A0A096LSA7_POEFO Loading...

Smoothelin, like

AlphaFold DB , UniProt , Accession A0A096LSA7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 533 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	43.6	Very low	241 Å²	241	160.5 Å²	160.5	100%	1.187	85%	0.846	S	S	*	*				0	173	0	-74.6	-171.9	-78.5	0	0	108.7
2	Q	40.3	Very low	43.6	Very low	200 Å²	200	160.3 Å²	160.3	94%	0.935	84%	0.844	S	S	*	*			trans	-78.1	174.4	-165.9	-72.7	143.7	-61.8	0	0	114.4
3	A	42.1	Very low	43.4	Very low	90 Å²	90	158.2 Å²	158.2	74%	0.744	85%	0.849	S	S	*	*			trans	-99.1	-160.1	-179.3	0	0	0	0	0	112.1
4	Q	44	Very low	44.1	Very low	181 Å²	181	157.1 Å²	157.1	85%	0.846	84%	0.835	S	S	*	*			trans	74.8	141.9	176.4	-56.6	-175.2	-71.2	0	0	115.2
5	T	44.4	Very low	44.2	Very low	100 Å²	100	159.3 Å²	159.3	61%	0.613	84%	0.838	S	S	*	*			cis	-154.8	136.2	-15	12.9	0	0	0	0	106.3	A7	T5-A7 PolarHBondContact O-N 3.02Å
6	L	45.1	Very low	44.1	Very low	177 Å²	177	164.1 Å²	164.1	93%	0.927	84%	0.841	S	S	*	*				48.7	49.1	75.9	-136.6	177.6	0	0	0	113.6
7	A	45.3	Very low	44.1	Very low	81 Å²	81	160.6 Å²	160.6	67%	0.669	84%	0.835	S	S	*	*			trans	-148.4	18.1	-176.4	0	0	0	0	0	115.4	T5	T5-A7 PolarHBondContact O-N 3.02Å
8	Q	44.8	Very low	44.3	Very low	190 Å²	190	158.6 Å²	158.6	89%	0.888	83%	0.833	S	S	*	*	S	Bend	trans	-139.1	31.3	-172.6	-70.2	-168.3	-26.9	0	0	115.2
9	M	41.7	Very low	44.4	Very low	193 Å²	193	153.2 Å²	153.2	95%	0.951	81%	0.81	S	S	*	*	S	Bend	trans	-139.7	32.3	171.4	-70.2	-160.4	-57.4	0	0	113.4
10	E	48.2	Very low	44.8	Very low	193 Å²	193	151.6 Å²	151.6	90%	0.902	81%	0.809	S	S	*	*	S	Bend	trans	-121.8	-7.5	-174.5	-148.6	162.1	-139.1	0	0	114.8
11	D	44.9	Very low	45.2	Very low	120 Å²	120	152.2 Å²	152.2	64%	0.642	81%	0.807	S	S	*	*	S	Bend	trans	-132.9	89	176.7	-166.7	7.5	0	0	0	113.3	H14	D11-H14 IonicContact OD1-CE1 3.18Å; D11-H14 PolarHBondContact OD1-CE1 3.48Å; D11-H14 IonicContact OD1-ND1 2.99Å; D11-H14 PolarHBondContact OD1-ND1 3.34Å
12	L	43.3	Very low	45.9	Very low	157 Å²	157	144 Å²	144	82%	0.822	79%	0.785	S	S	*	*			trans	-164.7	21	143	-110.1	163.8	0	0	0	113.6	H14	L12-H14 PolarHBondContact O-N 2.84Å; L12-H14 VanDerWaalsContact O-N 3.17Å
13	C	41.8	Very low	47	Very low	134 Å²	134	138.3 Å²	138.3	91%	0.905	76%	0.758	S	S	*	*			trans	-86.7	46.7	167.4	-76	0	0	0	0	111.8	H15	C13-H15 VanDerWaalsContact C-N 3.26Å; C13-H15 PolarHBondContact O-N 3.23Å
14	H	53.1	Low	49	Very low	142 Å²	142	138.5 Å²	138.5	66%	0.657	75%	0.75	S	S	*	*			trans	-72.2	68.3	178.5	-101.6	76	0	0	0	111.5	D11 L12	D11-H14 IonicContact OD1-CE1 3.18Å; D11-H14 PolarHBondContact OD1-CE1 3.48Å; D11-H14 IonicContact OD1-ND1 2.99Å; D11-H14 PolarHBondContact OD1-ND1 3.34Å; L12-H14 PolarHBondContact O-N 2.84Å; L12-H14 VanDerWaalsContact O-N 3.17Å
15	H	45.8	Very low	50.8	Low	190 Å²	190	135.2 Å²	135.2	88%	0.88	74%	0.742	S	S	*	*			trans	-159.8	84.2	165.2	-111.9	51.2	0	0	0	113.3	C13	C13-H15 VanDerWaalsContact C-N 3.26Å; C13-H15 PolarHBondContact O-N 3.23Å
16	R	41.3	Very low	52.6	Low	237 Å²	237	134.8 Å²	134.8	89%	0.894	74%	0.742	S	S	*	*				168.3	102.9	118.3	-169.6	167.9	-156.2	171.3	5.4	110
17	S	44	Very low	54.7	Low	104 Å²	104	128.6 Å²	128.6	73%	0.727	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-57.2	138.1	163	35.9	0	0	0	0	109.6	S19	S17-S19 PolarHBondContact O-N 3.12Å; S17-S19 VanDerWaalsContact O-N 3.15Å
18	P	48.9	Very low	56.7	Low	124 Å²	124	126.9 Å²	126.9	81%	0.805	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-65.8	117.1	176.3	26.6	-32.6	0	0	0	108.9
19	S	44.8	Very low	59	Low	56 Å²	56	122.8 Å²	122.8	39%	0.392	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-61.4	141.1	170.2	-163	0	0	0	0	108.7	S17 E21 G22	S17-S19 PolarHBondContact O-N 3.12Å; S17-S19 VanDerWaalsContact O-N 3.15Å; S19-E21 PolarHBondContact O-N 3.43Å; S19-E21 PolarHBondContact OG-OE2 3.42Å; S19-G22 PolarHBondContact O-N 3.44Å
20	P	54	Low	61.4	Low	122 Å²	122	117.2 Å²	117.2	79%	0.792	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-5.8	176.9	25.8	-36.4	0	0	0	114.2
21	E	51.8	Low	63.6	Low	164 Å²	164	114.2 Å²	114.2	77%	0.766	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-7.2	177.6	-57.9	150.4	146.4	0	0	113.1	S19 E23	S19-E21 PolarHBondContact O-N 3.43Å; S19-E21 PolarHBondContact OG-OE2 3.42Å; E21-E23 PolarHBondContact O-N 3.11Å
22	G	55.2	Low	66	Low	70 Å²	70	116 Å²	116	72%	0.722	64%	0.639	S	S	*	*			trans	-77.8	27.8	-173.5	0	0	0	0	0	116.2	S19	S19-G22 PolarHBondContact O-N 3.44Å
23	E	63.4	Low	68.5	Low	79 Å²	79	113.7 Å²	113.7	37%	0.369	62%	0.624	S	S	.	*			trans	-75.6	134.9	-179.3	-80.3	-170.1	84.3	0	0	113	E21 S27 R31	E21-E23 PolarHBondContact O-N 3.11Å; E23-S27 WeakPolarHBondContact OE1-CB 3.43Å; E23-S27 PolarHBondContact OE1-OG 2.94Å; E23-R31 VanDerWaalsContact CD-CZ 3.47Å; E23-R31 VanDerWaalsContact CD-NH2 3.29Å; E23-R31 IonicContact OE1-CZ 3.1Å; E23-R31 IonicContact OE1-NE 3.77Å; E23-R31 IonicContact OE1-NH1 3.01Å; E23-R31 PolarHBondContact OE1-NH1 3.32Å; E23-R31 IonicContact OE1-NH2 3.21Å; E23-R31 PolarHBondContact OE1-NH2 3.34Å; E23-R31 IonicContact OE2-CZ 3.05Å; E23-R31 IonicContact OE2-NH1 2.7Å; E23-R31 PolarHBondContact OE2-NH1 3.5Å; E23-R31 IonicContact OE2-NH2 2.69Å; E23-R31 PolarHBondContact OE2-NH2 3.38Å
24	T	83.2	Confident	71	Confident	95 Å²	95	110.8 Å²	110.8	58%	0.583	60%	0.6	S	S	*	*			trans	-67.2	148.4	169.6	62.7	0	0	0	0	109.9	C26 S27 A28	T24-C26 PolarHBondContact O-N 3.08Å; T24-C26 VanDerWaalsContact O-N 3.1Å; T24-S27 WeakPolarHBondContact O-CB 3.45Å; T24-S27 PolarHBondContact O-N 3.24Å; T24-S27 PolarHBondContact OG1-N 3.38Å; T24-A28 PolarHBondContact O-N 3.47Å
25	V	81.2	Confident	73.1	Confident	112 Å²	112	108.5 Å²	108.5	68%	0.679	60%	0.596	S	S	*	*	H	α-helix	trans	-55	-33	178.5	-178.2	0	0	0	0	111.3	A28 L29	V25-A28 PolarHBondContact O-N 2.76Å; V25-L29 HydrophobicContact CG1-CD1 3.93Å; V25-L29 HydrophobicContact CG1-CG 4.25Å; V25-L29 WeakPolarHBondContact O-CB 3.43Å; V25-L29 VanDerWaalsContact O-CG 3.27Å; V25-L29 WeakPolarHBondContact O-CG 3.43Å; V25-L29 PolarHBondContact O-N 2.91Å
26	C	82.3	Confident	75.6	Confident	90 Å²	90	103.3 Å²	103.3	61%	0.608	57%	0.574	S	S	*	*	H	α-helix	trans	-61.2	-44.3	173.4	-57.3	0	0	0	0	113.1	T24 A28 L29 T30	T24-C26 PolarHBondContact O-N 3.08Å; T24-C26 VanDerWaalsContact O-N 3.1Å; C26-A28 PolarHBondContact O-N 3Å; C26-L29 PolarHBondContact O-N 3.31Å; C26-T30 PolarHBondContact O-N 3.03Å; C26-T30 PolarHBondContact O-OG1 3Å
27	S	89.1	Confident	78.2	Confident	47 Å²	47	95.6 Å²	95.6	33%	0.329	55%	0.548	S	S	.	.	H	α-helix	trans	-60.7	-45.5	176.9	-173.5	0	0	0	0	111.3	E23 T24 L29 T30 R31	E23-S27 WeakPolarHBondContact OE1-CB 3.43Å; E23-S27 PolarHBondContact OE1-OG 2.94Å; T24-S27 WeakPolarHBondContact O-CB 3.45Å; T24-S27 PolarHBondContact O-N 3.24Å; T24-S27 PolarHBondContact OG1-N 3.38Å; S27-L29 PolarHBondContact O-N 3.34Å; S27-T30 PolarHBondContact O-N 3.17Å; S27-R31 WeakPolarHBondContact O-CG 3.41Å; S27-R31 PolarHBondContact O-N 3.33Å; S27-R31 VanDerWaalsContact O-N 3.15Å
28	A	88.5	Confident	80.7	Confident	45 Å²	45	94.8 Å²	94.8	37%	0.372	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177	0	0	0	0	0	112.3	T24 V25 C26 R31 Y32	T24-A28 PolarHBondContact O-N 3.47Å; V25-A28 PolarHBondContact O-N 2.76Å; C26-A28 PolarHBondContact O-N 3Å; A28-R31 PolarHBondContact O-N 3.19Å; A28-Y32 PolarHBondContact O-N 3.04Å
29	L	91.8	Very high	83.1	Confident	105 Å²	105	90.7 Å²	90.7	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-48.5	177.1	-75.7	170	0	0	0	112.3	V25 C26 S27 R31 Y32 E33	V25-L29 HydrophobicContact CG1-CD1 3.93Å; V25-L29 HydrophobicContact CG1-CG 4.25Å; V25-L29 WeakPolarHBondContact O-CB 3.43Å; V25-L29 VanDerWaalsContact O-CG 3.27Å; V25-L29 WeakPolarHBondContact O-CG 3.43Å; V25-L29 PolarHBondContact O-N 2.91Å; C26-L29 PolarHBondContact O-N 3.31Å; S27-L29 PolarHBondContact O-N 3.34Å; L29-R31 VanDerWaalsContact C-N 3.3Å; L29-R31 PolarHBondContact O-N 3.25Å; L29-Y32 PolarHBondContact O-N 3.27Å; L29-Y32 VanDerWaalsContact O-N 3.14Å; L29-E33 WeakPolarHBondContact O-CB 3.26Å; L29-E33 PolarHBondContact O-N 2.84Å
30	T	93.6	Very high	85.5	Confident	76 Å²	76	91.8 Å²	91.8	47%	0.466	51%	0.513	S	S	.	.	H	α-helix	trans	-61.5	-36.9	179.8	-61.2	0	0	0	0	112.1	C26 S27 N34	C26-T30 PolarHBondContact O-N 3.03Å; C26-T30 PolarHBondContact O-OG1 3Å; S27-T30 PolarHBondContact O-N 3.17Å; T30-N34 WeakPolarHBondContact O-CB 3.47Å; T30-N34 PolarHBondContact O-N 3.31Å; T30-N34 PolarHBondContact O-ND2 3.35Å
31	R	92.8	Very high	87.6	Confident	129 Å²	129	91.9 Å²	91.9	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-67.7	-43.3	173.1	-68.1	-169.9	-47.7	-152.1	-5	112.6	E23 S27 A28 L29 E33 N34 T35	E23-R31 VanDerWaalsContact CD-CZ 3.47Å; E23-R31 VanDerWaalsContact CD-NH2 3.29Å; E23-R31 IonicContact OE1-CZ 3.1Å; E23-R31 IonicContact OE1-NE 3.77Å; E23-R31 IonicContact OE1-NH1 3.01Å; E23-R31 PolarHBondContact OE1-NH1 3.32Å; E23-R31 IonicContact OE1-NH2 3.21Å; E23-R31 PolarHBondContact OE1-NH2 3.34Å; E23-R31 IonicContact OE2-CZ 3.05Å; E23-R31 IonicContact OE2-NH1 2.7Å; E23-R31 PolarHBondContact OE2-NH1 3.5Å; E23-R31 IonicContact OE2-NH2 2.69Å; E23-R31 PolarHBondContact OE2-NH2 3.38Å; S27-R31 WeakPolarHBondContact O-CG 3.41Å; S27-R31 PolarHBondContact O-N 3.33Å; S27-R31 VanDerWaalsContact O-N 3.15Å; A28-R31 PolarHBondContact O-N 3.19Å; L29-R31 VanDerWaalsContact C-N 3.3Å; L29-R31 PolarHBondContact O-N 3.25Å; R31-E33 VanDerWaalsContact C-N 3.32Å; R31-E33 PolarHBondContact O-N 2.98Å; R31-N34 PolarHBondContact O-N 2.85Å; R31-T35 PolarHBondContact O-N 3.21Å; R31-T35 PolarHBondContact O-OG1 3Å; R31-T35 VanDerWaalsContact O-OG1 3.11Å
32	Y	95.3	Very high	89.7	Confident	159 Å²	159	90.3 Å²	90.3	62%	0.624	49%	0.491	S	S	*	.	H	α-helix	trans	-60.4	-43.2	176.4	176.7	-97.8	0	0	0	111.5	A28 L29 T35 L36	A28-Y32 PolarHBondContact O-N 3.04Å; L29-Y32 PolarHBondContact O-N 3.27Å; L29-Y32 VanDerWaalsContact O-N 3.14Å; Y32-T35 PolarHBondContact O-N 3.43Å; Y32-L36 HydrophobicContact CE1-CD2 4.36Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 2.7Å
33	E	95.9	Very high	91.8	Very high	107 Å²	107	91.5 Å²	91.5	50%	0.5	48%	0.479	S	S	.	.	H	α-helix	trans	-60.5	-47.4	175	-171.9	-178.7	172.3	0	0	111.6	L29 R31 T35 L36 Q37	L29-E33 WeakPolarHBondContact O-CB 3.26Å; L29-E33 PolarHBondContact O-N 2.84Å; R31-E33 VanDerWaalsContact C-N 3.32Å; R31-E33 PolarHBondContact O-N 2.98Å; E33-T35 PolarHBondContact O-N 3Å; E33-L36 PolarHBondContact O-N 3.31Å; E33-Q37 WeakPolarHBondContact O-CG 3.4Å; E33-Q37 PolarHBondContact O-N 3.31Å; E33-Q37 PolarHBondContact OE1-NE2 2.9Å
34	N	95.9	Very high	93.4	Very high	74 Å²	74	93.8 Å²	93.8	40%	0.396	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-47.8	176.5	-72.5	-22.4	0	0	0	111.9	T30 R31 L36 Q37 D38	T30-N34 WeakPolarHBondContact O-CB 3.47Å; T30-N34 PolarHBondContact O-N 3.31Å; T30-N34 PolarHBondContact O-ND2 3.35Å; R31-N34 PolarHBondContact O-N 2.85Å; N34-L36 VanDerWaalsContact C-N 3.32Å; N34-L36 PolarHBondContact O-N 3.48Å; N34-Q37 PolarHBondContact O-N 3.46Å; N34-D38 PolarHBondContact O-N 3.25Å
35	T	97.2	Very high	94	Very high	94 Å²	94	91.6 Å²	91.6	58%	0.577	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-36.6	177.2	-58.7	0	0	0	0	112.5	R31 Y32 E33 D38 A39	R31-T35 PolarHBondContact O-N 3.21Å; R31-T35 PolarHBondContact O-OG1 3Å; R31-T35 VanDerWaalsContact O-OG1 3.11Å; Y32-T35 PolarHBondContact O-N 3.43Å; E33-T35 PolarHBondContact O-N 3Å; T35-D38 PolarHBondContact O-N 3.12Å; T35-A39 WeakPolarHBondContact O-CB 3.32Å; T35-A39 PolarHBondContact O-N 2.65Å
36	L	97.4	Very high	94.8	Very high	81 Å²	81	92.4 Å²	92.4	42%	0.424	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-43	173.8	179.1	61.7	0	0	0	111.4	Y32 E33 N34 A39 I40	Y32-L36 HydrophobicContact CE1-CD2 4.36Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 2.7Å; E33-L36 PolarHBondContact O-N 3.31Å; N34-L36 VanDerWaalsContact C-N 3.32Å; N34-L36 PolarHBondContact O-N 3.48Å; L36-A39 PolarHBondContact O-N 3Å; L36-I40 HydrophobicContact CD1-CD1 4.17Å; L36-I40 HydrophobicContact CG-CD1 4.03Å; L36-I40 WeakPolarHBondContact O-CD1 3.31Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.44Å; L36-I40 PolarHBondContact O-N 2.74Å
37	Q	97	Very high	95.4	Very high	75 Å²	75	92.3 Å²	92.3	35%	0.35	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-37.3	175.2	-68.9	-176.7	23.2	0	0	112.4	E33 N34 I40 R41	E33-Q37 WeakPolarHBondContact O-CG 3.4Å; E33-Q37 PolarHBondContact O-N 3.31Å; E33-Q37 PolarHBondContact OE1-NE2 2.9Å; N34-Q37 PolarHBondContact O-N 3.46Å; Q37-I40 PolarHBondContact O-N 2.72Å; Q37-R41 WeakPolarHBondContact O-CG 3.44Å; Q37-R41 PolarHBondContact O-N 2.86Å
38	D	96.5	Very high	95.8	Very high	86 Å²	86	93.2 Å²	93.2	46%	0.46	48%	0.48	S	S	.	.	H	α-helix	trans	-64.3	-46.5	173.8	-77.3	-41.4	0	0	0	111.8	N34 T35 I40 R41 E42	N34-D38 PolarHBondContact O-N 3.25Å; T35-D38 PolarHBondContact O-N 3.12Å; D38-I40 VanDerWaalsContact C-N 3.31Å; D38-I40 PolarHBondContact O-N 2.73Å; D38-R41 VanDerWaalsContact CG-NH2 3.32Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.34Å; D38-R41 VanDerWaalsContact O-N 3.13Å; D38-R41 IonicContact OD1-CZ 2.82Å; D38-R41 IonicContact OD1-NE 3.73Å; D38-R41 PolarHBondContact OD1-NE 2.96Å; D38-R41 IonicContact OD1-NH2 3.91Å; D38-R41 PolarHBondContact OD1-NH2 3.37Å; D38-R41 IonicContact OD2-NH2 2.76Å; D38-E42 PolarHBondContact O-N 3.04Å
39	A	97.4	Very high	96.2	Very high	39 Å²	39	96.1 Å²	96.1	32%	0.322	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-38.1	175.8	0	0	0	0	0	112.4	T35 L36 E42 I43	T35-A39 WeakPolarHBondContact O-CB 3.32Å; T35-A39 PolarHBondContact O-N 2.65Å; L36-A39 PolarHBondContact O-N 3Å; A39-E42 PolarHBondContact O-N 3.15Å; A39-I43 WeakPolarHBondContact O-CB 3.39Å; A39-I43 WeakPolarHBondContact O-CD1 3.47Å; A39-I43 VanDerWaalsContact O-CG1 3.25Å; A39-I43 WeakPolarHBondContact O-CG1 3.37Å; A39-I43 PolarHBondContact O-N 2.72Å
40	I	97.1	Very high	96.4	Very high	79 Å²	79	97.5 Å²	97.5	41%	0.405	49%	0.491	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174.4	-69.1	164.3	0	0	0	111.1	L36 Q37 D38 H44	L36-I40 HydrophobicContact CD1-CD1 4.17Å; L36-I40 HydrophobicContact CG-CD1 4.03Å; L36-I40 WeakPolarHBondContact O-CD1 3.31Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.44Å; L36-I40 PolarHBondContact O-N 2.74Å; Q37-I40 PolarHBondContact O-N 2.72Å; D38-I40 VanDerWaalsContact C-N 3.31Å; D38-I40 PolarHBondContact O-N 2.73Å; I40-H44 WeakPolarHBondContact O-CB 3.32Å; I40-H44 PolarHBondContact O-CD2 3.35Å; I40-H44 PolarHBondContact O-N 3.08Å
41	R	97	Very high	96.6	Very high	124 Å²	124	99.6 Å²	99.6	47%	0.468	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-43.5	174.1	-76.2	-177.6	-77.6	-95.5	7.6	111.8	Q37 D38 H44 A45	Q37-R41 WeakPolarHBondContact O-CG 3.44Å; Q37-R41 PolarHBondContact O-N 2.86Å; D38-R41 VanDerWaalsContact CG-NH2 3.32Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.34Å; D38-R41 VanDerWaalsContact O-N 3.13Å; D38-R41 IonicContact OD1-CZ 2.82Å; D38-R41 IonicContact OD1-NE 3.73Å; D38-R41 PolarHBondContact OD1-NE 2.96Å; D38-R41 IonicContact OD1-NH2 3.91Å; D38-R41 PolarHBondContact OD1-NH2 3.37Å; D38-R41 IonicContact OD2-NH2 2.76Å; R41-H44 PolarHBondContact O-N 3.12Å; R41-A45 PolarHBondContact O-N 3.37Å
42	E	97.1	Very high	96.7	Very high	131 Å²	131	98.5 Å²	98.5	61%	0.612	50%	0.497	S	S	*	.	H	α-helix	trans	-62.4	-50.3	177.6	-173.2	168.6	-144.7	0	0	111.3	D38 A39 H44 A45 E46	D38-E42 PolarHBondContact O-N 3.04Å; A39-E42 PolarHBondContact O-N 3.15Å; E42-H44 VanDerWaalsContact C-N 3.33Å; E42-H44 PolarHBondContact O-N 3.5Å; E42-A45 WeakPolarHBondContact O-CB 3.24Å; E42-A45 PolarHBondContact O-N 3.4Å; E42-E46 PolarHBondContact O-N 3.48Å
43	I	97.4	Very high	96.7	Very high	95 Å²	95	93.6 Å²	93.6	49%	0.487	48%	0.482	S	S	.	.	H	α-helix	trans	-59.2	-42.1	176.3	-68.4	164.4	0	0	0	111.4	A39 A45 E46 V47	A39-I43 WeakPolarHBondContact O-CB 3.39Å; A39-I43 WeakPolarHBondContact O-CD1 3.47Å; A39-I43 VanDerWaalsContact O-CG1 3.25Å; A39-I43 WeakPolarHBondContact O-CG1 3.37Å; A39-I43 PolarHBondContact O-N 2.72Å; I43-A45 VanDerWaalsContact C-N 3.32Å; I43-A45 PolarHBondContact O-N 3.3Å; I43-E46 PolarHBondContact O-N 2.7Å; I43-V47 HydrophobicContact CG2-CG2 4.3Å; I43-V47 WeakPolarHBondContact O-CB 3.41Å; I43-V47 VanDerWaalsContact O-CG2 3.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.1Å
44	H	97.5	Very high	96.6	Very high	127 Å²	127	91.8 Å²	91.8	59%	0.588	48%	0.475	S	S	*	.	H	α-helix	trans	-63.8	-36	176	-78.7	-163.3	0	0	0	112.5	I40 R41 E42 S48	I40-H44 WeakPolarHBondContact O-CB 3.32Å; I40-H44 PolarHBondContact O-CD2 3.35Å; I40-H44 PolarHBondContact O-N 3.08Å; R41-H44 PolarHBondContact O-N 3.12Å; E42-H44 VanDerWaalsContact C-N 3.33Å; E42-H44 PolarHBondContact O-N 3.5Å; H44-S48 WeakPolarHBondContact O-CB 2.86Å; H44-S48 PolarHBondContact O-N 3.43Å; H44-S48 VanDerWaalsContact O-N 3.07Å; H44-S48 PolarHBondContact O-OG 3.08Å
45	A	97	Very high	96.5	Very high	48 Å²	48	92.2 Å²	92.2	40%	0.397	47%	0.474	S	S	.	.	H	α-helix	trans	-69.9	-44.2	174.2	0	0	0	0	0	111.8	R41 E42 I43 S48 N49	R41-A45 PolarHBondContact O-N 3.37Å; E42-A45 WeakPolarHBondContact O-CB 3.24Å; E42-A45 PolarHBondContact O-N 3.4Å; I43-A45 VanDerWaalsContact C-N 3.32Å; I43-A45 PolarHBondContact O-N 3.3Å; A45-S48 PolarHBondContact O-N 3.19Å; A45-N49 WeakPolarHBondContact O-CB 2.95Å; A45-N49 VanDerWaalsContact O-CG 3.26Å; A45-N49 PolarHBondContact O-N 2.69Å; A45-N49 PolarHBondContact O-ND2 2.97Å; A45-N49 VanDerWaalsContact O-ND2 3.13Å
46	E	96.8	Very high	96.4	Very high	129 Å²	129	93.6 Å²	93.6	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-59.5	-47.8	174.9	-72.2	-159.6	138.1	0	0	112	E42 I43 S48 N49 F50	E42-E46 PolarHBondContact O-N 3.48Å; I43-E46 PolarHBondContact O-N 2.7Å; E46-S48 VanDerWaalsContact C-N 3.3Å; E46-S48 PolarHBondContact O-N 2.74Å; E46-N49 PolarHBondContact O-N 3.46Å; E46-F50 VanDerWaalsContact O-CB 3.25Å; E46-F50 WeakPolarHBondContact O-CB 3.29Å; E46-F50 PolarHBondContact O-N 3.25Å
47	V	95.3	Very high	96.2	Very high	88 Å²	88	92.9 Å²	92.9	53%	0.533	46%	0.461	S	S	.	.	H	α-helix	trans	-62	-38.3	177.4	170	0	0	0	0	111.5	I43 K51	I43-V47 HydrophobicContact CG2-CG2 4.3Å; I43-V47 WeakPolarHBondContact O-CB 3.41Å; I43-V47 VanDerWaalsContact O-CG2 3.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.1Å; V47-K51 WeakPolarHBondContact O-CB 3.5Å; V47-K51 PolarHBondContact O-N 2.92Å
48	S	96.9	Very high	95.7	Very high	66 Å²	66	93 Å²	93	46%	0.462	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-43.2	176.1	-59.9	0	0	0	0	112	H44 A45 E46 K51 L52	H44-S48 WeakPolarHBondContact O-CB 2.86Å; H44-S48 PolarHBondContact O-N 3.43Å; H44-S48 VanDerWaalsContact O-N 3.07Å; H44-S48 PolarHBondContact O-OG 3.08Å; A45-S48 PolarHBondContact O-N 3.19Å; E46-S48 VanDerWaalsContact C-N 3.3Å; E46-S48 PolarHBondContact O-N 2.74Å; S48-K51 PolarHBondContact O-N 3.1Å; S48-L52 WeakPolarHBondContact O-CG 3.28Å; S48-L52 PolarHBondContact O-N 2.85Å; S48-L52 VanDerWaalsContact O-N 3.07Å
49	N	96.8	Very high	95.4	Very high	106 Å²	106	93.6 Å²	93.6	57%	0.567	47%	0.472	S	S	*	.	H	α-helix	trans	-67.1	-39.6	176.7	-70.9	-34	0	0	0	111.9	A45 E46 L52 D53	A45-N49 WeakPolarHBondContact O-CB 2.95Å; A45-N49 VanDerWaalsContact O-CG 3.26Å; A45-N49 PolarHBondContact O-N 2.69Å; A45-N49 PolarHBondContact O-ND2 2.97Å; A45-N49 VanDerWaalsContact O-ND2 3.13Å; E46-N49 PolarHBondContact O-N 3.46Å; N49-L52 PolarHBondContact O-N 3.07Å; N49-D53 PolarHBondContact O-N 2.97Å
50	F	97	Very high	95	Very high	135 Å²	135	96 Å²	96	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-41.6	175	175.4	-108.6	0	0	0	111.9	E46 D53 I54	E46-F50 VanDerWaalsContact O-CB 3.25Å; E46-F50 WeakPolarHBondContact O-CB 3.29Å; E46-F50 PolarHBondContact O-N 3.25Å; F50-D53 PolarHBondContact O-N 3.14Å; F50-I54 HydrophobicContact CD1-CD1 4.08Å; F50-I54 HydrophobicContact CE1-CD1 3.53Å; F50-I54 HydrophobicContact CE2-CD1 4.01Å; F50-I54 HydrophobicContact CZ-CD1 3.5Å; F50-I54 VanDerWaalsContact CZ-CD1 3.5Å; F50-I54 HydrophobicContact CZ-CG1 4.47Å; F50-I54 WeakPolarHBondContact O-CG1 3.47Å; F50-I54 PolarHBondContact O-N 3.12Å
51	K	96.5	Very high	94.3	Very high	120 Å²	120	96.8 Å²	96.8	52%	0.522	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-50.2	172.3	-178.7	-171.8	164.5	-171.1	0	111	V47 S48 D53 I54 E55	V47-K51 WeakPolarHBondContact O-CB 3.5Å; V47-K51 PolarHBondContact O-N 2.92Å; S48-K51 PolarHBondContact O-N 3.1Å; K51-D53 VanDerWaalsContact C-N 3.33Å; K51-D53 PolarHBondContact O-N 3.21Å; K51-I54 PolarHBondContact O-N 3.3Å; K51-I54 VanDerWaalsContact O-N 3.17Å; K51-E55 WeakPolarHBondContact CE-OE1 3.4Å; K51-E55 VanDerWaalsContact CE-OE2 3.25Å; K51-E55 WeakPolarHBondContact CE-OE2 3.2Å; K51-E55 HydrophobicContact CG-CG 4.47Å; K51-E55 IonicContact NZ-OE1 3.19Å; K51-E55 PolarHBondContact NZ-OE1 3.36Å; K51-E55 IonicContact NZ-OE2 3.46Å; K51-E55 PolarHBondContact O-N 3.29Å
52	L	96.3	Very high	93.5	Very high	106 Å²	106	93.5 Å²	93.5	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-63.1	-34.9	-180	-70.5	170.3	0	0	0	112.9	S48 N49 R56	S48-L52 WeakPolarHBondContact O-CG 3.28Å; S48-L52 PolarHBondContact O-N 2.85Å; S48-L52 VanDerWaalsContact O-N 3.07Å; N49-L52 PolarHBondContact O-N 3.07Å; L52-R56 VanDerWaalsContact O-CB 3.24Å; L52-R56 WeakPolarHBondContact O-CB 3.41Å; L52-R56 PolarHBondContact O-N 3.46Å
53	D	95.3	Very high	92.9	Very high	56 Å²	56	93.1 Å²	93.1	30%	0.299	49%	0.487	S	S	.	.	H	α-helix	trans	-67.1	-39.1	173.5	-174.1	72.9	0	0	0	112.6	N49 F50 K51 R56 R57	N49-D53 PolarHBondContact O-N 2.97Å; F50-D53 PolarHBondContact O-N 3.14Å; K51-D53 VanDerWaalsContact C-N 3.33Å; K51-D53 PolarHBondContact O-N 3.21Å; D53-R56 IonicContact OD1-CZ 3.61Å; D53-R56 IonicContact OD1-NE 4Å; D53-R56 IonicContact OD1-NH2 2.65Å; D53-R56 PolarHBondContact OD1-NH2 2.86Å; D53-R57 WeakPolarHBondContact O-CB 3.49Å; D53-R57 WeakPolarHBondContact O-CG 3.48Å; D53-R57 PolarHBondContact O-N 3.24Å; D53-R57 VanDerWaalsContact OD2-CD 3.27Å; D53-R57 WeakPolarHBondContact OD2-CD 3.33Å; D53-R57 IonicContact OD2-CZ 2.74Å; D53-R57 IonicContact OD2-NE 2.71Å; D53-R57 IonicContact OD2-NH1 3.11Å; D53-R57 PolarHBondContact OD2-NH1 3.38Å
54	I	93.8	Very high	92.2	Very high	68 Å²	68	95.2 Å²	95.2	35%	0.349	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-50.5	173.6	-73.5	175.8	0	0	0	110.7	F50 K51 R56 R57 C58	F50-I54 HydrophobicContact CD1-CD1 4.08Å; F50-I54 HydrophobicContact CE1-CD1 3.53Å; F50-I54 HydrophobicContact CE2-CD1 4.01Å; F50-I54 HydrophobicContact CZ-CD1 3.5Å; F50-I54 VanDerWaalsContact CZ-CD1 3.5Å; F50-I54 HydrophobicContact CZ-CG1 4.47Å; F50-I54 WeakPolarHBondContact O-CG1 3.47Å; F50-I54 PolarHBondContact O-N 3.12Å; K51-I54 PolarHBondContact O-N 3.3Å; K51-I54 VanDerWaalsContact O-N 3.17Å; I54-R56 PolarHBondContact O-N 3.4Å; I54-R57 PolarHBondContact O-N 3.42Å; I54-R57 VanDerWaalsContact O-N 3.17Å; I54-C58 WeakPolarHBondContact O-CB 3.47Å; I54-C58 PolarHBondContact O-N 2.95Å; I54-C58 PolarHBondContact O-SG 3.08Å
