A0A087XHF4_POEFO Loading...

SH2B adaptor protein 3

AlphaFold DB , UniProt , Accession A0A087XHF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 710 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	31.1	Very low	31.5	Very low	218 Å²	218	144.2 Å²	144.2	100%	1.074	83%	0.832	S	S	*	*				0	148.2	0	-65.7	91	84.6	0	0	109
2	N	31.9	Very low	31.4	Very low	164 Å²	164	142.6 Å²	142.6	88%	0.877	83%	0.827	S	S	*	*			trans	50.8	139.1	149.9	-46.4	0.9	0	0	0	119.3
3	G	31.7	Very low	31.1	Very low	62 Å²	62	140 Å²	140	64%	0.639	82%	0.822	S	S	*	*			cis	157.1	165.7	-2.9	0	0	0	0	0	112.3
4	N	30.2	Very low	31.2	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	82%	0.817	S	S	*	*			trans	73.8	122.7	172.8	-49.2	-3.5	0	0	0	115.2
5	T	35.1	Very low	30.9	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	82%	0.82	S	S	*	*			cis	89.4	113.2	25.4	-54.2	0	0	0	0	115.1
6	I	30.8	Very low	31	Very low	162 Å²	162	129.8 Å²	129.8	83%	0.831	82%	0.821	S	S	*	*				-151.7	141.5	129.9	-68.7	-158.3	0	0	0	108.5
7	H	33.7	Very low	30.9	Very low	181 Å²	181	126.6 Å²	126.6	84%	0.838	82%	0.82	S	S	*	*			trans	-116	154.1	166	-90.7	-78.3	0	0	0	109.9
8	P	37.5	Very low	31.3	Very low	120 Å²	120	126.5 Å²	126.5	78%	0.779	82%	0.819	S	S	*	*				-147	177.4	109.3	38.5	-24.1	0	0	0	113.1
9	A	28.1	Very low	31.5	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	82%	0.821	S	S	*	*			cis	-165.4	150.3	-37	0	0	0	0	0	108.2
10	N	28.6	Very low	31.8	Very low	155 Å²	155	125.1 Å²	125.1	83%	0.829	81%	0.811	S	S	*	*			trans	-84	160.9	179.3	-75	-13.3	0	0	0	112.9
11	T	28.5	Very low	32.5	Very low	149 Å²	149	123.6 Å²	123.6	91%	0.914	81%	0.809	S	S	*	*			trans	-148.7	146.9	151.4	-70.9	0	0	0	0	109.6
12	T	30.2	Very low	33	Very low	125 Å²	125	116.7 Å²	116.7	77%	0.767	79%	0.786	S	S	*	*			trans	-138.6	134.6	-163.7	-55.2	0	0	0	0	112.1
13	S	26.4	Very low	33.7	Very low	109 Å²	109	113.7 Å²	113.7	76%	0.762	78%	0.776	S	S	*	*			trans	-168.5	123.1	146.6	-164.5	0	0	0	0	107
14	A	33.4	Very low	34.3	Very low	91 Å²	91	113.9 Å²	113.9	75%	0.752	77%	0.766	S	S	*	*			cis	72.6	118.9	48.8	0	0	0	0	0	113.1
15	G	26.2	Very low	35.5	Very low	83 Å²	83	116.2 Å²	116.2	86%	0.856	76%	0.763	S	S	*	*			trans	156.2	129.9	-177.9	0	0	0	0	0	109.2
16	G	32.2	Very low	37	Very low	82 Å²	82	112.1 Å²	112.1	85%	0.845	75%	0.746	S	S	*	*			trans	-148.2	156.8	-165.8	0	0	0	0	0	116.8
17	G	29.4	Very low	38.6	Very low	77 Å²	77	113.5 Å²	113.5	79%	0.794	74%	0.74	S	S	*	*			trans	88.4	165.1	176.4	0	0	0	0	0	115.1
18	P	37.7	Very low	40.3	Very low	124 Å²	124	114.2 Å²	114.2	81%	0.805	74%	0.736	S	S	*	*	P	Polyproline II helix	cis	-98.7	163.8	-9.3	38	-31.6	0	0	0	112.8
19	S	36.4	Very low	41.8	Very low	124 Å²	124	112.4 Å²	112.4	87%	0.867	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-74.5	125.6	177.8	-168	0	0	0	0	112
20	V	37.5	Very low	43.9	Very low	101 Å²	101	112 Å²	112	61%	0.612	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-82.8	133.7	172.3	174.5	0	0	0	0	109.4
21	A	46.4	Very low	45.8	Very low	94 Å²	94	107.3 Å²	107.3	78%	0.777	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-62.5	136.5	-175.7	0	0	0	0	0	112.7
22	A	41.7	Very low	47.8	Very low	72 Å²	72	105.5 Å²	105.5	60%	0.595	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-71.6	154.8	173.3	0	0	0	0	0	111.5
23	P	46.9	Very low	50	Low	101 Å²	101	104.1 Å²	104.1	66%	0.656	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-64.1	147.1	173	27.9	-35.5	0	0	0	111.3	R25	P23-R25 PolarHBondContact O-N 2.92Å
24	P	43.7	Very low	52.3	Low	66 Å²	66	103.6 Å²	103.6	43%	0.429	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-64	121.1	-172.2	24.8	-34.5	0	0	0	112.4	G26 E29 L33	P24-G26 VanDerWaalsContact C-N 3.25Å; P24-G26 PolarHBondContact O-N 2.74Å; P24-G26 VanDerWaalsContact O-N 3.12Å; P24-E29 WeakPolarHBondContact CA-OE2 3.49Å; P24-E29 HydrophobicContact CB-CB 3.66Å; P24-L33 HydrophobicContact CB-CD1 3.8Å; P24-L33 HydrophobicContact CG-CD1 3.82Å
25	R	55.6	Low	54.3	Low	207 Å²	207	102.2 Å²	102.2	78%	0.781	62%	0.619	S	S	*	*			trans	-88.9	52.1	-177.6	-64.3	-175.7	178.9	-100.3	1.6	112	P23 E29	P23-R25 PolarHBondContact O-N 2.92Å; R25-E29 PolarHBondContact N-OE2 3.32Å
26	G	66.1	Low	56.5	Low	39 Å²	39	101.6 Å²	101.6	40%	0.402	60%	0.595	S	S	.	*	S	Bend	trans	127.4	-175.6	164.4	0	0	0	0	0	115.6	P24 R28 E29 F30	P24-G26 VanDerWaalsContact C-N 3.25Å; P24-G26 PolarHBondContact O-N 2.74Å; P24-G26 VanDerWaalsContact O-N 3.12Å; G26-R28 VanDerWaalsContact C-N 3.28Å; G26-R28 PolarHBondContact O-N 3.09Å; G26-E29 PolarHBondContact O-N 3.43Å; G26-E29 VanDerWaalsContact O-N 3.1Å; G26-F30 PolarHBondContact O-N 3.06Å
27	W	64.1	Low	58.6	Low	190 Å²	190	99.3 Å²	99.3	72%	0.72	57%	0.569	S	S	*	*	H	α-helix	trans	-62.6	-30.3	-166.3	-157.5	-116.3	0	0	0	114.2	F30 C31	W27-F30 HydrophobicContact CD2-CD1 4.34Å; W27-F30 HydrophobicContact CE3-CB 4.49Å; W27-F30 AromaticContact CE3-CD1 3.98Å; W27-F30 HydrophobicContact CE3-CD1 3.98Å; W27-F30 HydrophobicContact CE3-CG 4.3Å; W27-F30 HydrophobicContact CH2-CD1 4.09Å; W27-F30 AromaticContact CH2-CE1 3.87Å; W27-F30 HydrophobicContact CH2-CE1 3.87Å; W27-F30 HydrophobicContact CZ2-CD1 4.44Å; W27-F30 HydrophobicContact CZ2-CE1 4.35Å; W27-F30 AromaticContact CZ3-CD1 3.85Å; W27-F30 HydrophobicContact CZ3-CD1 3.85Å; W27-F30 AromaticContact CZ3-CE1 3.98Å; W27-F30 HydrophobicContact CZ3-CE1 3.98Å; W27-F30 HydrophobicContact CZ3-CG 4.3Å; W27-C31 WeakPolarHBondContact O-CB 3.19Å; W27-C31 PolarHBondContact O-N 2.68Å; W27-C31 PolarHBondContact O-SG 3.3Å
28	R	69.9	Low	60.8	Low	197 Å²	197	99.9 Å²	99.9	74%	0.743	56%	0.557	S	S	*	*	H	α-helix	trans	-59.6	-53.6	172.9	177.7	177	-56.5	-68.4	-6.7	111.2	G26 C31 E32	G26-R28 VanDerWaalsContact C-N 3.28Å; G26-R28 PolarHBondContact O-N 3.09Å; R28-C31 PolarHBondContact O-N 2.71Å; R28-E32 VanDerWaalsContact O-CB 3.28Å; R28-E32 WeakPolarHBondContact O-CB 3.26Å; R28-E32 PolarHBondContact O-N 2.93Å
29	E	67.9	Low	62.6	Low	81 Å²	81	96.6 Å²	96.6	38%	0.379	54%	0.54	S	S	.	.	H	α-helix	trans	-71.9	-33.3	-175	-66.7	167	-146.9	0	0	111.1	P24 R25 G26 E32 L33	P24-E29 WeakPolarHBondContact CA-OE2 3.49Å; P24-E29 HydrophobicContact CB-CB 3.66Å; R25-E29 PolarHBondContact N-OE2 3.32Å; G26-E29 PolarHBondContact O-N 3.43Å; G26-E29 VanDerWaalsContact O-N 3.1Å; E29-E32 PolarHBondContact O-N 2.6Å; E29-L33 WeakPolarHBondContact O-CB 3.47Å; E29-L33 VanDerWaalsContact O-CG 3.23Å; E29-L33 WeakPolarHBondContact O-CG 3.46Å; E29-L33 PolarHBondContact O-N 3Å
30	F	73	Confident	64.4	Low	84 Å²	84	99.6 Å²	99.6	37%	0.368	53%	0.532	S	S	.	.	H	α-helix	trans	-57.5	-53.7	167.4	174.9	-91.7	0	0	0	111.8	G26 W27 E32 L33 H34	G26-F30 PolarHBondContact O-N 3.06Å; W27-F30 HydrophobicContact CD2-CD1 4.34Å; W27-F30 HydrophobicContact CE3-CB 4.49Å; W27-F30 AromaticContact CE3-CD1 3.98Å; W27-F30 HydrophobicContact CE3-CD1 3.98Å; W27-F30 HydrophobicContact CE3-CG 4.3Å; W27-F30 HydrophobicContact CH2-CD1 4.09Å; W27-F30 AromaticContact CH2-CE1 3.87Å; W27-F30 HydrophobicContact CH2-CE1 3.87Å; W27-F30 HydrophobicContact CZ2-CD1 4.44Å; W27-F30 HydrophobicContact CZ2-CE1 4.35Å; W27-F30 AromaticContact CZ3-CD1 3.85Å; W27-F30 HydrophobicContact CZ3-CD1 3.85Å; W27-F30 AromaticContact CZ3-CE1 3.98Å; W27-F30 HydrophobicContact CZ3-CE1 3.98Å; W27-F30 HydrophobicContact CZ3-CG 4.3Å; F30-E32 VanDerWaalsContact C-N 3.34Å; F30-E32 PolarHBondContact O-N 3.02Å; F30-L33 PolarHBondContact O-N 3.38Å; F30-H34 AromaticContact CD2-CE1 3.61Å; F30-H34 AromaticContact CD2-ND1 3.82Å; F30-H34 AromaticContact CE2-CE1 3.18Å; F30-H34 WeakPolarHBondContact CE2-CE1 3.31Å; F30-H34 AromaticContact CE2-ND1 3.71Å; F30-H34 AromaticContact CE2-NE2 3.94Å; F30-H34 AromaticContact CZ-CE1 3.5Å; F30-H34 AromaticContact CZ-ND1 3.79Å; F30-H34 AromaticContact CZ-NE2 3.96Å; F30-H34 PolarHBondContact O-N 2.75Å; F30-H34 PolarHBondContact O-ND1 2.7Å
31	C	68.4	Low	66.3	Low	58 Å²	58	100.9 Å²	100.9	39%	0.392	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-36.2	179.5	-72.8	0	0	0	0	112.5	W27 R28 H34 A35	W27-C31 WeakPolarHBondContact O-CB 3.19Å; W27-C31 PolarHBondContact O-N 2.68Å; W27-C31 PolarHBondContact O-SG 3.3Å; R28-C31 PolarHBondContact O-N 2.71Å; C31-H34 PolarHBondContact O-N 2.8Å; C31-A35 VanDerWaalsContact O-CB 3.24Å; C31-A35 WeakPolarHBondContact O-CB 3.35Å; C31-A35 PolarHBondContact O-N 3.09Å
32	E	71	Confident	67.9	Low	110 Å²	110	99.7 Å²	99.7	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-45.1	178	-173.5	163.2	-176.3	0	0	111.6	R28 E29 F30 H34 A35 I36	R28-E32 VanDerWaalsContact O-CB 3.28Å; R28-E32 WeakPolarHBondContact O-CB 3.26Å; R28-E32 PolarHBondContact O-N 2.93Å; E29-E32 PolarHBondContact O-N 2.6Å; F30-E32 VanDerWaalsContact C-N 3.34Å; F30-E32 PolarHBondContact O-N 3.02Å; E32-H34 PolarHBondContact O-N 3.09Å; E32-A35 PolarHBondContact O-N 3.1Å; E32-I36 HydrophobicContact CG-CD1 3.97Å; E32-I36 WeakPolarHBondContact O-CB 3.47Å; E32-I36 WeakPolarHBondContact O-CD1 3.49Å; E32-I36 WeakPolarHBondContact O-CG1 3.45Å; E32-I36 PolarHBondContact O-N 2.85Å
33	L	76.8	Confident	69.5	Low	96 Å²	96	98.2 Å²	98.2	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-59.8	-45.2	172.7	-74.1	169.3	0	0	0	112	P24 E29 F30 I36 A37	P24-L33 HydrophobicContact CB-CD1 3.8Å; P24-L33 HydrophobicContact CG-CD1 3.82Å; E29-L33 WeakPolarHBondContact O-CB 3.47Å; E29-L33 VanDerWaalsContact O-CG 3.23Å; E29-L33 WeakPolarHBondContact O-CG 3.46Å; E29-L33 PolarHBondContact O-N 3Å; F30-L33 PolarHBondContact O-N 3.38Å; L33-I36 PolarHBondContact O-N 2.72Å; L33-A37 WeakPolarHBondContact O-CB 3.3Å; L33-A37 PolarHBondContact O-N 2.89Å
34	H	74.6	Confident	70.8	Confident	99 Å²	99	94.8 Å²	94.8	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-36.7	178.6	-75.3	78.7	0	0	0	112.6	F30 C31 E32 A37 T38	F30-H34 AromaticContact CD2-CE1 3.61Å; F30-H34 AromaticContact CD2-ND1 3.82Å; F30-H34 AromaticContact CE2-CE1 3.18Å; F30-H34 WeakPolarHBondContact CE2-CE1 3.31Å; F30-H34 AromaticContact CE2-ND1 3.71Å; F30-H34 AromaticContact CE2-NE2 3.94Å; F30-H34 AromaticContact CZ-CE1 3.5Å; F30-H34 AromaticContact CZ-ND1 3.79Å; F30-H34 AromaticContact CZ-NE2 3.96Å; F30-H34 PolarHBondContact O-N 2.75Å; F30-H34 PolarHBondContact O-ND1 2.7Å; C31-H34 PolarHBondContact O-N 2.8Å; E32-H34 PolarHBondContact O-N 3.09Å; H34-A37 PolarHBondContact O-N 3.35Å; H34-T38 WeakPolarHBondContact O-CB 3.39Å; H34-T38 PolarHBondContact O-N 3.44Å; H34-T38 PolarHBondContact O-OG1 3.2Å
35	A	74.6	Confident	72.4	Confident	61 Å²	61	98 Å²	98	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-43	173.4	0	0	0	0	0	111.4	C31 E32 T38 A39	C31-A35 VanDerWaalsContact O-CB 3.24Å; C31-A35 WeakPolarHBondContact O-CB 3.35Å; C31-A35 PolarHBondContact O-N 3.09Å; E32-A35 PolarHBondContact O-N 3.1Å; A35-T38 PolarHBondContact O-N 2.92Å; A35-A39 VanDerWaalsContact O-CB 3.25Å; A35-A39 WeakPolarHBondContact O-CB 3.31Å; A35-A39 PolarHBondContact O-N 3.32Å
36	I	72.8	Confident	73.2	Confident	70 Å²	70	91.6 Å²	91.6	36%	0.359	47%	0.468	S	S	.	.	H	α-helix	trans	-63.9	-43.7	175.9	-70.5	165	0	0	0	111.1	E32 L33 A39 R40	E32-I36 HydrophobicContact CG-CD1 3.97Å; E32-I36 WeakPolarHBondContact O-CB 3.47Å; E32-I36 WeakPolarHBondContact O-CD1 3.49Å; E32-I36 WeakPolarHBondContact O-CG1 3.45Å; E32-I36 PolarHBondContact O-N 2.85Å; L33-I36 PolarHBondContact O-N 2.72Å; I36-A39 PolarHBondContact O-N 3.1Å; I36-R40 WeakPolarHBondContact O-CB 3.32Å; I36-R40 VanDerWaalsContact O-CG 3.25Å; I36-R40 WeakPolarHBondContact O-CG 3.28Å; I36-R40 PolarHBondContact O-N 3.47Å
37	A	76.1	Confident	73.5	Confident	35 Å²	35	98 Å²	98	29%	0.289	48%	0.481	S	S	.	.	H	α-helix	trans	-62	-47.9	176.3	0	0	0	0	0	111.8	L33 H34 A39 R40 Q41	L33-A37 WeakPolarHBondContact O-CB 3.3Å; L33-A37 PolarHBondContact O-N 2.89Å; H34-A37 PolarHBondContact O-N 3.35Å; A37-A39 PolarHBondContact O-N 3.13Å; A37-R40 WeakPolarHBondContact O-CB 3.39Å; A37-R40 PolarHBondContact O-N 3.04Å; A37-Q41 PolarHBondContact O-N 3.38Å
38	T	75.3	Confident	74.1	Confident	88 Å²	88	91.7 Å²	91.7	54%	0.54	47%	0.465	S	S	.	.	H	α-helix	trans	-62.2	-43.8	177.9	-53.2	0	0	0	0	111.5	H34 A35 R40 Q41 L42	H34-T38 WeakPolarHBondContact O-CB 3.39Å; H34-T38 PolarHBondContact O-N 3.44Å; H34-T38 PolarHBondContact O-OG1 3.2Å; A35-T38 PolarHBondContact O-N 2.92Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 2.95Å; T38-Q41 PolarHBondContact O-N 2.84Å; T38-L42 PolarHBondContact O-N 2.8Å
39	A	75.6	Confident	74.4	Confident	55 Å²	55	85 Å²	85	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-63.2	-37.5	176.8	0	0	0	0	0	112.3	A35 I36 A37 L42 A43	A35-A39 VanDerWaalsContact O-CB 3.25Å; A35-A39 WeakPolarHBondContact O-CB 3.31Å; A35-A39 PolarHBondContact O-N 3.32Å; I36-A39 PolarHBondContact O-N 3.1Å; A37-A39 PolarHBondContact O-N 3.13Å; A39-L42 PolarHBondContact O-N 2.88Å; A39-A43 VanDerWaalsContact O-CB 3.29Å; A39-A43 WeakPolarHBondContact O-CB 3.35Å; A39-A43 PolarHBondContact O-N 2.98Å
40	R	74.3	Confident	74.5	Confident	187 Å²	187	82.4 Å²	82.4	71%	0.706	43%	0.433	S	S	*	.	H	α-helix	trans	-64.6	-42.5	174.5	-75.1	168.8	178.4	-177.7	0.9	112.2	I36 A37 T38 A43 G44	I36-R40 WeakPolarHBondContact O-CB 3.32Å; I36-R40 VanDerWaalsContact O-CG 3.25Å; I36-R40 WeakPolarHBondContact O-CG 3.28Å; I36-R40 PolarHBondContact O-N 3.47Å; A37-R40 WeakPolarHBondContact O-CB 3.39Å; A37-R40 PolarHBondContact O-N 3.04Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 2.95Å; R40-A43 PolarHBondContact O-N 2.76Å; R40-G44 PolarHBondContact O-N 3.18Å
41	Q	78.3	Confident	74.2	Confident	129 Å²	129	82.6 Å²	82.6	60%	0.603	45%	0.445	S	S	*	.	H	α-helix	trans	-63	-47	175.3	-71.5	179.7	-11.6	0	0	111.5	A37 T38 A43 G44 H45	A37-Q41 PolarHBondContact O-N 3.38Å; T38-Q41 PolarHBondContact O-N 2.84Å; Q41-A43 PolarHBondContact O-N 2.8Å; Q41-G44 WeakPolarHBondContact O-CA 3.48Å; Q41-G44 PolarHBondContact O-N 3.4Å; Q41-H45 PolarHBondContact O-N 3.17Å
42	L	78.5	Confident	74.3	Confident	68 Å²	68	86.4 Å²	86.4	36%	0.356	46%	0.458	S	S	.	.	H	α-helix	trans	-58.6	-44.9	175.8	-178.4	67.1	0	0	0	112.1	T38 A39 G44 H45 Y46 F68	T38-L42 PolarHBondContact O-N 2.8Å; A39-L42 PolarHBondContact O-N 2.88Å; L42-G44 PolarHBondContact O-N 3.05Å; L42-H45 PolarHBondContact O-N 2.7Å; L42-Y46 WeakPolarHBondContact O-CB 3.4Å; L42-Y46 PolarHBondContact O-N 3.4Å; L42-F68 HydrophobicContact CD2-CD2 3.8Å; L42-F68 HydrophobicContact CD2-CE1 4.45Å; L42-F68 HydrophobicContact CD2-CE2 3.29Å; L42-F68 HydrophobicContact CD2-CZ 3.67Å
43	A	76.6	Confident	73.8	Confident	42 Å²	42	86 Å²	86	35%	0.347	45%	0.451	S	S	.	.	H	α-helix	trans	-69.5	-15	175.9	0	0	0	0	0	113.7	A39 R40 Q41 R47	A39-A43 VanDerWaalsContact O-CB 3.29Å; A39-A43 WeakPolarHBondContact O-CB 3.35Å; A39-A43 PolarHBondContact O-N 2.98Å; R40-A43 PolarHBondContact O-N 2.76Å; Q41-A43 PolarHBondContact O-N 2.8Å; A43-R47 PolarHBondContact O-NE 2.86Å; A43-R47 PolarHBondContact O-NH2 3.02Å
44	G	73.8	Confident	72.9	Confident	29 Å²	29	87 Å²	87	30%	0.299	46%	0.464	S	S	.	.	H	α-helix	trans	-75.5	-57.6	165.4	0	0	0	0	0	110.8	R40 Q41 L42 Y46 R47 S48	R40-G44 PolarHBondContact O-N 3.18Å; Q41-G44 WeakPolarHBondContact O-CA 3.48Å; Q41-G44 PolarHBondContact O-N 3.4Å; L42-G44 PolarHBondContact O-N 3.05Å; G44-Y46 VanDerWaalsContact C-N 3.3Å; G44-Y46 PolarHBondContact O-N 3.11Å; G44-R47 PolarHBondContact O-N 3.25Å; G44-S48 PolarHBondContact O-N 3.29Å
45	H	77.3	Confident	71.9	Confident	132 Å²	132	91.9 Å²	91.9	61%	0.611	49%	0.486	S	S	*	.	H	α-helix	trans	-57.5	-39.2	-179.9	-62.6	165.7	0	0	0	113	Q41 L42 R47 S48 F49	Q41-H45 PolarHBondContact O-N 3.17Å; L42-H45 PolarHBondContact O-N 2.7Å; H45-R47 VanDerWaalsContact C-N 3.34Å; H45-R47 PolarHBondContact O-N 2.85Å; H45-S48 PolarHBondContact O-N 3.05Å; H45-F49 WeakPolarHBondContact O-CB 3.21Å; H45-F49 PolarHBondContact O-N 2.74Å
46	Y	72.8	Confident	70.9	Confident	74 Å²	74	93.1 Å²	93.1	29%	0.29	48%	0.481	S	S	.	.	H	α-helix	trans	-64.6	-36.4	175.7	-176.4	-101.1	0	0	0	112.6	L42 G44 A50 F64	L42-Y46 WeakPolarHBondContact O-CB 3.4Å; L42-Y46 PolarHBondContact O-N 3.4Å; G44-Y46 VanDerWaalsContact C-N 3.3Å; G44-Y46 PolarHBondContact O-N 3.11Å; Y46-A50 WeakPolarHBondContact O-CB 3.45Å; Y46-A50 PolarHBondContact O-N 3.02Å; Y46-F64 AromaticContact CD2-CE2 3.76Å; Y46-F64 HydrophobicContact CD2-CE2 3.76Å; Y46-F64 HydrophobicContact CD2-CZ 4.1Å; Y46-F64 HydrophobicContact CE2-CD2 4.06Å; Y46-F64 AromaticContact CE2-CE2 3.56Å; Y46-F64 HydrophobicContact CE2-CE2 3.56Å; Y46-F64 HydrophobicContact CE2-CZ 4.31Å; Y46-F64 HydrophobicContact CG-CE2 4.37Å; Y46-F64 HydrophobicContact CG-CZ 4.34Å
47	R	73.1	Confident	70.1	Confident	174 Å²	174	98.3 Å²	98.3	66%	0.657	50%	0.504	S	S	*	.	H	α-helix	trans	-69.6	-40.8	175.7	-86.9	-179.2	-77.9	-173.7	-5.7	112.3	A43 G44 H45 A50 S51	A43-R47 PolarHBondContact O-NE 2.86Å; A43-R47 PolarHBondContact O-NH2 3.02Å; G44-R47 PolarHBondContact O-N 3.25Å; H45-R47 VanDerWaalsContact C-N 3.34Å; H45-R47 PolarHBondContact O-N 2.85Å; R47-A50 PolarHBondContact O-N 3.32Å; R47-S51 WeakPolarHBondContact O-CB 3.26Å; R47-S51 PolarHBondContact O-N 2.93Å; R47-S51 PolarHBondContact O-OG 3.11Å
48	S	76.5	Confident	69.4	Low	56 Å²	56	102 Å²	102	39%	0.392	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-53.7	170.5	-61.3	0	0	0	0	110.9	G44 H45 A50 S51 E52	G44-S48 PolarHBondContact O-N 3.29Å; H45-S48 PolarHBondContact O-N 3.05Å; S48-A50 VanDerWaalsContact C-N 3.32Å; S48-A50 PolarHBondContact O-N 2.91Å; S48-S51 PolarHBondContact O-N 3.32Å; S48-S51 VanDerWaalsContact O-N 3.07Å; S48-S51 PolarHBondContact O-OG 3.01Å; S48-E52 WeakPolarHBondContact O-CG 3.28Å; S48-E52 PolarHBondContact O-N 3.34Å
49	F	76.2	Confident	68.8	Low	58 Å²	58	100.9 Å²	100.9	25%	0.254	51%	0.511	S	S	.	.	H	α-helix	trans	-56.5	-40.6	178.7	175.9	-95.7	0	0	0	113.6	H45 R53 F216	H45-F49 WeakPolarHBondContact O-CB 3.21Å; H45-F49 PolarHBondContact O-N 2.74Å; F49-R53 PolarHBondContact O-N 3.45Å; F49-F216 HydrophobicContact CD2-CE2 4.46Å; F49-F216 HydrophobicContact CD2-CZ 4.33Å; F49-F216 HydrophobicContact CE1-CZ 4.44Å; F49-F216 AromaticContact CE2-CE1 3.86Å; F49-F216 HydrophobicContact CE2-CE1 3.86Å; F49-F216 AromaticContact CE2-CE2 3.64Å; F49-F216 HydrophobicContact CE2-CE2 3.64Å; F49-F216 AromaticContact CE2-CZ 3.25Å; F49-F216 HydrophobicContact CE2-CZ 3.25Å; F49-F216 AromaticContact CZ-CE1 3.66Å; F49-F216 HydrophobicContact CZ-CE1 3.66Å; F49-F216 HydrophobicContact CZ-CE2 4.2Å; F49-F216 AromaticContact CZ-CZ 3.33Å; F49-F216 HydrophobicContact CZ-CZ 3.33Å
50	A	68.4	Low	68.4	Low	25 Å²	25	101.5 Å²	101.5	21%	0.207	51%	0.511	C	S	.	.	H	α-helix	trans	-66.9	-43.6	175.4	0	0	0	0	0	112	Y46 R47 S48 E52 R53 L58	Y46-A50 WeakPolarHBondContact O-CB 3.45Å; Y46-A50 PolarHBondContact O-N 3.02Å; R47-A50 PolarHBondContact O-N 3.32Å; S48-A50 VanDerWaalsContact C-N 3.32Å; S48-A50 PolarHBondContact O-N 2.91Å; A50-E52 VanDerWaalsContact C-N 3.29Å; A50-E52 PolarHBondContact O-N 2.83Å; A50-R53 CarbonylContact O-C 3.52Å; A50-R53 PolarHBondContact O-N 2.88Å; A50-R53 VanDerWaalsContact O-N 3.14Å; A50-L58 HydrophobicContact CB-CD2 4.06Å
51	S	67.4	Low	67.8	Low	88 Å²	88	97 Å²	97	62%	0.615	51%	0.506	S	S	*	.	H	α-helix	trans	-65.6	-30.7	177	67.4	0	0	0	0	113.3	R47 S48 R53	R47-S51 WeakPolarHBondContact O-CB 3.26Å; R47-S51 PolarHBondContact O-N 2.93Å; R47-S51 PolarHBondContact O-OG 3.11Å; S48-S51 PolarHBondContact O-N 3.32Å; S48-S51 VanDerWaalsContact O-N 3.07Å; S48-S51 PolarHBondContact O-OG 3.01Å; S51-R53 VanDerWaalsContact C-N 3.31Å
52	E	70.9	Confident	67.1	Low	139 Å²	139	97.1 Å²	97.1	65%	0.65	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.4	175.2	-71.3	167.1	-152.5	0	0	113.3	S48 A50	S48-E52 WeakPolarHBondContact O-CG 3.28Å; S48-E52 PolarHBondContact O-N 3.34Å; A50-E52 VanDerWaalsContact C-N 3.29Å; A50-E52 PolarHBondContact O-N 2.83Å
53	R	60	Low	66.8	Low	102 Å²	102	96.8 Å²	96.8	39%	0.385	51%	0.507	S	S	.	.			trans	-138.1	70.7	-176.6	-63.6	-169.8	176.1	178.5	1.2	113.7	F49 A50 S51 Q55 H56	F49-R53 PolarHBondContact O-N 3.45Å; A50-R53 CarbonylContact O-C 3.52Å; A50-R53 PolarHBondContact O-N 2.88Å; A50-R53 VanDerWaalsContact O-N 3.14Å; S51-R53 VanDerWaalsContact C-N 3.31Å; R53-Q55 PolarHBondContact O-N 3.4Å; R53-H56 PolarHBondContact O-N 2.98Å
54	P	58.8	Low	66.7	Low	117 Å²	117	98 Å²	98	76%	0.76	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.6	-174.8	-23.8	35.2	0	0	0	116.3	H56	P54-H56 VanDerWaalsContact C-N 3.35Å
55	Q	52.6	Low	66.5	Low	200 Å²	200	99.7 Å²	99.7	94%	0.935	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	4.5	-178.7	-66.9	-173.8	-9.1	0	0	114.1	R53	R53-Q55 PolarHBondContact O-N 3.4Å
56	H	53.4	Low	66.3	Low	87 Å²	87	99.9 Å²	99.9	40%	0.403	51%	0.511	S	S	.	.	S	Bend	trans	-92	116.6	175.1	-128.6	-75.7	0	0	0	109.9	R53 P54 L58 R219	R53-H56 PolarHBondContact O-N 2.98Å; P54-H56 VanDerWaalsContact C-N 3.35Å; H56-L58 PolarHBondContact O-N 3.45Å; H56-L58 VanDerWaalsContact O-N 3.11Å; H56-R219 PolarHBondContact NE2-NH1 2.87Å
57	E	55.7	Low	66.3	Low	179 Å²	179	101.3 Å²	101.3	84%	0.836	52%	0.52	S	S	*	.			trans	-53.6	118.9	170.9	-172.3	175.8	-154.6	0	0	109.2	V59	E57-V59 PolarHBondContact O-N 2.81Å; E57-V59 VanDerWaalsContact O-N 3.09Å
58	L	61.6	Low	66.5	Low	114 Å²	114	97.4 Å²	97.4	60%	0.597	51%	0.508	S	S	*	.			trans	-76.1	103.5	-172.6	-67.7	177.5	0	0	0	109	A50 H56	A50-L58 HydrophobicContact CB-CD2 4.06Å; H56-L58 PolarHBondContact O-N 3.45Å; H56-L58 VanDerWaalsContact O-N 3.11Å
59	V	63	Low	66.4	Low	63 Å²	63	98 Å²	98	38%	0.382	51%	0.51	S	S	.	.			trans	-47.8	122.3	175.5	177.7	0	0	0	0	109.4	E57 T63 F64	E57-V59 PolarHBondContact O-N 2.81Å; E57-V59 VanDerWaalsContact O-N 3.09Å; V59-T63 HydrophobicContact CG1-CG2 3.73Å; V59-F64 HydrophobicContact CG1-CB 4.27Å
60	P	67.1	Low	66.5	Low	69 Å²	69	99.3 Å²	99.3	45%	0.448	52%	0.519	S	S	.	.			trans	-51.4	143.1	-178.2	-30.5	36.2	0	0	0	112.3	E62 T63 F64	P60-E62 WeakPolarHBondContact CB-OE2 3.37Å; P60-E62 PolarHBondContact O-N 2.84Å; P60-E62 VanDerWaalsContact O-N 3.1Å; P60-T63 CarbonylContact O-C 3.59Å; P60-T63 WeakPolarHBondContact O-CA 3.22Å; P60-T63 WeakPolarHBondContact O-CB 3.48Å; P60-T63 PolarHBondContact O-N 2.7Å; P60-F64 PolarHBondContact O-N 2.87Å
61	P	61	Low	66.9	Low	93 Å²	93	103.4 Å²	103.4	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-59.3	-29.7	-170	21.1	-31	0	0	0	113.2	S65	P61-S65 VanDerWaalsContact O-CB 3.31Å; P61-S65 WeakPolarHBondContact O-CB 3.19Å; P61-S65 PolarHBondContact O-N 3.19Å
62	E	64.9	Low	67.4	Low	130 Å²	130	104.9 Å²	104.9	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-61.5	-51	172.6	-56.8	69.6	-151.7	0	0	110.5	P60 S65 K66	P60-E62 WeakPolarHBondContact CB-OE2 3.37Å; P60-E62 PolarHBondContact O-N 2.84Å; P60-E62 VanDerWaalsContact O-N 3.1Å; E62-S65 PolarHBondContact O-N 3.19Å; E62-S65 PolarHBondContact O-OG 2.98Å; E62-K66 PolarHBondContact O-N 2.84Å
63	T	71	Confident	67.6	Low	61 Å²	61	101 Å²	101	37%	0.374	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-38.7	179.5	-51.4	0	0	0	0	111.7	V59 P60 K66 H67	V59-T63 HydrophobicContact CG1-CG2 3.73Å; P60-T63 CarbonylContact O-C 3.59Å; P60-T63 WeakPolarHBondContact O-CA 3.22Å; P60-T63 WeakPolarHBondContact O-CB 3.48Å; P60-T63 PolarHBondContact O-N 2.7Å; T63-K66 PolarHBondContact O-N 3.02Å; T63-H67 PolarHBondContact O-CD2 3.41Å; T63-H67 PolarHBondContact O-N 3.25Å; T63-H67 VanDerWaalsContact O-N 3.1Å
64	F	74.6	Confident	68.4	Low	69 Å²	69	101.2 Å²	101.2	30%	0.303	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-46.1	172.5	176.8	-92.4	0	0	0	111.5	Y46 V59 P60 K66 H67 F68	Y46-F64 AromaticContact CD2-CE2 3.76Å; Y46-F64 HydrophobicContact CD2-CE2 3.76Å; Y46-F64 HydrophobicContact CD2-CZ 4.1Å; Y46-F64 HydrophobicContact CE2-CD2 4.06Å; Y46-F64 AromaticContact CE2-CE2 3.56Å; Y46-F64 HydrophobicContact CE2-CE2 3.56Å; Y46-F64 HydrophobicContact CE2-CZ 4.31Å; Y46-F64 HydrophobicContact CG-CE2 4.37Å; Y46-F64 HydrophobicContact CG-CZ 4.34Å; V59-F64 HydrophobicContact CG1-CB 4.27Å; P60-F64 PolarHBondContact O-N 2.87Å; F64-K66 VanDerWaalsContact C-N 3.28Å; F64-K66 PolarHBondContact O-N 2.94Å; F64-H67 PolarHBondContact O-N 3.09Å; F64-F68 HydrophobicContact CE1-CB 4.49Å; F64-F68 WeakPolarHBondContact O-CB 3.44Å; F64-F68 PolarHBondContact O-N 2.73Å
65	S	69.6	Low	69.1	Low	63 Å²	63	100.3 Å²	100.3	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-37.3	-179.8	77.8	0	0	0	0	112.6	P61 E62 T69	P61-S65 VanDerWaalsContact O-CB 3.31Å; P61-S65 WeakPolarHBondContact O-CB 3.19Å; P61-S65 PolarHBondContact O-N 3.19Å; E62-S65 PolarHBondContact O-N 3.19Å; E62-S65 PolarHBondContact O-OG 2.98Å; S65-T69 WeakPolarHBondContact O-CB 3.44Å; S65-T69 PolarHBondContact O-N 3.07Å; S65-T69 PolarHBondContact O-OG1 3.28Å
66	K	74	Confident	70.1	Confident	137 Å²	137	96.6 Å²	96.6	60%	0.596	49%	0.486	S	S	*	.	H	α-helix	trans	-65.4	-55.2	174.8	-173.9	178.9	177.4	-175.8	0	111.1	E62 T63 F64 F68 T69 D70	E62-K66 PolarHBondContact O-N 2.84Å; T63-K66 PolarHBondContact O-N 3.02Å; F64-K66 VanDerWaalsContact C-N 3.28Å; F64-K66 PolarHBondContact O-N 2.94Å; K66-F68 VanDerWaalsContact C-N 3.3Å; K66-F68 PolarHBondContact O-N 3.25Å; K66-T69 WeakPolarHBondContact O-CB 3.46Å; K66-T69 PolarHBondContact O-N 3.14Å; K66-D70 PolarHBondContact O-N 3.28Å
67	H	73.1	Confident	71.1	Confident	104 Å²	104	94.7 Å²	94.7	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-60.6	-37.2	179.2	-72	-53.1	0	0	0	113.2	T63 F64 L71	T63-H67 PolarHBondContact O-CD2 3.41Å; T63-H67 PolarHBondContact O-N 3.25Å; T63-H67 VanDerWaalsContact O-N 3.1Å; F64-H67 PolarHBondContact O-N 3.09Å; H67-L71 WeakPolarHBondContact O-CB 3.43Å; H67-L71 VanDerWaalsContact O-CG 3.28Å; H67-L71 WeakPolarHBondContact O-CG 3.38Å; H67-L71 PolarHBondContact O-N 2.91Å
68	F	77.3	Confident	71.9	Confident	91 Å²	91	91.4 Å²	91.4	40%	0.399	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-44.3	173	175.4	-102.9	0	0	0	111.6	L42 F64 K66 L71 F72	L42-F68 HydrophobicContact CD2-CD2 3.8Å; L42-F68 HydrophobicContact CD2-CE1 4.45Å; L42-F68 HydrophobicContact CD2-CE2 3.29Å; L42-F68 HydrophobicContact CD2-CZ 3.67Å; F64-F68 HydrophobicContact CE1-CB 4.49Å; F64-F68 WeakPolarHBondContact O-CB 3.44Å; F64-F68 PolarHBondContact O-N 2.73Å; K66-F68 VanDerWaalsContact C-N 3.3Å; K66-F68 PolarHBondContact O-N 3.25Å; F68-L71 PolarHBondContact O-N 3.43Å; F68-F72 HydrophobicContact CE1-CB 4.45Å; F68-F72 HydrophobicContact CZ-CB 4.28Å; F68-F72 HydrophobicContact CZ-CD2 4.23Å; F68-F72 HydrophobicContact CZ-CG 4.48Å; F68-F72 WeakPolarHBondContact O-CB 3.41Å; F68-F72 PolarHBondContact O-N 2.95Å
69	T	73.9	Confident	72.3	Confident	70 Å²	70	88.3 Å²	88.3	43%	0.429	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-43.3	178.5	-57.5	0	0	0	0	111.6	S65 K66 Q73	S65-T69 WeakPolarHBondContact O-CB 3.44Å; S65-T69 PolarHBondContact O-N 3.07Å; S65-T69 PolarHBondContact O-OG1 3.28Å; K66-T69 WeakPolarHBondContact O-CB 3.46Å; K66-T69 PolarHBondContact O-N 3.14Å; T69-Q73 VanDerWaalsContact O-CB 3.28Å; T69-Q73 WeakPolarHBondContact O-CB 3.21Å; T69-Q73 PolarHBondContact O-N 2.96Å
70	D	77.5	Confident	72.5	Confident	85 Å²	85	89.1 Å²	89.1	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-47.5	178.6	-66.2	-30	0	0	0	111.3	K66 Q73 Q74	K66-D70 PolarHBondContact O-N 3.28Å; D70-Q73 PolarHBondContact O-N 3.01Å; D70-Q74 WeakPolarHBondContact O-CB 3.35Å; D70-Q74 PolarHBondContact O-N 2.88Å
71	L	77.5	Confident	72.6	Confident	110 Å²	110	91.2 Å²	91.2	58%	0.576	46%	0.462	S	S	*	.	H	α-helix	trans	-67.8	-40.9	178.3	-71.8	170.2	0	0	0	112.8	H67 F68 Q74 H75	H67-L71 WeakPolarHBondContact O-CB 3.43Å; H67-L71 VanDerWaalsContact O-CG 3.28Å; H67-L71 WeakPolarHBondContact O-CG 3.38Å; H67-L71 PolarHBondContact O-N 2.91Å; F68-L71 PolarHBondContact O-N 3.43Å; L71-Q74 PolarHBondContact O-N 3.01Å; L71-H75 PolarHBondContact O-N 2.91Å
72	F	78.8	Confident	72.8	Confident	120 Å²	120	92.1 Å²	92.1	53%	0.526	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-45.1	175.2	178.3	-91.3	0	0	0	110.8	F68 Q74 H75 F76	F68-F72 HydrophobicContact CE1-CB 4.45Å; F68-F72 HydrophobicContact CZ-CB 4.28Å; F68-F72 HydrophobicContact CZ-CD2 4.23Å; F68-F72 HydrophobicContact CZ-CG 4.48Å; F68-F72 WeakPolarHBondContact O-CB 3.41Å; F68-F72 PolarHBondContact O-N 2.95Å; F72-Q74 VanDerWaalsContact C-N 3.33Å; F72-Q74 PolarHBondContact O-N 3.02Å; F72-H75 PolarHBondContact O-N 3.07Å; F72-F76 HydrophobicContact CE1-CB 4.37Å; F72-F76 HydrophobicContact CZ-CD2 4.43Å; F72-F76 WeakPolarHBondContact O-CB 3.14Å; F72-F76 PolarHBondContact O-N 3.41Å
73	Q	74.6	Confident	72.3	Confident	56 Å²	56	92.6 Å²	92.6	26%	0.262	46%	0.463	S	S	.	.	H	α-helix	trans	-65.4	-36.6	177.6	-174.9	169.1	-23.6	0	0	111.9	T69 D70 C77	T69-Q73 VanDerWaalsContact O-CB 3.28Å; T69-Q73 WeakPolarHBondContact O-CB 3.21Å; T69-Q73 PolarHBondContact O-N 2.96Å; D70-Q73 PolarHBondContact O-N 3.01Å; Q73-C77 PolarHBondContact O-N 3.28Å; Q73-C77 VanDerWaalsContact O-N 3.12Å; Q73-C77 PolarHBondContact O-SG 3.49Å
74	Q	76.4	Confident	71.2	Confident	107 Å²	107	93 Å²	93	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-62.2	-52.1	173.4	-178.3	178.4	-2.7	0	0	111.8	D70 L71 F72 C77 Q78	D70-Q74 WeakPolarHBondContact O-CB 3.35Å; D70-Q74 PolarHBondContact O-N 2.88Å; L71-Q74 PolarHBondContact O-N 3.01Å; F72-Q74 VanDerWaalsContact C-N 3.33Å; F72-Q74 PolarHBondContact O-N 3.02Å; Q74-C77 PolarHBondContact O-N 3.31Å; Q74-Q78 WeakPolarHBondContact O-CG 3.43Å; Q74-Q78 PolarHBondContact O-N 3.27Å
75	H	73.1	Confident	69.9	Low	98 Å²	98	93.2 Å²	93.2	45%	0.454	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-38	-179.4	-168.7	-40.5	0	0	0	111.9	L71 F72 Q78 E79	L71-H75 PolarHBondContact O-N 2.91Å; F72-H75 PolarHBondContact O-N 3.07Å; H75-Q78 PolarHBondContact O-N 3.43Å; H75-E79 IonicContact CE1-OE2 3.81Å; H75-E79 WeakPolarHBondContact O-CB 3.43Å; H75-E79 PolarHBondContact O-N 2.92Å
76	F	73.3	Confident	68.8	Low	122 Å²	122	95.8 Å²	95.8	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-43	178.6	-176.4	-93.3	0	0	0	111.8	F72 V80	F72-F76 HydrophobicContact CE1-CB 4.37Å; F72-F76 HydrophobicContact CZ-CD2 4.43Å; F72-F76 WeakPolarHBondContact O-CB 3.14Å; F72-F76 PolarHBondContact O-N 3.41Å; F76-V80 HydrophobicContact CD1-CG2 4.34Å; F76-V80 HydrophobicContact CE1-CG2 3.96Å; F76-V80 HydrophobicContact CE2-CG2 4.36Å; F76-V80 HydrophobicContact CZ-CG2 3.96Å; F76-V80 WeakPolarHBondContact O-CB 3.43Å; F76-V80 VanDerWaalsContact O-CG2 3.28Å; F76-V80 WeakPolarHBondContact O-CG2 3.47Å; F76-V80 PolarHBondContact O-N 3.44Å; F76-V80 VanDerWaalsContact O-N 3.14Å
77	C	74.9	Confident	67.3	Low	48 Å²	48	92.9 Å²	92.9	32%	0.324	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-50.5	171.6	-73.8	0	0	0	0	111.2	Q73 Q74 E79 V80 D81	Q73-C77 PolarHBondContact O-N 3.28Å; Q73-C77 VanDerWaalsContact O-N 3.12Å; Q73-C77 PolarHBondContact O-SG 3.49Å; Q74-C77 PolarHBondContact O-N 3.31Å; C77-E79 VanDerWaalsContact C-N 3.29Å; C77-E79 PolarHBondContact O-N 3.28Å; C77-V80 PolarHBondContact O-N 3.49Å; C77-D81 WeakPolarHBondContact O-CB 3.37Å; C77-D81 PolarHBondContact O-N 3.05Å; C77-D81 VanDerWaalsContact O-OD2 3.13Å
78	Q	72.5	Confident	65.6	Low	110 Å²	110	93.2 Å²	93.2	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-58.5	-35.7	-178.1	-74.5	178.5	-11.7	0	0	114	Q74 H75 K82	Q74-Q78 WeakPolarHBondContact O-CG 3.43Å; Q74-Q78 PolarHBondContact O-N 3.27Å; H75-Q78 PolarHBondContact O-N 3.43Å; Q78-K82 WeakPolarHBondContact O-CB 3.38Å; Q78-K82 PolarHBondContact O-N 3.49Å
79	E	69.6	Low	63.5	Low	49 Å²	49	93 Å²	93	23%	0.229	55%	0.55	C	S	.	*	H	α-helix	trans	-78.8	-35.9	178.9	-149.2	73.7	167.4	0	0	111.9	H75 C77 K82 D83 F203	H75-E79 IonicContact CE1-OE2 3.81Å; H75-E79 WeakPolarHBondContact O-CB 3.43Å; H75-E79 PolarHBondContact O-N 2.92Å; C77-E79 VanDerWaalsContact C-N 3.29Å; C77-E79 PolarHBondContact O-N 3.28Å; E79-K82 HydrophobicContact CG-CD 4.44Å; E79-K82 WeakPolarHBondContact O-CB 3.41Å; E79-K82 PolarHBondContact O-N 2.97Å; E79-K82 IonicContact OE1-NZ 3.25Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 VanDerWaalsContact OE2-CD 3.23Å; E79-K82 WeakPolarHBondContact OE2-CD 3.29Å; E79-K82 IonicContact OE2-NZ 2.74Å; E79-K82 PolarHBondContact OE2-NZ 3Å; E79-D83 PolarHBondContact O-N 3.43Å; E79-F203 HydrophobicContact CG-CZ 4.39Å
