276-K280 VanDerWaalsContact CE2-CB 3.46Å; W276-K280 HydrophobicContact CE3-CB 3.95Å; W276-K280 HydrophobicContact CG-CB 4.45Å; W276-K280 HydrophobicContact CG-CD 4.18Å; W276-K280 HydrophobicContact CH2-CB 3.75Å; W276-K280 HydrophobicContact CZ2-CB 3.49Å; W276-K280 VanDerWaalsContact CZ2-CB 3.49Å; W276-K280 HydrophobicContact CZ2-CD 4.28Å; W276-K280 HydrophobicContact CZ3-CB 3.95Å; W276-K280 VanDerWaalsContact NE1-CD 3.29Å; W276-K280 VanDerWaalsContact O-CB 3.26Å; W276-K280 WeakPolarHBondContact O-CB 3.4Å; W276-K280 WeakPolarHBondContact O-CG 3.47Å; W276-K280 PolarHBondContact O-N 2.89Å
277	N	79.7	Confident	74.4	Confident	88 Å²	88	64.7 Å²	64.7	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-64.3	-25.6	178.5	-61.6	-57.5	0	0	0	113.9	V275 K280	V275-N277 PolarHBondContact O-N 3.43Å; V275-N277 VanDerWaalsContact O-N 3.09Å; N277-K280 WeakPolarHBondContact OD1-CE 3.29Å; N277-K280 PolarHBondContact OD1-NZ 2.82Å
278	N	79.8	Confident	72.3	Confident	74 Å²	74	69.4 Å²	69.4	40%	0.396	38%	0.382	S	S	.	.	H	α-helix	trans	-76.8	-30.6	175.4	-53.1	-22	0	0	0	111.8	L260 V275 W276	L260-N278 HydrophobicContact CD2-CB 4.22Å; L260-N278 PolarHBondContact O-ND2 2.81Å; V275-N278 VanDerWaalsContact O-CB 3.3Å; V275-N278 WeakPolarHBondContact O-CB 3.39Å; V275-N278 PolarHBondContact O-N 2.7Å; W276-N278 PolarHBondContact O-N 2.85Å
279	I	78	Confident	70.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-92.7	-40	-171.1	-63.6	172.7	0	0	0	110.5	L225 L244 L260 F272 V275 W276 E281 K282 Y283	L225-I279 HydrophobicContact CD1-CG2 4.38Å; L244-I279 HydrophobicContact CD1-CG2 4.3Å; L244-I279 HydrophobicContact CD2-CG2 3.92Å; L260-I279 HydrophobicContact CB-CG1 4.34Å; F272-I279 HydrophobicContact CD2-CD1 4.33Å; F272-I279 HydrophobicContact CE2-CD1 3.58Å; F272-I279 HydrophobicContact CZ-CD1 4.01Å; V275-I279 HydrophobicContact CG2-CD1 4.27Å; V275-I279 PolarHBondContact O-N 2.97Å; W276-I279 PolarHBondContact O-N 3.06Å; W276-I279 VanDerWaalsContact O-N 3.11Å; I279-E281 VanDerWaalsContact C-N 3.34Å; I279-E281 PolarHBondContact O-N 3.32Å; I279-K282 PolarHBondContact O-N 3.03Å; I279-Y283 PolarHBondContact O-N 2.86Å
280	K	78.3	Confident	68	Low	43 Å²	43	72.9 Å²	72.9	19%	0.187	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-26	-167.1	78.5	-172.1	-164.4	-174.4	0	115.7	D214 R217 W276 N277 K282	D214-K280 WeakPolarHBondContact OD1-CD 3.48Å; D214-K280 IonicContact OD1-NZ 3.36Å; D214-K280 PolarHBondContact OD1-NZ 3Å; D214-K280 IonicContact OD2-NZ 3.19Å; D214-K280 PolarHBondContact OD2-NZ 2.88Å; R217-K280 PolarHBondContact NH2-O 2.73Å; W276-K280 HydrophobicContact CD2-CB 3.74Å; W276-K280 HydrophobicContact CD2-CD 4.2Å; W276-K280 VanDerWaalsContact CE2-CB 3.46Å; W276-K280 HydrophobicContact CE3-CB 3.95Å; W276-K280 HydrophobicContact CG-CB 4.45Å; W276-K280 HydrophobicContact CG-CD 4.18Å; W276-K280 HydrophobicContact CH2-CB 3.75Å; W276-K280 HydrophobicContact CZ2-CB 3.49Å; W276-K280 VanDerWaalsContact CZ2-CB 3.49Å; W276-K280 HydrophobicContact CZ2-CD 4.28Å; W276-K280 HydrophobicContact CZ3-CB 3.95Å; W276-K280 VanDerWaalsContact NE1-CD 3.29Å; W276-K280 VanDerWaalsContact O-CB 3.26Å; W276-K280 WeakPolarHBondContact O-CB 3.4Å; W276-K280 WeakPolarHBondContact O-CG 3.47Å; W276-K280 PolarHBondContact O-N 2.89Å; N277-K280 WeakPolarHBondContact OD1-CE 3.29Å; N277-K280 PolarHBondContact OD1-NZ 2.82Å; K280-K282 PolarHBondContact O-N 3.05Å
281	E	72.9	Confident	65.4	Low	169 Å²	169	74.7 Å²	74.7	79%	0.79	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-11	177.1	-64.5	-173	171.6	0	0	112.5	I279	I279-E281 VanDerWaalsContact C-N 3.34Å; I279-E281 PolarHBondContact O-N 3.32Å
282	K	71.3	Confident	63.1	Low	83 Å²	83	77.3 Å²	77.3	36%	0.361	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-31.1	-178.8	-58	-169	179.3	-175.3	0	113.3	L244 P246 I279 K280 V284	L244-K282 HydrophobicContact CD2-CB 4.07Å; P246-K282 VanDerWaalsContact CA-NZ 3.29Å; P246-K282 PolarHBondContact O-NZ 2.88Å; I279-K282 PolarHBondContact O-N 3.03Å; K280-K282 PolarHBondContact O-N 3.05Å; K282-V284 PolarHBondContact O-N 3.2Å
283	Y	69.4	Low	60.8	Low	13 Å²	13	82.8 Å²	82.8	5%	0.051	47%	0.47	C	S	.	.			trans	-66.9	121.2	178.2	-161	-95.1	0	0	0	112.3	V221 E224 L225 H241 L244 I279	V221-Y283 HydrophobicContact CB-CD1 4.14Å; V221-Y283 HydrophobicContact CB-CE1 4.18Å; V221-Y283 HydrophobicContact CG1-CD1 3.51Å; V221-Y283 HydrophobicContact CG1-CD2 3.98Å; V221-Y283 HydrophobicContact CG1-CE1 3.66Å; V221-Y283 HydrophobicContact CG1-CE2 4.11Å; V221-Y283 HydrophobicContact CG1-CG 3.66Å; V221-Y283 HydrophobicContact CG2-CD1 3.43Å; V221-Y283 VanDerWaalsContact CG2-CD1 3.43Å; V221-Y283 HydrophobicContact CG2-CE1 3.57Å; V221-Y283 HydrophobicContact CG2-CG 4.33Å; E224-Y283 WeakPolarHBondContact CB-OH 3.43Å; L225-Y283 HydrophobicContact CD2-CD2 4.47Å; L225-Y283 HydrophobicContact CD2-CE2 3.79Å; L225-Y283 HydrophobicContact CG-CE2 4.16Å; H241-Y283 AromaticContact ND1-CE2 3.99Å; L244-Y283 HydrophobicContact CD1-CD2 3.98Å; L244-Y283 HydrophobicContact CD2-CD2 3.9Å; L244-Y283 HydrophobicContact CD2-CG 4.42Å; L244-Y283 HydrophobicContact CG-CD2 3.98Å; I279-Y283 PolarHBondContact O-N 2.86Å
284	V	60.7	Low	58.4	Low	93 Å²	93	84.9 Å²	84.9	56%	0.564	49%	0.491	S	S	*	.			trans	-123	117.8	170.2	-178.5	0	0	0	0	107.2	K282	K282-V284 PolarHBondContact O-N 3.2Å
285	S	55.5	Low	56	Low	28 Å²	28	83.1 Å²	83.1	20%	0.196	49%	0.494	C	S	.	.			trans	-71.9	133.5	-178.9	59.6	0	0	0	0	111.2	E224 S287 T288	E224-S285 WeakPolarHBondContact OE2-CB 3.48Å; S285-S287 WeakPolarHBondContact CB-OG 3.44Å; S285-S287 PolarHBondContact O-N 2.88Å; S285-S287 PolarHBondContact OG-OG 2.71Å; S285-T288 PolarHBondContact O-N 3.48Å; S285-T288 PolarHBondContact O-OG1 3.26Å
286	E	50.5	Low	53.6	Low	170 Å²	170	91.8 Å²	91.8	79%	0.794	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-52.1	-28.6	178.5	-69.6	-164.1	124.3	0	0	112.7	T288 A289	E286-T288 PolarHBondContact O-N 2.88Å; E286-A289 WeakPolarHBondContact O-CB 3.49Å; E286-A289 PolarHBondContact O-N 2.99Å
287	S	43.7	Very low	50.7	Low	94 Å²	94	97.5 Å²	97.5	66%	0.657	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-60.1	-10.1	177.4	56.1	0	0	0	0	115.7	S285	S285-S287 WeakPolarHBondContact CB-OG 3.44Å; S285-S287 PolarHBondContact O-N 2.88Å; S285-S287 PolarHBondContact OG-OG 2.71Å
288	T	41.2	Very low	48.2	Very low	103 Å²	103	99.1 Å²	99.1	63%	0.632	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-106.9	-0.6	172.1	55.1	0	0	0	0	114.2	S285 E286 D290	S285-T288 PolarHBondContact O-N 3.48Å; S285-T288 PolarHBondContact O-OG1 3.26Å; E286-T288 PolarHBondContact O-N 2.88Å; T288-D290 PolarHBondContact O-N 3.4Å
289	A	34.5	Very low	45.7	Very low	82 Å²	82	105.2 Å²	105.2	68%	0.678	61%	0.61	S	S	*	*			trans	-91.1	28.6	-171.9	0	0	0	0	0	115.6	E286	E286-A289 WeakPolarHBondContact O-CB 3.49Å; E286-A289 PolarHBondContact O-N 2.99Å
290	D	35.8	Very low	43.3	Very low	135 Å²	135	111.9 Å²	111.9	72%	0.722	65%	0.645	S	S	*	*			trans	-132.6	65.6	-176	-158.8	10	0	0	0	114.6	T288 P292	T288-D290 PolarHBondContact O-N 3.4Å; D290-P292 WeakPolarHBondContact OD1-CD 3.36Å
291	V	28	Very low	41	Very low	140 Å²	140	118.4 Å²	118.4	85%	0.848	68%	0.676	S	S	*	*			trans	-130	90.6	152.5	-176.1	0	0	0	0	109.5
292	P	33	Very low	38.8	Very low	91 Å²	91	115.8 Å²	115.8	59%	0.591	67%	0.672	S	S	*	*			trans	-68.2	142.3	172.8	-19.1	32.6	0	0	0	111.3	D290	D290-P292 WeakPolarHBondContact OD1-CD 3.36Å
293	P	34.7	Very low	36.7	Very low	116 Å²	116	123.5 Å²	123.5	75%	0.753	70%	0.699	S	S	*	*			trans	-63.9	146	171.8	27.5	-34.3	0	0	0	110.7	G295	P293-G295 PolarHBondContact O-N 3.48Å
294	P	32.8	Very low	34.6	Very low	132 Å²	132	129.8 Å²	129.8	86%	0.857	73%	0.734	S	S	*	*			trans	-64.9	103	-179.9	-21.3	33.5	0	0	0	112	E296	P294-E296 PolarHBondContact O-N 3.45Å
295	G	29.8	Very low	33.7	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	74%	0.737	S	S	*	*			trans	-67.9	126.9	-179.2	0	0	0	0	0	113.2	P293	P293-G295 PolarHBondContact O-N 3.48Å
296	E	30.9	Very low	32.5	Very low	193 Å²	193	133.9 Å²	133.9	90%	0.902	76%	0.764	S	S	*	*			trans	-62.4	146	170.8	-64.2	-173.1	109.4	0	0	111.9	P294	P294-E296 PolarHBondContact O-N 3.45Å
297	T	25.6	Very low	31.4	Very low	128 Å²	128	130.1 Å²	130.1	79%	0.785	76%	0.756	S	S	*	*			trans	-136.9	101.8	161	25.6	0	0	0	0	112.8
298	T	25.7	Very low	30.7	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	76%	0.76	S	S	*	*			trans	59.6	115.8	145.2	61.1	0	0	0	0	119.8
299	Q	28.3	Very low	30.1	Very low	203 Å²	203	133.5 Å²	133.5	95%	0.949	76%	0.763	S	S	*	*				-145.6	148.4	109.8	-129.7	145.5	107.4	0	0	111.9
300	D	26.2	Very low	29.8	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	76%	0.763	S	S	*	*			trans	-117.8	129.8	-172.7	170	21	0	0	0	109.2
301	E	29.9	Very low	29.5	Very low	180 Å²	180	134.2 Å²	134.2	84%	0.841	76%	0.764	S	S	*	*			trans	-163.9	98.2	140.8	-115	-173.3	162.6	0	0	112
302	T	27.2	Very low	29.6	Very low	114 Å²	114	136.5 Å²	136.5	70%	0.699	77%	0.765	S	S	*	*			trans	25.5	126.1	145.4	62.9	0	0	0	0	120.9
303	R	27.3	Very low	29.3	Very low	246 Å²	246	139.6 Å²	139.6	93%	0.928	78%	0.777	S	S	*	*				-168.9	124.8	100.4	-130.1	176.1	171.9	150.3	-2.1	115.8
304	D	25.1	Very low	29.1	Very low	145 Å²	145	144 Å²	144	78%	0.775	78%	0.78	S	S	*	*			trans	-92.6	177.1	165.1	-147.1	27.1	0	0	0	109.3
305	P	43.2	Very low	29.9	Very low	99 Å²	99	142.5 Å²	142.5	64%	0.643	77%	0.77	S	S	*	*			cis	-135.2	174.7	-4.6	43.5	-27.7	0	0	0	115.7
306	S	29.6	Very low	29.9	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	77%	0.77	S	S	*	*				163	133.4	101.3	70.4	0	0	0	0	117.2
307	S	27.4	Very low	29.8	Very low	91 Å²	91	145 Å²	145	64%	0.636	77%	0.767	S	S	*	*			trans	79.9	104.2	138	-152.2	0	0	0	0	120.1
308	D	28.1	Very low	30	Very low	139 Å²	139	146.5 Å²	146.5	74%	0.743	77%	0.77	S	S	*	*				43.9	143.8	116	-22	-48.2	0	0	0	119.5
309	N	28.6	Very low	30.3	Very low	129 Å²	129	148.2 Å²	148.2	69%	0.69	77%	0.773	S	S	*	*			cis	-167.7	152.2	18.2	-154	36.1	0	0	0	113.7
310	D	27.9	Very low	30.9	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	75%	0.754	S	S	*	*			trans	54.5	129.2	144.2	-82	-25.6	0	0	0	125.7
311	S	29.8	Very low	31.1	Very low	106 Å²	106	144 Å²	144	74%	0.741	76%	0.756	S	S	*	*				82.7	100.2	128.8	-66.6	0	0	0	0	121.8
312	E	31.1	Very low	31.2	Very low	188 Å²	188	144.4 Å²	144.4	88%	0.879	76%	0.758	S	S	*	*			trans	-17.4	149.9	141.1	-54.1	172.3	177.4	0	0	118.8
313	N	26.3	Very low	31.3	Very low	156 Å²	156	145.8 Å²	145.8	83%	0.834	76%	0.762	S	S	*	*				-166.2	141.6	113	-154.7	53.2	0	0	0	113.3
314	Y	29.7	Very low	31.7	Very low	208 Å²	208	141.5 Å²	141.5	82%	0.816	76%	0.757	S	S	*	*			trans	-110.3	-175.1	165.2	-91	-93.8	0	0	0	109
315	P	49.6	Very low	32.1	Very low	101 Å²	101	141.4 Å²	141.4	66%	0.656	76%	0.757	S	S	*	*			cis	-97.2	-137	-14.8	2.3	23.6	0	0	0	111.6
316	D	29.6	Very low	31.6	Very low	139 Å²	139	145 Å²	145	74%	0.743	77%	0.765	S	S	*	*			cis	-144	149.6	8.2	-42.6	-83.1	0	0	0	108.1
317	E	30.8	Very low	31.8	Very low	180 Å²	180	146.6 Å²	146.6	84%	0.841	77%	0.765	S	S	*	*				57	121.3	68.2	-53.3	-163.9	167.4	0	0	114.2
318	D	28.5	Very low	32.1	Very low	159 Å²	159	150.2 Å²	150.2	85%	0.85	77%	0.774	S	S	*	*				-149.1	-177.8	59.9	-112.5	-41.5	0	0	0	115.9
319	I	32.1	Very low	32.3	Very low	158 Å²	158	150.6 Å²	150.6	81%	0.81	78%	0.776	S	S	*	*			trans	-135.2	164.2	-163.4	-84.9	165.7	0	0	0	110.2
320	P	40.1	Very low	32.6	Very low	85 Å²	85	153.8 Å²	153.8	55%	0.552	79%	0.786	S	S	*	*			cis	-135.8	-166.4	11.2	44.9	-27.6	0	0	0	117.6
321	E	31.8	Very low	32.9	Very low	167 Å²	167	155.5 Å²	155.5	78%	0.78	80%	0.796	S	S	*	*			trans	66.2	162.6	150.4	-71.1	141.3	-133.6	0	0	119.5
322	E	30.8	Very low	33.1	Very low	189 Å²	189	158.2 Å²	158.2	88%	0.883	80%	0.802	S	S	*	*			cis	-128.5	173.5	6.9	-63.1	171.9	109.6	0	0	111.6
323	D	30.8	Very low	33.2	Very low	144 Å²	144	157.6 Å²	157.6	77%	0.77	80%	0.799	S	S	*	*			trans	-123.1	-152.9	-154.2	-51	-100.5	0	0	0	118.6
324	D	33.8	Very low	33.4	Very low	156 Å²	156	155.3 Å²	155.3	83%	0.834	79%	0.787	S	S	*	*			trans	74.4	143.2	171.8	-68.2	4.6	0	0	0	120.8
325	D	34.6	Very low	33.7	Very low	143 Å²	143	154.4 Å²	154.4	77%	0.765	79%	0.792	S	S	*	*			cis	-169	-170.8	-20	-147.5	-8.2	0	0	0	113.1
326	E	32.2	Very low	33	Very low	174 Å²	174	156.1 Å²	156.1	81%	0.813	80%	0.796	S	S	*	*			trans	95.3	86.3	164.5	-62.9	-171.9	-167.7	0	0	121.5
327	D	33.3	Very low	33.1	Very low	141 Å²	141	154.3 Å²	154.3	75%	0.754	78%	0.783	S	S	*	*				59.5	112.9	126.2	-57.3	-11.9	0	0	0	124.7
328	M	33.8	Very low	33.3	Very low	166 Å²	166	148.8 Å²	148.8	82%	0.818	78%	0.775	S	S	*	*				-173.2	128.8	104.4	-108.1	-175.9	-64.1	0	0	114.3
329	D	33.1	Very low	33.3	Very low	147 Å²	147	146.8 Å²	146.8	79%	0.786	76%	0.764	S	S	*	*			trans	48.8	93.8	145.3	-50	-8.4	0	0	0	119.9
330	E	34.9	Very low	33.4	Very low	196 Å²	196	150.1 Å²	150.1	92%	0.916	77%	0.768	S	S	*	*			trans	-107.7	148.9	147.4	-69.8	-164.8	145.9	0	0	109.6
331	D	34.3	Very low	32.9	Very low	163 Å²	163	152.6 Å²	152.6	87%	0.872	77%	0.77	S	S	*	*			trans	-74.7	134.4	-168.4	-64.5	-78.2	0	0	0	114	E333	D331-E333 PolarHBondContact O-N 3.23Å
332	D	34	Very low	32.9	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	77%	0.765	S	S	*	*			trans	-67.3	92.4	171.6	-80.6	-49.2	0	0	0	112	D334	D332-D334 PolarHBondContact O-N 2.92Å
333	E	32.5	Very low	32.9	Very low	175 Å²	175	146.8 Å²	146.8	82%	0.818	76%	0.763	S	S	*	*			trans	-80.8	91.6	158.6	-72.7	-161	163.1	0	0	110.1	D331 M335	D331-E333 PolarHBondContact O-N 3.23Å; E333-M335 PolarHBondContact O-N 3.48Å
334	D	32	Very low	32.7	Very low	108 Å²	108	145 Å²	145	58%	0.578	76%	0.761	S	S	*	*			trans	-49	94.5	171.9	-91.7	-24.4	0	0	0	111.8	D332 D336 R389	D332-D334 PolarHBondContact O-N 2.92Å; D334-D336 VanDerWaalsContact C-N 3.29Å; D334-D336 PolarHBondContact O-N 2.83Å; D334-D336 VanDerWaalsContact O-N 3.11Å; D334-R389 IonicContact OD2-CZ 2.75Å; D334-R389 IonicContact OD2-NH1 2.79Å; D334-R389 PolarHBondContact OD2-NH1 3.02Å; D334-R389 IonicContact OD2-NH2 3.61Å; D334-R389 PolarHBondContact OD2-NH2 3.12Å
335	M	35.5	Very low	32.9	Very low	190 Å²	190	144 Å²	144	94%	0.936	76%	0.762	S	S	*	*			trans	-82.5	70.2	166.9	-79.1	-154	-176.6	0	0	111.5	E333	E333-M335 PolarHBondContact O-N 3.48Å
336	D	34.1	Very low	32.7	Very low	137 Å²	137	142.4 Å²	142.4	73%	0.733	76%	0.762	S	S	*	*			trans	-122.2	108.1	158.6	-169.9	33.1	0	0	0	110.3	D334	D334-D336 VanDerWaalsContact C-N 3.29Å; D334-D336 PolarHBondContact O-N 2.83Å; D334-D336 VanDerWaalsContact O-N 3.11Å
337	E	32.4	Very low	33.2	Very low	101 Å²	101	142.3 Å²	142.3	47%	0.472	76%	0.761	S	S	.	*				-171.7	145.2	101.4	-158.5	164.2	-144.2	0	0	108.6	D339 N382	E337-D339 VanDerWaalsContact C-N 3.34Å; E337-D339 PolarHBondContact O-N 2.98Å; E337-N382 VanDerWaalsContact CD-ND2 3.32Å; E337-N382 PolarHBondContact OE1-ND2 2.88Å; E337-N382 PolarHBondContact OE2-ND2 2.87Å
338	G	33.8	Very low	33	Very low	64 Å²	64	142 Å²	142	66%	0.66	77%	0.765	S	S	*	*			trans	-71.8	82.7	179.5	0	0	0	0	0	112.4	Y340	G338-Y340 VanDerWaalsContact C-N 3.31Å; G338-Y340 PolarHBondContact O-N 2.85Å
339	D	28.8	Very low	33.3	Very low	116 Å²	116	140.6 Å²	140.6	62%	0.62	76%	0.76	S	S	*	*			trans	-56.1	81.7	-176.4	177.4	31.2	0	0	0	113.3	E337 K341	E337-D339 VanDerWaalsContact C-N 3.34Å; E337-D339 PolarHBondContact O-N 2.98Å; D339-K341 PolarHBondContact O-N 3.38Å; D339-K341 IonicContact OD1-NZ 2.83Å; D339-K341 PolarHBondContact OD1-NZ 2.87Å; D339-K341 VanDerWaalsContact OD1-NZ 3.09Å; D339-K341 IonicContact OD2-NZ 3.94Å; D339-K341 PolarHBondContact OD2-NZ 2.85Å
340	Y	35.4	Very low	33.6	Very low	228 Å²	228	141.2 Å²	141.2	89%	0.894	76%	0.764	S	S	*	*			trans	-73.2	58	171.3	-108.7	-85.2	0	0	0	110.8	G338	G338-Y340 VanDerWaalsContact C-N 3.31Å; G338-Y340 PolarHBondContact O-N 2.85Å
341	K	29.5	Very low	33.7	Very low	137 Å²	137	140.2 Å²	140.2	60%	0.596	76%	0.756	S	S	*	*			trans	-55.6	121.9	178.2	-170.1	176.3	-97.3	60.1	0	109.5	D339	D339-K341 PolarHBondContact O-N 3.38Å; D339-K341 IonicContact OD1-NZ 2.83Å; D339-K341 PolarHBondContact OD1-NZ 2.87Å; D339-K341 VanDerWaalsContact OD1-NZ 3.09Å; D339-K341 IonicContact OD2-NZ 3.94Å; D339-K341 PolarHBondContact OD2-NZ 2.85Å
342	P	32.2	Very low	34.1	Very low	104 Å²	104	141.2 Å²	141.2	68%	0.675	75%	0.753	S	S	*	*			trans	-63.2	137	179.4	25.4	-33.7	0	0	0	109.7	S344	P342-S344 PolarHBondContact O-N 2.04Å
343	P	30.5	Very low	34.4	Very low	130 Å²	130	140.9 Å²	140.9	84%	0.844	75%	0.751	S	S	*	*			trans	-69.5	90.8	-174.3	26.9	-34.4	0	0	0	111.5	T345	P343-T345 PolarHBondContact O-N 2.87Å