55	E	93.8	Very high	91.4	Very high	83 Å²	83	92.5 Å²	92.5	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-58	-48.9	179.8	-72.8	175.6	148.3	0	0	110.6	K51 R57 C58 D59	K51-E55 WeakPolarHBondContact CE-OE1 3.4Å; K51-E55 VanDerWaalsContact CE-OE2 3.25Å; K51-E55 WeakPolarHBondContact CE-OE2 3.2Å; K51-E55 HydrophobicContact CG-CG 4.47Å; K51-E55 IonicContact NZ-OE1 3.19Å; K51-E55 PolarHBondContact NZ-OE1 3.36Å; K51-E55 IonicContact NZ-OE2 3.46Å; K51-E55 PolarHBondContact O-N 3.29Å; E55-R57 VanDerWaalsContact C-N 3.35Å; E55-R57 PolarHBondContact O-N 3.3Å; E55-C58 WeakPolarHBondContact O-CB 3.05Å; E55-C58 PolarHBondContact O-N 2.87Å; E55-D59 PolarHBondContact O-N 2.96Å
56	R	95.5	Very high	91	Very high	124 Å²	124	91.9 Å²	91.9	47%	0.468	49%	0.492	S	S	.	.	H	α-helix	trans	-55.3	-44.7	174.1	-179.5	-178.7	66.9	93.8	-4.5	113	L52 D53 I54 D59 E60	L52-R56 VanDerWaalsContact O-CB 3.24Å; L52-R56 WeakPolarHBondContact O-CB 3.41Å; L52-R56 PolarHBondContact O-N 3.46Å; D53-R56 IonicContact OD1-CZ 3.61Å; D53-R56 IonicContact OD1-NE 4Å; D53-R56 IonicContact OD1-NH2 2.65Å; D53-R56 PolarHBondContact OD1-NH2 2.86Å; I54-R56 PolarHBondContact O-N 3.4Å; R56-D59 PolarHBondContact O-N 3.44Å; R56-E60 WeakPolarHBondContact CG-OE1 3.19Å; R56-E60 IonicContact CZ-OE1 3.19Å; R56-E60 IonicContact NE-OE1 2.69Å; R56-E60 IonicContact NH1-OE1 3.82Å; R56-E60 PolarHBondContact NH1-OE1 3.33Å; R56-E60 IonicContact NH1-OE2 3.35Å; R56-E60 WeakPolarHBondContact O-CG 3.14Å; R56-E60 PolarHBondContact O-N 2.97Å
57	R	91.9	Very high	90.7	Very high	65 Å²	65	89.5 Å²	89.5	25%	0.245	49%	0.487	C	S	.	.	H	α-helix	trans	-75.8	-26.7	-178.7	-79.1	166.2	49	-115.9	-19.2	113.2	D53 I54 E55 T61 F417	D53-R57 WeakPolarHBondContact O-CB 3.49Å; D53-R57 WeakPolarHBondContact O-CG 3.48Å; D53-R57 PolarHBondContact O-N 3.24Å; D53-R57 VanDerWaalsContact OD2-CD 3.27Å; D53-R57 WeakPolarHBondContact OD2-CD 3.33Å; D53-R57 IonicContact OD2-CZ 2.74Å; D53-R57 IonicContact OD2-NE 2.71Å; D53-R57 IonicContact OD2-NH1 3.11Å; D53-R57 PolarHBondContact OD2-NH1 3.38Å; I54-R57 PolarHBondContact O-N 3.42Å; I54-R57 VanDerWaalsContact O-N 3.17Å; E55-R57 VanDerWaalsContact C-N 3.35Å; E55-R57 PolarHBondContact O-N 3.3Å; R57-T61 WeakPolarHBondContact O-CB 3.39Å; R57-T61 PolarHBondContact O-N 2.95Å; R57-T61 VanDerWaalsContact O-N 3.07Å; R57-T61 PolarHBondContact O-OG1 3.43Å; R57-F417 VanDerWaalsContact NH2-CB 3.27Å; R57-F417 PolarHBondContact NH2-O 3.03Å
58	C	88	Confident	90.5	Very high	78 Å²	78	90.9 Å²	90.9	53%	0.527	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-46	166	-76.8	0	0	0	0	110.7	I54 E55 T61 A62	I54-C58 WeakPolarHBondContact O-CB 3.47Å; I54-C58 PolarHBondContact O-N 2.95Å; I54-C58 PolarHBondContact O-SG 3.08Å; E55-C58 WeakPolarHBondContact O-CB 3.05Å; E55-C58 PolarHBondContact O-N 2.87Å; C58-T61 PolarHBondContact O-N 2.88Å; C58-A62 WeakPolarHBondContact O-CB 3.45Å; C58-A62 PolarHBondContact O-N 3.46Å
59	D	90.1	Very high	90	Very high	99 Å²	99	89.4 Å²	89.4	53%	0.529	49%	0.486	S	S	.	.	H	α-helix	trans	-64.7	-42.7	176.5	-71.6	-20.8	0	0	0	112.3	E55 R56 T61 A62 N63	E55-D59 PolarHBondContact O-N 2.96Å; R56-D59 PolarHBondContact O-N 3.44Å; D59-T61 VanDerWaalsContact C-N 3.27Å; D59-T61 PolarHBondContact O-N 3.04Å; D59-A62 PolarHBondContact O-N 3.26Å; D59-N63 WeakPolarHBondContact O-CB 3.44Å; D59-N63 PolarHBondContact O-N 3.33Å; D59-N63 PolarHBondContact O-ND2 3.1Å
60	E	88.8	Confident	89.8	Confident	90 Å²	90	91.1 Å²	91.1	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-56.5	-41.8	172.4	-74.9	167.3	-172.8	0	0	111.3	R56 L64	R56-E60 WeakPolarHBondContact CG-OE1 3.19Å; R56-E60 IonicContact CZ-OE1 3.19Å; R56-E60 IonicContact NE-OE1 2.69Å; R56-E60 IonicContact NH1-OE1 3.82Å; R56-E60 PolarHBondContact NH1-OE1 3.33Å; R56-E60 IonicContact NH1-OE2 3.35Å; R56-E60 WeakPolarHBondContact O-CG 3.14Å; R56-E60 PolarHBondContact O-N 2.97Å; E60-L64 WeakPolarHBondContact O-CG 3.26Å; E60-L64 PolarHBondContact O-N 3.45Å
61	T	82.3	Confident	89.7	Confident	95 Å²	95	86.8 Å²	86.8	58%	0.583	48%	0.48	S	S	*	.	H	α-helix	trans	-71.1	-38.1	177.8	-54	0	0	0	0	112.3	R57 C58 D59 L64 S65	R57-T61 WeakPolarHBondContact O-CB 3.39Å; R57-T61 PolarHBondContact O-N 2.95Å; R57-T61 VanDerWaalsContact O-N 3.07Å; R57-T61 PolarHBondContact O-OG1 3.43Å; C58-T61 PolarHBondContact O-N 2.88Å; D59-T61 VanDerWaalsContact C-N 3.27Å; D59-T61 PolarHBondContact O-N 3.04Å; T61-L64 PolarHBondContact O-N 2.84Å; T61-S65 PolarHBondContact O-N 3.28Å; T61-S65 VanDerWaalsContact O-N 3.15Å
62	A	80	Confident	89.6	Confident	54 Å²	54	85 Å²	85	45%	0.446	48%	0.479	S	S	.	.	H	α-helix	trans	-66.4	-41.7	176.2	0	0	0	0	0	111.8	C58 D59 L64 S65 G66	C58-A62 WeakPolarHBondContact O-CB 3.45Å; C58-A62 PolarHBondContact O-N 3.46Å; D59-A62 PolarHBondContact O-N 3.26Å; A62-L64 VanDerWaalsContact C-N 3.28Å; A62-L64 PolarHBondContact O-N 3.25Å; A62-S65 PolarHBondContact O-N 3.27Å; A62-S65 VanDerWaalsContact O-N 3.11Å; A62-S65 PolarHBondContact O-OG 3.09Å; A62-G66 PolarHBondContact O-N 2.84Å
63	N	84.9	Confident	89.6	Confident	124 Å²	124	85.3 Å²	85.3	66%	0.663	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-34.2	175	-77.4	-64	0	0	0	112.4	D59 P67	D59-N63 WeakPolarHBondContact O-CB 3.44Å; D59-N63 PolarHBondContact O-N 3.33Å; D59-N63 PolarHBondContact O-ND2 3.1Å; N63-P67 WeakPolarHBondContact O-CD 3.36Å
64	L	82.1	Confident	89.6	Confident	138 Å²	138	88 Å²	88	72%	0.723	49%	0.491	S	S	*	.	H	α-helix	trans	-72.1	-27.1	173.7	-71.8	169.3	0	0	0	113.5	E60 T61 A62	E60-L64 WeakPolarHBondContact O-CG 3.26Å; E60-L64 PolarHBondContact O-N 3.45Å; T61-L64 PolarHBondContact O-N 2.84Å; A62-L64 VanDerWaalsContact C-N 3.28Å; A62-L64 PolarHBondContact O-N 3.25Å
65	S	80.3	Confident	89.8	Confident	70 Å²	70	89.5 Å²	89.5	49%	0.49	50%	0.499	S	S	.	.	H	α-helix	trans	-80.1	-28.2	-179	77.8	0	0	0	0	113.3	T61 A62 L68 G69	T61-S65 PolarHBondContact O-N 3.28Å; T61-S65 VanDerWaalsContact O-N 3.15Å; A62-S65 PolarHBondContact O-N 3.27Å; A62-S65 VanDerWaalsContact O-N 3.11Å; A62-S65 PolarHBondContact O-OG 3.09Å; S65-L68 WeakPolarHBondContact O-CB 3.24Å; S65-L68 PolarHBondContact O-N 3.08Å; S65-G69 PolarHBondContact O-N 3.48Å
66	G	89.3	Confident	89.9	Confident	35 Å²	35	91.1 Å²	91.1	36%	0.361	51%	0.507	S	S	.	.	H	α-helix	trans	-54.2	-55.8	179.4	0	0	0	0	0	114.5	A62 L68 G69 Q70	A62-G66 PolarHBondContact O-N 2.84Å; G66-L68 VanDerWaalsContact C-N 3.28Å; G66-L68 PolarHBondContact O-N 3.14Å; G66-G69 PolarHBondContact O-N 3.05Å; G66-Q70 PolarHBondContact O-N 3.22Å
67	P	90.9	Very high	90	Very high	79 Å²	79	92 Å²	92	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-60.6	-34	177.3	-25.8	35.4	0	0	0	113.6	N63 Q70 A71	N63-P67 WeakPolarHBondContact O-CD 3.36Å; P67-Q70 PolarHBondContact O-N 2.86Å; P67-A71 WeakPolarHBondContact O-CB 3.47Å; P67-A71 PolarHBondContact O-N 3.32Å
68	L	89.3	Confident	90.2	Very high	118 Å²	118	93.1 Å²	93.1	62%	0.618	52%	0.524	S	S	*	.	H	α-helix	trans	-66.7	-42.7	175.4	-179.4	61.8	0	0	0	111.3	S65 G66 Q70 A71 V72	S65-L68 WeakPolarHBondContact O-CB 3.24Å; S65-L68 PolarHBondContact O-N 3.08Å; G66-L68 VanDerWaalsContact C-N 3.28Å; G66-L68 PolarHBondContact O-N 3.14Å; L68-Q70 VanDerWaalsContact C-N 3.35Å; L68-Q70 PolarHBondContact O-N 3.49Å; L68-A71 PolarHBondContact O-N 3.49Å; L68-V72 WeakPolarHBondContact O-CG2 3.29Å; L68-V72 PolarHBondContact O-N 2.99Å
69	G	87.3	Confident	90.7	Very high	34 Å²	34	93.4 Å²	93.4	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-42.3	173.6	0	0	0	0	0	112.7	S65 G66 V72 L73	S65-G69 PolarHBondContact O-N 3.48Å; G66-G69 PolarHBondContact O-N 3.05Å; G69-V72 PolarHBondContact O-N 3.46Å; G69-L73 WeakPolarHBondContact O-CG 3.37Å; G69-L73 PolarHBondContact O-N 3.35Å
70	Q	93.1	Very high	91	Very high	143 Å²	143	96.7 Å²	96.7	67%	0.668	53%	0.526	S	S	*	.	H	α-helix	trans	-62.3	-45.7	174.9	-69.5	175.8	-5.6	0	0	112	G66 P67 L68 V72 L73 Q74	G66-Q70 PolarHBondContact O-N 3.22Å; P67-Q70 PolarHBondContact O-N 2.86Å; L68-Q70 VanDerWaalsContact C-N 3.35Å; L68-Q70 PolarHBondContact O-N 3.49Å; Q70-V72 PolarHBondContact O-N 3.19Å; Q70-L73 PolarHBondContact O-N 3.28Å; Q70-Q74 PolarHBondContact O-N 3.26Å
71	A	93.3	Very high	91.4	Very high	44 Å²	44	97.3 Å²	97.3	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-39.3	177.1	0	0	0	0	0	112.6	P67 L68 Q74 L75	P67-A71 WeakPolarHBondContact O-CB 3.47Å; P67-A71 PolarHBondContact O-N 3.32Å; L68-A71 PolarHBondContact O-N 3.49Å; A71-Q74 PolarHBondContact O-N 3.44Å; A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 VanDerWaalsContact O-CG 3.31Å; A71-L75 WeakPolarHBondContact O-CG 3.47Å; A71-L75 PolarHBondContact O-N 3.05Å
72	V	95.4	Very high	92.1	Very high	81 Å²	81	97.8 Å²	97.8	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-44.4	174.9	168.9	0	0	0	0	111.3	L68 G69 Q70 L75 Q76	L68-V72 WeakPolarHBondContact O-CG2 3.29Å; L68-V72 PolarHBondContact O-N 2.99Å; G69-V72 PolarHBondContact O-N 3.46Å; Q70-V72 PolarHBondContact O-N 3.19Å; V72-L75 PolarHBondContact O-N 3.34Å; V72-Q76 VanDerWaalsContact O-CB 3.29Å; V72-Q76 WeakPolarHBondContact O-CB 3.45Å; V72-Q76 PolarHBondContact O-N 2.99Å
73	L	95.4	Very high	92.9	Very high	113 Å²	113	103.7 Å²	103.7	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-62.2	-43.3	176.6	-72.6	170.7	0	0	0	112	G69 Q70 Q76 Q77	G69-L73 WeakPolarHBondContact O-CG 3.37Å; G69-L73 PolarHBondContact O-N 3.35Å; Q70-L73 PolarHBondContact O-N 3.28Å; L73-Q76 PolarHBondContact O-N 3.1Å; L73-Q77 PolarHBondContact O-N 2.91Å
74	Q	96.9	Very high	93.5	Very high	114 Å²	114	102 Å²	102	53%	0.533	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-51.4	175.3	-179.9	178.3	-15.6	0	0	111.4	Q70 A71 Q76 Q77 E78	Q70-Q74 PolarHBondContact O-N 3.26Å; A71-Q74 PolarHBondContact O-N 3.44Å; Q74-Q76 PolarHBondContact O-N 3.46Å; Q74-Q77 WeakPolarHBondContact O-CB 3.36Å; Q74-Q77 PolarHBondContact O-N 3.47Å; Q74-Q77 VanDerWaalsContact O-N 3.08Å; Q74-E78 HydrophobicContact CG-CG 4.47Å; Q74-E78 WeakPolarHBondContact CG-OE1 3.4Å; Q74-E78 PolarHBondContact NE2-OE1 3.44Å; Q74-E78 WeakPolarHBondContact O-CG 3.39Å; Q74-E78 PolarHBondContact O-N 2.95Å
75	L	96.6	Very high	94.2	Very high	98 Å²	98	100.6 Å²	100.6	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-33.1	178.6	-72.7	170.1	0	0	0	112.3	A71 V72 N79	A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 VanDerWaalsContact O-CG 3.31Å; A71-L75 WeakPolarHBondContact O-CG 3.47Å; A71-L75 PolarHBondContact O-N 3.05Å; V72-L75 PolarHBondContact O-N 3.34Å; L75-N79 VanDerWaalsContact O-CB 3.32Å; L75-N79 WeakPolarHBondContact O-CB 3.35Å; L75-N79 PolarHBondContact O-N 3.46Å; L75-N79 PolarHBondContact O-ND2 3.47Å
76	Q	96.6	Very high	94.9	Very high	117 Å²	117	102.7 Å²	102.7	55%	0.547	52%	0.523	S	S	.	.	H	α-helix	trans	-71.6	-35.6	175.5	-167	178.7	17.9	0	0	112.3	V72 L73 Q74 R80	V72-Q76 VanDerWaalsContact O-CB 3.29Å; V72-Q76 WeakPolarHBondContact O-CB 3.45Å; V72-Q76 PolarHBondContact O-N 2.99Å; L73-Q76 PolarHBondContact O-N 3.1Å; Q74-Q76 PolarHBondContact O-N 3.46Å; Q76-R80 PolarHBondContact O-N 2.88Å; Q76-R80 VanDerWaalsContact O-N 3.13Å
77	Q	97.4	Very high	95.2	Very high	144 Å²	144	105.7 Å²	105.7	67%	0.673	53%	0.527	S	S	*	.	H	α-helix	trans	-68.2	-45.7	172.6	-178.4	174.6	-7	0	0	111.5	L73 Q74 N79 R80 Q81	L73-Q77 PolarHBondContact O-N 2.91Å; Q74-Q77 WeakPolarHBondContact O-CB 3.36Å; Q74-Q77 PolarHBondContact O-N 3.47Å; Q74-Q77 VanDerWaalsContact O-N 3.08Å; Q77-N79 PolarHBondContact O-N 2.8Å; Q77-R80 WeakPolarHBondContact O-CB 3.43Å; Q77-R80 PolarHBondContact O-N 3.46Å; Q77-R80 VanDerWaalsContact O-N 3.14Å; Q77-Q81 PolarHBondContact O-N 2.98Å
78	E	96.9	Very high	95.4	Very high	87 Å²	87	104.6 Å²	104.6	41%	0.407	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-43.2	176.1	-71.5	174.3	-168.8	0	0	111.5	Q74 R80 Q81 L82	Q74-E78 HydrophobicContact CG-CG 4.47Å; Q74-E78 WeakPolarHBondContact CG-OE1 3.4Å; Q74-E78 PolarHBondContact NE2-OE1 3.44Å; Q74-E78 WeakPolarHBondContact O-CG 3.39Å; Q74-E78 PolarHBondContact O-N 2.95Å; E78-R80 VanDerWaalsContact C-N 3.29Å; E78-R80 PolarHBondContact O-N 3.39Å; E78-Q81 PolarHBondContact O-N 2.92Å; E78-L82 WeakPolarHBondContact O-CB 3.27Å; E78-L82 WeakPolarHBondContact O-CG 3.43Å; E78-L82 PolarHBondContact O-N 3.03Å
79	N	97.1	Very high	95.7	Very high	84 Å²	84	104 Å²	104	45%	0.449	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-36.3	173.3	-92.7	-93.3	0	0	0	112.8	L75 Q77 R83	L75-N79 VanDerWaalsContact O-CB 3.32Å; L75-N79 WeakPolarHBondContact O-CB 3.35Å; L75-N79 PolarHBondContact O-N 3.46Å; L75-N79 PolarHBondContact O-ND2 3.47Å; Q77-N79 PolarHBondContact O-N 2.8Å; N79-R83 VanDerWaalsContact O-CG 3.27Å; N79-R83 WeakPolarHBondContact O-CG 3.32Å; N79-R83 PolarHBondContact O-N 2.87Å; N79-R83 VanDerWaalsContact O-N 3.16Å
80	R	96.4	Very high	96.1	Very high	168 Å²	168	105.4 Å²	105.4	63%	0.634	52%	0.523	S	S	*	.	H	α-helix	trans	-66.5	-45.2	174.5	-168.8	-173.5	-59.2	-167.1	1.7	111	Q76 Q77 E78 R83 I84	Q76-R80 PolarHBondContact O-N 2.88Å; Q76-R80 VanDerWaalsContact O-N 3.13Å; Q77-R80 WeakPolarHBondContact O-CB 3.43Å; Q77-R80 PolarHBondContact O-N 3.46Å; Q77-R80 VanDerWaalsContact O-N 3.14Å; E78-R80 VanDerWaalsContact C-N 3.29Å; E78-R80 PolarHBondContact O-N 3.39Å; R80-R83 PolarHBondContact O-N 3.21Å; R80-I84 HydrophobicContact CG-CD1 4.2Å; R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.17Å; R80-I84 VanDerWaalsContact O-N 3.1Å
81	Q	97.4	Very high	96.1	Very high	103 Å²	103	105 Å²	105	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-63	-43.3	179.3	-172.9	61.6	21.1	0	0	112	Q77 E78 R83 I84 Q85	Q77-Q81 PolarHBondContact O-N 2.98Å; E78-Q81 PolarHBondContact O-N 2.92Å; Q81-R83 VanDerWaalsContact C-N 3.34Å; Q81-R83 PolarHBondContact O-N 2.9Å; Q81-I84 PolarHBondContact O-N 3.42Å; Q81-Q85 WeakPolarHBondContact O-CG 3.14Å; Q81-Q85 PolarHBondContact O-N 3.39Å
82	L	97.9	Very high	96	Very high	105 Å²	105	108.6 Å²	108.6	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-37.3	176.8	-71.6	170	0	0	0	112.3	E78 Q85 L86	E78-L82 WeakPolarHBondContact O-CB 3.27Å; E78-L82 WeakPolarHBondContact O-CG 3.43Å; E78-L82 PolarHBondContact O-N 3.03Å; L82-Q85 PolarHBondContact O-N 3.37Å; L82-L86 WeakPolarHBondContact O-CB 3.39Å; L82-L86 PolarHBondContact O-N 2.83Å
83	R	96.3	Very high	95.8	Very high	178 Å²	178	108.2 Å²	108.2	67%	0.672	52%	0.523	S	S	*	.	H	α-helix	trans	-64.4	-44.4	173.9	-73.5	172	-173.8	-149.6	1.2	112	N79 R80 Q81 Q85 L86 E87	N79-R83 VanDerWaalsContact O-CG 3.27Å; N79-R83 WeakPolarHBondContact O-CG 3.32Å; N79-R83 PolarHBondContact O-N 2.87Å; N79-R83 VanDerWaalsContact O-N 3.16Å; R80-R83 PolarHBondContact O-N 3.21Å; Q81-R83 VanDerWaalsContact C-N 3.34Å; Q81-R83 PolarHBondContact O-N 2.9Å; R83-Q85 VanDerWaalsContact C-N 3.33Å; R83-Q85 PolarHBondContact O-N 2.98Å; R83-L86 PolarHBondContact O-N 3.19Å; R83-E87 WeakPolarHBondContact O-CB 3.43Å; R83-E87 PolarHBondContact O-N 2.98Å
84	I	96.9	Very high	95.5	Very high	88 Å²	88	108.4 Å²	108.4	45%	0.451	52%	0.52	S	S	.	.	H	α-helix	trans	-62.6	-40.9	176.7	-65.9	164.3	0	0	0	110.9	R80 Q81 E87 A88	R80-I84 HydrophobicContact CG-CD1 4.2Å; R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.17Å; R80-I84 VanDerWaalsContact O-N 3.1Å; Q81-I84 PolarHBondContact O-N 3.42Å; I84-E87 PolarHBondContact O-N 3.19Å; I84-A88 WeakPolarHBondContact O-CB 3.37Å; I84-A88 PolarHBondContact O-N 3.5Å
85	Q	96.9	Very high	95	Very high	109 Å²	109	108.7 Å²	108.7	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-40.5	175.1	-74.9	179.7	-30.1	0	0	112.6	Q81 L82 R83 A88 L89	Q81-Q85 WeakPolarHBondContact O-CG 3.14Å; Q81-Q85 PolarHBondContact O-N 3.39Å; L82-Q85 PolarHBondContact O-N 3.37Å; R83-Q85 VanDerWaalsContact C-N 3.33Å; R83-Q85 PolarHBondContact O-N 2.98Å; Q85-A88 PolarHBondContact O-N 3.22Å; Q85-L89 WeakPolarHBondContact O-CB 3.42Å; Q85-L89 PolarHBondContact O-N 2.95Å
86	L	96.2	Very high	94.3	Very high	115 Å²	115	109.1 Å²	109.1	60%	0.602	53%	0.528	S	S	*	.	H	α-helix	trans	-62.3	-46.3	175	-168.6	77.1	0	0	0	111	L82 R83 A88 L89 T90	L82-L86 WeakPolarHBondContact O-CB 3.39Å; L82-L86 PolarHBondContact O-N 2.83Å; R83-L86 PolarHBondContact O-N 3.19Å; L86-A88 PolarHBondContact O-N 2.87Å; L86-L89 PolarHBondContact O-N 2.87Å; L86-T90 PolarHBondContact O-N 3.3Å; L86-T90 PolarHBondContact O-OG1 3.11Å; L86-T90 VanDerWaalsContact O-OG1 3.1Å
87	E	95.8	Very high	93.4	Very high	98 Å²	98	108.5 Å²	108.5	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-40.7	178.6	-165.4	-169.5	136.9	0	0	112.2	R83 I84 R91	R83-E87 WeakPolarHBondContact O-CB 3.43Å; R83-E87 PolarHBondContact O-N 2.98Å; I84-E87 PolarHBondContact O-N 3.19Å; E87-R91 PolarHBondContact O-N 3.37Å; E87-R91 VanDerWaalsContact O-N 3.08Å; E87-R91 IonicContact OE1-CZ 3.84Å; E87-R91 IonicContact OE1-NH1 2.92Å; E87-R91 PolarHBondContact OE1-NH1 3.43Å; E87-R91 IonicContact OE1-NH2 2.72Å; E87-R91 PolarHBondContact OE1-NH2 3.23Å
88	A	95.1	Very high	92.2	Very high	55 Å²	55	103.3 Å²	103.3	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-41.2	173.7	0	0	0	0	0	112.5	I84 Q85 L86 R91 Q92	I84-A88 WeakPolarHBondContact O-CB 3.37Å; I84-A88 PolarHBondContact O-N 3.5Å; Q85-A88 PolarHBondContact O-N 3.22Å; L86-A88 PolarHBondContact O-N 2.87Å; A88-R91 PolarHBondContact O-N 3.42Å; A88-Q92 PolarHBondContact O-N 2.99Å; A88-Q92 VanDerWaalsContact O-N 3.12Å
89	L	95.5	Very high	90.6	Very high	105 Å²	105	103.9 Å²	103.9	55%	0.55	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-42	176.8	-162.3	81	0	0	0	111.4	Q85 L86 Q92 V93	Q85-L89 WeakPolarHBondContact O-CB 3.42Å; Q85-L89 PolarHBondContact O-N 2.95Å; L86-L89 PolarHBondContact O-N 2.87Å; L89-Q92 WeakPolarHBondContact O-CB 3.47Å; L89-Q92 PolarHBondContact O-N 2.89Å; L89-Q92 VanDerWaalsContact O-N 3.14Å; L89-V93 WeakPolarHBondContact O-CG2 3.45Å; L89-V93 PolarHBondContact O-N 3.47Å
90	T	94.7	Very high	88.8	Confident	64 Å²	64	103.5 Å²	103.5	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-57.5	-50.2	174.8	-65.6	0	0	0	0	111	L86 Q92 V93 E94	L86-T90 PolarHBondContact O-N 3.3Å; L86-T90 PolarHBondContact O-OG1 3.11Å; L86-T90 VanDerWaalsContact O-OG1 3.1Å; T90-Q92 PolarHBondContact O-N 3.21Å; T90-V93 PolarHBondContact O-N 2.78Å; T90-V93 VanDerWaalsContact O-N 3.08Å; T90-E94 HydrophobicContact CG2-CG 4.38Å; T90-E94 WeakPolarHBondContact CG2-OE1 3.25Å; T90-E94 WeakPolarHBondContact O-CG 3.38Å; T90-E94 PolarHBondContact O-N 3.13Å
91	R	92.8	Very high	86.9	Confident	135 Å²	135	99 Å²	99	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-57.2	-36.8	174.9	-73.8	-172.6	-178.6	103.2	7.9	113	E87 A88 E94 L95	E87-R91 PolarHBondContact O-N 3.37Å; E87-R91 VanDerWaalsContact O-N 3.08Å; E87-R91 IonicContact OE1-CZ 3.84Å; E87-R91 IonicContact OE1-NH1 2.92Å; E87-R91 PolarHBondContact OE1-NH1 3.43Å; E87-R91 IonicContact OE1-NH2 2.72Å; E87-R91 PolarHBondContact OE1-NH2 3.23Å; A88-R91 PolarHBondContact O-N 3.42Å; R91-E94 PolarHBondContact O-N 3.35Å; R91-L95 VanDerWaalsContact O-CG 3.32Å; R91-L95 WeakPolarHBondContact O-CG 3.46Å; R91-L95 PolarHBondContact O-N 3.16Å
92	Q	91.9	Very high	84.9	Confident	120 Å²	120	100.1 Å²	100.1	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-69.2	-37.1	177.5	-166.4	174.3	15.3	0	0	112.3	A88 L89 T90 L96	A88-Q92 PolarHBondContact O-N 2.99Å; A88-Q92 VanDerWaalsContact O-N 3.12Å; L89-Q92 WeakPolarHBondContact O-CB 3.47Å; L89-Q92 PolarHBondContact O-N 2.89Å; L89-Q92 VanDerWaalsContact O-N 3.14Å; T90-Q92 PolarHBondContact O-N 3.21Å; Q92-L96 VanDerWaalsContact O-CG 3.31Å; Q92-L96 WeakPolarHBondContact O-CG 3.37Å; Q92-L96 PolarHBondContact O-N 3.3Å; Q92-L96 VanDerWaalsContact O-N 3.12Å
93	V	90.8	Very high	82.9	Confident	73 Å²	73	103.3 Å²	103.3	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-40.6	172.9	174.1	0	0	0	0	111.3	L89 T90 L95 L96 N97	L89-V93 WeakPolarHBondContact O-CG2 3.45Å; L89-V93 PolarHBondContact O-N 3.47Å; T90-V93 PolarHBondContact O-N 2.78Å; T90-V93 VanDerWaalsContact O-N 3.08Å; V93-L95 PolarHBondContact O-N 3.46Å; V93-L96 PolarHBondContact O-N 3.4Å; V93-N97 WeakPolarHBondContact O-CB 3.47Å; V93-N97 PolarHBondContact O-N 2.82Å
94	E	88.3	Confident	80.9	Confident	116 Å²	116	99.6 Å²	99.6	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-59.9	-44	175.1	-72.3	166.8	169.8	0	0	111.7	T90 R91 N97 G98	T90-E94 HydrophobicContact CG2-CG 4.38Å; T90-E94 WeakPolarHBondContact CG2-OE1 3.25Å; T90-E94 WeakPolarHBondContact O-CG 3.38Å; T90-E94 PolarHBondContact O-N 3.13Å; R91-E94 PolarHBondContact O-N 3.35Å; E94-N97 PolarHBondContact O-N 3.14Å; E94-G98 PolarHBondContact O-N 2.89Å
95	L	87.2	Confident	79	Confident	121 Å²	121	99.9 Å²	99.9	63%	0.634	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-41	174.7	-72.6	168.7	0	0	0	112.6	R91 V93 N97 G98 L99	R91-L95 VanDerWaalsContact O-CG 3.32Å; R91-L95 WeakPolarHBondContact O-CG 3.46Å; R91-L95 PolarHBondContact O-N 3.16Å; V93-L95 PolarHBondContact O-N 3.46Å; L95-N97 VanDerWaalsContact C-N 3.34Å; L95-G98 PolarHBondContact O-N 3.17Å; L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 VanDerWaalsContact O-CG 3.26Å; L95-L99 WeakPolarHBondContact O-CG 3.5Å; L95-L99 PolarHBondContact O-N 3.11Å
96	L	81.5	Confident	77	Confident	107 Å²	107	99.4 Å²	99.4	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-65.4	-36.9	175.6	-73.2	166.3	0	0	0	112.3	Q92 V93 T100	Q92-L96 VanDerWaalsContact O-CG 3.31Å; Q92-L96 WeakPolarHBondContact O-CG 3.37Å; Q92-L96 PolarHBondContact O-N 3.3Å; Q92-L96 VanDerWaalsContact O-N 3.12Å; V93-L96 PolarHBondContact O-N 3.4Å; L96-T100 PolarHBondContact O-N 3.37Å; L96-T100 PolarHBondContact O-OG1 3.44Å
97	N	78.6	Confident	75	Confident	104 Å²	104	97.5 Å²	97.5	56%	0.556	52%	0.515	S	S	*	.	H	α-helix	trans	-71.3	-40.1	175.3	-73.7	-3.4	0	0	0	112	V93 E94 L95 T100 C101	V93-N97 WeakPolarHBondContact O-CB 3.47Å; V93-N97 PolarHBondContact O-N 2.82Å; E94-N97 PolarHBondContact O-N 3.14Å; L95-N97 VanDerWaalsContact C-N 3.34Å; N97-T100 WeakPolarHBondContact CA-OG1 3.49Å; N97-T100 PolarHBondContact O-N 3.48Å; N97-T100 PolarHBondContact O-OG1 2.85Å; N97-C101 WeakPolarHBondContact O-CB 3.33Å; N97-C101 PolarHBondContact O-N 3.38Å
98	G	72.9	Confident	72.8	Confident	35 Å²	35	98 Å²	98	36%	0.361	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-48.7	174.4	0	0	0	0	0	112.1	E94 L95 T100 C101 E102	E94-G98 PolarHBondContact O-N 2.89Å; L95-G98 PolarHBondContact O-N 3.17Å; G98-T100 VanDerWaalsContact C-N 3.25Å; G98-T100 PolarHBondContact O-N 2.97Å; G98-C101 WeakPolarHBondContact O-CB 3.49Å; G98-C101 PolarHBondContact O-N 3.43Å; G98-E102 PolarHBondContact O-N 3.39Å
99	L	63.3	Low	70.6	Confident	99 Å²	99	100 Å²	100	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-66.6	-20.8	178.8	-70.6	170.4	0	0	0	114.1	L95 R103	L95-L99 WeakPolarHBondContact O-CB 3.44Å; L95-L99 VanDerWaalsContact O-CG 3.26Å; L95-L99 WeakPolarHBondContact O-CG 3.5Å; L95-L99 PolarHBondContact O-N 3.11Å; L99-R103 WeakPolarHBondContact O-CB 3.26Å
100	T	58.6	Low	68.3	Low	75 Å²	75	100.7 Å²	100.7	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-84.7	-32.3	169.2	37.3	0	0	0	0	112	L96 N97 G98 N104	L96-T100 PolarHBondContact O-N 3.37Å; L96-T100 PolarHBondContact O-OG1 3.44Å; N97-T100 WeakPolarHBondContact CA-OG1 3.49Å; N97-T100 PolarHBondContact O-N 3.48Å; N97-T100 PolarHBondContact O-OG1 2.85Å; G98-T100 VanDerWaalsContact C-N 3.25Å; G98-T100 PolarHBondContact O-N 2.97Å; T100-N104 VanDerWaalsContact O-CG 3.25Å; T100-N104 PolarHBondContact O-N 2.91Å; T100-N104 PolarHBondContact O-ND2 3.04Å