80	V	68.9	Low	61.4	Low	80 Å²	80	96 Å²	96	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-68.5	-38.9	174.3	170.1	0	0	0	0	112	F76 C77 K82 G84	F76-V80 HydrophobicContact CD1-CG2 4.34Å; F76-V80 HydrophobicContact CE1-CG2 3.96Å; F76-V80 HydrophobicContact CE2-CG2 4.36Å; F76-V80 HydrophobicContact CZ-CG2 3.96Å; F76-V80 WeakPolarHBondContact O-CB 3.43Å; F76-V80 VanDerWaalsContact O-CG2 3.28Å; F76-V80 WeakPolarHBondContact O-CG2 3.47Å; F76-V80 PolarHBondContact O-N 3.44Å; F76-V80 VanDerWaalsContact O-N 3.14Å; C77-V80 PolarHBondContact O-N 3.49Å; V80-K82 PolarHBondContact O-N 3.49Å; V80-G84 PolarHBondContact O-N 3.24Å
81	D	67.8	Low	59.3	Low	112 Å²	112	96.1 Å²	96.1	60%	0.599	59%	0.587	S	S	*	*	H	α-helix	trans	-67.1	-23.1	176.3	-65	-30.9	0	0	0	111.9	C77	C77-D81 WeakPolarHBondContact O-CB 3.37Å; C77-D81 PolarHBondContact O-N 3.05Å; C77-D81 VanDerWaalsContact O-OD2 3.13Å
82	K	66.6	Low	57.1	Low	112 Å²	112	97.7 Å²	97.7	49%	0.487	60%	0.601	S	S	.	*	H	α-helix	trans	-69.9	-50.1	179.4	-146.2	174.5	179.5	-178.4	0	111.8	Q78 E79 V80 G84 A85	Q78-K82 WeakPolarHBondContact O-CB 3.38Å; Q78-K82 PolarHBondContact O-N 3.49Å; E79-K82 HydrophobicContact CG-CD 4.44Å; E79-K82 WeakPolarHBondContact O-CB 3.41Å; E79-K82 PolarHBondContact O-N 2.97Å; E79-K82 IonicContact OE1-NZ 3.25Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 VanDerWaalsContact OE2-CD 3.23Å; E79-K82 WeakPolarHBondContact OE2-CD 3.29Å; E79-K82 IonicContact OE2-NZ 2.74Å; E79-K82 PolarHBondContact OE2-NZ 3Å; V80-K82 PolarHBondContact O-N 3.49Å; K82-G84 VanDerWaalsContact C-N 3.25Å; K82-G84 PolarHBondContact O-N 2.87Å; K82-A85 PolarHBondContact O-N 3.49Å; K82-A85 VanDerWaalsContact O-N 3.15Å
83	D	52.6	Low	54.8	Low	140 Å²	140	96.4 Å²	96.4	75%	0.749	61%	0.612	S	S	*	*	H	α-helix	trans	-67.9	-28.2	179.4	-70.9	-20	0	0	0	111.5	E79 A85	E79-D83 PolarHBondContact O-N 3.43Å; D83-A85 VanDerWaalsContact C-N 3.28Å; D83-A85 PolarHBondContact O-N 3.46Å
84	G	48.7	Very low	52.7	Low	71 Å²	71	99.8 Å²	99.8	73%	0.732	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-17.9	173.2	0	0	0	0	0	115.1	V80 K82	V80-G84 PolarHBondContact O-N 3.24Å; K82-G84 VanDerWaalsContact C-N 3.25Å; K82-G84 PolarHBondContact O-N 2.87Å
85	A	48.2	Very low	50.4	Low	73 Å²	73	100.1 Å²	100.1	60%	0.603	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-21.3	-173.5	0	0	0	0	0	114.4	K82 D83 G87	K82-A85 PolarHBondContact O-N 3.49Å; K82-A85 VanDerWaalsContact O-N 3.15Å; D83-A85 VanDerWaalsContact C-N 3.28Å; D83-A85 PolarHBondContact O-N 3.46Å; A85-G87 PolarHBondContact O-N 3.35Å
86	S	45.8	Very low	48.6	Very low	117 Å²	117	100.9 Å²	100.9	82%	0.818	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	26.1	-172.7	-167.4	0	0	0	0	115
87	G	42.5	Very low	46.5	Very low	75 Å²	75	104.5 Å²	104.5	77%	0.773	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	10.4	-171.3	0	0	0	0	0	116	A85	A85-G87 PolarHBondContact O-N 3.35Å
88	S	36.9	Very low	44.2	Very low	112 Å²	112	107 Å²	107	78%	0.783	71%	0.709	S	S	*	*	S	Bend	trans	-156.9	160.7	175.4	-164.9	0	0	0	0	113.5
89	A	33.3	Very low	42.3	Very low	87 Å²	87	109 Å²	109	72%	0.719	72%	0.723	S	S	*	*			trans	60	95	170.1	0	0	0	0	0	117.9
90	S	30	Very low	40.4	Very low	133 Å²	133	113.1 Å²	113.1	93%	0.93	75%	0.745	S	S	*	*			trans	-72.8	117.2	143.5	176.3	0	0	0	0	108.9
91	A	33	Very low	38.5	Very low	87 Å²	87	116.1 Å²	116.1	72%	0.719	76%	0.758	S	S	*	*			trans	-157	117.9	165.8	0	0	0	0	0	111.9
92	T	31	Very low	36.6	Very low	142 Å²	142	118.5 Å²	118.5	87%	0.871	77%	0.766	S	S	*	*			trans	-0.5	122.5	160.6	-45	0	0	0	0	119
93	A	30.7	Very low	34.9	Very low	93 Å²	93	119.2 Å²	119.2	77%	0.769	77%	0.774	S	S	*	*			trans	-88.4	154	170	0	0	0	0	0	113.4
94	P	31	Very low	33.7	Very low	128 Å²	128	122.1 Å²	122.1	83%	0.831	78%	0.775	S	S	*	*			trans	-115.8	154.1	151.5	36.1	-27.7	0	0	0	112.4
95	S	27.5	Very low	32.7	Very low	113 Å²	113	127.8 Å²	127.8	79%	0.79	78%	0.782	S	S	*	*			trans	-99.8	162.9	179	56.2	0	0	0	0	113
96	P	36.8	Very low	31.6	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	78%	0.784	S	S	*	*			trans	-106.8	116.2	-156.1	36.9	-30.9	0	0	0	116.6
97	H	28.3	Very low	30.6	Very low	197 Å²	197	129.3 Å²	129.3	91%	0.912	78%	0.783	S	S	*	*			trans	-144.3	151.6	151.8	-66.5	-79.9	0	0	0	107.2
98	A	27.3	Very low	29.9	Very low	101 Å²	101	133 Å²	133	84%	0.835	78%	0.784	S	S	*	*			cis	-141.2	-157.1	10.6	0	0	0	0	0	112.5
99	L	31	Very low	29.4	Very low	153 Å²	153	131.7 Å²	131.7	80%	0.801	78%	0.775	S	S	*	*			trans	-100.8	156.1	-169.2	-83.2	163.6	0	0	0	114.7
100	I	31.1	Very low	29.2	Very low	134 Å²	134	134.5 Å²	134.5	69%	0.687	77%	0.773	S	S	*	*			trans	78.8	145.1	142.4	-76.3	164.2	0	0	0	120.2
101	N	27.9	Very low	29.2	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	76%	0.756	S	S	*	*			trans	64.2	124.5	171.8	-67.5	-19	0	0	0	118.2
102	Q	29.1	Very low	29	Very low	162 Å²	162	137.6 Å²	137.6	76%	0.757	76%	0.755	S	S	*	*			cis	84.1	137.2	49.7	-84.3	-70.6	6.7	0	0	115.8
103	L	30.1	Very low	29.2	Very low	127 Å²	127	140.1 Å²	140.1	67%	0.665	75%	0.749	S	S	*	*			trans	73.4	108.7	163.1	-62.9	163.3	0	0	0	121
104	R	27.8	Very low	29.1	Very low	201 Å²	201	143 Å²	143	76%	0.758	75%	0.746	S	S	*	*				84.1	124.9	120.5	-79.1	-178.8	177.8	-178.6	-0.4	123.2
105	H	26.8	Very low	29	Very low	191 Å²	191	141 Å²	141	88%	0.884	74%	0.741	S	S	*	*			trans	80.5	155.1	138.5	-63.3	-46.3	0	0	0	120.9
106	S	25	Very low	29	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	73%	0.734	S	S	*	*			trans	-108.4	159.7	-168.9	52.8	0	0	0	0	112.1
107	T	26.1	Very low	28.8	Very low	127 Å²	127	147.8 Å²	147.8	78%	0.779	74%	0.738	S	S	*	*				-172.9	134.2	124.5	27.8	0	0	0	0	114.1
108	L	28.5	Very low	28.9	Very low	152 Å²	152	143.3 Å²	143.3	80%	0.796	73%	0.729	S	S	*	*			trans	44.6	140.7	139.6	-92.9	73.7	0	0	0	124.8
109	S	26.1	Very low	28.9	Very low	85 Å²	85	144.3 Å²	144.3	59%	0.594	73%	0.729	S	S	*	*			trans	74	145.3	133.1	-68.6	0	0	0	0	121.3
110	Q	28.5	Very low	28.8	Very low	146 Å²	146	140.2 Å²	140.2	68%	0.682	73%	0.725	S	S	*	*			cis	-168.6	172.9	-21	-132.6	170.2	-81.1	0	0	113.1
111	D	29.1	Very low	28.7	Very low	106 Å²	106	137.7 Å²	137.7	57%	0.567	73%	0.732	S	S	*	*			trans	84	132.5	138.2	-79.5	-6.2	0	0	0	125.5
112	Y	29	Very low	28.8	Very low	180 Å²	180	135.6 Å²	135.6	71%	0.706	73%	0.734	S	S	*	*			trans	63.5	146.1	146.3	-75.2	-56.9	0	0	0	120.6
113	R	35.5	Very low	28.8	Very low	195 Å²	195	132.4 Å²	132.4	74%	0.736	74%	0.736	S	S	*	*			cis	-151.2	172.5	4.4	-156.1	148.7	-170	161.3	3.1	113.8
114	E	28.8	Very low	28.8	Very low	153 Å²	153	131 Å²	131	72%	0.715	74%	0.736	S	S	*	*			trans	-53.9	173.8	168.2	-51.6	156.2	84.6	0	0	113.4
115	A	29.8	Very low	28.9	Very low	87 Å²	87	129 Å²	129	72%	0.719	74%	0.739	S	S	*	*			cis	-166	174	23.7	0	0	0	0	0	108.1
116	K	25.7	Very low	28.8	Very low	152 Å²	152	124.4 Å²	124.4	66%	0.661	73%	0.728	S	S	*	*			cis	154.4	118.9	-2	163.2	-173.2	174.5	-176.6	0	107.2
117	R	33.1	Very low	28.9	Very low	218 Å²	218	126.1 Å²	126.1	82%	0.823	74%	0.735	S	S	*	*			trans	69.9	161.8	156.6	-67.5	178.5	-162.4	179.3	3.1	117.7
118	S	30.1	Very low	29.1	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	74%	0.736	S	S	*	*			cis	-171.8	158.3	-12.5	43.5	0	0	0	0	113.4
119	S	28.5	Very low	30	Very low	121 Å²	121	124.5 Å²	124.5	85%	0.846	73%	0.733	S	S	*	*			trans	71.8	147.6	152.3	-152	0	0	0	0	118.7
120	G	28.8	Very low	29.8	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	75%	0.745	S	S	*	*			cis	148.6	130.2	-14.9	0	0	0	0	0	115.2
121	G	27.9	Very low	29.7	Very low	81 Å²	81	129.2 Å²	129.2	84%	0.835	75%	0.752	S	S	*	*			trans	84.1	156.9	171.7	0	0	0	0	0	116.1
122	A	29.9	Very low	29.5	Very low	99 Å²	99	132.4 Å²	132.4	82%	0.818	76%	0.763	S	S	*	*			cis	-165.2	146.7	-13.4	0	0	0	0	0	111.8
123	A	30.3	Very low	30.3	Very low	95 Å²	95	128.5 Å²	128.5	79%	0.785	76%	0.76	S	S	*	*			trans	45.7	162.6	150.5	0	0	0	0	0	121
124	S	29.2	Very low	29.7	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	76%	0.759	S	S	*	*			cis	-162.8	168.9	15.8	-28.7	0	0	0	0	113.1
125	I	29.6	Very low	29.5	Very low	159 Å²	159	123.7 Å²	123.7	82%	0.815	76%	0.762	S	S	*	*			trans	78.6	106.1	140.9	-70.1	163.4	0	0	0	121.8
126	S	25.1	Very low	29.3	Very low	94 Å²	94	125.8 Å²	125.8	66%	0.657	77%	0.766	S	S	*	*				83.2	137.1	120.7	-157.7	0	0	0	0	126.3
127	T	26.7	Very low	29.1	Very low	130 Å²	130	123.8 Å²	123.8	80%	0.798	77%	0.771	S	S	*	*			trans	75	157.2	145	33.1	0	0	0	0	122.7
128	V	30.1	Very low	29.5	Very low	132 Å²	132	119.7 Å²	119.7	80%	0.8	77%	0.772	S	S	*	*			trans	-156.8	135.9	-162.6	174.7	0	0	0	0	105.6
129	P	48	Very low	29.5	Very low	114 Å²	114	123.5 Å²	123.5	74%	0.74	78%	0.779	S	S	*	*				-158.1	170.2	69.3	45	-24.3	0	0	0	120.4
130	K	23	Very low	30.1	Very low	195 Å²	195	122.8 Å²	122.8	85%	0.848	77%	0.771	S	S	*	*			trans	28	122.7	137.6	-168.4	-168.4	-178.7	-179.3	0	120.5
131	V	26.5	Very low	29.9	Very low	135 Å²	135	128 Å²	128	82%	0.818	78%	0.777	S	S	*	*				174.8	155	127.1	145.7	0	0	0	0	111.8
132	E	23.2	Very low	30.1	Very low	172 Å²	172	131.6 Å²	131.6	80%	0.804	78%	0.777	S	S	*	*			trans	-90	-169.9	176.1	-122.8	-170.9	123	0	0	111.6
133	P	46.9	Very low	30.7	Very low	98 Å²	98	131.4 Å²	131.4	64%	0.636	77%	0.767	S	S	*	*			cis	-130.4	-155.7	-25.6	35	-14.7	0	0	0	112.2
134	V	22.8	Very low	30.7	Very low	120 Å²	120	133.8 Å²	133.8	73%	0.727	77%	0.766	S	S	*	*			trans	131.7	103.3	144.4	177.2	0	0	0	0	117.1
135	V	24.2	Very low	30.6	Very low	127 Å²	127	139.4 Å²	139.4	77%	0.77	77%	0.772	S	S	*	*			trans	43.6	130.7	131.1	-170.7	0	0	0	0	121.9
136	V	25	Very low	30.5	Very low	132 Å²	132	137.5 Å²	137.5	80%	0.8	77%	0.772	S	S	*	*				-179.5	140	120.1	149.8	0	0	0	0	111.3
137	S	23.3	Very low	30.5	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	78%	0.777	S	S	*	*			trans	-124.2	168.9	169	-41.2	0	0	0	0	108.9
138	P	41	Very low	30.4	Very low	131 Å²	131	136.1 Å²	136.1	85%	0.851	78%	0.779	S	S	*	*				-151.9	-176	74.3	39.5	-18.3	0	0	0	116.5
139	E	28.8	Very low	30.2	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	78%	0.78	S	S	*	*			trans	-131.4	157.6	176.5	-179.1	-171.9	-138	0	0	109.8
140	P	41.9	Very low	29.2	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	78%	0.776	S	S	*	*			trans	-110.8	139.9	171.9	36.7	-26.6	0	0	0	116.7
141	E	24.1	Very low	29.4	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	77%	0.773	S	S	*	*			trans	75	95.8	150.6	-60.8	-173.8	123	0	0	121.6
142	L	32.9	Very low	29.5	Very low	157 Å²	157	140.2 Å²	140.2	82%	0.822	78%	0.778	S	S	*	*				75.3	160.8	66.1	-74.3	178.4	0	0	0	116.4
143	P	43.1	Very low	29.7	Very low	96 Å²	96	138.1 Å²	138.1	62%	0.623	78%	0.782	S	S	*	*			cis	-139.7	-179.5	-8.8	27.6	-3.5	0	0	0	117.2
144	L	30	Very low	28.7	Very low	145 Å²	145	136.3 Å²	136.3	76%	0.759	78%	0.782	S	S	*	*			trans	80.2	134.2	156.8	-47.1	-170.9	0	0	0	118.9
145	R	27.3	Very low	29	Very low	215 Å²	215	136.3 Å²	136.3	81%	0.811	79%	0.787	S	S	*	*			cis	-159.6	145.9	-11.3	-129.2	-175	-177.6	-168.2	0.8	114.8
146	C	26.1	Very low	29.2	Very low	118 Å²	118	141.6 Å²	141.6	80%	0.797	79%	0.793	S	S	*	*			trans	66.4	159.9	152.5	-68	0	0	0	0	119.5
147	A	24.8	Very low	29.4	Very low	94 Å²	94	140.8 Å²	140.8	78%	0.777	79%	0.793	S	S	*	*			trans	-148.8	163.3	-165.9	0	0	0	0	0	113.1
148	A	25.9	Very low	29.7	Very low	101 Å²	101	142.4 Å²	142.4	84%	0.835	80%	0.798	S	S	*	*			trans	24.6	140.7	154	0	0	0	0	0	121.5
149	R	25.7	Very low	29.1	Very low	216 Å²	216	139.5 Å²	139.5	82%	0.815	79%	0.792	S	S	*	*				167.3	140.9	100.2	-176.7	168.9	-176.5	-177.1	2.2	115.1
150	N	27.5	Very low	29.1	Very low	125 Å²	125	134.8 Å²	134.8	67%	0.668	79%	0.792	S	S	*	*			trans	67.7	142.8	154.3	-83.3	31.1	0	0	0	124.5
151	S	26.2	Very low	28.4	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	80%	0.8	S	S	*	*			trans	91.1	154.3	137.1	-72.1	0	0	0	0	122.2
152	F	28.7	Very low	28.6	Very low	210 Å²	210	130.4 Å²	130.4	92%	0.921	80%	0.797	S	S	*	*			trans	-96.2	140.2	-165.2	-65.3	-102	0	0	0	114.7
153	S	28.3	Very low	28.4	Very low	127 Å²	127	129.5 Å²	129.5	89%	0.888	79%	0.792	S	S	*	*			trans	176.4	149.8	140.9	-167.1	0	0	0	0	108
154	G	25.9	Very low	27.7	Very low	61 Å²	61	131.3 Å²	131.3	63%	0.629	80%	0.796	S	S	*	*			cis	151.9	129.8	-6.2	0	0	0	0	0	111.5
155	S	28.3	Very low	27.5	Very low	119 Å²	119	130.7 Å²	130.7	83%	0.832	79%	0.792	S	S	*	*			trans	70.4	155.3	178.9	-122	0	0	0	0	115.1
156	R	29.5	Very low	27.3	Very low	238 Å²	238	127.1 Å²	127.1	90%	0.898	79%	0.785	S	S	*	*			cis	-133.2	171.5	6.8	-84.5	-171.4	174	-178.5	-1.7	113.2
157	S	27.6	Very low	27.3	Very low	115 Å²	115	126.6 Å²	126.6	80%	0.804	78%	0.782	S	S	*	*			trans	-92.1	156.5	176.9	178.9	0	0	0	0	113.7
158	V	31	Very low	27.3	Very low	144 Å²	144	129.7 Å²	129.7	87%	0.873	78%	0.78	S	S	*	*			trans	163.3	138.7	143.5	153.4	0	0	0	0	107.3
159	G	27.8	Very low	27.4	Very low	71 Å²	71	129.5 Å²	129.5	73%	0.732	77%	0.773	S	S	*	*			cis	154.4	143.5	-6.3	0	0	0	0	0	111.6
160	G	27.7	Very low	27.5	Very low	83 Å²	83	125.7 Å²	125.7	86%	0.856	77%	0.768	S	S	*	*			trans	109.1	150.2	173.2	0	0	0	0	0	116
161	G	27.2	Very low	27.6	Very low	82 Å²	82	127.2 Å²	127.2	85%	0.845	78%	0.776	S	S	*	*			trans	-100.5	-146.4	166.2	0	0	0	0	0	110.8
162	S	28.4	Very low	27.7	Very low	109 Å²	109	129.6 Å²	129.6	76%	0.762	78%	0.775	S	S	*	*			cis	-167.8	174.7	-1	-163.5	0	0	0	0	109.5
163	L	29.3	Very low	27.8	Very low	139 Å²	139	126.3 Å²	126.3	73%	0.728	77%	0.766	S	S	*	*			trans	69.8	118.6	158.6	-57.7	-174.2	0	0	0	121.6
164	L	28.4	Very low	27.8	Very low	134 Å²	134	124.9 Å²	124.9	70%	0.702	76%	0.756	S	S	*	*				74.1	129.2	119.8	-60.4	177.2	0	0	0	123.8
165	I	26.1	Very low	27.8	Very low	131 Å²	131	126.8 Å²	126.8	67%	0.672	77%	0.766	S	S	*	*				82	107	124.7	-72.1	176.9	0	0	0	121.2
166	Q	23.8	Very low	27.8	Very low	141 Å²	141	125.6 Å²	125.6	66%	0.659	76%	0.763	S	S	*	*				63	118	119.8	-165.2	-177.4	-2.4	0	0	121.7
167	S	24.6	Very low	27.7	Very low	107 Å²	107	120.6 Å²	120.6	75%	0.748	75%	0.754	S	S	*	*				179.6	134.8	120.7	-76.1	0	0	0	0	108.9
168	H	25.9	Very low	27.7	Very low	159 Å²	159	124.3 Å²	124.3	74%	0.736	75%	0.751	S	S	*	*				75.5	102.4	52	-77.4	-77.3	0	0	0	115.4
169	S	27.5	Very low	27.5	Very low	96 Å²	96	125.4 Å²	125.4	67%	0.671	75%	0.746	S	S	*	*			trans	-172.8	113.3	150.8	-166.3	0	0	0	0	105.4
170	N	27.6	Very low	27.4	Very low	136 Å²	136	129.6 Å²	129.6	73%	0.727	75%	0.746	S	S	*	*				65.6	143.8	90.2	-52.3	-5.3	0	0	0	112.6
171	D	29.7	Very low	27.5	Very low	157 Å²	157	131.2 Å²	131.2	84%	0.84	74%	0.742	S	S	*	*			cis	-131.2	-172.5	24.1	-81.1	-79.8	0	0	0	115
172	E	28.6	Very low	27.4	Very low	163 Å²	163	131.4 Å²	131.4	76%	0.762	73%	0.731	S	S	*	*			trans	-123.4	179.2	-160.6	-150.8	-171.6	103.1	0	0	113.3
173	I	30.2	Very low	27.3	Very low	140 Å²	140	132.9 Å²	132.9	72%	0.718	73%	0.725	S	S	*	*			trans	73.3	144	158.4	-68	161.7	0	0	0	117.3
174	S	28.6	Very low	27.1	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	72%	0.72	S	S	*	*			cis	-171.8	152.6	-26	-90	0	0	0	0	110.1
175	A	26.6	Very low	26.9	Very low	102 Å²	102	135 Å²	135	84%	0.843	72%	0.721	S	S	*	*			trans	62.3	158.4	152.6	0	0	0	0	0	120.1
176	A	29	Very low	26.7	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	72%	0.72	S	S	*	*			cis	-167.2	160.7	-27.8	0	0	0	0	0	112.1
177	D	26.4	Very low	26.8	Very low	133 Å²	133	131.6 Å²	131.6	71%	0.711	72%	0.724	S	S	*	*			trans	77.7	154.6	153.3	-155.3	24.2	0	0	0	121.6
178	R	28.2	Very low	26.8	Very low	193 Å²	193	133 Å²	133	73%	0.728	72%	0.723	S	S	*	*			trans	85.8	96.8	159	-56.4	-145.7	151.9	168.1	-10	123.5
179	H	26.5	Very low	26.8	Very low	166 Å²	166	129.7 Å²	129.7	77%	0.769	72%	0.718	S	S	*	*				71.1	126.4	128.3	-68.6	-80.7	0	0	0	123.4
180	Q	25.3	Very low	26.8	Very low	159 Å²	159	132.5 Å²	132.5	74%	0.743	72%	0.724	S	S	*	*			trans	-34.3	152.4	157.7	-89.4	-129.2	24.9	0	0	117.8
181	P	29.9	Very low	26.8	Very low	117 Å²	117	132 Å²	132	76%	0.76	73%	0.726	S	S	*	*				-145.4	154	73.9	40.6	-23.6	0	0	0	119.8
182	S	25.1	Very low	27.3	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	73%	0.725	S	S	*	*				-1	143	126.5	-84.8	0	0	0	0	118.8
183	E	25.9	Very low	27.1	Very low	139 Å²	139	126.4 Å²	126.4	65%	0.65	73%	0.726	S	S	*	*			cis	-154.5	-165.8	-5.6	-51.4	-169.9	61.1	0	0	108.1
184	R	25.1	Very low	27	Very low	166 Å²	166	125.8 Å²	125.8	63%	0.626	73%	0.734	S	S	*	*			cis	-163.3	170.2	-2.6	-150.3	-175.8	-81.1	157.4	3	109.9
185	H	23.9	Very low	26.9	Very low	153 Å²	153	125 Å²	125	71%	0.708	74%	0.741	S	S	*	*			trans	71.6	152.9	163.4	-50.7	131.4	0	0	0	117.5
186	S	23.1	Very low	26.9	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	74%	0.738	S	S	*	*			cis	-171.3	144.5	-25.5	-89.7	0	0	0	0	110
187	S	25.4	Very low	27.1	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	74%	0.74	S	S	*	*			trans	58.5	160	149.8	-71.1	0	0	0	0	120.7
188	D	24.9	Very low	27.2	Very low	136 Å²	136	124.7 Å²	124.7	73%	0.727	74%	0.741	S	S	*	*			cis	-174.5	159.3	-26.8	-106.1	111	0	0	0	106.5
189	S	25.6	Very low	27.3	Very low	90 Å²	90	122.1 Å²	122.1	63%	0.629	74%	0.742	S	S	*	*			cis	-153.7	-171.9	-13.3	-128	0	0	0	0	106.3
190	L	26.5	Very low	27.5	Very low	155 Å²	155	121.8 Å²	121.8	81%	0.812	74%	0.744	S	S	*	*				-179.3	129.8	66.4	-83.8	167.2	0	0	0	110.5
191	V	28.5	Very low	27.9	Very low	125 Å²	125	121.3 Å²	121.3	76%	0.758	75%	0.753	S	S	*	*				32.9	141.8	120.1	178.8	0	0	0	0	119.7
192	P	40.3	Very low	28.1	Very low	127 Å²	127	123.9 Å²	123.9	83%	0.825	75%	0.754	S	S	*	*			cis	-133.4	169.2	18.8	24.9	-0.7	0	0	0	118.5
193	G	24.9	Very low	28.7	Very low	77 Å²	77	126.2 Å²	126.2	79%	0.794	75%	0.754	S	S	*	*			trans	178.7	83.5	166.5	0	0	0	0	0	119
194	S	27.8	Very low	29.3	Very low	126 Å²	126	122.1 Å²	122.1	88%	0.881	74%	0.739	S	S	*	*			trans	52	80.9	152.7	-165.9	0	0	0	0	122.8
195	G	26.6	Very low	30.2	Very low	80 Å²	80	118.3 Å²	118.3	83%	0.825	73%	0.734	S	S	*	*				56.1	111.2	123.3	0	0	0	0	0	123.7
196	G	26.6	Very low	31.1	Very low	76 Å²	76	114 Å²	114	78%	0.784	72%	0.721	S	S	*	*			trans	-97.5	-156.6	144	0	0	0	0	0	110.7
197	H	32.6	Very low	32.1	Very low	175 Å²	175	115.4 Å²	115.4	81%	0.81	72%	0.718	S	S	*	*			cis	-162.7	166.6	-9.1	-147	-71.8	0	0	0	107.1	D199	H197-D199 IonicContact CE1-OD2 2.73Å; H197-D199 PolarHBondContact CE1-OD2 3.12Å; H197-D199 VanDerWaalsContact CE1-OD2 3.29Å; H197-D199 IonicContact ND1-OD2 2.64Å; H197-D199 PolarHBondContact ND1-OD2 2.95Å
198	G	28.5	Very low	33.2	Very low	72 Å²	72	114.7 Å²	114.7	74%	0.742	70%	0.704	S	S	*	*			trans	-153.7	24.1	-172.8	0	0	0	0	0	119.7
199	D	30.1	Very low	34.3	Very low	139 Å²	139	113.9 Å²	113.9	74%	0.743	70%	0.696	S	S	*	*			trans	-89.6	123.5	177.2	-69.4	-73	0	0	0	111.9	H197	H197-D199 IonicContact CE1-OD2 2.73Å; H197-D199 PolarHBondContact CE1-OD2 3.12Å; H197-D199 VanDerWaalsContact CE1-OD2 3.29Å; H197-D199 IonicContact ND1-OD2 2.64Å; H197-D199 PolarHBondContact ND1-OD2 2.95Å
200	I	31.3	Very low	35.3	Very low	159 Å²	159	116.5 Å²	116.5	82%	0.815	70%	0.696	S	S	*	*			trans	-136.7	97.1	171.7	-56.7	-179.7	0	0	0	110.1
201	T	33.5	Very low	36.5	Very low	150 Å²	150	112.7 Å²	112.7	92%	0.92	68%	0.679	S	S	*	*			trans	-177.9	69.8	145.6	21.1	0	0	0	0	110.2
202	H	34.4	Very low	37.4	Very low	171 Å²	171	110 Å²	110	79%	0.792	66%	0.663	S	S	*	*			trans	-126.9	92.2	172.2	-171.9	-76.9	0	0	0	111.6
203	F	37	Very low	37.5	Very low	136 Å²	136	110.1 Å²	110.1	60%	0.596	65%	0.653	S	S	*	*			trans	-61.3	123.4	174.7	-119.5	-88.8	0	0	0	110.4	E79 V205	E79-F203 HydrophobicContact CG-CZ 4.39Å; F203-V205 PolarHBondContact O-N 3.47Å
204	P	38.8	Very low	38.2	Very low	52 Å²	52	113.6 Å²	113.6	34%	0.338	64%	0.642	S	S	.	*			trans	-79.3	82.3	-175.4	31.9	-35.3	0	0	0	111.3	S206 Q207	P204-S206 PolarHBondContact O-N 3.41Å; P204-Q207 HydrophobicContact CB-CG 4.25Å; P204-Q207 HydrophobicContact CG-CG 4.23Å; P204-Q207 PolarHBondContact O-N 3.46Å
205	V	44.4	Very low	39.2	Very low	87 Å²	87	111.9 Å²	111.9	53%	0.527	62%	0.622	S	S	.	*	H	α-helix	trans	-50.7	-29.1	174.5	177.9	0	0	0	0	112.3	F203 Q207 I208 Q209	F203-V205 PolarHBondContact O-N 3.47Å; V205-Q207 VanDerWaalsContact C-N 3.3Å; V205-Q207 PolarHBondContact O-N 3.45Å; V205-I208 PolarHBondContact O-N 2.85Å; V205-Q209 HydrophobicContact CG1-CG 4.41Å; V205-Q209 WeakPolarHBondContact O-CG 3.25Å; V205-Q209 PolarHBondContact O-N 2.9Å
206	S	42.4	Very low	40.1	Very low	63 Å²	63	110.9 Å²	110.9	44%	0.441	60%	0.595	S	S	.	*	H	α-helix	trans	-63.4	-26	174.7	59.1	0	0	0	0	114.6	P204 K210	P204-S206 PolarHBondContact O-N 3.41Å; S206-K210 WeakPolarHBondContact O-CB 3.25Å; S206-K210 WeakPolarHBondContact O-CD 3.47Å; S206-K210 VanDerWaalsContact O-CG 3.22Å; S206-K210 WeakPolarHBondContact O-CG 3.49Å; S206-K210 PolarHBondContact O-N 2.94Å
207	Q	43.5	Very low	40.8	Very low	122 Å²	122	113.6 Å²	113.6	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-72.4	-43.1	170.6	-72.5	-167.5	-0.7	0	0	111.1	P204 V205 Q209 K210 T211	P204-Q207 HydrophobicContact CB-CG 4.25Å; P204-Q207 HydrophobicContact CG-CG 4.23Å; P204-Q207 PolarHBondContact O-N 3.46Å; V205-Q207 VanDerWaalsContact C-N 3.3Å; V205-Q207 PolarHBondContact O-N 3.45Å; Q207-Q209 PolarHBondContact O-N 3.46Å; Q207-K210 PolarHBondContact O-N 3.35Å; Q207-T211 PolarHBondContact O-N 2.86Å; Q207-T211 PolarHBondContact O-OG1 3.48Å; Q207-T211 VanDerWaalsContact O-OG1 3.05Å
208	I	48.8	Very low	41	Very low	90 Å²	90	110.5 Å²	110.5	46%	0.462	57%	0.572	S	S	.	*	H	α-helix	trans	-61.9	-45.4	178	-59.3	175.7	0	0	0	110.1	V205 K210 T211 V212	V205-I208 PolarHBondContact O-N 2.85Å; I208-K210 PolarHBondContact O-N 2.88Å; I208-T211 PolarHBondContact O-N 3.35Å; I208-V212 HydrophobicContact CG2-CG2 4.4Å; I208-V212 WeakPolarHBondContact O-CG2 3.16Å; I208-V212 PolarHBondContact O-N 3.06Å
209	Q	48.2	Very low	41.6	Very low	119 Å²	119	114.5 Å²	114.5	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-57.8	-47	175.2	-73	176.1	-22.1	0	0	112.4	V205 Q207 V212 Q213	V205-Q209 HydrophobicContact CG1-CG 4.41Å; V205-Q209 WeakPolarHBondContact O-CG 3.25Å; V205-Q209 PolarHBondContact O-N 2.9Å; Q207-Q209 PolarHBondContact O-N 3.46Å; Q209-V212 PolarHBondContact O-N 3.49Å; Q209-Q213 WeakPolarHBondContact O-CB 3.2Å; Q209-Q213 WeakPolarHBondContact O-CG 3.44Å; Q209-Q213 PolarHBondContact O-N 3.47Å
210	K	45.4	Very low	41.9	Very low	145 Å²	145	114.3 Å²	114.3	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-62.3	-42.2	177.2	-75.4	172.2	-179.2	-176.7	0	112.4	S206 Q207 I208 Q213 W214	S206-K210 WeakPolarHBondContact O-CB 3.25Å; S206-K210 WeakPolarHBondContact O-CD 3.47Å; S206-K210 VanDerWaalsContact O-CG 3.22Å; S206-K210 WeakPolarHBondContact O-CG 3.49Å; S206-K210 PolarHBondContact O-N 2.94Å; Q207-K210 PolarHBondContact O-N 3.35Å; I208-K210 PolarHBondContact O-N 2.88Å; K210-Q213 PolarHBondContact O-N 2.92Å; K210-W214 WeakPolarHBondContact O-CB 3.4Å; K210-W214 PolarHBondContact O-N 3.47Å
211	T	52.9	Low	41.9	Very low	75 Å²	75	111.2 Å²	111.2	46%	0.46	55%	0.552	S	S	.	*	H	α-helix	trans	-66.5	-42.2	178.6	-59.5	0	0	0	0	111.9	Q207 I208 W214 I215	Q207-T211 PolarHBondContact O-N 2.86Å; Q207-T211 PolarHBondContact O-OG1 3.48Å; Q207-T211 VanDerWaalsContact O-OG1 3.05Å; I208-T211 PolarHBondContact O-N 3.35Å; T211-W214 PolarHBondContact O-N 3.49Å; T211-I215 HydrophobicContact CG2-CD1 3.97Å; T211-I215 VanDerWaalsContact O-CG1 3.27Å; T211-I215 WeakPolarHBondContact O-CG1 3.24Å; T211-I215 PolarHBondContact O-N 2.85Å
212	V	46.6	Very low	41.8	Very low	69 Å²	69	115 Å²	115	42%	0.418	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-43.1	175.7	172.3	0	0	0	0	111.3	I208 Q209 I215 F216	I208-V212 HydrophobicContact CG2-CG2 4.4Å; I208-V212 WeakPolarHBondContact O-CG2 3.16Å; I208-V212 PolarHBondContact O-N 3.06Å; Q209-V212 PolarHBondContact O-N 3.49Å; V212-I215 PolarHBondContact O-N 3.29Å; V212-F216 HydrophobicContact CG1-CD2 3.93Å; V212-F216 HydrophobicContact CG1-CE2 3.74Å; V212-F216 VanDerWaalsContact O-CD2 3.27Å; V212-F216 WeakPolarHBondContact O-CD2 3.23Å; V212-F216 PolarHBondContact O-N 3Å
213	Q	44.1	Very low	41.6	Very low	130 Å²	130	111.2 Å²	111.2	61%	0.607	54%	0.542	S	S	*	.	H	α-helix	trans	-59.6	-48.9	173.8	-76.1	175.5	-19.7	0	0	111.5	Q209 K210 I215 F216 Q217	Q209-Q213 WeakPolarHBondContact O-CB 3.2Å; Q209-Q213 WeakPolarHBondContact O-CG 3.44Å; Q209-Q213 PolarHBondContact O-N 3.47Å; K210-Q213 PolarHBondContact O-N 2.92Å; Q213-I215 PolarHBondContact O-N 3Å; Q213-F216 PolarHBondContact O-N 3.1Å; Q213-Q217 WeakPolarHBondContact O-CB 3.34Å; Q213-Q217 PolarHBondContact O-N 2.72Å
214	W	37.9	Very low	41.2	Very low	150 Å²	150	109.2 Å²	109.2	57%	0.568	55%	0.545	S	S	*	.	H	α-helix	trans	-59.3	-42.9	178.7	-175.2	80.4	0	0	0	112.6	K210 T211 F216 Q217 K218	K210-W214 WeakPolarHBondContact O-CB 3.4Å; K210-W214 PolarHBondContact O-N 3.47Å; T211-W214 PolarHBondContact O-N 3.49Å; W214-F216 PolarHBondContact O-N 3.31Å; W214-Q217 PolarHBondContact O-N 3.28Å; W214-K218 HydrophobicContact CD2-CD 4.34Å; W214-K218 HydrophobicContact CE3-CD 4.37Å; W214-K218 HydrophobicContact CH2-CD 3.99Å; W214-K218 HydrophobicContact CZ2-CD 3.88Å; W214-K218 HydrophobicContact CZ3-CD 4.2Å; W214-K218 WeakPolarHBondContact O-CB 3.28Å; W214-K218 PolarHBondContact O-N 3.12Å
215	I	49	Very low	40.8	Very low	90 Å²	90	116 Å²	116	46%	0.462	57%	0.571	S	S	.	*	H	α-helix	trans	-60.9	-42.1	177.8	-72.7	167.4	0	0	0	111.5	T211 V212 Q213 R219	T211-I215 HydrophobicContact CG2-CD1 3.97Å; T211-I215 VanDerWaalsContact O-CG1 3.27Å; T211-I215 WeakPolarHBondContact O-CG1 3.24Å; T211-I215 PolarHBondContact O-N 2.85Å; V212-I215 PolarHBondContact O-N 3.29Å; Q213-I215 PolarHBondContact O-N 3Å; I215-R219 PolarHBondContact O-N 3.2Å
216	F	46.7	Very low	40	Very low	58 Å²	58	117.4 Å²	117.4	25%	0.254	59%	0.585	S	S	.	*	H	α-helix	trans	-74.7	-38.2	177.9	-73	-55.4	0	0	0	113.4	F49 V212 Q213 W214 K218 R219 Q220	F49-F216 HydrophobicContact CD2-CE2 4.46Å; F49-F216 HydrophobicContact CD2-CZ 4.33Å; F49-F216 HydrophobicContact CE1-CZ 4.44Å; F49-F216 AromaticContact CE2-CE1 3.86Å; F49-F216 HydrophobicContact CE2-CE1 3.86Å; F49-F216 AromaticContact CE2-CE2 3.64Å; F49-F216 HydrophobicContact CE2-CE2 3.64Å; F49-F216 AromaticContact CE2-CZ 3.25Å; F49-F216 HydrophobicContact CE2-CZ 3.25Å; F49-F216 AromaticContact CZ-CE1 3.66Å; F49-F216 HydrophobicContact CZ-CE1 3.66Å; F49-F216 HydrophobicContact CZ-CE2 4.2Å; F49-F216 AromaticContact CZ-CZ 3.33Å; F49-F216 HydrophobicContact CZ-CZ 3.33Å; V212-F216 HydrophobicContact CG1-CD2 3.93Å; V212-F216 HydrophobicContact CG1-CE2 3.74Å; V212-F216 VanDerWaalsContact O-CD2 3.27Å; V212-F216 WeakPolarHBondContact O-CD2 3.23Å; V212-F216 PolarHBondContact O-N 3Å; Q213-F216 PolarHBondContact O-N 3.1Å; W214-F216 PolarHBondContact O-N 3.31Å; F216-K218 VanDerWaalsContact C-N 3.31Å; F216-K218 PolarHBondContact O-N 3.01Å; F216-R219 WeakPolarHBondContact O-CB 3.37Å; F216-R219 PolarHBondContact O-N 2.67Å; F216-R219 VanDerWaalsContact O-N 3.09Å; F216-Q220 PolarHBondContact O-N 3.21Å
217	Q	39.8	Very low	39.3	Very low	134 Å²	134	119.5 Å²	119.5	63%	0.626	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-35.6	177.4	-150.7	162.7	35.1	0	0	111.3	Q213 W214 R219 Q220 S221	Q213-Q217 WeakPolarHBondContact O-CB 3.34Å; Q213-Q217 PolarHBondContact O-N 2.72Å; W214-Q217 PolarHBondContact O-N 3.28Å; Q217-R219 PolarHBondContact O-N 2.9Å; Q217-Q220 PolarHBondContact O-N 3.41Å; Q217-S221 PolarHBondContact O-N 3.17Å
218	K	38.6	Very low	38.8	Very low	109 Å²	109	122.3 Å²	122.3	47%	0.474	61%	0.613	S	S	.	*	H	α-helix	trans	-72.8	-7.5	173.4	-160.4	173.7	-170.7	179.7	0	114.2	W214 F216	W214-K218 HydrophobicContact CD2-CD 4.34Å; W214-K218 HydrophobicContact CE3-CD 4.37Å; W214-K218 HydrophobicContact CH2-CD 3.99Å; W214-K218 HydrophobicContact CZ2-CD 3.88Å; W214-K218 HydrophobicContact CZ3-CD 4.2Å; W214-K218 WeakPolarHBondContact O-CB 3.28Å; W214-K218 PolarHBondContact O-N 3.12Å; F216-K218 VanDerWaalsContact C-N 3.31Å; F216-K218 PolarHBondContact O-N 3.01Å
219	R	39.5	Very low	37.8	Very low	157 Å²	157	124.4 Å²	124.4	59%	0.592	63%	0.625	S	S	*	*	H	α-helix	trans	-84.3	-38	166.2	-112.2	-175.5	179.6	-135.6	-2.4	111.8	H56 I215 F216 Q217 S221 R222 S223	H56-R219 PolarHBondContact NE2-NH1 2.87Å; I215-R219 PolarHBondContact O-N 3.2Å; F216-R219 WeakPolarHBondContact O-CB 3.37Å; F216-R219 PolarHBondContact O-N 2.67Å; F216-R219 VanDerWaalsContact O-N 3.09Å; Q217-R219 PolarHBondContact O-N 2.9Å; R219-S221 VanDerWaalsContact C-N 3.35Å; R219-S221 PolarHBondContact O-N 3.28Å; R219-R222 PolarHBondContact O-N 3.02Å; R219-R222 VanDerWaalsContact O-N 3.11Å; R219-S223 PolarHBondContact O-N 3.33Å
220	Q	36.7	Very low	37.1	Very low	134 Å²	134	125.6 Å²	125.6	63%	0.626	64%	0.635	S	S	*	*	H	α-helix	trans	-66	-33.5	180	-69.7	177.9	-47.5	0	0	113	F216 Q217 R222 S223	F216-Q220 PolarHBondContact O-N 3.21Å; Q217-Q220 PolarHBondContact O-N 3.41Å; Q220-R222 PolarHBondContact O-N 3Å; Q220-S223 PolarHBondContact O-OG 2.84Å; Q220-S223 VanDerWaalsContact O-OG 3.04Å
221	S	32.2	Very low	36.1	Very low	95 Å²	95	123.8 Å²	123.8	66%	0.664	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	0.5	174.1	58.3	0	0	0	0	114.7	Q217 R219	Q217-S221 PolarHBondContact O-N 3.17Å; R219-S221 VanDerWaalsContact C-N 3.35Å; R219-S221 PolarHBondContact O-N 3.28Å
222	R	31.8	Very low	36.2	Very low	229 Å²	229	126 Å²	126	86%	0.864	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	-2.5	175.7	-85.2	-173.5	162.8	-164.3	-6.3	114.4	R219 Q220	R219-R222 PolarHBondContact O-N 3.02Å; R219-R222 VanDerWaalsContact O-N 3.11Å; Q220-R222 PolarHBondContact O-N 3Å
223	S	29.8	Very low	35.2	Very low	92 Å²	92	129.7 Å²	129.7	64%	0.643	68%	0.679	S	S	*	*	S	Bend	trans	-96.4	0.9	-179.6	49.3	0	0	0	0	114.8	R219 Q220	R219-S223 PolarHBondContact O-N 3.33Å; Q220-S223 PolarHBondContact O-OG 2.84Å; Q220-S223 VanDerWaalsContact O-OG 3.04Å
224	S	28.7	Very low	34.6	Very low	94 Å²	94	131 Å²	131	66%	0.657	69%	0.69	S	S	*	*	S	Bend	trans	-105.1	27.2	-169.2	-52.9	0	0	0	0	115.4
225	H	29.4	Very low	35.8	Very low	193 Å²	193	129 Å²	129	89%	0.894	70%	0.696	S	S	*	*			trans	-149.2	93.1	166.6	-83	-63.2	0	0	0	111.5
226	S	28.6	Very low	34.9	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	72%	0.716	S	S	*	*			trans	-164.1	127.7	160.6	-173.7	0	0	0	0	110.6
227	S	28.3	Very low	35.3	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	74%	0.74	S	S	*	*			trans	-172.5	147	161.4	-79.8	0	0	0	0	108.8
228	Q	31.9	Very low	34.8	Very low	182 Å²	182	133.2 Å²	133.2	85%	0.85	75%	0.745	S	S	*	*			trans	67.7	137.6	177.8	-52.6	178	-20.3	0	0	114.4
229	D	28.2	Very low	34.4	Very low	133 Å²	133	134.4 Å²	134.4	71%	0.711	76%	0.762	S	S	*	*			cis	-165.8	175.8	-14.9	-111.7	-49.8	0	0	0	107.9
230	L	32.4	Very low	34.1	Very low	145 Å²	145	130.5 Å²	130.5	76%	0.759	76%	0.763	S	S	*	*			cis	-141.2	-105.4	7.5	-146.5	177.2	0	0	0	112
231	S	26.4	Very low	33.8	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	77%	0.769	S	S	*	*			trans	-164	169.3	-175.7	-85.2	0	0	0	0	112.5
232	P	53.6	Low	33.7	Very low	122 Å²	122	133.3 Å²	133.3	79%	0.792	78%	0.775	S	S	*	*			trans	-105	-178.4	-156.4	41.1	-37.8	0	0	0	116.5
233	T	25.9	Very low	33.7	Very low	147 Å²	147	127.5 Å²	127.5	90%	0.902	77%	0.77	S	S	*	*			trans	-138.6	154	176	-54.7	0	0	0	0	113.7
234	N	31.3	Very low	34.7	Very low	156 Å²	156	128.7 Å²	128.7	83%	0.834	78%	0.775	S	S	*	*			trans	-65.5	171.9	-161.1	-97.6	-11.1	0	0	0	121.5
235	P	62.9	Low	34.7	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	78%	0.779	S	S	*	*			trans	-105.5	-175.7	178.1	43.2	-36.5	0	0	0	114.8
236	N	30.8	Very low	34.7	Very low	166 Å²	166	126.5 Å²	126.5	89%	0.888	77%	0.771	S	S	*	*			trans	-163.5	164.6	151.6	-107.7	-18.8	0	0	0	114.3
237	P	54	Low	34.8	Very low	116 Å²	116	128 Å²	128	75%	0.753	77%	0.77	S	S	*	*			trans	-130.9	-171.2	-166.1	44.7	-29.8	0	0	0	117.7
238	A	30.5	Very low	34.8	Very low	89 Å²	89	126.8 Å²	126.8	74%	0.736	78%	0.775	S	S	*	*			trans	81.6	157.2	167.6	0	0	0	0	0	117.4
239	T	30.5	Very low	34.7	Very low	134 Å²	134	123.8 Å²	123.8	82%	0.822	76%	0.764	S	S	*	*			cis	-156.9	159.1	14.4	-28	0	0	0	0	114
240	A	32.1	Very low	34.8	Very low	75 Å²	75	127.3 Å²	127.3	62%	0.62	77%	0.768	S	S	*	*			trans	84.3	135.4	139.9	0	0	0	0	0	124.7
241	N	30.3	Very low	34.8	Very low	142 Å²	142	126.3 Å²	126.3	76%	0.759	77%	0.767	S	S	*	*			trans	69.8	146	147.2	-60.4	-1.4	0	0	0	120
242	N	31.5	Very low	35	Very low	146 Å²	146	128.1 Å²	128.1	78%	0.781	77%	0.768	S	S	*	*			cis	-152.6	175.8	-5.4	-113.8	-7.4	0	0	0	111.6
243	S	30.3	Very low	34	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	77%	0.773	S	S	*	*			trans	-119.4	-166.5	-176.3	-50.1	0	0	0	0	112.2