344	S	26.8	Very low	34.8	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	75%	0.749	S	S	*	*			trans	-65.4	117.4	169.6	175.7	0	0	0	0	109.6	P342 S346	P342-S344 PolarHBondContact O-N 2.04Å; S344-S346 PolarHBondContact O-N 3.47Å; S344-S346 VanDerWaalsContact O-N 3.07Å
345	T	38.1	Very low	35.6	Very low	137 Å²	137	140.5 Å²	140.5	84%	0.84	76%	0.755	S	S	*	*			trans	-57.8	109.6	179.6	51.9	0	0	0	0	112.4	P343	P343-T345 PolarHBondContact O-N 2.87Å
346	S	30.3	Very low	36.6	Very low	109 Å²	109	139 Å²	139	76%	0.762	75%	0.746	S	S	*	*			trans	-148.2	137.8	164.5	-79.9	0	0	0	0	108.5	S344	S344-S346 PolarHBondContact O-N 3.47Å; S344-S346 VanDerWaalsContact O-N 3.07Å
347	Q	42.7	Very low	37.7	Very low	172 Å²	172	135.2 Å²	135.2	80%	0.804	72%	0.723	S	S	*	*			trans	-83	130.3	-170.3	-63.4	170.5	-96.9	0	0	112.3
348	T	27.4	Very low	39.1	Very low	135 Å²	135	132.6 Å²	132.6	83%	0.828	72%	0.724	S	S	*	*			trans	-136.2	95.1	154	50.6	0	0	0	0	107.6	D350	T348-D350 PolarHBondContact O-N 2.91Å; T348-D350 VanDerWaalsContact O-N 3.11Å
349	D	40.3	Very low	41.2	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	73%	0.729	S	S	*	*			trans	-70.9	96	175.5	-61.6	-89.2	0	0	0	109.9
350	D	39.6	Very low	43.5	Very low	161 Å²	161	133.7 Å²	133.7	86%	0.861	72%	0.717	S	S	*	*			trans	-163.4	55	163.8	-101.7	-29.5	0	0	0	111.7	T348	T348-D350 PolarHBondContact O-N 2.91Å; T348-D350 VanDerWaalsContact O-N 3.11Å
351	K	36.8	Very low	45.8	Very low	174 Å²	174	125 Å²	125	76%	0.757	69%	0.689	S	S	*	*			trans	-141.9	109.4	158	-83.2	-153.1	173	-163.7	0	111.9
352	K	44.1	Very low	48.6	Very low	184 Å²	184	124.2 Å²	124.2	80%	0.8	70%	0.698	S	S	*	*			trans	-136	142.3	149.5	-67	-174	178	-176.5	0	104.5
353	D	39.6	Very low	51.3	Low	156 Å²	156	122.7 Å²	122.7	83%	0.834	68%	0.679	S	S	*	*	S	Bend	cis	-133.1	96.4	20.5	-63	-81.3	0	0	0	111.3
354	D	41.8	Very low	54.1	Low	143 Å²	143	120 Å²	120	77%	0.765	66%	0.658	S	S	*	*			trans	-145.2	0.2	-179.7	-127.8	-14.2	0	0	0	113.5	E356	D354-E356 VanDerWaalsContact C-N 3.31Å; D354-E356 PolarHBondContact O-N 3.24Å
355	D	48.8	Very low	57.1	Low	132 Å²	132	121.9 Å²	121.9	71%	0.706	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-80.8	-0.3	-169.4	-87.5	-33.9	0	0	0	114.8	E357	D355-E357 PolarHBondContact O-N 3.29Å
356	E	55	Low	59.6	Low	159 Å²	159	122 Å²	122	74%	0.743	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-83.5	-6.2	-168	-130.8	-162.3	-130.6	0	0	115.3	K213 D354	K213-E356 PolarHBondContact NZ-O 2.79Å; K213-E356 IonicContact NZ-OE2 2.64Å; K213-E356 PolarHBondContact NZ-OE2 2.75Å; D354-E356 VanDerWaalsContact C-N 3.31Å; D354-E356 PolarHBondContact O-N 3.24Å
357	E	57.1	Low	62.6	Low	56 Å²	56	117.3 Å²	117.3	26%	0.262	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-97.3	-2	174.7	-142.9	-177.6	-139.5	0	0	113.5	K206 R210 D355	K206-E357 HydrophobicContact CD-CG 4.29Å; K206-E357 WeakPolarHBondContact CD-OE2 3.49Å; K206-E357 WeakPolarHBondContact CE-OE2 3.27Å; K206-E357 HydrophobicContact CG-CG 4.27Å; K206-E357 IonicContact NZ-OE2 2.68Å; K206-E357 PolarHBondContact NZ-OE2 3.03Å; R210-E357 WeakPolarHBondContact CD-OE1 3.28Å; R210-E357 VanDerWaalsContact CG-OE1 3.25Å; R210-E357 WeakPolarHBondContact CG-OE1 3.23Å; R210-E357 IonicContact CZ-OE1 2.79Å; R210-E357 IonicContact NE-OE1 3.92Å; R210-E357 PolarHBondContact NE-OE1 3.34Å; R210-E357 IonicContact NH1-OE1 2.66Å; R210-E357 PolarHBondContact NH1-OE1 3.1Å; R210-E357 IonicContact NH1-OE2 3.55Å; D355-E357 PolarHBondContact O-N 3.29Å
358	G	63.1	Low	64.9	Low	47 Å²	47	112.1 Å²	112.1	49%	0.485	59%	0.588	S	S	.	*			trans	81.2	155.4	172.2	0	0	0	0	0	116.1	W202	W202-G358 WeakPolarHBondContact CZ2-O 3.15Å
359	T	76.6	Confident	68.1	Low	126 Å²	126	109.1 Å²	109.1	77%	0.773	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.2	173.2	54.7	0	0	0	0	111.1
360	M	76.9	Confident	70.7	Confident	76 Å²	76	104.8 Å²	104.8	37%	0.374	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-52.3	131.6	175	-175.7	175.2	71.7	0	0	111.1	W202 Y363	W202-M360 HydrophobicContact CB-CG 4.28Å; W202-M360 HydrophobicContact CD2-CB 4.41Å; W202-M360 HydrophobicContact CD2-CG 4.23Å; W202-M360 HydrophobicContact CG-CB 4.32Å; W202-M360 HydrophobicContact CG-CG 3.77Å; W202-M360 HydrophobicContact CG-SD 4.45Å; M360-Y363 HydrophobicContact CE-CE1 4.44Å
361	P	84.7	Confident	73.2	Confident	46 Å²	46	98.3 Å²	98.3	30%	0.299	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-55.2	147.3	175.7	-27.3	34.9	0	0	0	112	H198 W202	H198-P361 PolarHBondContact NE2-O 3.02Å; W202-P361 HydrophobicContact CE3-CG 3.97Å; W202-P361 HydrophobicContact CZ3-CG 4.19Å
362	P	87.9	Confident	76	Confident	120 Å²	120	94 Å²	94	78%	0.779	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-59.7	149.7	172.9	27.6	-35.1	0	0	0	110.5	H198	H198-P362 PolarHBondContact CE1-O 2.94Å
363	Y	88.4	Confident	78.4	Confident	72 Å²	72	87.7 Å²	87.7	28%	0.282	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-57.3	147	172.9	-62.9	-64.5	0	0	0	111.1	K195 H198 M360 T367 I371	K195-Y363 HydrophobicContact CG-CE1 4.11Å; H198-Y363 HydrophobicContact CB-CD1 3.98Å; H198-Y363 HydrophobicContact CB-CE1 4.02Å; H198-Y363 AromaticContact CD2-CD1 3.43Å; H198-Y363 VanDerWaalsContact CD2-CD1 3.43Å; H198-Y363 WeakPolarHBondContact CD2-CD1 3.21Å; H198-Y363 AromaticContact CD2-CE1 3.45Å; H198-Y363 VanDerWaalsContact CD2-CE1 3.45Å; H198-Y363 WeakPolarHBondContact CD2-CE1 3.45Å; H198-Y363 AromaticContact CG-CD1 3.61Å; H198-Y363 AromaticContact CG-CE1 3.87Å; H198-Y363 AromaticContact NE2-CD1 3.88Å; M360-Y363 HydrophobicContact CE-CE1 4.44Å; Y363-T367 HydrophobicContact CD1-CG2 3.59Å; Y363-T367 HydrophobicContact CE1-CG2 4.37Å; Y363-T367 HydrophobicContact CG-CG2 3.89Å; Y363-I371 HydrophobicContact CD1-CD1 4.4Å; Y363-I371 HydrophobicContact CD2-CD1 3.46Å; Y363-I371 VanDerWaalsContact CD2-CD1 3.46Å; Y363-I371 HydrophobicContact CE2-CD1 3.66Å; Y363-I371 HydrophobicContact CG-CD1 3.87Å
364	D	89.9	Confident	81.1	Confident	74 Å²	74	80.2 Å²	80.2	40%	0.396	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-67.9	166.8	172	73.4	84.4	0	0	0	111.5	E366 T367 Q368	D364-E366 VanDerWaalsContact C-N 3.3Å; D364-E366 PolarHBondContact O-N 3.03Å; D364-E366 WeakPolarHBondContact OD1-CA 3.45Å; D364-E366 VanDerWaalsContact OD1-CB 3.25Å; D364-E366 WeakPolarHBondContact OD1-CB 3.34Å; D364-E366 PolarHBondContact OD1-N 3.38Å; D364-T367 PolarHBondContact O-N 3.48Å; D364-T367 PolarHBondContact OD1-N 3.42Å; D364-T367 WeakPolarHBondContact OD2-CB 3.42Å; D364-T367 PolarHBondContact OD2-OG1 2.92Å; D364-Q368 WeakPolarHBondContact O-CB 3.28Å; D364-Q368 PolarHBondContact O-N 2.8Å
365	Q	91.1	Very high	83.7	Confident	145 Å²	145	77 Å²	77	68%	0.678	42%	0.419	S	S	*	.	H	α-helix	trans	-65.2	-28.8	-174.2	-173.8	60.6	88.6	0	0	113.9	T369	Q365-T369 WeakPolarHBondContact O-CG2 3.43Å; Q365-T369 PolarHBondContact O-N 2.85Å; Q365-T369 PolarHBondContact O-OG1 3.29Å
366	E	90.6	Very high	86	Confident	141 Å²	141	76.1 Å²	76.1	66%	0.659	41%	0.409	S	S	*	.	H	α-helix	trans	-75.4	-49.2	177.1	-168.6	178	156.2	0	0	109.5	D364 Q368 T369 L370	D364-E366 VanDerWaalsContact C-N 3.3Å; D364-E366 PolarHBondContact O-N 3.03Å; D364-E366 WeakPolarHBondContact OD1-CA 3.45Å; D364-E366 VanDerWaalsContact OD1-CB 3.25Å; D364-E366 WeakPolarHBondContact OD1-CB 3.34Å; D364-E366 PolarHBondContact OD1-N 3.38Å; E366-Q368 VanDerWaalsContact C-N 3.32Å; E366-Q368 PolarHBondContact O-N 3.08Å; E366-T369 PolarHBondContact O-N 2.94Å; E366-T369 VanDerWaalsContact O-N 3.11Å; E366-T369 PolarHBondContact O-OG1 2.83Å; E366-L370 PolarHBondContact O-N 2.81Å; E366-L370 VanDerWaalsContact O-N 3.08Å
367	T	91.4	Very high	87.9	Confident	9 Å²	9	68.8 Å²	68.8	6%	0.055	38%	0.376	C	S	.	.	H	α-helix	trans	-57	-43	173.2	-62.2	0	0	0	0	111.8	A194 Y363 D364 T369 L370 I371	A194-T367 HydrophobicContact CB-CG2 3.79Å; Y363-T367 HydrophobicContact CD1-CG2 3.59Å; Y363-T367 HydrophobicContact CE1-CG2 4.37Å; Y363-T367 HydrophobicContact CG-CG2 3.89Å; D364-T367 PolarHBondContact O-N 3.48Å; D364-T367 PolarHBondContact OD1-N 3.42Å; D364-T367 WeakPolarHBondContact OD2-CB 3.42Å; D364-T367 PolarHBondContact OD2-OG1 2.92Å; T367-T369 PolarHBondContact O-N 2.88Å; T367-L370 WeakPolarHBondContact O-CB 3.34Å; T367-L370 PolarHBondContact O-N 2.88Å; T367-L370 VanDerWaalsContact O-N 3.15Å; T367-I371 HydrophobicContact CG2-CD1 4.07Å; T367-I371 WeakPolarHBondContact O-CG1 3.4Å; T367-I371 PolarHBondContact O-N 2.72Å
368	Q	92.6	Very high	89.8	Confident	64 Å²	64	68 Å²	68	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-41.3	176	-170.8	61.7	51.6	0	0	111.9	D364 E366 L370 I371 D372	D364-Q368 WeakPolarHBondContact O-CB 3.28Å; D364-Q368 PolarHBondContact O-N 2.8Å; E366-Q368 VanDerWaalsContact C-N 3.32Å; E366-Q368 PolarHBondContact O-N 3.08Å; Q368-L370 PolarHBondContact O-N 3.43Å; Q368-I371 WeakPolarHBondContact O-CB 3.2Å; Q368-I371 PolarHBondContact O-N 3.32Å; Q368-I371 VanDerWaalsContact O-N 3.15Å; Q368-D372 PolarHBondContact NE2-OD1 3.42Å; Q368-D372 PolarHBondContact O-N 2.85Å
369	T	94.3	Very high	91.5	Very high	72 Å²	72	69.9 Å²	69.9	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-25.7	175.6	51.7	0	0	0	0	113.8	Q365 E366 T367 A373	Q365-T369 WeakPolarHBondContact O-CG2 3.43Å; Q365-T369 PolarHBondContact O-N 2.85Å; Q365-T369 PolarHBondContact O-OG1 3.29Å; E366-T369 PolarHBondContact O-N 2.94Å; E366-T369 VanDerWaalsContact O-N 3.11Å; E366-T369 PolarHBondContact O-OG1 2.83Å; T367-T369 PolarHBondContact O-N 2.88Å; T369-A373 VanDerWaalsContact O-CB 3.23Å; T369-A373 WeakPolarHBondContact O-CB 3.24Å; T369-A373 PolarHBondContact O-N 3.36Å; T369-A373 VanDerWaalsContact O-N 3.11Å
370	L	94.2	Very high	92.4	Very high	44 Å²	44	67.3 Å²	67.3	23%	0.23	35%	0.348	C	S	.	.	H	α-helix	trans	-73.8	-39.2	171.6	-65.2	171.6	0	0	0	111.5	P190 A194 E366 T367 Q368 A373 A374	P190-L370 HydrophobicContact CB-CD1 4.4Å; P190-L370 HydrophobicContact CB-CD2 4.13Å; P190-L370 HydrophobicContact CG-CD2 4.34Å; A194-L370 HydrophobicContact CB-CD1 3.84Å; E366-L370 PolarHBondContact O-N 2.81Å; E366-L370 VanDerWaalsContact O-N 3.08Å; T367-L370 WeakPolarHBondContact O-CB 3.34Å; T367-L370 PolarHBondContact O-N 2.88Å; T367-L370 VanDerWaalsContact O-N 3.15Å; Q368-L370 PolarHBondContact O-N 3.43Å; L370-A373 PolarHBondContact O-N 2.86Å; L370-A374 VanDerWaalsContact O-CB 3.31Å; L370-A374 WeakPolarHBondContact O-CB 3.34Å; L370-A374 PolarHBondContact O-N 2.89Å
371	I	93	Very high	93.4	Very high	24 Å²	24	64.8 Å²	64.8	12%	0.123	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-48.9	173.1	-65.6	168.1	0	0	0	110.7	E191 K195 Y363 T367 Q368 A373 A374 Q375	E191-I371 HydrophobicContact CG-CB 4.49Å; E191-I371 HydrophobicContact CG-CG1 3.84Å; K195-I371 HydrophobicContact CG-CD1 4.37Å; Y363-I371 HydrophobicContact CD1-CD1 4.4Å; Y363-I371 HydrophobicContact CD2-CD1 3.46Å; Y363-I371 VanDerWaalsContact CD2-CD1 3.46Å; Y363-I371 HydrophobicContact CE2-CD1 3.66Å; Y363-I371 HydrophobicContact CG-CD1 3.87Å; T367-I371 HydrophobicContact CG2-CD1 4.07Å; T367-I371 WeakPolarHBondContact O-CG1 3.4Å; T367-I371 PolarHBondContact O-N 2.72Å; Q368-I371 WeakPolarHBondContact O-CB 3.2Å; Q368-I371 PolarHBondContact O-N 3.32Å; Q368-I371 VanDerWaalsContact O-N 3.15Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 2.79Å; I371-A374 PolarHBondContact O-N 3.16Å; I371-Q375 WeakPolarHBondContact O-CB 3.36Å; I371-Q375 PolarHBondContact O-N 3.32Å
372	D	94.9	Very high	94	Very high	85 Å²	85	65 Å²	65	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-37.8	179.1	-61	-16.4	0	0	0	111.6	Q368 K376	Q368-D372 PolarHBondContact NE2-OD1 3.42Å; Q368-D372 PolarHBondContact O-N 2.85Å; D372-K376 WeakPolarHBondContact O-CB 3.23Å; D372-K376 PolarHBondContact O-N 2.85Å
373	A	94.9	Very high	94.4	Very high	50 Å²	50	65.6 Å²	65.6	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-71.5	-42.4	177.3	0	0	0	0	0	112.8	T369 L370 I371 A377	T369-A373 VanDerWaalsContact O-CB 3.23Å; T369-A373 WeakPolarHBondContact O-CB 3.24Å; T369-A373 PolarHBondContact O-N 3.36Å; T369-A373 VanDerWaalsContact O-N 3.11Å; L370-A373 PolarHBondContact O-N 2.86Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 2.79Å; A373-A377 PolarHBondContact O-N 2.93Å; A373-A377 VanDerWaalsContact O-N 3.08Å
374	A	95.7	Very high	94.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-43	176.1	0	0	0	0	0	111.5	A187 E188 E191 L370 I371 K376 A377 R378	A187-A374 HydrophobicContact CB-CB 4.35Å; E188-A374 HydrophobicContact CG-CB 4.42Å; E191-A374 HydrophobicContact CB-CB 3.81Å; E191-A374 HydrophobicContact CG-CB 4.04Å; E191-A374 VanDerWaalsContact OE2-CB 3.28Å; E191-A374 WeakPolarHBondContact OE2-CB 3.34Å; L370-A374 VanDerWaalsContact O-CB 3.31Å; L370-A374 WeakPolarHBondContact O-CB 3.34Å; L370-A374 PolarHBondContact O-N 2.89Å; I371-A374 PolarHBondContact O-N 3.16Å; A374-K376 PolarHBondContact O-N 3.32Å; A374-A377 WeakPolarHBondContact O-CB 3.21Å; A374-A377 PolarHBondContact O-N 3.25Å; A374-A377 VanDerWaalsContact O-N 3.12Å; A374-R378 WeakPolarHBondContact O-CG 3.38Å; A374-R378 PolarHBondContact O-N 3.44Å
375	Q	95.9	Very high	95.2	Very high	76 Å²	76	61.4 Å²	61.4	36%	0.355	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-45.6	175.9	-169.7	58.2	41.8	0	0	111.3	I371 A377 R378 D379	I371-Q375 WeakPolarHBondContact O-CB 3.36Å; I371-Q375 PolarHBondContact O-N 3.32Å; Q375-A377 PolarHBondContact O-N 3.44Å; Q375-R378 WeakPolarHBondContact O-CA 3.39Å; Q375-R378 WeakPolarHBondContact O-CB 3.35Å; Q375-R378 PolarHBondContact O-N 2.9Å; Q375-D379 PolarHBondContact NE2-OD1 3.31Å; Q375-D379 PolarHBondContact O-N 3.01Å
376	K	96.8	Very high	95.5	Very high	112 Å²	112	60.7 Å²	60.7	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-35.6	174.2	-177.8	-179.9	174.9	-65.5	0	112.7	D372 A374 E380	D372-K376 WeakPolarHBondContact O-CB 3.23Å; D372-K376 PolarHBondContact O-N 2.85Å; A374-K376 PolarHBondContact O-N 3.32Å; K376-E380 WeakPolarHBondContact CE-OE1 3.32Å; K376-E380 IonicContact NZ-OE1 3.49Å; K376-E380 PolarHBondContact NZ-OE1 2.91Å; K376-E380 IonicContact NZ-OE2 2.63Å; K376-E380 PolarHBondContact NZ-OE2 2.88Å; K376-E380 WeakPolarHBondContact O-CB 3.36Å; K376-E380 WeakPolarHBondContact O-CG 3.46Å; K376-E380 PolarHBondContact O-N 3.47Å
377	A	96.4	Very high	95.7	Very high	6 Å²	6	55.5 Å²	55.5	5%	0.05	28%	0.283	C	S	.	.	H	α-helix	trans	-72.7	-33.1	176.1	0	0	0	0	0	112.9	V183 A187 A373 A374 Q375 F381	V183-A377 HydrophobicContact CG1-CB 4.21Å; A187-A377 HydrophobicContact CB-CB 3.98Å; A373-A377 PolarHBondContact O-N 2.93Å; A373-A377 VanDerWaalsContact O-N 3.08Å; A374-A377 WeakPolarHBondContact O-CB 3.21Å; A374-A377 PolarHBondContact O-N 3.25Å; A374-A377 VanDerWaalsContact O-N 3.12Å; Q375-A377 PolarHBondContact O-N 3.44Å; A377-F381 VanDerWaalsContact O-CB 3.27Å; A377-F381 WeakPolarHBondContact O-CB 3.43Å; A377-F381 PolarHBondContact O-N 3.39Å; A377-F381 VanDerWaalsContact O-N 3.14Å
378	R	97.1	Very high	96	Very high	40 Å²	40	56.1 Å²	56.1	15%	0.151	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-54.1	167.5	-66.2	174.4	-179	116.9	12.1	110.5	K184 E188 E191 A374 Q375 E380 F381 N382	K184-R378 HydrophobicContact CD-CG 4.34Å; K184-R378 HydrophobicContact CG-CG 4.48Å; E188-R378 IonicContact OE1-CZ 2.68Å; E188-R378 IonicContact OE1-NE 2.65Å; E188-R378 PolarHBondContact OE1-NE 2.86Å; E188-R378 IonicContact OE1-NH2 2.68Å; E188-R378 PolarHBondContact OE1-NH2 2.87Å; E191-R378 IonicContact OE1-NH1 2.72Å; E191-R378 PolarHBondContact OE1-NH1 3.32Å; E191-R378 IonicContact OE1-NH2 3.42Å; E191-R378 IonicContact OE2-CZ 2.71Å; E191-R378 IonicContact OE2-NH1 3.82Å; E191-R378 PolarHBondContact OE2-NH1 2.85Å; E191-R378 IonicContact OE2-NH2 3.97Å; E191-R378 PolarHBondContact OE2-NH2 2.81Å; A374-R378 WeakPolarHBondContact O-CG 3.38Å; A374-R378 PolarHBondContact O-N 3.44Å; Q375-R378 WeakPolarHBondContact O-CA 3.39Å; Q375-R378 WeakPolarHBondContact O-CB 3.35Å; Q375-R378 PolarHBondContact O-N 2.9Å; R378-E380 VanDerWaalsContact C-N 3.35Å; R378-E380 PolarHBondContact O-N 2.86Å; R378-F381 PolarHBondContact O-N 2.83Å; R378-F381 VanDerWaalsContact O-N 3.1Å; R378-N382 WeakPolarHBondContact O-CB 2.83Å; R378-N382 VanDerWaalsContact O-CG 3.24Å; R378-N382 PolarHBondContact O-N 2.95Å; R378-N382 PolarHBondContact O-OD1 2.8Å; R378-N382 VanDerWaalsContact O-OD1 3.08Å
379	D	97.4	Very high	96.2	Very high	86 Å²	86	58.7 Å²	58.7	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-56.1	-47.1	-177.5	-57.7	-18.5	0	0	0	111.5	Q375 E383	Q375-D379 PolarHBondContact NE2-OD1 3.31Å; Q375-D379 PolarHBondContact O-N 3.01Å; D379-E383 WeakPolarHBondContact O-CB 3.45Å; D379-E383 PolarHBondContact O-N 2.83Å