101	C	57.1	Low	65.9	Low	73 Å²	73	101.6 Å²	101.6	49%	0.493	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-49.8	174.6	-152.4	0	0	0	0	112.2	N97 G98 R103 N104 I105	N97-C101 WeakPolarHBondContact O-CB 3.33Å; N97-C101 PolarHBondContact O-N 3.38Å; G98-C101 WeakPolarHBondContact O-CB 3.49Å; G98-C101 PolarHBondContact O-N 3.43Å; C101-R103 VanDerWaalsContact C-N 3.27Å; C101-R103 PolarHBondContact O-N 2.84Å; C101-N104 PolarHBondContact O-N 3.34Å; C101-N104 VanDerWaalsContact O-N 3.17Å; C101-I105 WeakPolarHBondContact O-CG1 3.3Å; C101-I105 PolarHBondContact O-N 3.4Å
102	E	54.4	Low	63.5	Low	127 Å²	127	103 Å²	103	59%	0.593	55%	0.545	S	S	*	.	H	α-helix	trans	-58.8	-38.4	175.9	-71.2	-167.5	139.8	0	0	112.4	G98 N104 I105 T106	G98-E102 PolarHBondContact O-N 3.39Å; E102-N104 VanDerWaalsContact C-N 3.35Å; E102-N104 PolarHBondContact O-N 2.87Å; E102-I105 PolarHBondContact O-N 3.48Å; E102-T106 WeakPolarHBondContact O-CB 3.4Å; E102-T106 PolarHBondContact O-N 3.38Å; E102-T106 PolarHBondContact O-OG1 3.02Å
103	R	56.2	Low	61.1	Low	173 Å²	173	105.2 Å²	105.2	65%	0.653	55%	0.553	S	S	*	*	H	α-helix	trans	-61.9	-43.4	177.9	-158.6	178.8	-137.1	89.2	0.1	111.4	L99 C101 T106 T107	L99-R103 WeakPolarHBondContact O-CB 3.26Å; C101-R103 VanDerWaalsContact C-N 3.27Å; C101-R103 PolarHBondContact O-N 2.84Å; R103-T106 PolarHBondContact O-N 3.27Å; R103-T107 PolarHBondContact O-N 3.12Å; R103-T107 PolarHBondContact O-OG1 3.01Å
104	N	54.9	Low	58.8	Low	99 Å²	99	107 Å²	107	53%	0.529	56%	0.56	S	S	.	*	H	α-helix	trans	-68.5	-37.2	178.1	-67.6	-17.1	0	0	0	112.6	T100 C101 E102 T106 T107 N108	T100-N104 VanDerWaalsContact O-CG 3.25Å; T100-N104 PolarHBondContact O-N 2.91Å; T100-N104 PolarHBondContact O-ND2 3.04Å; C101-N104 PolarHBondContact O-N 3.34Å; C101-N104 VanDerWaalsContact O-N 3.17Å; E102-N104 VanDerWaalsContact C-N 3.35Å; E102-N104 PolarHBondContact O-N 2.87Å; N104-T106 VanDerWaalsContact C-N 3.33Å; N104-T107 WeakPolarHBondContact CA-OG1 3.31Å; N104-T107 PolarHBondContact O-OG1 3.36Å; N104-N108 PolarHBondContact O-N 3.13Å; N104-N108 VanDerWaalsContact O-N 3.08Å
105	I	56.6	Low	56.5	Low	95 Å²	95	109.6 Å²	109.6	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-64.5	-41	173.4	-66.3	166.1	0	0	0	110.2	C101 E102 N109	C101-I105 WeakPolarHBondContact O-CG1 3.3Å; C101-I105 PolarHBondContact O-N 3.4Å; E102-I105 PolarHBondContact O-N 3.48Å; I105-N109 WeakPolarHBondContact CG2-ND2 3.27Å; I105-N109 WeakPolarHBondContact O-CB 3.32Å; I105-N109 PolarHBondContact O-N 3.21Å; I105-N109 VanDerWaalsContact O-N 3.12Å; I105-N109 PolarHBondContact O-ND2 3.42Å
106	T	53.5	Low	54.4	Low	98 Å²	98	111.3 Å²	111.3	60%	0.601	58%	0.581	S	S	*	*	H	α-helix	trans	-66.6	-41.2	179.2	-52.8	0	0	0	0	111.8	E102 R103 N104 H110	E102-T106 WeakPolarHBondContact O-CB 3.4Å; E102-T106 PolarHBondContact O-N 3.38Å; E102-T106 PolarHBondContact O-OG1 3.02Å; R103-T106 PolarHBondContact O-N 3.27Å; N104-T106 VanDerWaalsContact C-N 3.33Å; T106-H110 PolarHBondContact O-N 3.15Å
107	T	54.6	Low	52.4	Low	75 Å²	75	115.3 Å²	115.3	46%	0.46	60%	0.596	S	S	.	*	H	α-helix	trans	-67.7	-44.2	177	49.6	0	0	0	0	112.8	R103 N104 N109 H110 S111	R103-T107 PolarHBondContact O-N 3.12Å; R103-T107 PolarHBondContact O-OG1 3.01Å; N104-T107 WeakPolarHBondContact CA-OG1 3.31Å; N104-T107 PolarHBondContact O-OG1 3.36Å; T107-N109 VanDerWaalsContact C-N 3.35Å; T107-N109 PolarHBondContact O-N 2.79Å; T107-H110 PolarHBondContact O-N 3.45Å; T107-H110 VanDerWaalsContact O-N 3.11Å; T107-S111 PolarHBondContact O-N 3.39Å
108	N	50.8	Low	50.5	Low	110 Å²	110	118 Å²	118	59%	0.588	61%	0.611	S	S	*	*	H	α-helix	trans	-64.6	-38.2	179.6	-77.2	2.4	0	0	0	112.4	N104 H110 S111 H112	N104-N108 PolarHBondContact O-N 3.13Å; N104-N108 VanDerWaalsContact O-N 3.08Å; N108-H110 PolarHBondContact O-N 3.25Å; N108-S111 PolarHBondContact O-N 3.13Å; N108-H112 PolarHBondContact O-N 3.42Å
109	N	47.7	Very low	48.9	Very low	95 Å²	95	124.1 Å²	124.1	51%	0.508	63%	0.634	S	S	.	*	H	α-helix	trans	-68	-20.3	175.5	-81.5	-63.4	0	0	0	113.7	I105 T107	I105-N109 WeakPolarHBondContact CG2-ND2 3.27Å; I105-N109 WeakPolarHBondContact O-CB 3.32Å; I105-N109 PolarHBondContact O-N 3.21Å; I105-N109 VanDerWaalsContact O-N 3.12Å; I105-N109 PolarHBondContact O-ND2 3.42Å; T107-N109 VanDerWaalsContact C-N 3.35Å; T107-N109 PolarHBondContact O-N 2.79Å
110	H	48.1	Very low	47.7	Very low	121 Å²	121	128 Å²	128	56%	0.56	65%	0.649	S	S	*	*	H	α-helix	trans	-83.1	-35	175.5	-156.9	32.5	0	0	0	112	T106 T107 N108 K113 N114	T106-H110 PolarHBondContact O-N 3.15Å; T107-H110 PolarHBondContact O-N 3.45Å; T107-H110 VanDerWaalsContact O-N 3.11Å; N108-H110 PolarHBondContact O-N 3.25Å; H110-K113 PolarHBondContact O-N 2.96Å; H110-N114 PolarHBondContact CE1-ND2 3.15Å; H110-N114 VanDerWaalsContact O-CG 3.27Å; H110-N114 PolarHBondContact O-ND2 2.65Å; H110-N114 PolarHBondContact O-OD1 3.04Å
111	S	43.2	Very low	46.6	Very low	83 Å²	83	133 Å²	133	58%	0.58	67%	0.667	S	S	*	*	H	α-helix	trans	-60.9	-47.5	173.4	-64.4	0	0	0	0	112.6	T107 N108 K113	T107-S111 PolarHBondContact O-N 3.39Å; N108-S111 PolarHBondContact O-N 3.13Å; S111-K113 VanDerWaalsContact C-N 3.27Å; S111-K113 PolarHBondContact O-N 2.98Å
112	H	44.1	Very low	45.5	Very low	165 Å²	165	136.6 Å²	136.6	76%	0.764	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	0.3	-176.7	-81.4	-45.3	0	0	0	115.9	N108	N108-H112 PolarHBondContact O-N 3.42Å
113	K	40.9	Very low	44.6	Very low	166 Å²	166	137.6 Å²	137.6	72%	0.722	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-10.5	175.8	-75.4	-170.8	174.4	-175.3	0	114.7	H110 S111	H110-K113 PolarHBondContact O-N 2.96Å; S111-K113 VanDerWaalsContact C-N 3.27Å; S111-K113 PolarHBondContact O-N 2.98Å
114	N	41.5	Very low	43.5	Very low	110 Å²	110	136.7 Å²	136.7	59%	0.588	69%	0.689	S	S	*	*	S	Bend	trans	-97	7.6	-174.5	-65.9	-1.8	0	0	0	113.7	H110	H110-N114 PolarHBondContact CE1-ND2 3.15Å; H110-N114 VanDerWaalsContact O-CG 3.27Å; H110-N114 PolarHBondContact O-ND2 2.65Å; H110-N114 PolarHBondContact O-OD1 3.04Å
115	E	41.3	Very low	42.5	Very low	171 Å²	171	138.1 Å²	138.1	80%	0.799	70%	0.697	S	S	*	*	S	Bend	trans	-117.6	16.2	-170.4	-152.8	170.1	-152.6	0	0	113.9
116	L	42.7	Very low	41.3	Very low	157 Å²	157	139.8 Å²	139.8	82%	0.822	71%	0.711	S	S	*	*	S	Bend	trans	-141.9	15.4	-173.2	-109.7	174.9	0	0	0	116.7
117	H	40	Very low	40.3	Very low	190 Å²	190	144.5 Å²	144.5	88%	0.88	72%	0.723	S	S	*	*	S	Bend	trans	-141.4	38.4	-176.4	-102.4	-68.7	0	0	0	115.1
118	D	37.2	Very low	39.4	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	75%	0.745	S	S	*	*	S	Bend	trans	-125.3	19.2	-179.9	-129.5	-20.7	0	0	0	114
119	I	40.1	Very low	38.5	Very low	162 Å²	162	151.4 Å²	151.4	83%	0.831	76%	0.756	S	S	*	*	S	Bend	trans	-141.1	65.6	172.1	-43.3	177.9	0	0	0	111.3
120	Q	38.9	Very low	37.7	Very low	182 Å²	182	154 Å²	154	85%	0.85	77%	0.768	S	S	*	*	S	Bend	trans	-166.5	167.4	150.8	-153.6	61.6	-5	0	0	110.5
121	E	34.9	Very low	36.9	Very low	178 Å²	178	159.1 Å²	159.1	83%	0.832	78%	0.784	S	S	*	*			trans	71.7	49.1	161	-152.6	132.3	-109.8	0	0	117.9	H123	E121-H123 PolarHBondContact O-N 2.67Å
122	N	34.9	Very low	36.3	Very low	149 Å²	149	158.5 Å²	158.5	80%	0.797	79%	0.791	S	S	*	*			trans	-79	91	150.5	171.6	-2.1	0	0	0	109.7
123	H	35.7	Very low	35.7	Very low	148 Å²	148	163 Å²	163	69%	0.685	80%	0.801	S	S	*	*			trans	-176.6	152.1	146	-106.6	45.8	0	0	0	112.1	E121	E121-H123 PolarHBondContact O-N 2.67Å
124	Q	32	Very low	35.2	Very low	155 Å²	155	158.4 Å²	158.4	72%	0.724	80%	0.801	S	S	*	*			trans	65.3	134.1	173.9	-119.9	47.3	51.3	0	0	115.2
125	D	33.8	Very low	34.6	Very low	128 Å²	128	162.5 Å²	162.5	68%	0.684	82%	0.817	S	S	*	*			cis	-135.8	151.9	11.5	-136.8	-27.3	0	0	0	113.5
126	V	32.2	Very low	34.1	Very low	131 Å²	131	158.7 Å²	158.7	79%	0.794	82%	0.815	S	S	*	*			trans	-112.8	92.8	172.2	176.8	0	0	0	0	108.7
127	K	31.4	Very low	33.4	Very low	196 Å²	196	156.1 Å²	156.1	85%	0.852	81%	0.81	S	S	*	*			trans	179.2	105.7	154.9	-93.6	141.3	-172.5	175.2	0	110.7
128	E	35.8	Very low	32.9	Very low	198 Å²	198	152.7 Å²	152.7	93%	0.925	80%	0.802	S	S	*	*				-160.4	144.3	96.7	-110.2	-171	162.6	0	0	111.4
129	V	32.6	Very low	32.4	Very low	133 Å²	133	154 Å²	154	81%	0.806	80%	0.803	S	S	*	*			trans	-132.2	125.9	176.5	170.5	0	0	0	0	106.2
130	I	30.6	Very low	31.8	Very low	149 Å²	149	152.8 Å²	152.8	76%	0.764	80%	0.799	S	S	*	*			trans	-172	118.5	147.8	-101.7	147.3	0	0	0	110.6
131	Y	30.8	Very low	31.2	Very low	228 Å²	228	154.2 Å²	154.2	89%	0.894	80%	0.802	S	S	*	*			trans	47	132.9	154.3	-65.7	-114.2	0	0	0	120.8
132	G	30.4	Very low	30.8	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	80%	0.796	S	S	*	*			cis	158.1	151.8	-8.8	0	0	0	0	0	115.1
133	R	31.2	Very low	30.5	Very low	259 Å²	259	151.3 Å²	151.3	98%	0.977	80%	0.796	S	S	*	*			trans	46.8	119	154.1	-173.8	-168.7	-72.1	-136.3	0.5	120.2
134	G	30.9	Very low	30.1	Very low	71 Å²	71	152.7 Å²	152.7	73%	0.732	80%	0.803	S	S	*	*			trans	-171.9	150.2	157.2	0	0	0	0	0	113.4
135	Q	30.3	Very low	29.9	Very low	195 Å²	195	152 Å²	152	91%	0.911	80%	0.804	S	S	*	*			trans	-140	161.8	-179	-79.7	-170.3	-16.9	0	0	113
136	A	29.6	Very low	29.6	Very low	92 Å²	92	154.6 Å²	154.6	76%	0.76	81%	0.812	S	S	*	*			trans	76	106.8	147.1	0	0	0	0	0	121.7
137	S	27.3	Very low	29.3	Very low	103 Å²	103	154.3 Å²	154.3	72%	0.72	81%	0.811	S	S	*	*				48.8	111.2	119.7	-154.6	0	0	0	0	122.2
138	T	29.9	Very low	29.1	Very low	118 Å²	118	153.7 Å²	153.7	72%	0.724	81%	0.811	S	S	*	*				53	113.7	125	-34.9	0	0	0	0	121.2
139	Q	27.9	Very low	28.7	Very low	189 Å²	189	149 Å²	149	88%	0.883	80%	0.8	S	S	*	*				-159.8	163.6	129.3	-115	176.4	44.2	0	0	113.2
140	N	27.4	Very low	28.5	Very low	137 Å²	137	153.7 Å²	153.7	73%	0.733	80%	0.804	S	S	*	*			trans	-91.5	163.7	-175.2	-54	-40.5	0	0	0	112.3
141	F	25.6	Very low	28.4	Very low	211 Å²	211	151.6 Å²	151.6	93%	0.925	80%	0.803	S	S	*	*			trans	-155.1	159.7	137.1	-117.4	-77.1	0	0	0	111.8
142	T	26.1	Very low	28.3	Very low	114 Å²	114	146.1 Å²	146.1	70%	0.699	80%	0.798	S	S	*	*			trans	-142.4	145.4	-169.5	-40.4	0	0	0	0	111.7
143	L	30	Very low	29.1	Very low	152 Å²	152	148 Å²	148	80%	0.796	80%	0.798	S	S	*	*			trans	70.7	131.6	159.3	-128.6	77.5	0	0	0	119.3
144	E	25.6	Very low	29	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	79%	0.786	S	S	*	*				-166.1	167.7	104.7	-106	-158.5	128.4	0	0	113.1
145	N	28.1	Very low	28.9	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	78%	0.783	S	S	*	*			trans	-99.5	159.1	177.8	-77	-39	0	0	0	111.5
146	Q	27.9	Very low	28.8	Very low	183 Å²	183	140.6 Å²	140.6	86%	0.855	78%	0.782	S	S	*	*				-167.6	175.4	127.8	-112.4	160.9	98.5	0	0	116.5
147	T	27.2	Very low	28.6	Very low	124 Å²	124	142 Å²	142	76%	0.761	79%	0.786	S	S	*	*			trans	-118.4	162.1	-163	48.3	0	0	0	0	113.7
148	Q	26.3	Very low	28.6	Very low	184 Å²	184	142 Å²	142	86%	0.86	79%	0.786	S	S	*	*			trans	-143.1	151.6	158.9	-66.6	-175.5	2	0	0	107
149	S	27.1	Very low	28.5	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	79%	0.79	S	S	*	*			cis	138.5	122.5	-8.3	-84.9	0	0	0	0	106.9
150	Y	27.6	Very low	28.5	Very low	232 Å²	232	145 Å²	145	91%	0.91	79%	0.791	S	S	*	*			trans	170.2	178.9	148.2	-92.2	-59.1	0	0	0	111.2
151	S	29.8	Very low	28.6	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	79%	0.788	S	S	*	*			trans	-128.1	163.6	-137.3	-50.1	0	0	0	0	118.5
152	S	27.9	Very low	28.8	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	78%	0.78	S	S	*	*			trans	-12.2	161.6	149.2	-52.6	0	0	0	0	119.3
153	P	47.9	Very low	29	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	78%	0.782	S	S	*	*			cis	-157	178.2	40.2	42.6	-19.6	0	0	0	121
154	S	29.1	Very low	28.9	Very low	105 Å²	105	139 Å²	139	73%	0.734	78%	0.78	S	S	*	*			trans	47.4	155	140.8	62	0	0	0	0	124
155	S	28.8	Very low	29.1	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	78%	0.776	S	S	*	*			cis	-175.2	163	-23.3	59.2	0	0	0	0	110.9
156	L	27.3	Very low	29.3	Very low	170 Å²	170	134 Å²	134	89%	0.89	78%	0.776	S	S	*	*			trans	57.2	123.7	156.7	-66.2	163.1	0	0	0	121.7
157	S	26.3	Very low	30.2	Very low	121 Å²	121	130.7 Å²	130.7	85%	0.846	77%	0.77	S	S	*	*				-179.4	163.8	109.9	-160.8	0	0	0	0	113.5
158	S	27.8	Very low	30.3	Very low	102 Å²	102	130.9 Å²	130.9	71%	0.713	77%	0.771	S	S	*	*			trans	-85.2	177.5	174.5	-60.4	0	0	0	0	111
159	T	28	Very low	30.5	Very low	132 Å²	132	127 Å²	127	81%	0.81	77%	0.765	S	S	*	*			cis	-173.4	162	37	-32.5	0	0	0	0	112.8
160	R	27.8	Very low	30.5	Very low	240 Å²	240	127.7 Å²	127.7	91%	0.906	77%	0.769	S	S	*	*			trans	95.6	119.7	139.4	-151.4	171.3	-167.9	166.2	3.1	120.5
161	A	29.4	Very low	30.6	Very low	82 Å²	82	122.2 Å²	122.2	68%	0.678	77%	0.765	S	S	*	*			trans	-69	164.3	-179.9	0	0	0	0	0	117.6
162	N	28.2	Very low	30.6	Very low	141 Å²	141	123 Å²	123	75%	0.754	77%	0.77	S	S	*	*				-171.2	151.5	107.4	-102.8	-8.9	0	0	0	114.9
163	L	30	Very low	32.3	Very low	140 Å²	140	123.1 Å²	123.1	73%	0.733	77%	0.769	S	S	*	*			trans	28.6	141.5	135.7	-51.1	172.4	0	0	0	119.3
164	T	28	Very low	32.6	Very low	123 Å²	123	123.8 Å²	123.8	76%	0.755	77%	0.773	S	S	*	*			cis	-171	-179	11.3	5.7	0	0	0	0	108.3
165	S	29.9	Very low	32.7	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	78%	0.778	S	S	*	*			cis	-168.4	160.5	-3.4	38.4	0	0	0	0	109.9
166	S	33.9	Very low	32.7	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	79%	0.785	S	S	*	*			trans	-88.5	163.2	166.6	-46.3	0	0	0	0	112.6
167	P	47	Very low	32.9	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	78%	0.778	S	S	*	*				-132.1	148.3	94.1	9.1	14.4	0	0	0	113.2
168	T	29	Very low	33.2	Very low	129 Å²	129	125.6 Å²	125.6	79%	0.791	78%	0.781	S	S	*	*				49.4	135.2	80.8	72.3	0	0	0	0	114.3
169	S	28.8	Very low	33.4	Very low	103 Å²	103	124.6 Å²	124.6	72%	0.72	79%	0.787	S	S	*	*			cis	-152.1	136.1	43.5	49.5	0	0	0	0	111.4
170	S	28.6	Very low	33.5	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	79%	0.788	S	S	*	*				73.8	102.1	60.2	79.2	0	0	0	0	117.2
171	S	29.2	Very low	33.6	Very low	117 Å²	117	116.8 Å²	116.8	82%	0.818	77%	0.774	S	S	*	*			trans	-163.9	130.1	147.8	58.3	0	0	0	0	112.1
172	S	30.6	Very low	33.7	Very low	121 Å²	121	121.1 Å²	121.1	85%	0.846	78%	0.783	S	S	*	*			trans	-146.3	-174.1	170.4	-46.9	0	0	0	0	109.4
173	P	63.1	Low	33.8	Very low	116 Å²	116	122.3 Å²	122.3	75%	0.753	79%	0.786	S	S	*	*				-95.2	-176.8	-123.6	42.6	-31.7	0	0	0	114.3
174	P	52.8	Low	33.9	Very low	125 Å²	125	122.5 Å²	122.5	81%	0.812	78%	0.784	S	S	*	*				-147.9	-174.2	103.4	38.1	-22.2	0	0	0	113.7
175	A	32.5	Very low	34.1	Very low	101 Å²	101	121.8 Å²	121.8	84%	0.835	78%	0.784	S	S	*	*			cis	-173	150.8	-48.6	0	0	0	0	0	109.6
176	G	28.1	Very low	34.9	Very low	78 Å²	78	123.2 Å²	123.2	80%	0.804	79%	0.791	S	S	*	*			trans	131.5	147.6	167.2	0	0	0	0	0	114.8
177	S	31.7	Very low	34.6	Very low	106 Å²	106	121.5 Å²	121.5	74%	0.741	79%	0.79	S	S	*	*			cis	-157.3	127.3	-11.2	-164.4	0	0	0	0	112.7
178	R	33.5	Very low	34	Very low	243 Å²	243	122.9 Å²	122.9	92%	0.917	80%	0.797	S	S	*	*			trans	35.3	118.1	146.4	-54.1	173.9	76.4	177.2	4.6	119.8
179	G	30.7	Very low	34.1	Very low	81 Å²	81	122 Å²	122	84%	0.835	80%	0.796	S	S	*	*			trans	-175.4	104.7	160.3	0	0	0	0	0	114.6
180	S	31.3	Very low	34.3	Very low	121 Å²	121	122.5 Å²	122.5	85%	0.846	80%	0.8	S	S	*	*			trans	-88.2	174.3	170.9	-45.3	0	0	0	0	110.4
181	S	29.2	Very low	34.5	Very low	86 Å²	86	122.5 Å²	122.5	60%	0.601	80%	0.8	S	S	*	*			cis	-168.9	149.4	21.8	-148.3	0	0	0	0	114.7
182	M	30.8	Very low	35.4	Very low	174 Å²	174	123.2 Å²	123.2	86%	0.857	80%	0.802	S	S	*	*			trans	68.5	161.3	140.3	-76.3	168.9	-173.9	0	0	124.3
183	M	30	Very low	35.4	Very low	166 Å²	166	122.5 Å²	122.5	82%	0.818	80%	0.796	S	S	*	*			trans	71.4	135.3	178.3	-67.3	-146.3	151.2	0	0	117.3
184	M	33.7	Very low	33.9	Very low	144 Å²	144	124.3 Å²	124.3	71%	0.709	80%	0.798	S	S	*	*			cis	-155.4	168.5	-8.2	-111.8	-56.6	120.7	0	0	111.3
185	S	32.5	Very low	33.1	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	80%	0.799	S	S	*	*			trans	-159	164.2	171	-69.6	0	0	0	0	109
186	P	46.7	Very low	33.3	Very low	135 Å²	135	130.6 Å²	130.6	88%	0.877	80%	0.799	S	S	*	*			cis	-125.8	-169	2.5	42.2	-26.7	0	0	0	113.9
187	G	27.6	Very low	33.4	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	80%	0.803	S	S	*	*			trans	-163.2	156.2	171.1	0	0	0	0	0	113.3
188	T	33.4	Very low	33.6	Very low	141 Å²	141	135.7 Å²	135.7	87%	0.865	80%	0.798	S	S	*	*			trans	-131.1	138	-164.2	53.9	0	0	0	0	115.5
189	S	31.3	Very low	33.9	Very low	111 Å²	111	130 Å²	130	78%	0.776	80%	0.795	S	S	*	*			trans	174.4	129.4	156.2	39	0	0	0	0	108
190	S	32	Very low	34.2	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	80%	0.798	S	S	*	*			cis	92.6	121.6	46.1	75.9	0	0	0	0	114
191	S	34.3	Very low	34.4	Very low	112 Å²	112	136 Å²	136	78%	0.783	79%	0.794	S	S	*	*			trans	-73.3	167.5	-176.8	-43.6	0	0	0	0	113.8
192	P	46.9	Very low	34.9	Very low	132 Å²	132	137.4 Å²	137.4	86%	0.857	80%	0.799	S	S	*	*				-144.7	-166.1	104.9	38.9	-22.9	0	0	0	114.6
193	S	30.8	Very low	35	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	80%	0.8	S	S	*	*			trans	-134.4	167.8	-160.1	-47	0	0	0	0	114.8
194	I	32.5	Very low	35.2	Very low	155 Å²	155	135.7 Å²	135.7	80%	0.795	80%	0.802	S	S	*	*			trans	72.4	128.8	155.8	-76.6	170	0	0	0	115.9
195	T	35.5	Very low	35.1	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	80%	0.804	S	S	*	*				-164	161.9	83.3	-20.2	0	0	0	0	115.6
196	R	37.3	Very low	35.1	Very low	225 Å²	225	135.3 Å²	135.3	85%	0.849	81%	0.808	S	S	*	*			trans	-45.1	155.4	174.4	-67.2	169.2	163.6	147.4	-6.4	118.5
197	F	28.9	Very low	34.3	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.873	80%	0.798	S	S	*	*				-142.3	157.8	119.1	-158.9	-99.8	0	0	0	110.9
198	S	36.5	Very low	34.6	Very low	91 Å²	91	138.9 Å²	138.9	64%	0.636	80%	0.801	S	S	*	*			trans	-121.8	145.7	-177.1	-60.5	0	0	0	0	112
199	S	38.9	Very low	34.7	Very low	124 Å²	124	138.4 Å²	138.4	87%	0.867	80%	0.798	S	S	*	*			trans	-135.8	149.1	161.7	-85.5	0	0	0	0	110.7
200	R	37.4	Very low	34.7	Very low	234 Å²	234	140.1 Å²	140.1	88%	0.883	80%	0.799	S	S	*	*			trans	-125.5	127.2	-164.2	170.9	-177.7	174.7	179.7	-1.1	109.8
201	A	36.9	Very low	34.6	Very low	93 Å²	93	140 Å²	140	77%	0.769	80%	0.798	S	S	*	*			trans	-131.5	133.9	169.8	0	0	0	0	0	109.1
202	T	38.7	Very low	34.8	Very low	116 Å²	116	141.6 Å²	141.6	71%	0.712	80%	0.796	S	S	*	*			trans	-110.9	121.4	-173.9	47.6	0	0	0	0	110.8
203	F	33.3	Very low	34.3	Very low	200 Å²	200	144.4 Å²	144.4	88%	0.877	80%	0.798	S	S	*	*			trans	-99.2	120.7	162.1	-76.7	-84.2	0	0	0	109
204	A	34.7	Very low	34.5	Very low	104 Å²	104	149.2 Å²	149.2	86%	0.86	80%	0.8	S	S	*	*			trans	-85.9	121.5	171.2	0	0	0	0	0	109
205	V	30.9	Very low	34.5	Very low	124 Å²	124	148.7 Å²	148.7	75%	0.752	79%	0.794	S	S	*	*			trans	-109.2	110.8	169.5	175.4	0	0	0	0	107.6	S207	V205-S207 PolarHBondContact O-N 3.22Å
206	S	31.7	Very low	34.6	Very low	120 Å²	120	149.9 Å²	149.9	84%	0.839	79%	0.791	S	S	*	*			trans	-87	85.3	174.8	-170.7	0	0	0	0	109.7	K208	S206-K208 PolarHBondContact O-N 3.31Å
207	S	31.7	Very low	34.7	Very low	96 Å²	96	144 Å²	144	67%	0.671	78%	0.781	S	S	*	*			trans	-86.9	85.8	176.9	55.5	0	0	0	0	110.9	V205 T209	V205-S207 PolarHBondContact O-N 3.22Å; S207-T209 PolarHBondContact O-N 3.07Å
208	K	32.2	Very low	34.8	Very low	188 Å²	188	142.4 Å²	142.4	82%	0.817	78%	0.78	S	S	*	*			trans	-91.4	79.3	175.1	-167.7	172.8	-177.1	176.8	0	111.7	S206	S206-K208 PolarHBondContact O-N 3.31Å
209	T	37.4	Very low	34.8	Very low	131 Å²	131	147 Å²	147	80%	0.804	79%	0.792	S	S	*	*			trans	-82.6	128.3	162.6	48.6	0	0	0	0	109.3	S207	S207-T209 PolarHBondContact O-N 3.07Å
210	N	30.1	Very low	34.6	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	79%	0.788	S	S	*	*			trans	-138.5	116.4	172.1	-152.7	29.7	0	0	0	111.4
211	S	29.6	Very low	34.3	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	78%	0.778	S	S	*	*			trans	-173.2	139.9	179.9	-81.8	0	0	0	0	104.9
212	I	39.6	Very low	34.8	Very low	144 Å²	144	143.1 Å²	143.1	74%	0.738	78%	0.776	S	S	*	*			cis	-160	160.6	5.4	-172.8	163	0	0	0	107.6
213	E	35.4	Very low	34.5	Very low	191 Å²	191	143 Å²	143	89%	0.893	78%	0.775	S	S	*	*			trans	-160.2	161.5	150	-116.6	155.8	-148	0	0	112.1
214	R	34.9	Very low	35.3	Very low	207 Å²	207	139 Å²	139	78%	0.781	77%	0.77	S	S	*	*			trans	-134.5	-172.9	175	-64.3	175.5	163.2	-165.8	-4.9	106.3
215	E	32.9	Very low	35	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	76%	0.76	S	S	*	*			cis	-151.1	165.7	18.7	-87.9	-169.4	172.7	0	0	106.7
216	E	36.5	Very low	35	Very low	159 Å²	159	140.9 Å²	140.9	74%	0.743	77%	0.765	S	S	*	*			cis	-158.1	-175.2	4.8	-110.7	-73.5	94.8	0	0	107.2
217	P	39.5	Very low	34.9	Very low	100 Å²	100	139.4 Å²	139.4	65%	0.649	76%	0.76	S	S	*	*			trans	-97.2	173.1	-161.6	39.3	-40	0	0	0	116.8
218	I	32.3	Very low	34.8	Very low	167 Å²	167	138.3 Å²	138.3	86%	0.856	76%	0.764	S	S	*	*			trans	-137.7	138.2	167.8	-60.5	-179.2	0	0	0	110.6
219	E	36.1	Very low	34.9	Very low	187 Å²	187	137.6 Å²	137.6	87%	0.874	76%	0.764	S	S	*	*			trans	-118.5	114.7	179.9	172.5	-171.4	-162.2	0	0	110.6
220	V	34.8	Very low	34.5	Very low	131 Å²	131	137.7 Å²	137.7	79%	0.794	76%	0.755	S	S	*	*			trans	-157.1	139.3	158.9	-159.8	0	0	0	0	110.7
221	D	29.9	Very low	34.8	Very low	127 Å²	127	137.5 Å²	137.5	68%	0.679	75%	0.754	S	S	*	*			trans	-132.8	137.8	156.5	-179.4	38	0	0	0	107.2	V223	D221-V223 PolarHBondContact OD1-N 3.18Å
222	P	48.1	Very low	34.9	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	75%	0.748	S	S	*	*				-148	128.3	99.4	34.4	-15.2	0	0	0	116.6
223	V	33	Very low	34.8	Very low	114 Å²	114	137.2 Å²	137.2	69%	0.691	75%	0.754	S	S	*	*			trans	-0.3	129.6	130.1	-179	0	0	0	0	115	D221	D221-V223 PolarHBondContact OD1-N 3.18Å
224	P	48.9	Very low	34.7	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	74%	0.739	S	S	*	*				-157.7	170.9	72.3	43.3	-23	0	0	0	121.2
225	A	28.5	Very low	34.4	Very low	79 Å²	79	129.3 Å²	129.3	65%	0.653	74%	0.743	S	S	*	*			trans	111.4	116.5	133.7	0	0	0	0	0	121.7
226	H	32.3	Very low	34.3	Very low	188 Å²	188	127 Å²	127	87%	0.87	75%	0.748	S	S	*	*			trans	65.6	148.6	143.7	-67.6	-49.9	0	0	0	121.5
227	A	29.3	Very low	34	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	75%	0.746	S	S	*	*			cis	-166.7	161.7	-14	0	0	0	0	0	112.9
228	G	28.7	Very low	33.5	Very low	72 Å²	72	127 Å²	127	74%	0.742	75%	0.751	S	S	*	*			trans	80.8	154.1	166.1	0	0	0	0	0	115.5
229	Q	34.8	Very low	33.4	Very low	174 Å²	174	126.6 Å²	126.6	81%	0.813	75%	0.745	S	S	*	*			cis	-161.2	159.1	-6.3	-100.4	172.6	-97.1	0	0	105.3
230	E	29.6	Very low	33.1	Very low	133 Å²	133	121.4 Å²	121.4	62%	0.621	73%	0.729	S	S	*	*			cis	-171.4	-176.9	-7.6	54.4	179.7	-153.9	0	0	109.4
231	N	35.5	Very low	32.8	Very low	141 Å²	141	121.1 Å²	121.1	75%	0.754	73%	0.727	S	S	*	*			trans	69.1	135.9	179.9	-52.1	-47	0	0	0	115
232	G	32.6	Very low	32.9	Very low	65 Å²	65	122 Å²	122	67%	0.67	73%	0.731	S	S	*	*			cis	124.1	130.9	11.4	0	0	0	0	0	109
233	H	36.2	Very low	32.2	Very low	187 Å²	187	121.7 Å²	121.7	87%	0.866	73%	0.727	S	S	*	*			cis	-155.3	152.8	17.2	-104.3	-93.4	0	0	0	113.2