244	P	51.6	Low	34.1	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	77%	0.769	S	S	*	*				-128.4	-158.5	-71.1	36.2	-17.7	0	0	0	112.9
245	S	28.2	Very low	34.3	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	77%	0.768	S	S	*	*			trans	101.8	106.1	149.6	-60.9	0	0	0	0	122
246	N	29.4	Very low	32.9	Very low	134 Å²	134	126.5 Å²	126.5	72%	0.717	77%	0.772	S	S	*	*				84.5	128.8	111	-158.4	50.6	0	0	0	122.7
247	N	29.8	Very low	32.9	Very low	149 Å²	149	124.4 Å²	124.4	80%	0.797	77%	0.77	S	S	*	*			trans	59.1	139.1	156.5	-72.4	-10.6	0	0	0	122
248	G	30.3	Very low	31.9	Very low	82 Å²	82	124 Å²	124	85%	0.845	77%	0.77	S	S	*	*			trans	162.2	130	166.2	0	0	0	0	0	112
249	D	28.2	Very low	31.9	Very low	118 Å²	118	125 Å²	125	63%	0.631	77%	0.772	S	S	*	*			trans	-140.4	135.8	-174.1	178.9	30.8	0	0	0	110.7
250	R	30.8	Very low	31.9	Very low	208 Å²	208	123.3 Å²	123.3	79%	0.785	77%	0.765	S	S	*	*			trans	63.6	157.9	173.5	-72.6	153.9	176.3	132.7	-1.6	116.2
251	V	32.7	Very low	31.9	Very low	123 Å²	123	124.4 Å²	124.4	75%	0.745	77%	0.768	S	S	*	*			cis	-151	154.8	1.9	-121.5	0	0	0	0	112.4
252	D	30.8	Very low	31.8	Very low	144 Å²	144	125 Å²	125	77%	0.77	77%	0.767	S	S	*	*			trans	76.5	151.1	142.6	-95	-62.4	0	0	0	128.9
253	E	31.9	Very low	31.7	Very low	192 Å²	192	123 Å²	123	90%	0.897	76%	0.764	S	S	*	*			trans	45.5	138.5	165.7	-73.6	-162.7	116.1	0	0	124
254	G	28.9	Very low	31.5	Very low	78 Å²	78	126.7 Å²	126.7	80%	0.804	77%	0.767	S	S	*	*			trans	151.7	52.2	169.2	0	0	0	0	0	117.2
255	S	35.1	Very low	30.2	Very low	118 Å²	118	125.5 Å²	125.5	83%	0.825	76%	0.761	S	S	*	*			trans	-70.1	142.8	-170	-60.3	0	0	0	0	117.1
256	S	32.2	Very low	30	Very low	111 Å²	111	129.6 Å²	129.6	78%	0.776	77%	0.766	S	S	*	*				-175.4	117.9	128	-83.2	0	0	0	0	115.2
257	S	32.7	Very low	29.8	Very low	122 Å²	122	132.4 Å²	132.4	85%	0.853	78%	0.775	S	S	*	*			trans	56.1	135.4	142.3	-56.3	0	0	0	0	121
258	S	31.9	Very low	29.5	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.776	S	S	*	*			cis	-162.1	145.7	20.5	52.3	0	0	0	0	115.2
259	S	30.8	Very low	29.2	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	78%	0.78	S	S	*	*			trans	44.1	108.3	145.4	-52.9	0	0	0	0	120.7
260	S	30.8	Very low	29	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	79%	0.79	S	S	*	*				81.3	115.3	64.5	73.5	0	0	0	0	114.4
261	S	31.1	Very low	28.7	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	78%	0.784	S	S	*	*				73	146.3	64.8	-69.1	0	0	0	0	114
262	Q	29.8	Very low	28.2	Very low	156 Å²	156	136.7 Å²	136.7	73%	0.729	79%	0.791	S	S	*	*			cis	-161.7	172.7	0.5	-118.6	162.2	30	0	0	111.4
263	S	28.8	Very low	28.1	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	79%	0.787	S	S	*	*			trans	-94	156.8	165.9	-42.8	0	0	0	0	111.4
264	F	25.2	Very low	28.3	Very low	186 Å²	186	131.1 Å²	131.1	82%	0.816	79%	0.786	S	S	*	*			trans	-156	175.8	156.6	-85.6	-55.3	0	0	0	113.3
265	S	24.4	Very low	28.1	Very low	91 Å²	91	131.5 Å²	131.5	64%	0.636	78%	0.782	S	S	*	*			trans	-147.3	158.7	-150.1	-44.3	0	0	0	0	116.1
266	F	23.9	Very low	27.7	Very low	193 Å²	193	132 Å²	132	85%	0.846	78%	0.78	S	S	*	*			trans	57.1	127.2	157.1	-54.6	-63.8	0	0	0	121.3
267	Q	25.5	Very low	27.4	Very low	192 Å²	192	133.5 Å²	133.5	90%	0.897	78%	0.779	S	S	*	*				-177.8	178.1	105.4	-95.8	-178.6	18.8	0	0	112.8
268	N	23.5	Very low	27.2	Very low	152 Å²	152	136 Å²	136	81%	0.813	78%	0.777	S	S	*	*			trans	-87.9	159.6	-167.9	-54.7	-51.7	0	0	0	114.6
269	F	24.8	Very low	27	Very low	216 Å²	216	140.4 Å²	140.4	95%	0.947	78%	0.777	S	S	*	*			trans	-156.5	-170.1	134.4	-120.9	-78	0	0	0	111.3
270	E	22.6	Very low	27.1	Very low	178 Å²	178	140.8 Å²	140.8	83%	0.832	78%	0.776	S	S	*	*			trans	-129.2	164.6	-148.8	-166.9	174.3	83.1	0	0	114.8
271	A	24.9	Very low	26.8	Very low	81 Å²	81	145.5 Å²	145.5	67%	0.669	78%	0.779	S	S	*	*			trans	92	141.5	151.6	0	0	0	0	0	122.3
272	T	23.6	Very low	26.6	Very low	144 Å²	144	146.2 Å²	146.2	88%	0.883	78%	0.779	S	S	*	*			trans	85.2	138.6	153.5	-44.2	0	0	0	0	119.3
273	A	27	Very low	26.4	Very low	82 Å²	82	144.6 Å²	144.6	68%	0.678	78%	0.779	S	S	*	*			trans	-128.1	169.1	176.3	0	0	0	0	0	110.8
274	P	36.9	Very low	26.2	Very low	137 Å²	137	144.4 Å²	144.4	89%	0.89	78%	0.778	S	S	*	*				-135.7	-173.5	128.4	36.6	-24.1	0	0	0	113.7
275	A	24.4	Very low	26.2	Very low	86 Å²	86	143.3 Å²	143.3	71%	0.711	78%	0.775	S	S	*	*			trans	-111.9	-166.7	-153.8	0	0	0	0	0	116.1
276	T	26.8	Very low	26.4	Very low	128 Å²	128	146.3 Å²	146.3	79%	0.785	78%	0.783	S	S	*	*			trans	86.3	145.2	173.9	80.1	0	0	0	0	115.1
277	L	27.1	Very low	26.7	Very low	143 Å²	143	145 Å²	145	75%	0.749	79%	0.785	S	S	*	*			cis	-155.4	168.6	-5	-146.7	50.6	0	0	0	114
278	H	28.2	Very low	26.7	Very low	175 Å²	175	145.5 Å²	145.5	81%	0.81	79%	0.787	S	S	*	*			trans	71.1	140.4	158.2	-93.9	-73.8	0	0	0	123.8
279	R	26.8	Very low	27.1	Very low	199 Å²	199	141.3 Å²	141.3	75%	0.751	78%	0.779	S	S	*	*			trans	-124.8	163.5	169.7	-136.8	-165.2	-179.5	162.8	2.6	107.1
280	P	33.9	Very low	27.3	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	78%	0.78	S	S	*	*				-123.8	160.8	54.9	11.2	14.1	0	0	0	113.4
281	R	24.4	Very low	27.9	Very low	198 Å²	198	144.1 Å²	144.1	75%	0.747	78%	0.782	S	S	*	*				60	130	69.9	-131.9	-169.8	174	163	-2.6	111.6
282	V	27	Very low	28.1	Very low	114 Å²	114	150.8 Å²	150.8	69%	0.691	79%	0.79	S	S	*	*			cis	-157.5	170.9	35	-152.8	0	0	0	0	112.2
283	V	25.7	Very low	28.5	Very low	121 Å²	121	151.8 Å²	151.8	73%	0.733	79%	0.79	S	S	*	*			trans	84.6	109.5	156.3	177	0	0	0	0	119.9
284	S	23.8	Very low	28.7	Very low	100 Å²	100	157.3 Å²	157.3	70%	0.699	79%	0.793	S	S	*	*			trans	53.8	153.7	134.2	-54.1	0	0	0	0	122.5
285	H	24.9	Very low	28.2	Very low	162 Å²	162	155.4 Å²	155.4	75%	0.75	78%	0.783	S	S	*	*			cis	-163.4	160.5	-17.5	-127.9	-103	0	0	0	108.9
286	L	28	Very low	28.6	Very low	154 Å²	154	160.4 Å²	160.4	81%	0.806	78%	0.783	S	S	*	*			trans	68.9	164.2	161	-64.6	161.8	0	0	0	119.3
287	L	30.3	Very low	29	Very low	167 Å²	167	159.9 Å²	159.9	87%	0.874	79%	0.785	S	S	*	*			trans	78.5	50.8	166.6	-62.2	172.7	0	0	0	120.2
288	E	25.6	Very low	29.1	Very low	201 Å²	201	160.6 Å²	160.6	94%	0.939	79%	0.786	S	S	*	*				-123.1	146.6	129.7	-71.5	-167.2	131.1	0	0	108.3
289	G	31.7	Very low	29.5	Very low	64 Å²	64	163.8 Å²	163.8	66%	0.66	79%	0.791	S	S	*	*			cis	173	99.7	-4.1	0	0	0	0	0	109.3	R291	G289-R291 PolarHBondContact O-N 3.02Å
290	F	29.2	Very low	29.9	Very low	217 Å²	217	161.8 Å²	161.8	95%	0.952	79%	0.794	S	S	*	*			trans	-62.7	106.5	-167.4	-76.3	-89.1	0	0	0	113.5
291	R	36	Very low	29.7	Very low	237 Å²	237	166.7 Å²	166.7	89%	0.894	80%	0.798	S	S	*	*			trans	-132.6	56.6	166.7	-72	-166.3	-179.6	-87.7	2.8	112.7	G289	G289-R291 PolarHBondContact O-N 3.02Å
292	W	29.6	Very low	30	Very low	220 Å²	220	167.8 Å²	167.8	83%	0.833	80%	0.802	S	S	*	*			trans	-143.6	77.7	162.7	-143.7	66.2	0	0	0	112.9
293	L	32	Very low	30.3	Very low	166 Å²	166	169.9 Å²	169.9	87%	0.869	81%	0.809	S	S	*	*			trans	-108.4	128.2	165.5	-93	168.3	0	0	0	109.6
294	R	29.6	Very low	30.8	Very low	197 Å²	197	169.5 Å²	169.5	74%	0.743	80%	0.802	S	S	*	*			trans	66.5	122.3	176.8	-58.5	-176.7	173.9	-165.9	-1.2	116.7
295	S	27.4	Very low	31.6	Very low	97 Å²	97	170.8 Å²	170.8	68%	0.678	81%	0.806	S	S	*	*			trans	-145.5	115.3	139.3	-81.1	0	0	0	0	109.9
296	R	32.9	Very low	33.2	Very low	191 Å²	191	168.2 Å²	168.2	72%	0.721	81%	0.806	S	S	*	*			trans	-77.7	151.7	165.6	-94.8	-178	165	157.2	0.2	108.7
297	S	34.1	Very low	34.9	Very low	117 Å²	117	161.8 Å²	161.8	82%	0.818	78%	0.777	S	S	*	*			trans	30.1	106.7	152	-164.4	0	0	0	0	118.2
298	M	30.9	Very low	36.8	Very low	159 Å²	159	157 Å²	157	78%	0.783	76%	0.757	S	S	*	*			trans	-117.9	90	165.7	-98.6	-75.1	-91.7	0	0	111.5
299	R	35.1	Very low	39.6	Very low	241 Å²	241	149.7 Å²	149.7	91%	0.909	73%	0.728	S	S	*	*			trans	-117.4	128.7	141	-84.8	-169.7	176.3	-177.6	0.6	108.1
300	L	35.7	Very low	42.4	Very low	157 Å²	157	148 Å²	148	82%	0.822	70%	0.702	S	S	*	*	S	Bend	trans	74.1	74.5	166.6	-154.5	74.2	0	0	0	118.5
301	R	28.8	Very low	45.5	Very low	220 Å²	220	142.1 Å²	142.1	83%	0.83	68%	0.677	S	S	*	*				-149.7	163	102.3	-108.1	176.2	-176.2	-163.2	0.2	112
302	R	32.7	Very low	48.2	Very low	222 Å²	222	131.8 Å²	131.8	84%	0.838	65%	0.645	S	S	*	*			trans	-76.3	168.2	-170.4	-52.5	174.5	-170	161.8	2.3	110.3
303	L	32.2	Very low	51.3	Low	158 Å²	158	126.9 Å²	126.9	83%	0.827	63%	0.631	S	S	*	*			cis	-155.5	152.6	21.8	-165.5	73.9	0	0	0	111.3
304	D	35.4	Very low	54.3	Low	113 Å²	113	119.6 Å²	119.6	60%	0.604	59%	0.593	S	S	*	*			trans	50.6	87.4	158.8	-150.9	24.5	0	0	0	122.5	S306	D304-S306 VanDerWaalsContact OD1-CB 3.26Å; D304-S306 WeakPolarHBondContact OD1-CB 3.38Å; D304-S306 PolarHBondContact OD1-N 2.86Å; D304-S306 PolarHBondContact OD1-OG 2.89Å
305	V	42.5	Very low	57.3	Low	126 Å²	126	113.6 Å²	113.6	76%	0.764	57%	0.572	S	S	*	*				-126.9	90.4	116.4	176.9	0	0	0	0	106.3	G307	V305-G307 PolarHBondContact O-N 2.9Å
306	S	57.2	Low	60.4	Low	108 Å²	108	109.3 Å²	109.3	76%	0.755	54%	0.541	S	S	*	.			trans	-79.1	78.5	-160.6	-63	0	0	0	0	115.1	D304	D304-S306 VanDerWaalsContact OD1-CB 3.26Å; D304-S306 WeakPolarHBondContact OD1-CB 3.38Å; D304-S306 PolarHBondContact OD1-N 2.86Å; D304-S306 PolarHBondContact OD1-OG 2.89Å
307	G	64.9	Low	63.2	Low	20 Å²	20	101 Å²	101	21%	0.206	51%	0.511	C	S	.	.	S	Bend	trans	154.5	-14.4	155.4	0	0	0	0	0	119	V305 R338 R339	V305-G307 PolarHBondContact O-N 2.9Å; G307-R338 CarbonylContact O-C 3.5Å; G307-R338 VanDerWaalsContact O-CA 3.3Å; G307-R338 WeakPolarHBondContact O-CA 3.43Å; G307-R339 PolarHBondContact O-N 3.24Å
308	C	70.1	Confident	65.8	Low	67 Å²	67	99.7 Å²	99.7	45%	0.453	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	136.4	-178.8	54.1	0	0	0	0	112.1	L336	C308-L336 HydrophobicContact CB-CD1 3.87Å
309	C	83.2	Confident	68.2	Low	47 Å²	47	95.2 Å²	95.2	32%	0.318	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-50.9	171.9	-51.4	0	0	0	0	109.3	V337 R339 Y355 E420	C309-V337 HydrophobicContact CB-CB 4.3Å; C309-V337 HydrophobicContact CB-CG1 4.03Å; C309-V337 PolarHBondContact N-O 2.91Å; C309-R339 PolarHBondContact SG-N 2.94Å; C309-Y355 VanDerWaalsContact SG-CE1 3.56Å; C309-E420 WeakPolarHBondContact CB-OE1 3.46Å
310	K	91.3	Very high	70.1	Confident	28 Å²	28	87.8 Å²	87.8	12%	0.122	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	140.9	175.8	-168.7	177	-180	-174	0	111.4	V337 S416 W417 E420	K310-V337 PolarHBondContact N-O 2.83Å; K310-V337 PolarHBondContact O-N 2.92Å; K310-S416 VanDerWaalsContact NZ-C 3.25Å; K310-S416 PolarHBondContact NZ-O 3.5Å; K310-S416 PolarHBondContact NZ-OG 3.1Å; K310-W417 HydrophobicContact CB-CH2 4.42Å; K310-W417 HydrophobicContact CB-CZ3 4.36Å; K310-W417 HydrophobicContact CD-CD2 3.95Å; K310-W417 HydrophobicContact CD-CE3 3.84Å; K310-W417 HydrophobicContact CD-CH2 3.99Å; K310-W417 HydrophobicContact CD-CZ2 4.08Å; K310-W417 HydrophobicContact CD-CZ3 3.87Å; K310-W417 HydrophobicContact CG-CE3 4.47Å; K310-W417 HydrophobicContact CG-CH2 3.78Å; K310-W417 HydrophobicContact CG-CZ2 4.09Å; K310-W417 HydrophobicContact CG-CZ3 3.99Å; K310-W417 VanDerWaalsContact NZ-CD1 3.29Å; K310-W417 VanDerWaalsContact NZ-CG 3.27Å; K310-E420 HydrophobicContact CB-CG 3.71Å; K310-E420 HydrophobicContact CD-CB 4.01Å; K310-E420 HydrophobicContact CD-CG 3.87Å; K310-E420 HydrophobicContact CG-CG 4.41Å
311	E	93.8	Very high	71.3	Confident	93 Å²	93	87.8 Å²	87.8	44%	0.435	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.6	175.9	-170	175	170.7	0	0	110.2	R334 L335 L336	E311-R334 HydrophobicContact CG-CG 4.22Å; E311-R334 WeakPolarHBondContact OE1-CD 3.45Å; E311-R334 IonicContact OE1-CZ 3.52Å; E311-R334 IonicContact OE1-NE 3.09Å; E311-R334 IonicContact OE1-NH1 3.36Å; E311-R334 PolarHBondContact OE1-NH1 3.33Å; E311-L335 WeakPolarHBondContact CA-O 3.46Å; E311-L336 HydrophobicContact CB-CD1 3.92Å; E311-L336 HydrophobicContact CG-CB 4.46Å; E311-L336 HydrophobicContact CG-CD1 4.07Å
312	G	92.5	Very high	72.6	Confident	21 Å²	21	82.5 Å²	82.5	22%	0.216	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	164.9	169.5	0	0	0	0	0	113.3	R334 L335	G312-R334 CarbonylContact O-C 3.51Å; G312-R334 WeakPolarHBondContact O-CA 3.49Å; G312-L335 PolarHBondContact N-O 3.46Å; G312-L335 PolarHBondContact O-N 3.04Å
313	Q	94.5	Very high	73.7	Confident	117 Å²	117	74 Å²	74	55%	0.547	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126	173.9	-63.6	-178.6	33.2	0	0	109.3	C333 R334 P363	Q313-C333 CarbonylContact C-O 3.53Å; Q313-C333 VanDerWaalsContact CA-O 3.29Å; Q313-C333 WeakPolarHBondContact CA-O 3.29Å; Q313-R334 HydrophobicContact CG-CB 4.45Å; Q313-P363 HydrophobicContact CG-CB 4.4Å
314	L	94.9	Very high	74.8	Confident	12 Å²	12	71.6 Å²	71.6	6%	0.063	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	162	-177.4	-61.9	179.5	0	0	0	109.8	C333 L335 F395 F406 T408 W417	L314-C333 PolarHBondContact N-O 3.45Å; L314-C333 PolarHBondContact O-N 2.83Å; L314-L335 HydrophobicContact CD1-CB 4.28Å; L314-L335 HydrophobicContact CD1-CD2 3.92Å; L314-F395 HydrophobicContact CD1-CE1 4.18Å; L314-F395 HydrophobicContact CD1-CZ 4.09Å; L314-F406 HydrophobicContact CB-CD1 4.16Å; L314-F406 HydrophobicContact CD1-CB 4.31Å; L314-F406 HydrophobicContact CD1-CD1 3.8Å; L314-F406 HydrophobicContact CD1-CG 4.33Å; L314-T408 HydrophobicContact CD2-CG2 3.94Å; L314-W417 HydrophobicContact CD1-CD2 4.29Å; L314-W417 HydrophobicContact CD1-CZ2 4.42Å
315	K	92.6	Very high	75.6	Confident	71 Å²	71	74.3 Å²	74.3	31%	0.309	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	147.6	158.5	-77.7	-178	-83.5	152.8	0	108.6	W330 Q331 R332 F406 E407	K315-W330 HydrophobicContact CB-CB 4.38Å; K315-W330 HydrophobicContact CB-CE3 4.03Å; K315-W330 HydrophobicContact CD-CB 4.12Å; K315-Q331 CarbonylContact C-O 3.46Å; K315-Q331 WeakPolarHBondContact CA-O 3.34Å; K315-R332 HydrophobicContact CG-CG 4.12Å; K315-F406 WeakPolarHBondContact O-CA 3.35Å; K315-E407 HydrophobicContact CB-CB 4.07Å; K315-E407 VanDerWaalsContact CE-CD 3.47Å; K315-E407 WeakPolarHBondContact CE-OE1 3.48Å; K315-E407 WeakPolarHBondContact CE-OE2 3.11Å; K315-E407 PolarHBondContact N-O 3.33Å; K315-E407 IonicContact NZ-OE1 3.09Å; K315-E407 PolarHBondContact NZ-OE1 3.18Å; K315-E407 IonicContact NZ-OE2 3.36Å; K315-E407 PolarHBondContact NZ-OE2 3.44Å; K315-E407 PolarHBondContact O-N 3.31Å
316	Y	93.3	Very high	76.5	Confident	7 Å²	7	71.8 Å²	71.8	3%	0.027	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	156.8	176	85.2	-74.7	0	0	0	112	Q331 C333 L359 D361 K369 L404 I405 F406	Y316-Q331 HydrophobicContact CD1-CB 3.91Å; Y316-Q331 WeakPolarHBondContact CD1-O 3.35Å; Y316-Q331 HydrophobicContact CE1-CB 3.42Å; Y316-Q331 VanDerWaalsContact CE1-CB 3.42Å; Y316-Q331 PolarHBondContact N-O 3.4Å; Y316-Q331 PolarHBondContact O-N 3.33Å; Y316-Q331 PolarHBondContact OH-OE1 3.46Å; Y316-C333 HydrophobicContact CD1-CB 3.56Å; Y316-C333 HydrophobicContact CE1-CB 3.75Å; Y316-L359 HydrophobicContact CD2-CD1 4.18Å; Y316-L359 HydrophobicContact CE1-CD2 4Å; Y316-L359 HydrophobicContact CE2-CD1 4.12Å; Y316-L359 HydrophobicContact CG-CD1 4.43Å; Y316-D361 HydrophobicContact CE1-CB 3.99Å; Y316-D361 PolarHBondContact OH-OD2 2.75Å; Y316-K369 WeakPolarHBondContact OH-CD 3.27Å; Y316-K369 PolarHBondContact OH-NZ 2.83Å; Y316-L404 HydrophobicContact CD2-CD2 3.6Å; Y316-L404 HydrophobicContact CE2-CD2 3.76Å; Y316-I405 CarbonylContact C-O 3.53Å; Y316-I405 WeakPolarHBondContact CA-O 3.38Å; Y316-I405 WeakPolarHBondContact CB-O 3.13Å; Y316-F406 HydrophobicContact CG-CE1 4.38Å
317	L	90.9	Very high	76.8	Confident	17 Å²	17	75.4 Å²	75.4	9%	0.089	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	128.3	173.7	-176.4	71.1	0	0	0	107.1	P328 W330 I405	L317-P328 HydrophobicContact CD1-CB 4.13Å; L317-P328 HydrophobicContact CD2-CB 3.68Å; L317-W330 HydrophobicContact CB-CE3 4.09Å; L317-W330 HydrophobicContact CB-CH2 4.4Å; L317-W330 HydrophobicContact CB-CZ3 3.99Å; L317-I405 HydrophobicContact CB-CB 4.45Å; L317-I405 PolarHBondContact N-O 3.49Å; L317-I405 PolarHBondContact O-N 2.75Å
318	L	88.7	Confident	77.2	Confident	89 Å²	89	76.9 Å²	76.9	47%	0.466	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.2	164.4	-177.1	69.9	0	0	0	107.4	I323 L404	L318-I323 WeakPolarHBondContact O-CD1 3.15Å; L318-L404 HydrophobicContact CB-CD2 4.38Å; L318-L404 HydrophobicContact CD1-CD2 3.7Å; L318-L404 HydrophobicContact CD1-CG 4.31Å
319	V	82.8	Confident	77.7	Confident	66 Å²	66	79.2 Å²	79.2	40%	0.4	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.1	174.1	-174.7	0	0	0	0	108	S403 I405	V319-S403 PolarHBondContact N-O 3.11Å; V319-I405 HydrophobicContact CG2-CD1 3.62Å; V319-I405 HydrophobicContact CG2-CG1 3.72Å
320	D	74.3	Confident	77.9	Confident	84 Å²	84	79.5 Å²	79.5	45%	0.449	43%	0.431	S	S	.	.			trans	-128.6	152	176.2	177.6	52.8	0	0	0	108.5	T322 I323	D320-T322 PolarHBondContact O-N 2.89Å; D320-T322 WeakPolarHBondContact OD2-CB 3.35Å; D320-T322 VanDerWaalsContact OD2-CG2 3.31Å; D320-T322 WeakPolarHBondContact OD2-CG2 3.47Å; D320-T322 PolarHBondContact OD2-OG1 3.27Å; D320-I323 HydrophobicContact CB-CD1 4.06Å; D320-I323 HydrophobicContact CB-CG1 4.27Å; D320-I323 WeakPolarHBondContact O-CG1 3.37Å; D320-I323 PolarHBondContact O-N 3.04Å
321	D	60	Low	78	Confident	157 Å²	157	81.4 Å²	81.4	84%	0.84	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-7.4	-171.6	-65.1	-38.6	0	0	0	113.2
322	T	56.2	Low	77.9	Confident	110 Å²	110	83.7 Å²	83.7	68%	0.675	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.4	-178.9	63.9	0	0	0	0	115.2	D320 S324	D320-T322 PolarHBondContact O-N 2.89Å; D320-T322 WeakPolarHBondContact OD2-CB 3.35Å; D320-T322 VanDerWaalsContact OD2-CG2 3.31Å; D320-T322 WeakPolarHBondContact OD2-CG2 3.47Å; D320-T322 PolarHBondContact OD2-OG1 3.27Å; T322-S324 VanDerWaalsContact C-N 3.34Å; T322-S324 PolarHBondContact O-N 3.44Å
323	I	57.4	Low	78	Confident	42 Å²	42	82.7 Å²	82.7	22%	0.215	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-80.3	-14.4	-163.9	-54.7	172.3	0	0	0	113.3	L318 D320 D325 S326	L318-I323 WeakPolarHBondContact O-CD1 3.15Å; D320-I323 HydrophobicContact CB-CD1 4.06Å; D320-I323 HydrophobicContact CB-CG1 4.27Å; D320-I323 WeakPolarHBondContact O-CG1 3.37Å; D320-I323 PolarHBondContact O-N 3.04Å; I323-D325 PolarHBondContact O-N 3.47Å; I323-S326 PolarHBondContact O-N 3.19Å; I323-S326 PolarHBondContact O-OG 3.41Å; I323-S326 VanDerWaalsContact O-OG 3.04Å
324	S	54	Low	78.1	Confident	109 Å²	109	79.8 Å²	79.8	76%	0.762	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-45.1	-33.8	-168.6	-55.9	0	0	0	0	117	T322	T322-S324 VanDerWaalsContact C-N 3.34Å; T322-S324 PolarHBondContact O-N 3.44Å
325	D	53.4	Low	78.1	Confident	170 Å²	170	79.2 Å²	79.2	91%	0.909	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-106.1	10.8	-176.4	-62.5	-50.5	0	0	0	114.1	I323	I323-D325 PolarHBondContact O-N 3.47Å
326	S	60.1	Low	78.1	Confident	73 Å²	73	76.6 Å²	76.6	51%	0.51	40%	0.404	S	S	.	.	S	Bend	trans	-129.3	148.6	-172	70.8	0	0	0	0	114.1	I323	I323-S326 PolarHBondContact O-N 3.19Å; I323-S326 PolarHBondContact O-OG 3.41Å; I323-S326 VanDerWaalsContact O-OG 3.04Å
327	Q	64.7	Low	78.1	Confident	184 Å²	184	76.2 Å²	76.2	86%	0.86	40%	0.403	S	S	*	.			trans	-64.5	132.3	178.3	-168.4	178.5	20.4	0	0	110.4	N329	Q327-N329 PolarHBondContact O-N 3.11Å; Q327-N329 VanDerWaalsContact O-N 3.1Å
328	P	71.9	Confident	78.1	Confident	50 Å²	50	79.3 Å²	79.3	33%	0.325	41%	0.414	S	S	.	.			trans	-59.4	116.1	-173.3	21	-33.8	0	0	0	112.4	L317 W330	L317-P328 HydrophobicContact CD1-CB 4.13Å; L317-P328 HydrophobicContact CD2-CB 3.68Å; P328-W330 PolarHBondContact O-N 3.09Å
329	N	80.4	Confident	78	Confident	117 Å²	117	79.2 Å²	79.2	63%	0.626	41%	0.407	S	S	*	.			trans	-80.8	81.4	-177	-173	2.7	0	0	0	111.5	Q327 Q331	Q327-N329 PolarHBondContact O-N 3.11Å; Q327-N329 VanDerWaalsContact O-N 3.1Å; N329-Q331 PolarHBondContact O-N 3.31Å; N329-Q331 VanDerWaalsContact O-N 3.15Å
330	W	89	Confident	78.1	Confident	53 Å²	53	77.9 Å²	77.9	20%	0.201	40%	0.397	C	S	.	.			trans	-66.1	106	-178.3	-68.5	101.3	0	0	0	113.3	K315 L317 P328 M388 T394 I405 E407	K315-W330 HydrophobicContact CB-CB 4.38Å; K315-W330 HydrophobicContact CB-CE3 4.03Å; K315-W330 HydrophobicContact CD-CB 4.12Å; L317-W330 HydrophobicContact CB-CE3 4.09Å; L317-W330 HydrophobicContact CB-CH2 4.4Å; L317-W330 HydrophobicContact CB-CZ3 3.99Å; P328-W330 PolarHBondContact O-N 3.09Å; W330-M388 HydrophobicContact CH2-CE 4.43Å; W330-M388 HydrophobicContact CH2-SD 4.2Å; W330-M388 HydrophobicContact CZ2-CE 3.73Å; W330-M388 HydrophobicContact CZ2-SD 3.95Å; W330-T394 HydrophobicContact CH2-CG2 4.25Å; W330-I405 HydrophobicContact CH2-CG2 3.75Å; W330-I405 HydrophobicContact CZ3-CG2 4.18Å; W330-E407 HydrophobicContact CE3-CB 4.11Å; W330-E407 HydrophobicContact CH2-CB 3.97Å; W330-E407 HydrophobicContact CZ3-CB 3.7Å
331	Q	91.9	Very high	78.3	Confident	67 Å²	67	82 Å²	82	31%	0.313	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	145.5	174.2	-67.8	174.4	8.4	0	0	110	K315 Y316 N329 D361	K315-Q331 CarbonylContact C-O 3.46Å; K315-Q331 WeakPolarHBondContact CA-O 3.34Å; Y316-Q331 HydrophobicContact CD1-CB 3.91Å; Y316-Q331 WeakPolarHBondContact CD1-O 3.35Å; Y316-Q331 HydrophobicContact CE1-CB 3.42Å; Y316-Q331 VanDerWaalsContact CE1-CB 3.42Å; Y316-Q331 PolarHBondContact N-O 3.4Å; Y316-Q331 PolarHBondContact O-N 3.33Å; Y316-Q331 PolarHBondContact OH-OE1 3.46Å; N329-Q331 PolarHBondContact O-N 3.31Å; N329-Q331 VanDerWaalsContact O-N 3.15Å; Q331-D361 PolarHBondContact OE1-OD2 2.98Å
332	R	92.9	Very high	78.2	Confident	141 Å²	141	77.7 Å²	77.7	53%	0.532	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	124.7	177.5	-68.7	-176.3	66.9	98.6	4.5	109.4	K315 P363	K315-R332 HydrophobicContact CG-CG 4.12Å; R332-P363 HydrophobicContact CB-CG 3.87Å; R332-P363 WeakPolarHBondContact O-CD 3.28Å; R332-P363 WeakPolarHBondContact O-CG 3.49Å
333	C	94.9	Very high	78.2	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	164.3	176	67.1	0	0	0	0	112.8	Q313 L314 Y316 L359 Y360 D361	Q313-C333 CarbonylContact C-O 3.53Å; Q313-C333 VanDerWaalsContact CA-O 3.29Å; Q313-C333 WeakPolarHBondContact CA-O 3.29Å; L314-C333 PolarHBondContact N-O 3.45Å; L314-C333 PolarHBondContact O-N 2.83Å; Y316-C333 HydrophobicContact CD1-CB 3.56Å; Y316-C333 HydrophobicContact CE1-CB 3.75Å; C333-L359 HydrophobicContact CB-CD2 3.54Å; C333-L359 HydrophobicContact CB-CG 3.86Å; C333-Y360 CarbonylContact C-O 3.41Å; C333-Y360 WeakPolarHBondContact CA-O 3.28Å; C333-Y360 WeakPolarHBondContact CB-O 3.45Å; C333-D361 HydrophobicContact CB-CB 4.44Å
334	R	94.9	Very high	77.9	Confident	56 Å²	56	86.3 Å²	86.3	21%	0.211	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.9	158.8	179.2	172.6	69.8	101.5	1.9	106.8	E311 G312 Q313 Y360 P363	E311-R334 HydrophobicContact CG-CG 4.22Å; E311-R334 WeakPolarHBondContact OE1-CD 3.45Å; E311-R334 IonicContact OE1-CZ 3.52Å; E311-R334 IonicContact OE1-NE 3.09Å; E311-R334 IonicContact OE1-NH1 3.36Å; E311-R334 PolarHBondContact OE1-NH1 3.33Å; G312-R334 CarbonylContact O-C 3.51Å; G312-R334 WeakPolarHBondContact O-CA 3.49Å; Q313-R334 HydrophobicContact CG-CB 4.45Å; R334-Y360 PolarHBondContact N-O 2.69Å; R334-Y360 PolarHBondContact O-N 2.8Å; R334-P363 HydrophobicContact CB-CB 3.93Å; R334-P363 WeakPolarHBondContact CB-O 3.4Å; R334-P363 WeakPolarHBondContact CD-O 3.27Å; R334-P363 PolarHBondContact NE-O 2.95Å
335	L	95.3	Very high	77.5	Confident	1 Å²	1	85.5 Å²	85.5	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.6	179.7	-166.5	67.1	0	0	0	108.4	E311 G312 L314 L357 L359 F395 F406 W417	E311-L335 WeakPolarHBondContact CA-O 3.46Å; G312-L335 PolarHBondContact N-O 3.46Å; G312-L335 PolarHBondContact O-N 3.04Å; L314-L335 HydrophobicContact CD1-CB 4.28Å; L314-L335 HydrophobicContact CD1-CD2 3.92Å; L335-L357 HydrophobicContact CD1-CD1 3.78Å; L335-L357 HydrophobicContact CD1-CD2 4.47Å; L335-L357 HydrophobicContact CD1-CG 4.18Å; L335-L357 HydrophobicContact CD2-CD1 4.45Å; L335-L357 HydrophobicContact CG-CD1 3.98Å; L335-L359 HydrophobicContact CD1-CB 4.06Å; L335-L359 HydrophobicContact CD1-CG 4.28Å; L335-F395 HydrophobicContact CD2-CZ 4.41Å; L335-F406 HydrophobicContact CD1-CE1 3.98Å; L335-F406 HydrophobicContact CD1-CZ 3.95Å; L335-F406 HydrophobicContact CD2-CD1 4.28Å; L335-F406 HydrophobicContact CD2-CE1 3.89Å; L335-F406 HydrophobicContact CD2-CZ 4.1Å; L335-F406 HydrophobicContact CG-CE1 4.4Å; L335-W417 HydrophobicContact CB-CH2 4.17Å; L335-W417 HydrophobicContact CB-CZ3 4.37Å; L335-W417 HydrophobicContact CD2-CE3 3.92Å; L335-W417 HydrophobicContact CD2-CH2 4.35Å; L335-W417 HydrophobicContact CD2-CZ3 3.8Å; L335-W417 HydrophobicContact CG-CH2 4.39Å; L335-W417 HydrophobicContact CG-CZ3 4.09Å; L335-W417 WeakPolarHBondContact O-CH2 3.38Å
336	L	93.5	Very high	77.3	Confident	15 Å²	15	82 Å²	82	8%	0.079	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	123.6	-176.8	173.2	62.8	0	0	0	109.7	C308 E311 L357 E358 Y360	C308-L336 HydrophobicContact CB-CD1 3.87Å; E311-L336 HydrophobicContact CB-CD1 3.92Å; E311-L336 HydrophobicContact CG-CB 4.46Å; E311-L336 HydrophobicContact CG-CD1 4.07Å; L336-L357 WeakPolarHBondContact O-CA 3.16Å; L336-E358 HydrophobicContact CB-CB 4.4Å; L336-E358 PolarHBondContact N-O 3.42Å; L336-E358 PolarHBondContact O-N 2.73Å; L336-Y360 HydrophobicContact CB-CE2 4.34Å; L336-Y360 HydrophobicContact CD2-CE2 4.12Å
337	V	92.9	Very high	76.6	Confident	0 Å²	0	81 Å²	81	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	123.8	164.6	-176.1	0	0	0	0	107.4	C309 K310 L357 W417 L421 C424	C309-V337 HydrophobicContact CB-CB 4.3Å; C309-V337 HydrophobicContact CB-CG1 4.03Å; C309-V337 PolarHBondContact N-O 2.91Å; K310-V337 PolarHBondContact N-O 2.83Å; K310-V337 PolarHBondContact O-N 2.92Å; V337-L357 HydrophobicContact CG2-CD1 3.71Å; V337-W417 HydrophobicContact CG2-CZ3 4.26Å; V337-L421 HydrophobicContact CG2-CD2 3.72Å; V337-C424 HydrophobicContact CG1-CB 4.38Å
338	R	90.7	Very high	75.7	Confident	81 Å²	81	76.6 Å²	76.6	31%	0.306	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.9	174.8	66.4	179.8	-179.4	98.2	-2.9	112.6	G307 Q356 E358	G307-R338 CarbonylContact O-C 3.5Å; G307-R338 VanDerWaalsContact O-CA 3.3Å; G307-R338 WeakPolarHBondContact O-CA 3.43Å; R338-Q356 HydrophobicContact CG-CB 4.42Å; R338-Q356 PolarHBondContact N-O 3.14Å; R338-Q356 PolarHBondContact O-N 2.87Å; R338-E358 WeakPolarHBondContact CD-OE2 3.29Å; R338-E358 IonicContact CZ-OE1 2.78Å; R338-E358 VanDerWaalsContact CZ-OE1 3.25Å; R338-E358 IonicContact CZ-OE2 3.8Å; R338-E358 IonicContact NE-OE1 2.62Å; R338-E358 PolarHBondContact NE-OE1 2.9Å; R338-E358 IonicContact NE-OE2 2.71Å; R338-E358 PolarHBondContact NE-OE2 3.19Å; R338-E358 IonicContact NH2-OE1 2.65Å; R338-E358 PolarHBondContact NH2-OE1 3.49Å; R338-E358 IonicContact NH2-OE2 3.32Å
339	R	87.4	Confident	74.6	Confident	88 Å²	88	85.3 Å²	85.3	33%	0.332	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.2	169.1	180	177.5	57.4	173	0.3	109.4	G307 C309 E353 R354 Y355	G307-R339 PolarHBondContact O-N 3.24Å; C309-R339 PolarHBondContact SG-N 2.94Å; R339-E353 WeakPolarHBondContact CD-OE2 3.38Å; R339-E353 HydrophobicContact CG-CB 4.33Å; R339-E353 IonicContact CZ-OE1 2.8Å; R339-E353 IonicContact CZ-OE2 3.88Å; R339-E353 IonicContact NE-OE1 3.83Å; R339-E353 IonicContact NE-OE2 3.2Å; R339-E353 IonicContact NH1-OE1 3.68Å; R339-E353 PolarHBondContact NH1-OE1 3.38Å; R339-E353 IonicContact NH1-OE2 2.68Å; R339-E353 PolarHBondContact NH1-OE2 2.96Å; R339-R354 CarbonylContact C-O 3.59Å; R339-R354 WeakPolarHBondContact CA-O 3.27Å; R339-Y355 HydrophobicContact CB-CD1 4.11Å; R339-Y355 HydrophobicContact CB-CE1 4.02Å; R339-Y355 HydrophobicContact CG-CE1 4.36Å
340	I	83.9	Confident	73	Confident	38 Å²	38	84.2 Å²	84.2	20%	0.195	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.8	173.6	-58.3	-170.1	0	0	0	108.5	R354 Q356	I340-R354 PolarHBondContact N-O 3.26Å; I340-R354 PolarHBondContact O-N 2.7Å; I340-Q356 HydrophobicContact CD1-CB 3.53Å; I340-Q356 VanDerWaalsContact CD1-CD 3.46Å; I340-Q356 HydrophobicContact CD1-CG 4.08Å; I340-Q356 HydrophobicContact CG1-CB 4.04Å
341	R	77.8	Confident	71.3	Confident	169 Å²	169	84.4 Å²	84.4	64%	0.638	48%	0.481	S	S	*	.			trans	-112.3	130.1	168.2	-68.1	178.1	172.8	169.9	-2.5	107.9	T343	R341-T343 PolarHBondContact O-N 3.27Å
342	D	58.8	Low	69.7	Low	68 Å²	68	84.5 Å²	84.5	36%	0.364	49%	0.489	S	S	.	.			trans	-69.7	103.1	173.9	-72.3	-46.5	0	0	0	109.6	Q344 R354	D342-Q344 PolarHBondContact O-N 3.24Å; D342-R354 IonicContact OD1-CZ 2.76Å; D342-R354 IonicContact OD1-NE 2.68Å; D342-R354 IonicContact OD1-NH2 3.84Å; D342-R354 PolarHBondContact OD1-NH2 3.11Å; D342-R354 IonicContact OD2-CZ 2.69Å; D342-R354 IonicContact OD2-NE 3.6Å; D342-R354 PolarHBondContact OD2-NE 2.82Å; D342-R354 IonicContact OD2-NH2 2.82Å; D342-R354 PolarHBondContact OD2-NH2 3.06Å; D342-R354 VanDerWaalsContact OD2-NH2 3.09Å
343	T	55.6	Low	68.6	Low	144 Å²	144	81.5 Å²	81.5	88%	0.883	48%	0.481	S	S	*	.			trans	-74.2	-3.8	176.3	47.6	0	0	0	0	113	R341	R341-T343 PolarHBondContact O-N 3.27Å
344	Q	52.8	Low	68	Low	189 Å²	189	86.5 Å²	86.5	88%	0.883	50%	0.5	S	S	*	.			trans	-112.2	51.7	-172.1	-160.6	153.8	7.6	0	0	113.1	D342	D342-Q344 PolarHBondContact O-N 3.24Å
345	S	44.3	Very low	67.8	Low	92 Å²	92	85.4 Å²	85.4	64%	0.643	50%	0.496	S	S	*	.			trans	-140	93.6	157.6	-165.2	0	0	0	0	110.1	G347	S345-G347 PolarHBondContact O-N 2.81Å
346	G	50.4	Low	67.6	Low	96 Å²	96	86.4 Å²	86.4	99%	0.99	50%	0.501	S	S	*	.			trans	-75.2	68.9	173.9	0	0	0	0	0	111.2
347	G	45.3	Very low	67.6	Low	51 Å²	51	85.8 Å²	85.8	53%	0.526	50%	0.498	S	S	.	.	S	Bend	trans	-176.1	52.4	-168.5	0	0	0	0	0	117.7	S345 R349	S345-G347 PolarHBondContact O-N 2.81Å; G347-R349 PolarHBondContact O-N 2.85Å
348	G	45.4	Very low	67.7	Low	93 Å²	93	86.2 Å²	86.2	96%	0.959	50%	0.5	S	S	*	.	S	Bend	trans	63.5	-11.5	149.9	0	0	0	0	0	120.8
349	R	48.1	Very low	67.8	Low	232 Å²	232	82.6 Å²	82.6	88%	0.875	49%	0.486	S	S	*	.	S	Bend	trans	-93	147.7	175.2	-73.6	-173.2	169.6	-157.7	-4.4	110.9	G347 G351	G347-R349 PolarHBondContact O-N 2.85Å; R349-G351 PolarHBondContact O-N 2.72Å; R349-G351 VanDerWaalsContact O-N 3.09Å
350	A	48.1	Very low	68.1	Low	94 Å²	94	79.8 Å²	79.8	78%	0.777	48%	0.476	S	S	*	.			trans	-63.1	111.6	-178.9	0	0	0	0	0	110.8	S352	A350-S352 PolarHBondContact O-N 2.91Å
351	G	51.5	Low	68.4	Low	57 Å²	57	79.7 Å²	79.7	59%	0.588	48%	0.476	S	S	*	.			trans	-65.8	127.2	176.5	0	0	0	0	0	111.1	R349 E353	R349-G351 PolarHBondContact O-N 2.72Å; R349-G351 VanDerWaalsContact O-N 3.09Å; G351-E353 PolarHBondContact O-N 3.32Å
352	S	59	Low	68.7	Low	70 Å²	70	75.6 Å²	75.6	49%	0.49	47%	0.471	S	S	.	.			trans	-54.8	125.4	178.7	-52.6	0	0	0	0	111	A350 R354	A350-S352 PolarHBondContact O-N 2.91Å; S352-R354 PolarHBondContact O-N 2.87Å
353	E	69.8	Low	70.2	Confident	77 Å²	77	73.3 Å²	73.3	36%	0.36	46%	0.46	S	S	.	.			trans	-71.9	100.4	176.1	-63.4	-149.5	133	0	0	109.7	R339 G351 Y355	R339-E353 WeakPolarHBondContact CD-OE2 3.38Å; R339-E353 HydrophobicContact CG-CB 4.33Å; R339-E353 IonicContact CZ-OE1 2.8Å; R339-E353 IonicContact CZ-OE2 3.88Å; R339-E353 IonicContact NE-OE1 3.83Å; R339-E353 IonicContact NE-OE2 3.2Å; R339-E353 IonicContact NH1-OE1 3.68Å; R339-E353 PolarHBondContact NH1-OE1 3.38Å; R339-E353 IonicContact NH1-OE2 2.68Å; R339-E353 PolarHBondContact NH1-OE2 2.96Å; G351-E353 PolarHBondContact O-N 3.32Å; E353-Y355 HydrophobicContact CB-CE2 4.44Å; E353-Y355 WeakPolarHBondContact O-CD2 3.5Å; E353-Y355 WeakPolarHBondContact O-CE2 3.34Å
354	R	82.2	Confident	71.7	Confident	106 Å²	106	76 Å²	76	40%	0.4	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	144.7	-179.6	-64.2	-156.1	-84.4	163.9	-6.3	110.5	R339 I340 D342 S352	R339-R354 CarbonylContact C-O 3.59Å; R339-R354 WeakPolarHBondContact CA-O 3.27Å; I340-R354 PolarHBondContact N-O 3.26Å; I340-R354 PolarHBondContact O-N 2.7Å; D342-R354 IonicContact OD1-CZ 2.76Å; D342-R354 IonicContact OD1-NE 2.68Å; D342-R354 IonicContact OD1-NH2 3.84Å; D342-R354 PolarHBondContact OD1-NH2 3.11Å; D342-R354 IonicContact OD2-CZ 2.69Å; D342-R354 IonicContact OD2-NE 3.6Å; D342-R354 PolarHBondContact OD2-NE 2.82Å; D342-R354 IonicContact OD2-NH2 2.82Å; D342-R354 PolarHBondContact OD2-NH2 3.06Å; D342-R354 VanDerWaalsContact OD2-NH2 3.09Å; S352-R354 PolarHBondContact O-N 2.87Å