380	E	96.6	Very high	96.3	Very high	71 Å²	71	60.1 Å²	60.1	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-33.5	178.5	-74.2	179	159.3	0	0	113	L180 K376 R378 A384	L180-E380 WeakPolarHBondContact CD1-O 3.49Å; L180-E380 HydrophobicContact CD2-CB 4.15Å; K376-E380 WeakPolarHBondContact CE-OE1 3.32Å; K376-E380 IonicContact NZ-OE1 3.49Å; K376-E380 PolarHBondContact NZ-OE1 2.91Å; K376-E380 IonicContact NZ-OE2 2.63Å; K376-E380 PolarHBondContact NZ-OE2 2.88Å; K376-E380 WeakPolarHBondContact O-CB 3.36Å; K376-E380 WeakPolarHBondContact O-CG 3.46Å; K376-E380 PolarHBondContact O-N 3.47Å; R378-E380 VanDerWaalsContact C-N 3.35Å; R378-E380 PolarHBondContact O-N 2.86Å; E380-A384 WeakPolarHBondContact O-CB 3.42Å; E380-A384 PolarHBondContact O-N 3.12Å
381	F	97.9	Very high	96.5	Very high	24 Å²	24	58.8 Å²	58.8	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-51.1	173.8	175.1	-93.5	0	0	0	111.5	V177 L180 R181 K184 A377 R378 E383 A384 E385	V177-F381 HydrophobicContact CG1-CD2 4.49Å; V177-F381 HydrophobicContact CG1-CE2 3.73Å; V177-F381 HydrophobicContact CG1-CZ 4.27Å; L180-F381 HydrophobicContact CB-CB 4.34Å; L180-F381 HydrophobicContact CB-CD2 4.13Å; R181-F381 HydrophobicContact CB-CD2 4.22Å; R181-F381 HydrophobicContact CB-CE2 3.82Å; R181-F381 HydrophobicContact CG-CE2 4.36Å; K184-F381 HydrophobicContact CD-CB 4.15Å; K184-F381 HydrophobicContact CD-CD1 3.88Å; K184-F381 HydrophobicContact CD-CG 4.01Å; A377-F381 VanDerWaalsContact O-CB 3.27Å; A377-F381 WeakPolarHBondContact O-CB 3.43Å; A377-F381 PolarHBondContact O-N 3.39Å; A377-F381 VanDerWaalsContact O-N 3.14Å; R378-F381 PolarHBondContact O-N 2.83Å; R378-F381 VanDerWaalsContact O-N 3.1Å; F381-E383 VanDerWaalsContact C-N 3.29Å; F381-E383 PolarHBondContact O-N 2.92Å; F381-A384 WeakPolarHBondContact O-CA 3.46Å; F381-A384 WeakPolarHBondContact O-CB 3.03Å; F381-A384 PolarHBondContact O-N 2.87Å; F381-E385 WeakPolarHBondContact CE1-OE2 3.46Å; F381-E385 PolarHBondContact O-N 3.16Å
382	N	96.8	Very high	96.6	Very high	49 Å²	49	60.7 Å²	60.7	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-36.8	-179.2	-62.7	13.5	0	0	0	110.6	E337 R378 K386	E337-N382 VanDerWaalsContact CD-ND2 3.32Å; E337-N382 PolarHBondContact OE1-ND2 2.88Å; E337-N382 PolarHBondContact OE2-ND2 2.87Å; R378-N382 WeakPolarHBondContact O-CB 2.83Å; R378-N382 VanDerWaalsContact O-CG 3.24Å; R378-N382 PolarHBondContact O-N 2.95Å; R378-N382 PolarHBondContact O-OD1 2.8Å; R378-N382 VanDerWaalsContact O-OD1 3.08Å; N382-K386 WeakPolarHBondContact O-CB 3.37Å; N382-K386 PolarHBondContact O-N 2.81Å
383	E	97.1	Very high	96.7	Very high	134 Å²	134	59.9 Å²	59.9	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-62.8	-43.6	170.8	-172.9	-169.6	-168.2	0	0	112.1	D379 F381 A387	D379-E383 WeakPolarHBondContact O-CB 3.45Å; D379-E383 PolarHBondContact O-N 2.83Å; F381-E383 VanDerWaalsContact C-N 3.29Å; F381-E383 PolarHBondContact O-N 2.92Å; E383-A387 WeakPolarHBondContact O-CB 3.41Å; E383-A387 PolarHBondContact O-N 3.11Å
384	A	96.9	Very high	96.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-39.4	-179.6	0	0	0	0	0	112.8	K176 V177 L180 E380 F381 A387 L388	K176-A384 HydrophobicContact CD-CB 4.06Å; V177-A384 HydrophobicContact CG2-CB 3.85Å; V177-A384 WeakPolarHBondContact CG2-O 3.44Å; L180-A384 HydrophobicContact CD1-CB 3.52Å; E380-A384 WeakPolarHBondContact O-CB 3.42Å; E380-A384 PolarHBondContact O-N 3.12Å; F381-A384 WeakPolarHBondContact O-CA 3.46Å; F381-A384 WeakPolarHBondContact O-CB 3.03Å; F381-A384 PolarHBondContact O-N 2.87Å; A384-A387 PolarHBondContact O-N 2.92Å; A384-L388 PolarHBondContact O-N 2.91Å
385	E	96.6	Very high	96.8	Very high	57 Å²	57	63 Å²	63	27%	0.266	30%	0.298	S	S	.	.	H	α-helix	trans	-66.6	-44.8	176.2	-165.4	-165.4	136.5	0	0	110.9	F381 A387 L388 R389	F381-E385 WeakPolarHBondContact CE1-OE2 3.46Å; F381-E385 PolarHBondContact O-N 3.16Å; E385-A387 VanDerWaalsContact C-N 3.31Å; E385-A387 PolarHBondContact O-N 3.41Å; E385-L388 WeakPolarHBondContact O-CA 3.13Å; E385-L388 WeakPolarHBondContact O-CB 3.24Å; E385-L388 PolarHBondContact O-N 3.43Å; E385-R389 PolarHBondContact O-N 3.07Å; E385-R389 IonicContact OE1-CZ 3.56Å; E385-R389 VanDerWaalsContact OE1-CZ 3.23Å; E385-R389 IonicContact OE1-NE 2.7Å; E385-R389 PolarHBondContact OE1-NE 2.68Å; E385-R389 IonicContact OE1-NH2 3.84Å; E385-R389 PolarHBondContact OE1-NH2 3.03Å
386	K	97.4	Very high	96.8	Very high	130 Å²	130	67 Å²	67	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-57.2	-44.6	173.7	179.4	175.4	173.1	176.2	0	112	N382 L388 R389 E390	N382-K386 WeakPolarHBondContact O-CB 3.37Å; N382-K386 PolarHBondContact O-N 2.81Å; K386-L388 VanDerWaalsContact C-N 3.26Å; K386-L388 PolarHBondContact O-N 2.85Å; K386-R389 PolarHBondContact O-N 2.92Å; K386-E390 WeakPolarHBondContact CE-OE1 3.43Å; K386-E390 IonicContact NZ-OE1 3.21Å; K386-E390 WeakPolarHBondContact O-CG 3.28Å; K386-E390 PolarHBondContact O-N 2.81Å
387	A	96.6	Very high	96.6	Very high	33 Å²	33	66.6 Å²	66.6	27%	0.273	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-31.3	176.1	0	0	0	0	0	112.8	L173 E383 A384 E385 V391	L173-A387 HydrophobicContact CD2-CB 4.33Å; E383-A387 WeakPolarHBondContact O-CB 3.41Å; E383-A387 PolarHBondContact O-N 3.11Å; A384-A387 PolarHBondContact O-N 2.92Å; E385-A387 VanDerWaalsContact C-N 3.31Å; E385-A387 PolarHBondContact O-N 3.41Å; A387-V391 WeakPolarHBondContact O-CB 3.39Å; A387-V391 WeakPolarHBondContact O-CG2 3.39Å; A387-V391 PolarHBondContact O-N 3.25Å
388	L	97.3	Very high	96.5	Very high	21 Å²	21	67.8 Å²	67.8	11%	0.11	32%	0.319	C	S	.	.	H	α-helix	trans	-69.2	-49.7	171.9	179	59.9	0	0	0	111.2	K170 L173 E174 V177 A384 E385 K386 E390 V391 E392	K170-L388 HydrophobicContact CG-CD1 3.96Å; L173-L388 HydrophobicContact CB-CB 4.48Å; L173-L388 HydrophobicContact CB-CD1 4.14Å; E174-L388 HydrophobicContact CG-CD1 3.95Å; E174-L388 HydrophobicContact CG-CD2 4.16Å; V177-L388 HydrophobicContact CG2-CB 4.31Å; V177-L388 HydrophobicContact CG2-CD2 4.17Å; A384-L388 PolarHBondContact O-N 2.91Å; E385-L388 WeakPolarHBondContact O-CA 3.13Å; E385-L388 WeakPolarHBondContact O-CB 3.24Å; E385-L388 PolarHBondContact O-N 3.43Å; K386-L388 VanDerWaalsContact C-N 3.26Å; K386-L388 PolarHBondContact O-N 2.85Å; L388-E390 VanDerWaalsContact C-N 3.32Å; L388-E390 PolarHBondContact O-N 2.66Å; L388-V391 PolarHBondContact O-N 2.6Å; L388-E392 HydrophobicContact CD1-CG 4.32Å; L388-E392 WeakPolarHBondContact O-CG 3.39Å; L388-E392 PolarHBondContact O-N 2.79Å
389	R	96.8	Very high	96.3	Very high	119 Å²	119	69.9 Å²	69.9	45%	0.449	33%	0.331	S	S	.	.	H	α-helix	trans	-54.9	-45.5	175.8	-65.1	-176.1	-174.3	-146.8	7.4	111.3	D334 E385 K386 V391 E392 D393	D334-R389 IonicContact OD2-CZ 2.75Å; D334-R389 IonicContact OD2-NH1 2.79Å; D334-R389 PolarHBondContact OD2-NH1 3.02Å; D334-R389 IonicContact OD2-NH2 3.61Å; D334-R389 PolarHBondContact OD2-NH2 3.12Å; E385-R389 PolarHBondContact O-N 3.07Å; E385-R389 IonicContact OE1-CZ 3.56Å; E385-R389 VanDerWaalsContact OE1-CZ 3.23Å; E385-R389 IonicContact OE1-NE 2.7Å; E385-R389 PolarHBondContact OE1-NE 2.68Å; E385-R389 IonicContact OE1-NH2 3.84Å; E385-R389 PolarHBondContact OE1-NH2 3.03Å; K386-R389 PolarHBondContact O-N 2.92Å; R389-V391 VanDerWaalsContact C-N 3.31Å; R389-V391 PolarHBondContact O-N 2.82Å; R389-E392 PolarHBondContact O-N 2.9Å; R389-D393 PolarHBondContact O-N 2.77Å
390	E	96.6	Very high	96	Very high	101 Å²	101	71.7 Å²	71.7	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-31.9	175.7	-74.8	-178.3	-165.8	0	0	113.9	K386 L388 Q394	K386-E390 WeakPolarHBondContact CE-OE1 3.43Å; K386-E390 IonicContact NZ-OE1 3.21Å; K386-E390 WeakPolarHBondContact O-CG 3.28Å; K386-E390 PolarHBondContact O-N 2.81Å; L388-E390 VanDerWaalsContact C-N 3.32Å; L388-E390 PolarHBondContact O-N 2.66Å; E390-Q394 WeakPolarHBondContact O-CG 3.28Å; E390-Q394 PolarHBondContact O-N 3.27Å; E390-Q394 PolarHBondContact O-NE2 2.85Å
391	V	97.4	Very high	95.6	Very high	16 Å²	16	69.8 Å²	69.8	10%	0.097	33%	0.325	C	S	.	.	H	α-helix	trans	-79	-36.3	176.2	157.6	0	0	0	0	111.7	V166 K170 L173 A387 L388 R389 Q394 I395	V166-V391 HydrophobicContact CG1-CG1 3.86Å; K170-V391 HydrophobicContact CB-CG1 3.82Å; L173-V391 HydrophobicContact CD1-CB 4.15Å; L173-V391 HydrophobicContact CD1-CG1 4.47Å; L173-V391 HydrophobicContact CD1-CG2 3.73Å; A387-V391 WeakPolarHBondContact O-CB 3.39Å; A387-V391 WeakPolarHBondContact O-CG2 3.39Å; A387-V391 PolarHBondContact O-N 3.25Å; L388-V391 PolarHBondContact O-N 2.6Å; R389-V391 VanDerWaalsContact C-N 3.31Å; R389-V391 PolarHBondContact O-N 2.82Å; V391-Q394 PolarHBondContact O-N 2.9Å; V391-I395 HydrophobicContact CG1-CD1 4.34Å; V391-I395 WeakPolarHBondContact O-CG1 3.25Å; V391-I395 PolarHBondContact O-N 3.01Å
392	E	96.2	Very high	95.3	Very high	65 Å²	65	71 Å²	71	30%	0.304	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-40.1	172.6	-69.7	-169.3	126.2	0	0	111.8	K170 L388 R389 Q394 I395 R396	K170-E392 HydrophobicContact CD-CG 4.11Å; K170-E392 IonicContact NZ-OE1 3.19Å; K170-E392 PolarHBondContact NZ-OE1 2.9Å; L388-E392 HydrophobicContact CD1-CG 4.32Å; L388-E392 WeakPolarHBondContact O-CG 3.39Å; L388-E392 PolarHBondContact O-N 2.79Å; R389-E392 PolarHBondContact O-N 2.9Å; E392-Q394 VanDerWaalsContact C-N 3.32Å; E392-Q394 PolarHBondContact O-N 3.2Å; E392-I395 WeakPolarHBondContact O-CB 3.46Å; E392-I395 PolarHBondContact O-N 2.86Å; E392-I395 VanDerWaalsContact O-N 3.16Å; E392-R396 WeakPolarHBondContact O-CG 3.37Å; E392-R396 PolarHBondContact O-N 2.8Å
393	D	96.5	Very high	95	Very high	68 Å²	68	73 Å²	73	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-35.6	173.2	-80.3	-24.7	0	0	0	113.1	R389 I395 R396 N397	R389-D393 PolarHBondContact O-N 2.77Å; D393-I395 VanDerWaalsContact C-N 3.34Å; D393-R396 PolarHBondContact O-N 2.96Å; D393-R396 IonicContact OD1-CZ 3.55Å; D393-R396 VanDerWaalsContact OD1-CZ 3.28Å; D393-R396 IonicContact OD1-NE 2.71Å; D393-R396 PolarHBondContact OD1-NE 3.4Å; D393-R396 VanDerWaalsContact OD1-NE 3.09Å; D393-R396 IonicContact OD1-NH2 3.63Å; D393-R396 PolarHBondContact OD1-NH2 2.93Å; D393-N397 WeakPolarHBondContact O-CB 3.43Å; D393-N397 PolarHBondContact O-N 3.17Å; D393-N397 PolarHBondContact O-ND2 2.86Å
394	Q	96	Very high	94.7	Very high	98 Å²	98	68.7 Å²	68.7	46%	0.458	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-39.5	172.5	-73.2	168.9	59.5	0	0	111.7	V166 E390 V391 E392 L398	V166-Q394 HydrophobicContact CG1-CB 4.26Å; E390-Q394 WeakPolarHBondContact O-CG 3.28Å; E390-Q394 PolarHBondContact O-N 3.27Å; E390-Q394 PolarHBondContact O-NE2 2.85Å; V391-Q394 PolarHBondContact O-N 2.9Å; E392-Q394 VanDerWaalsContact C-N 3.32Å; E392-Q394 PolarHBondContact O-N 3.2Å; Q394-L398 WeakPolarHBondContact O-CB 3.4Å; Q394-L398 VanDerWaalsContact O-CG 3.28Å; Q394-L398 WeakPolarHBondContact O-CG 3.47Å; Q394-L398 PolarHBondContact O-N 3.4Å
395	I	96.4	Very high	94.4	Very high	16 Å²	16	72.1 Å²	72.1	8%	0.082	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-53.3	173.3	-68.8	167.9	0	0	0	110.4	L163 V166 Q167 K170 V391 E392 D393 N397 L398 E399	L163-I395 HydrophobicContact CD1-CB 4.42Å; L163-I395 HydrophobicContact CD1-CG1 4.31Å; L163-I395 HydrophobicContact CD1-CG2 4.06Å; V166-I395 HydrophobicContact CB-CG1 4.48Å; V166-I395 HydrophobicContact CG1-CD1 4.19Å; V166-I395 HydrophobicContact CG1-CG1 3.68Å; Q167-I395 HydrophobicContact CG-CD1 4Å; Q167-I395 HydrophobicContact CG-CG1 4.29Å; K170-I395 HydrophobicContact CB-CD1 3.94Å; K170-I395 HydrophobicContact CD-CD1 3.81Å; K170-I395 HydrophobicContact CG-CD1 4.44Å; V391-I395 HydrophobicContact CG1-CD1 4.34Å; V391-I395 WeakPolarHBondContact O-CG1 3.25Å; V391-I395 PolarHBondContact O-N 3.01Å; E392-I395 WeakPolarHBondContact O-CB 3.46Å; E392-I395 PolarHBondContact O-N 2.86Å; E392-I395 VanDerWaalsContact O-N 3.16Å; D393-I395 VanDerWaalsContact C-N 3.34Å; I395-N397 VanDerWaalsContact C-N 3.28Å; I395-N397 PolarHBondContact O-N 2.93Å; I395-L398 PolarHBondContact O-N 3.37Å; I395-L398 VanDerWaalsContact O-N 3.17Å; I395-E399 HydrophobicContact CG2-CG 4.24Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.23Å; I395-E399 WeakPolarHBondContact O-CB 3.18Å; I395-E399 WeakPolarHBondContact O-CG 3.41Å; I395-E399 PolarHBondContact O-N 2.83Å
396	R	95.4	Very high	94.2	Very high	162 Å²	162	70.1 Å²	70.1	61%	0.611	34%	0.338	S	S	*	.	H	α-helix	trans	-54.6	-43.2	179.4	-70.5	-164.8	-76.8	-156.6	1	111.7	E392 D393 K400	E392-R396 WeakPolarHBondContact O-CG 3.37Å; E392-R396 PolarHBondContact O-N 2.8Å; D393-R396 PolarHBondContact O-N 2.96Å; D393-R396 IonicContact OD1-CZ 3.55Å; D393-R396 VanDerWaalsContact OD1-CZ 3.28Å; D393-R396 IonicContact OD1-NE 2.71Å; D393-R396 PolarHBondContact OD1-NE 3.4Å; D393-R396 VanDerWaalsContact OD1-NE 3.09Å; D393-R396 IonicContact OD1-NH2 3.63Å; D393-R396 PolarHBondContact OD1-NH2 2.93Å; R396-K400 WeakPolarHBondContact O-CB 3.29Å; R396-K400 PolarHBondContact O-N 3.12Å
397	N	92.6	Very high	93.9	Very high	102 Å²	102	64.3 Å²	64.3	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-71.6	-40.4	178.6	-77.3	-67	0	0	0	113.4	D393 I395 E401	D393-N397 WeakPolarHBondContact O-CB 3.43Å; D393-N397 PolarHBondContact O-N 3.17Å; D393-N397 PolarHBondContact O-ND2 2.86Å; I395-N397 VanDerWaalsContact C-N 3.28Å; I395-N397 PolarHBondContact O-N 2.93Å; N397-E401 WeakPolarHBondContact O-CB 3.17Å; N397-E401 PolarHBondContact O-N 3.43Å
398	L	93.8	Very high	93.5	Very high	32 Å²	32	67.5 Å²	67.5	17%	0.168	33%	0.333	C	S	.	.	H	α-helix	trans	-66.5	-44.4	176	-77.1	170.8	0	0	0	112.1	K159 L163 Q394 I395 E401 I402	K159-L398 HydrophobicContact CG-CD2 4.46Å; L163-L398 HydrophobicContact CB-CD1 4.45Å; L163-L398 HydrophobicContact CD1-CB 4.2Å; Q394-L398 WeakPolarHBondContact O-CB 3.4Å; Q394-L398 VanDerWaalsContact O-CG 3.28Å; Q394-L398 WeakPolarHBondContact O-CG 3.47Å; Q394-L398 PolarHBondContact O-N 3.4Å; I395-L398 PolarHBondContact O-N 3.37Å; I395-L398 VanDerWaalsContact O-N 3.17Å; L398-E401 PolarHBondContact O-N 3.46Å; L398-I402 WeakPolarHBondContact O-CB 3.38Å; L398-I402 WeakPolarHBondContact O-CD1 3.21Å; L398-I402 VanDerWaalsContact O-CG1 3.22Å; L398-I402 WeakPolarHBondContact O-CG1 3.4Å; L398-I402 PolarHBondContact O-N 2.99Å
399	E	93.8	Very high	93.1	Very high	84 Å²	84	68.4 Å²	68.4	39%	0.393	34%	0.341	S	S	.	.	H	α-helix	trans	-64.8	-42.2	178.2	-71.5	178.9	174.9	0	0	111	L163 Q167 I395 E401 I402 S403	L163-E399 HydrophobicContact CD1-CG 3.76Å; L163-E399 HydrophobicContact CD2-CG 3.67Å; L163-E399 HydrophobicContact CG-CG 4.38Å; Q167-E399 PolarHBondContact NE2-OE1 2.89Å; I395-E399 HydrophobicContact CG2-CG 4.24Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.23Å; I395-E399 WeakPolarHBondContact O-CB 3.18Å; I395-E399 WeakPolarHBondContact O-CG 3.41Å; I395-E399 PolarHBondContact O-N 2.83Å; E399-E401 PolarHBondContact O-N 3.31Å; E399-I402 PolarHBondContact O-N 3.43Å; E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 3.05Å
400	K	90.7	Very high	92.9	Very high	124 Å²	124	64 Å²	64	54%	0.539	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-46.5	171.7	-175.2	173.1	-175.4	170.4	0	111.9	R396 I402 S403 F404	R396-K400 WeakPolarHBondContact O-CB 3.29Å; R396-K400 PolarHBondContact O-N 3.12Å; K400-I402 PolarHBondContact O-N 2.8Å; K400-S403 PolarHBondContact O-N 3.48Å; K400-S403 PolarHBondContact O-OG 3.28Å; K400-F404 HydrophobicContact CG-CE2 4.18Å; K400-F404 VanDerWaalsContact O-CD2 3.23Å; K400-F404 WeakPolarHBondContact O-CD2 3.49Å
401	E	89.6	Confident	92.7	Very high	31 Å²	31	59.8 Å²	59.8	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-41.4	177.1	-166.5	-176.2	-162.7	0	0	112.5	K159 N397 L398 E399 S403 F406 Y416	K159-E401 VanDerWaalsContact CD-OE2 3.31Å; K159-E401 WeakPolarHBondContact CD-OE2 3.42Å; K159-E401 WeakPolarHBondContact CE-OE2 3.3Å; K159-E401 IonicContact NZ-OE1 3.71Å; K159-E401 PolarHBondContact NZ-OE1 2.99Å; K159-E401 IonicContact NZ-OE2 2.81Å; K159-E401 PolarHBondContact NZ-OE2 2.73Å; N397-E401 WeakPolarHBondContact O-CB 3.17Å; N397-E401 PolarHBondContact O-N 3.43Å; L398-E401 PolarHBondContact O-N 3.46Å; E399-E401 PolarHBondContact O-N 3.31Å; E401-S403 PolarHBondContact O-N 2.65Å; E401-F406 WeakPolarHBondContact O-CE2 3Å; E401-Y416 HydrophobicContact CG-CD1 4.04Å; E401-Y416 HydrophobicContact CG-CE1 3.62Å; E401-Y416 WeakPolarHBondContact OE1-CD1 3.05Å; E401-Y416 WeakPolarHBondContact OE1-CE1 2.97Å