234	A	33.2	Very low	32	Very low	70 Å²	70	125.5 Å²	125.5	58%	0.579	74%	0.737	S	S	*	*			trans	62.4	120	136.2	0	0	0	0	0	124.1
235	N	29.9	Very low	31	Very low	161 Å²	161	123 Å²	123	86%	0.861	73%	0.733	S	S	*	*				78.6	140.7	126.4	-62.6	6.8	0	0	0	120.4
236	A	29.9	Very low	31	Very low	94 Å²	94	129.3 Å²	129.3	78%	0.777	75%	0.746	S	S	*	*			cis	-160	170.4	-5	0	0	0	0	0	113.3
237	S	29.8	Very low	30.9	Very low	99 Å²	99	126.7 Å²	126.7	69%	0.692	74%	0.743	S	S	*	*			trans	-46.6	158.9	159.1	-81.1	0	0	0	0	114.1
238	E	29.3	Very low	31	Very low	161 Å²	161	127.6 Å²	127.6	75%	0.752	74%	0.744	S	S	*	*			cis	-158.2	-158.5	3.2	-123	163.6	-100.2	0	0	111
239	H	31.6	Very low	32.5	Very low	159 Å²	159	130 Å²	130	74%	0.736	75%	0.746	S	S	*	*			cis	-157	166.4	28.4	-178.5	-97.5	0	0	0	114.8
240	S	29.2	Very low	33.6	Very low	77 Å²	77	127.3 Å²	127.3	54%	0.538	74%	0.744	S	S	.	*			trans	-59.5	157.2	178.1	-174.7	0	0	0	0	120
241	V	28.3	Very low	33.6	Very low	126 Å²	126	125.2 Å²	125.2	76%	0.764	75%	0.75	S	S	*	*			trans	174	107.9	134.3	151.7	0	0	0	0	107.3
242	L	32.2	Very low	33.4	Very low	146 Å²	146	126.4 Å²	126.4	76%	0.764	76%	0.756	S	S	*	*				66.2	123.9	74.4	-144	75.7	0	0	0	113
243	V	32.1	Very low	33.2	Very low	104 Å²	104	126.7 Å²	126.7	63%	0.63	76%	0.758	S	S	*	*				-174.2	136.5	76.7	156.6	0	0	0	0	112.6
244	Q	29.4	Very low	33.9	Very low	193 Å²	193	123.1 Å²	123.1	90%	0.902	75%	0.752	S	S	*	*			trans	41.1	152.5	152	-63.3	168.5	-36.5	0	0	122.8
245	G	28.8	Very low	33.9	Very low	66 Å²	66	127 Å²	127	68%	0.68	76%	0.762	S	S	*	*			cis	154.2	162.8	-6.6	0	0	0	0	0	114.6
246	K	27.6	Very low	33.9	Very low	211 Å²	211	126.2 Å²	126.2	92%	0.917	75%	0.754	S	S	*	*			trans	71.9	150.2	178.2	-80.2	-175.4	172.3	-178.8	0	117.9
247	V	30.9	Very low	34.1	Very low	132 Å²	132	129 Å²	129	80%	0.8	75%	0.75	S	S	*	*			cis	-162.6	168.4	-26.9	110.6	0	0	0	0	109.5
248	S	30.8	Very low	34	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	75%	0.753	S	S	*	*			trans	-103.2	-148.3	-159.4	-47.9	0	0	0	0	117.1
249	P	59.5	Low	34.2	Very low	121 Å²	121	125.8 Å²	125.8	79%	0.786	76%	0.757	S	S	*	*				-122	-134.7	-128.3	41.4	-17.8	0	0	0	112.1
250	P	58.6	Low	35.4	Very low	118 Å²	118	124 Å²	124	77%	0.766	76%	0.76	S	S	*	*			cis	-129.5	-170.3	-31.7	40.9	-23.9	0	0	0	113.8
251	A	30.8	Very low	35.5	Very low	90 Å²	90	127.4 Å²	127.4	74%	0.744	78%	0.777	S	S	*	*			trans	-175.3	130	145.1	0	0	0	0	0	115.5
252	D	30.3	Very low	35.7	Very low	166 Å²	166	126.7 Å²	126.7	89%	0.888	77%	0.773	S	S	*	*			trans	32.1	153.6	142	-52.3	-37.1	0	0	0	126.5
253	G	28.4	Very low	36.2	Very low	70 Å²	70	127.6 Å²	127.6	72%	0.722	78%	0.778	S	S	*	*			trans	-99.7	-139.5	171.5	0	0	0	0	0	113.5
254	P	50.6	Low	36.3	Very low	113 Å²	113	134.1 Å²	134.1	73%	0.734	79%	0.791	S	S	*	*			cis	-145.8	-172.8	8.3	47.4	-29.2	0	0	0	117
255	L	33.2	Very low	37.1	Very low	152 Å²	152	133 Å²	133	80%	0.796	79%	0.788	S	S	*	*			trans	65.5	153.8	155	-68	166.9	0	0	0	118.9
256	E	30.6	Very low	37.8	Very low	144 Å²	144	135.7 Å²	135.7	67%	0.673	79%	0.793	S	S	*	*			cis	-157.5	-175.5	-8.5	-143.1	-172	126	0	0	113.3
257	H	33.1	Very low	38.4	Very low	152 Å²	152	133.7 Å²	133.7	70%	0.704	79%	0.787	S	S	*	*			trans	86.4	85	154	-64.9	-18.7	0	0	0	122.2
258	A	29.5	Very low	39.4	Very low	92 Å²	92	135.3 Å²	135.3	76%	0.76	79%	0.79	S	S	*	*				51.6	115.4	107.5	0	0	0	0	0	123.8
259	A	32.4	Very low	40.1	Very low	100 Å²	100	135.3 Å²	135.3	83%	0.826	79%	0.788	S	S	*	*				81.9	153.7	127.8	0	0	0	0	0	121.9
260	P	56.1	Low	39.3	Very low	123 Å²	123	137.6 Å²	137.6	80%	0.799	79%	0.791	S	S	*	*			trans	-117.1	159.3	-161.1	41.3	-29.6	0	0	0	115.9
261	V	32.6	Very low	38.5	Very low	147 Å²	147	137.7 Å²	137.7	89%	0.891	79%	0.79	S	S	*	*			trans	-136.2	151.4	172.2	-179.7	0	0	0	0	112.5
262	T	33.1	Very low	38.7	Very low	112 Å²	112	138.1 Å²	138.1	69%	0.687	79%	0.793	S	S	*	*			trans	-74.9	160.3	-163.8	57.3	0	0	0	0	118.2
263	L	41.5	Very low	39.1	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	79%	0.789	S	S	*	*			trans	39.6	122.3	137.7	-67.7	165.3	0	0	0	119.9
264	R	34.8	Very low	39.5	Very low	240 Å²	240	139.7 Å²	139.7	91%	0.906	80%	0.796	S	S	*	*				178.7	134.6	116.9	-171.9	166.6	-169.6	136.5	-1.9	112.1
265	M	44.8	Very low	38.8	Very low	170 Å²	170	144 Å²	144	84%	0.837	80%	0.802	S	S	*	*			trans	-86.2	139.5	168.9	-59.8	176.9	80.1	0	0	111.5
266	P	45.4	Very low	38.8	Very low	122 Å²	122	142.6 Å²	142.6	79%	0.792	80%	0.801	S	S	*	*			trans	-98.1	144.7	153.8	34.8	-28.1	0	0	0	111.2
267	H	40.3	Very low	39	Very low	169 Å²	169	139.4 Å²	139.4	78%	0.782	80%	0.799	S	S	*	*			trans	-109.7	145	176.1	40	-94.7	0	0	0	109.3
268	L	50.8	Low	38.8	Very low	167 Å²	167	141 Å²	141	87%	0.874	81%	0.806	S	S	*	*			trans	-136	148.3	170.7	-75.2	176.3	0	0	0	110.5
269	P	45.8	Very low	39.4	Very low	109 Å²	109	144.2 Å²	144.2	71%	0.708	81%	0.809	S	S	*	*			trans	-84.5	154.3	-164.1	33.3	-36.7	0	0	0	114.1
270	I	43.3	Very low	39.2	Very low	168 Å²	168	149.2 Å²	149.2	86%	0.862	81%	0.812	S	S	*	*			trans	-78.5	128.3	169.5	-60.2	169	0	0	0	109.2
271	T	41.5	Very low	37.9	Very low	120 Å²	120	147.2 Å²	147.2	74%	0.736	81%	0.806	S	S	*	*			trans	-126.1	97.9	167.4	47.4	0	0	0	0	110.7
272	A	33.6	Very low	37.8	Very low	99 Å²	99	145.1 Å²	145.1	82%	0.818	80%	0.798	S	S	*	*			trans	-75.2	131.9	166.8	0	0	0	0	0	109.4
273	T	39.9	Very low	37.6	Very low	131 Å²	131	145.9 Å²	145.9	80%	0.804	80%	0.803	S	S	*	*			trans	-121.2	116.2	172.1	50.7	0	0	0	0	109.9
274	T	36.5	Very low	37	Very low	139 Å²	139	145.1 Å²	145.1	85%	0.853	80%	0.799	S	S	*	*			trans	-71.5	143.1	170.5	39.3	0	0	0	0	109.9
275	K	36.8	Very low	36.8	Very low	202 Å²	202	139.2 Å²	139.2	88%	0.878	80%	0.795	S	S	*	*			trans	-123.7	115.2	170.5	-172	174.6	-179.4	179.2	0	109.9
276	T	32.6	Very low	37.1	Very low	124 Å²	124	136.7 Å²	136.7	76%	0.761	79%	0.791	S	S	*	*			trans	-131.7	147.6	-178.7	-50.1	0	0	0	0	108.4
277	A	35.6	Very low	36.4	Very low	76 Å²	76	136.5 Å²	136.5	63%	0.628	79%	0.793	S	S	*	*			trans	67	159.9	170.9	0	0	0	0	0	115.4
278	E	28.4	Very low	36.2	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.864	79%	0.794	S	S	*	*			cis	-148.2	172.7	-4.4	-140	162.6	-130.1	0	0	112
279	I	40.9	Very low	36.2	Very low	161 Å²	161	132.3 Å²	132.3	83%	0.826	79%	0.793	S	S	*	*			trans	-108.3	136.4	177.7	-62.8	168.8	0	0	0	109.4
280	K	28.4	Very low	35.6	Very low	204 Å²	204	134.4 Å²	134.4	89%	0.887	80%	0.804	S	S	*	*			trans	-148.7	133.4	160.8	-145.5	161	-171.5	167.4	0	115.6
281	A	30.1	Very low	35	Very low	82 Å²	82	129.3 Å²	129.3	68%	0.678	79%	0.793	S	S	*	*			trans	-45.7	162.3	166.6	0	0	0	0	0	115.2
282	S	29.4	Very low	34.4	Very low	102 Å²	102	129.6 Å²	129.6	71%	0.713	80%	0.8	S	S	*	*			cis	-176.2	161.6	-9.9	-93.3	0	0	0	0	108.8
283	T	29.2	Very low	34.5	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	80%	0.803	S	S	*	*				167.9	148	125.4	33.9	0	0	0	0	115.4
284	N	28.9	Very low	34	Very low	149 Å²	149	133 Å²	133	80%	0.797	81%	0.805	S	S	*	*			trans	64.1	87.8	147.2	-58.6	1.1	0	0	0	122.2
285	S	31.2	Very low	33.8	Very low	116 Å²	116	131.8 Å²	131.8	81%	0.811	80%	0.802	S	S	*	*			trans	-60.4	176.3	132.9	-54.1	0	0	0	0	111.1
286	P	50.9	Low	34.3	Very low	117 Å²	117	128 Å²	128	76%	0.76	80%	0.798	S	S	*	*			cis	-143.1	171.5	14.2	44.2	-26.1	0	0	0	117.9
287	S	30.3	Very low	34.1	Very low	118 Å²	118	127.2 Å²	127.2	83%	0.825	80%	0.798	S	S	*	*				172.2	146.1	114.4	46	0	0	0	0	113.2
288	S	35.5	Very low	34	Very low	115 Å²	115	128 Å²	128	80%	0.804	80%	0.799	S	S	*	*			trans	-131.8	159.9	164.2	-50.2	0	0	0	0	108.3
289	P	51.9	Low	34	Very low	133 Å²	133	127.6 Å²	127.6	86%	0.864	80%	0.797	S	S	*	*			trans	-129.3	178.6	141	34.7	-23	0	0	0	113.1
290	V	33.4	Very low	33.3	Very low	153 Å²	153	123.7 Å²	123.7	93%	0.927	79%	0.789	S	S	*	*			trans	-124.3	150.5	-166.9	162.6	0	0	0	0	111.2
291	G	29.1	Very low	33.4	Very low	61 Å²	61	119.5 Å²	119.5	63%	0.629	79%	0.785	S	S	*	*			trans	129.3	152.1	162.2	0	0	0	0	0	114.1
292	S	30.5	Very low	34.3	Very low	126 Å²	126	121.6 Å²	121.6	88%	0.881	79%	0.791	S	S	*	*			cis	-159.8	171.5	-5.2	-90.4	0	0	0	0	111.1
293	M	34.8	Very low	34.3	Very low	182 Å²	182	121.3 Å²	121.3	90%	0.897	79%	0.789	S	S	*	*			trans	-52.3	146.2	-178.8	-58.4	-71.3	-160.1	0	0	115.6
294	S	29.9	Very low	34.5	Very low	120 Å²	120	121.7 Å²	121.7	84%	0.839	79%	0.791	S	S	*	*			trans	-172.1	150.1	131.1	27.8	0	0	0	0	113.1
295	S	32.6	Very low	34.5	Very low	114 Å²	114	119.8 Å²	119.8	80%	0.797	79%	0.79	S	S	*	*			trans	-118	165.1	165.2	-45.1	0	0	0	0	108
296	P	47.6	Very low	34.2	Very low	121 Å²	121	123.2 Å²	123.2	79%	0.786	79%	0.785	S	S	*	*				-152.8	-170.8	85.6	40.6	-20.5	0	0	0	116.3
297	S	28.1	Very low	34	Very low	108 Å²	108	123.5 Å²	123.5	76%	0.755	79%	0.787	S	S	*	*			trans	-35.6	170.4	172.3	-29.5	0	0	0	0	118.7
298	S	32.8	Very low	33.9	Very low	92 Å²	92	124.7 Å²	124.7	64%	0.643	78%	0.779	S	S	*	*			cis	-139.7	-155.6	9.6	-63.3	0	0	0	0	110.5
299	E	27.9	Very low	34.5	Very low	178 Å²	178	124.9 Å²	124.9	83%	0.832	78%	0.778	S	S	*	*			cis	-157	-170.9	-0.4	-144.6	124.1	81.4	0	0	107.2
300	A	27.6	Very low	33.3	Very low	79 Å²	79	122.6 Å²	122.6	65%	0.653	77%	0.771	S	S	*	*			cis	-155.7	-165.5	8.4	0	0	0	0	0	111.3
301	S	29.1	Very low	33	Very low	115 Å²	115	124.4 Å²	124.4	80%	0.804	77%	0.769	S	S	*	*			trans	-151.7	-179.9	164.8	-46.9	0	0	0	0	108.7
302	P	50.4	Low	32.9	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	78%	0.778	S	S	*	*				-139.7	-160.7	53.1	41.8	-19.3	0	0	0	112.5
303	S	27.8	Very low	32.8	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	78%	0.775	S	S	*	*			cis	-162.7	147.2	14	56.9	0	0	0	0	114.9
304	V	34.6	Very low	32.4	Very low	136 Å²	136	122.3 Å²	122.3	82%	0.824	77%	0.768	S	S	*	*			trans	56.1	134.4	135	172.3	0	0	0	0	120
305	S	28.3	Very low	32.4	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	77%	0.773	S	S	*	*			cis	-166.9	-163.8	-13.2	63.8	0	0	0	0	112.1
306	R	25.8	Very low	32.4	Very low	187 Å²	187	128.6 Å²	128.6	71%	0.706	78%	0.777	S	S	*	*			trans	-102.1	-177.2	170.4	-123.7	-177.3	120	-155.1	6.7	110.3
307	P	45.5	Very low	32	Very low	123 Å²	123	128.4 Å²	128.4	80%	0.799	78%	0.775	S	S	*	*			cis	-135.3	-159.2	34.4	40.6	-18.7	0	0	0	116.9
308	Q	29	Very low	32.3	Very low	143 Å²	143	127.7 Å²	127.7	67%	0.668	78%	0.776	S	S	*	*			trans	-134.3	173.9	-167.3	-136.2	-178.8	-9.9	0	0	108.9
309	P	47.5	Very low	33	Very low	119 Å²	119	129.4 Å²	129.4	77%	0.773	79%	0.785	S	S	*	*				-158.6	-174.6	67.9	43.2	-21.1	0	0	0	118.7
310	A	27.6	Very low	33.1	Very low	86 Å²	86	128.7 Å²	128.7	71%	0.711	79%	0.785	S	S	*	*			trans	88.8	110.2	145.8	0	0	0	0	0	123.5
311	E	26.6	Very low	33.3	Very low	190 Å²	190	131.2 Å²	131.2	89%	0.888	79%	0.792	S	S	*	*			trans	55.1	116.4	138.8	-52.8	-162.2	147.3	0	0	124.3
312	S	26.4	Very low	33.4	Very low	118 Å²	118	135 Å²	135	83%	0.825	79%	0.794	S	S	*	*				-180	147.3	98.4	42.6	0	0	0	0	115.5
313	S	27.8	Very low	32.3	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	80%	0.795	S	S	*	*			trans	37.8	102.6	156.4	-60.1	0	0	0	0	124.7
314	A	26.6	Very low	32.2	Very low	91 Å²	91	141.5 Å²	141.5	75%	0.752	80%	0.803	S	S	*	*				53.1	116.7	119.3	0	0	0	0	0	123.4
315	L	29.8	Very low	32	Very low	181 Å²	181	141.1 Å²	141.1	95%	0.948	80%	0.801	S	S	*	*				-169.6	172.7	93.8	-95.1	171.5	0	0	0	111.6
316	Q	32.7	Very low	32.8	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	79%	0.794	S	S	*	*			trans	-113.5	158.7	-163.3	-83	-95.3	-26.8	0	0	115.4
317	P	39.3	Very low	33.1	Very low	117 Å²	117	138 Å²	138	76%	0.76	80%	0.8	S	S	*	*			trans	-102	-173.5	-174.7	41.4	-36.3	0	0	0	115.5
318	A	36.1	Very low	33.6	Very low	92 Å²	92	137.5 Å²	137.5	76%	0.76	80%	0.797	S	S	*	*			trans	-86.3	166.2	-173.3	0	0	0	0	0	115.9
319	P	47	Very low	33.7	Very low	129 Å²	129	137.7 Å²	137.7	84%	0.838	81%	0.807	S	S	*	*			trans	-111.1	174.8	174.5	40.3	-32.5	0	0	0	115.9
320	I	29.3	Very low	33.1	Very low	162 Å²	162	143.2 Å²	143.2	83%	0.831	81%	0.813	S	S	*	*			trans	-100.7	158.7	-163.2	-75.2	163	0	0	0	114.5
321	V	32	Very low	33.3	Very low	132 Å²	132	145.6 Å²	145.6	80%	0.8	82%	0.819	S	S	*	*			trans	-49.5	147.3	173.1	179.2	0	0	0	0	114.4
322	K	30.9	Very low	33.7	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	82%	0.818	S	S	*	*			trans	-139.3	142.6	163.8	-71.1	-168.9	176.9	-178.8	0	113.7
323	T	27.8	Very low	33.8	Very low	135 Å²	135	142.7 Å²	142.7	83%	0.828	82%	0.818	S	S	*	*			trans	-75.8	161	178.9	-45	0	0	0	0	112.7
324	W	25.2	Very low	33.9	Very low	222 Å²	222	142.5 Å²	142.5	84%	0.841	82%	0.816	S	S	*	*			trans	-127.3	135.5	178.9	-127.7	82.3	0	0	0	112.7	P326	W324-P326 HydrophobicContact CZ3-CB 4.15Å
325	T	30.3	Very low	34.8	Very low	128 Å²	128	144 Å²	144	79%	0.785	82%	0.819	S	S	*	*			trans	-148.8	134.1	169.8	47.7	0	0	0	0	109.8
326	P	46	Very low	34.7	Very low	96 Å²	96	142.5 Å²	142.5	62%	0.623	81%	0.806	S	S	*	*			trans	-98.4	170.4	-171.9	37.9	-36.5	0	0	0	114.7	W324	W324-P326 HydrophobicContact CZ3-CB 4.15Å
327	T	31.5	Very low	34.6	Very low	135 Å²	135	140.9 Å²	140.9	83%	0.828	80%	0.799	S	S	*	*			trans	160.7	-172.6	139.4	49.8	0	0	0	0	109.8
328	P	56	Low	34.1	Very low	113 Å²	113	142.8 Å²	142.8	73%	0.734	80%	0.797	S	S	*	*				-136	149.9	-95.3	39.5	-20.2	0	0	0	116.9
329	V	32.3	Very low	33.7	Very low	148 Å²	148	144.1 Å²	144.1	90%	0.897	79%	0.792	S	S	*	*			trans	-141.8	141.1	170.7	180	0	0	0	0	112.8
330	R	34.1	Very low	32.8	Very low	234 Å²	234	147.4 Å²	147.4	88%	0.883	79%	0.793	S	S	*	*			trans	-100	158.2	166.8	-72.6	173.3	164	172.9	-5.5	110.4
331	T	30.8	Very low	32.8	Very low	137 Å²	137	144.4 Å²	144.4	84%	0.84	79%	0.792	S	S	*	*				178.4	162.2	122.6	-78	0	0	0	0	112.5
332	L	35.4	Very low	32.7	Very low	168 Å²	168	145.9 Å²	145.9	88%	0.88	80%	0.796	S	S	*	*			trans	-53.6	155.7	-169.4	-76.6	63.3	0	0	0	117.5
333	G	28.8	Very low	32.6	Very low	79 Å²	79	142.4 Å²	142.4	81%	0.814	80%	0.796	S	S	*	*			trans	-179.2	120.3	155.5	0	0	0	0	0	113.1
334	S	30.5	Very low	33	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	79%	0.791	S	S	*	*			trans	-159.6	140	171.7	-178.5	0	0	0	0	109.5
335	P	45.3	Very low	33.5	Very low	124 Å²	124	135.7 Å²	135.7	81%	0.805	79%	0.79	S	S	*	*				-149	135.2	115.1	34.9	-17.2	0	0	0	117.2
336	H	28.2	Very low	33.5	Very low	148 Å²	148	135.1 Å²	135.1	69%	0.685	79%	0.792	S	S	*	*				65.8	109.3	125.6	-153.4	72.6	0	0	0	123.4
337	H	30.8	Very low	32.7	Very low	152 Å²	152	140.1 Å²	140.1	70%	0.704	80%	0.803	S	S	*	*			trans	68.7	154.7	149.3	-77	-139.7	0	0	0	118.4
338	Q	28.2	Very low	32.7	Very low	157 Å²	157	138.5 Å²	138.5	73%	0.734	80%	0.798	S	S	*	*			cis	-151.4	166.3	25.1	-145.8	175.7	-65.7	0	0	114.2
339	D	26.5	Very low	31.3	Very low	120 Å²	120	140.1 Å²	140.1	64%	0.642	81%	0.805	S	S	*	*			trans	51.2	96.1	156.8	-69.8	-42.7	0	0	0	125.2
340	K	29.5	Very low	31.1	Very low	198 Å²	198	138.7 Å²	138.7	86%	0.861	80%	0.797	S	S	*	*				49.2	106.2	103.1	-169.5	-176.8	-175.7	178.9	0	121.4
341	A	27.6	Very low	30.7	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	80%	0.798	S	S	*	*			trans	-161.3	166.3	143.8	0	0	0	0	0	112.2
342	N	30.1	Very low	30.7	Very low	164 Å²	164	136.5 Å²	136.5	88%	0.877	79%	0.79	S	S	*	*			trans	-114	163.3	-172.7	-77.3	-25.3	0	0	0	114.5
343	S	28.9	Very low	30.3	Very low	123 Å²	123	131.6 Å²	131.6	86%	0.86	78%	0.779	S	S	*	*			trans	85.4	137.7	154.3	-154.2	0	0	0	0	119.3
344	A	36.1	Very low	30.4	Very low	87 Å²	87	135.3 Å²	135.3	72%	0.719	78%	0.78	S	S	*	*			trans	-98.5	161.5	167.1	0	0	0	0	0	111.3
345	P	37.2	Very low	30.4	Very low	128 Å²	128	138 Å²	138	83%	0.831	78%	0.78	S	S	*	*			trans	-112.7	159.2	169.4	38.2	-30.3	0	0	0	114.3
346	S	30.4	Very low	29.6	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	78%	0.775	S	S	*	*			trans	-92.2	159.6	-172.8	-35.6	0	0	0	0	115
347	K	29.1	Very low	29.6	Very low	201 Å²	201	137.8 Å²	137.8	87%	0.874	77%	0.772	S	S	*	*			trans	-147.1	130	143.5	-63.3	-168.6	-178.2	-179.5	0	108.6
348	S	31.5	Very low	29.5	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	77%	0.77	S	S	*	*			cis	99	110.6	21.1	77.7	0	0	0	0	115.3
349	V	26.1	Very low	29.7	Very low	148 Å²	148	139.9 Å²	139.9	90%	0.897	78%	0.776	S	S	*	*			trans	-148.1	147.1	148.8	177.7	0	0	0	0	107.6
350	T	28.3	Very low	30.3	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.724	78%	0.784	S	S	*	*			trans	-135.4	155.9	-174.8	-52	0	0	0	0	110.5
351	Y	25.6	Very low	30.6	Very low	229 Å²	229	139.7 Å²	139.7	90%	0.898	78%	0.779	S	S	*	*			trans	-134.8	156.4	155.8	-163.1	-95.6	0	0	0	110.3
352	S	30.6	Very low	31.1	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	77%	0.769	S	S	*	*			trans	-137.1	153.8	-157.3	-58.5	0	0	0	0	115.3
353	G	27.7	Very low	31.4	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	76%	0.758	S	S	*	*			trans	175.6	111.7	165.2	0	0	0	0	0	108.4
354	L	31.4	Very low	31.6	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	75%	0.75	S	S	*	*				63.8	123.5	73.7	-63.8	174.3	0	0	0	112.2
355	Q	29.8	Very low	31.3	Very low	168 Å²	168	142.6 Å²	142.6	79%	0.785	75%	0.753	S	S	*	*			cis	-165.3	164.8	-0.9	-151.9	174	35.8	0	0	111.6
356	H	29.2	Very low	31	Very low	153 Å²	153	143.7 Å²	143.7	71%	0.708	75%	0.751	S	S	*	*			trans	80.9	110.6	147.9	-136.4	44.7	0	0	0	123
357	N	26.6	Very low	30.8	Very low	115 Å²	115	142.5 Å²	142.5	62%	0.615	74%	0.742	S	S	*	*				63.7	140.6	124.1	-76.2	50.1	0	0	0	128
358	D	29.5	Very low	30.7	Very low	123 Å²	123	136.5 Å²	136.5	66%	0.658	74%	0.737	S	S	*	*			trans	81.3	105.1	136.8	-80.8	-60.7	0	0	0	125.5
359	R	32	Very low	30.7	Very low	229 Å²	229	139.8 Å²	139.8	86%	0.864	74%	0.741	S	S	*	*				74.4	154.2	120.1	-102.5	178.9	171.7	-136.5	-3.4	124.8
360	D	39.3	Very low	30.8	Very low	150 Å²	150	139.6 Å²	139.6	80%	0.802	74%	0.74	S	S	*	*			trans	-99.1	155	-170.5	-34.2	-112.5	0	0	0	115.4
361	E	36.8	Very low	31.1	Very low	165 Å²	165	137.6 Å²	137.6	77%	0.771	74%	0.743	S	S	*	*			trans	-178.3	158.6	141.2	-96.8	-146.1	110.5	0	0	108.9	K363	E361-K363 IonicContact OE1-NZ 3.29Å; E361-K363 PolarHBondContact OE1-NZ 3.16Å
362	D	37.4	Very low	31.3	Very low	109 Å²	109	136 Å²	136	58%	0.583	74%	0.744	S	S	*	*			cis	-172.2	177.7	-29.3	-167.4	10.7	0	0	0	109.3
363	K	36.8	Very low	31.6	Very low	150 Å²	150	143.1 Å²	143.1	65%	0.652	76%	0.756	S	S	*	*			trans	70.7	151.2	152	-78.8	153.5	-167.7	110.4	0	118.3	E361	E361-K363 IonicContact OE1-NZ 3.29Å; E361-K363 PolarHBondContact OE1-NZ 3.16Å
364	N	32.4	Very low	32	Very low	130 Å²	130	149.8 Å²	149.8	70%	0.695	76%	0.761	S	S	*	*			cis	-165.5	171.4	-13.4	-166.9	15.6	0	0	0	112.3
365	N	30.4	Very low	32.2	Very low	144 Å²	144	151 Å²	151	77%	0.77	75%	0.754	S	S	*	*			trans	89.4	157	145.6	-90.8	-14	0	0	0	123.3
366	N	30.6	Very low	32.2	Very low	150 Å²	150	150.7 Å²	150.7	80%	0.802	75%	0.753	S	S	*	*			trans	-150.1	-172.1	-167	-151	8.7	0	0	0	106.8
367	C	26.3	Very low	32.3	Very low	92 Å²	92	150.3 Å²	150.3	62%	0.622	76%	0.755	S	S	*	*			cis	-160.1	166.3	10.8	-168.2	0	0	0	0	110.3
368	G	26.5	Very low	32.7	Very low	74 Å²	74	150.7 Å²	150.7	76%	0.763	76%	0.762	S	S	*	*			trans	-150.9	133.9	169.1	0	0	0	0	0	111.5
369	Q	31.4	Very low	32.7	Very low	170 Å²	170	155.4 Å²	155.4	79%	0.794	77%	0.77	S	S	*	*			trans	-133.3	175.8	-164.4	-74.9	-171	-19.5	0	0	114.5
370	V	29.1	Very low	33	Very low	144 Å²	144	149.7 Å²	149.7	87%	0.873	77%	0.766	S	S	*	*			trans	97.3	129	151.4	-170	0	0	0	0	117.8
371	G	33	Very low	32.8	Very low	76 Å²	76	151.2 Å²	151.2	78%	0.784	77%	0.768	S	S	*	*			trans	147.6	79.5	157.2	0	0	0	0	0	116.9
372	E	31.3	Very low	32.9	Very low	196 Å²	196	149.4 Å²	149.4	92%	0.916	77%	0.769	S	S	*	*			trans	-98.4	143.3	176.9	-62.5	-172.8	114.1	0	0	114.8
373	R	36.2	Very low	33.3	Very low	246 Å²	246	151.9 Å²	151.9	93%	0.928	78%	0.781	S	S	*	*			trans	-156.6	134.7	140.5	-158.3	159.8	-75.9	-143.9	-0.1	114.5
374	R	35.5	Very low	33.7	Very low	203 Å²	203	150 Å²	150	77%	0.766	78%	0.784	S	S	*	*			trans	-56	164.7	170.4	-87.8	167.1	150.6	159.1	-6.5	114.3
375	R	36.7	Very low	34.6	Very low	183 Å²	183	156 Å²	156	69%	0.691	80%	0.797	S	S	*	*			cis	-155.1	141	16.6	-112.3	143.4	-176.6	157.6	-2.8	108.5
376	E	29	Very low	35.3	Very low	162 Å²	162	154 Å²	154	76%	0.757	79%	0.786	S	S	*	*				70	121	97.4	-143.6	166	-135	0	0	113.4
377	L	30.9	Very low	36.3	Very low	145 Å²	145	151.4 Å²	151.4	76%	0.759	79%	0.786	S	S	*	*				-152.4	147.3	59	-103.7	84.6	0	0	0	115.1
378	V	35.7	Very low	37.8	Very low	124 Å²	124	155.1 Å²	155.1	75%	0.752	79%	0.794	S	S	*	*			trans	68.1	133.3	141.5	177.7	0	0	0	0	122.5
379	R	29.3	Very low	38.9	Very low	221 Å²	221	154 Å²	154	83%	0.834	78%	0.777	S	S	*	*			trans	95	80	159.1	-130.3	171.9	-173	90.5	-0.2	120.6
380	S	38	Very low	39.9	Very low	110 Å²	110	156.6 Å²	156.6	77%	0.769	78%	0.78	S	S	*	*			trans	80.7	123.4	139.7	-55.4	0	0	0	0	120.6
381	Q	35.5	Very low	41.1	Very low	182 Å²	182	159.3 Å²	159.3	85%	0.85	77%	0.774	S	S	*	*			trans	-57.7	143.7	172.4	-55.8	164.3	29.8	0	0	111
382	T	38.5	Very low	41.7	Very low	127 Å²	127	158.8 Å²	158.8	78%	0.779	76%	0.759	S	S	*	*			cis	76.7	124.3	35.3	-40.1	0	0	0	0	114.3
383	L	46.6	Very low	42.6	Very low	161 Å²	161	155.6 Å²	155.6	84%	0.843	75%	0.746	S	S	*	*			trans	-78.9	142.6	-175.3	-61.1	99.4	0	0	0	113.5
384	P	44.1	Very low	43.1	Very low	111 Å²	111	152.9 Å²	152.9	72%	0.721	74%	0.742	S	S	*	*			trans	-73.4	134.1	166.2	-15.5	30.7	0	0	0	112.5
385	R	52	Low	43.6	Very low	256 Å²	256	150.4 Å²	150.4	97%	0.966	74%	0.739	S	S	*	*			trans	-108.3	74.5	179.1	-175.2	-178.5	173.2	147.4	-2.6	111.3
386	N	44.4	Very low	44.2	Very low	102 Å²	102	152.1 Å²	152.1	55%	0.545	75%	0.745	S	S	.	*			trans	-148.3	139.5	173.9	53.9	2.3	0	0	0	113.4	Q388	N386-Q388 VanDerWaalsContact C-N 3.33Å; N386-Q388 PolarHBondContact O-N 3.11Å
387	A	51.5	Low	44.9	Very low	95 Å²	95	152.1 Å²	152.1	79%	0.785	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.5	-166.6	0	0	0	0	0	115.5
388	Q	57.8	Low	45.3	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.794	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-24.7	-179.7	-72.8	170.6	-31.8	0	0	113.1	N386 R390	N386-Q388 VanDerWaalsContact C-N 3.33Å; N386-Q388 PolarHBondContact O-N 3.11Å; Q388-R390 PolarHBondContact O-N 3.42Å; Q388-R390 VanDerWaalsContact O-N 3.15Å
389	A	50.7	Low	45.4	Very low	50 Å²	50	151.3 Å²	151.3	41%	0.413	75%	0.75	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-6.9	-177.4	0	0	0	0	0	115
390	R	52.6	Low	45.7	Very low	224 Å²	224	149.9 Å²	149.9	85%	0.845	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-10.4	-179.4	-86.4	-170.6	165.9	-159.3	-5.6	115.4	Q388	Q388-R390 PolarHBondContact O-N 3.42Å; Q388-R390 VanDerWaalsContact O-N 3.15Å
391	R	53.6	Low	45.5	Very low	202 Å²	202	151.4 Å²	151.4	76%	0.762	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-39.5	-174.8	-59.1	-170.3	-172.7	-140.3	2.1	113	I393 F394	R391-I393 PolarHBondContact O-N 2.94Å; R391-I393 VanDerWaalsContact O-N 3.15Å; R391-F394 PolarHBondContact O-N 3.5Å
392	S	45.8	Very low	45.4	Very low	65 Å²	65	147.7 Å²	147.7	46%	0.455	75%	0.751	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	-2.2	-176.1	52	0	0	0	0	116.2
393	I	50.1	Low	45.2	Very low	128 Å²	128	149.9 Å²	149.9	66%	0.656	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-30.4	172.8	-59.8	177.5	0	0	0	110.8	R391 E395	R391-I393 PolarHBondContact O-N 2.94Å; R391-I393 VanDerWaalsContact O-N 3.15Å; I393-E395 VanDerWaalsContact C-N 3.32Å