355	Y	90.1	Very high	73.3	Confident	32 Å²	32	68 Å²	68	13%	0.125	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	143.4	-179.7	-63.1	-103.4	0	0	0	110.3	C309 R339 E353 C374 C424 N427	C309-Y355 VanDerWaalsContact SG-CE1 3.56Å; R339-Y355 HydrophobicContact CB-CD1 4.11Å; R339-Y355 HydrophobicContact CB-CE1 4.02Å; R339-Y355 HydrophobicContact CG-CE1 4.36Å; E353-Y355 HydrophobicContact CB-CE2 4.44Å; E353-Y355 WeakPolarHBondContact O-CD2 3.5Å; E353-Y355 WeakPolarHBondContact O-CE2 3.34Å; Y355-C374 VanDerWaalsContact CB-SG 3.55Å; Y355-C374 PolarHBondContact O-N 3.39Å; Y355-C424 HydrophobicContact CD1-CB 4Å; Y355-C424 WeakPolarHBondContact CD1-SG 3.27Å; Y355-C424 HydrophobicContact CG-CB 3.93Å; Y355-N427 HydrophobicContact CD2-CB 4.44Å; Y355-N427 HydrophobicContact CE2-CB 3.88Å; Y355-N427 PolarHBondContact OH-ND2 2.9Å; Y355-N427 VanDerWaalsContact OH-ND2 3.13Å
356	Q	92.3	Very high	75.3	Confident	22 Å²	22	69.6 Å²	69.6	10%	0.103	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.6	-179.3	179.4	158.1	-52.1	0	0	110.1	R338 I340 E358 T371 H373	R338-Q356 HydrophobicContact CG-CB 4.42Å; R338-Q356 PolarHBondContact N-O 3.14Å; R338-Q356 PolarHBondContact O-N 2.87Å; I340-Q356 HydrophobicContact CD1-CB 3.53Å; I340-Q356 VanDerWaalsContact CD1-CD 3.46Å; I340-Q356 HydrophobicContact CD1-CG 4.08Å; I340-Q356 HydrophobicContact CG1-CB 4.04Å; Q356-E358 HydrophobicContact CG-CG 4.33Å; Q356-E358 PolarHBondContact NE2-OE1 2.85Å; Q356-T371 HydrophobicContact CG-CG2 3.99Å; Q356-H373 PolarHBondContact OE1-CE1 2.81Å; Q356-H373 PolarHBondContact OE1-ND1 3.47Å
357	L	93.5	Very high	77.1	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.2	176.8	-177.1	72.2	0	0	0	109.5	L335 L336 V337 T371 T372 I377 L397 L421	L335-L357 HydrophobicContact CD1-CD1 3.78Å; L335-L357 HydrophobicContact CD1-CD2 4.47Å; L335-L357 HydrophobicContact CD1-CG 4.18Å; L335-L357 HydrophobicContact CD2-CD1 4.45Å; L335-L357 HydrophobicContact CG-CD1 3.98Å; L336-L357 WeakPolarHBondContact O-CA 3.16Å; V337-L357 HydrophobicContact CG2-CD1 3.71Å; L357-T371 WeakPolarHBondContact O-CA 3.41Å; L357-T372 HydrophobicContact CB-CG2 3.96Å; L357-T372 HydrophobicContact CD2-CG2 4.23Å; L357-T372 PolarHBondContact N-O 2.91Å; L357-T372 PolarHBondContact O-N 2.57Å; L357-I377 HydrophobicContact CD2-CD1 4.26Å; L357-L397 HydrophobicContact CD2-CD1 4.43Å; L357-L397 HydrophobicContact CD2-CD2 3.48Å; L357-L397 VanDerWaalsContact CD2-CD2 3.48Å; L357-L421 HydrophobicContact CD1-CD2 3.79Å; L357-L421 HydrophobicContact CD2-CD2 4.41Å
358	E	94.1	Very high	79.2	Confident	9 Å²	9	68.2 Å²	68.2	4%	0.042	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.1	-179.3	-77.8	164.9	175.7	0	0	110.2	L336 R338 Q356 Y360 P368 L370 T371	L336-E358 HydrophobicContact CB-CB 4.4Å; L336-E358 PolarHBondContact N-O 3.42Å; L336-E358 PolarHBondContact O-N 2.73Å; R338-E358 WeakPolarHBondContact CD-OE2 3.29Å; R338-E358 IonicContact CZ-OE1 2.78Å; R338-E358 VanDerWaalsContact CZ-OE1 3.25Å; R338-E358 IonicContact CZ-OE2 3.8Å; R338-E358 IonicContact NE-OE1 2.62Å; R338-E358 PolarHBondContact NE-OE1 2.9Å; R338-E358 IonicContact NE-OE2 2.71Å; R338-E358 PolarHBondContact NE-OE2 3.19Å; R338-E358 IonicContact NH2-OE1 2.65Å; R338-E358 PolarHBondContact NH2-OE1 3.49Å; R338-E358 IonicContact NH2-OE2 3.32Å; Q356-E358 HydrophobicContact CG-CG 4.33Å; Q356-E358 PolarHBondContact NE2-OE1 2.85Å; E358-Y360 HydrophobicContact CB-CE2 3.96Å; E358-P368 HydrophobicContact CB-CB 4.05Å; E358-P368 HydrophobicContact CG-CB 4.2Å; E358-P368 HydrophobicContact CG-CG 4.2Å; E358-L370 WeakPolarHBondContact CA-O 3.34Å; E358-T371 HydrophobicContact CG-CG2 4.04Å
359	L	93.6	Very high	81.3	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.021	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	111.1	178.4	-172.4	169.3	0	0	0	108.2	Y316 C333 L335 D361 P368 K369 L370 L404 F406	Y316-L359 HydrophobicContact CD2-CD1 4.18Å; Y316-L359 HydrophobicContact CE1-CD2 4Å; Y316-L359 HydrophobicContact CE2-CD1 4.12Å; Y316-L359 HydrophobicContact CG-CD1 4.43Å; C333-L359 HydrophobicContact CB-CD2 3.54Å; C333-L359 HydrophobicContact CB-CG 3.86Å; L335-L359 HydrophobicContact CD1-CB 4.06Å; L335-L359 HydrophobicContact CD1-CG 4.28Å; L359-D361 HydrophobicContact CD2-CB 3.77Å; L359-P368 CarbonylContact O-C 3.57Å; L359-P368 WeakPolarHBondContact O-CA 3.35Å; L359-K369 PolarHBondContact O-N 3.39Å; L359-L370 HydrophobicContact CB-CB 4.15Å; L359-L370 PolarHBondContact N-O 3.25Å; L359-L370 PolarHBondContact O-N 2.73Å; L359-L404 HydrophobicContact CD1-CD1 4.33Å; L359-F406 HydrophobicContact CD1-CE1 4.06Å; L359-F406 HydrophobicContact CD1-CZ 3.83Å
360	Y	93.2	Very high	83.2	Confident	29 Å²	29	59.3 Å²	59.3	11%	0.114	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121	174.3	-60.8	-98.4	0	0	0	109.5	C333 R334 L336 E358 P362 A365 S367 P368	C333-Y360 CarbonylContact C-O 3.41Å; C333-Y360 WeakPolarHBondContact CA-O 3.28Å; C333-Y360 WeakPolarHBondContact CB-O 3.45Å; R334-Y360 PolarHBondContact N-O 2.69Å; R334-Y360 PolarHBondContact O-N 2.8Å; L336-Y360 HydrophobicContact CB-CE2 4.34Å; L336-Y360 HydrophobicContact CD2-CE2 4.12Å; E358-Y360 HydrophobicContact CB-CE2 3.96Å; Y360-P362 CarbonylContact C-O 3.48Å; Y360-A365 HydrophobicContact CD1-CB 4.46Å; Y360-A365 WeakPolarHBondContact CD1-O 3.33Å; Y360-S367 VanDerWaalsContact CD1-C 3.45Å; Y360-S367 WeakPolarHBondContact CD1-O 3.41Å; Y360-P368 HydrophobicContact CD1-CB 4.21Å; Y360-P368 HydrophobicContact CD2-CB 4.49Å; Y360-P368 HydrophobicContact CE1-CB 4.09Å; Y360-P368 HydrophobicContact CE1-CG 4.4Å; Y360-P368 HydrophobicContact CE2-CB 4.37Å; Y360-P368 HydrophobicContact CG-CB 4.41Å
361	D	89.8	Confident	85.2	Confident	37 Å²	37	57.6 Å²	57.6	20%	0.198	33%	0.325	C	S	.	.	S	Bend	trans	-138.4	115.6	176.6	168.5	31.9	0	0	0	108.3	Y316 Q331 C333 L359 K369	Y316-D361 HydrophobicContact CE1-CB 3.99Å; Y316-D361 PolarHBondContact OH-OD2 2.75Å; Q331-D361 PolarHBondContact OE1-OD2 2.98Å; C333-D361 HydrophobicContact CB-CB 4.44Å; L359-D361 HydrophobicContact CD2-CB 3.77Å; D361-K369 HydrophobicContact CB-CB 4.35Å; D361-K369 HydrophobicContact CB-CD 3.75Å; D361-K369 VanDerWaalsContact OD2-CD 3.29Å; D361-K369 WeakPolarHBondContact OD2-CD 3.48Å; D361-K369 IonicContact OD2-NZ 3.71Å; D361-K369 PolarHBondContact OD2-NZ 3.44Å
362	P	85.6	Confident	87.1	Confident	83 Å²	83	55.6 Å²	55.6	54%	0.539	30%	0.302	S	S	.	.	S	Bend	cis	-64.6	165.4	0.6	28.5	-36.9	0	0	0	113	Y360 K364 A365	Y360-P362 CarbonylContact C-O 3.48Å; P362-K364 PolarHBondContact O-N 3.38Å; P362-A365 VanDerWaalsContact O-CB 3.27Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 2.96Å
363	P	88.4	Confident	88.6	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.123	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.3	-171.2	-24.6	35.3	0	0	0	114.6	Q313 R332 R334	Q313-P363 HydrophobicContact CG-CB 4.4Å; R332-P363 HydrophobicContact CB-CG 3.87Å; R332-P363 WeakPolarHBondContact O-CD 3.28Å; R332-P363 WeakPolarHBondContact O-CG 3.49Å; R334-P363 HydrophobicContact CB-CB 3.93Å; R334-P363 WeakPolarHBondContact CB-O 3.4Å; R334-P363 WeakPolarHBondContact CD-O 3.27Å; R334-P363 PolarHBondContact NE-O 2.95Å
364	K	88.3	Confident	89.5	Confident	200 Å²	200	51.7 Å²	51.7	87%	0.87	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	7.6	-180	-60.7	-175.3	177.6	-176.1	0	113.8	P362	P362-K364 PolarHBondContact O-N 3.38Å
365	A	87.1	Confident	89.6	Confident	21 Å²	21	49.4 Å²	49.4	17%	0.174	28%	0.276	C	S	.	.			trans	-61.1	144.3	177.5	0	0	0	0	0	111.4	Y360 P362 S367	Y360-A365 HydrophobicContact CD1-CB 4.46Å; Y360-A365 WeakPolarHBondContact CD1-O 3.33Å; P362-A365 VanDerWaalsContact O-CB 3.27Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 2.96Å; A365-S367 VanDerWaalsContact C-N 3.35Å; A365-S367 WeakPolarHBondContact CB-O 3.44Å
366	S	85.1	Confident	89.5	Confident	126 Å²	126	50.5 Å²	50.5	88%	0.881	28%	0.284	S	S	*	.	S	Bend	trans	-75.9	-23.5	174.4	48.4	0	0	0	0	112.8
367	S	87.8	Confident	89.4	Confident	77 Å²	77	50 Å²	50	54%	0.538	28%	0.282	S	S	.	.	S	Bend	trans	-119.8	145.8	176.8	52.4	0	0	0	0	111.8	Y360 A365	Y360-S367 VanDerWaalsContact CD1-C 3.45Å; Y360-S367 WeakPolarHBondContact CD1-O 3.41Å; A365-S367 VanDerWaalsContact C-N 3.35Å; A365-S367 WeakPolarHBondContact CB-O 3.44Å
368	P	90.2	Very high	89.3	Confident	41 Å²	41	55 Å²	55	27%	0.266	31%	0.305	S	S	.	.			trans	-78.3	137.7	175.9	31.4	-34.9	0	0	0	111.9	E358 L359 Y360 T371	E358-P368 HydrophobicContact CB-CB 4.05Å; E358-P368 HydrophobicContact CG-CB 4.2Å; E358-P368 HydrophobicContact CG-CG 4.2Å; L359-P368 CarbonylContact O-C 3.57Å; L359-P368 WeakPolarHBondContact O-CA 3.35Å; Y360-P368 HydrophobicContact CD1-CB 4.21Å; Y360-P368 HydrophobicContact CD2-CB 4.49Å; Y360-P368 HydrophobicContact CE1-CB 4.09Å; Y360-P368 HydrophobicContact CE1-CG 4.4Å; Y360-P368 HydrophobicContact CE2-CB 4.37Å; Y360-P368 HydrophobicContact CG-CB 4.41Å; P368-T371 WeakPolarHBondContact CG-OG1 3.32Å
369	K	88.9	Confident	89.1	Confident	115 Å²	115	58 Å²	58	50%	0.5	32%	0.319	S	S	.	.	S	Bend	trans	-74.1	-33.8	175.3	-174.8	-178.7	-178	-175	0	112.1	Y316 L359 D361	Y316-K369 WeakPolarHBondContact OH-CD 3.27Å; Y316-K369 PolarHBondContact OH-NZ 2.83Å; L359-K369 PolarHBondContact O-N 3.39Å; D361-K369 HydrophobicContact CB-CB 4.35Å; D361-K369 HydrophobicContact CB-CD 3.75Å; D361-K369 VanDerWaalsContact OD2-CD 3.29Å; D361-K369 WeakPolarHBondContact OD2-CD 3.48Å; D361-K369 IonicContact OD2-NZ 3.71Å; D361-K369 PolarHBondContact OD2-NZ 3.44Å
370	L	88.3	Confident	89.2	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.12	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135	167.1	172.6	66.8	0	0	0	109.5	E358 L359 V399 R401 L404	E358-L370 WeakPolarHBondContact CA-O 3.34Å; L359-L370 HydrophobicContact CB-CB 4.15Å; L359-L370 PolarHBondContact N-O 3.25Å; L359-L370 PolarHBondContact O-N 2.73Å; L370-V399 HydrophobicContact CD2-CG2 4.13Å; L370-R401 HydrophobicContact CD1-CB 4.28Å; L370-L404 HydrophobicContact CD2-CD1 3.59Å
371	T	91.1	Very high	89.2	Confident	59 Å²	59	60.3 Å²	60.3	36%	0.362	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.2	167.5	-59.7	0	0	0	0	108	Q356 L357 E358 P368	Q356-T371 HydrophobicContact CG-CG2 3.99Å; L357-T371 WeakPolarHBondContact O-CA 3.41Å; E358-T371 HydrophobicContact CG-CG2 4.04Å; P368-T371 WeakPolarHBondContact CG-OG1 3.32Å
372	T	90.6	Very high	89.4	Confident	15 Å²	15	63.6 Å²	63.6	9%	0.092	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	148.6	179.5	-164.2	0	0	0	0	109.5	L357 D376 V399	L357-T372 HydrophobicContact CB-CG2 3.96Å; L357-T372 HydrophobicContact CD2-CG2 4.23Å; L357-T372 PolarHBondContact N-O 2.91Å; L357-T372 PolarHBondContact O-N 2.57Å; T372-D376 WeakPolarHBondContact OG1-CB 3.22Å; T372-V399 HydrophobicContact CG2-CG1 4.03Å
373	H	90	Very high	89.7	Confident	64 Å²	64	60.7 Å²	60.7	30%	0.296	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	151	169.7	-63	-61.7	0	0	0	109.6	Q356 S375 D376	Q356-H373 PolarHBondContact OE1-CE1 2.81Å; Q356-H373 PolarHBondContact OE1-ND1 3.47Å; H373-S375 PolarHBondContact O-N 2.89Å; H373-D376 VanDerWaalsContact CB-OD2 3.31Å; H373-D376 WeakPolarHBondContact CB-OD2 3.27Å; H373-D376 IonicContact CD2-OD2 3.64Å; H373-D376 IonicContact CG-OD2 2.8Å; H373-D376 PolarHBondContact N-OD2 2.95Å; H373-D376 WeakPolarHBondContact O-CB 3.49Å; H373-D376 PolarHBondContact O-N 3.13Å
374	C	88.4	Confident	89.6	Confident	1 Å²	1	63 Å²	63	1%	0.007	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-62.4	-27.9	174.2	-62.9	0	0	0	0	111.2	Y355 D376 I377 C424 I425	Y355-C374 VanDerWaalsContact CB-SG 3.55Å; Y355-C374 PolarHBondContact O-N 3.39Å; C374-D376 PolarHBondContact O-N 3.45Å; C374-I377 HydrophobicContact CB-CD1 4.14Å; C374-I377 WeakPolarHBondContact O-CB 3.16Å; C374-I377 WeakPolarHBondContact O-CG1 3.38Å; C374-I377 PolarHBondContact O-N 3.43Å; C374-C424 HydrophobicContact CB-CB 4.02Å; C374-I425 WeakPolarHBondContact O-CG1 3.29Å
375	S	85.4	Confident	89.2	Confident	58 Å²	58	62.3 Å²	62.3	41%	0.406	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-61	-18.2	171.3	-51.1	0	0	0	0	115	H373	H373-S375 PolarHBondContact O-N 2.89Å
376	D	87.9	Confident	88.8	Confident	54 Å²	54	69.1 Å²	69.1	29%	0.289	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-96	-0.4	-179.6	-52.7	-42.1	0	0	0	112.9	T372 H373 C374 Q378	T372-D376 WeakPolarHBondContact OG1-CB 3.22Å; H373-D376 VanDerWaalsContact CB-OD2 3.31Å; H373-D376 WeakPolarHBondContact CB-OD2 3.27Å; H373-D376 IonicContact CD2-OD2 3.64Å; H373-D376 IonicContact CG-OD2 2.8Å; H373-D376 PolarHBondContact N-OD2 2.95Å; H373-D376 WeakPolarHBondContact O-CB 3.49Å; H373-D376 PolarHBondContact O-N 3.13Å; C374-D376 PolarHBondContact O-N 3.45Å; D376-Q378 PolarHBondContact O-N 2.91Å
377	I	90.8	Very high	88.7	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	117.4	177.2	-58	170.1	0	0	0	108.3	L357 C374 V380 L397 V399 L421 I425	L357-I377 HydrophobicContact CD2-CD1 4.26Å; C374-I377 HydrophobicContact CB-CD1 4.14Å; C374-I377 WeakPolarHBondContact O-CB 3.16Å; C374-I377 WeakPolarHBondContact O-CG1 3.38Å; C374-I377 PolarHBondContact O-N 3.43Å; I377-V380 HydrophobicContact CG2-CG2 3.56Å; I377-L397 HydrophobicContact CB-CD1 4.44Å; I377-L397 HydrophobicContact CD1-CD1 4.05Å; I377-L397 HydrophobicContact CG1-CD1 4.15Å; I377-L397 HydrophobicContact CG2-CD1 3.45Å; I377-L397 VanDerWaalsContact CG2-CD1 3.45Å; I377-V399 HydrophobicContact CG1-CG1 4.11Å; I377-L421 HydrophobicContact CD1-CD2 4.43Å; I377-I425 HydrophobicContact CB-CD1 3.79Å; I377-I425 HydrophobicContact CB-CG1 4.07Å; I377-I425 HydrophobicContact CD1-CD1 4.13Å; I377-I425 HydrophobicContact CD1-CG1 4.16Å; I377-I425 HydrophobicContact CG2-CD1 3.71Å
378	Q	89.8	Confident	88.6	Confident	108 Å²	108	63.2 Å²	63.2	51%	0.505	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-37.6	-180	-59.5	-179.3	4.3	0	0	111.8	D376 K398 N400	D376-Q378 PolarHBondContact O-N 2.91Å; Q378-K398 HydrophobicContact CB-CB 4.33Å; Q378-K398 HydrophobicContact CB-CD 4.37Å; Q378-K398 HydrophobicContact CB-CG 4.29Å; Q378-K398 PolarHBondContact N-O 3.34Å; Q378-N400 PolarHBondContact NE2-OD1 2.68Å
379	E	90.9	Very high	87.7	Confident	71 Å²	71	64.2 Å²	64.2	33%	0.332	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	140.3	-171.4	-161.3	-179.8	-177.9	0	0	111.9	R381 K398	E379-R381 HydrophobicContact CG-CG 4.38Å; E379-R381 VanDerWaalsContact OE1-CD 3.27Å; E379-R381 WeakPolarHBondContact OE1-CD 3.26Å; E379-R381 IonicContact OE1-CZ 3.3Å; E379-R381 IonicContact OE1-NE 3.01Å; E379-R381 PolarHBondContact OE1-NE 2.85Å; E379-R381 IonicContact OE1-NH2 2.71Å; E379-K398 HydrophobicContact CB-CB 3.67Å; E379-K398 HydrophobicContact CB-CD 4.47Å; E379-K398 PolarHBondContact N-O 2.82Å; E379-K398 PolarHBondContact O-N 3.3Å
380	V	95.1	Very high	87.1	Confident	11 Å²	11	65.3 Å²	65.3	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	117.3	170.3	-178.3	0	0	0	0	108.7	I377 V396 L397 T418 L421 K422 I425	I377-V380 HydrophobicContact CG2-CG2 3.56Å; V380-V396 WeakPolarHBondContact CA-O 3.15Å; V380-L397 HydrophobicContact CG2-CD1 3.94Å; V380-T418 HydrophobicContact CG1-CG2 3.9Å; V380-L421 HydrophobicContact CG1-CB 4.17Å; V380-L421 HydrophobicContact CG1-CD1 4.28Å; V380-L421 HydrophobicContact CG2-CB 4.1Å; V380-K422 HydrophobicContact CB-CG 4.24Å; V380-K422 HydrophobicContact CG1-CG 4.46Å; V380-K422 WeakPolarHBondContact O-CE 3.37Å; V380-K422 PolarHBondContact O-NZ 3.28Å; V380-I425 HydrophobicContact CG2-CD1 3.64Å
381	R	94.2	Very high	86.7	Confident	70 Å²	70	67.1 Å²	67.1	26%	0.264	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	166	176.8	57.5	167.5	171.6	80.3	4.6	112.3	E379 E387 F395 V396	E379-R381 HydrophobicContact CG-CG 4.38Å; E379-R381 VanDerWaalsContact OE1-CD 3.27Å; E379-R381 WeakPolarHBondContact OE1-CD 3.26Å; E379-R381 IonicContact OE1-CZ 3.3Å; E379-R381 IonicContact OE1-NE 3.01Å; E379-R381 PolarHBondContact OE1-NE 2.85Å; E379-R381 IonicContact OE1-NH2 2.71Å; R381-E387 IonicContact CZ-OE1 3.29Å; R381-E387 VanDerWaalsContact CZ-OE1 3.3Å; R381-E387 IonicContact CZ-OE2 3.16Å; R381-E387 VanDerWaalsContact NH1-CD 3.28Å; R381-E387 IonicContact NH1-OE1 2.69Å; R381-E387 PolarHBondContact NH1-OE1 2.98Å; R381-E387 IonicContact NH1-OE2 2.8Å; R381-E387 PolarHBondContact NH1-OE2 2.89Å; R381-E387 IonicContact NH2-OE1 3.5Å; R381-E387 PolarHBondContact NH2-OE1 3.46Å; R381-E387 IonicContact NH2-OE2 2.69Å; R381-F395 CarbonylContact O-C 3.46Å; R381-F395 VanDerWaalsContact O-CA 3.3Å; R381-F395 WeakPolarHBondContact O-CA 3.29Å; R381-F395 VanDerWaalsContact O-CB 3.29Å; R381-F395 WeakPolarHBondContact O-CB 3.32Å; R381-V396 HydrophobicContact CG-CB 4.39Å; R381-V396 PolarHBondContact N-O 2.99Å; R381-V396 VanDerWaalsContact N-O 3.11Å; R381-V396 PolarHBondContact O-N 2.87Å
382	R	93.7	Very high	86.2	Confident	107 Å²	107	70.1 Å²	70.1	40%	0.404	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	148.7	163.8	-66.7	-169.8	165.2	76.6	-9.8	109.9	D411 V414 S415	R382-D411 IonicContact CZ-OD1 3.49Å; R382-D411 IonicContact CZ-OD2 3.15Å; R382-D411 IonicContact NE-OD1 3.23Å; R382-D411 PolarHBondContact NE-OD1 3.01Å; R382-D411 IonicContact NH2-OD1 2.7Å; R382-D411 PolarHBondContact NH2-OD1 3.01Å; R382-D411 IonicContact NH2-OD2 3.53Å; R382-D411 PolarHBondContact NH2-OD2 3.41Å; R382-V414 HydrophobicContact CG-CG1 3.7Å; R382-S415 PolarHBondContact NH2-OG 3.45Å
383	C	91	Very high	86.2	Confident	22 Å²	22	72.2 Å²	72.2	15%	0.149	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-64.4	145.8	166.7	-64.9	0	0	0	0	110.1	E387 M388 T394 F395 V396	C383-E387 HydrophobicContact CB-CB 4.47Å; C383-M388 HydrophobicContact CB-CB 4.06Å; C383-M388 HydrophobicContact CB-CG 4.15Å; C383-T394 VanDerWaalsContact CB-OG1 3.26Å; C383-T394 WeakPolarHBondContact CB-OG1 3.48Å; C383-T394 PolarHBondContact N-O 2.97Å; C383-T394 VanDerWaalsContact N-O 3.1Å; C383-T394 PolarHBondContact SG-OG1 2.9Å; C383-F395 VanDerWaalsContact SG-C 3.56Å; C383-V396 HydrophobicContact CB-CG2 4.36Å; C383-V396 WeakPolarHBondContact SG-CG2 3.4Å
384	T	87.3	Confident	86.4	Confident	67 Å²	67	69.2 Å²	69.2	41%	0.411	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-81	160	165.7	65.6	0	0	0	0	109.6	L386 E387 M388	T384-L386 PolarHBondContact O-N 2.83Å; T384-L386 VanDerWaalsContact O-N 3.08Å; T384-L386 PolarHBondContact OG1-N 2.64Å; T384-E387 WeakPolarHBondContact CB-OE2 3.37Å; T384-E387 WeakPolarHBondContact CG2-OE2 3.44Å; T384-E387 PolarHBondContact N-OE2 3.4Å; T384-E387 PolarHBondContact O-N 2.68Å; T384-E387 PolarHBondContact OG1-N 3.18Å; T384-E387 PolarHBondContact OG1-OE2 2.91Å; T384-M388 PolarHBondContact O-N 3.44Å
385	R	80.3	Confident	86.8	Confident	185 Å²	185	69.2 Å²	69.2	70%	0.698	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-6.5	174.3	-64.6	-169.9	68.6	-159.2	-2.1	114.2	P389 L392	R385-P389 VanDerWaalsContact O-CA 3.28Å; R385-P389 WeakPolarHBondContact O-CA 3.24Å; R385-P389 WeakPolarHBondContact O-CB 3.43Å; R385-L392 HydrophobicContact CG-CD2 4.19Å
386	L	78.3	Confident	87.2	Confident	165 Å²	165	66.7 Å²	66.7	86%	0.864	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-27.8	171.7	-64.1	175.6	0	0	0	112.1	T384	T384-L386 PolarHBondContact O-N 2.83Å; T384-L386 VanDerWaalsContact O-N 3.08Å; T384-L386 PolarHBondContact OG1-N 2.64Å
387	E	82.8	Confident	87.5	Confident	65 Å²	65	64.1 Å²	64.1	30%	0.304	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-39.6	177	-65	155.1	125.7	0	0	111.5	R381 C383 T384 I405	R381-E387 IonicContact CZ-OE1 3.29Å; R381-E387 VanDerWaalsContact CZ-OE1 3.3Å; R381-E387 IonicContact CZ-OE2 3.16Å; R381-E387 VanDerWaalsContact NH1-CD 3.28Å; R381-E387 IonicContact NH1-OE1 2.69Å; R381-E387 PolarHBondContact NH1-OE1 2.98Å; R381-E387 IonicContact NH1-OE2 2.8Å; R381-E387 PolarHBondContact NH1-OE2 2.89Å; R381-E387 IonicContact NH2-OE1 3.5Å; R381-E387 PolarHBondContact NH2-OE1 3.46Å; R381-E387 IonicContact NH2-OE2 2.69Å; C383-E387 HydrophobicContact CB-CB 4.47Å; T384-E387 WeakPolarHBondContact CB-OE2 3.37Å; T384-E387 WeakPolarHBondContact CG2-OE2 3.44Å; T384-E387 PolarHBondContact N-OE2 3.4Å; T384-E387 PolarHBondContact O-N 2.68Å; T384-E387 PolarHBondContact OG1-N 3.18Å; T384-E387 PolarHBondContact OG1-OE2 2.91Å; E387-I405 HydrophobicContact CB-CD1 4.49Å
388	M	84.8	Confident	87.6	Confident	14 Å²	14	67.1 Å²	67.1	7%	0.069	33%	0.327	C	S	.	.			trans	-138.1	89.1	175.3	-70.2	-55.7	-41.4	0	0	109.9	W330 C383 T384 D390 N391 T394 I405	W330-M388 HydrophobicContact CH2-CE 4.43Å; W330-M388 HydrophobicContact CH2-SD 4.2Å; W330-M388 HydrophobicContact CZ2-CE 3.73Å; W330-M388 HydrophobicContact CZ2-SD 3.95Å; C383-M388 HydrophobicContact CB-CB 4.06Å; C383-M388 HydrophobicContact CB-CG 4.15Å; T384-M388 PolarHBondContact O-N 3.44Å; M388-D390 PolarHBondContact O-N 3.23Å; M388-N391 HydrophobicContact CE-CB 4.09Å; M388-T394 HydrophobicContact CG-CG2 4.24Å; M388-I405 HydrophobicContact CG-CD1 4.31Å; M388-I405 HydrophobicContact CG-CG2 4.02Å; M388-I405 HydrophobicContact SD-CD1 4.4Å; M388-I405 HydrophobicContact SD-CG2 4.37Å
389	P	71.6	Confident	87.6	Confident	62 Å²	62	62.2 Å²	62.2	40%	0.403	30%	0.304	S	S	.	.	S	Bend	trans	-66.3	-36.6	-178.2	23.3	-32.2	0	0	0	113.4	R385	R385-P389 VanDerWaalsContact O-CA 3.28Å; R385-P389 WeakPolarHBondContact O-CA 3.24Å; R385-P389 WeakPolarHBondContact O-CB 3.43Å
390	D	76.8	Confident	87	Confident	138 Å²	138	63.8 Å²	63.8	74%	0.738	32%	0.315	S	S	*	.	S	Bend	trans	-97.7	-15.3	-168.2	-50.1	-49.2	0	0	0	114.2	M388	M388-D390 PolarHBondContact O-N 3.23Å
391	N	79.9	Confident	86	Confident	61 Å²	61	72.9 Å²	72.9	33%	0.326	35%	0.348	S	S	.	.			trans	-127.2	88.9	-172.3	-75	-70.8	0	0	0	111.6	M388 N393 T394	M388-N391 HydrophobicContact CE-CB 4.09Å; N391-N393 VanDerWaalsContact C-N 3.26Å; N391-N393 PolarHBondContact O-N 3.41Å; N391-T394 HydrophobicContact CB-CG2 3.84Å; N391-T394 VanDerWaalsContact O-CG2 3.32Å; N391-T394 WeakPolarHBondContact O-CG2 2.82Å; N391-T394 PolarHBondContact O-OG1 3.39Å
392	L	80.2	Confident	85.5	Confident	121 Å²	121	70.9 Å²	70.9	63%	0.634	35%	0.349	S	S	*	.	S	Bend	trans	-68	-21.8	-179.9	-59.6	178.3	0	0	0	113.8	R385 T394	R385-L392 HydrophobicContact CG-CD2 4.19Å; L392-T394 PolarHBondContact O-N 3.22Å
393	N	91.9	Very high	85.3	Confident	59 Å²	59	67.5 Å²	67.5	32%	0.316	34%	0.342	S	S	.	.	S	Bend	trans	-80	36.6	-179.8	-61.4	-26.7	0	0	0	113.1	N391 T408 D409 D411 V414	N391-N393 VanDerWaalsContact C-N 3.26Å; N391-N393 PolarHBondContact O-N 3.41Å; N393-T408 WeakPolarHBondContact CB-O 3.44Å; N393-T408 PolarHBondContact O-N 3.05Å; N393-T408 PolarHBondContact O-OG1 2.83Å; N393-D409 PolarHBondContact ND2-O 3.44Å; N393-D411 PolarHBondContact OD1-N 3.35Å; N393-V414 HydrophobicContact CB-CG2 4.29Å; N393-V414 WeakPolarHBondContact O-CG2 3.28Å
394	T	94	Very high	85.4	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.3	-172.3	54.6	0	0	0	0	113.5	W330 C383 M388 N391 L392 F406 E407	W330-T394 HydrophobicContact CH2-CG2 4.25Å; C383-T394 VanDerWaalsContact CB-OG1 3.26Å; C383-T394 WeakPolarHBondContact CB-OG1 3.48Å; C383-T394 PolarHBondContact N-O 2.97Å; C383-T394 VanDerWaalsContact N-O 3.1Å; C383-T394 PolarHBondContact SG-OG1 2.9Å; M388-T394 HydrophobicContact CG-CG2 4.24Å; N391-T394 HydrophobicContact CB-CG2 3.84Å; N391-T394 VanDerWaalsContact O-CG2 3.32Å; N391-T394 WeakPolarHBondContact O-CG2 2.82Å; N391-T394 PolarHBondContact O-OG1 3.39Å; L392-T394 PolarHBondContact O-N 3.22Å; T394-F406 CarbonylContact C-O 3.58Å; T394-F406 WeakPolarHBondContact CA-O 3.33Å; T394-F406 WeakPolarHBondContact CB-O 3.23Å; T394-E407 HydrophobicContact CG2-CB 4.14Å; T394-E407 HydrophobicContact CG2-CG 4.24Å
395	F	95.7	Very high	85.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.5	174.5	69.1	-93.6	0	0	0	113.4	L314 L335 R381 C383 I405 F406 T408 V414 W417 T418 L421	L314-F395 HydrophobicContact CD1-CE1 4.18Å; L314-F395 HydrophobicContact CD1-CZ 4.09Å; L335-F395 HydrophobicContact CD2-CZ 4.41Å; R381-F395 CarbonylContact O-C 3.46Å; R381-F395 VanDerWaalsContact O-CA 3.3Å; R381-F395 WeakPolarHBondContact O-CA 3.29Å; R381-F395 VanDerWaalsContact O-CB 3.29Å; R381-F395 WeakPolarHBondContact O-CB 3.32Å; C383-F395 VanDerWaalsContact SG-C 3.56Å; F395-I405 CarbonylContact O-C 3.5Å; F395-I405 WeakPolarHBondContact O-CA 3.21Å; F395-F406 HydrophobicContact CD1-CB 3.93Å; F395-F406 HydrophobicContact CD2-CB 4.22Å; F395-F406 HydrophobicContact CD2-CD2 4.08Å; F395-F406 HydrophobicContact CE1-CB 3.54Å; F395-F406 HydrophobicContact CE1-CG 4.24Å; F395-F406 HydrophobicContact CE2-CB 3.85Å; F395-F406 AromaticContact CE2-CD2 3.5Å; F395-F406 HydrophobicContact CE2-CD2 3.5Å; F395-F406 VanDerWaalsContact CE2-CD2 3.5Å; F395-F406 HydrophobicContact CE2-CE2 4.27Å; F395-F406 AromaticContact CE2-CG 3.83Å; F395-F406 HydrophobicContact CE2-CG 3.83Å; F395-F406 HydrophobicContact CG-CB 4.25Å; F395-F406 HydrophobicContact CZ-CB 3.49Å; F395-F406 VanDerWaalsContact CZ-CB 3.49Å; F395-F406 HydrophobicContact CZ-CD1 4.41Å; F395-F406 AromaticContact CZ-CD2 3.86Å; F395-F406 HydrophobicContact CZ-CD2 3.86Å; F395-F406 AromaticContact CZ-CG 3.67Å; F395-F406 HydrophobicContact CZ-CG 3.67Å; F395-F406 PolarHBondContact N-O 3.45Å; F395-F406 PolarHBondContact O-N 2.95Å; F395-T408 HydrophobicContact CD1-CG2 3.92Å; F395-T408 HydrophobicContact CE1-CG2 3.69Å; F395-V414 HydrophobicContact CB-CG1 4.25Å; F395-W417 HydrophobicContact CD1-CB 4.29Å; F395-W417 HydrophobicContact CE1-CB 3.57Å; F395-W417 AromaticContact CE1-CG 3.98Å; F395-W417 HydrophobicContact CE1-CG 3.98Å; F395-W417 HydrophobicContact CZ-CB 3.72Å; F395-W417 HydrophobicContact CZ-CG 4.12Å; F395-T418 HydrophobicContact CB-CG2 3.57Å; F395-T418 HydrophobicContact CD1-CG2 4.5Å; F395-T418 HydrophobicContact CD2-CG2 4.22Å; F395-T418 HydrophobicContact CG-CG2 3.89Å; F395-L421 HydrophobicContact CE2-CD1 4.02Å
396	V	94.6	Very high	86.4	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.03	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.8	171.6	-169.4	0	0	0	0	109.5	V380 R381 C383 L404 I405	V380-V396 WeakPolarHBondContact CA-O 3.15Å; R381-V396 HydrophobicContact CG-CB 4.39Å; R381-V396 PolarHBondContact N-O 2.99Å; R381-V396 VanDerWaalsContact N-O 3.11Å; R381-V396 PolarHBondContact O-N 2.87Å; C383-V396 HydrophobicContact CB-CG2 4.36Å; C383-V396 WeakPolarHBondContact SG-CG2 3.4Å; V396-L404 WeakPolarHBondContact CA-O 3.29Å; V396-I405 HydrophobicContact CG2-CG1 4.35Å
397	L	94.4	Very high	87.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	116.6	166.3	172.8	72	0	0	0	107.9	L357 I377 V380 V399 L404 F406 L421	L357-L397 HydrophobicContact CD2-CD1 4.43Å; L357-L397 HydrophobicContact CD2-CD2 3.48Å; L357-L397 VanDerWaalsContact CD2-CD2 3.48Å; I377-L397 HydrophobicContact CB-CD1 4.44Å; I377-L397 HydrophobicContact CD1-CD1 4.05Å; I377-L397 HydrophobicContact CG1-CD1 4.15Å; I377-L397 HydrophobicContact CG2-CD1 3.45Å; I377-L397 VanDerWaalsContact CG2-CD1 3.45Å; V380-L397 HydrophobicContact CG2-CD1 3.94Å; L397-V399 HydrophobicContact CD1-CG1 4.36Å; L397-V399 HydrophobicContact CD2-CG1 4.28Å; L397-V399 HydrophobicContact CG-CG1 4.1Å; L397-L404 HydrophobicContact CB-CB 4.42Å; L397-L404 HydrophobicContact CD2-CD1 4.18Å; L397-L404 PolarHBondContact N-O 2.94Å; L397-L404 PolarHBondContact O-N 3.43Å; L397-F406 HydrophobicContact CB-CD2 4.22Å; L397-F406 HydrophobicContact CB-CE2 3.83Å; L397-F406 HydrophobicContact CD2-CE2 3.73Å; L397-F406 HydrophobicContact CD2-CZ 4.21Å; L397-F406 HydrophobicContact CG-CE2 4.43Å; L397-L421 HydrophobicContact CD1-CD1 4.49Å
398	K	91.7	Very high	87.7	Confident	77 Å²	77	46.1 Å²	46.1	34%	0.335	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.5	174.6	-165.6	178.5	-177.3	-178	0	110.2	Q378 E379	Q378-K398 HydrophobicContact CB-CB 4.33Å; Q378-K398 HydrophobicContact CB-CD 4.37Å; Q378-K398 HydrophobicContact CB-CG 4.29Å; Q378-K398 PolarHBondContact N-O 3.34Å; E379-K398 HydrophobicContact CB-CB 3.67Å; E379-K398 HydrophobicContact CB-CD 4.47Å; E379-K398 PolarHBondContact N-O 2.82Å; E379-K398 PolarHBondContact O-N 3.3Å
399	V	89.8	Confident	87.9	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.03	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	165	178.5	-68.6	0	0	0	0	109.8	L370 T372 I377 L397 R401 G402 L404	L370-V399 HydrophobicContact CD2-CG2 4.13Å; T372-V399 HydrophobicContact CG2-CG1 4.03Å; I377-V399 HydrophobicContact CG1-CG1 4.11Å; L397-V399 HydrophobicContact CD1-CG1 4.36Å; L397-V399 HydrophobicContact CD2-CG1 4.28Å; L397-V399 HydrophobicContact CG-CG1 4.1Å; V399-R401 HydrophobicContact CG2-CB 4.27Å; V399-R401 PolarHBondContact O-N 3.38Å; V399-G402 VanDerWaalsContact CG2-O 3.29Å; V399-G402 WeakPolarHBondContact CG2-O 3.45Å; V399-G402 PolarHBondContact N-O 3.46Å; V399-G402 PolarHBondContact O-N 2.82Å; V399-G402 VanDerWaalsContact O-O 3.11Å; V399-L404 HydrophobicContact CG2-CD1 4.42Å
400	N	78.3	Confident	88.8	Confident	104 Å²	104	52 Å²	52	56%	0.556	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-10.1	175.8	-66.4	-23	0	0	0	114.7	Q378	Q378-N400 PolarHBondContact NE2-OD1 2.68Å
401	R	74.1	Confident	89.5	Confident	201 Å²	201	48.6 Å²	48.6	76%	0.758	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	5.3	177.3	-75.7	-178.4	158.2	-128	-4.5	114.9	L370 V399	L370-R401 HydrophobicContact CD1-CB 4.28Å; V399-R401 HydrophobicContact CG2-CB 4.27Å; V399-R401 PolarHBondContact O-N 3.38Å
402	G	84.1	Confident	90.1	Very high	29 Å²	29	53.2 Å²	53.2	30%	0.299	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.2	-177.6	177.8	0	0	0	0	0	114.3	V399	V399-G402 VanDerWaalsContact CG2-O 3.29Å; V399-G402 WeakPolarHBondContact CG2-O 3.45Å; V399-G402 PolarHBondContact N-O 3.46Å; V399-G402 PolarHBondContact O-N 2.82Å; V399-G402 VanDerWaalsContact O-O 3.11Å
403	S	90.3	Very high	90.7	Very high	35 Å²	35	50.7 Å²	50.7	25%	0.245	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.3	177.1	-67.5	0	0	0	0	110.5	V319	V319-S403 PolarHBondContact N-O 3.11Å
404	L	92	Very high	90.8	Very high	9 Å²	9	47.9 Å²	47.9	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129	178.4	-68.5	158.6	0	0	0	109.1	Y316 L318 L359 L370 V396 L397 V399 F406	Y316-L404 HydrophobicContact CD2-CD2 3.6Å; Y316-L404 HydrophobicContact CE2-CD2 3.76Å; L318-L404 HydrophobicContact CB-CD2 4.38Å; L318-L404 HydrophobicContact CD1-CD2 3.7Å; L318-L404 HydrophobicContact CD1-CG 4.31Å; L359-L404 HydrophobicContact CD1-CD1 4.33Å; L370-L404 HydrophobicContact CD2-CD1 3.59Å; V396-L404 WeakPolarHBondContact CA-O 3.29Å; L397-L404 HydrophobicContact CB-CB 4.42Å; L397-L404 HydrophobicContact CD2-CD1 4.18Å; L397-L404 PolarHBondContact N-O 2.94Å; L397-L404 PolarHBondContact O-N 3.43Å; V399-L404 HydrophobicContact CG2-CD1 4.42Å; L404-F406 HydrophobicContact CB-CD2 4.36Å; L404-F406 HydrophobicContact CB-CE2 3.65Å; L404-F406 HydrophobicContact CB-CZ 4.25Å; L404-F406 HydrophobicContact CD1-CE2 4.41Å; L404-F406 HydrophobicContact CD1-CZ 4.41Å
405	I	93.5	Very high	90.7	Very high	9 Å²	9	49.6 Å²	49.6	5%	0.046	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.9	168.8	-66.1	173.6	0	0	0	108	Y316 L317 V319 W330 E387 M388 F395 V396	Y316-I405 CarbonylContact C-O 3.53Å; Y316-I405 WeakPolarHBondContact CA-O 3.38Å; Y316-I405 WeakPolarHBondContact CB-O 3.13Å; L317-I405 HydrophobicContact CB-CB 4.45Å; L317-I405 PolarHBondContact N-O 3.49Å; L317-I405 PolarHBondContact O-N 2.75Å; V319-I405 HydrophobicContact CG2-CD1 3.62Å; V319-I405 HydrophobicContact CG2-CG1 3.72Å; W330-I405 HydrophobicContact CH2-CG2 3.75Å; W330-I405 HydrophobicContact CZ3-CG2 4.18Å; E387-I405 HydrophobicContact CB-CD1 4.49Å; M388-I405 HydrophobicContact CG-CD1 4.31Å; M388-I405 HydrophobicContact CG-CG2 4.02Å; M388-I405 HydrophobicContact SD-CD1 4.4Å; M388-I405 HydrophobicContact SD-CG2 4.37Å; F395-I405 CarbonylContact O-C 3.5Å; F395-I405 WeakPolarHBondContact O-CA 3.21Å; V396-I405 HydrophobicContact CG2-CG1 4.35Å