402	I	90.7	Very high	92.5	Very high	49 Å²	49	59 Å²	59	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-66.6	-25.2	177.1	-70.5	164.1	0	0	0	112.1	L156 K159 K160 L163 L398 E399 K400	L156-I402 HydrophobicContact CD1-CG1 4.14Å; L156-I402 HydrophobicContact CD1-CG2 4.3Å; K159-I402 HydrophobicContact CB-CD1 4.2Å; K159-I402 HydrophobicContact CB-CG1 4.27Å; K160-I402 HydrophobicContact CG-CD1 4.34Å; L163-I402 HydrophobicContact CB-CD1 4.47Å; L163-I402 HydrophobicContact CD2-CD1 3.9Å; L398-I402 WeakPolarHBondContact O-CB 3.38Å; L398-I402 WeakPolarHBondContact O-CD1 3.21Å; L398-I402 VanDerWaalsContact O-CG1 3.22Å; L398-I402 WeakPolarHBondContact O-CG1 3.4Å; L398-I402 PolarHBondContact O-N 2.99Å; E399-I402 PolarHBondContact O-N 3.43Å; K400-I402 PolarHBondContact O-N 2.8Å
403	S	90.6	Very high	92.4	Very high	90 Å²	90	57 Å²	57	63%	0.629	30%	0.299	S	S	*	.	H	α-helix	trans	-79	-16.3	-176.8	77.2	0	0	0	0	115.5	E399 K400 E401	E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 3.05Å; K400-S403 PolarHBondContact O-N 3.48Å; K400-S403 PolarHBondContact O-OG 3.28Å; E401-S403 PolarHBondContact O-N 2.65Å
404	F	90	Very high	92.2	Very high	45 Å²	45	55.9 Å²	55.9	20%	0.197	29%	0.29	C	S	.	.	S	Bend	trans	-70.8	137.3	-176	-78.9	-72.4	0	0	0	113.4	K400 F406 Y416 W453	K400-F404 HydrophobicContact CG-CE2 4.18Å; K400-F404 VanDerWaalsContact O-CD2 3.23Å; K400-F404 WeakPolarHBondContact O-CD2 3.49Å; F404-F406 HydrophobicContact CB-CD1 4.29Å; F404-F406 HydrophobicContact CB-CD2 4.24Å; F404-F406 HydrophobicContact CB-CE1 3.83Å; F404-F406 HydrophobicContact CB-CE2 3.79Å; F404-F406 HydrophobicContact CB-CG 4.48Å; F404-F406 HydrophobicContact CB-CZ 3.57Å; F404-F406 HydrophobicContact CD2-CZ 4.19Å; F404-F406 HydrophobicContact CG-CE1 4.45Å; F404-F406 HydrophobicContact CG-CZ 4.2Å; F404-F406 PolarHBondContact O-N 3.37Å; F404-Y416 AromaticContact CD2-CE2 3.89Å; F404-Y416 HydrophobicContact CD2-CE2 3.89Å; F404-Y416 AromaticContact CE2-CE2 3.65Å; F404-Y416 HydrophobicContact CE2-CE2 3.65Å; F404-Y416 HydrophobicContact CZ-CE2 4.36Å; F404-W453 AromaticContact CD1-NE1 3.9Å; F404-W453 AromaticContact CE1-CD1 3.8Å; F404-W453 AromaticContact CE1-NE1 3.85Å
405	D	91.4	Very high	92.2	Very high	71 Å²	71	51.2 Å²	51.2	38%	0.38	27%	0.268	S	S	.	.			trans	-72.7	90.3	167.6	-178.4	8.7	0	0	0	111.1	G407 W456 Y464	D405-G407 PolarHBondContact O-N 2.8Å; D405-G407 WeakPolarHBondContact OD1-CA 3.47Å; D405-G407 PolarHBondContact OD1-N 2.82Å; D405-W456 PolarHBondContact O-NE1 2.91Å; D405-W456 VanDerWaalsContact OD2-CD1 3.3Å; D405-Y464 PolarHBondContact OD1-OH 2.77Å; D405-Y464 WeakPolarHBondContact OD2-CE1 3.22Å; D405-Y464 PolarHBondContact OD2-OH 2.03Å
406	F	92.6	Very high	91.9	Very high	16 Å²	16	53.3 Å²	53.3	7%	0.07	28%	0.275	C	S	.	.			trans	-83.9	16.7	171.3	-63.4	-54.5	0	0	0	114	E401 F404 S410 E411 F412 A413 Y416 F434	E401-F406 WeakPolarHBondContact O-CE2 3Å; F404-F406 HydrophobicContact CB-CD1 4.29Å; F404-F406 HydrophobicContact CB-CD2 4.24Å; F404-F406 HydrophobicContact CB-CE1 3.83Å; F404-F406 HydrophobicContact CB-CE2 3.79Å; F404-F406 HydrophobicContact CB-CG 4.48Å; F404-F406 HydrophobicContact CB-CZ 3.57Å; F404-F406 HydrophobicContact CD2-CZ 4.19Å; F404-F406 HydrophobicContact CG-CE1 4.45Å; F404-F406 HydrophobicContact CG-CZ 4.2Å; F404-F406 PolarHBondContact O-N 3.37Å; F406-S410 CarbonylContact O-C 3.21Å; F406-S410 VanDerWaalsContact O-CA 3.28Å; F406-S410 WeakPolarHBondContact O-CA 3.11Å; F406-E411 PolarHBondContact O-N 2.82Å; F406-F412 WeakPolarHBondContact O-CB 3.07Å; F406-F412 WeakPolarHBondContact O-CD2 3.42Å; F406-F412 PolarHBondContact O-N 3.2Å; F406-A413 HydrophobicContact CB-CB 3.88Å; F406-A413 HydrophobicContact CD1-CB 4.23Å; F406-A413 HydrophobicContact CD2-CB 3.84Å; F406-A413 HydrophobicContact CE2-CB 4.41Å; F406-A413 HydrophobicContact CG-CB 3.73Å; F406-Y416 AromaticContact CE1-CD2 3.76Å; F406-Y416 HydrophobicContact CE1-CD2 3.76Å; F406-Y416 HydrophobicContact CE1-CG 4.07Å; F406-Y416 AromaticContact CZ-CD2 3.7Å; F406-Y416 HydrophobicContact CZ-CD2 3.7Å; F406-Y416 HydrophobicContact CZ-CE2 4.4Å; F406-Y416 AromaticContact CZ-CG 3.89Å; F406-Y416 HydrophobicContact CZ-CG 3.89Å; F406-F434 HydrophobicContact CD1-CD1 4.34Å; F406-F434 HydrophobicContact CD1-CD2 4.11Å; F406-F434 AromaticContact CD1-CE1 3.98Å; F406-F434 HydrophobicContact CD1-CE1 3.98Å; F406-F434 AromaticContact CD1-CE2 3.72Å; F406-F434 HydrophobicContact CD1-CE2 3.72Å; F406-F434 HydrophobicContact CD1-CG 4.41Å; F406-F434 AromaticContact CD1-CZ 3.66Å; F406-F434 HydrophobicContact CD1-CZ 3.66Å; F406-F434 HydrophobicContact CE1-CD1 4.22Å; F406-F434 AromaticContact CE1-CD2 3.81Å; F406-F434 HydrophobicContact CE1-CD2 3.81Å; F406-F434 HydrophobicContact CE1-CE1 4.32Å; F406-F434 AromaticContact CE1-CE2 3.9Å; F406-F434 HydrophobicContact CE1-CE2 3.9Å; F406-F434 AromaticContact CE1-CG 3.98Å; F406-F434 HydrophobicContact CE1-CG 3.98Å; F406-F434 HydrophobicContact CE1-CZ 4.17Å
407	G	90.3	Very high	91.6	Very high	8 Å²	8	50.6 Å²	50.6	8%	0.082	28%	0.281	C	S	.	.			trans	93.9	166.1	-175.3	0	0	0	0	0	114	D405 S409 S410	D405-G407 PolarHBondContact O-N 2.8Å; D405-G407 WeakPolarHBondContact OD1-CA 3.47Å; D405-G407 PolarHBondContact OD1-N 2.82Å; G407-S409 PolarHBondContact O-N 3.37Å; G407-S410 PolarHBondContact O-N 3.43Å
408	P	88.6	Confident	91.7	Very high	100 Å²	100	49.6 Å²	49.6	65%	0.649	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.2	-169	29	-37.6	0	0	0	114.6	E411 Y464	P408-E411 WeakPolarHBondContact CD-OE2 3.27Å; P408-Y464 HydrophobicContact CG-CE2 4.33Å
409	S	89.9	Confident	91.8	Very high	39 Å²	39	51.4 Å²	51.4	27%	0.273	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	18.4	169.2	-87.2	0	0	0	0	112.8	K153 G407 E411	K153-S409 WeakPolarHBondContact CE-O 3.42Å; K153-S409 PolarHBondContact NZ-OG 2.99Å; G407-S409 PolarHBondContact O-N 3.37Å; S409-E411 WeakPolarHBondContact CA-OE2 3.23Å; S409-E411 PolarHBondContact N-OE2 3.15Å; S409-E411 PolarHBondContact O-N 3.12Å
410	S	91.7	Very high	91.9	Very high	27 Å²	27	49.2 Å²	49.2	19%	0.189	28%	0.276	C	S	.	.			trans	59	25.8	-173.8	-48.3	0	0	0	0	113.8	A152 F406 G407 F412 A413	A152-S410 VanDerWaalsContact CB-O 3.31Å; A152-S410 WeakPolarHBondContact CB-O 3.3Å; F406-S410 CarbonylContact O-C 3.21Å; F406-S410 VanDerWaalsContact O-CA 3.28Å; F406-S410 WeakPolarHBondContact O-CA 3.11Å; G407-S410 PolarHBondContact O-N 3.43Å; S410-F412 PolarHBondContact O-N 2.95Å; S410-F412 VanDerWaalsContact O-N 3.13Å; S410-A413 VanDerWaalsContact O-CB 3.26Å; S410-A413 WeakPolarHBondContact O-CB 3.33Å; S410-A413 PolarHBondContact O-N 3.48Å
411	E	92	Very high	92.1	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.056	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.7	-175.8	53.1	-103.5	-103.5	0	0	114.9	K145 I149 F406 P408 S409 Y414 A514	K145-E411 WeakPolarHBondContact CE-OE1 3.2Å; K145-E411 HydrophobicContact CG-CB 4.26Å; K145-E411 IonicContact NZ-OE1 4Å; K145-E411 PolarHBondContact NZ-OE1 3.05Å; I149-E411 HydrophobicContact CD1-CB 4.09Å; I149-E411 HydrophobicContact CG1-CB 3.7Å; F406-E411 PolarHBondContact O-N 2.82Å; P408-E411 WeakPolarHBondContact CD-OE2 3.27Å; S409-E411 WeakPolarHBondContact CA-OE2 3.23Å; S409-E411 PolarHBondContact N-OE2 3.15Å; S409-E411 PolarHBondContact O-N 3.12Å; E411-Y414 WeakPolarHBondContact O-CD1 3.12Å; E411-A514 HydrophobicContact CB-CB 4.16Å; E411-A514 HydrophobicContact CG-CB 4.4Å; E411-A514 VanDerWaalsContact O-CB 3.32Å; E411-A514 WeakPolarHBondContact O-CB 3.13Å
412	F	94.6	Very high	92.4	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.2	178.7	-58.5	-71.4	0	0	0	113.5	F406 S410 Y414 L415 F434 W456 Y464 L487 A514 I515	F406-F412 WeakPolarHBondContact O-CB 3.07Å; F406-F412 WeakPolarHBondContact O-CD2 3.42Å; F406-F412 PolarHBondContact O-N 3.2Å; S410-F412 PolarHBondContact O-N 2.95Å; S410-F412 VanDerWaalsContact O-N 3.13Å; F412-Y414 PolarHBondContact O-N 3.33Å; F412-Y414 VanDerWaalsContact O-N 3.14Å; F412-L415 HydrophobicContact CB-CD1 4.23Å; F412-L415 HydrophobicContact CD1-CD1 3.98Å; F412-L415 VanDerWaalsContact O-CB 3.3Å; F412-L415 WeakPolarHBondContact O-CB 3.38Å; F412-L415 PolarHBondContact O-N 2.04Å; F412-F434 HydrophobicContact CB-CE2 4.15Å; F412-F434 HydrophobicContact CB-CZ 3.79Å; F412-W456 HydrophobicContact CB-CH2 4.33Å; F412-W456 HydrophobicContact CB-CZ2 4.31Å; F412-W456 HydrophobicContact CD1-CH2 4.11Å; F412-W456 AromaticContact CD2-CH2 3.64Å; F412-W456 HydrophobicContact CD2-CH2 3.64Å; F412-W456 AromaticContact CD2-CZ2 3.73Å; F412-W456 HydrophobicContact CD2-CZ2 3.73Å; F412-W456 HydrophobicContact CE1-CH2 4.36Å; F412-W456 AromaticContact CE2-CH2 3.94Å; F412-W456 HydrophobicContact CE2-CH2 3.94Å; F412-W456 HydrophobicContact CE2-CZ2 4.29Å; F412-W456 AromaticContact CG-CH2 3.75Å; F412-W456 HydrophobicContact CG-CH2 3.75Å; F412-W456 HydrophobicContact CG-CZ2 4.05Å; F412-W456 HydrophobicContact CZ-CH2 4.28Å; F412-Y464 HydrophobicContact CD2-CD1 4.41Å; F412-Y464 AromaticContact CE2-CD1 3.98Å; F412-Y464 HydrophobicContact CE2-CD1 3.98Å; F412-Y464 HydrophobicContact CE2-CG 4.05Å; F412-L487 HydrophobicContact CD1-CD2 4.14Å; F412-L487 HydrophobicContact CE1-CD2 3.59Å; F412-L487 HydrophobicContact CZ-CD2 4.31Å; F412-A514 HydrophobicContact CD1-CB 3.57Å; F412-A514 HydrophobicContact CE1-CB 3.56Å; F412-A514 HydrophobicContact CG-CB 4.4Å; F412-A514 HydrophobicContact CZ-CB 4.38Å; F412-I515 HydrophobicContact CE1-CB 4.48Å; F412-I515 HydrophobicContact CZ-CD1 4.14Å
413	A	93.4	Very high	92.5	Very high	23 Å²	23	51.3 Å²	51.3	19%	0.19	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-60.7	-28.7	-173.9	0	0	0	0	0	113.5	A152 F406 S410 L415 Y416	A152-A413 HydrophobicContact CB-CB 3.91Å; F406-A413 HydrophobicContact CB-CB 3.88Å; F406-A413 HydrophobicContact CD1-CB 4.23Å; F406-A413 HydrophobicContact CD2-CB 3.84Å; F406-A413 HydrophobicContact CE2-CB 4.41Å; F406-A413 HydrophobicContact CG-CB 3.73Å; S410-A413 VanDerWaalsContact O-CB 3.26Å; S410-A413 WeakPolarHBondContact O-CB 3.33Å; S410-A413 PolarHBondContact O-N 3.48Å; A413-L415 PolarHBondContact O-N 3.17Å; A413-Y416 VanDerWaalsContact O-CB 3.31Å; A413-Y416 WeakPolarHBondContact O-CB 3.28Å; A413-Y416 PolarHBondContact O-N 2.9Å; A413-Y416 VanDerWaalsContact O-N 3.15Å
414	Y	92.9	Very high	92.4	Very high	44 Å²	44	49 Å²	49	17%	0.173	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-66.1	-19.7	176.5	84.9	-77.6	0	0	0	113.7	L148 E411 F412 Y416 Q418 T493 S512 A514	L148-Y414 HydrophobicContact CB-CD1 4.47Å; L148-Y414 HydrophobicContact CD1-CD1 3.92Å; L148-Y414 HydrophobicContact CD1-CE1 3.78Å; L148-Y414 HydrophobicContact CD1-CE2 4.4Å; L148-Y414 HydrophobicContact CD1-CG 4.3Å; L148-Y414 HydrophobicContact CD2-CD1 4.1Å; L148-Y414 HydrophobicContact CD2-CD2 4.05Å; L148-Y414 HydrophobicContact CD2-CG 3.75Å; L148-Y414 HydrophobicContact CG-CD1 4.39Å; E411-Y414 WeakPolarHBondContact O-CD1 3.12Å; F412-Y414 PolarHBondContact O-N 3.33Å; F412-Y414 VanDerWaalsContact O-N 3.14Å; Y414-Y416 VanDerWaalsContact C-N 3.31Å; Y414-Q418 WeakPolarHBondContact O-CG 3.32Å; Y414-Q418 PolarHBondContact O-NE2 3.14Å; Y414-Q418 PolarHBondContact O-OE1 2.78Å; Y414-T493 HydrophobicContact CE2-CG2 4.35Å; Y414-T493 WeakPolarHBondContact CE2-OG1 3.39Å; Y414-T493 PolarHBondContact OH-OG1 2.73Å; Y414-S512 PolarHBondContact OH-OG 3.09Å; Y414-A514 HydrophobicContact CE1-CB 3.84Å
415	L	94.4	Very high	92.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-77.4	-18.1	175.9	-61	175	0	0	0	112.6	F412 A413 Q418 Y420 P433 F434 T493 F510	F412-L415 HydrophobicContact CB-CD1 4.23Å; F412-L415 HydrophobicContact CD1-CD1 3.98Å; F412-L415 VanDerWaalsContact O-CB 3.3Å; F412-L415 WeakPolarHBondContact O-CB 3.38Å; F412-L415 PolarHBondContact O-N 2.04Å; A413-L415 PolarHBondContact O-N 3.17Å; L415-Q418 PolarHBondContact O-N 3.09Å; L415-Y420 HydrophobicContact CD2-CE2 4.08Å; L415-P433 HydrophobicContact CB-CB 3.82Å; L415-P433 HydrophobicContact CB-CG 4.04Å; L415-P433 HydrophobicContact CD1-CB 4.46Å; L415-F434 HydrophobicContact CB-CE2 4.13Å; L415-T493 HydrophobicContact CD2-CG2 3.58Å; L415-F510 HydrophobicContact CD1-CE1 4.04Å; L415-F510 HydrophobicContact CD2-CE1 3.97Å; L415-F510 HydrophobicContact CD2-CZ 3.94Å
416	Y	91.8	Very high	92	Very high	60 Å²	60	52.8 Å²	52.8	24%	0.235	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	141	179.3	-170.2	-96.7	0	0	0	110.6	E401 F404 F406 A413 Y414 Q418 F434	E401-Y416 HydrophobicContact CG-CD1 4.04Å; E401-Y416 HydrophobicContact CG-CE1 3.62Å; E401-Y416 WeakPolarHBondContact OE1-CD1 3.05Å; E401-Y416 WeakPolarHBondContact OE1-CE1 2.97Å; F404-Y416 AromaticContact CD2-CE2 3.89Å; F404-Y416 HydrophobicContact CD2-CE2 3.89Å; F404-Y416 AromaticContact CE2-CE2 3.65Å; F404-Y416 HydrophobicContact CE2-CE2 3.65Å; F404-Y416 HydrophobicContact CZ-CE2 4.36Å; F406-Y416 AromaticContact CE1-CD2 3.76Å; F406-Y416 HydrophobicContact CE1-CD2 3.76Å; F406-Y416 HydrophobicContact CE1-CG 4.07Å; F406-Y416 AromaticContact CZ-CD2 3.7Å; F406-Y416 HydrophobicContact CZ-CD2 3.7Å; F406-Y416 HydrophobicContact CZ-CE2 4.4Å; F406-Y416 AromaticContact CZ-CG 3.89Å; F406-Y416 HydrophobicContact CZ-CG 3.89Å; A413-Y416 VanDerWaalsContact O-CB 3.31Å; A413-Y416 WeakPolarHBondContact O-CB 3.28Å; A413-Y416 PolarHBondContact O-N 2.9Å; A413-Y416 VanDerWaalsContact O-N 3.15Å; Y414-Y416 VanDerWaalsContact C-N 3.31Å; Y416-Q418 PolarHBondContact O-N 3.4Å; Y416-F434 HydrophobicContact CD2-CB 3.87Å; Y416-F434 HydrophobicContact CD2-CD2 4.4Å; Y416-F434 HydrophobicContact CD2-CG 4.39Å; Y416-F434 HydrophobicContact CE2-CB 4.3Å
417	S	87.9	Confident	91.9	Very high	104 Å²	104	55.9 Å²	55.9	73%	0.727	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	10.2	-172.5	-60.4	0	0	0	0	116
418	Q	94.1	Very high	92.2	Very high	81 Å²	81	56.9 Å²	56.9	38%	0.379	32%	0.324	S	S	.	.			trans	-98.1	153.3	170.3	-60.1	-169.2	-5.2	0	0	110.8	Y414 L415 Y416 Y420 C432 P433	Y414-Q418 WeakPolarHBondContact O-CG 3.32Å; Y414-Q418 PolarHBondContact O-NE2 3.14Å; Y414-Q418 PolarHBondContact O-OE1 2.78Å; L415-Q418 PolarHBondContact O-N 3.09Å; Y416-Q418 PolarHBondContact O-N 3.4Å; Q418-Y420 HydrophobicContact CB-CE2 3.84Å; Q418-Y420 PolarHBondContact OE1-OH 2.76Å; Q418-C432 WeakPolarHBondContact O-CA 3.08Å; Q418-P433 VanDerWaalsContact O-CD 3.25Å; Q418-P433 WeakPolarHBondContact O-CD 3.3Å
419	C	96	Very high	92.5	Very high	71 Å²	71	53.2 Å²	53.2	48%	0.48	30%	0.298	S	S	.	.			trans	-134.8	138.3	176.6	-64.8	0	0	0	0	110	R430 L431 C432	C419-R430 HydrophobicContact CB-CG 4.05Å; C419-L431 CarbonylContact C-O 3.51Å; C419-L431 WeakPolarHBondContact CA-O 3.31Å; C419-C432 HydrophobicContact CB-CB 4.16Å; C419-C432 WeakPolarHBondContact CB-SG 3.25Å; C419-C432 WeakPolarHBondContact SG-CB 3.3Å; C419-C432 CovalentContact SG-SG 2.04Å; C419-C432 PolarHBondContact SG-SG 2.74Å
420	Y	96.2	Very high	92.7	Very high	38 Å²	38	54 Å²	54	15%	0.149	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.4	-175.3	-65.9	-92.6	0	0	0	109.3	L415 Q418 R430 L431 P433 T493 F510	L415-Y420 HydrophobicContact CD2-CE2 4.08Å; Q418-Y420 HydrophobicContact CB-CE2 3.84Å; Q418-Y420 PolarHBondContact OE1-OH 2.76Å; Y420-R430 WeakPolarHBondContact O-CA 3.25Å; Y420-L431 PolarHBondContact N-O 2.61Å; Y420-L431 PolarHBondContact O-N 2.04Å; Y420-P433 HydrophobicContact CD2-CG 4.49Å; Y420-T493 HydrophobicContact CD1-CG2 4.33Å; Y420-T493 HydrophobicContact CE1-CG2 3.55Å; Y420-T493 WeakPolarHBondContact CE1-O 3.45Å; Y420-T493 HydrophobicContact CE2-CG2 4.04Å; Y420-T493 WeakPolarHBondContact OH-CG2 3.25Å; Y420-F510 HydrophobicContact CD1-CE2 4.15Å; Y420-F510 AromaticContact CD2-CE2 3.91Å; Y420-F510 HydrophobicContact CD2-CE2 3.91Å; Y420-F510 AromaticContact CD2-CZ 3.84Å; Y420-F510 HydrophobicContact CD2-CZ 3.84Å; Y420-F510 HydrophobicContact CE2-CE2 4.44Å; Y420-F510 HydrophobicContact CE2-CZ 4Å; Y420-F510 AromaticContact CG-CE2 3.77Å; Y420-F510 HydrophobicContact CG-CE2 3.77Å; Y420-F510 HydrophobicContact CG-CZ 4.16Å
421	E	95.2	Very high	93	Very high	121 Å²	121	52.8 Å²	52.8	57%	0.565	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	130	-175.3	-66.3	-167.7	166	0	0	112.5	V428 Y429 R430	E421-V428 HydrophobicContact CB-CG1 4.26Å; E421-Y429 CarbonylContact C-O 3.45Å; E421-Y429 VanDerWaalsContact CA-O 3.26Å; E421-Y429 WeakPolarHBondContact CA-O 3.28Å; E421-R430 HydrophobicContact CG-CB 3.87Å; E421-R430 HydrophobicContact CG-CG 3.72Å; E421-R430 VanDerWaalsContact OE1-CD 3.29Å; E421-R430 WeakPolarHBondContact OE1-CD 3.45Å