394	F	47.6	Very low	44.6	Very low	189 Å²	189	148.2 Å²	148.2	83%	0.829	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-77.6	-20.5	-178.6	-143.2	-89.1	0	0	0	112.8	R391	R391-F394 PolarHBondContact O-N 3.5Å
395	E	44.4	Very low	44	Very low	152 Å²	152	154.3 Å²	154.3	71%	0.71	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-88.7	-4.2	-174.7	-164.1	167.6	-153.7	0	0	113.5	I393	I393-E395 VanDerWaalsContact C-N 3.32Å
396	R	49.5	Very low	43.3	Very low	218 Å²	218	147.6 Å²	147.6	82%	0.823	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-107.2	12.5	-174.3	-73.5	-174.6	172.4	179.3	-1.9	115.4
397	L	45.3	Very low	43.3	Very low	162 Å²	162	152.2 Å²	152.2	85%	0.848	77%	0.767	S	S	*	*	S	Bend	trans	-115.4	-4.7	174.3	-99.9	80.8	0	0	0	114.3
398	D	37.6	Very low	42.7	Very low	145 Å²	145	153.5 Å²	153.5	78%	0.775	77%	0.768	S	S	*	*	S	Bend	trans	-113.2	26.2	-170.4	-157.3	37.9	0	0	0	112.9
399	S	38.9	Very low	41.9	Very low	107 Å²	107	149.7 Å²	149.7	75%	0.748	77%	0.765	S	S	*	*	S	Bend	trans	-153.8	55.3	-174.7	-71.7	0	0	0	0	114.4
400	E	35.1	Very low	41.7	Very low	192 Å²	192	150.9 Å²	150.9	90%	0.897	78%	0.783	S	S	*	*			trans	-152.5	168.1	143.4	-82.4	-140.4	125.3	0	0	109.7
401	V	34.4	Very low	41.4	Very low	141 Å²	141	148.3 Å²	148.3	86%	0.855	79%	0.785	S	S	*	*			trans	75.2	77.2	178.9	-164.8	0	0	0	0	116.2
402	S	33.1	Very low	41.2	Very low	104 Å²	104	148.3 Å²	148.3	73%	0.727	79%	0.79	S	S	*	*			trans	-131.2	132.9	142.3	-106	0	0	0	0	106.8
403	H	34.5	Very low	41.1	Very low	173 Å²	173	156 Å²	156	80%	0.801	81%	0.809	S	S	*	*			cis	-141.8	152.6	14.6	-47.2	-73.3	0	0	0	113
404	S	34.1	Very low	40.9	Very low	126 Å²	126	155.2 Å²	155.2	88%	0.881	82%	0.815	S	S	*	*			trans	-177	169.2	135.7	39.7	0	0	0	0	112.4
405	R	31.1	Very low	41	Very low	240 Å²	240	153 Å²	153	91%	0.906	81%	0.808	S	S	*	*			trans	-59.5	165.8	-175.9	-97	-177.2	171.9	-165.4	-0.1	114.4
406	P	36.8	Very low	41	Very low	114 Å²	114	151 Å²	151	74%	0.74	81%	0.81	S	S	*	*			cis	-126.9	-172.5	-0.5	39.1	-22.1	0	0	0	114.5
407	K	44.8	Very low	41	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.865	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.3	132.8	177.2	-61	179.3	-179.8	-179.4	0	112.2
408	P	38.5	Very low	41.3	Very low	122 Å²	122	142.5 Å²	142.5	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.9	144.5	159.3	31.9	-32.4	0	0	0	110.7
409	A	42.1	Very low	41.8	Very low	90 Å²	90	141.4 Å²	141.4	74%	0.744	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.8	148	172.8	0	0	0	0	0	111	L411	A409-L411 PolarHBondContact O-N 2.88Å; A409-L411 VanDerWaalsContact O-N 3.15Å
410	G	46.1	Very low	42.9	Very low	75 Å²	75	139 Å²	139	77%	0.773	78%	0.775	S	S	*	*			trans	-69.9	109.8	-178.4	0	0	0	0	0	112.2	K412	G410-K412 PolarHBondContact O-N 3.08Å
411	L	45.8	Very low	45	Very low	170 Å²	170	134.5 Å²	134.5	89%	0.89	76%	0.76	S	S	*	*			trans	-60.7	102.7	161.9	-97.6	66.2	0	0	0	108.4	A409 R413	A409-L411 PolarHBondContact O-N 2.88Å; A409-L411 VanDerWaalsContact O-N 3.15Å; L411-R413 VanDerWaalsContact C-N 3.27Å; L411-R413 PolarHBondContact O-N 2.91Å
412	K	49.4	Very low	47.1	Very low	202 Å²	202	131 Å²	131	88%	0.878	75%	0.746	S	S	*	*			trans	-63.4	92.6	165	-73.5	-173.3	177.9	-179.6	0	107.7	G410 S414	G410-K412 PolarHBondContact O-N 3.08Å; K412-S414 PolarHBondContact O-N 3.27Å; K412-S414 VanDerWaalsContact O-N 3.08Å
413	R	43.8	Very low	49.5	Very low	227 Å²	227	130 Å²	130	86%	0.857	74%	0.739	S	S	*	*			trans	-49.2	117.6	165.5	177.2	-179.5	-66.1	101.9	1.2	107.1	L411 Q415	L411-R413 VanDerWaalsContact C-N 3.27Å; L411-R413 PolarHBondContact O-N 2.91Å; R413-Q415 PolarHBondContact O-N 2.85Å; R413-Q415 VanDerWaalsContact O-N 3.17Å
414	S	45.5	Very low	52.1	Low	112 Å²	112	124.1 Å²	124.1	78%	0.783	72%	0.718	S	S	*	*			trans	-50	121.9	-169.6	-52.6	0	0	0	0	111	K412 S416	K412-S414 PolarHBondContact O-N 3.27Å; K412-S414 VanDerWaalsContact O-N 3.08Å; S414-S416 PolarHBondContact O-N 3.37Å
415	Q	49.6	Very low	54.9	Low	142 Å²	142	121.2 Å²	121.2	66%	0.664	69%	0.692	S	S	*	*			trans	-67.2	106.4	166.1	-96.4	-147.4	47.2	0	0	107.9	R413 F417	R413-Q415 PolarHBondContact O-N 2.85Å; R413-Q415 VanDerWaalsContact O-N 3.17Å; Q415-F417 HydrophobicContact CB-CD2 3.79Å; Q415-F417 HydrophobicContact CB-CE2 3.68Å; Q415-F417 HydrophobicContact CB-CG 4.39Å; Q415-F417 HydrophobicContact CB-CZ 4.21Å; Q415-F417 WeakPolarHBondContact O-CD2 3.45Å; Q415-F417 PolarHBondContact O-N 3.38Å
416	S	45	Very low	57.9	Low	109 Å²	109	112.5 Å²	112.5	76%	0.762	66%	0.66	S	S	*	*			trans	-68.2	77.5	157.6	55.6	0	0	0	0	108.6	S414 G418	S414-S416 PolarHBondContact O-N 3.37Å; S416-G418 PolarHBondContact O-N 3.11Å
417	F	48.9	Very low	60.6	Low	130 Å²	130	112.8 Å²	112.8	57%	0.57	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	110.3	169.9	-71.9	-88.2	0	0	0	108.1	R57 Q415	R57-F417 VanDerWaalsContact NH2-CB 3.27Å; R57-F417 PolarHBondContact NH2-O 3.03Å; Q415-F417 HydrophobicContact CB-CD2 3.79Å; Q415-F417 HydrophobicContact CB-CE2 3.68Å; Q415-F417 HydrophobicContact CB-CG 4.39Å; Q415-F417 HydrophobicContact CB-CZ 4.21Å; Q415-F417 WeakPolarHBondContact O-CD2 3.45Å; Q415-F417 PolarHBondContact O-N 3.38Å
418	G	51.5	Low	63	Low	72 Å²	72	108.2 Å²	108.2	74%	0.742	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.2	-35.6	-173.3	0	0	0	0	0	112.4	S416	S416-G418 PolarHBondContact O-N 3.11Å
419	V	49.4	Very low	65.8	Low	123 Å²	123	102.9 Å²	102.9	75%	0.745	60%	0.6	S	S	*	*			trans	-128	103.1	160.6	-177	0	0	0	0	108.3	T421	V419-T421 PolarHBondContact O-N 3.04Å; V419-T421 VanDerWaalsContact O-N 3.16Å
420	S	62	Low	68.3	Low	57 Å²	57	98.9 Å²	98.9	40%	0.399	57%	0.566	S	S	.	*			trans	-60.2	116.2	158.7	36.9	0	0	0	0	107.2	I425	S420-I425 WeakPolarHBondContact O-CD1 3.19Å; S420-I425 WeakPolarHBondContact OG-CG1 3.44Å
421	T	79.8	Confident	70.7	Confident	97 Å²	97	100.3 Å²	100.3	60%	0.595	55%	0.553	S	S	*	*			trans	-50.8	147	179.7	-46.3	0	0	0	0	109.8	V419 S423 S424 I425	V419-T421 PolarHBondContact O-N 3.04Å; V419-T421 VanDerWaalsContact O-N 3.16Å; T421-S423 CarbonylContact O-C 3.57Å; T421-S423 PolarHBondContact O-N 3.06Å; T421-S424 WeakPolarHBondContact O-CA 3.26Å; T421-S424 VanDerWaalsContact O-CB 3.31Å; T421-S424 WeakPolarHBondContact O-CB 3.33Å; T421-S424 PolarHBondContact O-N 3.3Å; T421-I425 PolarHBondContact O-N 2.88Å; T421-I425 VanDerWaalsContact O-N 3.11Å
422	A	76.8	Confident	73.1	Confident	67 Å²	67	93.7 Å²	93.7	55%	0.554	52%	0.516	S	S	*	.	H	α-helix	trans	-49.6	-33.9	-177.5	0	0	0	0	0	113.7	I425 K426	A422-I425 PolarHBondContact O-N 3.29Å; A422-K426 WeakPolarHBondContact O-CB 3.47Å; A422-K426 WeakPolarHBondContact O-CG 3.38Å; A422-K426 PolarHBondContact O-N 3.04Å
423	S	84.7	Confident	75.4	Confident	83 Å²	83	84 Å²	84	58%	0.58	47%	0.474	S	S	*	.	H	α-helix	trans	-62.7	-40.6	171.7	-44.3	0	0	0	0	113.8	T421 K426 Q427	T421-S423 CarbonylContact O-C 3.57Å; T421-S423 PolarHBondContact O-N 3.06Å; S423-K426 PolarHBondContact O-N 3.11Å; S423-Q427 WeakPolarHBondContact O-CG 3.5Å; S423-Q427 PolarHBondContact O-N 3.28Å
424	S	88.8	Confident	77.9	Confident	50 Å²	50	77.2 Å²	77.2	35%	0.35	45%	0.448	S	S	.	.	H	α-helix	trans	-67.4	-42.3	175.2	168.2	0	0	0	0	111.7	T421 K426 Q427 I428	T421-S424 WeakPolarHBondContact O-CA 3.26Å; T421-S424 VanDerWaalsContact O-CB 3.31Å; T421-S424 WeakPolarHBondContact O-CB 3.33Å; T421-S424 PolarHBondContact O-N 3.3Å; S424-K426 VanDerWaalsContact C-N 3.31Å; S424-K426 PolarHBondContact O-N 3.46Å; S424-Q427 PolarHBondContact O-N 3.14Å; S424-I428 WeakPolarHBondContact O-CG1 3.34Å; S424-I428 PolarHBondContact O-N 2.76Å
425	I	92.6	Very high	80.3	Confident	65 Å²	65	75.4 Å²	75.4	33%	0.333	44%	0.436	S	S	.	.	H	α-helix	trans	-59.9	-44.7	173.8	-60.1	174.4	0	0	0	110.2	S420 T421 A422 Q427 I428 L429 F519	S420-I425 WeakPolarHBondContact O-CD1 3.19Å; S420-I425 WeakPolarHBondContact OG-CG1 3.44Å; T421-I425 PolarHBondContact O-N 2.88Å; T421-I425 VanDerWaalsContact O-N 3.11Å; A422-I425 PolarHBondContact O-N 3.29Å; I425-Q427 VanDerWaalsContact C-N 3.35Å; I425-Q427 PolarHBondContact O-N 3.04Å; I425-I428 PolarHBondContact O-N 2.81Å; I425-L429 WeakPolarHBondContact O-CB 3.18Å; I425-L429 PolarHBondContact O-N 3Å; I425-F519 HydrophobicContact CG2-CZ 4.25Å
426	K	93.4	Very high	82.5	Confident	56 Å²	56	70.8 Å²	70.8	24%	0.243	41%	0.413	C	S	.	.	H	α-helix	trans	-58.6	-41.2	174.8	-81.1	178.5	175.5	-168.5	0	112.9	A422 S423 S424 L430 F448 M516 F519	A422-K426 WeakPolarHBondContact O-CB 3.47Å; A422-K426 WeakPolarHBondContact O-CG 3.38Å; A422-K426 PolarHBondContact O-N 3.04Å; S423-K426 PolarHBondContact O-N 3.11Å; S424-K426 VanDerWaalsContact C-N 3.31Å; S424-K426 PolarHBondContact O-N 3.46Å; K426-L430 VanDerWaalsContact O-CB 3.22Å; K426-L430 WeakPolarHBondContact O-CB 3.48Å; K426-L430 PolarHBondContact O-N 2.69Å; K426-L430 VanDerWaalsContact O-N 3.11Å; K426-F448 HydrophobicContact CB-CE2 4.16Å; K426-F448 HydrophobicContact CG-CE2 4.26Å; K426-F448 WeakPolarHBondContact O-CE2 3.25Å; K426-M516 PolarHBondContact NZ-SD 2.85Å; K426-F519 HydrophobicContact CB-CE2 4.32Å; K426-F519 HydrophobicContact CD-CD2 4.36Å; K426-F519 HydrophobicContact CD-CE2 4.44Å; K426-F519 HydrophobicContact CG-CD2 3.62Å; K426-F519 HydrophobicContact CG-CE2 3.38Å; K426-F519 HydrophobicContact CG-CG 4.3Å; K426-F519 HydrophobicContact CG-CZ 3.89Å
427	Q	94.6	Very high	84.9	Confident	121 Å²	121	66.2 Å²	66.2	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-67.3	-44.3	175.6	-68.5	-60.2	-62.3	0	0	112.4	S423 S424 I425 L429 L430 E431	S423-Q427 WeakPolarHBondContact O-CG 3.5Å; S423-Q427 PolarHBondContact O-N 3.28Å; S424-Q427 PolarHBondContact O-N 3.14Å; I425-Q427 VanDerWaalsContact C-N 3.35Å; I425-Q427 PolarHBondContact O-N 3.04Å; Q427-L429 PolarHBondContact O-N 3.27Å; Q427-L430 PolarHBondContact O-N 3.34Å; Q427-E431 WeakPolarHBondContact O-CB 3.37Å; Q427-E431 PolarHBondContact O-N 3.01Å
428	I	95.2	Very high	87.1	Confident	103 Å²	103	66.3 Å²	66.3	53%	0.528	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-46.7	178.5	-67.7	162.1	0	0	0	111	S424 I425 L430 E431 W432	S424-I428 WeakPolarHBondContact O-CG1 3.34Å; S424-I428 PolarHBondContact O-N 2.76Å; I425-I428 PolarHBondContact O-N 2.81Å; I428-L430 PolarHBondContact O-N 3.45Å; I428-E431 PolarHBondContact O-N 2.93Å; I428-W432 PolarHBondContact O-N 3.02Å
429	L	96.2	Very high	89	Confident	10 Å²	10	66.6 Å²	66.6	5%	0.052	39%	0.389	C	S	.	.	H	α-helix	trans	-64.1	-40.4	179	-176.1	67.3	0	0	0	111.9	I425 Q427 W432 C433 F448 F519 V522 Q523 Y526	I425-L429 WeakPolarHBondContact O-CB 3.18Å; I425-L429 PolarHBondContact O-N 3Å; Q427-L429 PolarHBondContact O-N 3.27Å; L429-W432 HydrophobicContact CD1-CE3 4.31Å; L429-W432 PolarHBondContact O-N 3.4Å; L429-C433 PolarHBondContact O-N 3.34Å; L429-C433 PolarHBondContact O-SG 3.42Å; L429-F448 HydrophobicContact CB-CZ 4.09Å; L429-F448 HydrophobicContact CD2-CE1 3.94Å; L429-F448 HydrophobicContact CD2-CZ 3.85Å; L429-F448 HydrophobicContact CG-CE1 4.2Å; L429-F448 HydrophobicContact CG-CZ 3.98Å; L429-F519 HydrophobicContact CD2-CD2 3.63Å; L429-F519 HydrophobicContact CD2-CE2 3.45Å; L429-F519 VanDerWaalsContact CD2-CE2 3.45Å; L429-F519 HydrophobicContact CD2-CZ 4.41Å; L429-V522 HydrophobicContact CD1-CG1 4.31Å; L429-V522 HydrophobicContact CD2-CB 4.43Å; L429-V522 HydrophobicContact CD2-CG1 4.09Å; L429-V522 HydrophobicContact CG-CG1 4.13Å; L429-Q523 HydrophobicContact CD2-CB 4Å; L429-Y526 VanDerWaalsContact CD1-CB 3.45Å; L429-Y526 HydrophobicContact CD1-CD1 4.38Å; L429-Y526 HydrophobicContact CD1-CD2 4.21Å; L429-Y526 HydrophobicContact CD1-CG 3.76Å
430	L	96	Very high	91.1	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.026	36%	0.363	C	S	.	.	H	α-helix	trans	-69.6	-37.6	-179.4	-167.5	146.6	0	0	0	111.9	K426 Q427 I428 C433 R434 I445 F448	K426-L430 VanDerWaalsContact O-CB 3.22Å; K426-L430 WeakPolarHBondContact O-CB 3.48Å; K426-L430 PolarHBondContact O-N 2.69Å; K426-L430 VanDerWaalsContact O-N 3.11Å; Q427-L430 PolarHBondContact O-N 3.34Å; I428-L430 PolarHBondContact O-N 3.45Å; L430-C433 WeakPolarHBondContact O-CB 3.47Å; L430-C433 PolarHBondContact O-N 3.11Å; L430-R434 VanDerWaalsContact CD2-CZ 3.41Å; L430-R434 WeakPolarHBondContact O-CG 3.36Å; L430-R434 PolarHBondContact O-N 3.47Å; L430-I445 HydrophobicContact CG-CG2 4.3Å; L430-F448 HydrophobicContact CB-CE2 3.98Å; L430-F448 HydrophobicContact CB-CZ 3.73Å; L430-F448 HydrophobicContact CD1-CD2 4.2Å; L430-F448 HydrophobicContact CD1-CE2 3.87Å; L430-F448 HydrophobicContact CD1-CZ 4.21Å; L430-F448 HydrophobicContact CG-CE2 4.46Å; L430-F448 HydrophobicContact CG-CZ 4.35Å
431	E	96.4	Very high	92.4	Very high	105 Å²	105	66.6 Å²	66.6	49%	0.491	37%	0.372	S	S	.	.	H	α-helix	trans	-70.9	-35.5	175.3	-161.6	60.4	-156.8	0	0	112.3	Q427 I428 R434 S435	Q427-E431 WeakPolarHBondContact O-CB 3.37Å; Q427-E431 PolarHBondContact O-N 3.01Å; I428-E431 PolarHBondContact O-N 2.93Å; E431-R434 PolarHBondContact O-N 2.81Å; E431-R434 VanDerWaalsContact OE2-CD 3.27Å; E431-R434 WeakPolarHBondContact OE2-CD 3.3Å; E431-R434 IonicContact OE2-CZ 2.69Å; E431-R434 IonicContact OE2-NE 3.65Å; E431-R434 IonicContact OE2-NH1 3.75Å; E431-R434 PolarHBondContact OE2-NH1 2.78Å; E431-S435 WeakPolarHBondContact O-CB 3.27Å; E431-S435 PolarHBondContact O-N 2.95Å
432	W	95.9	Very high	92.6	Very high	31 Å²	31	68.8 Å²	68.8	12%	0.117	38%	0.381	C	S	.	.	H	α-helix	trans	-62.3	-42.4	169.2	172.6	88.4	0	0	0	112	I428 L429 R434 S435 K436 L461 F465 Y526 L529	I428-W432 PolarHBondContact O-N 3.02Å; L429-W432 HydrophobicContact CD1-CE3 4.31Å; L429-W432 PolarHBondContact O-N 3.4Å; W432-R434 PolarHBondContact O-N 2.96Å; W432-S435 PolarHBondContact O-N 3.45Å; W432-K436 HydrophobicContact CD2-CG 4.26Å; W432-K436 HydrophobicContact CZ2-CG 4.15Å; W432-K436 WeakPolarHBondContact O-CG 3.3Å; W432-K436 PolarHBondContact O-N 2.97Å; W432-L461 HydrophobicContact CH2-CD1 3.84Å; W432-L461 HydrophobicContact CH2-CD2 4.25Å; W432-L461 HydrophobicContact CH2-CG 4.41Å; W432-L461 HydrophobicContact CZ3-CD1 3.82Å; W432-L461 HydrophobicContact CZ3-CD2 3.92Å; W432-L461 HydrophobicContact CZ3-CG 4.42Å; W432-F465 HydrophobicContact CH2-CE2 4.38Å; W432-F465 HydrophobicContact CH2-CZ 4.46Å; W432-F465 HydrophobicContact CZ2-CE2 4.03Å; W432-F465 AromaticContact CZ2-CZ 3.69Å; W432-F465 HydrophobicContact CZ2-CZ 3.69Å; W432-Y526 AromaticContact CD1-CE2 3.93Å; W432-Y526 AromaticContact CD2-CD2 3.51Å; W432-Y526 HydrophobicContact CD2-CD2 3.51Å; W432-Y526 HydrophobicContact CD2-CE2 4.06Å; W432-Y526 AromaticContact CE2-CD2 3.53Å; W432-Y526 AromaticContact CE3-CD2 3.79Å; W432-Y526 HydrophobicContact CE3-CD2 3.79Å; W432-Y526 AromaticContact CG-CD2 3.93Å; W432-Y526 HydrophobicContact CG-CD2 3.93Å; W432-Y526 HydrophobicContact CG-CE2 4.02Å; W432-Y526 HydrophobicContact CH2-CD2 4.11Å; W432-Y526 AromaticContact CZ2-CD2 3.83Å; W432-Y526 HydrophobicContact CZ2-CD2 3.83Å; W432-Y526 HydrophobicContact CZ3-CD2 4.08Å; W432-Y526 AromaticContact NE1-CD2 3.92Å; W432-Y526 AromaticContact NE1-CE2 3.91Å; W432-L529 HydrophobicContact CH2-CB 4.36Å; W432-L529 HydrophobicContact CH2-CD1 4.26Å; W432-L529 HydrophobicContact CZ2-CB 4.42Å
433	C	97.2	Very high	93.4	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-58.1	-49	175.7	-64.9	0	0	0	0	111	L429 L430 S435 K436 T437 I445 W452 V522	L429-C433 PolarHBondContact O-N 3.34Å; L429-C433 PolarHBondContact O-SG 3.42Å; L430-C433 WeakPolarHBondContact O-CB 3.47Å; L430-C433 PolarHBondContact O-N 3.11Å; C433-S435 PolarHBondContact O-N 2.71Å; C433-K436 PolarHBondContact O-N 2.95Å; C433-T437 PolarHBondContact O-N 3.37Å; C433-T437 PolarHBondContact O-OG1 3.3Å; C433-I445 HydrophobicContact CB-CD1 3.88Å; C433-I445 HydrophobicContact CB-CG2 4.26Å; C433-W452 HydrophobicContact CB-CH2 4.21Å; C433-W452 HydrophobicContact CB-CZ2 4.2Å; C433-V522 WeakPolarHBondContact SG-CG1 3.39Å
434	R	96.9	Very high	93.8	Very high	84 Å²	84	67.8 Å²	67.8	32%	0.317	36%	0.359	S	S	.	.	H	α-helix	trans	-56	-49.4	175.4	-72.7	168.3	171.6	171.4	-6.3	112.2	L430 E431 W432 K436 T437 I438 I445	L430-R434 VanDerWaalsContact CD2-CZ 3.41Å; L430-R434 WeakPolarHBondContact O-CG 3.36Å; L430-R434 PolarHBondContact O-N 3.47Å; E431-R434 PolarHBondContact O-N 2.81Å; E431-R434 VanDerWaalsContact OE2-CD 3.27Å; E431-R434 WeakPolarHBondContact OE2-CD 3.3Å; E431-R434 IonicContact OE2-CZ 2.69Å; E431-R434 IonicContact OE2-NE 3.65Å; E431-R434 IonicContact OE2-NH1 3.75Å; E431-R434 PolarHBondContact OE2-NH1 2.78Å; W432-R434 PolarHBondContact O-N 2.96Å; R434-K436 VanDerWaalsContact C-N 3.29Å; R434-K436 PolarHBondContact O-N 2.78Å; R434-T437 CarbonylContact O-C 3.42Å; R434-T437 PolarHBondContact O-N 3Å; R434-T437 PolarHBondContact O-OG1 2.95Å; R434-I438 WeakPolarHBondContact O-CG1 3.47Å; R434-I438 PolarHBondContact O-N 3.26Å; R434-I438 VanDerWaalsContact O-N 3.11Å; R434-I445 HydrophobicContact CG-CB 4.21Å; R434-I445 PolarHBondContact NE-O 3.01Å; R434-I445 PolarHBondContact NH2-O 3.41Å
435	S	96.3	Very high	94.1	Very high	73 Å²	73	65.5 Å²	65.5	51%	0.51	34%	0.343	S	S	.	.	H	α-helix	trans	-56.7	-42.1	-179.5	-174.2	0	0	0	0	112	E431 W432 C433 I438	E431-S435 WeakPolarHBondContact O-CB 3.27Å; E431-S435 PolarHBondContact O-N 2.95Å; W432-S435 PolarHBondContact O-N 3.45Å; C433-S435 PolarHBondContact O-N 2.71Å; S435-I438 WeakPolarHBondContact O-CG1 3.18Å
436	K	95.6	Very high	94.2	Very high	46 Å²	46	68.3 Å²	68.3	20%	0.2	36%	0.355	C	S	.	.	H	α-helix	trans	-74.2	-23.9	176.4	-66.2	-65.9	173.7	179.9	0	114.1	W432 C433 R434 L461 S464 F465 E533	W432-K436 HydrophobicContact CD2-CG 4.26Å; W432-K436 HydrophobicContact CZ2-CG 4.15Å; W432-K436 WeakPolarHBondContact O-CG 3.3Å; W432-K436 PolarHBondContact O-N 2.97Å; C433-K436 PolarHBondContact O-N 2.95Å; R434-K436 VanDerWaalsContact C-N 3.29Å; R434-K436 PolarHBondContact O-N 2.78Å; K436-L461 HydrophobicContact CB-CD1 3.71Å; K436-L461 HydrophobicContact CG-CD1 4.36Å; K436-S464 WeakPolarHBondContact O-CB 3.27Å; K436-F465 HydrophobicContact CD-CE1 4.36Å; K436-F465 HydrophobicContact CD-CE2 4.01Å; K436-F465 HydrophobicContact CD-CZ 3.59Å; K436-F465 HydrophobicContact CG-CE2 4.14Å; K436-F465 HydrophobicContact CG-CZ 4.01Å; K436-E533 WeakPolarHBondContact CE-OE1 3.36Å; K436-E533 VanDerWaalsContact CE-OE2 3.32Å; K436-E533 WeakPolarHBondContact CE-OE2 3.49Å; K436-E533 IonicContact NZ-OE1 3.6Å; K436-E533 PolarHBondContact NZ-OE1 2.99Å; K436-E533 IonicContact NZ-OE2 3.94Å; K436-E533 PolarHBondContact NZ-OE2 3.35Å; K436-E533 VanDerWaalsContact NZ-OE2 3.11Å
437	T	95.8	Very high	94.3	Very high	12 Å²	12	68.1 Å²	68.1	7%	0.074	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	16.9	176.1	64.5	0	0	0	0	114.4	C433 R434 G439 Y440 I445 A460 L461	C433-T437 PolarHBondContact O-N 3.37Å; C433-T437 PolarHBondContact O-OG1 3.3Å; R434-T437 CarbonylContact O-C 3.42Å; R434-T437 PolarHBondContact O-N 3Å; R434-T437 PolarHBondContact O-OG1 2.95Å; T437-G439 PolarHBondContact O-N 2.93Å; T437-Y440 PolarHBondContact O-N 3.33Å; T437-I445 HydrophobicContact CG2-CD1 4.01Å; T437-A460 HydrophobicContact CG2-CB 3.84Å; T437-L461 HydrophobicContact CG2-CB 4.39Å
438	I	94.6	Very high	94.5	Very high	132 Å²	132	63 Å²	63	68%	0.677	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	131.4	172.6	-65.5	176.9	0	0	0	109.6	R434 S435	R434-I438 WeakPolarHBondContact O-CG1 3.47Å; R434-I438 PolarHBondContact O-N 3.26Å; R434-I438 VanDerWaalsContact O-N 3.11Å; S435-I438 WeakPolarHBondContact O-CG1 3.18Å
439	G	91.1	Very high	94.5	Very high	78 Å²	78	59 Å²	59	80%	0.804	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-9.4	177.6	0	0	0	0	0	115.4	T437	T437-G439 PolarHBondContact O-N 2.93Å
440	Y	94.4	Very high	94.5	Very high	50 Å²	50	61.2 Å²	61.2	20%	0.196	33%	0.33	C	S	.	.			trans	-76	133.2	175.1	-72.4	-99.6	0	0	0	111.3	T437 A460 H463 S464 Y472	T437-Y440 PolarHBondContact O-N 3.33Å; Y440-A460 HydrophobicContact CD1-CB 3.38Å; Y440-A460 HydrophobicContact CD2-CB 4.2Å; Y440-A460 HydrophobicContact CE1-CB 3.78Å; Y440-A460 HydrophobicContact CG-CB 3.62Å; Y440-H463 HydrophobicContact CE1-CB 4.21Å; Y440-H463 AromaticContact CE1-ND1 3.55Å; Y440-H463 AromaticContact CZ-ND1 3.64Å; Y440-H463 PolarHBondContact OH-ND1 3.47Å; Y440-S464 WeakPolarHBondContact OH-CA 3.38Å; Y440-S464 PolarHBondContact OH-N 3.02Å; Y440-Y472 AromaticContact CD1-CD1 3.67Å; Y440-Y472 HydrophobicContact CD1-CD1 3.67Å; Y440-Y472 AromaticContact CD1-CD2 3.88Å; Y440-Y472 HydrophobicContact CD1-CD2 3.88Å; Y440-Y472 AromaticContact CD1-CE1 3.78Å; Y440-Y472 HydrophobicContact CD1-CE1 3.78Å; Y440-Y472 AromaticContact CD1-CE2 3.98Å; Y440-Y472 HydrophobicContact CD1-CE2 3.98Å; Y440-Y472 AromaticContact CD1-CG 3.74Å; Y440-Y472 HydrophobicContact CD1-CG 3.74Å; Y440-Y472 AromaticContact CD1-CZ 3.93Å; Y440-Y472 HydrophobicContact CE1-CD1 4.22Å; Y440-Y472 HydrophobicContact CE1-CD2 4.12Å; Y440-Y472 AromaticContact CE1-CG 3.92Å; Y440-Y472 HydrophobicContact CE1-CG 3.92Å
441	Q	88.5	Confident	94.6	Very high	130 Å²	130	62.1 Å²	62.1	61%	0.607	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	145.8	178.8	-65	-173.1	65.1	0	0	111.6	I443 Y472	Q441-I443 VanDerWaalsContact C-N 3.29Å; Q441-I443 PolarHBondContact O-N 3.34Å; Q441-Y472 PolarHBondContact O-OH 2.9Å
442	N	84.6	Confident	94.6	Very high	144 Å²	144	57.1 Å²	57.1	77%	0.77	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	23.3	175.4	-53.2	-56.8	0	0	0	116
443	I	92.3	Very high	94.7	Very high	35 Å²	35	56.1 Å²	56.1	18%	0.179	31%	0.311	C	S	.	.			trans	-114.1	130	176.4	-73.4	177	0	0	0	111.5	Q441 I445 M456 A460 Y472	Q441-I443 VanDerWaalsContact C-N 3.29Å; Q441-I443 PolarHBondContact O-N 3.34Å; I443-I445 HydrophobicContact CG2-CD1 4.21Å; I443-I445 HydrophobicContact CG2-CG1 3.74Å; I443-M456 HydrophobicContact CD1-CB 4.44Å; I443-M456 WeakPolarHBondContact CD1-O 3.42Å; I443-M456 HydrophobicContact CG1-CB 4.35Å; I443-A460 HydrophobicContact CD1-CB 3.17Å; I443-Y472 HydrophobicContact CD1-CE2 4.11Å; I443-Y472 WeakPolarHBondContact CD1-OH 3.48Å; I443-Y472 WeakPolarHBondContact CG1-OH 3.33Å
444	D	92.8	Very high	94.6	Very high	94 Å²	94	57.6 Å²	57.6	50%	0.503	32%	0.319	S	S	.	.			trans	-138.6	104.8	164.2	-176.3	0.1	0	0	0	109.5	Q446 S451	D444-Q446 PolarHBondContact O-N 3.02Å; D444-Q446 WeakPolarHBondContact OD1-CG 3.34Å; D444-Q446 PolarHBondContact OD2-NE2 3.44Å; D444-S451 WeakPolarHBondContact O-CB 3.43Å; D444-S451 PolarHBondContact O-OG 3.45Å
445	I	95.9	Very high	94.5	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	30%	0.304	C	S	.	.			trans	-87	93.9	179.3	-53.7	-177.9	0	0	0	108.4	L430 C433 R434 T437 I443 W452 A457	L430-I445 HydrophobicContact CG-CG2 4.3Å; C433-I445 HydrophobicContact CB-CD1 3.88Å; C433-I445 HydrophobicContact CB-CG2 4.26Å; R434-I445 HydrophobicContact CG-CB 4.21Å; R434-I445 PolarHBondContact NE-O 3.01Å; R434-I445 PolarHBondContact NH2-O 3.41Å; T437-I445 HydrophobicContact CG2-CD1 4.01Å; I443-I445 HydrophobicContact CG2-CD1 4.21Å; I443-I445 HydrophobicContact CG2-CG1 3.74Å; I445-W452 HydrophobicContact CD1-CH2 4.2Å; I445-W452 HydrophobicContact CD1-CZ2 4.14Å; I445-W452 HydrophobicContact CG2-CZ2 3.78Å; I445-A457 HydrophobicContact CD1-CB 4.14Å; I445-A457 HydrophobicContact CG1-CB 4.25Å