406	F	94.8	Very high	90.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.8	174.3	-67.9	-94	0	0	0	110.6	L314 K315 Y316 L335 L359 T394 F395 L397 L404	L314-F406 HydrophobicContact CB-CD1 4.16Å; L314-F406 HydrophobicContact CD1-CB 4.31Å; L314-F406 HydrophobicContact CD1-CD1 3.8Å; L314-F406 HydrophobicContact CD1-CG 4.33Å; K315-F406 WeakPolarHBondContact O-CA 3.35Å; Y316-F406 HydrophobicContact CG-CE1 4.38Å; L335-F406 HydrophobicContact CD1-CE1 3.98Å; L335-F406 HydrophobicContact CD1-CZ 3.95Å; L335-F406 HydrophobicContact CD2-CD1 4.28Å; L335-F406 HydrophobicContact CD2-CE1 3.89Å; L335-F406 HydrophobicContact CD2-CZ 4.1Å; L335-F406 HydrophobicContact CG-CE1 4.4Å; L359-F406 HydrophobicContact CD1-CE1 4.06Å; L359-F406 HydrophobicContact CD1-CZ 3.83Å; T394-F406 CarbonylContact C-O 3.58Å; T394-F406 WeakPolarHBondContact CA-O 3.33Å; T394-F406 WeakPolarHBondContact CB-O 3.23Å; F395-F406 HydrophobicContact CD1-CB 3.93Å; F395-F406 HydrophobicContact CD2-CB 4.22Å; F395-F406 HydrophobicContact CD2-CD2 4.08Å; F395-F406 HydrophobicContact CE1-CB 3.54Å; F395-F406 HydrophobicContact CE1-CG 4.24Å; F395-F406 HydrophobicContact CE2-CB 3.85Å; F395-F406 AromaticContact CE2-CD2 3.5Å; F395-F406 HydrophobicContact CE2-CD2 3.5Å; F395-F406 VanDerWaalsContact CE2-CD2 3.5Å; F395-F406 HydrophobicContact CE2-CE2 4.27Å; F395-F406 AromaticContact CE2-CG 3.83Å; F395-F406 HydrophobicContact CE2-CG 3.83Å; F395-F406 HydrophobicContact CG-CB 4.25Å; F395-F406 HydrophobicContact CZ-CB 3.49Å; F395-F406 VanDerWaalsContact CZ-CB 3.49Å; F395-F406 HydrophobicContact CZ-CD1 4.41Å; F395-F406 AromaticContact CZ-CD2 3.86Å; F395-F406 HydrophobicContact CZ-CD2 3.86Å; F395-F406 AromaticContact CZ-CG 3.67Å; F395-F406 HydrophobicContact CZ-CG 3.67Å; F395-F406 PolarHBondContact N-O 3.45Å; F395-F406 PolarHBondContact O-N 2.95Å; L397-F406 HydrophobicContact CB-CD2 4.22Å; L397-F406 HydrophobicContact CB-CE2 3.83Å; L397-F406 HydrophobicContact CD2-CE2 3.73Å; L397-F406 HydrophobicContact CD2-CZ 4.21Å; L397-F406 HydrophobicContact CG-CE2 4.43Å; L404-F406 HydrophobicContact CB-CD2 4.36Å; L404-F406 HydrophobicContact CB-CE2 3.65Å; L404-F406 HydrophobicContact CB-CZ 4.25Å; L404-F406 HydrophobicContact CD1-CE2 4.41Å; L404-F406 HydrophobicContact CD1-CZ 4.41Å
407	E	94.4	Very high	90.7	Very high	32 Å²	32	51.9 Å²	51.9	15%	0.15	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	138	170.8	-172.6	-156.8	141.8	0	0	109.5	K315 W330 T394	K315-E407 HydrophobicContact CB-CB 4.07Å; K315-E407 VanDerWaalsContact CE-CD 3.47Å; K315-E407 WeakPolarHBondContact CE-OE1 3.48Å; K315-E407 WeakPolarHBondContact CE-OE2 3.11Å; K315-E407 PolarHBondContact N-O 3.33Å; K315-E407 IonicContact NZ-OE1 3.09Å; K315-E407 PolarHBondContact NZ-OE1 3.18Å; K315-E407 IonicContact NZ-OE2 3.36Å; K315-E407 PolarHBondContact NZ-OE2 3.44Å; K315-E407 PolarHBondContact O-N 3.31Å; W330-E407 HydrophobicContact CE3-CB 4.11Å; W330-E407 HydrophobicContact CH2-CB 3.97Å; W330-E407 HydrophobicContact CZ3-CB 3.7Å; T394-E407 HydrophobicContact CG2-CB 4.14Å; T394-E407 HydrophobicContact CG2-CG 4.24Å
408	T	93.9	Very high	90.7	Very high	5 Å²	5	52.2 Å²	52.2	3%	0.031	27%	0.269	C	S	.	.			trans	-129.3	160.7	179.8	72.4	0	0	0	0	110.4	L314 N393 F395 N410 Q413 V414	L314-T408 HydrophobicContact CD2-CG2 3.94Å; N393-T408 WeakPolarHBondContact CB-O 3.44Å; N393-T408 PolarHBondContact O-N 3.05Å; N393-T408 PolarHBondContact O-OG1 2.83Å; F395-T408 HydrophobicContact CD1-CG2 3.92Å; F395-T408 HydrophobicContact CE1-CG2 3.69Å; T408-N410 VanDerWaalsContact C-N 3.3Å; T408-N410 PolarHBondContact O-N 3.14Å; T408-N410 PolarHBondContact OG1-O 3.11Å; T408-Q413 HydrophobicContact CG2-CB 4.24Å; T408-V414 HydrophobicContact CG2-CG2 4.33Å; T408-V414 WeakPolarHBondContact OG1-CG2 3.4Å
409	D	89.3	Confident	90.6	Very high	134 Å²	134	52.6 Å²	52.6	72%	0.717	28%	0.278	S	S	*	.	S	Bend	trans	-69.5	-23.9	-175.9	-48.4	-66.3	0	0	0	113.7	N393	N393-D409 PolarHBondContact ND2-O 3.44Å
410	N	92.1	Very high	90.7	Very high	65 Å²	65	54.7 Å²	54.7	35%	0.348	29%	0.287	S	S	.	.	S	Bend	trans	-161	163.1	-179.7	61.4	52.7	0	0	0	113.4	T408 Q412 Q413 V414	T408-N410 VanDerWaalsContact C-N 3.3Å; T408-N410 PolarHBondContact O-N 3.14Å; T408-N410 PolarHBondContact OG1-O 3.11Å; N410-Q412 PolarHBondContact O-N 3Å; N410-Q412 WeakPolarHBondContact OD1-CA 3.43Å; N410-Q412 WeakPolarHBondContact OD1-CB 3.46Å; N410-Q412 PolarHBondContact OD1-N 3.49Å; N410-Q412 VanDerWaalsContact OD1-N 3.1Å; N410-Q413 WeakPolarHBondContact O-CA 3.22Å; N410-Q413 WeakPolarHBondContact O-CB 3.32Å; N410-Q413 PolarHBondContact O-N 3.3Å; N410-Q413 PolarHBondContact OD1-N 3.19Å; N410-V414 PolarHBondContact O-N 2.85Å; N410-V414 VanDerWaalsContact O-N 3.12Å
411	D	90.9	Very high	91.4	Very high	67 Å²	67	49.8 Å²	49.8	36%	0.358	26%	0.261	S	S	.	.	H	α-helix	trans	-63.1	-20.5	178.8	-175	75.5	0	0	0	114.5	R382 N393 V414 S415	R382-D411 IonicContact CZ-OD1 3.49Å; R382-D411 IonicContact CZ-OD2 3.15Å; R382-D411 IonicContact NE-OD1 3.23Å; R382-D411 PolarHBondContact NE-OD1 3.01Å; R382-D411 IonicContact NH2-OD1 2.7Å; R382-D411 PolarHBondContact NH2-OD1 3.01Å; R382-D411 IonicContact NH2-OD2 3.53Å; R382-D411 PolarHBondContact NH2-OD2 3.41Å; N393-D411 PolarHBondContact OD1-N 3.35Å; D411-V414 PolarHBondContact O-N 2.87Å; D411-S415 VanDerWaalsContact O-CB 3.3Å; D411-S415 WeakPolarHBondContact O-CB 3.49Å; D411-S415 PolarHBondContact O-N 2.85Å; D411-S415 PolarHBondContact O-OG 2.79Å; D411-S415 PolarHBondContact OD2-OG 2.81Å
412	Q	92.1	Very high	92.1	Very high	158 Å²	158	44.7 Å²	44.7	74%	0.738	24%	0.244	S	C	*	.	H	α-helix	trans	-68.8	-36.8	171.2	-58.7	-178.2	-5.7	0	0	111.1	N410 S415 S416	N410-Q412 PolarHBondContact O-N 3Å; N410-Q412 WeakPolarHBondContact OD1-CA 3.43Å; N410-Q412 WeakPolarHBondContact OD1-CB 3.46Å; N410-Q412 PolarHBondContact OD1-N 3.49Å; N410-Q412 VanDerWaalsContact OD1-N 3.1Å; Q412-S415 PolarHBondContact O-N 3.34Å; Q412-S416 WeakPolarHBondContact O-CB 3.45Å; Q412-S416 PolarHBondContact O-N 3.38Å
413	Q	92.7	Very high	92.3	Very high	69 Å²	69	49.1 Å²	49.1	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-67.3	-43.2	170	-72.9	-67.2	-9.7	0	0	111.4	T408 N410 S415 S416 W417	T408-Q413 HydrophobicContact CG2-CB 4.24Å; N410-Q413 WeakPolarHBondContact O-CA 3.22Å; N410-Q413 WeakPolarHBondContact O-CB 3.32Å; N410-Q413 PolarHBondContact O-N 3.3Å; N410-Q413 PolarHBondContact OD1-N 3.19Å; Q413-S415 VanDerWaalsContact C-N 3.34Å; Q413-S415 PolarHBondContact O-N 3.16Å; Q413-S416 PolarHBondContact O-N 2.86Å; Q413-W417 WeakPolarHBondContact O-CB 3.3Å; Q413-W417 PolarHBondContact O-N 3.18Å
414	V	93.8	Very high	92.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.2	-50.6	171.8	-178	0	0	0	0	111.2	R382 N393 F395 T408 N410 D411 S416 W417 T418	R382-V414 HydrophobicContact CG-CG1 3.7Å; N393-V414 HydrophobicContact CB-CG2 4.29Å; N393-V414 WeakPolarHBondContact O-CG2 3.28Å; F395-V414 HydrophobicContact CB-CG1 4.25Å; T408-V414 HydrophobicContact CG2-CG2 4.33Å; T408-V414 WeakPolarHBondContact OG1-CG2 3.4Å; N410-V414 PolarHBondContact O-N 2.85Å; N410-V414 VanDerWaalsContact O-N 3.12Å; D411-V414 PolarHBondContact O-N 2.87Å; V414-S416 PolarHBondContact O-N 2.98Å; V414-W417 PolarHBondContact O-N 3.25Å; V414-T418 HydrophobicContact CG1-CG2 4.37Å; V414-T418 WeakPolarHBondContact O-CB 3.33Å; V414-T418 WeakPolarHBondContact O-CG2 3.25Å; V414-T418 PolarHBondContact O-N 2.83Å; V414-T418 PolarHBondContact O-OG1 2.97Å
415	S	92.4	Very high	91.9	Very high	38 Å²	38	49.2 Å²	49.2	27%	0.266	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-46	177.8	-63.3	0	0	0	0	111.6	R382 D411 Q412 Q413 T418 T419	R382-S415 PolarHBondContact NH2-OG 3.45Å; D411-S415 VanDerWaalsContact O-CB 3.3Å; D411-S415 WeakPolarHBondContact O-CB 3.49Å; D411-S415 PolarHBondContact O-N 2.85Å; D411-S415 PolarHBondContact O-OG 2.79Å; D411-S415 PolarHBondContact OD2-OG 2.81Å; Q412-S415 PolarHBondContact O-N 3.34Å; Q413-S415 VanDerWaalsContact C-N 3.34Å; Q413-S415 PolarHBondContact O-N 3.16Å; S415-T418 PolarHBondContact O-OG1 2.89Å; S415-T419 VanDerWaalsContact O-CB 3.22Å; S415-T419 WeakPolarHBondContact O-CB 3.38Å; S415-T419 PolarHBondContact O-N 3.31Å; S415-T419 PolarHBondContact O-OG1 2.86Å
416	S	94.6	Very high	91.1	Very high	50 Å²	50	52.8 Å²	52.8	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-67.6	-39.8	-179	178.6	0	0	0	0	112.6	K310 Q412 Q413 V414 E420	K310-S416 VanDerWaalsContact NZ-C 3.25Å; K310-S416 PolarHBondContact NZ-O 3.5Å; K310-S416 PolarHBondContact NZ-OG 3.1Å; Q412-S416 WeakPolarHBondContact O-CB 3.45Å; Q412-S416 PolarHBondContact O-N 3.38Å; Q413-S416 PolarHBondContact O-N 2.86Å; V414-S416 PolarHBondContact O-N 2.98Å; S416-E420 VanDerWaalsContact O-CB 3.29Å; S416-E420 WeakPolarHBondContact O-CB 3.42Å; S416-E420 PolarHBondContact O-N 3.33Å; S416-E420 VanDerWaalsContact O-N 3.17Å
417	W	94.9	Very high	89.7	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.011	30%	0.301	C	S	.	.	H	α-helix	trans	-72.3	-45.6	176.1	-80.6	106.4	0	0	0	112.1	K310 L314 L335 V337 F395 Q413 V414 T419 L421	K310-W417 HydrophobicContact CB-CH2 4.42Å; K310-W417 HydrophobicContact CB-CZ3 4.36Å; K310-W417 HydrophobicContact CD-CD2 3.95Å; K310-W417 HydrophobicContact CD-CE3 3.84Å; K310-W417 HydrophobicContact CD-CH2 3.99Å; K310-W417 HydrophobicContact CD-CZ2 4.08Å; K310-W417 HydrophobicContact CD-CZ3 3.87Å; K310-W417 HydrophobicContact CG-CE3 4.47Å; K310-W417 HydrophobicContact CG-CH2 3.78Å; K310-W417 HydrophobicContact CG-CZ2 4.09Å; K310-W417 HydrophobicContact CG-CZ3 3.99Å; K310-W417 VanDerWaalsContact NZ-CD1 3.29Å; K310-W417 VanDerWaalsContact NZ-CG 3.27Å; L314-W417 HydrophobicContact CD1-CD2 4.29Å; L314-W417 HydrophobicContact CD1-CZ2 4.42Å; L335-W417 HydrophobicContact CB-CH2 4.17Å; L335-W417 HydrophobicContact CB-CZ3 4.37Å; L335-W417 HydrophobicContact CD2-CE3 3.92Å; L335-W417 HydrophobicContact CD2-CH2 4.35Å; L335-W417 HydrophobicContact CD2-CZ3 3.8Å; L335-W417 HydrophobicContact CG-CH2 4.39Å; L335-W417 HydrophobicContact CG-CZ3 4.09Å; L335-W417 WeakPolarHBondContact O-CH2 3.38Å; V337-W417 HydrophobicContact CG2-CZ3 4.26Å; F395-W417 HydrophobicContact CD1-CB 4.29Å; F395-W417 HydrophobicContact CE1-CB 3.57Å; F395-W417 AromaticContact CE1-CG 3.98Å; F395-W417 HydrophobicContact CE1-CG 3.98Å; F395-W417 HydrophobicContact CZ-CB 3.72Å; F395-W417 HydrophobicContact CZ-CG 4.12Å; Q413-W417 WeakPolarHBondContact O-CB 3.3Å; Q413-W417 PolarHBondContact O-N 3.18Å; V414-W417 PolarHBondContact O-N 3.25Å; W417-T419 VanDerWaalsContact C-N 3.29Å; W417-T419 PolarHBondContact O-N 2.8Å; W417-L421 WeakPolarHBondContact O-CB 3.32Å; W417-L421 WeakPolarHBondContact O-CD1 3.49Å; W417-L421 VanDerWaalsContact O-CG 3.24Å; W417-L421 WeakPolarHBondContact O-CG 3.44Å; W417-L421 PolarHBondContact O-N 2.89Å; W417-L421 VanDerWaalsContact O-N 3.13Å
418	T	94.4	Very high	87.8	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.043	33%	0.33	C	S	.	.	H	α-helix	trans	-68.4	-26.8	179.7	56.5	0	0	0	0	113.2	V380 F395 V414 S415 K422	V380-T418 HydrophobicContact CG1-CG2 3.9Å; F395-T418 HydrophobicContact CB-CG2 3.57Å; F395-T418 HydrophobicContact CD1-CG2 4.5Å; F395-T418 HydrophobicContact CD2-CG2 4.22Å; F395-T418 HydrophobicContact CG-CG2 3.89Å; V414-T418 HydrophobicContact CG1-CG2 4.37Å; V414-T418 WeakPolarHBondContact O-CB 3.33Å; V414-T418 WeakPolarHBondContact O-CG2 3.25Å; V414-T418 PolarHBondContact O-N 2.83Å; V414-T418 PolarHBondContact O-OG1 2.97Å; S415-T418 PolarHBondContact O-OG1 2.89Å; T418-K422 WeakPolarHBondContact O-CB 3.43Å; T418-K422 VanDerWaalsContact O-CD 3.26Å; T418-K422 WeakPolarHBondContact O-CD 3.37Å; T418-K422 WeakPolarHBondContact O-CG 3.13Å; T418-K422 PolarHBondContact O-N 3.23Å
419	T	90.9	Very high	85.4	Confident	84 Å²	84	69.8 Å²	69.8	52%	0.515	37%	0.367	S	S	.	.	H	α-helix	trans	-77.1	-50.9	174.2	-55.1	0	0	0	0	111.7	S415 W417 L421 K422 E423	S415-T419 VanDerWaalsContact O-CB 3.22Å; S415-T419 WeakPolarHBondContact O-CB 3.38Å; S415-T419 PolarHBondContact O-N 3.31Å; S415-T419 PolarHBondContact O-OG1 2.86Å; W417-T419 VanDerWaalsContact C-N 3.29Å; W417-T419 PolarHBondContact O-N 2.8Å; T419-L421 VanDerWaalsContact C-N 3.32Å; T419-L421 PolarHBondContact O-N 3.12Å; T419-K422 WeakPolarHBondContact O-CA 3.49Å; T419-K422 WeakPolarHBondContact O-CB 3.5Å; T419-K422 PolarHBondContact O-N 3.15Å; T419-E423 PolarHBondContact O-N 3.11Å
420	E	92.1	Very high	83	Confident	50 Å²	50	67 Å²	67	23%	0.234	37%	0.37	C	S	.	.	H	α-helix	trans	-54.4	-47.2	179	-176	81.5	-153.7	0	0	111.9	C309 K310 S416 K422 E423 C424	C309-E420 WeakPolarHBondContact CB-OE1 3.46Å; K310-E420 HydrophobicContact CB-CG 3.71Å; K310-E420 HydrophobicContact CD-CB 4.01Å; K310-E420 HydrophobicContact CD-CG 3.87Å; K310-E420 HydrophobicContact CG-CG 4.41Å; S416-E420 VanDerWaalsContact O-CB 3.29Å; S416-E420 WeakPolarHBondContact O-CB 3.42Å; S416-E420 PolarHBondContact O-N 3.33Å; S416-E420 VanDerWaalsContact O-N 3.17Å; E420-K422 VanDerWaalsContact C-N 3.31Å; E420-K422 PolarHBondContact O-N 2.91Å; E420-E423 PolarHBondContact O-N 2.95Å; E420-C424 PolarHBondContact O-N 2.88Å; E420-C424 PolarHBondContact O-SG 2.9Å
421	L	91.6	Very high	80	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-38.3	178.2	-68.2	168.8	0	0	0	111.3	V337 L357 I377 V380 F395 L397 W417 T419 C424 I425	V337-L421 HydrophobicContact CG2-CD2 3.72Å; L357-L421 HydrophobicContact CD1-CD2 3.79Å; L357-L421 HydrophobicContact CD2-CD2 4.41Å; I377-L421 HydrophobicContact CD1-CD2 4.43Å; V380-L421 HydrophobicContact CG1-CB 4.17Å; V380-L421 HydrophobicContact CG1-CD1 4.28Å; V380-L421 HydrophobicContact CG2-CB 4.1Å; F395-L421 HydrophobicContact CE2-CD1 4.02Å; L397-L421 HydrophobicContact CD1-CD1 4.49Å; W417-L421 WeakPolarHBondContact O-CB 3.32Å; W417-L421 WeakPolarHBondContact O-CD1 3.49Å; W417-L421 VanDerWaalsContact O-CG 3.24Å; W417-L421 WeakPolarHBondContact O-CG 3.44Å; W417-L421 PolarHBondContact O-N 2.89Å; W417-L421 VanDerWaalsContact O-N 3.13Å; T419-L421 VanDerWaalsContact C-N 3.32Å; T419-L421 PolarHBondContact O-N 3.12Å; L421-C424 PolarHBondContact O-N 3.49Å; L421-I425 VanDerWaalsContact O-CD1 3.27Å; L421-I425 WeakPolarHBondContact O-CD1 3.38Å; L421-I425 WeakPolarHBondContact O-CG1 3.3Å; L421-I425 PolarHBondContact O-N 2.69Å
422	K	89.4	Confident	77.6	Confident	95 Å²	95	71.5 Å²	71.5	41%	0.413	41%	0.405	S	S	.	.	H	α-helix	trans	-69.3	-35.9	176.5	-76.9	174.1	-172.9	-175.7	0	113.2	V380 T418 T419 E420 I425 S426	V380-K422 HydrophobicContact CB-CG 4.24Å; V380-K422 HydrophobicContact CG1-CG 4.46Å; V380-K422 WeakPolarHBondContact O-CE 3.37Å; V380-K422 PolarHBondContact O-NZ 3.28Å; T418-K422 WeakPolarHBondContact O-CB 3.43Å; T418-K422 VanDerWaalsContact O-CD 3.26Å; T418-K422 WeakPolarHBondContact O-CD 3.37Å; T418-K422 WeakPolarHBondContact O-CG 3.13Å; T418-K422 PolarHBondContact O-N 3.23Å; T419-K422 WeakPolarHBondContact O-CA 3.49Å; T419-K422 WeakPolarHBondContact O-CB 3.5Å; T419-K422 PolarHBondContact O-N 3.15Å; E420-K422 VanDerWaalsContact C-N 3.31Å; E420-K422 PolarHBondContact O-N 2.91Å; K422-I425 PolarHBondContact O-N 2.84Å; K422-S426 VanDerWaalsContact O-CB 3.26Å; K422-S426 WeakPolarHBondContact O-CB 3.14Å; K422-S426 PolarHBondContact O-N 2.81Å; K422-S426 PolarHBondContact O-OG 2.89Å
423	E	88	Confident	74.7	Confident	121 Å²	121	71 Å²	71	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-65.2	-45.5	174.1	-167.7	168.5	166.2	0	0	110.3	T419 E420 I425 S426 N427	T419-E423 PolarHBondContact O-N 3.11Å; E420-E423 PolarHBondContact O-N 2.95Å; E423-I425 VanDerWaalsContact C-N 3.29Å; E423-I425 PolarHBondContact O-N 2.78Å; E423-S426 PolarHBondContact O-N 2.85Å; E423-N427 PolarHBondContact O-N 2.96Å; E423-N427 VanDerWaalsContact O-N 3.11Å
424	C	86.8	Confident	71.8	Confident	6 Å²	6	74.4 Å²	74.4	4%	0.041	43%	0.427	C	S	.	.	H	α-helix	trans	-64.7	-27.1	175.8	-64.2	0	0	0	0	114.2	V337 Y355 C374 E420 L421	V337-C424 HydrophobicContact CG1-CB 4.38Å; Y355-C424 HydrophobicContact CD1-CB 4Å; Y355-C424 WeakPolarHBondContact CD1-SG 3.27Å; Y355-C424 HydrophobicContact CG-CB 3.93Å; C374-C424 HydrophobicContact CB-CB 4.02Å; E420-C424 PolarHBondContact O-N 2.88Å; E420-C424 PolarHBondContact O-SG 2.9Å; L421-C424 PolarHBondContact O-N 3.49Å
425	I	86.8	Confident	68.5	Low	41 Å²	41	82.2 Å²	82.2	21%	0.21	46%	0.464	C	S	.	.	H	α-helix	trans	-75.7	-39.3	168.7	-66.6	157.6	0	0	0	110.8	C374 I377 V380 L421 K422 E423 N427 R428	C374-I425 WeakPolarHBondContact O-CG1 3.29Å; I377-I425 HydrophobicContact CB-CD1 3.79Å; I377-I425 HydrophobicContact CB-CG1 4.07Å; I377-I425 HydrophobicContact CD1-CD1 4.13Å; I377-I425 HydrophobicContact CD1-CG1 4.16Å; I377-I425 HydrophobicContact CG2-CD1 3.71Å; V380-I425 HydrophobicContact CG2-CD1 3.64Å; L421-I425 VanDerWaalsContact O-CD1 3.27Å; L421-I425 WeakPolarHBondContact O-CD1 3.38Å; L421-I425 WeakPolarHBondContact O-CG1 3.3Å; L421-I425 PolarHBondContact O-N 2.69Å; K422-I425 PolarHBondContact O-N 2.84Å; E423-I425 VanDerWaalsContact C-N 3.29Å; E423-I425 PolarHBondContact O-N 2.78Å; I425-N427 PolarHBondContact O-N 2.8Å; I425-R428 VanDerWaalsContact O-CB 3.22Å; I425-R428 WeakPolarHBondContact O-CB 3.27Å; I425-R428 PolarHBondContact O-N 2.86Å
426	S	78.1	Confident	65.2	Low	84 Å²	84	85.2 Å²	85.2	59%	0.587	49%	0.485	S	S	*	.	H	α-helix	trans	-74	-24	-171.9	-61.5	0	0	0	0	113.8	K422 E423 R428	K422-S426 VanDerWaalsContact O-CB 3.26Å; K422-S426 WeakPolarHBondContact O-CB 3.14Å; K422-S426 PolarHBondContact O-N 2.81Å; K422-S426 PolarHBondContact O-OG 2.89Å; E423-S426 PolarHBondContact O-N 2.85Å; S426-R428 PolarHBondContact O-N 3.15Å
427	N	65.2	Low	62.2	Low	80 Å²	80	88.2 Å²	88.2	43%	0.428	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-63.7	0.5	172.9	-87.6	16.2	0	0	0	114.8	Y355 E423 I425 S429	Y355-N427 HydrophobicContact CD2-CB 4.44Å; Y355-N427 HydrophobicContact CE2-CB 3.88Å; Y355-N427 PolarHBondContact OH-ND2 2.9Å; Y355-N427 VanDerWaalsContact OH-ND2 3.13Å; E423-N427 PolarHBondContact O-N 2.96Å; E423-N427 VanDerWaalsContact O-N 3.11Å; I425-N427 PolarHBondContact O-N 2.8Å; N427-S429 PolarHBondContact O-N 2.9Å
428	R	53.8	Low	58.9	Low	198 Å²	198	96 Å²	96	75%	0.747	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-55.2	-13.8	173.4	-173.3	175.6	-167.1	-90	3.1	115.7	I425 S426	I425-R428 VanDerWaalsContact O-CB 3.22Å; I425-R428 WeakPolarHBondContact O-CB 3.27Å; I425-R428 PolarHBondContact O-N 2.86Å; S426-R428 PolarHBondContact O-N 3.15Å
429	S	42.5	Very low	55.6	Low	116 Å²	116	100.8 Å²	100.8	81%	0.811	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-135.2	48.7	-171.7	-169.3	0	0	0	0	114	N427	N427-S429 PolarHBondContact O-N 2.9Å
430	G	39.8	Very low	52.5	Low	75 Å²	75	102.6 Å²	102.6	77%	0.773	59%	0.594	S	S	*	*			trans	-117.7	35	-177.3	0	0	0	0	0	116
431	S	28.8	Very low	49.3	Very low	91 Å²	91	104.7 Å²	104.7	64%	0.636	62%	0.62	S	S	*	*	S	Bend	trans	-145.3	162.1	172.4	-161.5	0	0	0	0	110.9
432	V	40.9	Very low	46	Very low	135 Å²	135	111.8 Å²	111.8	82%	0.818	66%	0.658	S	S	*	*			trans	-109.2	150.1	-148.1	-65.2	0	0	0	0	116.9
433	D	30.2	Very low	43.1	Very low	147 Å²	147	112 Å²	112	79%	0.786	67%	0.671	S	S	*	*			trans	97.1	146.9	141.1	-143.3	6.7	0	0	0	120.5
434	L	31.8	Very low	40.2	Very low	141 Å²	141	112.3 Å²	112.3	74%	0.738	69%	0.687	S	S	*	*			trans	67.4	104.8	160.1	-132.9	61.1	0	0	0	121.9
435	E	25.3	Very low	37.5	Very low	165 Å²	165	116.5 Å²	116.5	77%	0.771	72%	0.722	S	S	*	*			trans	72.6	131.6	134.5	-157.1	-172.4	129.2	0	0	122.5
436	S	23.8	Very low	35.5	Very low	100 Å²	100	120.3 Å²	120.3	70%	0.699	75%	0.749	S	S	*	*			trans	69.2	158.6	158	-83.3	0	0	0	0	117.4
437	P	31.9	Very low	33.1	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	75%	0.753	S	S	*	*			cis	-131.5	168.9	24.9	41.9	-26	0	0	0	118
438	L	24.9	Very low	31.4	Very low	168 Å²	168	122.8 Å²	122.8	88%	0.88	77%	0.767	S	S	*	*			trans	-118.8	147	150.2	-90.6	173.3	0	0	0	108.9
439	S	25.8	Very low	30.4	Very low	106 Å²	106	119.1 Å²	119.1	74%	0.741	76%	0.758	S	S	*	*			trans	66.7	155.2	-179.6	-52.5	0	0	0	0	114.2
440	S	24	Very low	29.9	Very low	122 Å²	122	124 Å²	124	85%	0.853	76%	0.759	S	S	*	*			cis	-130.4	170.4	13.3	-62.2	0	0	0	0	112.6
441	A	26.7	Very low	29.3	Very low	95 Å²	95	131.1 Å²	131.1	79%	0.785	76%	0.762	S	S	*	*			trans	-105.6	165.3	178.8	0	0	0	0	0	113.4
442	D	22.6	Very low	29.4	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	77%	0.766	S	S	*	*			trans	97.8	138.3	142.3	-143.9	-2.6	0	0	0	120.9
443	S	26.7	Very low	28.9	Very low	100 Å²	100	129.9 Å²	129.9	70%	0.699	76%	0.76	S	S	*	*			trans	44.9	106.9	153.9	-72.1	0	0	0	0	121.8
444	S	27.5	Very low	28.7	Very low	128 Å²	128	130.8 Å²	130.8	90%	0.895	77%	0.765	S	S	*	*				-165.1	140.1	99.8	53.5	0	0	0	0	113.2
445	A	30.1	Very low	28.4	Very low	93 Å²	93	128.5 Å²	128.5	77%	0.769	76%	0.761	S	S	*	*			trans	-128.6	167.3	164	0	0	0	0	0	107.9
446	P	44.4	Very low	28.5	Very low	121 Å²	121	123.3 Å²	123.3	79%	0.786	75%	0.751	S	S	*	*				-155.5	175.5	95.7	40.4	-23	0	0	0	116.6
447	A	29.3	Very low	28.6	Very low	80 Å²	80	126.5 Å²	126.5	66%	0.661	76%	0.755	S	S	*	*			trans	67.8	142.7	150.1	0	0	0	0	0	118.5
448	N	29.8	Very low	28.5	Very low	136 Å²	136	129.8 Å²	129.8	73%	0.727	76%	0.76	S	S	*	*			cis	-163.5	163.1	1.3	-105.2	-16.4	0	0	0	107.5
449	Q	31.3	Very low	28.7	Very low	121 Å²	121	126.6 Å²	126.6	57%	0.565	75%	0.752	S	S	*	*			cis	-166.4	157.5	7.1	-130.9	174.3	75	0	0	111.5
450	R	32.3	Very low	29.6	Very low	218 Å²	218	127.4 Å²	127.4	82%	0.823	76%	0.755	S	S	*	*			trans	65	151.8	154.8	-67.6	168.8	179.8	-171.9	1.2	117.9
451	R	27.8	Very low	30.1	Very low	225 Å²	225	127 Å²	127	85%	0.849	75%	0.747	S	S	*	*			cis	-150	135.5	-3.8	-141	177.3	-179.9	179.8	-1.2	105.9
452	S	30.8	Very low	30.2	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	75%	0.748	S	S	*	*				48	130.3	73.3	-90.7	0	0	0	0	115.5
453	S	31.1	Very low	30.8	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	75%	0.749	S	S	*	*			cis	-166.8	157.8	-6.3	-73.2	0	0	0	0	110.3
454	D	24.9	Very low	31	Very low	166 Å²	166	131 Å²	131	89%	0.888	76%	0.759	S	S	*	*			trans	64.3	159	154.8	-133	25.8	0	0	0	118
455	S	25.9	Very low	31.8	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	75%	0.749	S	S	*	*			cis	-141.3	-156.8	-5.2	88.3	0	0	0	0	111.2
456	G	27.2	Very low	32.3	Very low	56 Å²	56	130.4 Å²	130.4	58%	0.577	74%	0.736	S	S	*	*			trans	-65.4	172.8	-179.7	0	0	0	0	0	115.3
457	H	26.6	Very low	32.1	Very low	167 Å²	167	128.6 Å²	128.6	77%	0.773	72%	0.717	S	S	*	*			cis	-159.3	154.8	37.6	-86.8	-94.4	0	0	0	115.3
458	Q	29	Very low	33	Very low	181 Å²	181	132.2 Å²	132.2	85%	0.846	72%	0.721	S	S	*	*			trans	71	128.2	147.1	-70.4	171.8	95.7	0	0	121.3
459	S	29.4	Very low	33.9	Very low	102 Å²	102	129.5 Å²	129.5	71%	0.713	71%	0.709	S	S	*	*			trans	-78.9	168.9	162.4	-31.2	0	0	0	0	111.2
460	P	44.9	Very low	35	Very low	123 Å²	123	124.7 Å²	124.7	80%	0.799	69%	0.687	S	S	*	*				-121.4	145.5	59.8	4.8	19.5	0	0	0	113.7
461	V	34.6	Very low	36.1	Very low	113 Å²	113	118.9 Å²	118.9	69%	0.685	67%	0.669	S	S	*	*				67.9	114.5	67.1	179.9	0	0	0	0	111.1
462	T	28	Very low	37.5	Very low	131 Å²	131	115.4 Å²	115.4	80%	0.804	66%	0.66	S	S	*	*				-150.3	142.5	65	-51.1	0	0	0	0	114
463	F	35.3	Very low	39.1	Very low	186 Å²	186	111.8 Å²	111.8	82%	0.816	64%	0.636	S	S	*	*			trans	-104.6	153.7	174.8	-82	-116.5	0	0	0	112
464	A	30.5	Very low	40.7	Very low	109 Å²	109	108.4 Å²	108.4	90%	0.901	61%	0.61	S	S	*	*			trans	-131.4	82.9	170.2	0	0	0	0	0	111.2
465	L	44.7	Very low	42.9	Very low	132 Å²	132	106.1 Å²	106.1	69%	0.691	60%	0.598	S	S	*	*			trans	-130.8	-27.2	-177.3	-170.2	59.7	0	0	0	116.1	E467	L465-E467 PolarHBondContact O-N 2.83Å
466	P	40.2	Very low	45.4	Very low	77 Å²	77	108 Å²	108	50%	0.5	60%	0.595	S	S	.	*	S	Bend	trans	-62.7	-37.6	-174.8	-28	36.1	0	0	0	116.3	Q468 V469 I470	P466-Q468 PolarHBondContact O-N 2.96Å; P466-V469 PolarHBondContact O-N 2.99Å; P466-I470 HydrophobicContact CB-CD1 3.96Å; P466-I470 WeakPolarHBondContact O-CD1 3.43Å; P466-I470 WeakPolarHBondContact O-CG1 3.49Å
467	E	40.8	Very low	48	Very low	83 Å²	83	105.5 Å²	105.5	39%	0.388	57%	0.568	S	S	.	*	H	α-helix	trans	-60.2	-41.5	-156.8	-138.5	85	147.8	0	0	114.9	L465 I470 Q471 R516	L465-E467 PolarHBondContact O-N 2.83Å; E467-I470 PolarHBondContact O-N 3.47Å; E467-Q471 VanDerWaalsContact O-CG 3.29Å; E467-Q471 WeakPolarHBondContact O-CG 3.4Å; E467-Q471 PolarHBondContact O-N 3.05Å; E467-Q471 VanDerWaalsContact O-N 3.08Å; E467-R516 IonicContact OE1-CZ 3.89Å; E467-R516 IonicContact OE1-NH1 3.8Å; E467-R516 PolarHBondContact OE1-NH1 2.9Å; E467-R516 IonicContact OE1-NH2 3.63Å; E467-R516 IonicContact OE2-CZ 3.77Å; E467-R516 IonicContact OE2-NH1 2.7Å; E467-R516 PolarHBondContact OE2-NH1 3.04Å
468	Q	47.4	Very low	50.6	Low	157 Å²	157	102.5 Å²	102.5	73%	0.734	56%	0.561	S	S	*	*	H	α-helix	trans	-72.5	-31.7	-174.2	-73.4	-170.6	-37.3	0	0	114.2	P466 I470 K472	P466-Q468 PolarHBondContact O-N 2.96Å; Q468-I470 VanDerWaalsContact C-N 3.29Å; Q468-K472 PolarHBondContact O-N 2.92Å
469	V	50	Low	52.9	Low	79 Å²	79	97.7 Å²	97.7	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-70.5	-33.7	177	-177.9	0	0	0	0	110.3	P466 A473 E538	P466-V469 PolarHBondContact O-N 2.99Å; V469-A473 PolarHBondContact O-N 3.27Å; V469-E538 HydrophobicContact CG1-CB 4.47Å
470	I	52.8	Low	55.4	Low	19 Å²	19	93.7 Å²	93.7	10%	0.097	52%	0.517	C	S	.	.	H	α-helix	trans	-68.3	-51.8	177.7	-56.8	169.2	0	0	0	109.7	P466 E467 Q468 K472 A473 D474 R516	P466-I470 HydrophobicContact CB-CD1 3.96Å; P466-I470 WeakPolarHBondContact O-CD1 3.43Å; P466-I470 WeakPolarHBondContact O-CG1 3.49Å; E467-I470 PolarHBondContact O-N 3.47Å; Q468-I470 VanDerWaalsContact C-N 3.29Å; I470-K472 PolarHBondContact O-N 3.19Å; I470-A473 WeakPolarHBondContact O-CB 3.47Å; I470-A473 PolarHBondContact O-N 3.32Å; I470-D474 PolarHBondContact O-N 3.01Å; I470-R516 HydrophobicContact CD1-CB 3.76Å
471	Q	55.3	Low	57.4	Low	96 Å²	96	89.9 Å²	89.9	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-51.8	-51.2	176.7	-71.7	161.1	-0.5	0	0	111.6	E467 A473 D474 D475	E467-Q471 VanDerWaalsContact O-CG 3.29Å; E467-Q471 WeakPolarHBondContact O-CG 3.4Å; E467-Q471 PolarHBondContact O-N 3.05Å; E467-Q471 VanDerWaalsContact O-N 3.08Å; Q471-A473 VanDerWaalsContact C-N 3.25Å; Q471-A473 PolarHBondContact O-N 2.81Å; Q471-D474 WeakPolarHBondContact O-CB 3.4Å; Q471-D474 PolarHBondContact O-N 3.18Å; Q471-D474 VanDerWaalsContact O-N 3.11Å; Q471-D475 PolarHBondContact O-N 2.9Å
472	K	58.1	Low	60	Low	153 Å²	153	84.5 Å²	84.5	67%	0.665	46%	0.46	S	S	*	.	H	α-helix	trans	-60.9	-30.5	178.7	-174.2	-175	173.1	-161.9	0	113.8	Q468 I470	Q468-K472 PolarHBondContact O-N 2.92Å; I470-K472 PolarHBondContact O-N 3.19Å
473	A	64	Low	63.1	Low	25 Å²	25	78.7 Å²	78.7	21%	0.207	42%	0.423	C	S	.	.	H	α-helix	trans	-78	-39.7	175.1	0	0	0	0	0	111.8	V469 I470 Q471 L477 F519 L536	V469-A473 PolarHBondContact O-N 3.27Å; I470-A473 WeakPolarHBondContact O-CB 3.47Å; I470-A473 PolarHBondContact O-N 3.32Å; Q471-A473 VanDerWaalsContact C-N 3.25Å; Q471-A473 PolarHBondContact O-N 2.81Å; A473-L477 VanDerWaalsContact O-CG 3.27Å; A473-L477 WeakPolarHBondContact O-CG 3.44Å; A473-L477 PolarHBondContact O-N 2.93Å; A473-F519 HydrophobicContact CB-CE2 4.23Å; A473-F519 HydrophobicContact CB-CZ 4.15Å; A473-L536 HydrophobicContact CB-CD1 4.36Å
474	D	66.1	Low	65.8	Low	28 Å²	28	71.1 Å²	71.1	15%	0.15	39%	0.39	C	S	.	.	H	α-helix	trans	-60.7	-48.3	172.8	-64.4	-43	0	0	0	110.9	I470 Q471 F476 L477 V478 Q511 F519	I470-D474 PolarHBondContact O-N 3.01Å; Q471-D474 WeakPolarHBondContact O-CB 3.4Å; Q471-D474 PolarHBondContact O-N 3.18Å; Q471-D474 VanDerWaalsContact O-N 3.11Å; D474-F476 VanDerWaalsContact C-N 3.27Å; D474-F476 PolarHBondContact O-N 2.86Å; D474-L477 CarbonylContact O-C 3.52Å; D474-L477 WeakPolarHBondContact O-CA 3.13Å; D474-L477 PolarHBondContact O-N 2.82Å; D474-V478 WeakPolarHBondContact O-CG2 3.5Å; D474-V478 PolarHBondContact O-N 3.4Å; D474-Q511 PolarHBondContact OD1-NE2 3.37Å; D474-Q511 PolarHBondContact OD2-NE2 2.68Å; D474-F519 WeakPolarHBondContact OD1-CE1 3.14Å; D474-F519 WeakPolarHBondContact OD1-CZ 3.22Å
475	D	70.7	Confident	68.6	Low	119 Å²	119	66.4 Å²	66.4	64%	0.636	35%	0.353	S	S	*	.	H	α-helix	trans	-52.7	-43.5	-178.7	-68.8	-30.7	0	0	0	112.4	Q471	Q471-D475 PolarHBondContact O-N 2.9Å
476	F	77.8	Confident	70.8	Confident	132 Å²	132	65.5 Å²	65.5	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-67.6	-46.2	175.2	179.7	-106.1	0	0	0	111.5	D474 V478 S479 F480	D474-F476 VanDerWaalsContact C-N 3.27Å; D474-F476 PolarHBondContact O-N 2.86Å; F476-V478 PolarHBondContact O-N 3.44Å; F476-S479 PolarHBondContact O-N 3.15Å; F476-S479 PolarHBondContact O-OG 3.2Å; F476-F480 AromaticContact CD1-CE2 3.9Å; F476-F480 HydrophobicContact CD1-CE2 3.9Å; F476-F480 HydrophobicContact CD2-CE2 4.47Å; F476-F480 AromaticContact CE1-CE2 3.54Å; F476-F480 HydrophobicContact CE1-CE2 3.54Å; F476-F480 AromaticContact CE1-CZ 3.74Å; F476-F480 HydrophobicContact CE1-CZ 3.74Å; F476-F480 HydrophobicContact CE2-CE2 4.16Å; F476-F480 HydrophobicContact CE2-CZ 4.35Å; F476-F480 HydrophobicContact CG-CE2 4.36Å; F476-F480 AromaticContact CZ-CE2 3.69Å; F476-F480 HydrophobicContact CZ-CE2 3.69Å; F476-F480 AromaticContact CZ-CZ 3.64Å; F476-F480 HydrophobicContact CZ-CZ 3.64Å; F476-F480 VanDerWaalsContact O-CD2 3.3Å; F476-F480 WeakPolarHBondContact O-CD2 3.46Å; F476-F480 VanDerWaalsContact O-CE2 3.32Å; F476-F480 WeakPolarHBondContact O-CE2 3.28Å
477	L	82.4	Confident	73.2	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-69.2	-28	-177	-69.2	172.5	0	0	0	113.5	A473 D474 S479 F480 W482 F483 F519 L536 V552	A473-L477 VanDerWaalsContact O-CG 3.27Å; A473-L477 WeakPolarHBondContact O-CG 3.44Å; A473-L477 PolarHBondContact O-N 2.93Å; D474-L477 CarbonylContact O-C 3.52Å; D474-L477 WeakPolarHBondContact O-CA 3.13Å; D474-L477 PolarHBondContact O-N 2.82Å; L477-S479 PolarHBondContact O-N 2.92Å; L477-S479 VanDerWaalsContact O-N 3.15Å; L477-F480 WeakPolarHBondContact O-CB 3.47Å; L477-F480 PolarHBondContact O-N 2.9Å; L477-W482 HydrophobicContact CD2-CH2 3.73Å; L477-W482 HydrophobicContact CD2-CZ3 4.12Å; L477-F483 VanDerWaalsContact C-CD1 3.4Å; L477-F483 HydrophobicContact CB-CB 4.48Å; L477-F483 HydrophobicContact CB-CD1 3.8Å; L477-F483 HydrophobicContact CB-CD2 3.83Å; L477-F483 HydrophobicContact CB-CE1 3.81Å; L477-F483 HydrophobicContact CB-CE2 3.86Å; L477-F483 HydrophobicContact CB-CG 3.78Å; L477-F483 HydrophobicContact CB-CZ 3.84Å; L477-F483 HydrophobicContact CD1-CD2 4.29Å; L477-F483 HydrophobicContact CD1-CE2 3.92Å; L477-F483 HydrophobicContact CD1-CZ 4.34Å; L477-F483 VanDerWaalsContact O-CB 3.27Å; L477-F483 WeakPolarHBondContact O-CB 3.32Å; L477-F483 VanDerWaalsContact O-CD1 3.3Å; L477-F483 WeakPolarHBondContact O-CD1 3.34Å; L477-F483 WeakPolarHBondContact O-CG 3.05Å; L477-F519 HydrophobicContact CD1-CD1 3.94Å; L477-F519 HydrophobicContact CD1-CE1 3.6Å; L477-F519 HydrophobicContact CD1-CE2 4.29Å; L477-F519 HydrophobicContact CD1-CG 4.41Å; L477-F519 HydrophobicContact CD1-CZ 3.79Å; L477-L536 HydrophobicContact CD1-CD1 4.16Å; L477-V552 HydrophobicContact CD2-CB 4.38Å; L477-V552 HydrophobicContact CD2-CG2 4.26Å
478	V	80.4	Confident	75.7	Confident	103 Å²	103	60.7 Å²	60.7	62%	0.624	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.2	174.2	165.4	0	0	0	0	112.5	D474 F476 F480 F483	D474-V478 WeakPolarHBondContact O-CG2 3.5Å; D474-V478 PolarHBondContact O-N 3.4Å; F476-V478 PolarHBondContact O-N 3.44Å; V478-F480 PolarHBondContact O-N 3.4Å; V478-F483 HydrophobicContact CG2-CD1 4.31Å; V478-F483 HydrophobicContact CG2-CE1 3.93Å
479	S	77	Confident	77.9	Confident	80 Å²	80	60.4 Å²	60.4	56%	0.559	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.3	174.6	71.9	0	0	0	0	114.7	F476 L477 P481	F476-S479 PolarHBondContact O-N 3.15Å; F476-S479 PolarHBondContact O-OG 3.2Å; L477-S479 PolarHBondContact O-N 2.92Å; L477-S479 VanDerWaalsContact O-N 3.15Å; S479-P481 WeakPolarHBondContact O-CD 3.28Å