422	L	95	Very high	93.2	Very high	42 Å²	42	52.6 Å²	52.6	22%	0.22	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.2	165.8	-175.5	67	0	0	0	110.3	T424 V428 Y429 V495 T498	L422-T424 HydrophobicContact CD2-CG2 4.44Å; L422-V428 WeakPolarHBondContact O-CA 3.09Å; L422-Y429 PolarHBondContact N-O 3.2Å; L422-Y429 PolarHBondContact O-N 3.15Å; L422-V495 HydrophobicContact CB-CB 4.09Å; L422-V495 HydrophobicContact CB-CG1 3.71Å; L422-V495 HydrophobicContact CD2-CG1 4.1Å; L422-V495 HydrophobicContact CG-CG1 4.45Å; L422-T498 HydrophobicContact CB-CG2 4.44Å; L422-T498 HydrophobicContact CD2-CG2 3.77Å
423	T	93.6	Very high	93.2	Very high	85 Å²	85	52.6 Å²	52.6	52%	0.521	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	108.6	176.4	-65.8	0	0	0	0	110.2	V428	T423-V428 HydrophobicContact CG2-CG2 4.35Å
424	T	89.3	Confident	93.3	Very high	42 Å²	42	51.9 Å²	51.9	26%	0.258	28%	0.279	S	S	.	.			trans	-87.5	-162.1	176	67.6	0	0	0	0	111.3	L422 Y427 Y429 K442 T498	L422-T424 HydrophobicContact CD2-CG2 4.44Å; T424-Y427 PolarHBondContact N-O 2.91Å; T424-Y427 PolarHBondContact OG1-N 3.09Å; T424-Y427 PolarHBondContact OG1-O 3.02Å; T424-Y429 HydrophobicContact CG2-CD2 3.77Å; T424-Y429 HydrophobicContact CG2-CE2 3.59Å; T424-K442 WeakPolarHBondContact O-CE 3.46Å; T424-K442 PolarHBondContact O-NZ 3.17Å; T424-T498 WeakPolarHBondContact CG2-OG1 3.3Å
425	G	84.3	Confident	93.3	Very high	60 Å²	60	54.5 Å²	54.5	62%	0.619	30%	0.296	S	S	*	.	S	Bend	trans	-61.8	-55.1	173.7	0	0	0	0	0	112.6	K442	G425-K442 WeakPolarHBondContact O-CD 3.31Å; G425-K442 WeakPolarHBondContact O-CE 3.39Å; G425-K442 PolarHBondContact O-NZ 3.01Å
426	E	87.5	Confident	93.4	Very high	135 Å²	135	58.2 Å²	58.2	63%	0.631	31%	0.312	S	S	*	.	S	Bend	trans	-107	-30.7	-168.7	-62.1	174.2	154.3	0	0	113.3	K442	E426-K442 WeakPolarHBondContact O-CB 3.37Å; E426-K442 WeakPolarHBondContact O-CG 3.22Å; E426-K442 PolarHBondContact O-N 3.26Å
427	Y	92.1	Very high	93.6	Very high	80 Å²	80	55.3 Å²	55.3	31%	0.314	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.9	-172.4	-61.3	-86.5	0	0	0	112.8	T424 Q439 K440 P441	T424-Y427 PolarHBondContact N-O 2.91Å; T424-Y427 PolarHBondContact OG1-N 3.09Å; T424-Y427 PolarHBondContact OG1-O 3.02Å; Y427-Q439 HydrophobicContact CD1-CG 3.63Å; Y427-Q439 HydrophobicContact CE1-CG 4.42Å; Y427-Q439 HydrophobicContact CG-CG 3.94Å; Y427-K440 WeakPolarHBondContact CA-O 3.08Å; Y427-P441 HydrophobicContact CD1-CB 4.14Å; Y427-P441 HydrophobicContact CE1-CB 4.05Å
428	V	94.6	Very high	93.9	Very high	30 Å²	30	50.5 Å²	50.5	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.8	161.8	-175.3	0	0	0	0	107.7	E421 L422 T423 Q439 K440 K442	E421-V428 HydrophobicContact CB-CG1 4.26Å; L422-V428 WeakPolarHBondContact O-CA 3.09Å; T423-V428 HydrophobicContact CG2-CG2 4.35Å; V428-Q439 WeakPolarHBondContact O-CA 3.45Å; V428-K440 PolarHBondContact N-O 2.69Å; V428-K440 PolarHBondContact O-N 3.15Å; V428-K442 HydrophobicContact CG2-CG 4.24Å
429	Y	95	Very high	93.9	Very high	23 Å²	23	47.4 Å²	47.4	9%	0.09	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.3	173.4	-65.2	-95.9	0	0	0	108.6	E421 L422 T424 S438 Q439 L450 T498 Y506	E421-Y429 CarbonylContact C-O 3.45Å; E421-Y429 VanDerWaalsContact CA-O 3.26Å; E421-Y429 WeakPolarHBondContact CA-O 3.28Å; L422-Y429 PolarHBondContact N-O 3.2Å; L422-Y429 PolarHBondContact O-N 3.15Å; T424-Y429 HydrophobicContact CG2-CD2 3.77Å; T424-Y429 HydrophobicContact CG2-CE2 3.59Å; Y429-S438 CarbonylContact C-O 3.11Å; Y429-S438 WeakPolarHBondContact CA-O 3.4Å; Y429-Q439 HydrophobicContact CD1-CB 4.27Å; Y429-Q439 HydrophobicContact CD1-CG 4.07Å; Y429-Q439 HydrophobicContact CE1-CB 4.31Å; Y429-Q439 HydrophobicContact CE1-CG 3.78Å; Y429-Q439 PolarHBondContact OH-NE2 3.26Å; Y429-L450 HydrophobicContact CD1-CD1 3.78Å; Y429-L450 HydrophobicContact CE1-CD1 3.84Å; Y429-T498 HydrophobicContact CD1-CG2 4.37Å; Y429-T498 HydrophobicContact CD2-CG2 4Å; Y429-T498 HydrophobicContact CG-CG2 3.88Å; Y429-Y506 HydrophobicContact CE1-CD1 4.38Å
430	R	95.9	Very high	93.9	Very high	55 Å²	55	49.2 Å²	49.2	21%	0.208	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.1	175	-174	-178.9	71.8	-120.8	-10.3	109.8	C419 Y420 E421 S438 E447	C419-R430 HydrophobicContact CB-CG 4.05Å; Y420-R430 WeakPolarHBondContact O-CA 3.25Å; E421-R430 HydrophobicContact CG-CB 3.87Å; E421-R430 HydrophobicContact CG-CG 3.72Å; E421-R430 VanDerWaalsContact OE1-CD 3.29Å; E421-R430 WeakPolarHBondContact OE1-CD 3.45Å; R430-S438 PolarHBondContact N-O 2.91Å; R430-S438 PolarHBondContact NH2-OG 3.07Å; R430-S438 PolarHBondContact O-N 3.34Å; R430-S438 PolarHBondContact O-OG 2.98Å; R430-E447 IonicContact CZ-OE1 2.65Å; R430-E447 VanDerWaalsContact CZ-OE1 3.28Å; R430-E447 IonicContact CZ-OE2 2.82Å; R430-E447 IonicContact NH1-OE1 3.57Å; R430-E447 PolarHBondContact NH1-OE1 3.47Å; R430-E447 IonicContact NH1-OE2 2.65Å; R430-E447 IonicContact NH2-OE1 3.05Å; R430-E447 PolarHBondContact NH2-OE1 3.41Å; R430-E447 IonicContact NH2-OE2 2.73Å; R430-E447 PolarHBondContact NH2-OE2 3.35Å
431	L	96.7	Very high	93.7	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.3	172.3	166.4	61.4	0	0	0	108.6	C419 Y420 P433 V437 Y469 V485 V495 F510	C419-L431 CarbonylContact C-O 3.51Å; C419-L431 WeakPolarHBondContact CA-O 3.31Å; Y420-L431 PolarHBondContact N-O 2.61Å; Y420-L431 PolarHBondContact O-N 2.04Å; L431-P433 HydrophobicContact CD1-CG 4.48Å; L431-P433 HydrophobicContact CG-CG 4.24Å; L431-V437 HydrophobicContact CD1-CG2 3.75Å; L431-Y469 HydrophobicContact CD1-CE2 4.22Å; L431-V485 HydrophobicContact CD1-CG2 4.06Å; L431-V485 HydrophobicContact CD2-CG1 3.9Å; L431-V485 HydrophobicContact CD2-CG2 4.45Å; L431-V495 HydrophobicContact CB-CG2 4.16Å; L431-V495 HydrophobicContact CD2-CG2 3.95Å; L431-F510 HydrophobicContact CD2-CB 4.36Å; L431-F510 HydrophobicContact CD2-CD1 4.42Å; L431-F510 HydrophobicContact CD2-CD2 3.72Å; L431-F510 HydrophobicContact CD2-CE2 3.99Å; L431-F510 HydrophobicContact CD2-CG 3.95Å; L431-F510 HydrophobicContact CD2-CZ 4.44Å
432	C	96.6	Very high	93.5	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	99.4	169.1	-57	0	0	0	0	108.3	Q418 C419 N435 K436	Q418-C432 WeakPolarHBondContact O-CA 3.08Å; C419-C432 HydrophobicContact CB-CB 4.16Å; C419-C432 WeakPolarHBondContact CB-SG 3.25Å; C419-C432 WeakPolarHBondContact SG-CB 3.3Å; C419-C432 CovalentContact SG-SG 2.04Å; C419-C432 PolarHBondContact SG-SG 2.74Å; C432-N435 HydrophobicContact CB-CB 4.21Å; C432-N435 PolarHBondContact O-N 3.23Å; C432-N435 VanDerWaalsContact O-N 3.1Å; C432-K436 PolarHBondContact N-O 3.21Å; C432-K436 PolarHBondContact O-N 3.25Å; C432-K436 VanDerWaalsContact O-N 3.14Å
433	P	95.3	Very high	93.1	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	144.3	-175	-28.8	38.7	0	0	0	113.1	L415 Q418 Y420 L431 N435 M467 Y469 F510	L415-P433 HydrophobicContact CB-CB 3.82Å; L415-P433 HydrophobicContact CB-CG 4.04Å; L415-P433 HydrophobicContact CD1-CB 4.46Å; Q418-P433 VanDerWaalsContact O-CD 3.25Å; Q418-P433 WeakPolarHBondContact O-CD 3.3Å; Y420-P433 HydrophobicContact CD2-CG 4.49Å; L431-P433 HydrophobicContact CD1-CG 4.48Å; L431-P433 HydrophobicContact CG-CG 4.24Å; P433-N435 PolarHBondContact O-N 3.16Å; P433-N435 VanDerWaalsContact O-N 3.07Å; P433-M467 HydrophobicContact CB-CE 4.25Å; P433-Y469 WeakPolarHBondContact CA-OH 3.04Å; P433-F510 HydrophobicContact CG-CZ 4.44Å
434	F	94.1	Very high	92.6	Very high	7 Å²	7	53.4 Å²	53.4	3%	0.031	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	5.5	-174.8	-49.7	-79.5	0	0	0	115.8	F406 F412 L415 Y416 W453 W456 M467	F406-F434 HydrophobicContact CD1-CD1 4.34Å; F406-F434 HydrophobicContact CD1-CD2 4.11Å; F406-F434 AromaticContact CD1-CE1 3.98Å; F406-F434 HydrophobicContact CD1-CE1 3.98Å; F406-F434 AromaticContact CD1-CE2 3.72Å; F406-F434 HydrophobicContact CD1-CE2 3.72Å; F406-F434 HydrophobicContact CD1-CG 4.41Å; F406-F434 AromaticContact CD1-CZ 3.66Å; F406-F434 HydrophobicContact CD1-CZ 3.66Å; F406-F434 HydrophobicContact CE1-CD1 4.22Å; F406-F434 AromaticContact CE1-CD2 3.81Å; F406-F434 HydrophobicContact CE1-CD2 3.81Å; F406-F434 HydrophobicContact CE1-CE1 4.32Å; F406-F434 AromaticContact CE1-CE2 3.9Å; F406-F434 HydrophobicContact CE1-CE2 3.9Å; F406-F434 AromaticContact CE1-CG 3.98Å; F406-F434 HydrophobicContact CE1-CG 3.98Å; F406-F434 HydrophobicContact CE1-CZ 4.17Å; F412-F434 HydrophobicContact CB-CE2 4.15Å; F412-F434 HydrophobicContact CB-CZ 3.79Å; L415-F434 HydrophobicContact CB-CE2 4.13Å; Y416-F434 HydrophobicContact CD2-CB 3.87Å; Y416-F434 HydrophobicContact CD2-CD2 4.4Å; Y416-F434 HydrophobicContact CD2-CG 4.39Å; Y416-F434 HydrophobicContact CE2-CB 4.3Å; F434-W453 VanDerWaalsContact C-CB 3.43Å; F434-W453 HydrophobicContact CB-CG 4.47Å; F434-W453 HydrophobicContact CD1-CD2 4.26Å; F434-W453 AromaticContact CD1-CE2 3.67Å; F434-W453 HydrophobicContact CD1-CH2 4.47Å; F434-W453 AromaticContact CD1-CZ2 3.78Å; F434-W453 HydrophobicContact CD1-CZ2 3.78Å; F434-W453 AromaticContact CD1-NE1 3.81Å; F434-W453 HydrophobicContact CE1-CH2 4.32Å; F434-W453 AromaticContact CE1-CZ2 3.88Å; F434-W453 HydrophobicContact CE1-CZ2 3.88Å; F434-W456 AromaticContact CE1-CZ2 3.7Å; F434-W456 HydrophobicContact CE1-CZ2 3.7Å; F434-W456 HydrophobicContact CZ-CH2 4.21Å; F434-W456 AromaticContact CZ-CZ2 3.67Å; F434-W456 HydrophobicContact CZ-CZ2 3.67Å; F434-M467 HydrophobicContact CD1-CE 3.88Å; F434-M467 HydrophobicContact CD2-CE 4.24Å; F434-M467 HydrophobicContact CE1-CE 3.59Å; F434-M467 HydrophobicContact CE2-CE 3.98Å; F434-M467 HydrophobicContact CG-CE 4.19Å; F434-M467 HydrophobicContact CZ-CE 3.63Å
435	N	94.2	Very high	92.3	Very high	99 Å²	99	54.1 Å²	54.1	53%	0.529	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-82.6	178.7	-173.1	-42.2	0	0	0	111.4	C432 P433 T452 W453	C432-N435 HydrophobicContact CB-CB 4.21Å; C432-N435 PolarHBondContact O-N 3.23Å; C432-N435 VanDerWaalsContact O-N 3.1Å; P433-N435 PolarHBondContact O-N 3.16Å; P433-N435 VanDerWaalsContact O-N 3.07Å; N435-T452 WeakPolarHBondContact O-CA 3.43Å; N435-W453 PolarHBondContact O-N 2.78Å
436	K	95.5	Very high	92.5	Very high	78 Å²	78	56 Å²	56	34%	0.339	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	158	-177.8	69.8	-171.7	179.9	179.2	0	113.6	C432 G451	C432-K436 PolarHBondContact N-O 3.21Å; C432-K436 PolarHBondContact O-N 3.25Å; C432-K436 VanDerWaalsContact O-N 3.14Å; K436-G451 CarbonylContact C-O 3.52Å; K436-G451 VanDerWaalsContact CA-O 3.32Å; K436-G451 WeakPolarHBondContact CA-O 3.35Å
437	V	96.6	Very high	92.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.4	167.4	-172	0	0	0	0	109.1	L431 N449 L450 G451 Y469 T483 I508	L431-V437 HydrophobicContact CD1-CG2 3.75Å; V437-N449 PolarHBondContact O-OD1 2.78Å; V437-N449 VanDerWaalsContact O-OD1 3.12Å; V437-L450 HydrophobicContact CB-CB 4.17Å; V437-L450 HydrophobicContact CG1-CB 4.05Å; V437-L450 HydrophobicContact CG1-CD1 4.16Å; V437-L450 HydrophobicContact CG1-CG 4.45Å; V437-L450 PolarHBondContact O-N 2.78Å; V437-G451 PolarHBondContact N-O 3.43Å; V437-Y469 HydrophobicContact CG2-CD1 3.74Å; V437-Y469 HydrophobicContact CG2-CD2 3.93Å; V437-Y469 HydrophobicContact CG2-CE1 4.06Å; V437-Y469 HydrophobicContact CG2-CE2 4.24Å; V437-Y469 HydrophobicContact CG2-CG 3.71Å; V437-T483 HydrophobicContact CB-CG2 4.47Å; V437-T483 HydrophobicContact CG1-CG2 4.21Å; V437-T483 HydrophobicContact CG2-CG2 4.12Å; V437-I508 HydrophobicContact CG1-CD1 3.73Å
438	S	95.3	Very high	92.7	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.014	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.1	-176.5	39.1	0	0	0	0	111.8	Y429 R430 T448	Y429-S438 CarbonylContact C-O 3.11Å; Y429-S438 WeakPolarHBondContact CA-O 3.4Å; R430-S438 PolarHBondContact N-O 2.91Å; R430-S438 PolarHBondContact NH2-OG 3.07Å; R430-S438 PolarHBondContact O-N 3.34Å; R430-S438 PolarHBondContact O-OG 2.98Å; S438-T448 CarbonylContact C-O 3.56Å; S438-T448 WeakPolarHBondContact CA-O 3.06Å
439	Q	94	Very high	92.7	Very high	17 Å²	17	51.3 Å²	51.3	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.7	178.4	-171.7	-164.3	56.8	0	0	109.3	Y427 V428 Y429 T448 L450	Y427-Q439 HydrophobicContact CD1-CG 3.63Å; Y427-Q439 HydrophobicContact CE1-CG 4.42Å; Y427-Q439 HydrophobicContact CG-CG 3.94Å; V428-Q439 WeakPolarHBondContact O-CA 3.45Å; Y429-Q439 HydrophobicContact CD1-CB 4.27Å; Y429-Q439 HydrophobicContact CD1-CG 4.07Å; Y429-Q439 HydrophobicContact CE1-CB 4.31Å; Y429-Q439 HydrophobicContact CE1-CG 3.78Å; Y429-Q439 PolarHBondContact OH-NE2 3.26Å; Q439-T448 PolarHBondContact N-O 3.11Å; Q439-T448 PolarHBondContact O-N 3.2Å; Q439-L450 HydrophobicContact CB-CD1 3.91Å; Q439-L450 HydrophobicContact CB-CD2 3.86Å; Q439-L450 HydrophobicContact CB-CG 3.91Å
440	K	94.1	Very high	92.7	Very high	109 Å²	109	50.2 Å²	50.2	47%	0.474	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.9	178.9	-173.2	173.8	-179.2	175.2	0	110.6	Y427 V428	Y427-K440 WeakPolarHBondContact CA-O 3.08Å; V428-K440 PolarHBondContact N-O 2.69Å; V428-K440 PolarHBondContact O-N 3.15Å
441	P	93.6	Very high	92.7	Very high	34 Å²	34	47.6 Å²	47.6	22%	0.221	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	138.5	174.4	28.1	-34.1	0	0	0	110.7	Y427 F443 G444 S446	Y427-P441 HydrophobicContact CD1-CB 4.14Å; Y427-P441 HydrophobicContact CE1-CB 4.05Å; P441-F443 VanDerWaalsContact C-N 3.35Å; P441-F443 PolarHBondContact O-N 2.62Å; P441-G444 VanDerWaalsContact CG-O 3.29Å; P441-G444 WeakPolarHBondContact CG-O 3.33Å; P441-S446 WeakPolarHBondContact CD-O 3.35Å
442	K	90.1	Very high	92.7	Very high	91 Å²	91	50.1 Å²	50.1	40%	0.396	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-38.7	-179.4	-78.6	-176.8	-179	171.5	0	113.9	T424 G425 E426 V428 G444	T424-K442 WeakPolarHBondContact O-CE 3.46Å; T424-K442 PolarHBondContact O-NZ 3.17Å; G425-K442 WeakPolarHBondContact O-CD 3.31Å; G425-K442 WeakPolarHBondContact O-CE 3.39Å; G425-K442 PolarHBondContact O-NZ 3.01Å; E426-K442 WeakPolarHBondContact O-CB 3.37Å; E426-K442 WeakPolarHBondContact O-CG 3.22Å; E426-K442 PolarHBondContact O-N 3.26Å; V428-K442 HydrophobicContact CG2-CG 4.24Å; K442-G444 VanDerWaalsContact C-N 3.26Å; K442-G444 PolarHBondContact O-N 3.46Å
443	F	87.2	Confident	92.6	Very high	191 Å²	191	51.6 Å²	51.6	84%	0.838	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	21.7	-167.6	-59.1	-72.6	0	0	0	113.5	P441	P441-F443 VanDerWaalsContact C-N 3.35Å; P441-F443 PolarHBondContact O-N 2.62Å
444	G	81.9	Confident	92.5	Very high	58 Å²	58	53.3 Å²	53.3	60%	0.598	31%	0.305	S	S	*	.	S	Bend	trans	96.3	152.9	-175	0	0	0	0	0	112.7	P441 K442	P441-G444 VanDerWaalsContact CG-O 3.29Å; P441-G444 WeakPolarHBondContact CG-O 3.33Å; K442-G444 VanDerWaalsContact C-N 3.26Å; K442-G444 PolarHBondContact O-N 3.46Å
445	G	83.9	Confident	92.5	Very high	57 Å²	57	58.8 Å²	58.8	59%	0.588	33%	0.329	S	S	*	.			trans	135.6	168.4	-173.7	0	0	0	0	0	111.8
446	S	87.6	Confident	92.6	Very high	98 Å²	98	55.4 Å²	55.4	69%	0.685	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-72.8	159.7	175.2	45.6	0	0	0	0	112.1	P441	P441-S446 WeakPolarHBondContact CD-O 3.35Å
447	E	92.1	Very high	92.5	Very high	77 Å²	77	53.9 Å²	53.9	36%	0.36	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-81	130.4	169.8	-175.9	170.1	-82.5	0	0	109.8	R430	R430-E447 IonicContact CZ-OE1 2.65Å; R430-E447 VanDerWaalsContact CZ-OE1 3.28Å; R430-E447 IonicContact CZ-OE2 2.82Å; R430-E447 IonicContact NH1-OE1 3.57Å; R430-E447 PolarHBondContact NH1-OE1 3.47Å; R430-E447 IonicContact NH1-OE2 2.65Å; R430-E447 IonicContact NH2-OE1 3.05Å; R430-E447 PolarHBondContact NH2-OE1 3.41Å; R430-E447 IonicContact NH2-OE2 2.73Å; R430-E447 PolarHBondContact NH2-OE2 3.35Å
448	T	92.9	Very high	92.2	Very high	31 Å²	31	54.7 Å²	54.7	19%	0.19	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133	176.4	-58.6	0	0	0	0	109.6	S438 Q439 L450	S438-T448 CarbonylContact C-O 3.56Å; S438-T448 WeakPolarHBondContact CA-O 3.06Å; Q439-T448 PolarHBondContact N-O 3.11Å; Q439-T448 PolarHBondContact O-N 3.2Å; T448-L450 HydrophobicContact CG2-CD2 4.22Å
449	N	95.3	Very high	92	Very high	39 Å²	39	57.9 Å²	57.9	21%	0.209	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.7	174	-175.2	2.8	0	0	0	109.4	V437 G451 T473	V437-N449 PolarHBondContact O-OD1 2.78Å; V437-N449 VanDerWaalsContact O-OD1 3.12Å; N449-G451 VanDerWaalsContact OD1-C 3.32Å; N449-G451 PolarHBondContact OD1-N 2.98Å; N449-G451 PolarHBondContact OD1-O 3.11Å; N449-T473 WeakPolarHBondContact CB-OG1 3.42Å; N449-T473 PolarHBondContact N-OG1 3.19Å; N449-T473 VanDerWaalsContact N-OG1 3.16Å; N449-T473 PolarHBondContact O-N 3.28Å; N449-T473 PolarHBondContact O-OG1 3.39Å