446	Q	95.3	Very high	94.6	Very high	123 Å²	123	50.5 Å²	50.5	58%	0.575	28%	0.281	S	S	*	.			trans	-101.7	-22.8	177.7	-59.7	-167	2	0	0	113.6	D444 S451	D444-Q446 PolarHBondContact O-N 3.02Å; D444-Q446 WeakPolarHBondContact OD1-CG 3.34Å; D444-Q446 PolarHBondContact OD2-NE2 3.44Å; Q446-S451 PolarHBondContact N-OG 3.07Å; Q446-S451 VanDerWaalsContact N-OG 3.09Å
447	N	95.8	Very high	94.7	Very high	52 Å²	52	48.4 Å²	48.4	28%	0.278	27%	0.272	S	S	.	.	S	Bend	trans	-153.4	174.1	-174.2	60.6	62.6	0	0	0	111.1	S449 S450 S451 W452	N447-S449 VanDerWaalsContact C-N 3.34Å; N447-S449 VanDerWaalsContact OD1-C 3.31Å; N447-S449 WeakPolarHBondContact OD1-CA 3.49Å; N447-S449 PolarHBondContact OD1-N 2.93Å; N447-S450 PolarHBondContact ND2-OG 3.28Å; N447-S450 PolarHBondContact OD1-N 3.11Å; N447-S450 PolarHBondContact OD1-OG 2.99Å; N447-S451 PolarHBondContact OD1-N 3.45Å; N447-W452 PolarHBondContact O-NE1 3.13Å
448	F	97.2	Very high	94.7	Very high	14 Å²	14	47.9 Å²	47.9	6%	0.061	27%	0.269	C	S	.	.	S	Bend	trans	-93.5	32.9	173.2	-65.2	-74	0	0	0	112.8	K426 L429 L430 W452 P515 V518 F519 V522	K426-F448 HydrophobicContact CB-CE2 4.16Å; K426-F448 HydrophobicContact CG-CE2 4.26Å; K426-F448 WeakPolarHBondContact O-CE2 3.25Å; L429-F448 HydrophobicContact CB-CZ 4.09Å; L429-F448 HydrophobicContact CD2-CE1 3.94Å; L429-F448 HydrophobicContact CD2-CZ 3.85Å; L429-F448 HydrophobicContact CG-CE1 4.2Å; L429-F448 HydrophobicContact CG-CZ 3.98Å; L430-F448 HydrophobicContact CB-CE2 3.98Å; L430-F448 HydrophobicContact CB-CZ 3.73Å; L430-F448 HydrophobicContact CD1-CD2 4.2Å; L430-F448 HydrophobicContact CD1-CE2 3.87Å; L430-F448 HydrophobicContact CD1-CZ 4.21Å; L430-F448 HydrophobicContact CG-CE2 4.46Å; L430-F448 HydrophobicContact CG-CZ 4.35Å; F448-W452 HydrophobicContact CD1-CZ2 4.46Å; F448-P515 WeakPolarHBondContact O-CA 3.34Å; F448-V518 HydrophobicContact CB-CB 4.43Å; F448-V518 HydrophobicContact CB-CG1 4.12Å; F448-V518 HydrophobicContact CD1-CG1 4.46Å; F448-V518 WeakPolarHBondContact O-CB 3.45Å; F448-V518 WeakPolarHBondContact O-CG1 3.27Å; F448-F519 HydrophobicContact CB-CB 4.29Å; F448-F519 HydrophobicContact CD1-CB 4.39Å; F448-F519 HydrophobicContact CD2-CB 4.34Å; F448-F519 HydrophobicContact CD2-CD2 4.08Å; F448-F519 HydrophobicContact CE1-CD2 4.28Å; F448-F519 AromaticContact CE2-CD2 3.82Å; F448-F519 HydrophobicContact CE2-CD2 3.82Å; F448-F519 HydrophobicContact CE2-CE2 4.5Å; F448-F519 HydrophobicContact CG-CB 4.09Å; F448-F519 HydrophobicContact CG-CD2 4.43Å; F448-F519 AromaticContact CZ-CD2 3.93Å; F448-F519 HydrophobicContact CZ-CD2 3.93Å; F448-V522 HydrophobicContact CD1-CB 4.45Å; F448-V522 HydrophobicContact CE1-CB 4.26Å; F448-V522 HydrophobicContact CE1-CG1 3.98Å
449	S	96.4	Very high	94.9	Very high	18 Å²	18	41.6 Å²	41.6	13%	0.126	24%	0.237	C	C	.	.	S	Bend	trans	-140.2	-91.1	-177.6	-178.3	0	0	0	0	112	N447 S451 W452 S453 P513	N447-S449 VanDerWaalsContact C-N 3.34Å; N447-S449 VanDerWaalsContact OD1-C 3.31Å; N447-S449 WeakPolarHBondContact OD1-CA 3.49Å; N447-S449 PolarHBondContact OD1-N 2.93Å; S449-S451 VanDerWaalsContact C-N 3.28Å; S449-S451 PolarHBondContact O-N 3.46Å; S449-W452 PolarHBondContact O-N 3.09Å; S449-S453 PolarHBondContact O-N 2.72Å; S449-P513 VanDerWaalsContact CB-O 3.3Å; S449-P513 WeakPolarHBondContact CB-O 3.25Å; S449-P513 WeakPolarHBondContact O-CG 3.12Å; S449-P513 PolarHBondContact OG-O 3.4Å
450	S	96.6	Very high	95.2	Very high	58 Å²	58	37.9 Å²	37.9	41%	0.406	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-59.1	-37.1	-175.5	63.4	0	0	0	0	113	N447 W452 S453	N447-S450 PolarHBondContact ND2-OG 3.28Å; N447-S450 PolarHBondContact OD1-N 3.11Å; N447-S450 PolarHBondContact OD1-OG 2.99Å; S450-W452 PolarHBondContact O-N 2.83Å; S450-W452 VanDerWaalsContact O-N 3.12Å; S450-S453 WeakPolarHBondContact O-CB 3.25Å; S450-S453 PolarHBondContact O-N 3.49Å; S450-S453 VanDerWaalsContact O-N 3.15Å; S450-S453 PolarHBondContact O-OG 2.82Å
451	S	96.9	Very high	95.3	Very high	23 Å²	23	35.5 Å²	35.5	16%	0.161	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-63.8	-11	177.3	-67.6	0	0	0	0	114.4	D444 Q446 N447 S449 A457	D444-S451 WeakPolarHBondContact O-CB 3.43Å; D444-S451 PolarHBondContact O-OG 3.45Å; Q446-S451 PolarHBondContact N-OG 3.07Å; Q446-S451 VanDerWaalsContact N-OG 3.09Å; N447-S451 PolarHBondContact OD1-N 3.45Å; S449-S451 VanDerWaalsContact C-N 3.28Å; S449-S451 PolarHBondContact O-N 3.46Å; S451-A457 VanDerWaalsContact O-CB 3.25Å; S451-A457 WeakPolarHBondContact O-CB 3.47Å
452	W	97.3	Very high	95.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-115.8	2.8	179.4	-55.6	80.8	0	0	0	112.3	C433 I445 N447 F448 S449 S450 D454 A457 F458 L461 F484 V518 V522	C433-W452 HydrophobicContact CB-CH2 4.21Å; C433-W452 HydrophobicContact CB-CZ2 4.2Å; I445-W452 HydrophobicContact CD1-CH2 4.2Å; I445-W452 HydrophobicContact CD1-CZ2 4.14Å; I445-W452 HydrophobicContact CG2-CZ2 3.78Å; N447-W452 PolarHBondContact O-NE1 3.13Å; F448-W452 HydrophobicContact CD1-CZ2 4.46Å; S449-W452 PolarHBondContact O-N 3.09Å; S450-W452 PolarHBondContact O-N 2.83Å; S450-W452 VanDerWaalsContact O-N 3.12Å; W452-D454 VanDerWaalsContact C-N 3.28Å; W452-D454 PolarHBondContact O-N 3.35Å; W452-A457 HydrophobicContact CD2-CB 3.94Å; W452-A457 HydrophobicContact CE3-CB 3.65Å; W452-A457 HydrophobicContact CG-CB 4.48Å; W452-A457 HydrophobicContact CZ3-CB 3.98Å; W452-F458 HydrophobicContact CB-CD2 4.47Å; W452-F458 HydrophobicContact CB-CE2 3.82Å; W452-F458 HydrophobicContact CB-CZ 4.26Å; W452-F458 HydrophobicContact CD2-CE1 4.45Å; W452-F458 HydrophobicContact CD2-CE2 4.41Å; W452-F458 HydrophobicContact CD2-CZ 4.24Å; W452-F458 AromaticContact CE3-CD1 3.59Å; W452-F458 HydrophobicContact CE3-CD1 3.59Å; W452-F458 AromaticContact CE3-CD2 3.88Å; W452-F458 HydrophobicContact CE3-CD2 3.88Å; W452-F458 AromaticContact CE3-CE1 3.49Å; W452-F458 HydrophobicContact CE3-CE1 3.49Å; W452-F458 VanDerWaalsContact CE3-CE1 3.49Å; W452-F458 AromaticContact CE3-CE2 3.8Å; W452-F458 HydrophobicContact CE3-CE2 3.8Å; W452-F458 AromaticContact CE3-CG 3.78Å; W452-F458 HydrophobicContact CE3-CG 3.78Å; W452-F458 AromaticContact CE3-CZ 3.61Å; W452-F458 HydrophobicContact CE3-CZ 3.61Å; W452-F458 HydrophobicContact CG-CE2 4.47Å; W452-F458 AromaticContact CZ3-CD1 3.66Å; W452-F458 HydrophobicContact CZ3-CD1 3.66Å; W452-F458 AromaticContact CZ3-CE1 3.78Å; W452-F458 HydrophobicContact CZ3-CE1 3.78Å; W452-F458 HydrophobicContact CZ3-CG 4.15Å; W452-F458 HydrophobicContact CZ3-CZ 4.36Å; W452-L461 HydrophobicContact CH2-CD2 4.1Å; W452-L461 HydrophobicContact CZ3-CD2 4.26Å; W452-F484 WeakPolarHBondContact O-CE1 3.49Å; W452-V518 HydrophobicContact CB-CG1 4.01Å; W452-V518 HydrophobicContact CD2-CG1 4.06Å; W452-V518 HydrophobicContact CG-CG1 3.68Å; W452-V522 HydrophobicContact CD2-CG2 4.29Å; W452-V522 HydrophobicContact CE3-CG2 4.04Å; W452-V522 HydrophobicContact CH2-CB 4.49Å; W452-V522 HydrophobicContact CH2-CG1 3.92Å; W452-V522 HydrophobicContact CH2-CG2 3.64Å; W452-V522 HydrophobicContact CZ2-CG1 4.18Å; W452-V522 HydrophobicContact CZ2-CG2 3.91Å; W452-V522 HydrophobicContact CZ3-CG2 3.71Å
453	S	96.5	Very high	96.3	Very high	10 Å²	10	23.7 Å²	23.7	7%	0.07	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.6	-166.4	72.2	0	0	0	0	115.7	S449 S450 R480 R511	S449-S453 PolarHBondContact O-N 2.72Å; S450-S453 WeakPolarHBondContact O-CB 3.25Å; S450-S453 PolarHBondContact O-N 3.49Å; S450-S453 VanDerWaalsContact O-N 3.15Å; S450-S453 PolarHBondContact O-OG 2.82Å; S453-R480 VanDerWaalsContact O-CD 3.25Å; S453-R480 WeakPolarHBondContact O-CD 3.27Å; S453-R480 PolarHBondContact O-NH1 2.82Å; S453-R511 WeakPolarHBondContact CB-O 3.29Å; S453-R511 PolarHBondContact OG-O 2.93Å
454	D	95.4	Very high	96.5	Very high	32 Å²	32	23.8 Å²	23.8	17%	0.171	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-1.2	178.8	63.8	5.4	0	0	0	114.3	W452 M456 P477 R480 N483	W452-D454 VanDerWaalsContact C-N 3.28Å; W452-D454 PolarHBondContact O-N 3.35Å; D454-M456 VanDerWaalsContact C-N 3.26Å; D454-M456 PolarHBondContact O-N 3.04Å; D454-M456 WeakPolarHBondContact OD1-CB 3.35Å; D454-M456 PolarHBondContact OD1-N 3.49Å; D454-P477 HydrophobicContact CB-CB 4.14Å; D454-P477 WeakPolarHBondContact OD2-CB 3.36Å; D454-R480 HydrophobicContact CB-CG 4.35Å; D454-N483 PolarHBondContact O-ND2 3.31Å
455	G	95.9	Very high	96.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	80.2	-12.3	-177.5	0	0	0	0	0	115.5	A457 F458 C459	G455-A457 PolarHBondContact O-N 3.17Å; G455-F458 PolarHBondContact O-N 3.34Å; G455-C459 PolarHBondContact O-N 2.97Å; G455-C459 PolarHBondContact O-SG 3.29Å
456	M	97.1	Very high	96.5	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.039	12%	0.121	C	C	.	.	H	α-helix	trans	-65	-42	-173.7	-61.9	-56.2	-62.8	0	0	111.9	I443 D454 F458 C459 A460 Y472 L475 P477 N483	I443-M456 HydrophobicContact CD1-CB 4.44Å; I443-M456 WeakPolarHBondContact CD1-O 3.42Å; I443-M456 HydrophobicContact CG1-CB 4.35Å; D454-M456 VanDerWaalsContact C-N 3.26Å; D454-M456 PolarHBondContact O-N 3.04Å; D454-M456 WeakPolarHBondContact OD1-CB 3.35Å; D454-M456 PolarHBondContact OD1-N 3.49Å; M456-F458 VanDerWaalsContact C-N 3.31Å; M456-F458 PolarHBondContact O-N 3.42Å; M456-C459 WeakPolarHBondContact O-CB 3.44Å; M456-C459 PolarHBondContact O-N 3.23Å; M456-A460 PolarHBondContact O-N 2.95Å; M456-Y472 HydrophobicContact CE-CE1 4.4Å; M456-Y472 HydrophobicContact CE-CE2 3.69Å; M456-Y472 WeakPolarHBondContact CE-OH 3.5Å; M456-L475 HydrophobicContact CE-CB 3.84Å; M456-L475 HydrophobicContact SD-CB 4.25Å; M456-P477 HydrophobicContact CG-CB 3.83Å; M456-P477 HydrophobicContact SD-CB 4.43Å; M456-N483 PolarHBondContact SD-ND2 3.06Å
457	A	97.5	Very high	96.5	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-35.6	176.2	0	0	0	0	0	113.3	I445 S451 W452 G455 L461	I445-A457 HydrophobicContact CD1-CB 4.14Å; I445-A457 HydrophobicContact CG1-CB 4.25Å; S451-A457 VanDerWaalsContact O-CB 3.25Å; S451-A457 WeakPolarHBondContact O-CB 3.47Å; W452-A457 HydrophobicContact CD2-CB 3.94Å; W452-A457 HydrophobicContact CE3-CB 3.65Å; W452-A457 HydrophobicContact CG-CB 4.48Å; W452-A457 HydrophobicContact CZ3-CB 3.98Å; G455-A457 PolarHBondContact O-N 3.17Å; A457-L461 VanDerWaalsContact O-CB 3.26Å; A457-L461 WeakPolarHBondContact O-CB 3.46Å; A457-L461 PolarHBondContact O-N 3.19Å; A457-L461 VanDerWaalsContact O-N 3.11Å
458	F	97.4	Very high	96.4	Very high	1 Å²	1	23.2 Å²	23.2	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-69.9	-43.4	172.6	-69.3	-69.2	0	0	0	111.5	W452 G455 M456 L461 V462 F484 A487 F488 M506 V518 Y521 V522 L525	W452-F458 HydrophobicContact CB-CD2 4.47Å; W452-F458 HydrophobicContact CB-CE2 3.82Å; W452-F458 HydrophobicContact CB-CZ 4.26Å; W452-F458 HydrophobicContact CD2-CE1 4.45Å; W452-F458 HydrophobicContact CD2-CE2 4.41Å; W452-F458 HydrophobicContact CD2-CZ 4.24Å; W452-F458 AromaticContact CE3-CD1 3.59Å; W452-F458 HydrophobicContact CE3-CD1 3.59Å; W452-F458 AromaticContact CE3-CD2 3.88Å; W452-F458 HydrophobicContact CE3-CD2 3.88Å; W452-F458 AromaticContact CE3-CE1 3.49Å; W452-F458 HydrophobicContact CE3-CE1 3.49Å; W452-F458 VanDerWaalsContact CE3-CE1 3.49Å; W452-F458 AromaticContact CE3-CE2 3.8Å; W452-F458 HydrophobicContact CE3-CE2 3.8Å; W452-F458 AromaticContact CE3-CG 3.78Å; W452-F458 HydrophobicContact CE3-CG 3.78Å; W452-F458 AromaticContact CE3-CZ 3.61Å; W452-F458 HydrophobicContact CE3-CZ 3.61Å; W452-F458 HydrophobicContact CG-CE2 4.47Å; W452-F458 AromaticContact CZ3-CD1 3.66Å; W452-F458 HydrophobicContact CZ3-CD1 3.66Å; W452-F458 AromaticContact CZ3-CE1 3.78Å; W452-F458 HydrophobicContact CZ3-CE1 3.78Å; W452-F458 HydrophobicContact CZ3-CG 4.15Å; W452-F458 HydrophobicContact CZ3-CZ 4.36Å; G455-F458 PolarHBondContact O-N 3.34Å; M456-F458 VanDerWaalsContact C-N 3.31Å; M456-F458 PolarHBondContact O-N 3.42Å; F458-L461 PolarHBondContact O-N 3.45Å; F458-V462 WeakPolarHBondContact O-CG2 3.24Å; F458-V462 PolarHBondContact O-N 3.01Å; F458-F484 HydrophobicContact CD2-CD1 4.05Å; F458-F484 AromaticContact CD2-CE1 3.93Å; F458-F484 HydrophobicContact CD2-CE1 3.93Å; F458-F484 HydrophobicContact CE2-CD1 4.4Å; F458-F484 HydrophobicContact CE2-CE1 4.06Å; F458-A487 HydrophobicContact CB-CB 3.66Å; F458-F488 HydrophobicContact CB-CE1 4.37Å; F458-F488 HydrophobicContact CD1-CE1 4.02Å; F458-F488 AromaticContact CD2-CE1 3.85Å; F458-F488 HydrophobicContact CD2-CE1 3.85Å; F458-F488 HydrophobicContact CD2-CZ 4.38Å; F458-F488 HydrophobicContact CE1-CE1 4.2Å; F458-F488 HydrophobicContact CE2-CE1 4.04Å; F458-F488 HydrophobicContact CE2-CZ 4.22Å; F458-F488 AromaticContact CG-CE1 3.84Å; F458-F488 HydrophobicContact CG-CE1 3.84Å; F458-F488 HydrophobicContact CZ-CE1 4.21Å; F458-F488 HydrophobicContact CZ-CZ 4.46Å; F458-M506 HydrophobicContact CE2-CE 3.99Å; F458-V518 HydrophobicContact CZ-CG1 4.23Å; F458-Y521 HydrophobicContact CD1-CD1 4.41Å; F458-Y521 HydrophobicContact CD1-CE1 4.22Å; F458-Y521 AromaticContact CE1-CD1 3.65Å; F458-Y521 HydrophobicContact CE1-CD1 3.65Å; F458-Y521 AromaticContact CE1-CE1 3.9Å; F458-Y521 HydrophobicContact CE1-CE1 3.9Å; F458-Y521 HydrophobicContact CZ-CD1 4.12Å; F458-V522 HydrophobicContact CE1-CG2 3.76Å; F458-V522 HydrophobicContact CZ-CG2 4.35Å; F458-L525 HydrophobicContact CD1-CD1 3.83Å; F458-L525 HydrophobicContact CE1-CD1 3.99Å
459	C	97.2	Very high	96.3	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.1	-52.3	177.7	-64.7	0	0	0	0	111.4	G455 M456 L461 V462 H463 F470 Y472 L475 N483	G455-C459 PolarHBondContact O-N 2.97Å; G455-C459 PolarHBondContact O-SG 3.29Å; M456-C459 WeakPolarHBondContact O-CB 3.44Å; M456-C459 PolarHBondContact O-N 3.23Å; C459-L461 PolarHBondContact O-N 3.33Å; C459-V462 PolarHBondContact O-N 2.96Å; C459-H463 WeakPolarHBondContact O-CB 3.43Å; C459-H463 PolarHBondContact O-N 2.76Å; C459-F470 HydrophobicContact CB-CE2 4.16Å; C459-F470 HydrophobicContact CB-CZ 4.4Å; C459-F470 WeakPolarHBondContact O-CZ 3.42Å; C459-Y472 HydrophobicContact CB-CD2 4.15Å; C459-Y472 HydrophobicContact CB-CE2 4.25Å; C459-L475 HydrophobicContact CB-CD1 3.69Å; C459-N483 PolarHBondContact SG-O 2.89Å
460	A	97.6	Very high	96.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-40.5	178.7	0	0	0	0	0	112.9	T437 Y440 I443 M456 V462 H463 S464 Y472	T437-A460 HydrophobicContact CG2-CB 3.84Å; Y440-A460 HydrophobicContact CD1-CB 3.38Å; Y440-A460 HydrophobicContact CD2-CB 4.2Å; Y440-A460 HydrophobicContact CE1-CB 3.78Å; Y440-A460 HydrophobicContact CG-CB 3.62Å; I443-A460 HydrophobicContact CD1-CB 3.17Å; M456-A460 PolarHBondContact O-N 2.95Å; A460-V462 PolarHBondContact O-N 3.42Å; A460-H463 PolarHBondContact O-N 3.44Å; A460-S464 WeakPolarHBondContact O-CB 3.4Å; A460-S464 PolarHBondContact O-N 2.71Å; A460-Y472 HydrophobicContact CB-CD2 4.14Å; A460-Y472 HydrophobicContact CB-CE2 3.7Å
461	L	97.1	Very high	96.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-44	178.9	-177.3	63.1	0	0	0	111.2	W432 K436 T437 W452 A457 F458 C459 S464 F465 L525 L529	W432-L461 HydrophobicContact CH2-CD1 3.84Å; W432-L461 HydrophobicContact CH2-CD2 4.25Å; W432-L461 HydrophobicContact CH2-CG 4.41Å; W432-L461 HydrophobicContact CZ3-CD1 3.82Å; W432-L461 HydrophobicContact CZ3-CD2 3.92Å; W432-L461 HydrophobicContact CZ3-CG 4.42Å; K436-L461 HydrophobicContact CB-CD1 3.71Å; K436-L461 HydrophobicContact CG-CD1 4.36Å; T437-L461 HydrophobicContact CG2-CB 4.39Å; W452-L461 HydrophobicContact CH2-CD2 4.1Å; W452-L461 HydrophobicContact CZ3-CD2 4.26Å; A457-L461 VanDerWaalsContact O-CB 3.26Å; A457-L461 WeakPolarHBondContact O-CB 3.46Å; A457-L461 PolarHBondContact O-N 3.19Å; A457-L461 VanDerWaalsContact O-N 3.11Å; F458-L461 PolarHBondContact O-N 3.45Å; C459-L461 PolarHBondContact O-N 3.33Å; L461-S464 PolarHBondContact O-N 2.94Å; L461-S464 PolarHBondContact O-OG 3.21Å; L461-F465 HydrophobicContact CD1-CE2 4.38Å; L461-F465 VanDerWaalsContact O-CD2 3.31Å; L461-F465 WeakPolarHBondContact O-CD2 3.36Å; L461-L525 HydrophobicContact CD2-CD1 4.39Å; L461-L529 HydrophobicContact CD2-CD1 4.41Å; L461-L529 HydrophobicContact CG-CD1 4.06Å
462	V	96.8	Very high	96.1	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-70.2	-43.8	177.3	178	0	0	0	0	111.3	F458 C459 A460 S464 F465 F466 F470 T490 A491	F458-V462 WeakPolarHBondContact O-CG2 3.24Å; F458-V462 PolarHBondContact O-N 3.01Å; C459-V462 PolarHBondContact O-N 2.96Å; A460-V462 PolarHBondContact O-N 3.42Å; V462-S464 PolarHBondContact O-N 3.45Å; V462-F465 PolarHBondContact O-N 2.83Å; V462-F465 VanDerWaalsContact O-N 3.11Å; V462-F466 HydrophobicContact CG1-CD2 4.07Å; V462-F466 PolarHBondContact O-N 3.37Å; V462-F470 HydrophobicContact CG1-CE1 4.46Å; V462-T490 HydrophobicContact CG1-CG2 3.69Å; V462-A491 HydrophobicContact CG2-CB 4.05Å
463	H	96.8	Very high	95.9	Very high	24 Å²	24	32.6 Å²	32.6	11%	0.111	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-25.9	176.5	-173.2	-79.5	0	0	0	113	Y440 C459 A460 F465 F466 P467 F470 Y472	Y440-H463 HydrophobicContact CE1-CB 4.21Å; Y440-H463 AromaticContact CE1-ND1 3.55Å; Y440-H463 AromaticContact CZ-ND1 3.64Å; Y440-H463 PolarHBondContact OH-ND1 3.47Å; C459-H463 WeakPolarHBondContact O-CB 3.43Å; C459-H463 PolarHBondContact O-N 2.76Å; A460-H463 PolarHBondContact O-N 3.44Å; H463-F465 PolarHBondContact O-N 2.88Å; H463-F466 CarbonylContact O-C 3.48Å; H463-F466 PolarHBondContact O-N 3.11Å; H463-P467 WeakPolarHBondContact O-CA 3.42Å; H463-P467 WeakPolarHBondContact O-CB 3.37Å; H463-P467 WeakPolarHBondContact O-CD 3.32Å; H463-P467 VanDerWaalsContact O-N 3.13Å; H463-F470 HydrophobicContact CB-CE2 3.84Å; H463-F470 HydrophobicContact CB-CZ 3.92Å; H463-F470 AromaticContact CD2-CD2 3.9Å; H463-F470 AromaticContact CD2-CE2 3.79Å; H463-F470 PolarHBondContact CD2-O 3.23Å; H463-F470 PolarHBondContact NE2-O 3.15Å; H463-Y472 PolarHBondContact NE2-N 3.11Å
464	S	96.1	Very high	95.8	Very high	38 Å²	38	35.9 Å²	35.9	27%	0.266	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.3	176	76.5	0	0	0	0	114.1	K436 Y440 A460 L461 V462	K436-S464 WeakPolarHBondContact O-CB 3.27Å; Y440-S464 WeakPolarHBondContact OH-CA 3.38Å; Y440-S464 PolarHBondContact OH-N 3.02Å; A460-S464 WeakPolarHBondContact O-CB 3.4Å; A460-S464 PolarHBondContact O-N 2.71Å; L461-S464 PolarHBondContact O-N 2.94Å; L461-S464 PolarHBondContact O-OG 3.21Å; V462-S464 PolarHBondContact O-N 3.45Å
465	F	95.4	Very high	95.7	Very high	31 Å²	31	35.7 Å²	35.7	14%	0.136	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-32.3	172.2	-61.9	-92.2	0	0	0	112.1	W432 K436 L461 V462 H463 P467 L529 F532 E533	W432-F465 HydrophobicContact CH2-CE2 4.38Å; W432-F465 HydrophobicContact CH2-CZ 4.46Å; W432-F465 HydrophobicContact CZ2-CE2 4.03Å; W432-F465 AromaticContact CZ2-CZ 3.69Å; W432-F465 HydrophobicContact CZ2-CZ 3.69Å; K436-F465 HydrophobicContact CD-CE1 4.36Å; K436-F465 HydrophobicContact CD-CE2 4.01Å; K436-F465 HydrophobicContact CD-CZ 3.59Å; K436-F465 HydrophobicContact CG-CE2 4.14Å; K436-F465 HydrophobicContact CG-CZ 4.01Å; L461-F465 HydrophobicContact CD1-CE2 4.38Å; L461-F465 VanDerWaalsContact O-CD2 3.31Å; L461-F465 WeakPolarHBondContact O-CD2 3.36Å; V462-F465 PolarHBondContact O-N 2.83Å; V462-F465 VanDerWaalsContact O-N 3.11Å; H463-F465 PolarHBondContact O-N 2.88Å; F465-P467 VanDerWaalsContact C-CD 3.48Å; F465-P467 WeakPolarHBondContact O-CD 3.46Å; F465-L529 HydrophobicContact CB-CD2 4.34Å; F465-L529 HydrophobicContact CD1-CB 4.32Å; F465-L529 WeakPolarHBondContact CD1-O 3.02Å; F465-L529 HydrophobicContact CD2-CB 3.85Å; F465-L529 HydrophobicContact CD2-CD1 3.94Å; F465-L529 HydrophobicContact CD2-CD2 3.98Å; F465-L529 HydrophobicContact CD2-CG 4.14Å; F465-L529 HydrophobicContact CE1-CB 4.14Å; F465-L529 WeakPolarHBondContact CE1-O 3.37Å; F465-L529 HydrophobicContact CE2-CB 3.68Å; F465-L529 HydrophobicContact CE2-CD1 3.94Å; F465-L529 HydrophobicContact CE2-CG 4.28Å; F465-L529 HydrophobicContact CG-CB 4.18Å; F465-L529 HydrophobicContact CG-CD2 4.19Å; F465-L529 HydrophobicContact CZ-CB 3.84Å; F465-F532 HydrophobicContact CD1-CB 4.29Å; F465-E533 HydrophobicContact CE1-CB 4.23Å
466	F	95.3	Very high	95.7	Very high	25 Å²	25	37.7 Å²	37.7	11%	0.11	22%	0.22	C	C	.	.			trans	-127.3	66	-175.5	-48	-69.6	0	0	0	112.7	V462 H463 T468 E469 K494 A495 L529 F532	V462-F466 HydrophobicContact CG1-CD2 4.07Å; V462-F466 PolarHBondContact O-N 3.37Å; H463-F466 CarbonylContact O-C 3.48Å; H463-F466 PolarHBondContact O-N 3.11Å; F466-T468 PolarHBondContact O-N 3.27Å; F466-E469 HydrophobicContact CB-CG 3.62Å; F466-E469 PolarHBondContact O-N 3.24Å; F466-K494 HydrophobicContact CD1-CB 4.22Å; F466-K494 HydrophobicContact CD2-CB 4Å; F466-K494 HydrophobicContact CE1-CB 4.07Å; F466-K494 HydrophobicContact CE2-CB 3.83Å; F466-K494 HydrophobicContact CG-CB 4.19Å; F466-K494 HydrophobicContact CZ-CB 3.88Å; F466-A495 HydrophobicContact CE2-CB 4.08Å; F466-A495 HydrophobicContact CZ-CB 4.22Å; F466-L529 HydrophobicContact CD2-CD2 4.42Å; F466-L529 HydrophobicContact CE2-CD2 3.64Å; F466-L529 HydrophobicContact CZ-CD2 4.44Å; F466-F532 AromaticContact CE1-CD1 3.96Å; F466-F532 HydrophobicContact CE1-CD1 3.96Å; F466-F532 HydrophobicContact CE1-CE1 4.24Å; F466-F532 HydrophobicContact CE1-CG 4.21Å; F466-F532 HydrophobicContact CZ-CD1 4.03Å; F466-F532 HydrophobicContact CZ-CD2 4.01Å; F466-F532 HydrophobicContact CZ-CE1 4.18Å; F466-F532 HydrophobicContact CZ-CE2 4.18Å; F466-F532 AromaticContact CZ-CG 3.94Å; F466-F532 HydrophobicContact CZ-CG 3.94Å; F466-F532 HydrophobicContact CZ-CZ 4.26Å
467	P	94.9	Very high	95.5	Very high	80 Å²	80	40 Å²	40	52%	0.519	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	2.3	-176.3	31.5	-37.8	0	0	0	114.2	H463 F465	H463-P467 WeakPolarHBondContact O-CA 3.42Å; H463-P467 WeakPolarHBondContact O-CB 3.37Å; H463-P467 WeakPolarHBondContact O-CD 3.32Å; H463-P467 VanDerWaalsContact O-N 3.13Å; F465-P467 VanDerWaalsContact C-CD 3.48Å; F465-P467 WeakPolarHBondContact O-CD 3.46Å
468	T	93.9	Very high	95.3	Very high	123 Å²	123	43.4 Å²	43.4	76%	0.755	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-7.2	178.8	50	0	0	0	0	113.9	F466	F466-T468 PolarHBondContact O-N 3.27Å
469	E	94.3	Very high	95.2	Very high	71 Å²	71	47.8 Å²	47.8	33%	0.332	29%	0.287	S	S	.	.	S	Bend	trans	-89.8	-30.5	-169.7	-59.1	-60.7	145.2	0	0	113.5	F466 T490 K494	F466-E469 HydrophobicContact CB-CG 3.62Å; F466-E469 PolarHBondContact O-N 3.24Å; E469-T490 HydrophobicContact CB-CG2 3.82Å; E469-T490 HydrophobicContact CG-CG2 3.9Å; E469-K494 HydrophobicContact CG-CD 4.41Å; E469-K494 HydrophobicContact CG-CG 4.25Å; E469-K494 WeakPolarHBondContact OE1-CE 3.34Å; E469-K494 IonicContact OE1-NZ 3.27Å; E469-K494 PolarHBondContact OE1-NZ 2.72Å; E469-K494 WeakPolarHBondContact OE2-CE 3.31Å; E469-K494 IonicContact OE2-NZ 3.94Å; E469-K494 PolarHBondContact OE2-NZ 3.35Å