480	F	83.1	Confident	80.1	Confident	19 Å²	19	62.2 Å²	62.2	8%	0.083	33%	0.334	C	S	.	.	S	Bend	trans	-103.1	113.3	-174.3	-65.4	-101.4	0	0	0	112.1	F476 L477 V478 W482 F483 M553 W605	F476-F480 AromaticContact CD1-CE2 3.9Å; F476-F480 HydrophobicContact CD1-CE2 3.9Å; F476-F480 HydrophobicContact CD2-CE2 4.47Å; F476-F480 AromaticContact CE1-CE2 3.54Å; F476-F480 HydrophobicContact CE1-CE2 3.54Å; F476-F480 AromaticContact CE1-CZ 3.74Å; F476-F480 HydrophobicContact CE1-CZ 3.74Å; F476-F480 HydrophobicContact CE2-CE2 4.16Å; F476-F480 HydrophobicContact CE2-CZ 4.35Å; F476-F480 HydrophobicContact CG-CE2 4.36Å; F476-F480 AromaticContact CZ-CE2 3.69Å; F476-F480 HydrophobicContact CZ-CE2 3.69Å; F476-F480 AromaticContact CZ-CZ 3.64Å; F476-F480 HydrophobicContact CZ-CZ 3.64Å; F476-F480 VanDerWaalsContact O-CD2 3.3Å; F476-F480 WeakPolarHBondContact O-CD2 3.46Å; F476-F480 VanDerWaalsContact O-CE2 3.32Å; F476-F480 WeakPolarHBondContact O-CE2 3.28Å; L477-F480 WeakPolarHBondContact O-CB 3.47Å; L477-F480 PolarHBondContact O-N 2.9Å; V478-F480 PolarHBondContact O-N 3.4Å; F480-W482 HydrophobicContact CB-CD2 3.96Å; F480-W482 HydrophobicContact CB-CE3 4.36Å; F480-W482 HydrophobicContact CB-CG 4.5Å; F480-W482 HydrophobicContact CB-CH2 4.11Å; F480-W482 HydrophobicContact CB-CZ2 3.7Å; F480-W482 HydrophobicContact CB-CZ3 4.42Å; F480-W482 AromaticContact CD1-CE2 3.63Å; F480-W482 HydrophobicContact CD1-CH2 4.21Å; F480-W482 AromaticContact CD1-CZ2 3.3Å; F480-W482 HydrophobicContact CD1-CZ2 3.3Å; F480-W482 AromaticContact CD1-NE1 3.69Å; F480-W482 HydrophobicContact CD2-CZ2 4.47Å; F480-W482 HydrophobicContact CE1-CZ2 4.07Å; F480-W482 AromaticContact CG-CE2 3.91Å; F480-W482 HydrophobicContact CG-CH2 4.08Å; F480-W482 AromaticContact CG-CZ2 3.57Å; F480-W482 HydrophobicContact CG-CZ2 3.57Å; F480-W482 PolarHBondContact O-N 2.85Å; F480-F483 HydrophobicContact CB-CB 4.37Å; F480-F483 WeakPolarHBondContact O-CB 3.22Å; F480-F483 PolarHBondContact O-N 3.41Å; F480-M553 HydrophobicContact CD1-CE 3.71Å; F480-M553 HydrophobicContact CE1-CE 3.55Å; F480-W605 HydrophobicContact CB-CH2 4.13Å; F480-W605 HydrophobicContact CB-CZ2 4Å; F480-W605 AromaticContact CD1-CE2 3.65Å; F480-W605 AromaticContact CD1-CH2 3.83Å; F480-W605 HydrophobicContact CD1-CH2 3.83Å; F480-W605 AromaticContact CD1-CZ2 3.15Å; F480-W605 HydrophobicContact CD1-CZ2 3.15Å; F480-W605 AromaticContact CD1-NE1 3.95Å; F480-W605 AromaticContact CE1-CE2 3.84Å; F480-W605 AromaticContact CE1-CZ2 3.83Å; F480-W605 HydrophobicContact CE1-CZ2 3.83Å; F480-W605 AromaticContact CE1-NE1 3.66Å; F480-W605 HydrophobicContact CG-CH2 4.4Å; F480-W605 AromaticContact CG-CZ2 3.84Å; F480-W605 HydrophobicContact CG-CZ2 3.84Å
481	P	85.8	Confident	82	Confident	42 Å²	42	65.9 Å²	65.9	27%	0.273	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-6.3	178.7	11.3	-28	0	0	0	118.4	S479 F579 L581 A582 W605	S479-P481 WeakPolarHBondContact O-CD 3.28Å; P481-F579 HydrophobicContact CB-CE2 4.14Å; P481-L581 HydrophobicContact CB-CD2 3.66Å; P481-A582 PolarHBondContact O-N 3.19Å; P481-W605 VanDerWaalsContact CD-CH2 3.48Å; P481-W605 HydrophobicContact CG-CH2 3.69Å; P481-W605 HydrophobicContact CG-CZ2 4.4Å; P481-W605 HydrophobicContact CG-CZ3 4.35Å
482	W	90.3	Very high	83.8	Confident	1 Å²	1	61.3 Å²	61.3	0%	0.004	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.1	169.2	49.2	-108.1	0	0	0	113.7	L477 F480 F507 V509 V552 M553 L556 F579 W605	L477-W482 HydrophobicContact CD2-CH2 3.73Å; L477-W482 HydrophobicContact CD2-CZ3 4.12Å; F480-W482 HydrophobicContact CB-CD2 3.96Å; F480-W482 HydrophobicContact CB-CE3 4.36Å; F480-W482 HydrophobicContact CB-CG 4.5Å; F480-W482 HydrophobicContact CB-CH2 4.11Å; F480-W482 HydrophobicContact CB-CZ2 3.7Å; F480-W482 HydrophobicContact CB-CZ3 4.42Å; F480-W482 AromaticContact CD1-CE2 3.63Å; F480-W482 HydrophobicContact CD1-CH2 4.21Å; F480-W482 AromaticContact CD1-CZ2 3.3Å; F480-W482 HydrophobicContact CD1-CZ2 3.3Å; F480-W482 AromaticContact CD1-NE1 3.69Å; F480-W482 HydrophobicContact CD2-CZ2 4.47Å; F480-W482 HydrophobicContact CE1-CZ2 4.07Å; F480-W482 AromaticContact CG-CE2 3.91Å; F480-W482 HydrophobicContact CG-CH2 4.08Å; F480-W482 AromaticContact CG-CZ2 3.57Å; F480-W482 HydrophobicContact CG-CZ2 3.57Å; F480-W482 PolarHBondContact O-N 2.85Å; W482-F507 HydrophobicContact CB-CE2 4.16Å; W482-F507 HydrophobicContact CG-CE2 4.4Å; W482-V509 HydrophobicContact CE3-CB 3.69Å; W482-V509 HydrophobicContact CE3-CG2 3.57Å; W482-V509 HydrophobicContact CZ3-CB 3.69Å; W482-V509 HydrophobicContact CZ3-CG1 4.24Å; W482-V509 HydrophobicContact CZ3-CG2 3.62Å; W482-V509 PolarHBondContact O-N 2.65Å; W482-V552 HydrophobicContact CH2-CB 4.23Å; W482-V552 HydrophobicContact CH2-CG1 3.51Å; W482-V552 HydrophobicContact CZ2-CG1 4.41Å; W482-V552 HydrophobicContact CZ3-CG1 3.89Å; W482-M553 HydrophobicContact CZ2-CE 4.06Å; W482-L556 HydrophobicContact CD2-CD1 3.77Å; W482-L556 HydrophobicContact CE3-CD1 4Å; W482-L556 HydrophobicContact CG-CD1 4.42Å; W482-L556 HydrophobicContact CH2-CD1 3.93Å; W482-L556 HydrophobicContact CZ2-CD1 3.64Å; W482-L556 HydrophobicContact CZ3-CD1 4.1Å; W482-F579 HydrophobicContact CB-CB 3.78Å; W482-F579 HydrophobicContact CB-CD1 4.5Å; W482-F579 HydrophobicContact CB-CD2 3.68Å; W482-F579 HydrophobicContact CB-CE2 4.37Å; W482-F579 HydrophobicContact CB-CG 3.75Å; W482-W605 AromaticContact CD1-CH2 3.55Å; W482-W605 AromaticContact CD1-CZ3 3.57Å; W482-W605 AromaticContact NE1-CH2 3.46Å; W482-W605 AromaticContact NE1-CZ3 3.65Å
483	F	93.2	Very high	85.6	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.035	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-97.4	127.1	178.1	-179.8	-106.4	0	0	0	110.8	L477 V478 F480 V509 F519 A582	L477-F483 VanDerWaalsContact C-CD1 3.4Å; L477-F483 HydrophobicContact CB-CB 4.48Å; L477-F483 HydrophobicContact CB-CD1 3.8Å; L477-F483 HydrophobicContact CB-CD2 3.83Å; L477-F483 HydrophobicContact CB-CE1 3.81Å; L477-F483 HydrophobicContact CB-CE2 3.86Å; L477-F483 HydrophobicContact CB-CG 3.78Å; L477-F483 HydrophobicContact CB-CZ 3.84Å; L477-F483 HydrophobicContact CD1-CD2 4.29Å; L477-F483 HydrophobicContact CD1-CE2 3.92Å; L477-F483 HydrophobicContact CD1-CZ 4.34Å; L477-F483 VanDerWaalsContact O-CB 3.27Å; L477-F483 WeakPolarHBondContact O-CB 3.32Å; L477-F483 VanDerWaalsContact O-CD1 3.3Å; L477-F483 WeakPolarHBondContact O-CD1 3.34Å; L477-F483 WeakPolarHBondContact O-CG 3.05Å; V478-F483 HydrophobicContact CG2-CD1 4.31Å; V478-F483 HydrophobicContact CG2-CE1 3.93Å; F480-F483 HydrophobicContact CB-CB 4.37Å; F480-F483 WeakPolarHBondContact O-CB 3.22Å; F480-F483 PolarHBondContact O-N 3.41Å; F483-V509 CarbonylContact C-O 3.59Å; F483-V509 WeakPolarHBondContact CA-O 3.49Å; F483-V509 HydrophobicContact CD2-CB 4.28Å; F483-V509 HydrophobicContact CD2-CG1 4.14Å; F483-F519 AromaticContact CE2-CD1 3.75Å; F483-F519 HydrophobicContact CE2-CD1 3.75Å; F483-F519 AromaticContact CE2-CE1 3.73Å; F483-F519 HydrophobicContact CE2-CE1 3.73Å; F483-F519 HydrophobicContact CZ-CD1 4.35Å; F483-F519 AromaticContact CZ-CE1 3.89Å; F483-F519 HydrophobicContact CZ-CE1 3.89Å; F483-A582 WeakPolarHBondContact O-CB 3.36Å
484	H	90.9	Very high	87	Confident	27 Å²	27	57.8 Å²	57.8	13%	0.125	31%	0.312	C	S	.	.			trans	-109.1	9.8	-173.8	-74.6	-123.4	0	0	0	113.3	I487 L508 V509 V580 L581 A582	H484-I487 HydrophobicContact CB-CB 4.08Å; H484-I487 HydrophobicContact CB-CD1 4.24Å; H484-I487 HydrophobicContact CB-CG2 3.41Å; H484-I487 VanDerWaalsContact CB-CG2 3.41Å; H484-L508 HydrophobicContact CB-CD1 4.37Å; H484-V509 PolarHBondContact N-O 2.62Å; H484-V580 PolarHBondContact NE2-O 2.79Å; H484-L581 PolarHBondContact CE1-O 2.92Å; H484-L581 VanDerWaalsContact CE1-O 3.27Å; H484-A582 PolarHBondContact NE2-N 3.04Å
485	G	89.8	Confident	88.3	Confident	11 Å²	11	56.5 Å²	56.5	11%	0.113	31%	0.305	C	S	.	.	S	Bend	trans	59.1	-143.4	-178.7	0	0	0	0	0	112.9	I487 Q511	G485-I487 PolarHBondContact O-N 3.47Å; G485-Q511 PolarHBondContact O-N 3.3Å
486	P	90.4	Very high	89.4	Confident	112 Å²	112	50.8 Å²	50.8	73%	0.727	28%	0.275	S	S	*	.	S	Bend	trans	-76.8	68	178	32.5	-35.6	0	0	0	112.3
487	I	91.9	Very high	90.1	Very high	12 Å²	12	47.8 Å²	47.8	6%	0.062	26%	0.262	C	S	.	.			trans	-96.4	140.1	173.3	-170.6	166.4	0	0	0	111.4	H484 G485 K491 A492 L495 L508 R510	H484-I487 HydrophobicContact CB-CB 4.08Å; H484-I487 HydrophobicContact CB-CD1 4.24Å; H484-I487 HydrophobicContact CB-CG2 3.41Å; H484-I487 VanDerWaalsContact CB-CG2 3.41Å; G485-I487 PolarHBondContact O-N 3.47Å; I487-K491 HydrophobicContact CD1-CB 4.36Å; I487-K491 HydrophobicContact CD1-CD 3.82Å; I487-K491 HydrophobicContact CD1-CG 3.92Å; I487-K491 HydrophobicContact CG1-CB 4.04Å; I487-K491 HydrophobicContact CG1-CD 3.88Å; I487-K491 HydrophobicContact CG1-CG 4.07Å; I487-A492 HydrophobicContact CG2-CB 4.43Å; I487-L495 HydrophobicContact CD1-CD1 3.59Å; I487-L508 HydrophobicContact CG2-CD1 4.34Å; I487-R510 HydrophobicContact CG2-CB 3.36Å; I487-R510 HydrophobicContact CG2-CG 4.25Å; I487-R510 PolarHBondContact O-NH1 3.44Å
488	S	93.3	Very high	90.3	Very high	48 Å²	48	49.9 Å²	49.9	34%	0.336	28%	0.277	S	S	.	.			trans	-70.3	154.5	-173.3	72.9	0	0	0	0	114.1	V490 K491 A492 E513	S488-V490 PolarHBondContact O-N 2.99Å; S488-K491 PolarHBondContact O-N 2.9Å; S488-K491 WeakPolarHBondContact OG-CB 3.05Å; S488-K491 PolarHBondContact OG-N 2.89Å; S488-A492 VanDerWaalsContact O-CB 3.24Å; S488-A492 WeakPolarHBondContact O-CB 3.29Å; S488-A492 PolarHBondContact O-N 2.82Å; S488-E513 WeakPolarHBondContact CA-OE1 3.47Å; S488-E513 WeakPolarHBondContact CB-OE1 3.36Å
489	R	93.6	Very high	90.5	Very high	151 Å²	151	47.3 Å²	47.3	57%	0.57	26%	0.264	S	S	*	.	H	α-helix	trans	-53.5	-43.1	178.1	-173.4	-179.6	173.2	-177	-5.7	111.9	A493 E513 H531	R489-A493 VanDerWaalsContact O-CB 3.29Å; R489-A493 WeakPolarHBondContact O-CB 3.41Å; R489-A493 PolarHBondContact O-N 3.27Å; R489-E513 WeakPolarHBondContact CB-OE2 3.21Å; R489-E513 VanDerWaalsContact N-CD 3.25Å; R489-E513 PolarHBondContact N-OE1 3.02Å; R489-E513 PolarHBondContact N-OE2 3.1Å; R489-H531 WeakPolarHBondContact CG-NE2 3.47Å; R489-H531 PolarHBondContact NE-CD2 2.8Å; R489-H531 PolarHBondContact NE-NE2 2.82Å
490	V	94.4	Very high	91.1	Very high	117 Å²	117	44.7 Å²	44.7	71%	0.709	25%	0.25	S	C	*	.	H	α-helix	trans	-69.8	-46.9	-178	-177	0	0	0	0	111.1	S488 A492 A493 H494	S488-V490 PolarHBondContact O-N 2.99Å; V490-A492 PolarHBondContact O-N 2.96Å; V490-A493 PolarHBondContact O-N 2.7Å; V490-H494 PolarHBondContact O-N 2.96Å
491	K	92.8	Very high	91.3	Very high	95 Å²	95	47.8 Å²	47.8	41%	0.413	27%	0.272	S	S	.	.	H	α-helix	trans	-66.3	-39.8	178.8	-170.5	-179.7	166.3	-169.6	0	111.3	I487 S488 H494 L495	I487-K491 HydrophobicContact CD1-CB 4.36Å; I487-K491 HydrophobicContact CD1-CD 3.82Å; I487-K491 HydrophobicContact CD1-CG 3.92Å; I487-K491 HydrophobicContact CG1-CB 4.04Å; I487-K491 HydrophobicContact CG1-CD 3.88Å; I487-K491 HydrophobicContact CG1-CG 4.07Å; S488-K491 PolarHBondContact O-N 2.9Å; S488-K491 WeakPolarHBondContact OG-CB 3.05Å; S488-K491 PolarHBondContact OG-N 2.89Å; K491-H494 PolarHBondContact O-N 3.18Å; K491-L495 VanDerWaalsContact O-CG 3.31Å; K491-L495 WeakPolarHBondContact O-CG 3.34Å; K491-L495 PolarHBondContact O-N 3.45Å
492	A	94.7	Very high	91.4	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-41.5	174.2	0	0	0	0	0	112.9	I487 S488 V490 L495 V496 L508 T522	I487-A492 HydrophobicContact CG2-CB 4.43Å; S488-A492 VanDerWaalsContact O-CB 3.24Å; S488-A492 WeakPolarHBondContact O-CB 3.29Å; S488-A492 PolarHBondContact O-N 2.82Å; V490-A492 PolarHBondContact O-N 2.96Å; A492-L495 PolarHBondContact O-N 3.23Å; A492-V496 PolarHBondContact O-N 2.77Å; A492-L508 HydrophobicContact CB-CD1 3.99Å; A492-L508 HydrophobicContact CB-CD2 4.39Å; A492-T522 HydrophobicContact CB-CG2 4.01Å
493	A	94.9	Very high	91.3	Very high	13 Å²	13	54.1 Å²	54.1	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-50.6	174.4	0	0	0	0	0	111.3	R489 V490 L495 V496 Q497 A529	R489-A493 VanDerWaalsContact O-CB 3.29Å; R489-A493 WeakPolarHBondContact O-CB 3.41Å; R489-A493 PolarHBondContact O-N 3.27Å; V490-A493 PolarHBondContact O-N 2.7Å; A493-L495 VanDerWaalsContact C-N 3.29Å; A493-L495 PolarHBondContact O-N 3.3Å; A493-V496 WeakPolarHBondContact O-CG2 3.34Å; A493-V496 PolarHBondContact O-N 3.15Å; A493-Q497 VanDerWaalsContact O-CB 3.29Å; A493-Q497 WeakPolarHBondContact O-CB 3.2Å; A493-Q497 VanDerWaalsContact O-CG 3.23Å; A493-Q497 WeakPolarHBondContact O-CG 3.45Å; A493-Q497 PolarHBondContact O-N 3.21Å; A493-Q497 PolarHBondContact O-OE1 2.94Å; A493-A529 HydrophobicContact CB-CB 3.5Å
494	H	93.7	Very high	91.2	Very high	92 Å²	92	56.4 Å²	56.4	43%	0.426	31%	0.309	S	S	.	.	H	α-helix	trans	-58.3	-37.6	178	-170.1	-73	0	0	0	113.1	V490 K491 S498	V490-H494 PolarHBondContact O-N 2.96Å; K491-H494 PolarHBondContact O-N 3.18Å; H494-S498 PolarHBondContact O-N 3.27Å
495	L	92.6	Very high	91.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.9	-44.6	176.9	-76.3	172.5	0	0	0	112.8	I487 K491 A492 A493 S498 L508 V580 P586 A595	I487-L495 HydrophobicContact CD1-CD1 3.59Å; K491-L495 VanDerWaalsContact O-CG 3.31Å; K491-L495 WeakPolarHBondContact O-CG 3.34Å; K491-L495 PolarHBondContact O-N 3.45Å; A492-L495 PolarHBondContact O-N 3.23Å; A493-L495 VanDerWaalsContact C-N 3.29Å; A493-L495 PolarHBondContact O-N 3.3Å; L495-S498 PolarHBondContact O-OG 3.01Å; L495-S498 VanDerWaalsContact O-OG 3.05Å; L495-L508 HydrophobicContact CB-CD2 4.01Å; L495-L508 HydrophobicContact CD1-CD2 4.16Å; L495-V580 HydrophobicContact CB-CG1 4.26Å; L495-V580 HydrophobicContact CB-CG2 4.44Å; L495-V580 HydrophobicContact CD2-CG1 4.33Å; L495-P586 HydrophobicContact CD2-CB 4.28Å; L495-A595 HydrophobicContact CD2-CB 3.73Å
496	V	93.8	Very high	91.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-77.5	-26	179	-56.2	0	0	0	0	112.8	A492 A493 V506 L508 T522 N524 A529 V580	A492-V496 PolarHBondContact O-N 2.77Å; A493-V496 WeakPolarHBondContact O-CG2 3.34Å; A493-V496 PolarHBondContact O-N 3.15Å; V496-V506 HydrophobicContact CB-CG1 4.03Å; V496-V506 HydrophobicContact CG1-CG1 4.2Å; V496-L508 HydrophobicContact CG1-CD2 3.88Å; V496-L508 HydrophobicContact CG1-CG 4.11Å; V496-T522 HydrophobicContact CG1-CG2 4.45Å; V496-T522 HydrophobicContact CG2-CG2 4.08Å; V496-N524 HydrophobicContact CB-CB 4.08Å; V496-N524 HydrophobicContact CG2-CB 4.12Å; V496-N524 WeakPolarHBondContact O-CB 3.34Å; V496-N524 PolarHBondContact O-ND2 2.88Å; V496-A529 HydrophobicContact CG2-CB 4.16Å; V496-V580 HydrophobicContact CG1-CG2 4.07Å
497	Q	93.7	Very high	91.7	Very high	69 Å²	69	49.4 Å²	49.4	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-84.3	-4.5	178.5	-67.1	176.7	-84.3	0	0	113.9	A493 S499 G500 G527 A529	A493-Q497 VanDerWaalsContact O-CB 3.29Å; A493-Q497 WeakPolarHBondContact O-CB 3.2Å; A493-Q497 VanDerWaalsContact O-CG 3.23Å; A493-Q497 WeakPolarHBondContact O-CG 3.45Å; A493-Q497 PolarHBondContact O-N 3.21Å; A493-Q497 PolarHBondContact O-OE1 2.94Å; Q497-S499 PolarHBondContact O-N 2.76Å; Q497-S499 VanDerWaalsContact O-N 3.07Å; Q497-G500 PolarHBondContact O-N 3.13Å; Q497-G527 PolarHBondContact NE2-O 3.34Å; Q497-A529 HydrophobicContact CG-CB 3.96Å
498	S	87	Confident	91.8	Very high	47 Å²	47	48.8 Å²	48.8	33%	0.329	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.1	-174.7	62.4	0	0	0	0	114.5	H494 L495	H494-S498 PolarHBondContact O-N 3.27Å; L495-S498 PolarHBondContact O-OG 3.01Å; L495-S498 VanDerWaalsContact O-OG 3.05Å
499	S	83.8	Confident	92	Very high	49 Å²	49	46.5 Å²	46.5	34%	0.343	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	14.9	176.2	-55.7	0	0	0	0	113.4	Q497 E502 G503	Q497-S499 PolarHBondContact O-N 2.76Å; Q497-S499 VanDerWaalsContact O-N 3.07Å; S499-E502 PolarHBondContact O-N 3.23Å; S499-G503 PolarHBondContact O-N 2.95Å; S499-G503 VanDerWaalsContact O-N 3.16Å
500	G	88.7	Confident	92	Very high	26 Å²	26	39.8 Å²	39.8	27%	0.268	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-140	177	0	0	0	0	0	113.1	Q497 G503 N524 G527	Q497-G500 PolarHBondContact O-N 3.13Å; G500-G503 PolarHBondContact O-N 2.98Å; G500-N524 PolarHBondContact O-ND2 3.28Å; G500-G527 WeakPolarHBondContact O-CA 3.33Å
501	P	87.9	Confident	91.9	Very high	84 Å²	84	36.1 Å²	36.1	55%	0.545	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-30.5	177.9	29.8	-34.4	0	0	0	113.1	G503 H504	P501-G503 PolarHBondContact O-N 3.07Å; P501-H504 PolarHBondContact O-N 3.1Å; P501-H504 VanDerWaalsContact O-N 3.14Å
502	E	87.8	Confident	91.8	Very high	173 Å²	173	32.2 Å²	32.2	81%	0.808	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.9	175.8	-54.2	-52.7	124.3	0	0	112	S499 H504	S499-E502 PolarHBondContact O-N 3.23Å; E502-H504 PolarHBondContact O-N 2.78Å
503	G	87.6	Confident	91.4	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	17.8	172.4	0	0	0	0	0	115.3	S499 G500 P501 G505 V506 N524	S499-G503 PolarHBondContact O-N 2.95Å; S499-G503 VanDerWaalsContact O-N 3.16Å; G500-G503 PolarHBondContact O-N 2.98Å; P501-G503 PolarHBondContact O-N 3.07Å; G503-G505 PolarHBondContact O-N 3.32Å; G503-V506 WeakPolarHBondContact O-CB 3.36Å; G503-V506 WeakPolarHBondContact O-CG2 3.3Å; G503-V506 PolarHBondContact O-N 3.34Å; G503-N524 VanDerWaalsContact O-CB 3.24Å; G503-N524 WeakPolarHBondContact O-CB 3.3Å; G503-N524 PolarHBondContact O-ND2 3Å
504	H	92.3	Very high	90.6	Very high	57 Å²	57	42.4 Å²	42.4	26%	0.264	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	128	-179.1	-165.9	105.8	0	0	0	111.5	P501 E502 V506 Y525 Q526 V574 S577	P501-H504 PolarHBondContact O-N 3.1Å; P501-H504 VanDerWaalsContact O-N 3.14Å; E502-H504 PolarHBondContact O-N 2.78Å; H504-V506 VanDerWaalsContact C-N 3.28Å; H504-V506 PolarHBondContact O-N 3.13Å; H504-Y525 AromaticContact CE1-CD2 3.8Å; H504-Q526 PolarHBondContact ND1-N 2.75Å; H504-V574 VanDerWaalsContact NE2-CB 3.34Å; H504-V574 WeakPolarHBondContact NE2-CB 3.48Å; H504-V574 VanDerWaalsContact NE2-CG2 3.34Å; H504-V574 WeakPolarHBondContact NE2-CG2 3.36Å; H504-S577 PolarHBondContact O-OG 2.92Å
505	G	90.2	Very high	89.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	1	-177	0	0	0	0	0	115.4	G503 F507 N524 T575 S577	G503-G505 PolarHBondContact O-N 3.32Å; G505-F507 PolarHBondContact O-N 2.68Å; G505-N524 PolarHBondContact N-O 3.1Å; G505-T575 WeakPolarHBondContact CA-O 3.1Å; G505-S577 PolarHBondContact O-N 3.23Å; G505-S577 PolarHBondContact O-OG 3.01Å
506	V	94.5	Very high	89.3	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	131.6	168.4	171.2	0	0	0	0	109.2	V496 G503 H504 F523 N524 S577 S578 V580 L597	V496-V506 HydrophobicContact CB-CG1 4.03Å; V496-V506 HydrophobicContact CG1-CG1 4.2Å; G503-V506 WeakPolarHBondContact O-CB 3.36Å; G503-V506 WeakPolarHBondContact O-CG2 3.3Å; G503-V506 PolarHBondContact O-N 3.34Å; H504-V506 VanDerWaalsContact C-N 3.28Å; H504-V506 PolarHBondContact O-N 3.13Å; V506-F523 CarbonylContact O-C 3.52Å; V506-F523 WeakPolarHBondContact O-CA 3.35Å; V506-F523 WeakPolarHBondContact O-CB 3.24Å; V506-N524 HydrophobicContact CB-CB 4.31Å; V506-N524 PolarHBondContact O-N 2.86Å; V506-S577 PolarHBondContact N-OG 3.46Å; V506-S578 CarbonylContact C-O 3.49Å; V506-S578 VanDerWaalsContact CA-O 3.29Å; V506-S578 WeakPolarHBondContact CA-O 3.49Å; V506-S578 WeakPolarHBondContact CG2-OG 3.06Å; V506-V580 HydrophobicContact CG1-CG2 3.69Å; V506-L597 HydrophobicContact CG1-CD2 3.61Å; V506-L597 HydrophobicContact CG2-CD1 3.81Å; V506-L597 HydrophobicContact CG2-CD2 4.24Å
507	F	96.2	Very high	88.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	168.2	-178	76.2	-88.4	0	0	0	115.7	W482 G505 L521 T522 F523 L556 L576 S578 F579 V580 F600	W482-F507 HydrophobicContact CB-CE2 4.16Å; W482-F507 HydrophobicContact CG-CE2 4.4Å; G505-F507 PolarHBondContact O-N 2.68Å; F507-L521 HydrophobicContact CB-CD1 3.86Å; F507-L521 HydrophobicContact CD2-CD1 3.61Å; F507-L521 HydrophobicContact CG-CD1 4.02Å; F507-T522 CarbonylContact C-O 3.53Å; F507-T522 VanDerWaalsContact CA-O 3.28Å; F507-T522 WeakPolarHBondContact CA-O 3.31Å; F507-F523 HydrophobicContact CB-CB 3.74Å; F507-L556 HydrophobicContact CD2-CD2 4.08Å; F507-L556 HydrophobicContact CE2-CD1 3.97Å; F507-L556 HydrophobicContact CE2-CD2 3.65Å; F507-L556 HydrophobicContact CE2-CG 4.37Å; F507-L556 HydrophobicContact CZ-CD1 4.41Å; F507-L556 HydrophobicContact CZ-CD2 4.21Å; F507-L576 HydrophobicContact CB-CD2 3.91Å; F507-L576 HydrophobicContact CD1-CB 3.79Å; F507-L576 HydrophobicContact CD1-CD1 4.13Å; F507-L576 HydrophobicContact CD1-CD2 3.82Å; F507-L576 HydrophobicContact CD1-CG 4.12Å; F507-L576 HydrophobicContact CE1-CB 3.81Å; F507-L576 HydrophobicContact CE1-CD1 4.16Å; F507-L576 HydrophobicContact CE1-CG 4.41Å; F507-L576 HydrophobicContact CG-CD1 4.33Å; F507-L576 HydrophobicContact CG-CD2 3.96Å; F507-L576 HydrophobicContact CZ-CD1 4.38Å; F507-S578 WeakPolarHBondContact CD1-O 3.32Å; F507-S578 PolarHBondContact N-O 3.35Å; F507-F579 HydrophobicContact CD1-CB 4.33Å; F507-F579 HydrophobicContact CD2-CB 4.36Å; F507-F579 HydrophobicContact CE1-CB 3.99Å; F507-F579 HydrophobicContact CE2-CB 4.01Å; F507-F579 HydrophobicContact CZ-CB 3.83Å; F507-F579 CarbonylContact O-C 3.59Å; F507-F579 WeakPolarHBondContact O-CA 3.18Å; F507-V580 PolarHBondContact O-N 3.41Å; F507-F600 HydrophobicContact CE1-CB 4.2Å; F507-F600 HydrophobicContact CE1-CD1 4.22Å; F507-F600 HydrophobicContact CE1-CD2 4.33Å; F507-F600 HydrophobicContact CE1-CG 4.01Å; F507-F600 HydrophobicContact CZ-CD1 4.38Å; F507-F600 AromaticContact CZ-CD2 3.97Å; F507-F600 HydrophobicContact CZ-CD2 3.97Å; F507-F600 HydrophobicContact CZ-CE2 4.17Å; F507-F600 HydrophobicContact CZ-CG 4.11Å; F507-F600 HydrophobicContact CZ-CZ 4.48Å
508	L	95.6	Very high	88.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	157.7	162.2	63	90.8	0	0	0	109.8	H484 I487 A492 L495 V496 R510 T522 V580	H484-L508 HydrophobicContact CB-CD1 4.37Å; I487-L508 HydrophobicContact CG2-CD1 4.34Å; A492-L508 HydrophobicContact CB-CD1 3.99Å; A492-L508 HydrophobicContact CB-CD2 4.39Å; L495-L508 HydrophobicContact CB-CD2 4.01Å; L495-L508 HydrophobicContact CD1-CD2 4.16Å; V496-L508 HydrophobicContact CG1-CD2 3.88Å; V496-L508 HydrophobicContact CG1-CG 4.11Å; L508-R510 HydrophobicContact CD1-CB 4.11Å; L508-R510 HydrophobicContact CD1-CG 4.43Å; L508-T522 PolarHBondContact N-O 3.27Å; L508-T522 PolarHBondContact O-N 3.42Å; L508-T522 VanDerWaalsContact O-O 3.13Å; L508-V580 HydrophobicContact CB-CB 4.45Å; L508-V580 HydrophobicContact CD2-CB 4.23Å; L508-V580 HydrophobicContact CD2-CG2 4.27Å
509	V	95.5	Very high	88.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141.9	169.3	-174.9	0	0	0	0	109.4	W482 F483 H484 F519 V520 L521 L534 L556	W482-V509 HydrophobicContact CE3-CB 3.69Å; W482-V509 HydrophobicContact CE3-CG2 3.57Å; W482-V509 HydrophobicContact CZ3-CB 3.69Å; W482-V509 HydrophobicContact CZ3-CG1 4.24Å; W482-V509 HydrophobicContact CZ3-CG2 3.62Å; W482-V509 PolarHBondContact O-N 2.65Å; F483-V509 CarbonylContact C-O 3.59Å; F483-V509 WeakPolarHBondContact CA-O 3.49Å; F483-V509 HydrophobicContact CD2-CB 4.28Å; F483-V509 HydrophobicContact CD2-CG1 4.14Å; H484-V509 PolarHBondContact N-O 2.62Å; V509-F519 HydrophobicContact CG1-CB 4.38Å; V509-V520 WeakPolarHBondContact CA-O 3.27Å; V509-L521 HydrophobicContact CG2-CD1 4.05Å; V509-L534 HydrophobicContact CG1-CD1 3.9Å; V509-L556 HydrophobicContact CG2-CD1 4.42Å; V509-L556 HydrophobicContact CG2-CD2 4.23Å
510	R	94.5	Very high	89.2	Confident	9 Å²	9	47.6 Å²	47.6	3%	0.034	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	160.5	179.3	65.7	-169.3	-164.9	89.8	2.6	111.5	I487 L508 E513 F519 V520 T522	I487-R510 HydrophobicContact CG2-CB 3.36Å; I487-R510 HydrophobicContact CG2-CG 4.25Å; I487-R510 PolarHBondContact O-NH1 3.44Å; L508-R510 HydrophobicContact CD1-CB 4.11Å; L508-R510 HydrophobicContact CD1-CG 4.43Å; R510-E513 IonicContact CZ-OE2 2.7Å; R510-E513 IonicContact NH1-OE2 3.57Å; R510-E513 PolarHBondContact NH1-OE2 3.37Å; R510-E513 IonicContact NH2-OE2 2.98Å; R510-E513 PolarHBondContact NH2-OE2 2.74Å; R510-E513 VanDerWaalsContact NH2-OE2 3.09Å; R510-F519 CarbonylContact O-C 3.46Å; R510-F519 WeakPolarHBondContact O-CA 3.4Å; R510-V520 HydrophobicContact CG-CB 3.92Å; R510-V520 PolarHBondContact N-O 2.76Å; R510-V520 PolarHBondContact O-N 3.43Å; R510-T522 PolarHBondContact NE-OG1 3.14Å
511	Q	92.6	Very high	89.5	Confident	40 Å²	40	46.3 Å²	46.3	19%	0.187	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.3	166.9	-160.4	-178.8	53.3	0	0	110.4	D474 G485 F519	D474-Q511 PolarHBondContact OD1-NE2 3.37Å; D474-Q511 PolarHBondContact OD2-NE2 2.68Å; G485-Q511 PolarHBondContact O-N 3.3Å; Q511-F519 HydrophobicContact CB-CD1 4.4Å; Q511-F519 HydrophobicContact CB-CE1 4.34Å; Q511-F519 HydrophobicContact CG-CE1 4.22Å
512	S	89.5	Confident	89.9	Confident	13 Å²	13	42.3 Å²	42.3	9%	0.091	20%	0.201	C	C	.	.			trans	-84.5	117.2	180	-178.9	0	0	0	0	112.5	T514 R515 D518	S512-T514 PolarHBondContact O-N 3.03Å; S512-R515 WeakPolarHBondContact CB-O 3.27Å; S512-R515 PolarHBondContact OG-N 3.01Å; S512-D518 WeakPolarHBondContact CB-O 3.18Å; S512-D518 PolarHBondContact N-O 2.71Å
513	E	86.3	Confident	90.3	Very high	107 Å²	107	34.1 Å²	34.1	50%	0.5	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.1	176	-61.1	143.6	111.6	0	0	113.3	S488 R489 R510	S488-E513 WeakPolarHBondContact CA-OE1 3.47Å; S488-E513 WeakPolarHBondContact CB-OE1 3.36Å; R489-E513 WeakPolarHBondContact CB-OE2 3.21Å; R489-E513 VanDerWaalsContact N-CD 3.25Å; R489-E513 PolarHBondContact N-OE1 3.02Å; R489-E513 PolarHBondContact N-OE2 3.1Å; R510-E513 IonicContact CZ-OE2 2.7Å; R510-E513 IonicContact NH1-OE2 3.57Å; R510-E513 PolarHBondContact NH1-OE2 3.37Å; R510-E513 IonicContact NH2-OE2 2.98Å; R510-E513 PolarHBondContact NH2-OE2 2.74Å; R510-E513 VanDerWaalsContact NH2-OE2 3.09Å
514	T	79.3	Confident	90.6	Very high	121 Å²	121	34 Å²	34	74%	0.742	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-8.4	-169.5	58.1	0	0	0	0	113.7	S512	S512-T514 PolarHBondContact O-N 3.03Å
515	R	79.7	Confident	90.6	Very high	133 Å²	133	31.9 Å²	31.9	50%	0.502	15%	0.151	S	C	.	.	S	Bend	trans	-146.6	101	-176.8	-61.2	-177.2	-174.4	-121.9	0.2	110.1	S512 G517 D518	S512-R515 WeakPolarHBondContact CB-O 3.27Å; S512-R515 PolarHBondContact OG-N 3.01Å; R515-G517 PolarHBondContact O-N 2.6Å; R515-D518 HydrophobicContact CB-CB 4.03Å; R515-D518 WeakPolarHBondContact CB-OD2 3.26Å; R515-D518 WeakPolarHBondContact CD-OD2 3.32Å; R515-D518 PolarHBondContact O-N 3.01Å; R515-D518 VanDerWaalsContact O-N 3.13Å
516	R	78.6	Confident	90.6	Very high	186 Å²	186	36.3 Å²	36.3	70%	0.702	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	125.6	175.1	-72.5	-173.1	173	-155.2	-8.8	110.3	E467 I470	E467-R516 IonicContact OE1-CZ 3.89Å; E467-R516 IonicContact OE1-NH1 3.8Å; E467-R516 PolarHBondContact OE1-NH1 2.9Å; E467-R516 IonicContact OE1-NH2 3.63Å; E467-R516 IonicContact OE2-CZ 3.77Å; E467-R516 IonicContact OE2-NH1 2.7Å; E467-R516 PolarHBondContact OE2-NH1 3.04Å; I470-R516 HydrophobicContact CD1-CB 3.76Å
517	G	77.6	Confident	90.4	Very high	21 Å²	21	37.1 Å²	37.1	22%	0.216	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-4.3	179.3	0	0	0	0	0	116.8	R515	R515-G517 PolarHBondContact O-N 2.6Å
518	D	89.5	Confident	90.1	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	151.5	162.3	-74.4	-57.4	0	0	0	110.8	S512 R515 R533 S535	S512-D518 WeakPolarHBondContact CB-O 3.18Å; S512-D518 PolarHBondContact N-O 2.71Å; R515-D518 HydrophobicContact CB-CB 4.03Å; R515-D518 WeakPolarHBondContact CB-OD2 3.26Å; R515-D518 WeakPolarHBondContact CD-OD2 3.32Å; R515-D518 PolarHBondContact O-N 3.01Å; R515-D518 VanDerWaalsContact O-N 3.13Å; D518-R533 HydrophobicContact CB-CG 4.43Å; D518-R533 VanDerWaalsContact CG-NH2 3.33Å; D518-R533 IonicContact OD1-CZ 3.69Å; D518-R533 IonicContact OD1-NE 3.71Å; D518-R533 PolarHBondContact OD1-NE 2.98Å; D518-R533 IonicContact OD1-NH2 3.4Å; D518-R533 PolarHBondContact OD1-NH2 3.5Å; D518-R533 VanDerWaalsContact OD1-NH2 3.15Å; D518-R533 IonicContact OD2-CZ 3.77Å; D518-R533 IonicContact OD2-NE 2.8Å; D518-R533 PolarHBondContact OD2-NE 2.99Å; D518-R533 IonicContact OD2-NH2 3.88Å; D518-R533 PolarHBondContact OD2-NH2 2.87Å; D518-S535 PolarHBondContact OD1-OG 2.91Å
519	F	93.8	Very high	90.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	165.4	171.2	-63.4	-89	0	0	0	109.9	A473 D474 L477 F483 V509 R510 Q511 L534 L536	A473-F519 HydrophobicContact CB-CE2 4.23Å; A473-F519 HydrophobicContact CB-CZ 4.15Å; D474-F519 WeakPolarHBondContact OD1-CE1 3.14Å; D474-F519 WeakPolarHBondContact OD1-CZ 3.22Å; L477-F519 HydrophobicContact CD1-CD1 3.94Å; L477-F519 HydrophobicContact CD1-CE1 3.6Å; L477-F519 HydrophobicContact CD1-CE2 4.29Å; L477-F519 HydrophobicContact CD1-CG 4.41Å; L477-F519 HydrophobicContact CD1-CZ 3.79Å; F483-F519 AromaticContact CE2-CD1 3.75Å; F483-F519 HydrophobicContact CE2-CD1 3.75Å; F483-F519 AromaticContact CE2-CE1 3.73Å; F483-F519 HydrophobicContact CE2-CE1 3.73Å; F483-F519 HydrophobicContact CZ-CD1 4.35Å; F483-F519 AromaticContact CZ-CE1 3.89Å; F483-F519 HydrophobicContact CZ-CE1 3.89Å; V509-F519 HydrophobicContact CG1-CB 4.38Å; R510-F519 CarbonylContact O-C 3.46Å; R510-F519 WeakPolarHBondContact O-CA 3.4Å; Q511-F519 HydrophobicContact CB-CD1 4.4Å; Q511-F519 HydrophobicContact CB-CE1 4.34Å; Q511-F519 HydrophobicContact CG-CE1 4.22Å; F519-L534 HydrophobicContact CB-CB 4.13Å; F519-L534 HydrophobicContact CB-CD1 4.14Å; F519-L534 HydrophobicContact CB-CG 4.5Å; F519-L534 PolarHBondContact N-O 3.02Å; F519-L534 PolarHBondContact O-N 2.86Å; F519-L534 VanDerWaalsContact O-O 3.09Å; F519-L536 HydrophobicContact CD2-CD1 3.71Å; F519-L536 HydrophobicContact CD2-CG 3.77Å; F519-L536 HydrophobicContact CE2-CD1 3.62Å; F519-L536 HydrophobicContact CE2-CG 4.03Å; F519-L536 HydrophobicContact CZ-CD1 4.47Å
520	V	95.2	Very high	90	Very high	10 Å²	10	48.2 Å²	48.2	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	117.1	-177.7	-175.1	0	0	0	0	109.3	V509 R510 T522 H531 L532	V509-V520 WeakPolarHBondContact CA-O 3.27Å; R510-V520 HydrophobicContact CG-CB 3.92Å; R510-V520 PolarHBondContact N-O 2.76Å; R510-V520 PolarHBondContact O-N 3.43Å; V520-T522 PolarHBondContact O-N 3.18Å; V520-H531 HydrophobicContact CG1-CB 3.74Å; V520-L532 WeakPolarHBondContact CA-O 3.46Å
521	L	95.9	Very high	89.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	113.2	161.4	174.7	62.2	0	0	0	107.2	F507 V509 F523 H531 L532 L534 M555 L556 F559 I564 L576	F507-L521 HydrophobicContact CB-CD1 3.86Å; F507-L521 HydrophobicContact CD2-CD1 3.61Å; F507-L521 HydrophobicContact CG-CD1 4.02Å; V509-L521 HydrophobicContact CG2-CD1 4.05Å; L521-F523 HydrophobicContact CG-CD1 4.2Å; L521-H531 WeakPolarHBondContact O-CA 3.35Å; L521-L532 HydrophobicContact CB-CB 4.35Å; L521-L532 HydrophobicContact CD2-CD2 4.37Å; L521-L532 PolarHBondContact N-O 2.89Å; L521-L532 PolarHBondContact O-N 3.01Å; L521-L534 HydrophobicContact CB-CD1 4.17Å; L521-L534 HydrophobicContact CB-CD2 3.96Å; L521-L534 HydrophobicContact CB-CG 4.31Å; L521-M555 HydrophobicContact CD2-SD 4.11Å; L521-L556 HydrophobicContact CD1-CD2 3.84Å; L521-L556 HydrophobicContact CD2-CD2 4.37Å; L521-F559 HydrophobicContact CD2-CD2 4.45Å; L521-I564 HydrophobicContact CD2-CD1 4.49Å; L521-L576 HydrophobicContact CD2-CD1 4.21Å; L521-L576 HydrophobicContact CD2-CD2 4.43Å
522	T	96.1	Very high	89.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.4	173.6	-61.7	0	0	0	0	108.1	A492 V496 F507 L508 R510 V520 K530 H531	A492-T522 HydrophobicContact CB-CG2 4.01Å; V496-T522 HydrophobicContact CG1-CG2 4.45Å; V496-T522 HydrophobicContact CG2-CG2 4.08Å; F507-T522 CarbonylContact C-O 3.53Å; F507-T522 VanDerWaalsContact CA-O 3.28Å; F507-T522 WeakPolarHBondContact CA-O 3.31Å; L508-T522 PolarHBondContact N-O 3.27Å; L508-T522 PolarHBondContact O-N 3.42Å; L508-T522 VanDerWaalsContact O-O 3.13Å; R510-T522 PolarHBondContact NE-OG1 3.14Å; V520-T522 PolarHBondContact O-N 3.18Å; T522-K530 WeakPolarHBondContact CA-O 3.43Å; T522-H531 WeakPolarHBondContact CG2-ND1 3.43Å; T522-H531 PolarHBondContact OG1-ND1 2.84Å