450	L	94.1	Very high	91.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-2.5	177.1	-53	-168.8	0	0	0	113.2	Y429 V437 Q439 T448 R481 S482 T483 Y506	Y429-L450 HydrophobicContact CD1-CD1 3.78Å; Y429-L450 HydrophobicContact CE1-CD1 3.84Å; V437-L450 HydrophobicContact CB-CB 4.17Å; V437-L450 HydrophobicContact CG1-CB 4.05Å; V437-L450 HydrophobicContact CG1-CD1 4.16Å; V437-L450 HydrophobicContact CG1-CG 4.45Å; V437-L450 PolarHBondContact O-N 2.78Å; Q439-L450 HydrophobicContact CB-CD1 3.91Å; Q439-L450 HydrophobicContact CB-CD2 3.86Å; Q439-L450 HydrophobicContact CB-CG 3.91Å; T448-L450 HydrophobicContact CG2-CD2 4.22Å; L450-R481 CarbonylContact O-C 3.55Å; L450-S482 CarbonylContact O-C 3.44Å; L450-S482 WeakPolarHBondContact O-CA 3.45Å; L450-S482 PolarHBondContact O-N 2.92Å; L450-T483 VanDerWaalsContact CB-OG1 3.24Å; L450-T483 WeakPolarHBondContact CB-OG1 3.35Å; L450-T483 PolarHBondContact O-N 3.38Å; L450-T483 PolarHBondContact O-OG1 2.9Å; L450-Y506 HydrophobicContact CB-CD2 4.16Å; L450-Y506 HydrophobicContact CD1-CD1 4.09Å; L450-Y506 HydrophobicContact CD1-CD2 3.9Å; L450-Y506 HydrophobicContact CD1-CE1 4.45Å; L450-Y506 HydrophobicContact CD1-CE2 4.29Å; L450-Y506 HydrophobicContact CD1-CG 3.81Å; L450-Y506 HydrophobicContact CD2-CD2 4.03Å; L450-Y506 HydrophobicContact CD2-CE2 3.71Å; L450-Y506 HydrophobicContact CG-CD2 4.26Å; L450-Y506 HydrophobicContact CG-CE2 4.43Å
451	G	95.6	Very high	90.9	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150	139	174.6	0	0	0	0	0	112.3	K436 V437 N449 E470	K436-G451 CarbonylContact C-O 3.52Å; K436-G451 VanDerWaalsContact CA-O 3.32Å; K436-G451 WeakPolarHBondContact CA-O 3.35Å; V437-G451 PolarHBondContact N-O 3.43Å; N449-G451 VanDerWaalsContact OD1-C 3.32Å; N449-G451 PolarHBondContact OD1-N 2.98Å; N449-G451 PolarHBondContact OD1-O 3.11Å; G451-E470 CarbonylContact C-O 3.56Å; G451-E470 VanDerWaalsContact CA-O 3.23Å; G451-E470 WeakPolarHBondContact CA-O 3.4Å
452	T	96.1	Very high	90.6	Very high	54 Å²	54	68.2 Å²	68.2	33%	0.331	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	156.2	163.2	57.5	0	0	0	0	110	N435 G454 Y469 E470	N435-T452 WeakPolarHBondContact O-CA 3.43Å; T452-G454 PolarHBondContact O-N 2.8Å; T452-Y469 CarbonylContact O-C 3.17Å; T452-Y469 WeakPolarHBondContact O-CA 3.42Å; T452-Y469 WeakPolarHBondContact O-CB 3.38Å; T452-E470 PolarHBondContact N-O 2.87Å; T452-E470 PolarHBondContact O-N 2.82Å; T452-E470 PolarHBondContact OG1-O 3.22Å
453	W	95.5	Very high	90.6	Very high	41 Å²	41	67.3 Å²	67.3	16%	0.155	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	123.9	179.7	164	-114.7	0	0	0	111.4	F404 F434 N435 K455 W456 M467 Y469	F404-W453 AromaticContact CD1-NE1 3.9Å; F404-W453 AromaticContact CE1-CD1 3.8Å; F404-W453 AromaticContact CE1-NE1 3.85Å; F434-W453 VanDerWaalsContact C-CB 3.43Å; F434-W453 HydrophobicContact CB-CG 4.47Å; F434-W453 HydrophobicContact CD1-CD2 4.26Å; F434-W453 AromaticContact CD1-CE2 3.67Å; F434-W453 HydrophobicContact CD1-CH2 4.47Å; F434-W453 AromaticContact CD1-CZ2 3.78Å; F434-W453 HydrophobicContact CD1-CZ2 3.78Å; F434-W453 AromaticContact CD1-NE1 3.81Å; F434-W453 HydrophobicContact CE1-CH2 4.32Å; F434-W453 AromaticContact CE1-CZ2 3.88Å; F434-W453 HydrophobicContact CE1-CZ2 3.88Å; N435-W453 PolarHBondContact O-N 2.78Å; W453-K455 VanDerWaalsContact CZ3-C 3.48Å; W453-K455 WeakPolarHBondContact CZ3-O 3.49Å; W453-W456 AromaticContact CH2-CD2 3.81Å; W453-W456 HydrophobicContact CH2-CD2 3.81Å; W453-W456 AromaticContact CH2-CE2 3.85Å; W453-W456 HydrophobicContact CH2-CE3 4.36Å; W453-W456 AromaticContact CH2-CG 3.99Å; W453-W456 HydrophobicContact CH2-CG 3.99Å; W453-W456 HydrophobicContact CH2-CZ2 4.45Å; W453-W456 AromaticContact CH2-NE1 3.97Å; W453-M467 HydrophobicContact CE3-CB 4.36Å; W453-M467 HydrophobicContact CE3-CE 3.95Å; W453-M467 HydrophobicContact CH2-CB 4.5Å; W453-M467 HydrophobicContact CH2-CE 3.83Å; W453-M467 HydrophobicContact CH2-CG 4.16Å; W453-M467 HydrophobicContact CZ2-CE 4.44Å; W453-M467 HydrophobicContact CZ3-CB 3.62Å; W453-M467 HydrophobicContact CZ3-CE 3.59Å; W453-M467 HydrophobicContact CZ3-CG 3.68Å; W453-M467 HydrophobicContact CZ3-SD 4.41Å; W453-Y469 VanDerWaalsContact CA-CD1 3.49Å; W453-Y469 HydrophobicContact CB-CD1 4.06Å; W453-Y469 HydrophobicContact CB-CE1 3.82Å; W453-Y469 HydrophobicContact CE3-CE1 4.2Å; W453-Y469 HydrophobicContact CE3-CE2 4.31Å; W453-Y469 AromaticContact CE3-CZ 3.96Å
454	G	93.7	Very high	90.9	Very high	36 Å²	36	60.2 Å²	60.2	37%	0.371	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-73	175.1	0	0	0	0	0	111.8	T452 K468	T452-G454 PolarHBondContact O-N 2.8Å; G454-K468 PolarHBondContact N-O 3.42Å
455	K	94.1	Very high	91.4	Very high	123 Å²	123	58.4 Å²	58.4	54%	0.535	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	165.9	-171.4	59.1	-173.7	171.5	-166.6	0	114.1	W453 K468	W453-K455 VanDerWaalsContact CZ3-C 3.48Å; W453-K455 WeakPolarHBondContact CZ3-O 3.49Å; K455-K468 PolarHBondContact N-O 2.93Å; K455-K468 PolarHBondContact O-N 3.05Å
456	W	95.1	Very high	92	Very high	28 Å²	28	56.8 Å²	56.8	11%	0.106	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	140.4	161.8	-60	111.5	0	0	0	110.8	D405 F412 F434 W453 Y464 V466 M467 L487	D405-W456 PolarHBondContact O-NE1 2.91Å; D405-W456 VanDerWaalsContact OD2-CD1 3.3Å; F412-W456 HydrophobicContact CB-CH2 4.33Å; F412-W456 HydrophobicContact CB-CZ2 4.31Å; F412-W456 HydrophobicContact CD1-CH2 4.11Å; F412-W456 AromaticContact CD2-CH2 3.64Å; F412-W456 HydrophobicContact CD2-CH2 3.64Å; F412-W456 AromaticContact CD2-CZ2 3.73Å; F412-W456 HydrophobicContact CD2-CZ2 3.73Å; F412-W456 HydrophobicContact CE1-CH2 4.36Å; F412-W456 AromaticContact CE2-CH2 3.94Å; F412-W456 HydrophobicContact CE2-CH2 3.94Å; F412-W456 HydrophobicContact CE2-CZ2 4.29Å; F412-W456 AromaticContact CG-CH2 3.75Å; F412-W456 HydrophobicContact CG-CH2 3.75Å; F412-W456 HydrophobicContact CG-CZ2 4.05Å; F412-W456 HydrophobicContact CZ-CH2 4.28Å; F434-W456 AromaticContact CE1-CZ2 3.7Å; F434-W456 HydrophobicContact CE1-CZ2 3.7Å; F434-W456 HydrophobicContact CZ-CH2 4.21Å; F434-W456 AromaticContact CZ-CZ2 3.67Å; F434-W456 HydrophobicContact CZ-CZ2 3.67Å; W453-W456 AromaticContact CH2-CD2 3.81Å; W453-W456 HydrophobicContact CH2-CD2 3.81Å; W453-W456 AromaticContact CH2-CE2 3.85Å; W453-W456 HydrophobicContact CH2-CE3 4.36Å; W453-W456 AromaticContact CH2-CG 3.99Å; W453-W456 HydrophobicContact CH2-CG 3.99Å; W453-W456 HydrophobicContact CH2-CZ2 4.45Å; W453-W456 AromaticContact CH2-NE1 3.97Å; W456-Y464 AromaticContact CD1-CD1 3.92Å; W456-Y464 AromaticContact CD1-CE1 3.62Å; W456-Y464 AromaticContact CD2-CD1 3.56Å; W456-Y464 HydrophobicContact CD2-CD1 3.56Å; W456-Y464 HydrophobicContact CD2-CE1 4.08Å; W456-Y464 AromaticContact CE2-CD1 3.55Å; W456-Y464 AromaticContact CE2-CE1 3.88Å; W456-Y464 AromaticContact CE3-CD1 3.99Å; W456-Y464 HydrophobicContact CE3-CD1 3.99Å; W456-Y464 AromaticContact CG-CD1 3.83Å; W456-Y464 HydrophobicContact CG-CD1 3.83Å; W456-Y464 AromaticContact CG-CE1 3.94Å; W456-Y464 HydrophobicContact CG-CE1 3.94Å; W456-Y464 HydrophobicContact CH2-CD1 4.34Å; W456-Y464 AromaticContact CZ2-CD1 3.96Å; W456-Y464 HydrophobicContact CZ2-CD1 3.96Å; W456-Y464 HydrophobicContact CZ3-CD1 4.34Å; W456-Y464 VanDerWaalsContact CZ3-O 3.27Å; W456-Y464 WeakPolarHBondContact CZ3-O 3.23Å; W456-Y464 AromaticContact NE1-CD1 3.79Å; W456-Y464 AromaticContact NE1-CE1 3.61Å; W456-V466 WeakPolarHBondContact CA-O 2.95Å; W456-M467 HydrophobicContact CD2-CG 4.47Å; W456-M467 HydrophobicContact CE3-CG 3.61Å; W456-M467 HydrophobicContact CH2-CE 3.95Å; W456-M467 HydrophobicContact CH2-CG 3.8Å; W456-M467 HydrophobicContact CH2-SD 4.11Å; W456-M467 HydrophobicContact CZ2-CE 4.23Å; W456-M467 HydrophobicContact CZ3-CE 4.35Å; W456-M467 HydrophobicContact CZ3-CG 3.23Å; W456-M467 HydrophobicContact CZ3-SD 4.09Å; W456-L487 HydrophobicContact CZ3-CD1 4.28Å; W456-L487 HydrophobicContact CZ3-CD2 4.38Å
457	A	94.1	Very high	92.4	Very high	46 Å²	46	52.1 Å²	52.1	38%	0.38	28%	0.284	S	S	.	.			trans	-150.5	24	-169.3	0	0	0	0	0	113.7	V466 K468	A457-V466 HydrophobicContact CB-CG1 4.49Å; A457-V466 PolarHBondContact N-O 3.26Å; A457-K468 HydrophobicContact CB-CB 3.86Å
458	G	90.8	Very high	92.5	Very high	17 Å²	17	51.6 Å²	51.6	18%	0.175	28%	0.28	C	S	.	.			trans	-72	174.6	172.3	0	0	0	0	0	112.9	I463	G458-I463 WeakPolarHBondContact CA-O 3.39Å; G458-I463 PolarHBondContact N-O 2.04Å
459	P	89.8	Confident	92.7	Very high	69 Å²	69	50.1 Å²	50.1	45%	0.448	27%	0.271	S	S	.	.			trans	-66.1	164	174.2	32.8	-37.4	0	0	0	111.6	D461 N462 I463 S465	P459-D461 VanDerWaalsContact CB-OD1 3.29Å; P459-D461 WeakPolarHBondContact CB-OD1 3.08Å; P459-D461 VanDerWaalsContact CG-OD1 3.25Å; P459-D461 WeakPolarHBondContact CG-OD1 3.21Å; P459-D461 PolarHBondContact O-N 3.01Å; P459-D461 VanDerWaalsContact O-N 3.12Å; P459-N462 CarbonylContact O-C 3.57Å; P459-N462 PolarHBondContact O-N 2.99Å; P459-I463 WeakPolarHBondContact O-CG2 3.08Å; P459-I463 PolarHBondContact O-N 3.27Å; P459-S465 WeakPolarHBondContact CD-OG 3.36Å
460	E	83.6	Confident	92.7	Very high	199 Å²	199	50.5 Å²	50.5	93%	0.93	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.1	-171.8	-61.8	-175.7	168.7	0	0	114.2
461	D	82.6	Confident	92.7	Very high	141 Å²	141	57.1 Å²	57.1	75%	0.754	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-22.8	176.1	64.3	-60.8	0	0	0	113.6	P459	P459-D461 VanDerWaalsContact CB-OD1 3.29Å; P459-D461 WeakPolarHBondContact CB-OD1 3.08Å; P459-D461 VanDerWaalsContact CG-OD1 3.25Å; P459-D461 WeakPolarHBondContact CG-OD1 3.21Å; P459-D461 PolarHBondContact O-N 3.01Å; P459-D461 VanDerWaalsContact O-N 3.12Å
462	N	85.6	Confident	92.5	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.193	30%	0.304	C	S	.	.			trans	-155.2	69.8	-179.5	-168.3	-3.9	0	0	0	112.5	P459 Y464 S465	P459-N462 CarbonylContact O-C 3.57Å; P459-N462 PolarHBondContact O-N 2.99Å; N462-Y464 PolarHBondContact O-N 3.16Å; N462-Y464 VanDerWaalsContact O-N 3.08Å; N462-S465 WeakPolarHBondContact O-CB 3.44Å; N462-S465 PolarHBondContact O-N 2.66Å; N462-S465 PolarHBondContact O-OG 2.85Å; N462-S465 PolarHBondContact OD1-N 2.83Å
463	I	91.3	Very high	92.3	Very high	72 Å²	72	58 Å²	58	37%	0.369	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-57.4	-26.6	-179	65.4	176	0	0	0	113.3	G458 P459 S465	G458-I463 WeakPolarHBondContact CA-O 3.39Å; G458-I463 PolarHBondContact N-O 2.04Å; P459-I463 WeakPolarHBondContact O-CG2 3.08Å; P459-I463 PolarHBondContact O-N 3.27Å; I463-S465 VanDerWaalsContact C-N 3.3Å; I463-S465 PolarHBondContact O-N 2.95Å
464	Y	92.7	Very high	92.1	Very high	43 Å²	43	58.1 Å²	58.1	17%	0.169	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-80	-5	-179.4	-61.8	-74.1	0	0	0	114.2	D405 P408 F412 W456 N462 V466	D405-Y464 PolarHBondContact OD1-OH 2.77Å; D405-Y464 WeakPolarHBondContact OD2-CE1 3.22Å; D405-Y464 PolarHBondContact OD2-OH 2.03Å; P408-Y464 HydrophobicContact CG-CE2 4.33Å; F412-Y464 HydrophobicContact CD2-CD1 4.41Å; F412-Y464 AromaticContact CE2-CD1 3.98Å; F412-Y464 HydrophobicContact CE2-CD1 3.98Å; F412-Y464 HydrophobicContact CE2-CG 4.05Å; W456-Y464 AromaticContact CD1-CD1 3.92Å; W456-Y464 AromaticContact CD1-CE1 3.62Å; W456-Y464 AromaticContact CD2-CD1 3.56Å; W456-Y464 HydrophobicContact CD2-CD1 3.56Å; W456-Y464 HydrophobicContact CD2-CE1 4.08Å; W456-Y464 AromaticContact CE2-CD1 3.55Å; W456-Y464 AromaticContact CE2-CE1 3.88Å; W456-Y464 AromaticContact CE3-CD1 3.99Å; W456-Y464 HydrophobicContact CE3-CD1 3.99Å; W456-Y464 AromaticContact CG-CD1 3.83Å; W456-Y464 HydrophobicContact CG-CD1 3.83Å; W456-Y464 AromaticContact CG-CE1 3.94Å; W456-Y464 HydrophobicContact CG-CE1 3.94Å; W456-Y464 HydrophobicContact CH2-CD1 4.34Å; W456-Y464 AromaticContact CZ2-CD1 3.96Å; W456-Y464 HydrophobicContact CZ2-CD1 3.96Å; W456-Y464 HydrophobicContact CZ3-CD1 4.34Å; W456-Y464 VanDerWaalsContact CZ3-O 3.27Å; W456-Y464 WeakPolarHBondContact CZ3-O 3.23Å; W456-Y464 AromaticContact NE1-CD1 3.79Å; W456-Y464 AromaticContact NE1-CE1 3.61Å; N462-Y464 PolarHBondContact O-N 3.16Å; N462-Y464 VanDerWaalsContact O-N 3.08Å; Y464-V466 VanDerWaalsContact C-N 3.26Å; Y464-V466 PolarHBondContact O-N 2.82Å
465	S	93.1	Very high	91.8	Very high	20 Å²	20	57 Å²	57	14%	0.14	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-73.8	-12.8	176.1	62.3	0	0	0	0	114.2	P459 N462 I463 L487	P459-S465 WeakPolarHBondContact CD-OG 3.36Å; N462-S465 WeakPolarHBondContact O-CB 3.44Å; N462-S465 PolarHBondContact O-N 2.66Å; N462-S465 PolarHBondContact O-OG 2.85Å; N462-S465 PolarHBondContact OD1-N 2.83Å; I463-S465 VanDerWaalsContact C-N 3.3Å; I463-S465 PolarHBondContact O-N 2.95Å; S465-L487 PolarHBondContact O-N 3.26Å
466	V	95.9	Very high	91.3	Very high	23 Å²	23	60.7 Å²	60.7	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	127.4	179.9	-174.5	0	0	0	0	111	W456 A457 Y464 T484 V485 K486	W456-V466 WeakPolarHBondContact CA-O 2.95Å; A457-V466 HydrophobicContact CB-CG1 4.49Å; A457-V466 PolarHBondContact N-O 3.26Å; Y464-V466 VanDerWaalsContact C-N 3.26Å; Y464-V466 PolarHBondContact O-N 2.82Å; V466-T484 HydrophobicContact CG1-CG2 3.44Å; V466-T484 VanDerWaalsContact CG1-CG2 3.44Å; V466-V485 WeakPolarHBondContact CA-O 3Å; V466-K486 HydrophobicContact CG2-CG 4.34Å
467	M	95.7	Very high	90.7	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130	168.3	-70.9	178	108.1	0	0	109.7	P433 F434 W453 W456 Y469 V485 L487	P433-M467 HydrophobicContact CB-CE 4.25Å; F434-M467 HydrophobicContact CD1-CE 3.88Å; F434-M467 HydrophobicContact CD2-CE 4.24Å; F434-M467 HydrophobicContact CE1-CE 3.59Å; F434-M467 HydrophobicContact CE2-CE 3.98Å; F434-M467 HydrophobicContact CG-CE 4.19Å; F434-M467 HydrophobicContact CZ-CE 3.63Å; W453-M467 HydrophobicContact CE3-CB 4.36Å; W453-M467 HydrophobicContact CE3-CE 3.95Å; W453-M467 HydrophobicContact CH2-CB 4.5Å; W453-M467 HydrophobicContact CH2-CE 3.83Å; W453-M467 HydrophobicContact CH2-CG 4.16Å; W453-M467 HydrophobicContact CZ2-CE 4.44Å; W453-M467 HydrophobicContact CZ3-CB 3.62Å; W453-M467 HydrophobicContact CZ3-CE 3.59Å; W453-M467 HydrophobicContact CZ3-CG 3.68Å; W453-M467 HydrophobicContact CZ3-SD 4.41Å; W456-M467 HydrophobicContact CD2-CG 4.47Å; W456-M467 HydrophobicContact CE3-CG 3.61Å; W456-M467 HydrophobicContact CH2-CE 3.95Å; W456-M467 HydrophobicContact CH2-CG 3.8Å; W456-M467 HydrophobicContact CH2-SD 4.11Å; W456-M467 HydrophobicContact CZ2-CE 4.23Å; W456-M467 HydrophobicContact CZ3-CE 4.35Å; W456-M467 HydrophobicContact CZ3-CG 3.23Å; W456-M467 HydrophobicContact CZ3-SD 4.09Å; M467-Y469 HydrophobicContact CB-CD2 4.44Å; M467-Y469 HydrophobicContact CB-CE2 3.63Å; M467-Y469 WeakPolarHBondContact CE-OH 3.46Å; M467-Y469 HydrophobicContact SD-CE2 4.5Å; M467-Y469 PolarHBondContact SD-OH 3.41Å; M467-V485 HydrophobicContact CB-CB 4.23Å; M467-V485 PolarHBondContact N-O 3.03Å; M467-V485 PolarHBondContact O-N 2.97Å; M467-L487 HydrophobicContact CB-CD1 4.4Å; M467-L487 HydrophobicContact CG-CD1 3.85Å; M467-L487 HydrophobicContact SD-CD1 4.3Å
468	K	95.8	Very high	90.1	Very high	66 Å²	66	66.2 Å²	66.2	29%	0.287	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.2	175	-159	-176.6	-175.4	-161.5	0	111.2	G454 K455 A457 E470	G454-K468 PolarHBondContact N-O 3.42Å; K455-K468 PolarHBondContact N-O 2.93Å; K455-K468 PolarHBondContact O-N 3.05Å; A457-K468 HydrophobicContact CB-CB 3.86Å; K468-E470 HydrophobicContact CD-CG 4.03Å; K468-E470 WeakPolarHBondContact CD-OE1 3.38Å; K468-E470 WeakPolarHBondContact CE-OE1 3.35Å; K468-E470 HydrophobicContact CG-CG 4.04Å; K468-E470 IonicContact NZ-OE1 2.76Å; K468-E470 PolarHBondContact NZ-OE1 3.03Å
469	Y	96.4	Very high	90	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.3	174.7	-61.1	-104.1	0	0	0	108.9	L431 P433 V437 T452 W453 M467 S482 T483 V485	L431-Y469 HydrophobicContact CD1-CE2 4.22Å; P433-Y469 WeakPolarHBondContact CA-OH 3.04Å; V437-Y469 HydrophobicContact CG2-CD1 3.74Å; V437-Y469 HydrophobicContact CG2-CD2 3.93Å; V437-Y469 HydrophobicContact CG2-CE1 4.06Å; V437-Y469 HydrophobicContact CG2-CE2 4.24Å; V437-Y469 HydrophobicContact CG2-CG 3.71Å; T452-Y469 CarbonylContact O-C 3.17Å; T452-Y469 WeakPolarHBondContact O-CA 3.42Å; T452-Y469 WeakPolarHBondContact O-CB 3.38Å; W453-Y469 VanDerWaalsContact CA-CD1 3.49Å; W453-Y469 HydrophobicContact CB-CD1 4.06Å; W453-Y469 HydrophobicContact CB-CE1 3.82Å; W453-Y469 HydrophobicContact CE3-CE1 4.2Å; W453-Y469 HydrophobicContact CE3-CE2 4.31Å; W453-Y469 AromaticContact CE3-CZ 3.96Å; M467-Y469 HydrophobicContact CB-CD2 4.44Å; M467-Y469 HydrophobicContact CB-CE2 3.63Å; M467-Y469 WeakPolarHBondContact CE-OH 3.46Å; M467-Y469 HydrophobicContact SD-CE2 4.5Å; M467-Y469 PolarHBondContact SD-OH 3.41Å; Y469-S482 WeakPolarHBondContact O-CA 3.4Å; Y469-S482 WeakPolarHBondContact O-CB 3.14Å; Y469-T483 PolarHBondContact N-O 3.23Å; Y469-T483 PolarHBondContact O-N 3.43Å; Y469-V485 HydrophobicContact CD2-CG2 3.79Å; Y469-V485 HydrophobicContact CE2-CB 4.25Å; Y469-V485 HydrophobicContact CE2-CG2 3.51Å