470	F	95.6	Very high	95.1	Very high	26 Å²	26	49.2 Å²	49.2	11%	0.114	29%	0.293	C	S	.	.	S	Bend	trans	-159.7	153.9	176	53.6	-95.5	0	0	0	109.8	C459 V462 H463 Y472 L475 L486 T490	C459-F470 HydrophobicContact CB-CE2 4.16Å; C459-F470 HydrophobicContact CB-CZ 4.4Å; C459-F470 WeakPolarHBondContact O-CZ 3.42Å; V462-F470 HydrophobicContact CG1-CE1 4.46Å; H463-F470 HydrophobicContact CB-CE2 3.84Å; H463-F470 HydrophobicContact CB-CZ 3.92Å; H463-F470 AromaticContact CD2-CD2 3.9Å; H463-F470 AromaticContact CD2-CE2 3.79Å; H463-F470 PolarHBondContact CD2-O 3.23Å; H463-F470 PolarHBondContact NE2-O 3.15Å; F470-Y472 PolarHBondContact O-N 3.16Å; F470-L475 HydrophobicContact CD2-CD1 3.99Å; F470-L475 HydrophobicContact CE2-CD1 3.96Å; F470-L486 HydrophobicContact CB-CD1 4.09Å; F470-L486 HydrophobicContact CB-CD2 3.98Å; F470-L486 HydrophobicContact CB-CG 4.41Å; F470-L486 HydrophobicContact CD1-CD1 3.78Å; F470-L486 HydrophobicContact CD1-CD2 4.09Å; F470-L486 HydrophobicContact CD1-CG 3.81Å; F470-L486 HydrophobicContact CD2-CD2 3.88Å; F470-L486 HydrophobicContact CD2-CG 4.44Å; F470-L486 HydrophobicContact CE1-CD1 4.46Å; F470-L486 HydrophobicContact CE1-CG 4.11Å; F470-L486 HydrophobicContact CE2-CD2 4.35Å; F470-L486 HydrophobicContact CG-CD1 4.07Å; F470-L486 HydrophobicContact CG-CD2 3.73Å; F470-L486 HydrophobicContact CG-CG 3.99Å; F470-T490 HydrophobicContact CD1-CG2 4.46Å; F470-T490 HydrophobicContact CE1-CG2 4.06Å
471	D	95	Very high	95.1	Very high	87 Å²	87	53.1 Å²	53.1	47%	0.465	31%	0.309	S	S	.	.			trans	-83.3	112.6	171.4	174.5	24.8	0	0	0	110.3	N473 A474	D471-N473 PolarHBondContact O-N 3.27Å; D471-N473 WeakPolarHBondContact OD1-CB 3.43Å; D471-N473 PolarHBondContact OD1-N 3.45Å; D471-N473 PolarHBondContact OD1-ND2 2.83Å; D471-A474 HydrophobicContact CB-CB 4.37Å; D471-A474 PolarHBondContact O-N 3.17Å; D471-A474 PolarHBondContact OD2-N 3.32Å
472	Y	95.1	Very high	95.1	Very high	12 Å²	12	57.5 Å²	57.5	5%	0.047	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-59.3	-31.4	174.1	177.5	-89.5	0	0	0	113.1	Y440 Q441 I443 M456 C459 A460 H463 F470 A474 L475	Y440-Y472 AromaticContact CD1-CD1 3.67Å; Y440-Y472 HydrophobicContact CD1-CD1 3.67Å; Y440-Y472 AromaticContact CD1-CD2 3.88Å; Y440-Y472 HydrophobicContact CD1-CD2 3.88Å; Y440-Y472 AromaticContact CD1-CE1 3.78Å; Y440-Y472 HydrophobicContact CD1-CE1 3.78Å; Y440-Y472 AromaticContact CD1-CE2 3.98Å; Y440-Y472 HydrophobicContact CD1-CE2 3.98Å; Y440-Y472 AromaticContact CD1-CG 3.74Å; Y440-Y472 HydrophobicContact CD1-CG 3.74Å; Y440-Y472 AromaticContact CD1-CZ 3.93Å; Y440-Y472 HydrophobicContact CE1-CD1 4.22Å; Y440-Y472 HydrophobicContact CE1-CD2 4.12Å; Y440-Y472 AromaticContact CE1-CG 3.92Å; Y440-Y472 HydrophobicContact CE1-CG 3.92Å; Q441-Y472 PolarHBondContact O-OH 2.9Å; I443-Y472 HydrophobicContact CD1-CE2 4.11Å; I443-Y472 WeakPolarHBondContact CD1-OH 3.48Å; I443-Y472 WeakPolarHBondContact CG1-OH 3.33Å; M456-Y472 HydrophobicContact CE-CE1 4.4Å; M456-Y472 HydrophobicContact CE-CE2 3.69Å; M456-Y472 WeakPolarHBondContact CE-OH 3.5Å; C459-Y472 HydrophobicContact CB-CD2 4.15Å; C459-Y472 HydrophobicContact CB-CE2 4.25Å; A460-Y472 HydrophobicContact CB-CD2 4.14Å; A460-Y472 HydrophobicContact CB-CE2 3.7Å; H463-Y472 PolarHBondContact NE2-N 3.11Å; F470-Y472 PolarHBondContact O-N 3.16Å; Y472-A474 VanDerWaalsContact C-N 3.28Å; Y472-A474 PolarHBondContact O-N 2.94Å; Y472-L475 HydrophobicContact CD2-CD1 4.29Å; Y472-L475 WeakPolarHBondContact O-CB 3.4Å; Y472-L475 PolarHBondContact O-N 3.21Å; Y472-L475 VanDerWaalsContact O-N 3.12Å
473	N	93.5	Very high	95.2	Very high	114 Å²	114	57.4 Å²	57.4	61%	0.61	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-73.8	-20.3	-173.9	-53.6	-83.3	0	0	0	113	D471 L475	D471-N473 PolarHBondContact O-N 3.27Å; D471-N473 WeakPolarHBondContact OD1-CB 3.43Å; D471-N473 PolarHBondContact OD1-N 3.45Å; D471-N473 PolarHBondContact OD1-ND2 2.83Å; N473-L475 VanDerWaalsContact C-N 3.33Å
474	A	93.8	Very high	95.2	Very high	79 Å²	79	56.2 Å²	56.2	65%	0.653	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-80.1	-11.7	171.9	0	0	0	0	0	113.5	D471 Y472	D471-A474 HydrophobicContact CB-CB 4.37Å; D471-A474 PolarHBondContact O-N 3.17Å; D471-A474 PolarHBondContact OD2-N 3.32Å; Y472-A474 VanDerWaalsContact C-N 3.28Å; Y472-A474 PolarHBondContact O-N 2.94Å
475	L	94.4	Very high	95.3	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.141	33%	0.331	C	S	.	.			trans	-80.6	155.9	-178.2	-58.2	179.3	0	0	0	112.5	M456 C459 F470 Y472 N473 L486	M456-L475 HydrophobicContact CE-CB 3.84Å; M456-L475 HydrophobicContact SD-CB 4.25Å; C459-L475 HydrophobicContact CB-CD1 3.69Å; F470-L475 HydrophobicContact CD2-CD1 3.99Å; F470-L475 HydrophobicContact CE2-CD1 3.96Å; Y472-L475 HydrophobicContact CD2-CD1 4.29Å; Y472-L475 WeakPolarHBondContact O-CB 3.4Å; Y472-L475 PolarHBondContact O-N 3.21Å; Y472-L475 VanDerWaalsContact O-N 3.12Å; N473-L475 VanDerWaalsContact C-N 3.33Å; L475-L486 HydrophobicContact CD1-CD2 4.03Å; L475-L486 HydrophobicContact CD2-CD2 3.68Å; L475-L486 HydrophobicContact CG-CD2 4.47Å
476	S	94.3	Very high	95.4	Very high	43 Å²	43	59 Å²	59	30%	0.301	33%	0.334	S	S	.	.			trans	-138.9	135.1	-177	173.3	0	0	0	0	111.6	A478 N479 N483	S476-A478 PolarHBondContact O-N 3.34Å; S476-A478 PolarHBondContact OG-N 2.87Å; S476-N479 PolarHBondContact O-N 2.78Å; S476-N483 PolarHBondContact O-ND2 3.01Å
477	P	93.9	Very high	95.5	Very high	57 Å²	57	57.9 Å²	57.9	37%	0.37	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-6.1	177.5	27.9	-35.7	0	0	0	114	D454 M456	D454-P477 HydrophobicContact CB-CB 4.14Å; D454-P477 WeakPolarHBondContact OD2-CB 3.36Å; M456-P477 HydrophobicContact CG-CB 3.83Å; M456-P477 HydrophobicContact SD-CB 4.43Å
478	A	93.9	Very high	95.6	Very high	71 Å²	71	54.1 Å²	54.1	59%	0.587	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-38.5	167.5	0	0	0	0	0	112.1	S476 R480	S476-A478 PolarHBondContact O-N 3.34Å; S476-A478 PolarHBondContact OG-N 2.87Å; A478-R480 PolarHBondContact O-N 3.36Å
479	N	94.8	Very high	95.7	Very high	93 Å²	93	49.3 Å²	49.3	50%	0.497	28%	0.28	S	S	.	.			trans	-86	41.9	-168	-66.7	-8	0	0	0	112.9	S476 K481 H482 N483	S476-N479 PolarHBondContact O-N 2.78Å; N479-K481 VanDerWaalsContact C-N 3.32Å; N479-K481 PolarHBondContact O-N 3.07Å; N479-K481 VanDerWaalsContact O-N 3.08Å; N479-H482 WeakPolarHBondContact O-CB 3.46Å; N479-H482 PolarHBondContact O-N 2.89Å; N479-N483 PolarHBondContact O-N 3.07Å; N479-N483 PolarHBondContact O-OD1 3.39Å
480	R	95.6	Very high	95.9	Very high	31 Å²	31	46.7 Å²	46.7	12%	0.117	27%	0.268	C	S	.	.	H	α-helix	trans	-45.8	-47.7	-167.6	-54.3	-160.9	-61.5	140.7	4	115	S453 D454 A478 N483 F484 M507 G510	S453-R480 VanDerWaalsContact O-CD 3.25Å; S453-R480 WeakPolarHBondContact O-CD 3.27Å; S453-R480 PolarHBondContact O-NH1 2.82Å; D454-R480 HydrophobicContact CB-CG 4.35Å; A478-R480 PolarHBondContact O-N 3.36Å; R480-N483 WeakPolarHBondContact O-CB 3.48Å; R480-N483 PolarHBondContact O-N 3.41Å; R480-F484 HydrophobicContact CB-CD2 4.48Å; R480-F484 HydrophobicContact CB-CE2 4.09Å; R480-F484 WeakPolarHBondContact O-CD2 3.44Å; R480-F484 WeakPolarHBondContact O-CG 3.48Å; R480-F484 PolarHBondContact O-N 2.82Å; R480-M507 HydrophobicContact CB-SD 3.81Å; R480-M507 PolarHBondContact NH2-O 2.92Å; R480-G510 PolarHBondContact NH1-O 2.87Å
481	K	97.3	Very high	95.9	Very high	82 Å²	82	45.5 Å²	45.5	36%	0.357	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-49.4	-177.9	177.5	152.6	-177	165.5	0	111.4	N479 N483 F484 E485 V503 E504 M507	N479-K481 VanDerWaalsContact C-N 3.32Å; N479-K481 PolarHBondContact O-N 3.07Å; N479-K481 VanDerWaalsContact O-N 3.08Å; K481-N483 PolarHBondContact O-N 2.95Å; K481-F484 PolarHBondContact O-N 2.95Å; K481-E485 WeakPolarHBondContact CE-OE1 3.33Å; K481-E485 VanDerWaalsContact CG-OE1 3.24Å; K481-E485 WeakPolarHBondContact CG-OE1 3.44Å; K481-E485 VanDerWaalsContact O-CG 3.32Å; K481-E485 WeakPolarHBondContact O-CG 3.46Å; K481-E485 PolarHBondContact O-N 3.17Å; K481-V503 HydrophobicContact CD-CG1 4.35Å; K481-V503 HydrophobicContact CG-CG1 3.82Å; K481-E504 IonicContact NZ-OE2 2.65Å; K481-E504 PolarHBondContact NZ-OE2 3.04Å; K481-M507 HydrophobicContact CB-CE 4.08Å; K481-M507 HydrophobicContact CB-CG 4.22Å; K481-M507 HydrophobicContact CB-SD 3.94Å
482	H	97.6	Very high	96	Very high	91 Å²	91	44.4 Å²	44.4	42%	0.421	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-42.1	175.1	177	63.5	0	0	0	112.1	N479 F484 E485 L486	N479-H482 WeakPolarHBondContact O-CB 3.46Å; N479-H482 PolarHBondContact O-N 2.89Å; H482-F484 VanDerWaalsContact C-N 3.33Å; H482-F484 PolarHBondContact O-N 3.07Å; H482-E485 PolarHBondContact O-N 3.4Å; H482-L486 WeakPolarHBondContact O-CB 3.39Å; H482-L486 PolarHBondContact O-N 3.29Å
483	N	97.1	Very high	96.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-41.3	177.9	-57.5	-15.3	0	0	0	111.8	D454 M456 C459 S476 N479 R480 K481 A487	D454-N483 PolarHBondContact O-ND2 3.31Å; M456-N483 PolarHBondContact SD-ND2 3.06Å; C459-N483 PolarHBondContact SG-O 2.89Å; S476-N483 PolarHBondContact O-ND2 3.01Å; N479-N483 PolarHBondContact O-N 3.07Å; N479-N483 PolarHBondContact O-OD1 3.39Å; R480-N483 WeakPolarHBondContact O-CB 3.48Å; R480-N483 PolarHBondContact O-N 3.41Å; K481-N483 PolarHBondContact O-N 2.95Å; N483-A487 WeakPolarHBondContact O-CB 3.42Å; N483-A487 PolarHBondContact O-N 2.69Å; N483-A487 VanDerWaalsContact O-N 3.1Å
484	F	97.8	Very high	96.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-46.8	174.6	-64.6	-54	0	0	0	112	W452 F458 R480 K481 H482 L486 A487 F488 V503 M506 M507	W452-F484 WeakPolarHBondContact O-CE1 3.49Å; F458-F484 HydrophobicContact CD2-CD1 4.05Å; F458-F484 AromaticContact CD2-CE1 3.93Å; F458-F484 HydrophobicContact CD2-CE1 3.93Å; F458-F484 HydrophobicContact CE2-CD1 4.4Å; F458-F484 HydrophobicContact CE2-CE1 4.06Å; R480-F484 HydrophobicContact CB-CD2 4.48Å; R480-F484 HydrophobicContact CB-CE2 4.09Å; R480-F484 WeakPolarHBondContact O-CD2 3.44Å; R480-F484 WeakPolarHBondContact O-CG 3.48Å; R480-F484 PolarHBondContact O-N 2.82Å; K481-F484 PolarHBondContact O-N 2.95Å; H482-F484 VanDerWaalsContact C-N 3.33Å; H482-F484 PolarHBondContact O-N 3.07Å; F484-L486 VanDerWaalsContact C-N 3.34Å; F484-L486 PolarHBondContact O-N 2.97Å; F484-A487 PolarHBondContact O-N 2.65Å; F484-F488 HydrophobicContact CB-CD2 4.49Å; F484-F488 HydrophobicContact CB-CE2 4.22Å; F484-F488 HydrophobicContact CB-CZ 4.34Å; F484-F488 HydrophobicContact CD1-CE1 4.24Å; F484-F488 AromaticContact CD1-CZ 3.89Å; F484-F488 HydrophobicContact CD1-CZ 3.89Å; F484-F488 HydrophobicContact CG-CZ 4.45Å; F484-F488 WeakPolarHBondContact O-CB 3.22Å; F484-F488 WeakPolarHBondContact O-CG 3.2Å; F484-F488 PolarHBondContact O-N 3.03Å; F484-V503 HydrophobicContact CB-CB 4.49Å; F484-V503 HydrophobicContact CB-CG1 4.1Å; F484-V503 HydrophobicContact CB-CG2 4.05Å; F484-M506 HydrophobicContact CD1-CB 4.46Å; F484-M506 HydrophobicContact CD1-CE 4.35Å; F484-M506 HydrophobicContact CD2-CB 3.97Å; F484-M506 HydrophobicContact CE1-CB 4.28Å; F484-M506 HydrophobicContact CE1-CE 3.47Å; F484-M506 VanDerWaalsContact CE1-CE 3.47Å; F484-M506 HydrophobicContact CE1-CG 4.47Å; F484-M506 HydrophobicContact CE2-CB 3.77Å; F484-M506 HydrophobicContact CG-CB 4.34Å; F484-M506 HydrophobicContact CZ-CB 3.94Å; F484-M506 HydrophobicContact CZ-CE 3.6Å; F484-M507 HydrophobicContact CE2-SD 4.44Å
485	E	97.8	Very high	96.2	Very high	88 Å²	88	44 Å²	44	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-55.8	-47.8	177.2	-73	164.5	176.9	0	0	111.7	K481 H482 G489 V503	K481-E485 WeakPolarHBondContact CE-OE1 3.33Å; K481-E485 VanDerWaalsContact CG-OE1 3.24Å; K481-E485 WeakPolarHBondContact CG-OE1 3.44Å; K481-E485 VanDerWaalsContact O-CG 3.32Å; K481-E485 WeakPolarHBondContact O-CG 3.46Å; K481-E485 PolarHBondContact O-N 3.17Å; H482-E485 PolarHBondContact O-N 3.4Å; E485-G489 PolarHBondContact O-N 3.4Å; E485-V503 HydrophobicContact CG-CB 4.36Å; E485-V503 HydrophobicContact CG-CG1 3.91Å; E485-V503 HydrophobicContact CG-CG2 3.81Å
486	L	97.4	Very high	96.1	Very high	39 Å²	39	44.9 Å²	44.9	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-51.7	-179.7	-178	60.6	0	0	0	111.8	F470 L475 H482 F484 T490	F470-L486 HydrophobicContact CB-CD1 4.09Å; F470-L486 HydrophobicContact CB-CD2 3.98Å; F470-L486 HydrophobicContact CB-CG 4.41Å; F470-L486 HydrophobicContact CD1-CD1 3.78Å; F470-L486 HydrophobicContact CD1-CD2 4.09Å; F470-L486 HydrophobicContact CD1-CG 3.81Å; F470-L486 HydrophobicContact CD2-CD2 3.88Å; F470-L486 HydrophobicContact CD2-CG 4.44Å; F470-L486 HydrophobicContact CE1-CD1 4.46Å; F470-L486 HydrophobicContact CE1-CG 4.11Å; F470-L486 HydrophobicContact CE2-CD2 4.35Å; F470-L486 HydrophobicContact CG-CD1 4.07Å; F470-L486 HydrophobicContact CG-CD2 3.73Å; F470-L486 HydrophobicContact CG-CG 3.99Å; L475-L486 HydrophobicContact CD1-CD2 4.03Å; L475-L486 HydrophobicContact CD2-CD2 3.68Å; L475-L486 HydrophobicContact CG-CD2 4.47Å; H482-L486 WeakPolarHBondContact O-CB 3.39Å; H482-L486 PolarHBondContact O-N 3.29Å; F484-L486 VanDerWaalsContact C-N 3.34Å; F484-L486 PolarHBondContact O-N 2.97Å; L486-T490 VanDerWaalsContact O-CB 3.25Å; L486-T490 WeakPolarHBondContact O-CB 3.4Å; L486-T490 PolarHBondContact O-N 3.15Å; L486-T490 PolarHBondContact O-OG1 3.46Å
487	A	97	Very high	96.2	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-44.4	-178	0	0	0	0	0	112.1	F458 N483 F484 A491	F458-A487 HydrophobicContact CB-CB 3.66Å; N483-A487 WeakPolarHBondContact O-CB 3.42Å; N483-A487 PolarHBondContact O-N 2.69Å; N483-A487 VanDerWaalsContact O-N 3.1Å; F484-A487 PolarHBondContact O-N 2.65Å; A487-A491 VanDerWaalsContact O-CB 3.32Å; A487-A491 WeakPolarHBondContact O-CB 3.35Å; A487-A491 PolarHBondContact O-N 2.98Å
488	F	97.4	Very high	96.1	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-70.8	-42.8	-177.6	-64.7	-0.7	0	0	0	111.3	F458 F484 A491 E492 R499 V503 M506 Y521	F458-F488 HydrophobicContact CB-CE1 4.37Å; F458-F488 HydrophobicContact CD1-CE1 4.02Å; F458-F488 AromaticContact CD2-CE1 3.85Å; F458-F488 HydrophobicContact CD2-CE1 3.85Å; F458-F488 HydrophobicContact CD2-CZ 4.38Å; F458-F488 HydrophobicContact CE1-CE1 4.2Å; F458-F488 HydrophobicContact CE2-CE1 4.04Å; F458-F488 HydrophobicContact CE2-CZ 4.22Å; F458-F488 AromaticContact CG-CE1 3.84Å; F458-F488 HydrophobicContact CG-CE1 3.84Å; F458-F488 HydrophobicContact CZ-CE1 4.21Å; F458-F488 HydrophobicContact CZ-CZ 4.46Å; F484-F488 HydrophobicContact CB-CD2 4.49Å; F484-F488 HydrophobicContact CB-CE2 4.22Å; F484-F488 HydrophobicContact CB-CZ 4.34Å; F484-F488 HydrophobicContact CD1-CE1 4.24Å; F484-F488 AromaticContact CD1-CZ 3.89Å; F484-F488 HydrophobicContact CD1-CZ 3.89Å; F484-F488 HydrophobicContact CG-CZ 4.45Å; F484-F488 WeakPolarHBondContact O-CB 3.22Å; F484-F488 WeakPolarHBondContact O-CG 3.2Å; F484-F488 PolarHBondContact O-N 3.03Å; F488-A491 PolarHBondContact O-N 3.17Å; F488-E492 WeakPolarHBondContact O-CB 3.4Å; F488-E492 PolarHBondContact O-N 2.98Å; F488-R499 HydrophobicContact CB-CG 4.03Å; F488-V503 HydrophobicContact CD2-CG2 3.99Å; F488-V503 HydrophobicContact CE2-CG2 4.42Å; F488-M506 HydrophobicContact CE2-CG 4.38Å; F488-M506 HydrophobicContact CZ-CG 4.29Å; F488-Y521 AromaticContact CD1-CE1 3.62Å; F488-Y521 HydrophobicContact CD1-CE1 3.62Å; F488-Y521 HydrophobicContact CE1-CD1 4.19Å; F488-Y521 AromaticContact CE1-CE1 3.48Å; F488-Y521 HydrophobicContact CE1-CE1 3.48Å; F488-Y521 VanDerWaalsContact CE1-CE1 3.48Å; F488-Y521 HydrophobicContact CG-CE1 4.37Å; F488-Y521 HydrophobicContact CZ-CE1 4.11Å
489	G	96.8	Very high	96.1	Very high	22 Å²	22	48.5 Å²	48.5	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.1	0	0	0	0	0	113.1	E485 T493	E485-G489 PolarHBondContact O-N 3.4Å; G489-T493 VanDerWaalsContact O-CB 3.28Å; G489-T493 WeakPolarHBondContact O-CB 3.31Å; G489-T493 PolarHBondContact O-N 2.71Å; G489-T493 PolarHBondContact O-OG1 3.44Å
490	T	97	Very high	96.1	Very high	16 Å²	16	48.7 Å²	48.7	10%	0.098	25%	0.253	C	S	.	.	H	α-helix	trans	-68.7	-42.6	175.1	-53.8	0	0	0	0	111.2	V462 E469 F470 L486 E492 T493 K494	V462-T490 HydrophobicContact CG1-CG2 3.69Å; E469-T490 HydrophobicContact CB-CG2 3.82Å; E469-T490 HydrophobicContact CG-CG2 3.9Å; F470-T490 HydrophobicContact CD1-CG2 4.46Å; F470-T490 HydrophobicContact CE1-CG2 4.06Å; L486-T490 VanDerWaalsContact O-CB 3.25Å; L486-T490 WeakPolarHBondContact O-CB 3.4Å; L486-T490 PolarHBondContact O-N 3.15Å; L486-T490 PolarHBondContact O-OG1 3.46Å; T490-E492 PolarHBondContact O-N 3.32Å; T490-T493 PolarHBondContact O-N 3Å; T490-K494 HydrophobicContact CG2-CG 3.99Å; T490-K494 VanDerWaalsContact O-CB 3.29Å; T490-K494 WeakPolarHBondContact O-CB 3.25Å; T490-K494 WeakPolarHBondContact O-CG 3.5Å; T490-K494 PolarHBondContact O-N 3.37Å
491	A	96.6	Very high	96	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-40.1	177	0	0	0	0	0	112.9	V462 A487 F488 A495 G496 C497 L525	V462-A491 HydrophobicContact CG2-CB 4.05Å; A487-A491 VanDerWaalsContact O-CB 3.32Å; A487-A491 WeakPolarHBondContact O-CB 3.35Å; A487-A491 PolarHBondContact O-N 2.98Å; F488-A491 PolarHBondContact O-N 3.17Å; A491-A495 WeakPolarHBondContact O-CA 3.47Å; A491-A495 WeakPolarHBondContact O-CB 3.39Å; A491-A495 PolarHBondContact O-N 3.07Å; A491-G496 PolarHBondContact O-N 2.85Å; A491-C497 HydrophobicContact CB-CB 4.4Å; A491-C497 PolarHBondContact O-N 3.46Å; A491-L525 HydrophobicContact CB-CD2 3.65Å
492	E	96.8	Very high	96	Very high	65 Å²	65	50.3 Å²	50.3	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-52.6	172.9	-173.7	173.6	-93.8	0	0	110.8	F488 T490 K494 G496 C497 R499	F488-E492 WeakPolarHBondContact O-CB 3.4Å; F488-E492 PolarHBondContact O-N 2.98Å; T490-E492 PolarHBondContact O-N 3.32Å; E492-K494 PolarHBondContact O-N 3.42Å; E492-G496 VanDerWaalsContact O-CA 3.29Å; E492-G496 WeakPolarHBondContact O-CA 3.16Å; E492-G496 PolarHBondContact O-N 3.36Å; E492-G496 VanDerWaalsContact O-N 3.15Å; E492-C497 WeakPolarHBondContact CA-O 3.44Å; E492-R499 HydrophobicContact CB-CG 4.5Å; E492-R499 WeakPolarHBondContact OE1-CG 3.32Å; E492-R499 IonicContact OE1-CZ 2.72Å; E492-R499 IonicContact OE1-NE 2.7Å; E492-R499 PolarHBondContact OE1-NE 2.9Å; E492-R499 IonicContact OE1-NH2 3.31Å; E492-R499 PolarHBondContact OE1-NH2 2.86Å; E492-R499 IonicContact OE2-CZ 2.74Å; E492-R499 VanDerWaalsContact OE2-CZ 3.29Å; E492-R499 IonicContact OE2-NE 3.13Å; E492-R499 PolarHBondContact OE2-NE 3.08Å; E492-R499 IonicContact OE2-NH2 2.7Å; E492-R499 PolarHBondContact OE2-NH2 2.95Å
493	T	96.4	Very high	95.9	Very high	105 Å²	105	47 Å²	47	64%	0.644	25%	0.25	S	C	*	.	H	α-helix	trans	-67.9	-37	-175	-54.1	0	0	0	0	113.8	G489 T490	G489-T493 VanDerWaalsContact O-CB 3.28Å; G489-T493 WeakPolarHBondContact O-CB 3.31Å; G489-T493 PolarHBondContact O-N 2.71Å; G489-T493 PolarHBondContact O-OG1 3.44Å; T490-T493 PolarHBondContact O-N 3Å
494	K	95.8	Very high	95.9	Very high	82 Å²	82	51.3 Å²	51.3	36%	0.357	27%	0.27	S	S	.	.	H	α-helix	trans	-103.8	-34.1	-170.1	-59.9	-73.4	160.9	145	0	113.9	F466 E469 T490 E492 F532	F466-K494 HydrophobicContact CD1-CB 4.22Å; F466-K494 HydrophobicContact CD2-CB 4Å; F466-K494 HydrophobicContact CE1-CB 4.07Å; F466-K494 HydrophobicContact CE2-CB 3.83Å; F466-K494 HydrophobicContact CG-CB 4.19Å; F466-K494 HydrophobicContact CZ-CB 3.88Å; E469-K494 HydrophobicContact CG-CD 4.41Å; E469-K494 HydrophobicContact CG-CG 4.25Å; E469-K494 WeakPolarHBondContact OE1-CE 3.34Å; E469-K494 IonicContact OE1-NZ 3.27Å; E469-K494 PolarHBondContact OE1-NZ 2.72Å; E469-K494 WeakPolarHBondContact OE2-CE 3.31Å; E469-K494 IonicContact OE2-NZ 3.94Å; E469-K494 PolarHBondContact OE2-NZ 3.35Å; T490-K494 HydrophobicContact CG2-CG 3.99Å; T490-K494 VanDerWaalsContact O-CB 3.29Å; T490-K494 WeakPolarHBondContact O-CB 3.25Å; T490-K494 WeakPolarHBondContact O-CG 3.5Å; T490-K494 PolarHBondContact O-N 3.37Å; E492-K494 PolarHBondContact O-N 3.42Å; K494-F532 WeakPolarHBondContact O-CZ 2.79Å
495	A	93.9	Very high	95.8	Very high	9 Å²	9	54.8 Å²	54.8	7%	0.074	29%	0.288	C	S	.	.	H	α-helix	trans	-105.8	-5.9	-179.8	0	0	0	0	0	114	F466 A491 C497 H528 L529 F532	F466-A495 HydrophobicContact CE2-CB 4.08Å; F466-A495 HydrophobicContact CZ-CB 4.22Å; A491-A495 WeakPolarHBondContact O-CA 3.47Å; A491-A495 WeakPolarHBondContact O-CB 3.39Å; A491-A495 PolarHBondContact O-N 3.07Å; A495-C497 HydrophobicContact CB-CB 4.46Å; A495-C497 PolarHBondContact O-N 2.94Å; A495-H528 HydrophobicContact CB-CB 4.2Å; A495-H528 PolarHBondContact O-CD2 3.36Å; A495-L529 HydrophobicContact CB-CD2 3.87Å; A495-F532 HydrophobicContact CB-CE2 3.87Å; A495-F532 HydrophobicContact CB-CZ 4.47Å
496	G	93.9	Very high	95.7	Very high	46 Å²	46	50.6 Å²	50.6	47%	0.474	27%	0.269	S	S	.	.			trans	62.7	32.9	-172.9	0	0	0	0	0	112.3	A491 E492 H528	A491-G496 PolarHBondContact O-N 2.85Å; E492-G496 VanDerWaalsContact O-CA 3.29Å; E492-G496 WeakPolarHBondContact O-CA 3.16Å; E492-G496 PolarHBondContact O-N 3.36Å; E492-G496 VanDerWaalsContact O-N 3.15Å; G496-H528 PolarHBondContact O-CD2 3.27Å
497	C	94.8	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.			trans	-96.4	101.7	-177.6	-175.1	0	0	0	0	110.8	A491 E492 A495 L525 H528	A491-C497 HydrophobicContact CB-CB 4.4Å; A491-C497 PolarHBondContact O-N 3.46Å; E492-C497 WeakPolarHBondContact CA-O 3.44Å; A495-C497 HydrophobicContact CB-CB 4.46Å; A495-C497 PolarHBondContact O-N 2.94Å; C497-L525 HydrophobicContact CB-CD2 4.31Å; C497-H528 HydrophobicContact CB-CB 3.85Å
498	D	93.3	Very high	95.6	Very high	110 Å²	110	57.4 Å²	57.4	59%	0.588	30%	0.303	S	S	*	.			trans	-50	139.3	178.4	-58.4	-36.3	0	0	0	112.9	L500 Y521	D498-L500 HydrophobicContact CB-CD2 4.43Å; D498-L500 PolarHBondContact O-N 3.13Å; D498-Y521 WeakPolarHBondContact O-CE2 3.43Å
499	R	93.1	Very high	95.4	Very high	137 Å²	137	60.5 Å²	60.5	52%	0.517	32%	0.318	S	S	.	.			trans	-74.5	91.5	178.4	-71.3	-178.2	-80.1	168.2	-12.2	111.7	F488 E492 I501	F488-R499 HydrophobicContact CB-CG 4.03Å; E492-R499 HydrophobicContact CB-CG 4.5Å; E492-R499 WeakPolarHBondContact OE1-CG 3.32Å; E492-R499 IonicContact OE1-CZ 2.72Å; E492-R499 IonicContact OE1-NE 2.7Å; E492-R499 PolarHBondContact OE1-NE 2.9Å; E492-R499 IonicContact OE1-NH2 3.31Å; E492-R499 PolarHBondContact OE1-NH2 2.86Å; E492-R499 IonicContact OE2-CZ 2.74Å; E492-R499 VanDerWaalsContact OE2-CZ 3.29Å; E492-R499 IonicContact OE2-NE 3.13Å; E492-R499 PolarHBondContact OE2-NE 3.08Å; E492-R499 IonicContact OE2-NH2 2.7Å; E492-R499 PolarHBondContact OE2-NH2 2.95Å; R499-I501 VanDerWaalsContact C-N 3.26Å; R499-I501 PolarHBondContact O-N 3.21Å
500	L	94.6	Very high	95.3	Very high	97 Å²	97	60.3 Å²	60.3	51%	0.508	32%	0.317	S	S	.	.			trans	-77.8	-3.7	178.3	-53.7	-176.4	0	0	0	114.7	D498 T520 Y521	D498-L500 HydrophobicContact CB-CD2 4.43Å; D498-L500 PolarHBondContact O-N 3.13Å; L500-T520 HydrophobicContact CD1-CG2 4.47Å; L500-Y521 HydrophobicContact CB-CD2 3.84Å; L500-Y521 HydrophobicContact CD1-CD2 4.43Å; L500-Y521 HydrophobicContact CG-CD2 4.08Å
501	I	94.6	Very high	95.2	Very high	10 Å²	10	66.6 Å²	66.6	5%	0.051	34%	0.339	C	S	.	.	S	Bend	trans	-139.9	132.6	175.7	-45	175.7	0	0	0	107.5	R499 D505 M506 C517 Y521	R499-I501 VanDerWaalsContact C-N 3.26Å; R499-I501 PolarHBondContact O-N 3.21Å; I501-D505 HydrophobicContact CG2-CB 4.27Å; I501-M506 HydrophobicContact CD1-SD 4.43Å; I501-M506 HydrophobicContact CG2-CG 3.72Å; I501-M506 HydrophobicContact CG2-SD 4.06Å; I501-C517 HydrophobicContact CD1-CB 4.2Å; I501-Y521 HydrophobicContact CD1-CD1 4.3Å; I501-Y521 HydrophobicContact CD1-CG 4.2Å; I501-Y521 HydrophobicContact CG1-CG 4.26Å