523	F	95.7	Very high	90.1	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	159	-175.5	67.8	-85.8	0	0	0	112.1	V506 F507 L521 A529 K530 L532 I564 L566 V574 L576	V506-F523 CarbonylContact O-C 3.52Å; V506-F523 WeakPolarHBondContact O-CA 3.35Å; V506-F523 WeakPolarHBondContact O-CB 3.24Å; F507-F523 HydrophobicContact CB-CB 3.74Å; L521-F523 HydrophobicContact CG-CD1 4.2Å; F523-A529 WeakPolarHBondContact O-CA 3.14Å; F523-K530 HydrophobicContact CD1-CB 4.28Å; F523-K530 HydrophobicContact CD2-CB 4.3Å; F523-K530 HydrophobicContact CE1-CB 3.74Å; F523-K530 HydrophobicContact CE2-CB 3.74Å; F523-K530 HydrophobicContact CE2-CG 4.14Å; F523-K530 HydrophobicContact CZ-CB 3.45Å; F523-K530 VanDerWaalsContact CZ-CB 3.45Å; F523-K530 HydrophobicContact CZ-CG 4.14Å; F523-K530 PolarHBondContact N-O 3.23Å; F523-K530 PolarHBondContact O-N 3.22Å; F523-L532 HydrophobicContact CE1-CB 4.18Å; F523-I564 HydrophobicContact CD1-CD1 4.06Å; F523-I564 HydrophobicContact CD2-CD1 4.17Å; F523-I564 HydrophobicContact CE1-CD1 3.78Å; F523-I564 HydrophobicContact CE2-CD1 3.91Å; F523-I564 HydrophobicContact CG-CD1 4.24Å; F523-I564 HydrophobicContact CZ-CD1 3.69Å; F523-I564 HydrophobicContact CZ-CG2 4.38Å; F523-L566 HydrophobicContact CE2-CD1 4.26Å; F523-L566 HydrophobicContact CZ-CD1 4.04Å; F523-L566 HydrophobicContact CZ-CD2 4.17Å; F523-V574 HydrophobicContact CD2-CG2 4.14Å; F523-V574 HydrophobicContact CE2-CG1 3.9Å; F523-V574 HydrophobicContact CE2-CG2 4.1Å; F523-L576 HydrophobicContact CB-CD2 4.36Å
524	N	94.6	Very high	90.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.6	179.9	176.6	-11.9	0	0	0	111	V496 G500 G503 G505 V506 Q526 G527	V496-N524 HydrophobicContact CB-CB 4.08Å; V496-N524 HydrophobicContact CG2-CB 4.12Å; V496-N524 WeakPolarHBondContact O-CB 3.34Å; V496-N524 PolarHBondContact O-ND2 2.88Å; G500-N524 PolarHBondContact O-ND2 3.28Å; G503-N524 VanDerWaalsContact O-CB 3.24Å; G503-N524 WeakPolarHBondContact O-CB 3.3Å; G503-N524 PolarHBondContact O-ND2 3Å; G505-N524 PolarHBondContact N-O 3.1Å; V506-N524 HydrophobicContact CB-CB 4.31Å; V506-N524 PolarHBondContact O-N 2.86Å; N524-Q526 PolarHBondContact OD1-N 3.48Å; N524-G527 VanDerWaalsContact OD1-CA 3.28Å; N524-G527 WeakPolarHBondContact OD1-CA 3.44Å; N524-G527 PolarHBondContact OD1-N 3.38Å
525	Y	92.8	Very high	91	Very high	11 Å²	11	44.4 Å²	44.4	4%	0.043	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	98.7	174.4	-175.1	-108.9	0	0	0	108.9	H504 G527 K528 K530 L566 C568 A571 G572 V574	H504-Y525 AromaticContact CE1-CD2 3.8Å; Y525-G527 VanDerWaalsContact C-N 3.34Å; Y525-G527 PolarHBondContact O-N 3.49Å; Y525-K528 PolarHBondContact N-O 2.91Å; Y525-K528 WeakPolarHBondContact O-CB 3.2Å; Y525-K528 PolarHBondContact O-N 2.84Å; Y525-K530 HydrophobicContact CG-CG 4.29Å; Y525-L566 HydrophobicContact CD2-CD1 4.19Å; Y525-L566 HydrophobicContact CE2-CD1 4.16Å; Y525-C568 HydrophobicContact CE1-CB 4.43Å; Y525-A571 PolarHBondContact OH-O 3.19Å; Y525-G572 WeakPolarHBondContact CE2-O 3.31Å; Y525-G572 PolarHBondContact OH-O 2.93Å; Y525-V574 HydrophobicContact CD2-CB 3.66Å; Y525-V574 HydrophobicContact CD2-CG1 3.61Å; Y525-V574 HydrophobicContact CD2-CG2 4.16Å; Y525-V574 HydrophobicContact CE2-CB 3.89Å; Y525-V574 HydrophobicContact CE2-CG1 3.77Å
526	Q	90.4	Very high	91.4	Very high	94 Å²	94	39.8 Å²	39.8	44%	0.439	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	46.6	178.6	-59.6	170.6	-3.9	0	0	113	H504 N524 K528 A571	H504-Q526 PolarHBondContact ND1-N 2.75Å; N524-Q526 PolarHBondContact OD1-N 3.48Å; Q526-K528 VanDerWaalsContact C-N 3.26Å; Q526-K528 PolarHBondContact O-N 3.34Å; Q526-A571 PolarHBondContact NE2-O 2.97Å
527	G	88.3	Confident	91.5	Very high	18 Å²	18	33.5 Å²	33.5	19%	0.186	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-3.1	-177.6	0	0	0	0	0	114.7	Q497 G500 N524 Y525	Q497-G527 PolarHBondContact NE2-O 3.34Å; G500-G527 WeakPolarHBondContact O-CA 3.33Å; N524-G527 VanDerWaalsContact OD1-CA 3.28Å; N524-G527 WeakPolarHBondContact OD1-CA 3.44Å; N524-G527 PolarHBondContact OD1-N 3.38Å; Y525-G527 VanDerWaalsContact C-N 3.34Å; Y525-G527 PolarHBondContact O-N 3.49Å
528	K	91.5	Very high	91.4	Very high	148 Å²	148	38.6 Å²	38.6	64%	0.643	19%	0.187	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.7	178	-61.6	179.7	-178.4	176.4	0	110.4	Y525 Q526 K530	Y525-K528 PolarHBondContact N-O 2.91Å; Y525-K528 WeakPolarHBondContact O-CB 3.2Å; Y525-K528 PolarHBondContact O-N 2.84Å; Q526-K528 VanDerWaalsContact C-N 3.26Å; Q526-K528 PolarHBondContact O-N 3.34Å; K528-K530 PolarHBondContact O-N 2.86Å
529	A	94.1	Very high	90.5	Very high	23 Å²	23	46.8 Å²	46.8	19%	0.19	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	130	172.8	0	0	0	0	0	111.1	A493 V496 Q497 F523	A493-A529 HydrophobicContact CB-CB 3.5Å; V496-A529 HydrophobicContact CG2-CB 4.16Å; Q497-A529 HydrophobicContact CG-CB 3.96Å; F523-A529 WeakPolarHBondContact O-CA 3.14Å
530	K	94	Very high	89.6	Confident	63 Å²	63	48.4 Å²	48.4	27%	0.274	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	151.8	168.8	-64	-72.1	-171.2	169.4	0	108.5	T522 F523 Y525 K528 C568	T522-K530 WeakPolarHBondContact CA-O 3.43Å; F523-K530 HydrophobicContact CD1-CB 4.28Å; F523-K530 HydrophobicContact CD2-CB 4.3Å; F523-K530 HydrophobicContact CE1-CB 3.74Å; F523-K530 HydrophobicContact CE2-CB 3.74Å; F523-K530 HydrophobicContact CE2-CG 4.14Å; F523-K530 HydrophobicContact CZ-CB 3.45Å; F523-K530 VanDerWaalsContact CZ-CB 3.45Å; F523-K530 HydrophobicContact CZ-CG 4.14Å; F523-K530 PolarHBondContact N-O 3.23Å; F523-K530 PolarHBondContact O-N 3.22Å; Y525-K530 HydrophobicContact CG-CG 4.29Å; K528-K530 PolarHBondContact O-N 2.86Å; K530-C568 PolarHBondContact NZ-SG 3.07Å
531	H	93.1	Very high	89.2	Confident	57 Å²	57	52.6 Å²	52.6	26%	0.264	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.2	-179.6	-51.6	-75.7	0	0	0	109.2	R489 V520 L521 T522	R489-H531 WeakPolarHBondContact CG-NE2 3.47Å; R489-H531 PolarHBondContact NE-CD2 2.8Å; R489-H531 PolarHBondContact NE-NE2 2.82Å; V520-H531 HydrophobicContact CG1-CB 3.74Å; L521-H531 WeakPolarHBondContact O-CA 3.35Å; T522-H531 WeakPolarHBondContact CG2-ND1 3.43Å; T522-H531 PolarHBondContact OG1-ND1 2.84Å
532	L	92.9	Very high	88.9	Confident	13 Å²	13	52.6 Å²	52.6	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.1	-179.6	-175.7	60.2	0	0	0	108.5	V520 L521 F523 V544 Q545 F559 I564	V520-L532 WeakPolarHBondContact CA-O 3.46Å; L521-L532 HydrophobicContact CB-CB 4.35Å; L521-L532 HydrophobicContact CD2-CD2 4.37Å; L521-L532 PolarHBondContact N-O 2.89Å; L521-L532 PolarHBondContact O-N 3.01Å; F523-L532 HydrophobicContact CE1-CB 4.18Å; L532-V544 HydrophobicContact CD1-CG1 3.78Å; L532-V544 HydrophobicContact CD2-CG1 3.48Å; L532-V544 VanDerWaalsContact CD2-CG1 3.48Å; L532-V544 HydrophobicContact CG-CG1 3.49Å; L532-V544 VanDerWaalsContact CG-CG1 3.49Å; L532-Q545 HydrophobicContact CD1-CG 4.08Å; L532-F559 HydrophobicContact CD2-CE2 4.1Å; L532-F559 HydrophobicContact CD2-CZ 4.47Å; L532-I564 HydrophobicContact CD2-CG2 3.71Å
533	R	92.9	Very high	88.7	Confident	118 Å²	118	59.2 Å²	59.2	45%	0.445	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.7	-178.4	-179.7	174.8	169.8	-123.5	-4.5	109.9	D518	D518-R533 HydrophobicContact CB-CG 4.43Å; D518-R533 VanDerWaalsContact CG-NH2 3.33Å; D518-R533 IonicContact OD1-CZ 3.69Å; D518-R533 IonicContact OD1-NE 3.71Å; D518-R533 PolarHBondContact OD1-NE 2.98Å; D518-R533 IonicContact OD1-NH2 3.4Å; D518-R533 PolarHBondContact OD1-NH2 3.5Å; D518-R533 VanDerWaalsContact OD1-NH2 3.15Å; D518-R533 IonicContact OD2-CZ 3.77Å; D518-R533 IonicContact OD2-NE 2.8Å; D518-R533 PolarHBondContact OD2-NE 2.99Å; D518-R533 IonicContact OD2-NH2 3.88Å; D518-R533 PolarHBondContact OD2-NH2 2.87Å
534	L	93.5	Very high	88.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.3	175.7	-37.7	174.4	0	0	0	107	V509 F519 L521 V544 M555	V509-L534 HydrophobicContact CG1-CD1 3.9Å; F519-L534 HydrophobicContact CB-CB 4.13Å; F519-L534 HydrophobicContact CB-CD1 4.14Å; F519-L534 HydrophobicContact CB-CG 4.5Å; F519-L534 PolarHBondContact N-O 3.02Å; F519-L534 PolarHBondContact O-N 2.86Å; F519-L534 VanDerWaalsContact O-O 3.09Å; L521-L534 HydrophobicContact CB-CD1 4.17Å; L521-L534 HydrophobicContact CB-CD2 3.96Å; L521-L534 HydrophobicContact CB-CG 4.31Å; L534-V544 HydrophobicContact CD2-CB 4.48Å; L534-V544 HydrophobicContact CD2-CG1 4.21Å; L534-V544 HydrophobicContact CD2-CG2 3.48Å; L534-V544 VanDerWaalsContact CD2-CG2 3.48Å; L534-M555 HydrophobicContact CD1-CE 3.72Å; L534-M555 HydrophobicContact CD2-CE 3.8Å; L534-M555 HydrophobicContact CD2-SD 4.2Å; L534-M555 HydrophobicContact CG-CE 4.41Å
535	S	90.4	Very high	88.1	Confident	21 Å²	21	63.8 Å²	63.8	15%	0.147	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.3	167.1	-57.5	0	0	0	0	108.4	D518 R543	D518-S535 PolarHBondContact OD1-OG 2.91Å; S535-R543 PolarHBondContact N-O 2.88Å; S535-R543 PolarHBondContact O-N 2.94Å
536	L	87.8	Confident	87.6	Confident	36 Å²	36	69.3 Å²	69.3	19%	0.188	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	150.8	173.1	-54.2	-171.6	0	0	0	110	A473 L477 F519 Q541 C542 V552	A473-L536 HydrophobicContact CB-CD1 4.36Å; L477-L536 HydrophobicContact CD1-CD1 4.16Å; F519-L536 HydrophobicContact CD2-CD1 3.71Å; F519-L536 HydrophobicContact CD2-CG 3.77Å; F519-L536 HydrophobicContact CE2-CD1 3.62Å; F519-L536 HydrophobicContact CE2-CG 4.03Å; F519-L536 HydrophobicContact CZ-CD1 4.47Å; L536-Q541 WeakPolarHBondContact CA-O 3.16Å; L536-C542 HydrophobicContact CD2-CB 3.73Å; L536-V552 HydrophobicContact CD1-CG2 4.06Å; L536-V552 HydrophobicContact CD2-CG2 3.6Å; L536-V552 HydrophobicContact CG-CG2 4.48Å
537	N	81.9	Confident	87.5	Confident	55 Å²	55	67 Å²	67	29%	0.294	32%	0.316	S	S	.	.			trans	-103.2	173.2	166.3	66.1	19.7	0	0	0	111.3	W539 G540 Q541	N537-W539 HydrophobicContact CB-CE3 4.27Å; N537-W539 PolarHBondContact O-N 2.8Å; N537-W539 VanDerWaalsContact O-N 3.1Å; N537-W539 PolarHBondContact OD1-N 2.86Å; N537-G540 PolarHBondContact O-N 3.02Å; N537-G540 PolarHBondContact OD1-N 3.37Å; N537-Q541 PolarHBondContact N-O 2.92Å; N537-Q541 PolarHBondContact ND2-OE1 2.81Å; N537-Q541 WeakPolarHBondContact OD1-CB 3.46Å; N537-Q541 PolarHBondContact OD1-N 2.83Å
538	E	74.6	Confident	87.5	Confident	127 Å²	127	75.8 Å²	75.8	59%	0.593	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.3	-177.8	61.4	-170.6	-177.5	0	0	114.8	V469	V469-E538 HydrophobicContact CG1-CB 4.47Å
539	W	70.6	Confident	87.5	Confident	186 Å²	186	69.9 Å²	69.9	71%	0.705	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	4	173.2	-51	-70.2	0	0	0	113.6	N537	N537-W539 HydrophobicContact CB-CE3 4.27Å; N537-W539 PolarHBondContact O-N 2.8Å; N537-W539 VanDerWaalsContact O-N 3.1Å; N537-W539 PolarHBondContact OD1-N 2.86Å
540	G	75.9	Confident	87.1	Confident	35 Å²	35	73.1 Å²	73.1	36%	0.361	34%	0.337	S	S	.	.			trans	82.9	1.8	177.3	0	0	0	0	0	115.7	N537	N537-G540 PolarHBondContact O-N 3.02Å; N537-G540 PolarHBondContact OD1-N 3.37Å
541	Q	85.5	Confident	86.9	Confident	98 Å²	98	71.7 Å²	71.7	46%	0.458	33%	0.334	S	S	.	.			trans	-69.6	138.3	-180	-54.9	174.3	-25.6	0	0	110.7	L536 N537 F549 P550	L536-Q541 WeakPolarHBondContact CA-O 3.16Å; N537-Q541 PolarHBondContact N-O 2.92Å; N537-Q541 PolarHBondContact ND2-OE1 2.81Å; N537-Q541 WeakPolarHBondContact OD1-CB 3.46Å; N537-Q541 PolarHBondContact OD1-N 2.83Å; Q541-F549 CarbonylContact C-O 3.38Å; Q541-F549 WeakPolarHBondContact CA-O 3.42Å; Q541-P550 WeakPolarHBondContact CA-O 3.48Å
542	C	91.3	Very high	86.7	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.007	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.7	-176.4	-170.7	0	0	0	0	110.9	L536 F549 V552 M555	L536-C542 HydrophobicContact CD2-CB 3.73Å; C542-F549 HydrophobicContact CB-CB 4.42Å; C542-F549 PolarHBondContact N-O 3.17Å; C542-F549 PolarHBondContact O-N 2.84Å; C542-V552 HydrophobicContact CB-CG2 4.2Å; C542-M555 HydrophobicContact CB-CB 4.44Å
543	R	91.2	Very high	86.6	Confident	138 Å²	138	70.5 Å²	70.5	52%	0.521	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.7	171.9	-170.2	178.6	66.8	-153	-2.5	110.6	S535 L547 R548	S535-R543 PolarHBondContact N-O 2.88Å; S535-R543 PolarHBondContact O-N 2.94Å; R543-L547 WeakPolarHBondContact CA-O 3.48Å; R543-L547 WeakPolarHBondContact CG-O 3.32Å; R543-R548 HydrophobicContact CG-CG 4.23Å
544	V	90.9	Very high	86.5	Confident	2 Å²	2	68 Å²	68	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	111.6	-176	-173.7	0	0	0	0	109	L532 L534 H546 L547 F549 M555 F559	L532-V544 HydrophobicContact CD1-CG1 3.78Å; L532-V544 HydrophobicContact CD2-CG1 3.48Å; L532-V544 VanDerWaalsContact CD2-CG1 3.48Å; L532-V544 HydrophobicContact CG-CG1 3.49Å; L532-V544 VanDerWaalsContact CG-CG1 3.49Å; L534-V544 HydrophobicContact CD2-CB 4.48Å; L534-V544 HydrophobicContact CD2-CG1 4.21Å; L534-V544 HydrophobicContact CD2-CG2 3.48Å; L534-V544 VanDerWaalsContact CD2-CG2 3.48Å; V544-H546 PolarHBondContact O-N 2.88Å; V544-H546 VanDerWaalsContact O-N 3.13Å; V544-L547 PolarHBondContact N-O 3.35Å; V544-L547 WeakPolarHBondContact O-CA 3.28Å; V544-L547 WeakPolarHBondContact O-CB 3.35Å; V544-L547 PolarHBondContact O-N 3.11Å; V544-F549 HydrophobicContact CB-CE2 4.36Å; V544-F549 HydrophobicContact CG2-CD2 4.39Å; V544-F549 HydrophobicContact CG2-CE2 4.33Å; V544-M555 HydrophobicContact CG2-CG 3.7Å; V544-M555 HydrophobicContact CG2-SD 4.32Å; V544-F559 HydrophobicContact CG1-CE2 4.19Å; V544-F559 HydrophobicContact CG1-CZ 4.33Å
545	Q	86.8	Confident	86.5	Confident	96 Å²	96	68 Å²	68	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	-117.3	-166.7	-55.6	172.3	8.8	0	0	110.7	L532 P565	L532-Q545 HydrophobicContact CD1-CG 4.08Å; Q545-P565 PolarHBondContact NE2-O 2.91Å; Q545-P565 VanDerWaalsContact NE2-O 3.07Å
546	H	81.6	Confident	86.6	Confident	127 Å²	127	67 Å²	67	59%	0.588	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-14.7	176.3	60.1	-89.1	0	0	0	113.7	V544	V544-H546 PolarHBondContact O-N 2.88Å; V544-H546 VanDerWaalsContact O-N 3.13Å
547	L	88	Confident	86.7	Confident	45 Å²	45	66.6 Å²	66.6	24%	0.236	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	145.7	-178.1	-58.8	173	0	0	0	111.3	R543 V544 F549 F559 P565	R543-L547 WeakPolarHBondContact CA-O 3.48Å; R543-L547 WeakPolarHBondContact CG-O 3.32Å; V544-L547 PolarHBondContact N-O 3.35Å; V544-L547 WeakPolarHBondContact O-CA 3.28Å; V544-L547 WeakPolarHBondContact O-CB 3.35Å; V544-L547 PolarHBondContact O-N 3.11Å; L547-F549 HydrophobicContact CB-CE2 3.65Å; L547-F549 HydrophobicContact CB-CZ 3.84Å; L547-F549 HydrophobicContact CD1-CE2 4.45Å; L547-F549 HydrophobicContact CD1-CZ 4.09Å; L547-F559 HydrophobicContact CD1-CE1 3.95Å; L547-F559 HydrophobicContact CD1-CZ 3.89Å; L547-P565 HydrophobicContact CD1-CG 4.19Å
548	R	89.8	Confident	87.1	Confident	203 Å²	203	66.9 Å²	66.9	77%	0.766	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.7	179.1	-62.1	179.4	-178.8	88.4	-9.9	109.2	R543	R543-R548 HydrophobicContact CG-CG 4.23Å
549	F	90.5	Very high	87.9	Confident	23 Å²	23	60.9 Å²	60.9	10%	0.101	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	146.6	-177.6	-57.5	-80.4	0	0	0	110.5	Q541 C542 V544 L547 S551 D554 M555 H558 F559	Q541-F549 CarbonylContact C-O 3.38Å; Q541-F549 WeakPolarHBondContact CA-O 3.42Å; C542-F549 HydrophobicContact CB-CB 4.42Å; C542-F549 PolarHBondContact N-O 3.17Å; C542-F549 PolarHBondContact O-N 2.84Å; V544-F549 HydrophobicContact CB-CE2 4.36Å; V544-F549 HydrophobicContact CG2-CD2 4.39Å; V544-F549 HydrophobicContact CG2-CE2 4.33Å; L547-F549 HydrophobicContact CB-CE2 3.65Å; L547-F549 HydrophobicContact CB-CZ 3.84Å; L547-F549 HydrophobicContact CD1-CE2 4.45Å; L547-F549 HydrophobicContact CD1-CZ 4.09Å; F549-S551 PolarHBondContact O-N 3.34Å; F549-D554 HydrophobicContact CB-CB 4.3Å; F549-M555 HydrophobicContact CB-CB 3.94Å; F549-M555 HydrophobicContact CD1-CB 4.32Å; F549-M555 HydrophobicContact CD2-CB 3.51Å; F549-M555 HydrophobicContact CD2-CG 3.53Å; F549-M555 HydrophobicContact CE2-CB 4.04Å; F549-M555 HydrophobicContact CE2-CG 3.65Å; F549-M555 HydrophobicContact CG-CB 3.66Å; F549-M555 HydrophobicContact CG-CG 4.2Å; F549-M555 HydrophobicContact CZ-CG 4.41Å; F549-H558 HydrophobicContact CD1-CB 4.31Å; F549-H558 HydrophobicContact CE1-CB 3.63Å; F549-H558 AromaticContact CE1-CD2 3.64Å; F549-H558 AromaticContact CE1-CG 3.54Å; F549-H558 HydrophobicContact CZ-CB 4.28Å; F549-H558 AromaticContact CZ-CD2 3.63Å; F549-F559 HydrophobicContact CE2-CE2 4.33Å; F549-F559 HydrophobicContact CE2-CZ 4.22Å; F549-F559 HydrophobicContact CZ-CE2 4.48Å; F549-F559 HydrophobicContact CZ-CZ 4.15Å
550	P	86.1	Confident	88.9	Confident	92 Å²	92	55.7 Å²	55.7	60%	0.597	27%	0.27	S	S	*	.	S	Bend	trans	-62.3	-27.3	-179.8	-21.8	33.1	0	0	0	114	Q541 D554	Q541-P550 WeakPolarHBondContact CA-O 3.48Å; P550-D554 WeakPolarHBondContact CB-OD2 3.48Å
551	S	88.8	Confident	89.4	Confident	32 Å²	32	59.5 Å²	59.5	22%	0.224	28%	0.281	C	S	.	.	S	Bend	trans	-151.3	175	174.3	75.4	0	0	0	0	112.4	F549 M553 D554 M555	F549-S551 PolarHBondContact O-N 3.34Å; S551-M553 VanDerWaalsContact C-N 3.29Å; S551-M553 PolarHBondContact OG-N 3.48Å; S551-M553 VanDerWaalsContact OG-N 3.16Å; S551-D554 VanDerWaalsContact CB-OD2 3.27Å; S551-D554 WeakPolarHBondContact CB-OD2 3.34Å; S551-D554 PolarHBondContact N-OD2 2.87Å; S551-D554 PolarHBondContact OG-N 3.02Å; S551-D554 PolarHBondContact OG-OD2 2.81Å; S551-M555 PolarHBondContact O-N 3.08Å
552	V	90.3	Very high	89.6	Confident	9 Å²	9	61.3 Å²	61.3	6%	0.055	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-35.3	168.8	-178.8	0	0	0	0	111.5	L477 W482 L536 C542 M555 L556	L477-V552 HydrophobicContact CD2-CB 4.38Å; L477-V552 HydrophobicContact CD2-CG2 4.26Å; W482-V552 HydrophobicContact CH2-CB 4.23Å; W482-V552 HydrophobicContact CH2-CG1 3.51Å; W482-V552 HydrophobicContact CZ2-CG1 4.41Å; W482-V552 HydrophobicContact CZ3-CG1 3.89Å; L536-V552 HydrophobicContact CD1-CG2 4.06Å; L536-V552 HydrophobicContact CD2-CG2 3.6Å; L536-V552 HydrophobicContact CG-CG2 4.48Å; C542-V552 HydrophobicContact CB-CG2 4.2Å; V552-M555 HydrophobicContact CG1-CE 3.82Å; V552-M555 WeakPolarHBondContact O-CB 3.33Å; V552-M555 PolarHBondContact O-N 3.36Å; V552-L556 HydrophobicContact CG1-CD1 4.26Å; V552-L556 HydrophobicContact CG1-CG 4.39Å; V552-L556 WeakPolarHBondContact O-CG 3.21Å; V552-L556 PolarHBondContact O-N 2.65Å
553	M	89.9	Confident	89.5	Confident	37 Å²	37	64.3 Å²	64.3	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-38.3	-179.7	-175.9	59.5	77.2	0	0	111.6	F480 W482 S551 M555 L556 S557 F600 W605	F480-M553 HydrophobicContact CD1-CE 3.71Å; F480-M553 HydrophobicContact CE1-CE 3.55Å; W482-M553 HydrophobicContact CZ2-CE 4.06Å; S551-M553 VanDerWaalsContact C-N 3.29Å; S551-M553 PolarHBondContact OG-N 3.48Å; S551-M553 VanDerWaalsContact OG-N 3.16Å; M553-M555 VanDerWaalsContact C-N 3.32Å; M553-M555 PolarHBondContact O-N 3.36Å; M553-L556 PolarHBondContact O-N 3.15Å; M553-S557 VanDerWaalsContact O-CB 3.28Å; M553-S557 WeakPolarHBondContact O-CB 3.48Å; M553-S557 PolarHBondContact O-N 3.23Å; M553-S557 PolarHBondContact O-OG 3.5Å; M553-F600 HydrophobicContact SD-CZ 4.39Å; M553-W605 HydrophobicContact CE-CD2 3.79Å; M553-W605 HydrophobicContact CE-CE3 4.13Å; M553-W605 HydrophobicContact CE-CG 4.08Å; M553-W605 HydrophobicContact CE-CZ2 4.4Å
554	D	90.2	Very high	89.4	Confident	66 Å²	66	58.1 Å²	58.1	35%	0.353	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-39.1	175.5	-55.5	-61.5	0	0	0	111.4	F549 P550 S551 S557 H558	F549-D554 HydrophobicContact CB-CB 4.3Å; P550-D554 WeakPolarHBondContact CB-OD2 3.48Å; S551-D554 VanDerWaalsContact CB-OD2 3.27Å; S551-D554 WeakPolarHBondContact CB-OD2 3.34Å; S551-D554 PolarHBondContact N-OD2 2.87Å; S551-D554 PolarHBondContact OG-N 3.02Å; S551-D554 PolarHBondContact OG-OD2 2.81Å; D554-S557 PolarHBondContact O-N 3.49Å; D554-H558 WeakPolarHBondContact O-CB 3.29Å; D554-H558 PolarHBondContact O-N 3.08Å
555	M	94.1	Very high	88.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-46.6	175.2	179.8	-83.5	-59.3	0	0	112.2	L521 L534 C542 V544 F549 S551 V552 M553 S557 H558 F559	L521-M555 HydrophobicContact CD2-SD 4.11Å; L534-M555 HydrophobicContact CD1-CE 3.72Å; L534-M555 HydrophobicContact CD2-CE 3.8Å; L534-M555 HydrophobicContact CD2-SD 4.2Å; L534-M555 HydrophobicContact CG-CE 4.41Å; C542-M555 HydrophobicContact CB-CB 4.44Å; V544-M555 HydrophobicContact CG2-CG 3.7Å; V544-M555 HydrophobicContact CG2-SD 4.32Å; F549-M555 HydrophobicContact CB-CB 3.94Å; F549-M555 HydrophobicContact CD1-CB 4.32Å; F549-M555 HydrophobicContact CD2-CB 3.51Å; F549-M555 HydrophobicContact CD2-CG 3.53Å; F549-M555 HydrophobicContact CE2-CB 4.04Å; F549-M555 HydrophobicContact CE2-CG 3.65Å; F549-M555 HydrophobicContact CG-CB 3.66Å; F549-M555 HydrophobicContact CG-CG 4.2Å; F549-M555 HydrophobicContact CZ-CG 4.41Å; S551-M555 PolarHBondContact O-N 3.08Å; V552-M555 HydrophobicContact CG1-CE 3.82Å; V552-M555 WeakPolarHBondContact O-CB 3.33Å; V552-M555 PolarHBondContact O-N 3.36Å; M553-M555 VanDerWaalsContact C-N 3.32Å; M553-M555 PolarHBondContact O-N 3.36Å; M555-S557 VanDerWaalsContact C-N 3.35Å; M555-H558 PolarHBondContact O-N 3.48Å; M555-F559 HydrophobicContact CG-CD2 4.02Å; M555-F559 HydrophobicContact CG-CE2 3.76Å; M555-F559 WeakPolarHBondContact O-CD2 3.37Å; M555-F559 PolarHBondContact O-N 3Å; M555-F559 HydrophobicContact SD-CD2 3.49Å; M555-F559 WeakPolarHBondContact SD-CD2 3.28Å; M555-F559 HydrophobicContact SD-CE2 3.61Å
556	L	93.1	Very high	88.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-38.8	174.8	-64.8	175.5	0	0	0	111.8	W482 F507 V509 L521 V552 M553 R560 L576 F600	W482-L556 HydrophobicContact CD2-CD1 3.77Å; W482-L556 HydrophobicContact CE3-CD1 4Å; W482-L556 HydrophobicContact CG-CD1 4.42Å; W482-L556 HydrophobicContact CH2-CD1 3.93Å; W482-L556 HydrophobicContact CZ2-CD1 3.64Å; W482-L556 HydrophobicContact CZ3-CD1 4.1Å; F507-L556 HydrophobicContact CD2-CD2 4.08Å; F507-L556 HydrophobicContact CE2-CD1 3.97Å; F507-L556 HydrophobicContact CE2-CD2 3.65Å; F507-L556 HydrophobicContact CE2-CG 4.37Å; F507-L556 HydrophobicContact CZ-CD1 4.41Å; F507-L556 HydrophobicContact CZ-CD2 4.21Å; V509-L556 HydrophobicContact CG2-CD1 4.42Å; V509-L556 HydrophobicContact CG2-CD2 4.23Å; L521-L556 HydrophobicContact CD1-CD2 3.84Å; L521-L556 HydrophobicContact CD2-CD2 4.37Å; V552-L556 HydrophobicContact CG1-CD1 4.26Å; V552-L556 HydrophobicContact CG1-CG 4.39Å; V552-L556 WeakPolarHBondContact O-CG 3.21Å; V552-L556 PolarHBondContact O-N 2.65Å; M553-L556 PolarHBondContact O-N 3.15Å; L556-R560 PolarHBondContact O-N 3.03Å; L556-R560 VanDerWaalsContact O-N 3.11Å; L556-L576 HydrophobicContact CB-CD1 4.36Å; L556-L576 HydrophobicContact CD2-CD1 3.6Å; L556-F600 HydrophobicContact CB-CE1 4.31Å; L556-F600 HydrophobicContact CB-CZ 3.89Å
557	S	89.5	Confident	87.8	Confident	26 Å²	26	62.1 Å²	62.1	18%	0.182	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-38.3	177.3	-58.5	0	0	0	0	112	M553 D554 M555 R560 L602	M553-S557 VanDerWaalsContact O-CB 3.28Å; M553-S557 WeakPolarHBondContact O-CB 3.48Å; M553-S557 PolarHBondContact O-N 3.23Å; M553-S557 PolarHBondContact O-OG 3.5Å; D554-S557 PolarHBondContact O-N 3.49Å; M555-S557 VanDerWaalsContact C-N 3.35Å; S557-R560 WeakPolarHBondContact O-CB 3.48Å; S557-L602 WeakPolarHBondContact OG-CD2 3.08Å
558	H	89.9	Confident	86.3	Confident	62 Å²	62	62.5 Å²	62.5	29%	0.287	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-52.3	173.7	179.8	83.5	0	0	0	111.1	F549 D554 M555 R560 L561 Y562	F549-H558 HydrophobicContact CD1-CB 4.31Å; F549-H558 HydrophobicContact CE1-CB 3.63Å; F549-H558 AromaticContact CE1-CD2 3.64Å; F549-H558 AromaticContact CE1-CG 3.54Å; F549-H558 HydrophobicContact CZ-CB 4.28Å; F549-H558 AromaticContact CZ-CD2 3.63Å; D554-H558 WeakPolarHBondContact O-CB 3.29Å; D554-H558 PolarHBondContact O-N 3.08Å; M555-H558 PolarHBondContact O-N 3.48Å; H558-R560 PolarHBondContact O-N 2.93Å; H558-R560 VanDerWaalsContact O-N 3.14Å; H558-L561 PolarHBondContact O-N 2.93Å; H558-Y562 AromaticContact CE1-CD2 3.44Å; H558-Y562 VanDerWaalsContact CE1-CD2 3.44Å; H558-Y562 WeakPolarHBondContact CE1-CD2 3.23Å; H558-Y562 AromaticContact CE1-CG 3.79Å; H558-Y562 AromaticContact ND1-CD2 3.35Å; H558-Y562 WeakPolarHBondContact ND1-CD2 3.34Å; H558-Y562 AromaticContact ND1-CE2 3.91Å; H558-Y562 PolarHBondContact O-N 2.94Å
559	F	92.6	Very high	84.6	Confident	1 Å²	1	55.8 Å²	55.8	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-71.3	-5.7	-178.7	-66	-44.4	0	0	0	115	L521 L532 V544 L547 F549 M555 Y562 I564 T575 L576	L521-F559 HydrophobicContact CD2-CD2 4.45Å; L532-F559 HydrophobicContact CD2-CE2 4.1Å; L532-F559 HydrophobicContact CD2-CZ 4.47Å; V544-F559 HydrophobicContact CG1-CE2 4.19Å; V544-F559 HydrophobicContact CG1-CZ 4.33Å; L547-F559 HydrophobicContact CD1-CE1 3.95Å; L547-F559 HydrophobicContact CD1-CZ 3.89Å; F549-F559 HydrophobicContact CE2-CE2 4.33Å; F549-F559 HydrophobicContact CE2-CZ 4.22Å; F549-F559 HydrophobicContact CZ-CE2 4.48Å; F549-F559 HydrophobicContact CZ-CZ 4.15Å; M555-F559 HydrophobicContact CG-CD2 4.02Å; M555-F559 HydrophobicContact CG-CE2 3.76Å; M555-F559 WeakPolarHBondContact O-CD2 3.37Å; M555-F559 PolarHBondContact O-N 3Å; M555-F559 HydrophobicContact SD-CD2 3.49Å; M555-F559 WeakPolarHBondContact SD-CD2 3.28Å; M555-F559 HydrophobicContact SD-CE2 3.61Å; F559-Y562 CarbonylContact C-O 3.55Å; F559-Y562 VanDerWaalsContact CA-O 3.28Å; F559-Y562 WeakPolarHBondContact CA-O 3.29Å; F559-I564 HydrophobicContact CB-CG1 3.88Å; F559-I564 HydrophobicContact CD1-CB 4.37Å; F559-I564 HydrophobicContact CD1-CG1 3.82Å; F559-I564 HydrophobicContact CD2-CG1 4.29Å; F559-I564 HydrophobicContact CE1-CG1 4.44Å; F559-I564 HydrophobicContact CG-CG1 3.76Å; F559-T575 CarbonylContact O-C 3.55Å; F559-T575 WeakPolarHBondContact O-CA 3.24Å; F559-T575 WeakPolarHBondContact O-CB 3.43Å; F559-L576 HydrophobicContact CB-CD1 3.84Å; F559-L576 HydrophobicContact CB-CG 3.89Å; F559-L576 PolarHBondContact O-N 3.28Å
560	R	90.6	Very high	82.6	Confident	76 Å²	76	60.4 Å²	60.4	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-74.3	-35.4	164.8	-179.1	-134.5	-175.7	81.4	15.3	112.3	L556 S557 H558 T575 F600	L556-R560 PolarHBondContact O-N 3.03Å; L556-R560 VanDerWaalsContact O-N 3.11Å; S557-R560 WeakPolarHBondContact O-CB 3.48Å; H558-R560 PolarHBondContact O-N 2.93Å; H558-R560 VanDerWaalsContact O-N 3.14Å; R560-T575 WeakPolarHBondContact O-CB 3.29Å; R560-F600 HydrophobicContact CB-CD1 4Å; R560-F600 HydrophobicContact CB-CE1 3.94Å; R560-F600 HydrophobicContact CG-CD1 3.92Å; R560-F600 HydrophobicContact CG-CE1 4.26Å; R560-F600 VanDerWaalsContact NH1-C 3.26Å; R560-F600 PolarHBondContact NH1-O 3.37Å; R560-F600 PolarHBondContact NH2-O 3.04Å
561	L	87	Confident	80.8	Confident	115 Å²	115	58.3 Å²	58.3	60%	0.602	34%	0.339	S	S	*	.	H	α-helix	trans	-99.1	-36.3	-174	-60.9	177.7	0	0	0	112.4	H558	H558-L561 PolarHBondContact O-N 2.93Å
562	Y	88.8	Confident	79.4	Confident	136 Å²	136	59.1 Å²	59.1	53%	0.533	35%	0.353	S	S	.	.	S	Bend	trans	-112.9	137.4	-179.8	-57.1	-80.5	0	0	0	109.3	H558 F559	H558-Y562 AromaticContact CE1-CD2 3.44Å; H558-Y562 VanDerWaalsContact CE1-CD2 3.44Å; H558-Y562 WeakPolarHBondContact CE1-CD2 3.23Å; H558-Y562 AromaticContact CE1-CG 3.79Å; H558-Y562 AromaticContact ND1-CD2 3.35Å; H558-Y562 WeakPolarHBondContact ND1-CD2 3.34Å; H558-Y562 AromaticContact ND1-CE2 3.91Å; H558-Y562 PolarHBondContact O-N 2.94Å; F559-Y562 CarbonylContact C-O 3.55Å; F559-Y562 VanDerWaalsContact CA-O 3.28Å; F559-Y562 WeakPolarHBondContact CA-O 3.29Å
563	P	89.3	Confident	79	Confident	65 Å²	65	62.4 Å²	62.4	42%	0.422	38%	0.38	S	S	.	.			trans	-68.1	145.7	-177.5	27.8	-34.6	0	0	0	111.9	A573 V574 T575	P563-A573 HydrophobicContact CB-CB 3.54Å; P563-A573 HydrophobicContact CG-CB 3.93Å; P563-V574 CarbonylContact C-O 3.46Å; P563-V574 VanDerWaalsContact CA-O 3.25Å; P563-V574 WeakPolarHBondContact CA-O 3.4Å; P563-T575 HydrophobicContact CB-CG2 4.43Å
564	I	89.4	Confident	79	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.036	37%	0.372	C	S	.	.			trans	-63.8	126.4	176	-57.4	173.6	0	0	0	108.9	L521 F523 L532 F559 L566 V574 L576	L521-I564 HydrophobicContact CD2-CD1 4.49Å; F523-I564 HydrophobicContact CD1-CD1 4.06Å; F523-I564 HydrophobicContact CD2-CD1 4.17Å; F523-I564 HydrophobicContact CE1-CD1 3.78Å; F523-I564 HydrophobicContact CE2-CD1 3.91Å; F523-I564 HydrophobicContact CG-CD1 4.24Å; F523-I564 HydrophobicContact CZ-CD1 3.69Å; F523-I564 HydrophobicContact CZ-CG2 4.38Å; L532-I564 HydrophobicContact CD2-CG2 3.71Å; F559-I564 HydrophobicContact CB-CG1 3.88Å; F559-I564 HydrophobicContact CD1-CB 4.37Å; F559-I564 HydrophobicContact CD1-CG1 3.82Å; F559-I564 HydrophobicContact CD2-CG1 4.29Å; F559-I564 HydrophobicContact CE1-CG1 4.44Å; F559-I564 HydrophobicContact CG-CG1 3.76Å; I564-L566 HydrophobicContact CG2-CD2 3.89Å; I564-L566 HydrophobicContact CG2-CG 4.14Å; I564-L566 PolarHBondContact O-N 3.16Å; I564-L566 VanDerWaalsContact O-N 3.13Å; I564-V574 HydrophobicContact CB-CG1 4.13Å; I564-V574 HydrophobicContact CD1-CG1 4.5Å; I564-V574 PolarHBondContact N-O 3.32Å; I564-L576 HydrophobicContact CD1-CD2 3.97Å
565	P	80.9	Confident	79.1	Confident	51 Å²	51	60.1 Å²	60.1	33%	0.331	37%	0.371	S	S	.	.			trans	-68.9	111.4	174.6	27.5	-33	0	0	0	110.1	Q545 L547	Q545-P565 PolarHBondContact NE2-O 2.91Å; Q545-P565 VanDerWaalsContact NE2-O 3.07Å; L547-P565 HydrophobicContact CD1-CG 4.19Å
566	L	77.7	Confident	79.1	Confident	54 Å²	54	60.2 Å²	60.2	28%	0.283	37%	0.372	S	S	.	.			trans	-123.6	134.9	177.3	-61.2	179.9	0	0	0	109.9	F523 Y525 I564 C568 V574	F523-L566 HydrophobicContact CE2-CD1 4.26Å; F523-L566 HydrophobicContact CZ-CD1 4.04Å; F523-L566 HydrophobicContact CZ-CD2 4.17Å; Y525-L566 HydrophobicContact CD2-CD1 4.19Å; Y525-L566 HydrophobicContact CE2-CD1 4.16Å; I564-L566 HydrophobicContact CG2-CD2 3.89Å; I564-L566 HydrophobicContact CG2-CG 4.14Å; I564-L566 PolarHBondContact O-N 3.16Å; I564-L566 VanDerWaalsContact O-N 3.13Å; L566-C568 HydrophobicContact CB-CB 4.22Å; L566-C568 PolarHBondContact O-N 3.33Å; L566-V574 HydrophobicContact CD1-CG1 3.73Å
567	E	67.9	Low	78.9	Confident	205 Å²	205	62.8 Å²	62.8	96%	0.958	39%	0.39	S	S	*	.			trans	-71.3	14.9	173.5	-61.1	167.6	174.1	0	0	112.8	G569	E567-G569 PolarHBondContact O-N 3.05Å
568	C	56.3	Low	79	Confident	52 Å²	52	62.4 Å²	62.4	35%	0.351	39%	0.387	S	S	.	.			trans	-88.2	98.5	-176	-155.3	0	0	0	0	109	Y525 K530 L566	Y525-C568 HydrophobicContact CE1-CB 4.43Å; K530-C568 PolarHBondContact NZ-SG 3.07Å; L566-C568 HydrophobicContact CB-CB 4.22Å; L566-C568 PolarHBondContact O-N 3.33Å
569	G	53.9	Low	79.1	Confident	62 Å²	62	60 Å²	60	64%	0.639	38%	0.376	S	S	*	.			trans	-57.2	147.5	-168.7	0	0	0	0	0	116.2	E567 A571	E567-G569 PolarHBondContact O-N 3.05Å; G569-A571 PolarHBondContact O-N 3.38Å
570	A	47.3	Very low	79	Confident	120 Å²	120	60 Å²	60	99%	0.992	38%	0.376	S	S	*	.	S	Bend	trans	61.4	-20.6	163.2	0	0	0	0	0	120.1
571	A	49.5	Very low	78.8	Confident	49 Å²	49	58.7 Å²	58.7	41%	0.405	37%	0.374	S	S	.	.	S	Bend	trans	-111.7	56	-164	0	0	0	0	0	115.5	Y525 Q526 G569	Y525-A571 PolarHBondContact OH-O 3.19Å; Q526-A571 PolarHBondContact NE2-O 2.97Å; G569-A571 PolarHBondContact O-N 3.38Å
572	G	59.6	Low	78.4	Confident	49 Å²	49	55.4 Å²	55.4	51%	0.505	36%	0.364	S	S	.	.			trans	91.1	142.3	163.5	0	0	0	0	0	116.2	Y525	Y525-G572 WeakPolarHBondContact CE2-O 3.31Å; Y525-G572 PolarHBondContact OH-O 2.93Å
573	A	81.5	Confident	77.4	Confident	77 Å²	77	52.7 Å²	52.7	64%	0.636	38%	0.377	S	S	*	.			trans	-95.3	132.9	-177.1	0	0	0	0	0	110.3	P563	P563-A573 HydrophobicContact CB-CB 3.54Å; P563-A573 HydrophobicContact CG-CB 3.93Å
574	V	89.1	Confident	76.1	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	36%	0.363	C	S	.	.			trans	-111.3	124.2	-169.6	52.9	0	0	0	0	112.7	H504 F523 Y525 P563 I564 L566	H504-V574 VanDerWaalsContact NE2-CB 3.34Å; H504-V574 WeakPolarHBondContact NE2-CB 3.48Å; H504-V574 VanDerWaalsContact NE2-CG2 3.34Å; H504-V574 WeakPolarHBondContact NE2-CG2 3.36Å; F523-V574 HydrophobicContact CD2-CG2 4.14Å; F523-V574 HydrophobicContact CE2-CG1 3.9Å; F523-V574 HydrophobicContact CE2-CG2 4.1Å; Y525-V574 HydrophobicContact CD2-CB 3.66Å; Y525-V574 HydrophobicContact CD2-CG1 3.61Å; Y525-V574 HydrophobicContact CD2-CG2 4.16Å; Y525-V574 HydrophobicContact CE2-CB 3.89Å; Y525-V574 HydrophobicContact CE2-CG1 3.77Å; P563-V574 CarbonylContact C-O 3.46Å; P563-V574 VanDerWaalsContact CA-O 3.25Å; P563-V574 WeakPolarHBondContact CA-O 3.4Å; I564-V574 HydrophobicContact CB-CG1 4.13Å; I564-V574 HydrophobicContact CD1-CG1 4.5Å; I564-V574 PolarHBondContact N-O 3.32Å; L566-V574 HydrophobicContact CD1-CG1 3.73Å