470	E	95.1	Very high	90	Very high	47 Å²	47	70.6 Å²	70.6	22%	0.22	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	177.8	-169.9	-59.9	-176.4	120.7	0	0	109.1	G451 T452 K468 G472	G451-E470 CarbonylContact C-O 3.56Å; G451-E470 VanDerWaalsContact CA-O 3.23Å; G451-E470 WeakPolarHBondContact CA-O 3.4Å; T452-E470 PolarHBondContact N-O 2.87Å; T452-E470 PolarHBondContact O-N 2.82Å; T452-E470 PolarHBondContact OG1-O 3.22Å; K468-E470 HydrophobicContact CD-CG 4.03Å; K468-E470 WeakPolarHBondContact CD-OE1 3.38Å; K468-E470 WeakPolarHBondContact CE-OE1 3.35Å; K468-E470 HydrophobicContact CG-CG 4.04Å; K468-E470 IonicContact NZ-OE1 2.76Å; K468-E470 PolarHBondContact NZ-OE1 3.03Å; E470-G472 VanDerWaalsContact C-N 3.26Å; E470-G472 PolarHBondContact O-N 2.84Å; E470-G472 VanDerWaalsContact O-N 3.11Å
471	H	93.5	Very high	90.6	Very high	138 Å²	138	63.3 Å²	63.3	64%	0.639	33%	0.333	S	S	*	.			trans	54.4	34	176.1	-44.6	102	0	0	0	115.4
472	G	92	Very high	91.2	Very high	4 Å²	4	57.7 Å²	57.7	4%	0.041	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-71.4	173.3	169.3	0	0	0	0	0	112.4	E470 G474 N480 R481	E470-G472 VanDerWaalsContact C-N 3.26Å; E470-G472 PolarHBondContact O-N 2.84Å; E470-G472 VanDerWaalsContact O-N 3.11Å; G472-G474 PolarHBondContact O-N 2.68Å; G472-N480 WeakPolarHBondContact O-CB 3.32Å; G472-R481 WeakPolarHBondContact CA-O 3.11Å; G472-R481 PolarHBondContact N-O 3.02Å
473	T	92.1	Very high	91.7	Very high	68 Å²	68	56 Å²	56	42%	0.417	30%	0.295	S	S	.	.	S	Bend	trans	-52.1	135.4	-178.4	-56.9	0	0	0	0	111	N449 C475 R481	N449-T473 WeakPolarHBondContact CB-OG1 3.42Å; N449-T473 PolarHBondContact N-OG1 3.19Å; N449-T473 VanDerWaalsContact N-OG1 3.16Å; N449-T473 PolarHBondContact O-N 3.28Å; N449-T473 PolarHBondContact O-OG1 3.39Å; T473-C475 PolarHBondContact O-N 3.08Å; T473-R481 VanDerWaalsContact O-CG 3.28Å; T473-R481 WeakPolarHBondContact O-CG 3.49Å; T473-R481 PolarHBondContact O-N 2.73Å; T473-R481 PolarHBondContact O-NH1 3.08Å
474	G	90.6	Very high	91.9	Very high	44 Å²	44	54.8 Å²	54.8	45%	0.454	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-51.4	131.9	-178.9	0	0	0	0	0	113.6	G472 N480 R481	G472-G474 PolarHBondContact O-N 2.68Å; G474-N480 WeakPolarHBondContact CA-OD1 3.5Å; G474-R481 PolarHBondContact O-NH1 3.27Å
475	C	88.8	Confident	92.1	Very high	14 Å²	14	52.7 Å²	52.7	10%	0.095	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-84.9	133.2	177.3	-167.2	0	0	0	0	110	T473 Q477 G478 P479 C504	T473-C475 PolarHBondContact O-N 3.08Å; C475-Q477 PolarHBondContact O-N 2.97Å; C475-Q477 VanDerWaalsContact O-N 3.09Å; C475-G478 PolarHBondContact O-N 2.87Å; C475-G478 VanDerWaalsContact O-N 3.17Å; C475-P479 WeakPolarHBondContact CB-O 3.45Å; C475-P479 PolarHBondContact N-O 2.55Å; C475-C504 HydrophobicContact CB-CB 3.58Å; C475-C504 WeakPolarHBondContact CB-SG 3.39Å; C475-C504 WeakPolarHBondContact SG-CB 3.3Å; C475-C504 CovalentContact SG-SG 2.04Å; C475-C504 PolarHBondContact SG-SG 2.85Å
476	W	83.9	Confident	92.3	Very high	199 Å²	199	56.2 Å²	56.2	75%	0.754	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	120.1	170.5	-179.1	-97.2	0	0	0	108.9	G478 R503	W476-G478 VanDerWaalsContact C-N 3.29Å; W476-G478 PolarHBondContact O-N 3.46Å; W476-R503 PolarHBondContact O-NH2 3.05Å
477	Q	82.3	Confident	92.2	Very high	155 Å²	155	55.8 Å²	55.8	72%	0.724	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	41.4	-176.2	-58.7	168.5	-24	0	0	113.8	C475	C475-Q477 PolarHBondContact O-N 2.97Å; C475-Q477 VanDerWaalsContact O-N 3.09Å
478	G	80.6	Confident	92.2	Very high	35 Å²	35	58.4 Å²	58.4	36%	0.361	31%	0.309	S	S	.	.	S	Bend	trans	-156.6	177.1	175.1	0	0	0	0	0	112.2	C475 W476	C475-G478 PolarHBondContact O-N 2.87Å; C475-G478 VanDerWaalsContact O-N 3.17Å; W476-G478 VanDerWaalsContact C-N 3.29Å; W476-G478 PolarHBondContact O-N 3.46Å
479	P	87.8	Confident	92.1	Very high	88 Å²	88	57.8 Å²	57.8	57%	0.571	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-65.8	170.2	173.4	30.8	-36.2	0	0	0	111.7	C475 R481	C475-P479 WeakPolarHBondContact CB-O 3.45Å; C475-P479 PolarHBondContact N-O 2.55Å; P479-R481 PolarHBondContact O-N 3.02Å
480	N	91.8	Very high	91.9	Very high	91 Å²	91	57.9 Å²	57.9	49%	0.487	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-55.3	138.8	167.1	-74.4	-11.9	0	0	0	110.3	G472 G474 S482	G472-N480 WeakPolarHBondContact O-CB 3.32Å; G474-N480 WeakPolarHBondContact CA-OD1 3.5Å; N480-S482 PolarHBondContact O-N 3.36Å
481	R	94.2	Very high	91.7	Very high	45 Å²	45	59.8 Å²	59.8	17%	0.17	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-56.8	139.7	-178.3	-76.7	173.7	-178	83.1	-6.3	110.6	L450 G472 T473 G474 P479 C504 Y506	L450-R481 CarbonylContact O-C 3.55Å; G472-R481 WeakPolarHBondContact CA-O 3.11Å; G472-R481 PolarHBondContact N-O 3.02Å; T473-R481 VanDerWaalsContact O-CG 3.28Å; T473-R481 WeakPolarHBondContact O-CG 3.49Å; T473-R481 PolarHBondContact O-N 2.73Å; T473-R481 PolarHBondContact O-NH1 3.08Å; G474-R481 PolarHBondContact O-NH1 3.27Å; P479-R481 PolarHBondContact O-N 3.02Å; R481-C504 WeakPolarHBondContact CA-O 2.97Å; R481-C504 HydrophobicContact CG-CB 3.74Å; R481-Y506 HydrophobicContact CG-CE2 4.18Å
482	S	95.4	Very high	91.6	Very high	23 Å²	23	59.9 Å²	59.9	16%	0.161	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.8	176.5	67.7	0	0	0	0	110.9	L450 Y469 N480 C504 Y506	L450-S482 CarbonylContact O-C 3.44Å; L450-S482 WeakPolarHBondContact O-CA 3.45Å; L450-S482 PolarHBondContact O-N 2.92Å; Y469-S482 WeakPolarHBondContact O-CA 3.4Å; Y469-S482 WeakPolarHBondContact O-CB 3.14Å; N480-S482 PolarHBondContact O-N 3.36Å; S482-C504 PolarHBondContact N-O 3.12Å; S482-C504 VanDerWaalsContact N-O 3.12Å; S482-Y506 PolarHBondContact O-N 2.83Å
483	T	96.3	Very high	91.8	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.9	177.6	-54.8	0	0	0	0	110.7	V437 L450 Y469 V485 Y506 I508	V437-T483 HydrophobicContact CB-CG2 4.47Å; V437-T483 HydrophobicContact CG1-CG2 4.21Å; V437-T483 HydrophobicContact CG2-CG2 4.12Å; L450-T483 VanDerWaalsContact CB-OG1 3.24Å; L450-T483 WeakPolarHBondContact CB-OG1 3.35Å; L450-T483 PolarHBondContact O-N 3.38Å; L450-T483 PolarHBondContact O-OG1 2.9Å; Y469-T483 PolarHBondContact N-O 3.23Å; Y469-T483 PolarHBondContact O-N 3.43Å; T483-V485 HydrophobicContact CG2-CG2 4.01Å; T483-Y506 CarbonylContact C-O 3.42Å; T483-Y506 WeakPolarHBondContact CA-O 3.39Å; T483-I508 HydrophobicContact CG2-CD1 3.72Å; T483-I508 HydrophobicContact CG2-CG1 3.71Å
484	T	96.5	Very high	92	Very high	47 Å²	47	61.2 Å²	61.2	29%	0.288	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.5	168.4	-58.5	0	0	0	0	108.4	V466 Y506 L507 I508	V466-T484 HydrophobicContact CG1-CG2 3.44Å; V466-T484 VanDerWaalsContact CG1-CG2 3.44Å; T484-Y506 PolarHBondContact N-O 3.26Å; T484-L507 HydrophobicContact CG2-CD1 4.37Å; T484-L507 WeakPolarHBondContact O-CA 3.18Å; T484-I508 PolarHBondContact O-N 2.99Å
485	V	97.1	Very high	92.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.1	175.6	-173	0	0	0	0	108.5	L431 V466 M467 Y469 T483 I508 F510	L431-V485 HydrophobicContact CD1-CG2 4.06Å; L431-V485 HydrophobicContact CD2-CG1 3.9Å; L431-V485 HydrophobicContact CD2-CG2 4.45Å; V466-V485 WeakPolarHBondContact CA-O 3Å; M467-V485 HydrophobicContact CB-CB 4.23Å; M467-V485 PolarHBondContact N-O 3.03Å; M467-V485 PolarHBondContact O-N 2.97Å; Y469-V485 HydrophobicContact CD2-CG2 3.79Å; Y469-V485 HydrophobicContact CE2-CB 4.25Å; Y469-V485 HydrophobicContact CE2-CG2 3.51Å; T483-V485 HydrophobicContact CG2-CG2 4.01Å; V485-I508 CarbonylContact C-O 3.55Å; V485-I508 WeakPolarHBondContact CA-O 3.19Å; V485-I508 HydrophobicContact CG1-CB 4.28Å; V485-I508 HydrophobicContact CG1-CG2 4.33Å; V485-I508 HydrophobicContact CG2-CB 4.17Å; V485-F510 HydrophobicContact CG1-CB 3.57Å; V485-F510 HydrophobicContact CG1-CG 4.35Å
486	K	96.1	Very high	92.5	Very high	94 Å²	94	62.6 Å²	62.6	41%	0.409	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	129.7	175.2	-68.4	-178.5	-176.5	172.3	0	110	V466 L507 I508 F510	V466-K486 HydrophobicContact CG2-CG 4.34Å; K486-L507 HydrophobicContact CD-CD1 3.83Å; K486-L507 HydrophobicContact CG-CD1 3.85Å; K486-I508 PolarHBondContact N-O 2.59Å; K486-F510 PolarHBondContact O-N 3.14Å
487	L	95.1	Very high	93	Very high	13 Å²	13	54.8 Å²	54.8	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.5	179.1	-72.5	83.3	0	0	0	110.5	F412 W456 S465 M467 F510 I515	F412-L487 HydrophobicContact CD1-CD2 4.14Å; F412-L487 HydrophobicContact CE1-CD2 3.59Å; F412-L487 HydrophobicContact CZ-CD2 4.31Å; W456-L487 HydrophobicContact CZ3-CD1 4.28Å; W456-L487 HydrophobicContact CZ3-CD2 4.38Å; S465-L487 PolarHBondContact O-N 3.26Å; M467-L487 HydrophobicContact CB-CD1 4.4Å; M467-L487 HydrophobicContact CG-CD1 3.85Å; M467-L487 HydrophobicContact SD-CD1 4.3Å; L487-F510 CarbonylContact C-O 3.57Å; L487-F510 WeakPolarHBondContact CA-O 3.33Å; L487-F510 HydrophobicContact CG-CD1 4.31Å; L487-I515 HydrophobicContact CB-CB 4.14Å; L487-I515 HydrophobicContact CB-CG1 4.07Å; L487-I515 HydrophobicContact CB-CG2 4.17Å
488	T	94.1	Very high	93.6	Very high	56 Å²	56	48.8 Å²	48.8	34%	0.344	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.6	179.6	53.1	0	0	0	0	110.1	G490 F510 T511 S512 I515	T488-G490 PolarHBondContact O-N 3Å; T488-F510 PolarHBondContact N-O 2.62Å; T488-F510 PolarHBondContact OG1-O 3.22Å; T488-T511 WeakPolarHBondContact O-CA 3.46Å; T488-T511 WeakPolarHBondContact OG1-CA 3.06Å; T488-T511 PolarHBondContact OG1-OG1 2.79Å; T488-S512 PolarHBondContact O-N 3.11Å; T488-I515 WeakPolarHBondContact O-CG2 3.24Å
489	C	93.9	Very high	94.2	Very high	52 Å²	52	49.6 Å²	49.6	35%	0.351	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.8	-179.9	167.8	0	0	0	0	110.5	I515 C516	C489-I515 HydrophobicContact CB-CG2 4.19Å; C489-C516 WeakPolarHBondContact CA-SG 3.44Å; C489-C516 HydrophobicContact CB-CB 4.03Å; C489-C516 WeakPolarHBondContact CB-SG 3.3Å; C489-C516 VanDerWaalsContact SG-CA 3.54Å; C489-C516 WeakPolarHBondContact SG-CB 3.06Å; C489-C516 CovalentContact SG-SG 2.04Å; C489-C516 PolarHBondContact SG-SG 3.27Å
490	G	92.8	Very high	94.4	Very high	3 Å²	3	49.8 Å²	49.8	3%	0.031	27%	0.271	C	S	.	.			trans	-162.2	174.9	172.9	0	0	0	0	0	112.5	T488 S512 P513 C516	T488-G490 PolarHBondContact O-N 3Å; G490-S512 PolarHBondContact N-O 2.99Å; G490-S512 CarbonylContact O-C 3.49Å; G490-P513 WeakPolarHBondContact O-CA 3.25Å; G490-P513 VanDerWaalsContact O-N 3.14Å; G490-C516 PolarHBondContact N-SG 2.99Å
491	K	90.4	Very high	94.3	Very high	87 Å²	87	49.5 Å²	49.5	38%	0.378	28%	0.275	S	S	.	.	S	Bend	trans	-72.6	-38.5	-179.5	-177	-178.8	-170.1	151.4	0	113	E140 F144	E140-K491 IonicContact OE1-NZ 3.09Å; E140-K491 VanDerWaalsContact OE2-CD 3.27Å; E140-K491 WeakPolarHBondContact OE2-CD 3.34Å; E140-K491 WeakPolarHBondContact OE2-CE 3.49Å; E140-K491 IonicContact OE2-NZ 2.55Å; E140-K491 PolarHBondContact OE2-NZ 3.04Å; F144-K491 HydrophobicContact CE2-CG 4.46Å
492	E	92.5	Very high	94	Very high	139 Å²	139	49.9 Å²	49.9	65%	0.65	28%	0.284	S	S	*	.	S	Bend	trans	-113.6	159.9	-171.6	-64.9	178.5	-177.9	0	0	110.3	T511	E492-T511 CarbonylContact O-C 3.59Å
493	T	95.3	Very high	93.7	Very high	31 Å²	31	55.7 Å²	55.7	19%	0.19	30%	0.302	C	S	.	.			trans	-101.6	113.9	178.6	-49.2	0	0	0	0	109.5	Y414 L415 Y420 F510 T511 P513	Y414-T493 HydrophobicContact CE2-CG2 4.35Å; Y414-T493 WeakPolarHBondContact CE2-OG1 3.39Å; Y414-T493 PolarHBondContact OH-OG1 2.73Å; L415-T493 HydrophobicContact CD2-CG2 3.58Å; Y420-T493 HydrophobicContact CD1-CG2 4.33Å; Y420-T493 HydrophobicContact CE1-CG2 3.55Å; Y420-T493 WeakPolarHBondContact CE1-O 3.45Å; Y420-T493 HydrophobicContact CE2-CG2 4.04Å; Y420-T493 WeakPolarHBondContact OH-CG2 3.25Å; T493-F510 HydrophobicContact CG2-CE1 3.96Å; T493-F510 HydrophobicContact CG2-CE2 3.92Å; T493-F510 HydrophobicContact CG2-CZ 3.32Å; T493-T511 VanDerWaalsContact CA-O 3.27Å; T493-T511 WeakPolarHBondContact CA-O 3.26Å; T493-P513 WeakPolarHBondContact OG1-CD 3.14Å
494	V	95.9	Very high	93.3	Very high	69 Å²	69	56 Å²	56	42%	0.418	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	148.2	-171.2	64.7	0	0	0	0	111.8	F510 T511	V494-F510 VanDerWaalsContact O-CD2 3.23Å; V494-F510 WeakPolarHBondContact O-CD2 3.38Å; V494-T511 PolarHBondContact N-O 3.36Å; V494-T511 PolarHBondContact O-N 2.9Å
495	V	95.8	Very high	93.2	Very high	8 Å²	8	57.9 Å²	57.9	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.2	167.5	177.2	0	0	0	0	108.4	L422 L431 T498 I508 F510	L422-V495 HydrophobicContact CB-CB 4.09Å; L422-V495 HydrophobicContact CB-CG1 3.71Å; L422-V495 HydrophobicContact CD2-CG1 4.1Å; L422-V495 HydrophobicContact CG-CG1 4.45Å; L431-V495 HydrophobicContact CB-CG2 4.16Å; L431-V495 HydrophobicContact CD2-CG2 3.95Å; V495-T498 HydrophobicContact CG1-CG2 4.1Å; V495-I508 HydrophobicContact CG1-CG2 3.54Å; V495-I508 HydrophobicContact CG2-CG2 4.44Å; V495-F510 HydrophobicContact CG2-CD2 3.73Å; V495-F510 HydrophobicContact CG2-CE2 4.11Å
496	T	94.2	Very high	93	Very high	79 Å²	79	58.6 Å²	58.6	49%	0.485	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-37.8	-170.7	-62.2	0	0	0	0	112	E509 T511	T496-E509 PolarHBondContact N-O 3.03Å; T496-T511 PolarHBondContact OG1-OG1 3.25Å
497	S	94.4	Very high	93	Very high	35 Å²	35	55.7 Å²	55.7	25%	0.245	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161.1	175.6	90.1	0	0	0	0	112.5	I508 E509	S497-I508 WeakPolarHBondContact O-CA 3.39Å; S497-E509 WeakPolarHBondContact CB-OE2 3.42Å; S497-E509 PolarHBondContact N-O 2.99Å; S497-E509 PolarHBondContact O-N 3.1Å; S497-E509 WeakPolarHBondContact OG-CB 3.11Å; S497-E509 VanDerWaalsContact OG-CD 3.26Å; S497-E509 WeakPolarHBondContact OG-CG 3.49Å; S497-E509 PolarHBondContact OG-OE2 2.97Å
498	T	94.8	Very high	93.1	Very high	29 Å²	29	55.2 Å²	55.2	18%	0.178	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	134	176.1	54	0	0	0	0	109.6	L422 T424 Y429 V495 L507 I508	L422-T498 HydrophobicContact CB-CG2 4.44Å; L422-T498 HydrophobicContact CD2-CG2 3.77Å; T424-T498 WeakPolarHBondContact CG2-OG1 3.3Å; Y429-T498 HydrophobicContact CD1-CG2 4.37Å; Y429-T498 HydrophobicContact CD2-CG2 4Å; Y429-T498 HydrophobicContact CG-CG2 3.88Å; V495-T498 HydrophobicContact CG1-CG2 4.1Å; T498-L507 CarbonylContact C-O 3.43Å; T498-L507 WeakPolarHBondContact CA-O 3.42Å; T498-I508 HydrophobicContact CG2-CD1 4.29Å; T498-I508 HydrophobicContact CG2-CG1 4.08Å; T498-I508 HydrophobicContact CG2-CG2 4.19Å
499	S	93.5	Very high	93.2	Very high	53 Å²	53	56.1 Å²	56.1	37%	0.371	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	158.4	178.6	56.7	0	0	0	0	111.7	P501 L507	S499-P501 WeakPolarHBondContact O-CD 3.28Å; S499-L507 PolarHBondContact N-O 3.45Å; S499-L507 PolarHBondContact O-N 3.49Å; S499-L507 PolarHBondContact OG-O 3.44Å
500	E	91.7	Very high	93.3	Very high	91 Å²	91	53.7 Å²	53.7	43%	0.425	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	84.5	172.2	-174	171.2	166	0	0	108.2	S502 R503 C504 Y506	E500-S502 VanDerWaalsContact C-N 3.31Å; E500-S502 WeakPolarHBondContact CG-O 3.45Å; E500-S502 PolarHBondContact O-N 3Å; E500-R503 WeakPolarHBondContact OE1-CA 3.27Å; E500-C504 PolarHBondContact OE1-N 3.49Å; E500-Y506 HydrophobicContact CB-CD1 3.97Å; E500-Y506 HydrophobicContact CB-CE1 3.78Å; E500-Y506 VanDerWaalsContact CD-CE1 3.48Å; E500-Y506 HydrophobicContact CG-CD1 4.13Å; E500-Y506 HydrophobicContact CG-CE1 3.69Å; E500-Y506 PolarHBondContact OE1-OH 3.05Å; E500-Y506 WeakPolarHBondContact OE2-CE1 3.46Å; E500-Y506 VanDerWaalsContact OE2-CZ 3.25Å; E500-Y506 PolarHBondContact OE2-OH 3.47Å
501	P	89.6	Confident	93.5	Very high	86 Å²	86	54.7 Å²	54.7	56%	0.558	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	-32	-179.2	24	-36.2	0	0	0	113.8	S499 E505 L507	S499-P501 WeakPolarHBondContact O-CD 3.28Å; P501-E505 VanDerWaalsContact CD-O 3.23Å; P501-E505 WeakPolarHBondContact CD-O 3.25Å; P501-L507 HydrophobicContact CG-CB 4.01Å