575	T	92.5	Very high	74.4	Confident	54 Å²	54	54.7 Å²	54.7	33%	0.331	39%	0.389	S	S	.	.			trans	-109	158.1	170	51.5	0	0	0	0	111.4	G505 F559 R560 P563 S577	G505-T575 WeakPolarHBondContact CA-O 3.1Å; F559-T575 CarbonylContact O-C 3.55Å; F559-T575 WeakPolarHBondContact O-CA 3.24Å; F559-T575 WeakPolarHBondContact O-CB 3.43Å; R560-T575 WeakPolarHBondContact O-CB 3.29Å; P563-T575 HydrophobicContact CB-CG2 4.43Å; T575-S577 PolarHBondContact O-N 3.29Å
576	L	93.9	Very high	73.1	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	39%	0.387	C	S	.	.			trans	-77.8	114.3	177.6	-61.2	-174.3	0	0	0	111.1	F507 L521 F523 L556 F559 I564	F507-L576 HydrophobicContact CB-CD2 3.91Å; F507-L576 HydrophobicContact CD1-CB 3.79Å; F507-L576 HydrophobicContact CD1-CD1 4.13Å; F507-L576 HydrophobicContact CD1-CD2 3.82Å; F507-L576 HydrophobicContact CD1-CG 4.12Å; F507-L576 HydrophobicContact CE1-CB 3.81Å; F507-L576 HydrophobicContact CE1-CD1 4.16Å; F507-L576 HydrophobicContact CE1-CG 4.41Å; F507-L576 HydrophobicContact CG-CD1 4.33Å; F507-L576 HydrophobicContact CG-CD2 3.96Å; F507-L576 HydrophobicContact CZ-CD1 4.38Å; L521-L576 HydrophobicContact CD2-CD1 4.21Å; L521-L576 HydrophobicContact CD2-CD2 4.43Å; F523-L576 HydrophobicContact CB-CD2 4.36Å; L556-L576 HydrophobicContact CB-CD1 4.36Å; L556-L576 HydrophobicContact CD2-CD1 3.6Å; F559-L576 HydrophobicContact CB-CD1 3.84Å; F559-L576 HydrophobicContact CB-CG 3.89Å; F559-L576 PolarHBondContact O-N 3.28Å; I564-L576 HydrophobicContact CD1-CD2 3.97Å
577	S	90.2	Very high	71.8	Confident	54 Å²	54	53.9 Å²	53.9	38%	0.378	39%	0.387	S	S	.	.			trans	-100	-44.7	-171.9	63.7	0	0	0	0	113.1	H504 G505 V506 T575 F600	H504-S577 PolarHBondContact O-OG 2.92Å; G505-S577 PolarHBondContact O-N 3.23Å; G505-S577 PolarHBondContact O-OG 3.01Å; V506-S577 PolarHBondContact N-OG 3.46Å; T575-S577 PolarHBondContact O-N 3.29Å; S577-F600 PolarHBondContact O-N 3.23Å
578	S	90.3	Very high	70.7	Confident	18 Å²	18	47.8 Å²	47.8	13%	0.126	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	159.3	-174	54	0	0	0	0	110.6	V506 F507 V598	V506-S578 CarbonylContact C-O 3.49Å; V506-S578 VanDerWaalsContact CA-O 3.29Å; V506-S578 WeakPolarHBondContact CA-O 3.49Å; V506-S578 WeakPolarHBondContact CG2-OG 3.06Å; F507-S578 WeakPolarHBondContact CD1-O 3.32Å; F507-S578 PolarHBondContact N-O 3.35Å; S578-V598 CarbonylContact C-O 3.6Å; S578-V598 VanDerWaalsContact CA-O 3.28Å; S578-V598 WeakPolarHBondContact CA-O 3.19Å; S578-V598 VanDerWaalsContact CB-O 3.28Å; S578-V598 WeakPolarHBondContact CB-O 3.42Å
579	F	92.1	Very high	70.1	Confident	12 Å²	12	55.3 Å²	55.3	5%	0.053	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.5	178.6	65.7	-92.2	0	0	0	112.5	P481 W482 F507 L581 L597 V598 F600	P481-F579 HydrophobicContact CB-CE2 4.14Å; W482-F579 HydrophobicContact CB-CB 3.78Å; W482-F579 HydrophobicContact CB-CD1 4.5Å; W482-F579 HydrophobicContact CB-CD2 3.68Å; W482-F579 HydrophobicContact CB-CE2 4.37Å; W482-F579 HydrophobicContact CB-CG 3.75Å; F507-F579 HydrophobicContact CD1-CB 4.33Å; F507-F579 HydrophobicContact CD2-CB 4.36Å; F507-F579 HydrophobicContact CE1-CB 3.99Å; F507-F579 HydrophobicContact CE2-CB 4.01Å; F507-F579 HydrophobicContact CZ-CB 3.83Å; F507-F579 CarbonylContact O-C 3.59Å; F507-F579 WeakPolarHBondContact O-CA 3.18Å; F579-L581 HydrophobicContact CE2-CD2 4.05Å; F579-L581 HydrophobicContact CE2-CG 4.33Å; F579-L597 WeakPolarHBondContact O-CA 3.42Å; F579-V598 HydrophobicContact CD1-CB 4.28Å; F579-V598 HydrophobicContact CD1-CG1 4.49Å; F579-V598 HydrophobicContact CD2-CB 4.33Å; F579-V598 HydrophobicContact CE1-CB 3.8Å; F579-V598 HydrophobicContact CE1-CG1 3.64Å; F579-V598 HydrophobicContact CE2-CB 3.86Å; F579-V598 HydrophobicContact CE2-CG1 4.32Å; F579-V598 HydrophobicContact CE2-CG2 4.25Å; F579-V598 HydrophobicContact CZ-CB 3.58Å; F579-V598 HydrophobicContact CZ-CG1 3.54Å; F579-V598 HydrophobicContact CZ-CG2 4.25Å; F579-V598 PolarHBondContact N-O 2.9Å; F579-V598 PolarHBondContact O-N 3.38Å; F579-F600 HydrophobicContact CD1-CB 4.41Å; F579-F600 HydrophobicContact CD1-CD2 4.03Å; F579-F600 HydrophobicContact CE1-CD2 4.39Å
580	V	90.5	Very high	69.8	Low	0 Å²	0	56.5 Å²	56.5	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.5	170.5	-173.2	0	0	0	0	109.1	H484 L495 V496 V506 F507 L508 A582 S584 A595 L597	H484-V580 PolarHBondContact NE2-O 2.79Å; L495-V580 HydrophobicContact CB-CG1 4.26Å; L495-V580 HydrophobicContact CB-CG2 4.44Å; L495-V580 HydrophobicContact CD2-CG1 4.33Å; V496-V580 HydrophobicContact CG1-CG2 4.07Å; V506-V580 HydrophobicContact CG1-CG2 3.69Å; F507-V580 PolarHBondContact O-N 3.41Å; L508-V580 HydrophobicContact CB-CB 4.45Å; L508-V580 HydrophobicContact CD2-CB 4.23Å; L508-V580 HydrophobicContact CD2-CG2 4.27Å; V580-A582 PolarHBondContact O-N 3.33Å; V580-S584 VanDerWaalsContact CG1-OG 3.29Å; V580-S584 WeakPolarHBondContact CG1-OG 3.29Å; V580-A595 HydrophobicContact CG1-CB 3.92Å; V580-L597 HydrophobicContact CB-CD2 4.5Å; V580-L597 HydrophobicContact CG2-CD2 3.81Å
581	L	87.2	Confident	69.4	Low	49 Å²	49	56.9 Å²	56.9	26%	0.257	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64.6	132.1	175.4	-87.5	164.7	0	0	0	112.9	P481 H484 F579 S584 L596 V598	P481-L581 HydrophobicContact CB-CD2 3.66Å; H484-L581 PolarHBondContact CE1-O 2.92Å; H484-L581 VanDerWaalsContact CE1-O 3.27Å; F579-L581 HydrophobicContact CE2-CD2 4.05Å; F579-L581 HydrophobicContact CE2-CG 4.33Å; L581-S584 WeakPolarHBondContact O-CB 3.28Å; L581-S584 PolarHBondContact O-N 2.89Å; L581-S584 PolarHBondContact O-OG 3.01Å; L581-L596 HydrophobicContact CB-CB 4.26Å; L581-L596 HydrophobicContact CD1-CB 3.77Å; L581-L596 HydrophobicContact CD1-CD1 4.32Å; L581-L596 PolarHBondContact N-O 2.69Å; L581-V598 HydrophobicContact CD1-CG2 3.49Å; L581-V598 VanDerWaalsContact CD1-CG2 3.49Å; L581-V598 HydrophobicContact CD2-CG2 4.26Å; L581-V598 HydrophobicContact CG-CG2 3.65Å
582	A	79.3	Confident	68.8	Low	46 Å²	46	63.2 Å²	63.2	38%	0.38	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	139.2	167	0	0	0	0	0	110.9	P481 F483 H484 V580 S584	P481-A582 PolarHBondContact O-N 3.19Å; F483-A582 WeakPolarHBondContact O-CB 3.36Å; H484-A582 PolarHBondContact NE2-N 3.04Å; V580-A582 PolarHBondContact O-N 3.33Å; A582-S584 VanDerWaalsContact C-N 3.32Å
583	G	66.8	Low	68.1	Low	79 Å²	79	64.1 Å²	64.1	81%	0.814	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-6	-175.4	0	0	0	0	0	115.3	T585	G583-T585 PolarHBondContact O-N 3.09Å
584	S	61.7	Low	66.9	Low	17 Å²	17	62.5 Å²	62.5	12%	0.119	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-66.4	127.3	172.1	68.6	0	0	0	0	111.6	V580 L581 A582	V580-S584 VanDerWaalsContact CG1-OG 3.29Å; V580-S584 WeakPolarHBondContact CG1-OG 3.29Å; L581-S584 WeakPolarHBondContact O-CB 3.28Å; L581-S584 PolarHBondContact O-N 2.89Å; L581-S584 PolarHBondContact O-OG 3.01Å; A582-S584 VanDerWaalsContact C-N 3.32Å
585	T	54.4	Low	65.7	Low	97 Å²	97	62.8 Å²	62.8	60%	0.595	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-73.7	140.8	167.9	47.2	0	0	0	0	110.5	G583	G583-T585 PolarHBondContact O-N 3.09Å
586	P	52.4	Low	65	Low	44 Å²	44	65.7 Å²	65.7	29%	0.286	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-63.1	146	165.1	29.8	-34	0	0	0	109.4	L495 S588	L495-P586 HydrophobicContact CD2-CB 4.28Å; P586-S588 PolarHBondContact O-N 2.93Å
587	P	51.1	Low	64.5	Low	44 Å²	44	68.5 Å²	68.5	29%	0.286	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-63.1	121.1	177.1	24.9	-33.3	0	0	0	110.2
588	S	44	Very low	64.1	Low	77 Å²	77	67.4 Å²	67.4	54%	0.538	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-67.3	143.9	164.2	42.4	0	0	0	0	109.5	P586 G590 Q591	P586-S588 PolarHBondContact O-N 2.93Å; S588-G590 PolarHBondContact O-N 2.71Å; S588-Q591 PolarHBondContact O-N 3.4Å; S588-Q591 VanDerWaalsContact O-N 3.11Å
589	Q	44.2	Very low	63.8	Low	210 Å²	210	71 Å²	71	98%	0.981	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	99.6	-173.7	-174.7	174.1	-7.5	0	0	111.2
590	G	48.6	Very low	63.1	Low	87 Å²	87	70.6 Å²	70.6	90%	0.897	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.4	-8.6	-179.4	0	0	0	0	0	116	S588	S588-G590 PolarHBondContact O-N 2.71Å
591	Q	37.5	Very low	62	Low	128 Å²	128	73 Å²	73	60%	0.598	47%	0.465	S	S	*	.			trans	-124.7	127.7	-174.6	-155.3	166.2	12.8	0	0	112.9	S588 S593	S588-Q591 PolarHBondContact O-N 3.4Å; S588-Q591 VanDerWaalsContact O-N 3.11Å; Q591-S593 PolarHBondContact O-N 3.28Å
592	L	38.9	Very low	60.4	Low	181 Å²	181	73.8 Å²	73.8	95%	0.948	47%	0.469	S	S	*	.			trans	-72.9	19.8	-172	-66.4	175	0	0	0	115.5	G594	L592-G594 PolarHBondContact O-N 3.13Å
593	S	43.8	Very low	58.7	Low	69 Å²	69	79.7 Å²	79.7	48%	0.483	49%	0.489	S	S	.	.			trans	-78.5	71.8	173.3	-63.3	0	0	0	0	110.6	Q591	Q591-S593 PolarHBondContact O-N 3.28Å
594	G	55.5	Low	57.7	Low	42 Å²	42	84.1 Å²	84.1	43%	0.433	48%	0.481	S	S	.	.			trans	-61.8	154.9	172.9	0	0	0	0	0	112.4	L592 L596	L592-G594 PolarHBondContact O-N 3.13Å; G594-L596 PolarHBondContact O-N 3.23Å
595	A	65.5	Low	56.9	Low	9 Å²	9	87.4 Å²	87.4	7%	0.074	49%	0.491	C	S	.	.			trans	-63.2	127.2	176.4	0	0	0	0	0	109.9	L495 V580 L597	L495-A595 HydrophobicContact CD2-CB 3.73Å; V580-A595 HydrophobicContact CG1-CB 3.92Å; A595-L597 PolarHBondContact O-N 2.8Å
596	L	77.8	Confident	56	Low	114 Å²	114	85.6 Å²	85.6	60%	0.597	48%	0.482	S	S	*	.			trans	-70.1	105.1	-173.3	-64.4	177.3	0	0	0	110.6	L581 G594	L581-L596 HydrophobicContact CB-CB 4.26Å; L581-L596 HydrophobicContact CD1-CB 3.77Å; L581-L596 HydrophobicContact CD1-CD1 4.32Å; L581-L596 PolarHBondContact N-O 2.69Å; G594-L596 PolarHBondContact O-N 3.23Å
597	L	82.6	Confident	54.9	Low	61 Å²	61	87.3 Å²	87.3	32%	0.319	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.4	175.7	-58.2	-174.4	0	0	0	110.7	V506 F579 V580 A595	V506-L597 HydrophobicContact CG1-CD2 3.61Å; V506-L597 HydrophobicContact CG2-CD1 3.81Å; V506-L597 HydrophobicContact CG2-CD2 4.24Å; F579-L597 WeakPolarHBondContact O-CA 3.42Å; V580-L597 HydrophobicContact CB-CD2 4.5Å; V580-L597 HydrophobicContact CG2-CD2 3.81Å; A595-L597 PolarHBondContact O-N 2.8Å
598	V	82.6	Confident	53.9	Low	31 Å²	31	92.4 Å²	92.4	19%	0.188	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	174.1	176.6	0	0	0	0	109.3	S578 F579 L581 F600	S578-V598 CarbonylContact C-O 3.6Å; S578-V598 VanDerWaalsContact CA-O 3.28Å; S578-V598 WeakPolarHBondContact CA-O 3.19Å; S578-V598 VanDerWaalsContact CB-O 3.28Å; S578-V598 WeakPolarHBondContact CB-O 3.42Å; F579-V598 HydrophobicContact CD1-CB 4.28Å; F579-V598 HydrophobicContact CD1-CG1 4.49Å; F579-V598 HydrophobicContact CD2-CB 4.33Å; F579-V598 HydrophobicContact CE1-CB 3.8Å; F579-V598 HydrophobicContact CE1-CG1 3.64Å; F579-V598 HydrophobicContact CE2-CB 3.86Å; F579-V598 HydrophobicContact CE2-CG1 4.32Å; F579-V598 HydrophobicContact CE2-CG2 4.25Å; F579-V598 HydrophobicContact CZ-CB 3.58Å; F579-V598 HydrophobicContact CZ-CG1 3.54Å; F579-V598 HydrophobicContact CZ-CG2 4.25Å; F579-V598 PolarHBondContact N-O 2.9Å; F579-V598 PolarHBondContact O-N 3.38Å; L581-V598 HydrophobicContact CD1-CG2 3.49Å; L581-V598 VanDerWaalsContact CD1-CG2 3.49Å; L581-V598 HydrophobicContact CD2-CG2 4.26Å; L581-V598 HydrophobicContact CG-CG2 3.65Å; V598-F600 PolarHBondContact O-N 3.29Å
599	P	82.3	Confident	53.3	Low	93 Å²	93	93.1 Å²	93.1	60%	0.604	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	122.5	173.3	-26.4	35	0	0	0	111	S601	P599-S601 PolarHBondContact O-N 3.5Å; P599-S601 PolarHBondContact O-OG 3.44Å
600	F	77.4	Confident	52.5	Low	4 Å²	4	87.4 Å²	87.4	2%	0.018	50%	0.501	C	S	.	.			trans	-66.8	122.3	-176.5	-174.8	-132.2	0	0	0	108.1	F507 M553 L556 R560 S577 F579 V598 L602	F507-F600 HydrophobicContact CE1-CB 4.2Å; F507-F600 HydrophobicContact CE1-CD1 4.22Å; F507-F600 HydrophobicContact CE1-CD2 4.33Å; F507-F600 HydrophobicContact CE1-CG 4.01Å; F507-F600 HydrophobicContact CZ-CD1 4.38Å; F507-F600 AromaticContact CZ-CD2 3.97Å; F507-F600 HydrophobicContact CZ-CD2 3.97Å; F507-F600 HydrophobicContact CZ-CE2 4.17Å; F507-F600 HydrophobicContact CZ-CG 4.11Å; F507-F600 HydrophobicContact CZ-CZ 4.48Å; M553-F600 HydrophobicContact SD-CZ 4.39Å; L556-F600 HydrophobicContact CB-CE1 4.31Å; L556-F600 HydrophobicContact CB-CZ 3.89Å; R560-F600 HydrophobicContact CB-CD1 4Å; R560-F600 HydrophobicContact CB-CE1 3.94Å; R560-F600 HydrophobicContact CG-CD1 3.92Å; R560-F600 HydrophobicContact CG-CE1 4.26Å; R560-F600 VanDerWaalsContact NH1-C 3.26Å; R560-F600 PolarHBondContact NH1-O 3.37Å; R560-F600 PolarHBondContact NH2-O 3.04Å; S577-F600 PolarHBondContact O-N 3.23Å; F579-F600 HydrophobicContact CD1-CB 4.41Å; F579-F600 HydrophobicContact CD1-CD2 4.03Å; F579-F600 HydrophobicContact CE1-CD2 4.39Å; V598-F600 PolarHBondContact O-N 3.29Å; F600-L602 HydrophobicContact CE1-CD2 4.15Å; F600-L602 HydrophobicContact CE2-CD2 4.45Å; F600-L602 HydrophobicContact CZ-CD2 3.84Å
601	S	67.8	Low	51.8	Low	51 Å²	51	91.6 Å²	91.6	36%	0.357	50%	0.502	S	S	.	.			trans	-145	104.2	-168.9	-72.3	0	0	0	0	111.2	P599 H603 R604	P599-S601 PolarHBondContact O-N 3.5Å; P599-S601 PolarHBondContact O-OG 3.44Å; S601-H603 VanDerWaalsContact C-N 3.32Å; S601-H603 PolarHBondContact O-N 3.31Å; S601-R604 WeakPolarHBondContact O-CB 3.43Å; S601-R604 PolarHBondContact O-N 3.5Å
602	L	54.5	Low	51.4	Low	65 Å²	65	89.7 Å²	89.7	34%	0.34	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-61.4	-36.8	-174.1	-59.5	177.3	0	0	0	112.9	S557 F600 R604 W605 S606	S557-L602 WeakPolarHBondContact OG-CD2 3.08Å; F600-L602 HydrophobicContact CE1-CD2 4.15Å; F600-L602 HydrophobicContact CE2-CD2 4.45Å; F600-L602 HydrophobicContact CZ-CD2 3.84Å; L602-R604 PolarHBondContact O-N 2.87Å; L602-R604 VanDerWaalsContact O-N 3.11Å; L602-W605 PolarHBondContact O-N 3.25Å; L602-S606 PolarHBondContact O-N 2.97Å
603	H	42.6	Very low	51	Low	171 Å²	171	91.9 Å²	91.9	79%	0.792	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-61.1	-18.4	176	-69.5	-73.8	0	0	0	114.5	S601 W605 S606	S601-H603 VanDerWaalsContact C-N 3.32Å; S601-H603 PolarHBondContact O-N 3.31Å; H603-W605 VanDerWaalsContact C-N 3.32Å; H603-S606 PolarHBondContact O-OG 2.97Å
604	R	45.7	Very low	50.2	Low	171 Å²	171	95 Å²	95	65%	0.645	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-83.7	-5.1	173.6	-170.8	178.2	-80.7	-136.5	2.7	112.7	S601 L602	S601-R604 WeakPolarHBondContact O-CB 3.43Å; S601-R604 PolarHBondContact O-N 3.5Å; L602-R604 PolarHBondContact O-N 2.87Å; L602-R604 VanDerWaalsContact O-N 3.11Å
605	W	45.3	Very low	48.8	Very low	87 Å²	87	98.1 Å²	98.1	33%	0.33	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-18.7	179.3	-133.2	-64.8	0	0	0	114.1	F480 P481 W482 M553 L602 H603 S607	F480-W605 HydrophobicContact CB-CH2 4.13Å; F480-W605 HydrophobicContact CB-CZ2 4Å; F480-W605 AromaticContact CD1-CE2 3.65Å; F480-W605 AromaticContact CD1-CH2 3.83Å; F480-W605 HydrophobicContact CD1-CH2 3.83Å; F480-W605 AromaticContact CD1-CZ2 3.15Å; F480-W605 HydrophobicContact CD1-CZ2 3.15Å; F480-W605 AromaticContact CD1-NE1 3.95Å; F480-W605 AromaticContact CE1-CE2 3.84Å; F480-W605 AromaticContact CE1-CZ2 3.83Å; F480-W605 HydrophobicContact CE1-CZ2 3.83Å; F480-W605 AromaticContact CE1-NE1 3.66Å; F480-W605 HydrophobicContact CG-CH2 4.4Å; F480-W605 AromaticContact CG-CZ2 3.84Å; F480-W605 HydrophobicContact CG-CZ2 3.84Å; P481-W605 VanDerWaalsContact CD-CH2 3.48Å; P481-W605 HydrophobicContact CG-CH2 3.69Å; P481-W605 HydrophobicContact CG-CZ2 4.4Å; P481-W605 HydrophobicContact CG-CZ3 4.35Å; W482-W605 AromaticContact CD1-CH2 3.55Å; W482-W605 AromaticContact CD1-CZ3 3.57Å; W482-W605 AromaticContact NE1-CH2 3.46Å; W482-W605 AromaticContact NE1-CZ3 3.65Å; M553-W605 HydrophobicContact CE-CD2 3.79Å; M553-W605 HydrophobicContact CE-CE3 4.13Å; M553-W605 HydrophobicContact CE-CG 4.08Å; M553-W605 HydrophobicContact CE-CZ2 4.4Å; L602-W605 PolarHBondContact O-N 3.25Å; H603-W605 VanDerWaalsContact C-N 3.32Å; W605-S607 PolarHBondContact O-N 3.26Å
606	S	36.5	Very low	47.1	Very low	58 Å²	58	105.1 Å²	105.1	41%	0.406	57%	0.574	S	S	.	*	S	Bend	trans	-74.6	11	162	54.5	0	0	0	0	113.1	L602 H603	L602-S606 PolarHBondContact O-N 2.97Å; H603-S606 PolarHBondContact O-OG 2.97Å
607	S	28.8	Very low	44.6	Very low	80 Å²	80	104.1 Å²	104.1	56%	0.559	58%	0.582	S	S	*	*	S	Bend	trans	-153.3	157.7	177.3	-70.4	0	0	0	0	108.1	W605	W605-S607 PolarHBondContact O-N 3.26Å
608	E	29.5	Very low	42	Very low	152 Å²	152	111.7 Å²	111.7	71%	0.71	61%	0.607	S	S	*	*			trans	-62.2	141.4	-170	-163	176.9	109.5	0	0	113	S610	E608-S610 VanDerWaalsContact C-N 3.26Å; E608-S610 PolarHBondContact O-N 3.24Å; E608-S610 PolarHBondContact O-OG 2.78Å
609	P	31	Very low	39.3	Very low	91 Å²	91	115.5 Å²	115.5	59%	0.591	64%	0.635	S	S	*	*			trans	-69.2	81	179.7	29.4	-36.4	0	0	0	111.6	L611	P609-L611 PolarHBondContact O-N 2.69Å; P609-L611 VanDerWaalsContact O-N 3.11Å
610	S	29.1	Very low	36.9	Very low	91 Å²	91	116.5 Å²	116.5	64%	0.636	64%	0.644	S	S	*	*			trans	-58.9	113.1	-178.8	-64.4	0	0	0	0	111.2	E608 A612	E608-S610 VanDerWaalsContact C-N 3.26Å; E608-S610 PolarHBondContact O-N 3.24Å; E608-S610 PolarHBondContact O-OG 2.78Å; S610-A612 PolarHBondContact O-N 2.96Å
611	L	33.7	Very low	34.6	Very low	175 Å²	175	121.8 Å²	121.8	92%	0.916	68%	0.681	S	S	*	*			trans	-73.5	53.1	172	-75.1	175.6	0	0	0	112.2	P609 R613	P609-L611 PolarHBondContact O-N 2.69Å; P609-L611 VanDerWaalsContact O-N 3.11Å; L611-R613 VanDerWaalsContact C-N 3.27Å; L611-R613 PolarHBondContact O-N 2.97Å
612	A	28.4	Very low	32.9	Very low	87 Å²	87	128.3 Å²	128.3	72%	0.719	71%	0.706	S	S	*	*			trans	-67	91.1	159.1	0	0	0	0	0	108	S610 C614	S610-A612 PolarHBondContact O-N 2.96Å; A612-C614 PolarHBondContact O-N 3.25Å
613	R	30.4	Very low	32.1	Very low	228 Å²	228	130.4 Å²	130.4	86%	0.86	72%	0.723	S	S	*	*			trans	-48.8	137.3	164.4	-85.7	179.3	156.2	122.9	-6.8	108.6	L611 S615	L611-R613 VanDerWaalsContact C-N 3.27Å; L611-R613 PolarHBondContact O-N 2.97Å; R613-S615 PolarHBondContact O-N 2.73Å
614	C	27.8	Very low	31.6	Very low	133 Å²	133	128.3 Å²	128.3	90%	0.899	73%	0.725	S	S	*	*			trans	-67.5	85.5	166.7	-63.9	0	0	0	0	109.1	A612 L616	A612-C614 PolarHBondContact O-N 3.25Å; C614-L616 PolarHBondContact O-N 2.64Å
615	S	26.5	Very low	30.9	Very low	108 Å²	108	124.1 Å²	124.1	76%	0.755	73%	0.727	S	S	*	*			trans	-60.6	124.1	173.2	-66.8	0	0	0	0	109.4	R613 A617	R613-S615 PolarHBondContact O-N 2.73Å; S615-A617 PolarHBondContact O-N 3.11Å
616	L	28.1	Very low	30.1	Very low	157 Å²	157	130.3 Å²	130.3	82%	0.822	76%	0.757	S	S	*	*			trans	-69.1	96.5	-173.5	-168.9	81	0	0	0	110.9	C614 R618	C614-L616 PolarHBondContact O-N 2.64Å; L616-R618 HydrophobicContact CD2-CB 4.31Å; L616-R618 HydrophobicContact CG-CB 4.45Å; L616-R618 PolarHBondContact O-N 2.88Å
617	A	25.5	Very low	29.9	Very low	92 Å²	92	133 Å²	133	76%	0.76	78%	0.776	S	S	*	*			trans	-72.9	69.6	173.1	0	0	0	0	0	111.2	S615 S619	S615-A617 PolarHBondContact O-N 3.11Å; A617-S619 PolarHBondContact O-N 3.2Å
618	R	28.3	Very low	30.3	Very low	220 Å²	220	135 Å²	135	83%	0.83	79%	0.787	S	S	*	*			trans	-75	70.9	175.3	-173.5	-174.3	166	174.1	-4.3	110.4	L616	L616-R618 HydrophobicContact CD2-CB 4.31Å; L616-R618 HydrophobicContact CG-CB 4.45Å; L616-R618 PolarHBondContact O-N 2.88Å
619	S	27.1	Very low	30.2	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	79%	0.79	S	S	*	*			trans	-91	98.5	173.6	-61.3	0	0	0	0	109.7	A617	A617-S619 PolarHBondContact O-N 3.2Å
620	S	31	Very low	30.6	Very low	114 Å²	114	134.6 Å²	134.6	80%	0.797	80%	0.795	S	S	*	*			trans	-85.7	110.7	-178.1	175.8	0	0	0	0	112
621	S	29.4	Very low	30.6	Very low	115 Å²	115	136 Å²	136	80%	0.804	80%	0.8	S	S	*	*			trans	-149.2	119.3	158	44.7	0	0	0	0	110.6
622	Q	31.1	Very low	30.3	Very low	189 Å²	189	132.8 Å²	132.8	88%	0.883	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-84.8	162.8	169	-104.9	-173.5	-86	0	0	110.5
623	P	38.3	Very low	30.4	Very low	108 Å²	108	134.5 Å²	134.5	70%	0.701	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-85.9	160.5	-165.6	35.1	-37.4	0	0	0	113.4
624	P	33.3	Very low	30.5	Very low	128 Å²	128	130 Å²	130	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-97.8	132.8	146.1	34.2	-25.9	0	0	0	110.4
625	A	29.3	Very low	30.5	Very low	82 Å²	82	128.4 Å²	128.4	68%	0.678	78%	0.782	S	S	*	*			trans	-129.5	108.1	159.4	0	0	0	0	0	107.9
626	F	28.5	Very low	30.6	Very low	218 Å²	218	128.7 Å²	128.7	96%	0.956	78%	0.779	S	S	*	*			trans	-160.3	135.1	159	-85.4	-59.6	0	0	0	109.7
627	S	32.1	Very low	30.8	Very low	115 Å²	115	126.4 Å²	126.4	80%	0.804	78%	0.776	S	S	*	*			trans	-73.4	157.2	170.8	-43.6	0	0	0	0	110.3
628	P	37.4	Very low	31.1	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	78%	0.778	S	S	*	*				-148.7	170.2	86.8	40.6	-24	0	0	0	116.4
629	T	28.9	Very low	32	Very low	128 Å²	128	123.2 Å²	123.2	79%	0.785	78%	0.779	S	S	*	*			trans	-65.4	167.1	156.7	26.4	0	0	0	0	111.4
630	P	39.6	Very low	32.2	Very low	105 Å²	105	121.5 Å²	121.5	68%	0.682	78%	0.779	S	S	*	*			cis	-149.5	169.7	33.5	43.4	-22.6	0	0	0	120.4
631	T	27.3	Very low	32.4	Very low	121 Å²	121	120.5 Å²	120.5	74%	0.742	77%	0.772	S	S	*	*			trans	58.3	132.6	143.8	47.5	0	0	0	0	124.7
632	S	28.8	Very low	32.6	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	77%	0.774	S	S	*	*			trans	73.7	149.6	143.6	-59	0	0	0	0	118.1
633	T	30.4	Very low	32.7	Very low	124 Å²	124	119.4 Å²	119.4	76%	0.761	76%	0.761	S	S	*	*			cis	-158.9	158.5	-0.7	0.9	0	0	0	0	107.6
634	T	31.1	Very low	32.5	Very low	132 Å²	132	121.1 Å²	121.1	81%	0.81	76%	0.76	S	S	*	*			cis	-139.7	-155.1	3.5	-26.3	0	0	0	0	106.7
635	S	29.6	Very low	32.5	Very low	100 Å²	100	123.8 Å²	123.8	70%	0.699	76%	0.759	S	S	*	*			cis	-145.6	-157.4	1	54.5	0	0	0	0	107.5
636	T	28.8	Very low	32.4	Very low	115 Å²	115	123.7 Å²	123.7	71%	0.706	77%	0.765	S	S	*	*			cis	-143.7	137.3	12.8	-71.8	0	0	0	0	110
637	S	31.3	Very low	32.5	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	76%	0.763	S	S	*	*			trans	14.5	121.4	168.9	62.3	0	0	0	0	122.4
638	S	32.7	Very low	32.4	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	76%	0.761	S	S	*	*			trans	-93.5	177.7	138.9	-41	0	0	0	0	109.5
639	P	47.3	Very low	32.1	Very low	133 Å²	133	125.9 Å²	125.9	86%	0.864	76%	0.762	S	S	*	*				-121.1	-175.1	50	12	13.5	0	0	0	112.8
640	G	30.4	Very low	33.4	Very low	75 Å²	75	125 Å²	125	77%	0.773	76%	0.759	S	S	*	*			cis	131.5	150.1	6.9	0	0	0	0	0	110.7
641	S	35.1	Very low	32.9	Very low	93 Å²	93	126.4 Å²	126.4	65%	0.65	77%	0.766	S	S	*	*			cis	-167.9	165.9	-4.8	-166.3	0	0	0	0	112.1
642	F	33.2	Very low	33	Very low	193 Å²	193	125.5 Å²	125.5	85%	0.846	77%	0.771	S	S	*	*			trans	67.7	144.3	168	-60.5	-66	0	0	0	117.8
643	S	33	Very low	32.9	Very low	87 Å²	87	128.8 Å²	128.8	61%	0.608	77%	0.774	S	S	*	*			cis	-166.6	176.7	9	-116.4	0	0	0	0	109.2
644	Q	33.9	Very low	33.8	Very low	145 Å²	145	128 Å²	128	68%	0.678	77%	0.771	S	S	*	*			cis	-164.9	169.5	-0.1	-129.2	163.7	17.8	0	0	112.9
645	F	33.5	Very low	34	Very low	184 Å²	184	125.4 Å²	125.4	81%	0.807	76%	0.763	S	S	*	*			trans	49.6	130.9	153.1	-65.2	-52.2	0	0	0	126.4
646	G	28.4	Very low	34.8	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	77%	0.765	S	S	*	*			trans	105.5	139	143.1	0	0	0	0	0	118
647	R	30.2	Very low	34.9	Very low	241 Å²	241	126.3 Å²	126.3	91%	0.909	77%	0.771	S	S	*	*			cis	166.8	148.3	-41	179.7	-178.5	-177.3	-177.1	2.5	107.1
648	V	28.7	Very low	34.9	Very low	127 Å²	127	125.6 Å²	125.6	77%	0.77	77%	0.772	S	S	*	*			trans	120.6	143.2	161.5	178.9	0	0	0	0	116.3
649	V	32.5	Very low	35.6	Very low	133 Å²	133	125.8 Å²	125.8	81%	0.806	77%	0.771	S	S	*	*			trans	-166.6	176.7	-176.4	-91.5	0	0	0	0	107.1
650	P	56.3	Low	34.7	Very low	111 Å²	111	123.4 Å²	123.4	72%	0.721	76%	0.762	S	S	*	*			cis	-145.5	-176.4	15.4	46.9	-27.4	0	0	0	118.5
651	T	29.1	Very low	34.7	Very low	134 Å²	134	128.2 Å²	128.2	82%	0.822	76%	0.764	S	S	*	*			trans	53.2	136	136.9	-64.8	0	0	0	0	125.1
652	A	29.4	Very low	34.5	Very low	102 Å²	102	131.6 Å²	131.6	84%	0.843	77%	0.774	S	S	*	*			trans	-160.5	136.3	133.6	0	0	0	0	0	114.4
653	E	25.8	Very low	34.4	Very low	175 Å²	175	133 Å²	133	82%	0.818	77%	0.773	S	S	*	*			trans	-130.6	-171.1	164	-134.1	-141.1	111.8	0	0	105.8
654	P	50.5	Low	34.5	Very low	107 Å²	107	138.4 Å²	138.4	70%	0.695	78%	0.78	S	S	*	*			cis	-134.6	-167.6	0.2	42.2	-22.4	0	0	0	115.3
655	A	33.3	Very low	34.3	Very low	78 Å²	78	137.4 Å²	137.4	65%	0.645	79%	0.79	S	S	*	*			trans	-83.3	177.5	163.2	0	0	0	0	0	112.9
656	P	47.3	Very low	34.3	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	78%	0.783	S	S	*	*				-156.8	164.3	107.2	39.5	-21.4	0	0	0	119.2
657	S	31.2	Very low	34.7	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	78%	0.782	S	S	*	*			trans	74.5	155	144.4	60.8	0	0	0	0	122.7
658	A	30.2	Very low	34.9	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	78%	0.78	S	S	*	*			trans	-123.3	-161	-175.6	0	0	0	0	0	109.2
659	P	47.2	Very low	35	Very low	118 Å²	118	129.3 Å²	129.3	77%	0.766	77%	0.774	S	S	*	*			cis	-144	-168.4	1.9	43.8	-23.1	0	0	0	117
660	A	29.4	Very low	35.3	Very low	82 Å²	82	135.3 Å²	135.3	68%	0.678	78%	0.783	S	S	*	*			trans	84.9	123.5	143.4	0	0	0	0	0	123.9
661	H	30.6	Very low	34.3	Very low	177 Å²	177	141.2 Å²	141.2	82%	0.819	79%	0.79	S	S	*	*			trans	26.9	127.1	137.8	-58.9	-91.1	0	0	0	123.4
662	L	29.8	Very low	35.1	Very low	164 Å²	164	140.1 Å²	140.1	86%	0.859	79%	0.786	S	S	*	*				160.4	118.4	125.1	-84.1	164.1	0	0	0	109.2
663	R	32.1	Very low	35.3	Very low	222 Å²	222	142.3 Å²	142.3	84%	0.838	78%	0.782	S	S	*	*				68.1	108.4	86	-81.3	-75.7	179.5	110.7	-3.2	116.4
664	R	34.2	Very low	35.7	Very low	200 Å²	200	140.7 Å²	140.7	76%	0.755	78%	0.778	S	S	*	*			trans	45.8	132.4	151.4	-85.3	-167.5	176	-164.3	0.6	120.5	E666	R664-E666 IonicContact NH1-OE2 2.68Å
665	S	31	Very low	34.7	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	79%	0.785	S	S	*	*			trans	-153.7	163.2	130	-82.9	0	0	0	0	110.7
666	E	34.1	Very low	34.6	Very low	141 Å²	141	147.2 Å²	147.2	66%	0.659	79%	0.788	S	S	*	*			trans	-128.9	175.8	-167.6	-65.9	168.7	94.6	0	0	111.2	R664	R664-E666 IonicContact NH1-OE2 2.68Å
667	S	35.9	Very low	34.7	Very low	115 Å²	115	147.9 Å²	147.9	80%	0.804	79%	0.792	S	S	*	*			trans	69.5	157.3	-178.3	82.4	0	0	0	0	115.2
668	V	33.8	Very low	34.7	Very low	141 Å²	141	149.1 Å²	149.1	86%	0.855	79%	0.789	S	S	*	*			cis	-137.3	153.5	3.7	-124.5	0	0	0	0	106.4
669	G	31.3	Very low	35.9	Very low	64 Å²	64	149.2 Å²	149.2	66%	0.66	78%	0.782	S	S	*	*			cis	118.9	97.8	10.7	0	0	0	0	0	111.7
670	R	38	Very low	35.2	Very low	259 Å²	259	152.2 Å²	152.2	98%	0.977	79%	0.786	S	S	*	*			trans	-163	154.5	159.2	-111.1	164.8	-160.1	-126.3	1.2	113.4
671	R	36.1	Very low	35.5	Very low	234 Å²	234	152.5 Å²	152.5	88%	0.883	79%	0.788	S	S	*	*			trans	-121.3	165.8	-178.2	-123.5	177.2	-170.7	175.6	2.9	107.3
672	P	45.6	Very low	36.5	Very low	112 Å²	112	149.4 Å²	149.4	73%	0.727	78%	0.784	S	S	*	*				-153.3	159.5	73.7	36.1	-14.6	0	0	0	119
673	L	33.9	Very low	36.7	Very low	148 Å²	148	148.7 Å²	148.7	78%	0.775	78%	0.779	S	S	*	*			trans	39.5	140.7	139.8	-54.6	177.1	0	0	0	120.2
674	L	34.5	Very low	36.9	Very low	140 Å²	140	145.3 Å²	145.3	73%	0.733	78%	0.777	S	S	*	*			cis	-159	-165.6	4.6	-108.1	165.3	0	0	0	107.2
675	R	29.3	Very low	37.8	Very low	223 Å²	223	140.7 Å²	140.7	84%	0.842	77%	0.772	S	S	*	*			cis	-140.1	-134.2	10.9	-155.2	176.4	176.6	135.2	-0.6	112.2
676	S	31.5	Very low	37.9	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	77%	0.768	S	S	*	*			trans	-165.1	177.7	-171	-31.1	0	0	0	0	108.2
677	P	49.4	Very low	37.9	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	77%	0.77	S	S	*	*			cis	-141.1	-178.8	35.7	41.9	-21	0	0	0	118
678	N	31.8	Very low	37.6	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	76%	0.759	S	S	*	*			trans	-118.6	156.1	171.2	-176.7	32	0	0	0	108.5
679	P	55.6	Low	37.6	Very low	95 Å²	95	142.4 Å²	142.4	62%	0.617	75%	0.751	S	S	*	*				-148.9	178.4	105	37.2	-17.4	0	0	0	113
680	H	32.3	Very low	37.5	Very low	180 Å²	180	145.9 Å²	145.9	83%	0.833	75%	0.754	S	S	*	*			cis	-160.4	166	33.5	-112.6	-64.9	0	0	0	112.6
681	A	35.8	Very low	37.1	Very low	89 Å²	89	143.8 Å²	143.8	74%	0.736	75%	0.748	S	S	*	*			trans	-160.6	157	161.5	0	0	0	0	0	111.7
682	P	50.4	Low	36.9	Very low	112 Å²	112	139.8 Å²	139.8	73%	0.727	74%	0.739	S	S	*	*			trans	-144.9	134.7	162.7	34.3	-14.9	0	0	0	118.6
683	I	33.8	Very low	36.4	Very low	148 Å²	148	141.8 Å²	141.8	76%	0.759	74%	0.743	S	S	*	*			trans	66.8	135.3	132.4	-64.3	167.8	0	0	0	120.1
684	I	36.5	Very low	36.5	Very low	152 Å²	152	142.8 Å²	142.8	78%	0.779	74%	0.744	S	S	*	*			cis	94.7	147.2	18.2	-62.2	168.7	0	0	0	113.4
685	P	52.4	Low	37.4	Very low	103 Å²	103	141.4 Å²	141.4	67%	0.669	74%	0.743	S	S	*	*			cis	-132.8	179.3	4.5	44.3	-27.5	0	0	0	118.1
686	Q	33.1	Very low	37.6	Very low	168 Å²	168	136.2 Å²	136.2	79%	0.785	73%	0.732	S	S	*	*			trans	46.9	158.9	135.9	-72	-166.4	-21.6	0	0	123.6
687	R	35.3	Very low	37.7	Very low	186 Å²	186	142.1 Å²	142.1	70%	0.702	74%	0.739	S	S	*	*			cis	-170.9	176.3	1.3	-110.9	175.9	86.1	-153.4	-1.3	108
688	D	28.9	Very low	36.9	Very low	105 Å²	105	139.6 Å²	139.6	56%	0.561	74%	0.736	S	S	*	*			cis	-167.2	166.2	-11.8	-124.8	13.1	0	0	0	110.3
689	S	33.4	Very low	37.4	Very low	98 Å²	98	144.2 Å²	144.2	69%	0.685	74%	0.743	S	S	*	*			trans	59.6	160.1	157.1	62.7	0	0	0	0	121.1
690	D	29.3	Very low	36.7	Very low	138 Å²	138	149.9 Å²	149.9	74%	0.738	76%	0.758	S	S	*	*			cis	-169.6	165.8	-33.8	-92	-48	0	0	0	109.3
691	Y	29.9	Very low	37	Very low	214 Å²	214	153 Å²	153	84%	0.839	76%	0.762	S	S	*	*			trans	66.3	151.8	168.5	-78.2	-80.4	0	0	0	117.8
692	E	33.2	Very low	37.2	Very low	150 Å²	150	152.3 Å²	152.3	70%	0.701	76%	0.757	S	S	*	*			cis	-158.9	152.5	-5.4	-169.6	161.8	-176.8	0	0	112.9
693	L	34.3	Very low	36.8	Very low	155 Å²	155	154.8 Å²	154.8	81%	0.812	76%	0.762	S	S	*	*			trans	41.5	130.5	159.4	-70.5	168.2	0	0	0	125.5
694	E	35.3	Very low	36.9	Very low	169 Å²	169	153.4 Å²	153.4	79%	0.79	76%	0.757	S	S	*	*			trans	-80.3	176.6	156.4	-86.2	-87.2	125.8	0	0	112.3
695	P	53.3	Low	36.7	Very low	110 Å²	110	153.6 Å²	153.6	71%	0.714	76%	0.759	S	S	*	*			cis	-125.8	-149.3	6.5	32.4	-7.3	0	0	0	111.5
696	D	34.6	Very low	36.1	Very low	114 Å²	114	155.3 Å²	155.3	61%	0.61	76%	0.758	S	S	*	*			cis	-157.6	163.8	10.1	-176.1	18.4	0	0	0	110.8
697	R	33.3	Very low	36.2	Very low	224 Å²	224	157.5 Å²	157.5	85%	0.845	76%	0.761	S	S	*	*			trans	70.9	125.7	164.2	-42.9	-166	177.7	-165.1	-4.8	119.9
698	G	32.6	Very low	36.3	Very low	76 Å²	76	156.6 Å²	156.6	78%	0.784	77%	0.766	S	S	*	*			trans	-170.4	-60.2	162.4	0	0	0	0	0	116.8
699	R	43	Very low	36.8	Very low	243 Å²	243	158.9 Å²	158.9	92%	0.917	78%	0.778	S	S	*	*			trans	51.4	104.6	-175.2	-69.7	-176	174.1	-177.7	-0.9	116.6
700	K	40.6	Very low	36.9	Very low	214 Å²	214	166.1 Å²	166.1	93%	0.93	81%	0.807	S	S	*	*			trans	-156.1	168.3	142.7	-109	149.3	-170.8	175.4	0	112.2
701	R	38.7	Very low	37.3	Very low	244 Å²	244	167.5 Å²	167.5	92%	0.921	81%	0.811	S	S	*	*			trans	-69.7	169.9	-168.7	-38.7	173.1	-176.9	168.9	-0.8	111.2
702	A	38.6	Very low	37.7	Very low	76 Å²	76	165.1 Å²	165.1	63%	0.628	81%	0.809	S	S	*	*			cis	-161.1	-175.7	13.8	0	0	0	0	0	110.5
703	I	43.1	Very low	37.9	Very low	163 Å²	163	165.9 Å²	165.9	84%	0.836	82%	0.815	S	S	*	*			trans	56	134.7	161.2	58.5	175.5	0	0	0	117.3
704	D	35	Very low	38.1	Very low	120 Å²	120	166.5 Å²	166.5	64%	0.642	82%	0.816	S	S	*	*				-139.1	168	56.4	-169.1	19.1	0	0	0	114.1	Q706	D704-Q706 WeakPolarHBondContact OD2-CG 3.44Å; D704-Q706 PolarHBondContact OD2-NE2 2.92Å
705	N	33	Very low	38.3	Very low	155 Å²	155	166.4 Å²	166.4	83%	0.829	82%	0.817	S	S	*	*			trans	-115.2	87.6	170.1	-79.3	-102.1	0	0	0	110.6
706	Q	40.6	Very low	37.3	Very low	140 Å²	140	170.1 Å²	170.1	65%	0.654	82%	0.824	S	S	*	*			trans	-104.3	117.4	161.9	-68.3	179.3	32.4	0	0	109.2	D704	D704-Q706 WeakPolarHBondContact OD2-CG 3.44Å; D704-Q706 PolarHBondContact OD2-NE2 2.92Å
707	Y	34.9	Very low	37.5	Very low	214 Å²	214	174.1 Å²	174.1	84%	0.839	84%	0.839	S	S	*	*				-176.6	100.3	111.9	-94.1	-67.3	0	0	0	109
708	M	36.1	Very low	37.8	Very low	166 Å²	166	170.3 Å²	170.3	82%	0.818	84%	0.839	S	S	*	*			trans	-77.7	163.6	147.5	-85.6	-178.8	57.1	0	0	108.7
709	L	39.8	Very low	38.3	Very low	153 Å²	153	178.2 Å²	178.2	80%	0.801	84%	0.844	S	S	*	*			trans	68.2	84.2	174.3	-54.1	166.5	0	0	0	114.5
710	L	35.9	Very low	37.8	Very low	250 Å²	250	172.3 Å²	172.3	100%	1.309	84%	0.837	S	S	*	*				-167.4	0	103.5	-93.7	159.6	0	0	0	111.2

Retrieved 710 of 710 residues in 1131.1 ms (Link to these results)

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