502	S	88.9	Confident	93.7	Very high	53 Å²	53	50.5 Å²	50.5	37%	0.371	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.8	174.1	-36.1	0	0	0	0	109	E500 C504 E505	E500-S502 VanDerWaalsContact C-N 3.31Å; E500-S502 WeakPolarHBondContact CG-O 3.45Å; E500-S502 PolarHBondContact O-N 3Å; S502-C504 PolarHBondContact O-N 2.62Å; S502-C504 VanDerWaalsContact O-N 3.09Å; S502-E505 WeakPolarHBondContact CB-OE2 2.96Å; S502-E505 PolarHBondContact O-N 3.34Å; S502-E505 VanDerWaalsContact O-O 3.07Å; S502-E505 PolarHBondContact OG-OE2 2.89Å
503	R	88.1	Confident	93.8	Very high	144 Å²	144	44.1 Å²	44.1	54%	0.543	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	118.3	176.6	177.7	-179.2	-178.7	158.6	-3.8	111	W476 E500 E505	W476-R503 PolarHBondContact O-NH2 3.05Å; E500-R503 WeakPolarHBondContact OE1-CA 3.27Å; R503-E505 PolarHBondContact O-N 2.86Å
504	C	89.1	Confident	93.8	Very high	7 Å²	7	42.6 Å²	42.6	5%	0.047	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	13.9	-178.2	-65.2	0	0	0	0	116.2	C475 R481 S482 E500 S502	C475-C504 HydrophobicContact CB-CB 3.58Å; C475-C504 WeakPolarHBondContact CB-SG 3.39Å; C475-C504 WeakPolarHBondContact SG-CB 3.3Å; C475-C504 CovalentContact SG-SG 2.04Å; C475-C504 PolarHBondContact SG-SG 2.85Å; R481-C504 WeakPolarHBondContact CA-O 2.97Å; R481-C504 HydrophobicContact CG-CB 3.74Å; S482-C504 PolarHBondContact N-O 3.12Å; S482-C504 VanDerWaalsContact N-O 3.12Å; E500-C504 PolarHBondContact OE1-N 3.49Å; S502-C504 PolarHBondContact O-N 2.62Å; S502-C504 VanDerWaalsContact O-N 3.09Å
505	E	93.3	Very high	93.6	Very high	87 Å²	87	40.1 Å²	40.1	41%	0.407	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.8	165	-59.9	-175.6	153.5	0	0	109.4	P501 S502 R503	P501-E505 VanDerWaalsContact CD-O 3.23Å; P501-E505 WeakPolarHBondContact CD-O 3.25Å; S502-E505 WeakPolarHBondContact CB-OE2 2.96Å; S502-E505 PolarHBondContact O-N 3.34Å; S502-E505 VanDerWaalsContact O-O 3.07Å; S502-E505 PolarHBondContact OG-OE2 2.89Å; R503-E505 PolarHBondContact O-N 2.86Å
506	Y	94.1	Very high	93.5	Very high	14 Å²	14	39.8 Å²	39.8	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.7	-177.1	-62.9	-83.2	0	0	0	111.5	Y429 L450 R481 S482 T483 T484 E500	Y429-Y506 HydrophobicContact CE1-CD1 4.38Å; L450-Y506 HydrophobicContact CB-CD2 4.16Å; L450-Y506 HydrophobicContact CD1-CD1 4.09Å; L450-Y506 HydrophobicContact CD1-CD2 3.9Å; L450-Y506 HydrophobicContact CD1-CE1 4.45Å; L450-Y506 HydrophobicContact CD1-CE2 4.29Å; L450-Y506 HydrophobicContact CD1-CG 3.81Å; L450-Y506 HydrophobicContact CD2-CD2 4.03Å; L450-Y506 HydrophobicContact CD2-CE2 3.71Å; L450-Y506 HydrophobicContact CG-CD2 4.26Å; L450-Y506 HydrophobicContact CG-CE2 4.43Å; R481-Y506 HydrophobicContact CG-CE2 4.18Å; S482-Y506 PolarHBondContact O-N 2.83Å; T483-Y506 CarbonylContact C-O 3.42Å; T483-Y506 WeakPolarHBondContact CA-O 3.39Å; T484-Y506 PolarHBondContact N-O 3.26Å; E500-Y506 HydrophobicContact CB-CD1 3.97Å; E500-Y506 HydrophobicContact CB-CE1 3.78Å; E500-Y506 VanDerWaalsContact CD-CE1 3.48Å; E500-Y506 HydrophobicContact CG-CD1 4.13Å; E500-Y506 HydrophobicContact CG-CE1 3.69Å; E500-Y506 PolarHBondContact OE1-OH 3.05Å; E500-Y506 WeakPolarHBondContact OE2-CE1 3.46Å; E500-Y506 VanDerWaalsContact OE2-CZ 3.25Å; E500-Y506 PolarHBondContact OE2-OH 3.47Å
507	L	96.2	Very high	93.2	Very high	33 Å²	33	41.7 Å²	41.7	17%	0.173	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.6	172.7	173.2	63.7	0	0	0	109.4	T484 K486 T498 S499 P501	T484-L507 HydrophobicContact CG2-CD1 4.37Å; T484-L507 WeakPolarHBondContact O-CA 3.18Å; K486-L507 HydrophobicContact CD-CD1 3.83Å; K486-L507 HydrophobicContact CG-CD1 3.85Å; T498-L507 CarbonylContact C-O 3.43Å; T498-L507 WeakPolarHBondContact CA-O 3.42Å; S499-L507 PolarHBondContact N-O 3.45Å; S499-L507 PolarHBondContact O-N 3.49Å; S499-L507 PolarHBondContact OG-O 3.44Å; P501-L507 HydrophobicContact CG-CB 4.01Å
508	I	96.3	Very high	92.7	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.8	176.7	-54.6	-169.5	0	0	0	108.9	V437 T483 T484 V485 K486 V495 S497 T498	V437-I508 HydrophobicContact CG1-CD1 3.73Å; T483-I508 HydrophobicContact CG2-CD1 3.72Å; T483-I508 HydrophobicContact CG2-CG1 3.71Å; T484-I508 PolarHBondContact O-N 2.99Å; V485-I508 CarbonylContact C-O 3.55Å; V485-I508 WeakPolarHBondContact CA-O 3.19Å; V485-I508 HydrophobicContact CG1-CB 4.28Å; V485-I508 HydrophobicContact CG1-CG2 4.33Å; V485-I508 HydrophobicContact CG2-CB 4.17Å; K486-I508 PolarHBondContact N-O 2.59Å; V495-I508 HydrophobicContact CG1-CG2 3.54Å; V495-I508 HydrophobicContact CG2-CG2 4.44Å; S497-I508 WeakPolarHBondContact O-CA 3.39Å; T498-I508 HydrophobicContact CG2-CD1 4.29Å; T498-I508 HydrophobicContact CG2-CG1 4.08Å; T498-I508 HydrophobicContact CG2-CG2 4.19Å
509	E	96.6	Very high	91.7	Very high	76 Å²	76	43.9 Å²	43.9	36%	0.355	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120	170	-64.8	179.3	143.7	0	0	108.8	T496 S497	T496-E509 PolarHBondContact N-O 3.03Å; S497-E509 WeakPolarHBondContact CB-OE2 3.42Å; S497-E509 PolarHBondContact N-O 2.99Å; S497-E509 PolarHBondContact O-N 3.1Å; S497-E509 WeakPolarHBondContact OG-CB 3.11Å; S497-E509 VanDerWaalsContact OG-CD 3.26Å; S497-E509 WeakPolarHBondContact OG-CG 3.49Å; S497-E509 PolarHBondContact OG-OE2 2.97Å
510	F	96.9	Very high	90.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.2	-177.7	-171.9	-125	0	0	0	108.7	L415 Y420 L431 P433 V485 K486 L487 T488 T493 V494 V495	L415-F510 HydrophobicContact CD1-CE1 4.04Å; L415-F510 HydrophobicContact CD2-CE1 3.97Å; L415-F510 HydrophobicContact CD2-CZ 3.94Å; Y420-F510 HydrophobicContact CD1-CE2 4.15Å; Y420-F510 AromaticContact CD2-CE2 3.91Å; Y420-F510 HydrophobicContact CD2-CE2 3.91Å; Y420-F510 AromaticContact CD2-CZ 3.84Å; Y420-F510 HydrophobicContact CD2-CZ 3.84Å; Y420-F510 HydrophobicContact CE2-CE2 4.44Å; Y420-F510 HydrophobicContact CE2-CZ 4Å; Y420-F510 AromaticContact CG-CE2 3.77Å; Y420-F510 HydrophobicContact CG-CE2 3.77Å; Y420-F510 HydrophobicContact CG-CZ 4.16Å; L431-F510 HydrophobicContact CD2-CB 4.36Å; L431-F510 HydrophobicContact CD2-CD1 4.42Å; L431-F510 HydrophobicContact CD2-CD2 3.72Å; L431-F510 HydrophobicContact CD2-CE2 3.99Å; L431-F510 HydrophobicContact CD2-CG 3.95Å; L431-F510 HydrophobicContact CD2-CZ 4.44Å; P433-F510 HydrophobicContact CG-CZ 4.44Å; V485-F510 HydrophobicContact CG1-CB 3.57Å; V485-F510 HydrophobicContact CG1-CG 4.35Å; K486-F510 PolarHBondContact O-N 3.14Å; L487-F510 CarbonylContact C-O 3.57Å; L487-F510 WeakPolarHBondContact CA-O 3.33Å; L487-F510 HydrophobicContact CG-CD1 4.31Å; T488-F510 PolarHBondContact N-O 2.62Å; T488-F510 PolarHBondContact OG1-O 3.22Å; T493-F510 HydrophobicContact CG2-CE1 3.96Å; T493-F510 HydrophobicContact CG2-CE2 3.92Å; T493-F510 HydrophobicContact CG2-CZ 3.32Å; V494-F510 VanDerWaalsContact O-CD2 3.23Å; V494-F510 WeakPolarHBondContact O-CD2 3.38Å; V495-F510 HydrophobicContact CG2-CD2 3.73Å; V495-F510 HydrophobicContact CG2-CE2 4.11Å
511	T	95.8	Very high	88.8	Confident	24 Å²	24	43.8 Å²	43.8	15%	0.147	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.6	176.6	-58.6	0	0	0	0	108.8	T488 E492 T493 V494 T496	T488-T511 WeakPolarHBondContact O-CA 3.46Å; T488-T511 WeakPolarHBondContact OG1-CA 3.06Å; T488-T511 PolarHBondContact OG1-OG1 2.79Å; E492-T511 CarbonylContact O-C 3.59Å; T493-T511 VanDerWaalsContact CA-O 3.27Å; T493-T511 WeakPolarHBondContact CA-O 3.26Å; V494-T511 PolarHBondContact N-O 3.36Å; V494-T511 PolarHBondContact O-N 2.9Å; T496-T511 PolarHBondContact OG1-OG1 3.25Å
512	S	95.5	Very high	87.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	145.6	-176.9	168.9	0	0	0	0	111.7	Y414 T488 G490 A514	Y414-S512 PolarHBondContact OH-OG 3.09Å; T488-S512 PolarHBondContact O-N 3.11Å; G490-S512 PolarHBondContact N-O 2.99Å; G490-S512 CarbonylContact O-C 3.49Å; S512-A514 VanDerWaalsContact C-N 3.29Å; S512-A514 PolarHBondContact O-N 2.7Å; S512-A514 PolarHBondContact OG-N 2.75Å
513	P	94.9	Very high	85.1	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.026	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-65.3	-28.4	168.9	25.6	-34.3	0	0	0	113.4	G141 F144 L148 G490 T493 I515 C516	G141-P513 VanDerWaalsContact O-CB 3.27Å; G141-P513 WeakPolarHBondContact O-CB 3.22Å; F144-P513 HydrophobicContact CB-CB 3.82Å; F144-P513 HydrophobicContact CB-CG 4.34Å; L148-P513 HydrophobicContact CD1-CB 4.44Å; L148-P513 HydrophobicContact CD1-CG 3.78Å; G490-P513 WeakPolarHBondContact O-CA 3.25Å; G490-P513 VanDerWaalsContact O-N 3.14Å; T493-P513 WeakPolarHBondContact OG1-CD 3.14Å; P513-I515 VanDerWaalsContact C-N 3.28Å; P513-I515 PolarHBondContact O-N 3.38Å; P513-C516 VanDerWaalsContact O-CB 3.27Å; P513-C516 WeakPolarHBondContact O-CB 3.03Å; P513-C516 PolarHBondContact O-N 2.03Å
514	A	93.4	Very high	82.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-70.5	-17.9	-172.4	0	0	0	0	0	114.7	K145 E411 F412 Y414 S512	K145-A514 VanDerWaalsContact CD-O 3.3Å; K145-A514 WeakPolarHBondContact CD-O 3.22Å; K145-A514 WeakPolarHBondContact CE-O 2.82Å; K145-A514 PolarHBondContact NZ-O 3.12Å; E411-A514 HydrophobicContact CB-CB 4.16Å; E411-A514 HydrophobicContact CG-CB 4.4Å; E411-A514 VanDerWaalsContact O-CB 3.32Å; E411-A514 WeakPolarHBondContact O-CB 3.13Å; F412-A514 HydrophobicContact CD1-CB 3.57Å; F412-A514 HydrophobicContact CE1-CB 3.56Å; F412-A514 HydrophobicContact CG-CB 4.4Å; F412-A514 HydrophobicContact CZ-CB 4.38Å; Y414-A514 HydrophobicContact CE1-CB 3.84Å; S512-A514 VanDerWaalsContact C-N 3.29Å; S512-A514 PolarHBondContact O-N 2.7Å; S512-A514 PolarHBondContact OG-N 2.75Å
515	I	93.4	Very high	80.4	Confident	17 Å²	17	49.2 Å²	49.2	9%	0.087	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-89	-8	172.6	-163.5	60.5	0	0	0	113	F412 L487 T488 C489 P513 Q517	F412-I515 HydrophobicContact CE1-CB 4.48Å; F412-I515 HydrophobicContact CZ-CD1 4.14Å; L487-I515 HydrophobicContact CB-CB 4.14Å; L487-I515 HydrophobicContact CB-CG1 4.07Å; L487-I515 HydrophobicContact CB-CG2 4.17Å; T488-I515 WeakPolarHBondContact O-CG2 3.24Å; C489-I515 HydrophobicContact CB-CG2 4.19Å; P513-I515 VanDerWaalsContact C-N 3.28Å; P513-I515 PolarHBondContact O-N 3.38Å; I515-Q517 PolarHBondContact O-N 3.48Å
516	C	92.2	Very high	77.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-65.3	133.7	177.7	-62.7	0	0	0	0	112	F142 K145 C489 G490 P513	F142-C516 HydrophobicContact CB-CB 4.14Å; K145-C516 WeakPolarHBondContact CD-O 3.36Å; C489-C516 WeakPolarHBondContact CA-SG 3.44Å; C489-C516 HydrophobicContact CB-CB 4.03Å; C489-C516 WeakPolarHBondContact CB-SG 3.3Å; C489-C516 VanDerWaalsContact SG-CA 3.54Å; C489-C516 WeakPolarHBondContact SG-CB 3.06Å; C489-C516 CovalentContact SG-SG 2.04Å; C489-C516 PolarHBondContact SG-SG 3.27Å; G490-C516 PolarHBondContact N-SG 2.99Å; P513-C516 VanDerWaalsContact O-CB 3.27Å; P513-C516 WeakPolarHBondContact O-CB 3.03Å; P513-C516 PolarHBondContact O-N 2.03Å
517	Q	87.8	Confident	75.1	Confident	119 Å²	119	56.1 Å²	56.1	56%	0.556	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-92.3	171	178.3	-64.2	-177.6	-11.1	0	0	111.3	F142 I515 P519	F142-Q517 WeakPolarHBondContact CD2-O 3.31Å; F142-Q517 WeakPolarHBondContact CG-O 3.39Å; I515-Q517 PolarHBondContact O-N 3.48Å; Q517-P519 WeakPolarHBondContact O-CD 3.13Å
518	D	84.1	Confident	72.4	Confident	59 Å²	59	62.4 Å²	62.4	32%	0.316	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-71.4	122.7	176.8	-160.9	-46.8	0	0	0	109.8	F142 K146 A520 S521	F142-D518 HydrophobicContact CD1-CB 4.48Å; F142-D518 HydrophobicContact CE1-CB 3.62Å; F142-D518 WeakPolarHBondContact CE1-OD2 3.48Å; F142-D518 HydrophobicContact CE2-CB 3.99Å; F142-D518 VanDerWaalsContact CZ-CA 3.47Å; F142-D518 HydrophobicContact CZ-CB 3.33Å; F142-D518 WeakPolarHBondContact CZ-OD2 3.45Å; K146-D518 IonicContact NZ-OD2 3.5Å; D518-A520 PolarHBondContact O-N 3.1Å; D518-A520 VanDerWaalsContact OD1-CB 3.32Å; D518-A520 WeakPolarHBondContact OD1-CB 3.38Å; D518-A520 PolarHBondContact OD1-N 3.14Å; D518-S521 PolarHBondContact O-N 3.19Å; D518-S521 PolarHBondContact O-OG 3.45Å
519	P	74.9	Confident	70	Confident	51 Å²	51	69.2 Å²	69.2	33%	0.331	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-18.2	178.5	24.8	-34	0	0	0	113.1	K139 F142 Q517 S521 S522	K139-P519 HydrophobicContact CB-CG 4.42Å; K139-P519 HydrophobicContact CG-CG 4.49Å; F142-P519 VanDerWaalsContact CD1-CD 3.45Å; F142-P519 HydrophobicContact CD1-CG 4.48Å; Q517-P519 WeakPolarHBondContact O-CD 3.13Å; P519-S521 VanDerWaalsContact C-N 3.32Å; P519-S522 PolarHBondContact O-OG 2.81Å
520	A	64.1	Low	67.5	Low	80 Å²	80	72.1 Å²	72.1	66%	0.661	42%	0.42	S	S	*	.	H	α-helix	trans	-75	-14	172.5	0	0	0	0	0	114.2	D518	D518-A520 PolarHBondContact O-N 3.1Å; D518-A520 VanDerWaalsContact OD1-CB 3.32Å; D518-A520 WeakPolarHBondContact OD1-CB 3.38Å; D518-A520 PolarHBondContact OD1-N 3.14Å
521	S	59.5	Low	65.3	Low	63 Å²	63	73.5 Å²	73.5	44%	0.441	43%	0.427	S	S	.	.	H	α-helix	trans	-86.6	-33.9	173.6	55.1	0	0	0	0	113.1	D518 P519 D523 S524	D518-S521 PolarHBondContact O-N 3.19Å; D518-S521 PolarHBondContact O-OG 3.45Å; P519-S521 VanDerWaalsContact C-N 3.32Å; S521-D523 VanDerWaalsContact C-N 3.28Å; S521-D523 PolarHBondContact O-N 3.13Å; S521-S524 PolarHBondContact O-OG 2.03Å
522	S	54.4	Low	62.8	Low	82 Å²	82	79.4 Å²	79.4	57%	0.573	46%	0.456	S	S	*	.	H	α-helix	trans	-68.3	-23.1	179.2	40	0	0	0	0	114.4	P519 S524	P519-S522 PolarHBondContact O-OG 2.81Å; S522-S524 PolarHBondContact O-N 2.65Å
523	D	46.8	Very low	61.2	Low	148 Å²	148	83.4 Å²	83.4	79%	0.791	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	0.3	-177.3	-149.9	39.1	0	0	0	113.8	S521	S521-D523 VanDerWaalsContact C-N 3.28Å; S521-D523 PolarHBondContact O-N 3.13Å
524	S	39.5	Very low	59.4	Low	111 Å²	111	87.5 Å²	87.5	78%	0.776	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.9	-177.4	62.2	0	0	0	0	114.8	S521 S522	S521-S524 PolarHBondContact O-OG 2.03Å; S522-S524 PolarHBondContact O-N 2.65Å
525	G	37.9	Very low	57.5	Low	62 Å²	62	92.4 Å²	92.4	64%	0.639	53%	0.531	S	S	*	.	S	Bend	trans	-108	-22.5	-167.2	0	0	0	0	0	117	P527	G525-P527 WeakPolarHBondContact O-CD 3.27Å
526	H	38.4	Very low	55.4	Low	172 Å²	172	96.8 Å²	96.8	80%	0.796	56%	0.557	S	S	*	*			trans	-103.2	110	-177.2	-135.8	-42.7	0	0	0	110.3	D528	H526-D528 PolarHBondContact O-N 3.47Å
527	P	38.2	Very low	53.1	Low	75 Å²	75	102.9 Å²	102.9	49%	0.487	59%	0.592	S	S	.	*			trans	-67.9	128.8	163.6	28.3	-31.9	0	0	0	108.6	G525 H529	G525-P527 WeakPolarHBondContact O-CD 3.27Å; P527-H529 PolarHBondContact O-N 2.82Å
528	D	39.8	Very low	50.8	Low	164 Å²	164	101.8 Å²	101.8	88%	0.877	59%	0.594	S	S	*	*			trans	-67.5	72.7	163.1	-85.1	-38.4	0	0	0	109	H526 E530	H526-D528 PolarHBondContact O-N 3.47Å; D528-E530 PolarHBondContact O-N 2.98Å
529	H	45.3	Very low	48.4	Very low	146 Å²	146	104.9 Å²	104.9	68%	0.676	61%	0.614	S	S	*	*			trans	-78.5	62.4	166.1	-78.5	-45.3	0	0	0	109.9	P527 E531	P527-H529 PolarHBondContact O-N 2.82Å; H529-E531 VanDerWaalsContact C-N 3.32Å; H529-E531 PolarHBondContact O-N 3.09Å
530	E	43.8	Very low	46.4	Very low	138 Å²	138	109 Å²	109	65%	0.645	64%	0.636	S	S	*	*			trans	-69.2	91.9	163.3	-154.2	174.9	-149	0	0	107.2	D528 L532	D528-E530 PolarHBondContact O-N 2.98Å; E530-L532 HydrophobicContact CB-CG 4.23Å; E530-L532 HydrophobicContact CG-CD2 3.74Å; E530-L532 HydrophobicContact CG-CG 3.85Å; E530-L532 PolarHBondContact O-N 2.87Å
531	E	51.3	Low	44.9	Very low	29 Å²	29	111.4 Å²	111.4	14%	0.136	63%	0.634	C	S	.	*			trans	-68	86.5	166.6	-64.2	-147.8	159.8	0	0	108.2	R23 L29 H80 T82 H529	R23-E531 IonicContact CZ-OE2 2.78Å; R23-E531 VanDerWaalsContact CZ-OE2 3.25Å; R23-E531 IonicContact NH1-OE1 3.58Å; R23-E531 IonicContact NH1-OE2 3.82Å; R23-E531 PolarHBondContact NH1-OE2 2.68Å; R23-E531 IonicContact NH2-OE2 3.34Å; R23-E531 PolarHBondContact NH2-OE2 2.92Å; L29-E531 VanDerWaalsContact CB-OE1 3.23Å; L29-E531 WeakPolarHBondContact CB-OE1 3.49Å; L29-E531 HydrophobicContact CD1-CB 3.99Å; L29-E531 HydrophobicContact CD1-CG 3.68Å; L29-E531 VanDerWaalsContact CG-CD 3.44Å; L29-E531 HydrophobicContact CG-CG 4.12Å; L29-E531 VanDerWaalsContact CG-OE1 3.27Å; L29-E531 WeakPolarHBondContact CG-OE1 3.25Å; L29-E531 PolarHBondContact N-OE1 2.66Å; H80-E531 IonicContact CE1-OE2 3.92Å; H80-E531 PolarHBondContact CE1-OE2 3.28Å; T82-E531 HydrophobicContact CG2-CB 3.82Å; H529-E531 VanDerWaalsContact C-N 3.32Å; H529-E531 PolarHBondContact O-N 3.09Å
532	L	43.6	Very low	43.5	Very low	147 Å²	147	115.8 Å²	115.8	77%	0.77	65%	0.652	S	S	*	*			trans	-77.9	0	-179.3	-74	173	0	0	0	114.7	E530	E530-L532 HydrophobicContact CB-CG 4.23Å; E530-L532 HydrophobicContact CG-CD2 3.74Å; E530-L532 HydrophobicContact CG-CG 3.85Å; E530-L532 PolarHBondContact O-N 2.87Å

Retrieved 532 of 532 residues in 1013 ms (Link to these results)

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