502	E	95.5	Very high	95.1	Very high	137 Å²	137	74.8 Å²	74.8	64%	0.64	37%	0.374	S	S	*	.			trans	-77.5	153.2	173.8	-65.2	-164.4	-172	0	0	112	E504 D505 M506	E502-E504 VanDerWaalsContact C-N 3.29Å; E502-E504 PolarHBondContact O-N 2.89Å; E502-D505 PolarHBondContact O-N 3.15Å; E502-M506 PolarHBondContact O-N 3.42Å
503	V	96.5	Very high	95.1	Very high	22 Å²	22	71.7 Å²	71.7	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-39.5	177	171	0	0	0	0	111	K481 F484 E485 F488 M506 M507	K481-V503 HydrophobicContact CD-CG1 4.35Å; K481-V503 HydrophobicContact CG-CG1 3.82Å; F484-V503 HydrophobicContact CB-CB 4.49Å; F484-V503 HydrophobicContact CB-CG1 4.1Å; F484-V503 HydrophobicContact CB-CG2 4.05Å; E485-V503 HydrophobicContact CG-CB 4.36Å; E485-V503 HydrophobicContact CG-CG1 3.91Å; E485-V503 HydrophobicContact CG-CG2 3.81Å; F488-V503 HydrophobicContact CD2-CG2 3.99Å; F488-V503 HydrophobicContact CE2-CG2 4.42Å; V503-M506 PolarHBondContact O-N 2.86Å; V503-M507 WeakPolarHBondContact O-CG 3.43Å; V503-M507 PolarHBondContact O-N 3.47Å
504	E	96.5	Very high	95.1	Very high	89 Å²	89	70.2 Å²	70.2	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-70.1	-36.8	-177.5	-150.8	61.3	-132.3	0	0	111.4	K481 E502 M506 M507 I508	K481-E504 IonicContact NZ-OE2 2.65Å; K481-E504 PolarHBondContact NZ-OE2 3.04Å; E502-E504 VanDerWaalsContact C-N 3.29Å; E502-E504 PolarHBondContact O-N 2.89Å; E504-M506 PolarHBondContact O-N 3.26Å; E504-M507 WeakPolarHBondContact O-CB 3.4Å; E504-M507 PolarHBondContact O-N 2.89Å; E504-M507 VanDerWaalsContact O-N 3.1Å; E504-I508 HydrophobicContact CG-CD1 4.29Å; E504-I508 WeakPolarHBondContact O-CB 3.36Å; E504-I508 WeakPolarHBondContact O-CD1 3.39Å; E504-I508 VanDerWaalsContact O-CG1 3.24Å; E504-I508 WeakPolarHBondContact O-CG1 3.4Å; E504-I508 PolarHBondContact O-N 3.4Å
505	D	95.6	Very high	95.1	Very high	73 Å²	73	69.4 Å²	69.4	39%	0.39	35%	0.351	S	S	.	.	H	α-helix	trans	-56.9	-47.9	170.8	-74.6	-29.7	0	0	0	111.7	I501 E502 M507 I508 M509	I501-D505 HydrophobicContact CG2-CB 4.27Å; E502-D505 PolarHBondContact O-N 3.15Å; D505-M507 PolarHBondContact O-N 3.41Å; D505-I508 PolarHBondContact O-N 2.86Å; D505-M509 HydrophobicContact CB-CE 4.5Å; D505-M509 WeakPolarHBondContact O-CB 3.4Å; D505-M509 VanDerWaalsContact O-CG 3.26Å; D505-M509 WeakPolarHBondContact O-CG 3.28Å; D505-M509 PolarHBondContact O-N 3.18Å
506	M	95.6	Very high	95.2	Very high	1 Å²	1	73.6 Å²	73.6	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-29.7	176.9	-72.4	-66.3	-67.2	0	0	112.8	F458 F484 F488 I501 E502 V503 E504 P513 V518	F458-M506 HydrophobicContact CE2-CE 3.99Å; F484-M506 HydrophobicContact CD1-CB 4.46Å; F484-M506 HydrophobicContact CD1-CE 4.35Å; F484-M506 HydrophobicContact CD2-CB 3.97Å; F484-M506 HydrophobicContact CE1-CB 4.28Å; F484-M506 HydrophobicContact CE1-CE 3.47Å; F484-M506 VanDerWaalsContact CE1-CE 3.47Å; F484-M506 HydrophobicContact CE1-CG 4.47Å; F484-M506 HydrophobicContact CE2-CB 3.77Å; F484-M506 HydrophobicContact CG-CB 4.34Å; F484-M506 HydrophobicContact CZ-CB 3.94Å; F484-M506 HydrophobicContact CZ-CE 3.6Å; F488-M506 HydrophobicContact CE2-CG 4.38Å; F488-M506 HydrophobicContact CZ-CG 4.29Å; I501-M506 HydrophobicContact CD1-SD 4.43Å; I501-M506 HydrophobicContact CG2-CG 3.72Å; I501-M506 HydrophobicContact CG2-SD 4.06Å; E502-M506 PolarHBondContact O-N 3.42Å; V503-M506 PolarHBondContact O-N 2.86Å; E504-M506 PolarHBondContact O-N 3.26Å; M506-P513 HydrophobicContact CE-CB 3.99Å; M506-P513 HydrophobicContact CE-CG 3.95Å; M506-P513 HydrophobicContact SD-CB 3.85Å; M506-P513 HydrophobicContact SD-CG 4.46Å; M506-V518 HydrophobicContact CE-CG2 4.4Å; M506-V518 HydrophobicContact SD-CG2 4.33Å
507	M	96.3	Very high	95.3	Very high	52 Å²	52	73.7 Å²	73.7	26%	0.256	36%	0.363	S	S	.	.	H	α-helix	trans	-72.2	-46	173.8	-73.7	-65.8	-70.4	0	0	111.8	R480 K481 F484 V503 E504 D505 G510	R480-M507 HydrophobicContact CB-SD 3.81Å; R480-M507 PolarHBondContact NH2-O 2.92Å; K481-M507 HydrophobicContact CB-CE 4.08Å; K481-M507 HydrophobicContact CB-CG 4.22Å; K481-M507 HydrophobicContact CB-SD 3.94Å; F484-M507 HydrophobicContact CE2-SD 4.44Å; V503-M507 WeakPolarHBondContact O-CG 3.43Å; V503-M507 PolarHBondContact O-N 3.47Å; E504-M507 WeakPolarHBondContact O-CB 3.4Å; E504-M507 PolarHBondContact O-N 2.89Å; E504-M507 VanDerWaalsContact O-N 3.1Å; D505-M507 PolarHBondContact O-N 3.41Å; M507-G510 PolarHBondContact O-N 3.48Å; M507-G510 VanDerWaalsContact O-N 3.09Å
508	I	96.1	Very high	95.4	Very high	131 Å²	131	73.7 Å²	73.7	67%	0.672	36%	0.363	S	S	*	.	H	α-helix	trans	-61.4	-42.9	176.2	-68.7	162.8	0	0	0	111.2	E504 D505 G510	E504-I508 HydrophobicContact CG-CD1 4.29Å; E504-I508 WeakPolarHBondContact O-CB 3.36Å; E504-I508 WeakPolarHBondContact O-CD1 3.39Å; E504-I508 VanDerWaalsContact O-CG1 3.24Å; E504-I508 WeakPolarHBondContact O-CG1 3.4Å; E504-I508 PolarHBondContact O-N 3.4Å; D505-I508 PolarHBondContact O-N 2.86Å; I508-G510 PolarHBondContact O-N 3.13Å; I508-G510 VanDerWaalsContact O-N 3.14Å
509	M	94.1	Very high	95.6	Very high	66 Å²	66	69.4 Å²	69.4	33%	0.325	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-12	174.8	-73.5	-173.7	-162.4	0	0	114	D505 R511 K512 P513	D505-M509 HydrophobicContact CB-CE 4.5Å; D505-M509 WeakPolarHBondContact O-CB 3.4Å; D505-M509 VanDerWaalsContact O-CG 3.26Å; D505-M509 WeakPolarHBondContact O-CG 3.28Å; D505-M509 PolarHBondContact O-N 3.18Å; M509-R511 PolarHBondContact O-N 2.98Å; M509-K512 PolarHBondContact O-N 3.44Å; M509-P513 HydrophobicContact CB-CB 4.05Å; M509-P513 HydrophobicContact SD-CB 3.69Å
510	G	94.3	Very high	95.7	Very high	19 Å²	19	66.1 Å²	66.1	20%	0.196	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	61	-129.6	171.8	0	0	0	0	0	113.2	R480 M507 I508	R480-G510 PolarHBondContact NH1-O 2.87Å; M507-G510 PolarHBondContact O-N 3.48Å; M507-G510 VanDerWaalsContact O-N 3.09Å; I508-G510 PolarHBondContact O-N 3.13Å; I508-G510 VanDerWaalsContact O-N 3.14Å
511	R	95.1	Very high	95.9	Very high	148 Å²	148	61.6 Å²	61.6	56%	0.558	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	0.4	-173.4	-61.5	-62.9	-176.6	174.9	-1.6	114.7	S453 M509	S453-R511 WeakPolarHBondContact CB-O 3.29Å; S453-R511 PolarHBondContact OG-O 2.93Å; M509-R511 PolarHBondContact O-N 2.98Å
512	K	95.1	Very high	96	Very high	172 Å²	172	61.1 Å²	61.1	75%	0.748	31%	0.308	S	S	*	.	S	Bend	trans	-143.9	70	-177.3	-67.4	-174.3	179.3	178.8	0	111.2	M509	M509-K512 PolarHBondContact O-N 3.44Å
513	P	96.4	Very high	96	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.			trans	-62.9	156.3	174	28.8	-35.3	0	0	0	112.3	S449 M506 M509 P515 V518	S449-P513 VanDerWaalsContact CB-O 3.3Å; S449-P513 WeakPolarHBondContact CB-O 3.25Å; S449-P513 WeakPolarHBondContact O-CG 3.12Å; S449-P513 PolarHBondContact OG-O 3.4Å; M506-P513 HydrophobicContact CE-CB 3.99Å; M506-P513 HydrophobicContact CE-CG 3.95Å; M506-P513 HydrophobicContact SD-CB 3.85Å; M506-P513 HydrophobicContact SD-CG 4.46Å; M509-P513 HydrophobicContact CB-CB 4.05Å; M509-P513 HydrophobicContact SD-CB 3.69Å; P513-P515 WeakPolarHBondContact O-CD 3.43Å; P513-V518 HydrophobicContact CB-CG2 3.89Å; P513-V518 HydrophobicContact CG-CG2 3.97Å
514	D	96.4	Very high	96	Very high	74 Å²	74	58.2 Å²	58.2	40%	0.396	30%	0.295	S	S	.	.			trans	-60.3	120.8	-176.8	-175.9	-15.6	0	0	0	110.7	M516 C517 V518	D514-M516 PolarHBondContact O-N 3.41Å; D514-M516 WeakPolarHBondContact OD1-CB 3.24Å; D514-M516 PolarHBondContact OD1-N 3.19Å; D514-C517 HydrophobicContact CB-CB 4.13Å; D514-C517 PolarHBondContact O-N 3.15Å; D514-V518 PolarHBondContact O-N 2.92Å; D514-V518 VanDerWaalsContact O-N 3.13Å
515	P	95.9	Very high	96.1	Very high	65 Å²	65	54 Å²	54	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-52.2	-23.8	173.9	-24.2	31.5	0	0	0	115.5	F448 P513 F519	F448-P515 WeakPolarHBondContact O-CA 3.34Å; P513-P515 WeakPolarHBondContact O-CD 3.43Å; P515-F519 WeakPolarHBondContact O-CB 3.48Å; P515-F519 PolarHBondContact O-N 3.1Å
516	M	95.4	Very high	96.1	Very high	97 Å²	97	53.4 Å²	53.4	48%	0.478	27%	0.269	S	S	.	.	H	α-helix	trans	-84.8	-42.8	179.1	-68.3	-58	-56.7	0	0	112.6	K426 D514 T520	K426-M516 PolarHBondContact NZ-SD 2.85Å; D514-M516 PolarHBondContact O-N 3.41Å; D514-M516 WeakPolarHBondContact OD1-CB 3.24Å; D514-M516 PolarHBondContact OD1-N 3.19Å; M516-T520 WeakPolarHBondContact O-CB 3.26Å; M516-T520 PolarHBondContact O-N 3.28Å; M516-T520 PolarHBondContact O-OG1 2.98Å
517	C	96.1	Very high	96.1	Very high	48 Å²	48	56.9 Å²	56.9	32%	0.324	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-54.4	174.4	-65.1	0	0	0	0	110.4	I501 D514 F519 T520 Y521	I501-C517 HydrophobicContact CD1-CB 4.2Å; D514-C517 HydrophobicContact CB-CB 4.13Å; D514-C517 PolarHBondContact O-N 3.15Å; C517-F519 PolarHBondContact O-N 3.48Å; C517-T520 PolarHBondContact O-N 3.32Å; C517-T520 VanDerWaalsContact O-N 3.13Å; C517-Y521 PolarHBondContact O-N 3.5Å
518	V	97.3	Very high	96	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-44	179.9	174.5	0	0	0	0	111.4	F448 W452 F458 M506 P513 D514 T520 Y521 V522	F448-V518 HydrophobicContact CB-CB 4.43Å; F448-V518 HydrophobicContact CB-CG1 4.12Å; F448-V518 HydrophobicContact CD1-CG1 4.46Å; F448-V518 WeakPolarHBondContact O-CB 3.45Å; F448-V518 WeakPolarHBondContact O-CG1 3.27Å; W452-V518 HydrophobicContact CB-CG1 4.01Å; W452-V518 HydrophobicContact CD2-CG1 4.06Å; W452-V518 HydrophobicContact CG-CG1 3.68Å; F458-V518 HydrophobicContact CZ-CG1 4.23Å; M506-V518 HydrophobicContact CE-CG2 4.4Å; M506-V518 HydrophobicContact SD-CG2 4.33Å; P513-V518 HydrophobicContact CB-CG2 3.89Å; P513-V518 HydrophobicContact CG-CG2 3.97Å; D514-V518 PolarHBondContact O-N 2.92Å; D514-V518 VanDerWaalsContact O-N 3.13Å; V518-T520 VanDerWaalsContact C-N 3.31Å; V518-T520 PolarHBondContact O-N 3.16Å; V518-Y521 PolarHBondContact O-N 3.41Å; V518-V522 HydrophobicContact CG1-CG2 4.11Å; V518-V522 WeakPolarHBondContact O-CB 3.42Å; V518-V522 VanDerWaalsContact O-CG2 3.24Å; V518-V522 WeakPolarHBondContact O-CG2 3.34Å; V518-V522 PolarHBondContact O-N 3.05Å
519	F	96.8	Very high	95.9	Very high	19 Å²	19	49.9 Å²	49.9	8%	0.083	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-43	175.1	169.7	-101.6	0	0	0	112.3	I425 K426 L429 F448 P515 C517 V522 Q523	I425-F519 HydrophobicContact CG2-CZ 4.25Å; K426-F519 HydrophobicContact CB-CE2 4.32Å; K426-F519 HydrophobicContact CD-CD2 4.36Å; K426-F519 HydrophobicContact CD-CE2 4.44Å; K426-F519 HydrophobicContact CG-CD2 3.62Å; K426-F519 HydrophobicContact CG-CE2 3.38Å; K426-F519 HydrophobicContact CG-CG 4.3Å; K426-F519 HydrophobicContact CG-CZ 3.89Å; L429-F519 HydrophobicContact CD2-CD2 3.63Å; L429-F519 HydrophobicContact CD2-CE2 3.45Å; L429-F519 VanDerWaalsContact CD2-CE2 3.45Å; L429-F519 HydrophobicContact CD2-CZ 4.41Å; F448-F519 HydrophobicContact CB-CB 4.29Å; F448-F519 HydrophobicContact CD1-CB 4.39Å; F448-F519 HydrophobicContact CD2-CB 4.34Å; F448-F519 HydrophobicContact CD2-CD2 4.08Å; F448-F519 HydrophobicContact CE1-CD2 4.28Å; F448-F519 AromaticContact CE2-CD2 3.82Å; F448-F519 HydrophobicContact CE2-CD2 3.82Å; F448-F519 HydrophobicContact CE2-CE2 4.5Å; F448-F519 HydrophobicContact CG-CB 4.09Å; F448-F519 HydrophobicContact CG-CD2 4.43Å; F448-F519 AromaticContact CZ-CD2 3.93Å; F448-F519 HydrophobicContact CZ-CD2 3.93Å; P515-F519 WeakPolarHBondContact O-CB 3.48Å; P515-F519 PolarHBondContact O-N 3.1Å; C517-F519 PolarHBondContact O-N 3.48Å; F519-V522 PolarHBondContact O-N 3.34Å; F519-Q523 VanDerWaalsContact CE1-OE1 3.32Å; F519-Q523 VanDerWaalsContact O-CB 3.27Å; F519-Q523 WeakPolarHBondContact O-CB 3.47Å; F519-Q523 PolarHBondContact O-N 3.5Å
520	T	96.3	Very high	95.8	Very high	69 Å²	69	53 Å²	53	42%	0.423	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-43	-179.1	-54.4	0	0	0	0	111.2	L500 M516 C517 V518 Q523 S524	L500-T520 HydrophobicContact CD1-CG2 4.47Å; M516-T520 WeakPolarHBondContact O-CB 3.26Å; M516-T520 PolarHBondContact O-N 3.28Å; M516-T520 PolarHBondContact O-OG1 2.98Å; C517-T520 PolarHBondContact O-N 3.32Å; C517-T520 VanDerWaalsContact O-N 3.13Å; V518-T520 VanDerWaalsContact C-N 3.31Å; V518-T520 PolarHBondContact O-N 3.16Å; T520-Q523 PolarHBondContact O-N 2.92Å; T520-S524 PolarHBondContact O-N 3.15Å
521	Y	97.6	Very high	95.7	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-70.2	-41	176.8	-176.1	-122.7	0	0	0	112.7	F458 F488 D498 L500 I501 C517 V518 Q523 S524 L525	F458-Y521 HydrophobicContact CD1-CD1 4.41Å; F458-Y521 HydrophobicContact CD1-CE1 4.22Å; F458-Y521 AromaticContact CE1-CD1 3.65Å; F458-Y521 HydrophobicContact CE1-CD1 3.65Å; F458-Y521 AromaticContact CE1-CE1 3.9Å; F458-Y521 HydrophobicContact CE1-CE1 3.9Å; F458-Y521 HydrophobicContact CZ-CD1 4.12Å; F488-Y521 AromaticContact CD1-CE1 3.62Å; F488-Y521 HydrophobicContact CD1-CE1 3.62Å; F488-Y521 HydrophobicContact CE1-CD1 4.19Å; F488-Y521 AromaticContact CE1-CE1 3.48Å; F488-Y521 HydrophobicContact CE1-CE1 3.48Å; F488-Y521 VanDerWaalsContact CE1-CE1 3.48Å; F488-Y521 HydrophobicContact CG-CE1 4.37Å; F488-Y521 HydrophobicContact CZ-CE1 4.11Å; D498-Y521 WeakPolarHBondContact O-CE2 3.43Å; L500-Y521 HydrophobicContact CB-CD2 3.84Å; L500-Y521 HydrophobicContact CD1-CD2 4.43Å; L500-Y521 HydrophobicContact CG-CD2 4.08Å; I501-Y521 HydrophobicContact CD1-CD1 4.3Å; I501-Y521 HydrophobicContact CD1-CG 4.2Å; I501-Y521 HydrophobicContact CG1-CG 4.26Å; C517-Y521 PolarHBondContact O-N 3.5Å; V518-Y521 PolarHBondContact O-N 3.41Å; Y521-Q523 VanDerWaalsContact C-N 3.27Å; Y521-Q523 PolarHBondContact O-N 3.14Å; Y521-S524 CarbonylContact O-C 3.59Å; Y521-S524 WeakPolarHBondContact O-CA 3.25Å; Y521-S524 WeakPolarHBondContact O-CB 3.47Å; Y521-S524 PolarHBondContact O-N 3Å; Y521-L525 HydrophobicContact CD1-CD1 4.01Å; Y521-L525 HydrophobicContact CD1-CG 4.5Å; Y521-L525 HydrophobicContact CE1-CD1 3.67Å; Y521-L525 HydrophobicContact CE1-CD2 4.5Å; Y521-L525 HydrophobicContact CE1-CG 4.12Å; Y521-L525 HydrophobicContact CE2-CG 4.35Å; Y521-L525 PolarHBondContact O-N 2.92Å
522	V	97.4	Very high	95.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-31.4	174.5	177.3	0	0	0	0	111.6	L429 C433 F448 W452 F458 V518 F519 L525 Y526	L429-V522 HydrophobicContact CD1-CG1 4.31Å; L429-V522 HydrophobicContact CD2-CB 4.43Å; L429-V522 HydrophobicContact CD2-CG1 4.09Å; L429-V522 HydrophobicContact CG-CG1 4.13Å; C433-V522 WeakPolarHBondContact SG-CG1 3.39Å; F448-V522 HydrophobicContact CD1-CB 4.45Å; F448-V522 HydrophobicContact CE1-CB 4.26Å; F448-V522 HydrophobicContact CE1-CG1 3.98Å; W452-V522 HydrophobicContact CD2-CG2 4.29Å; W452-V522 HydrophobicContact CE3-CG2 4.04Å; W452-V522 HydrophobicContact CH2-CB 4.49Å; W452-V522 HydrophobicContact CH2-CG1 3.92Å; W452-V522 HydrophobicContact CH2-CG2 3.64Å; W452-V522 HydrophobicContact CZ2-CG1 4.18Å; W452-V522 HydrophobicContact CZ2-CG2 3.91Å; W452-V522 HydrophobicContact CZ3-CG2 3.71Å; F458-V522 HydrophobicContact CE1-CG2 3.76Å; F458-V522 HydrophobicContact CZ-CG2 4.35Å; V518-V522 HydrophobicContact CG1-CG2 4.11Å; V518-V522 WeakPolarHBondContact O-CB 3.42Å; V518-V522 VanDerWaalsContact O-CG2 3.24Å; V518-V522 WeakPolarHBondContact O-CG2 3.34Å; V518-V522 PolarHBondContact O-N 3.05Å; F519-V522 PolarHBondContact O-N 3.34Å; V522-L525 PolarHBondContact O-N 3.3Å; V522-Y526 WeakPolarHBondContact O-CB 3.44Å; V522-Y526 PolarHBondContact O-N 3.11Å
523	Q	96.4	Very high	94.6	Very high	76 Å²	76	55.8 Å²	55.8	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-36.1	170.5	-174	177.6	-3.8	0	0	111.8	L429 F519 T520 Y521 N527	L429-Q523 HydrophobicContact CD2-CB 4Å; F519-Q523 VanDerWaalsContact CE1-OE1 3.32Å; F519-Q523 VanDerWaalsContact O-CB 3.27Å; F519-Q523 WeakPolarHBondContact O-CB 3.47Å; F519-Q523 PolarHBondContact O-N 3.5Å; T520-Q523 PolarHBondContact O-N 2.92Å; Y521-Q523 VanDerWaalsContact C-N 3.27Å; Y521-Q523 PolarHBondContact O-N 3.14Å; Q523-N527 VanDerWaalsContact O-CG 3.3Å; Q523-N527 PolarHBondContact O-N 3.25Å; Q523-N527 VanDerWaalsContact O-N 3.16Å; Q523-N527 PolarHBondContact O-ND2 3.21Å
524	S	96.5	Very high	94.5	Very high	21 Å²	21	58.6 Å²	58.6	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-47.5	171.2	-164.3	0	0	0	0	111.7	T520 Y521 Y526 N527 H528	T520-S524 PolarHBondContact O-N 3.15Å; Y521-S524 CarbonylContact O-C 3.59Å; Y521-S524 WeakPolarHBondContact O-CA 3.25Å; Y521-S524 WeakPolarHBondContact O-CB 3.47Å; Y521-S524 PolarHBondContact O-N 3Å; S524-Y526 VanDerWaalsContact C-N 3.33Å; S524-Y526 PolarHBondContact O-N 3.49Å; S524-N527 PolarHBondContact O-N 2.62Å; S524-N527 VanDerWaalsContact O-N 3.11Å; S524-H528 PolarHBondContact O-N 3.01Å; S524-H528 PolarHBondContact O-ND1 3.04Å
525	L	96.9	Very high	94.4	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-56.3	-45.2	175.2	-73.7	170.7	0	0	0	111.3	F458 L461 A491 C497 Y521 V522 N527 H528 L529	F458-L525 HydrophobicContact CD1-CD1 3.83Å; F458-L525 HydrophobicContact CE1-CD1 3.99Å; L461-L525 HydrophobicContact CD2-CD1 4.39Å; A491-L525 HydrophobicContact CB-CD2 3.65Å; C497-L525 HydrophobicContact CB-CD2 4.31Å; Y521-L525 HydrophobicContact CD1-CD1 4.01Å; Y521-L525 HydrophobicContact CD1-CG 4.5Å; Y521-L525 HydrophobicContact CE1-CD1 3.67Å; Y521-L525 HydrophobicContact CE1-CD2 4.5Å; Y521-L525 HydrophobicContact CE1-CG 4.12Å; Y521-L525 HydrophobicContact CE2-CG 4.35Å; Y521-L525 PolarHBondContact O-N 2.92Å; V522-L525 PolarHBondContact O-N 3.3Å; L525-N527 PolarHBondContact O-N 2.92Å; L525-H528 PolarHBondContact O-N 2.69Å; L525-L529 HydrophobicContact CB-CD1 4.13Å; L525-L529 HydrophobicContact CD2-CD1 4.31Å; L525-L529 VanDerWaalsContact O-CB 3.27Å; L525-L529 WeakPolarHBondContact O-CB 3.35Å; L525-L529 VanDerWaalsContact O-CG 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.34Å; L525-L529 PolarHBondContact O-N 3.05Å
526	Y	96.3	Very high	94.4	Very high	61 Å²	61	57.4 Å²	57.4	24%	0.239	27%	0.273	C	S	.	.	H	α-helix	trans	-55.9	-47.6	174	170	-101.4	0	0	0	112.6	L429 W432 V522 S524 H528 R530	L429-Y526 VanDerWaalsContact CD1-CB 3.45Å; L429-Y526 HydrophobicContact CD1-CD1 4.38Å; L429-Y526 HydrophobicContact CD1-CD2 4.21Å; L429-Y526 HydrophobicContact CD1-CG 3.76Å; W432-Y526 AromaticContact CD1-CE2 3.93Å; W432-Y526 AromaticContact CD2-CD2 3.51Å; W432-Y526 HydrophobicContact CD2-CD2 3.51Å; W432-Y526 HydrophobicContact CD2-CE2 4.06Å; W432-Y526 AromaticContact CE2-CD2 3.53Å; W432-Y526 AromaticContact CE3-CD2 3.79Å; W432-Y526 HydrophobicContact CE3-CD2 3.79Å; W432-Y526 AromaticContact CG-CD2 3.93Å; W432-Y526 HydrophobicContact CG-CD2 3.93Å; W432-Y526 HydrophobicContact CG-CE2 4.02Å; W432-Y526 HydrophobicContact CH2-CD2 4.11Å; W432-Y526 AromaticContact CZ2-CD2 3.83Å; W432-Y526 HydrophobicContact CZ2-CD2 3.83Å; W432-Y526 HydrophobicContact CZ3-CD2 4.08Å; W432-Y526 AromaticContact NE1-CD2 3.92Å; W432-Y526 AromaticContact NE1-CE2 3.91Å; V522-Y526 WeakPolarHBondContact O-CB 3.44Å; V522-Y526 PolarHBondContact O-N 3.11Å; S524-Y526 VanDerWaalsContact C-N 3.33Å; S524-Y526 PolarHBondContact O-N 3.49Å; Y526-H528 PolarHBondContact O-N 2.69Å; Y526-R530 VanDerWaalsContact O-CB 3.25Å; Y526-R530 WeakPolarHBondContact O-CB 3.43Å; Y526-R530 WeakPolarHBondContact O-CD 3.49Å; Y526-R530 WeakPolarHBondContact O-CG 3.35Å; Y526-R530 PolarHBondContact O-N 2.59Å; Y526-R530 PolarHBondContact OH-NH1 3.48Å
527	N	95	Very high	94.3	Very high	73 Å²	73	55.1 Å²	55.1	39%	0.39	26%	0.261	S	S	.	.	H	α-helix	trans	-65.6	-25.8	-179.8	-71.7	-24.8	0	0	0	113.3	Q523 S524 L525 K531	Q523-N527 VanDerWaalsContact O-CG 3.3Å; Q523-N527 PolarHBondContact O-N 3.25Å; Q523-N527 VanDerWaalsContact O-N 3.16Å; Q523-N527 PolarHBondContact O-ND2 3.21Å; S524-N527 PolarHBondContact O-N 2.62Å; S524-N527 VanDerWaalsContact O-N 3.11Å; L525-N527 PolarHBondContact O-N 2.92Å; N527-K531 VanDerWaalsContact O-CE 3.26Å; N527-K531 WeakPolarHBondContact O-CE 3.41Å
528	H	95.7	Very high	94.2	Very high	37 Å²	37	55.5 Å²	55.5	17%	0.171	26%	0.257	C	S	.	.	H	α-helix	trans	-92.2	-51.4	179.5	-70.9	83.8	0	0	0	112.7	A495 G496 C497 S524 L525 Y526 R530 K531 F532	A495-H528 HydrophobicContact CB-CB 4.2Å; A495-H528 PolarHBondContact O-CD2 3.36Å; G496-H528 PolarHBondContact O-CD2 3.27Å; C497-H528 HydrophobicContact CB-CB 3.85Å; S524-H528 PolarHBondContact O-N 3.01Å; S524-H528 PolarHBondContact O-ND1 3.04Å; L525-H528 PolarHBondContact O-N 2.69Å; Y526-H528 PolarHBondContact O-N 2.69Å; H528-R530 VanDerWaalsContact C-N 3.34Å; H528-R530 PolarHBondContact O-N 2.7Å; H528-K531 PolarHBondContact CD2-NZ 2.87Å; H528-K531 PolarHBondContact NE2-NZ 3.17Å; H528-K531 VanDerWaalsContact O-CB 3.27Å; H528-K531 WeakPolarHBondContact O-CB 3.45Å; H528-K531 WeakPolarHBondContact O-CD 3.27Å; H528-K531 VanDerWaalsContact O-CG 3.3Å; H528-K531 WeakPolarHBondContact O-CG 3.47Å; H528-K531 PolarHBondContact O-N 2.91Å; H528-K531 VanDerWaalsContact O-N 3.15Å; H528-F532 WeakPolarHBondContact O-CD2 3.46Å; H528-F532 WeakPolarHBondContact O-CE2 3.41Å
529	L	93.3	Very high	94	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-34.2	-176.7	-65.2	173.4	0	0	0	112.5	W432 L461 F465 F466 A495 L525 K531 F532	W432-L529 HydrophobicContact CH2-CB 4.36Å; W432-L529 HydrophobicContact CH2-CD1 4.26Å; W432-L529 HydrophobicContact CZ2-CB 4.42Å; L461-L529 HydrophobicContact CD2-CD1 4.41Å; L461-L529 HydrophobicContact CG-CD1 4.06Å; F465-L529 HydrophobicContact CB-CD2 4.34Å; F465-L529 HydrophobicContact CD1-CB 4.32Å; F465-L529 WeakPolarHBondContact CD1-O 3.02Å; F465-L529 HydrophobicContact CD2-CB 3.85Å; F465-L529 HydrophobicContact CD2-CD1 3.94Å; F465-L529 HydrophobicContact CD2-CD2 3.98Å; F465-L529 HydrophobicContact CD2-CG 4.14Å; F465-L529 HydrophobicContact CE1-CB 4.14Å; F465-L529 WeakPolarHBondContact CE1-O 3.37Å; F465-L529 HydrophobicContact CE2-CB 3.68Å; F465-L529 HydrophobicContact CE2-CD1 3.94Å; F465-L529 HydrophobicContact CE2-CG 4.28Å; F465-L529 HydrophobicContact CG-CB 4.18Å; F465-L529 HydrophobicContact CG-CD2 4.19Å; F465-L529 HydrophobicContact CZ-CB 3.84Å; F466-L529 HydrophobicContact CD2-CD2 4.42Å; F466-L529 HydrophobicContact CE2-CD2 3.64Å; F466-L529 HydrophobicContact CZ-CD2 4.44Å; A495-L529 HydrophobicContact CB-CD2 3.87Å; L525-L529 HydrophobicContact CB-CD1 4.13Å; L525-L529 HydrophobicContact CD2-CD1 4.31Å; L525-L529 VanDerWaalsContact O-CB 3.27Å; L525-L529 WeakPolarHBondContact O-CB 3.35Å; L525-L529 VanDerWaalsContact O-CG 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.34Å; L525-L529 PolarHBondContact O-N 3.05Å; L529-K531 PolarHBondContact O-N 3.15Å; L529-F532 PolarHBondContact O-N 3.18Å
530	R	92	Very high	93.8	Very high	130 Å²	130	62.1 Å²	62.1	49%	0.491	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-1.7	175.5	83	-177.9	-149.5	151.8	12.7	114.9	Y526 H528 F532	Y526-R530 VanDerWaalsContact O-CB 3.25Å; Y526-R530 WeakPolarHBondContact O-CB 3.43Å; Y526-R530 WeakPolarHBondContact O-CD 3.49Å; Y526-R530 WeakPolarHBondContact O-CG 3.35Å; Y526-R530 PolarHBondContact O-N 2.59Å; Y526-R530 PolarHBondContact OH-NH1 3.48Å; H528-R530 VanDerWaalsContact C-N 3.34Å; H528-R530 PolarHBondContact O-N 2.7Å; R530-F532 VanDerWaalsContact C-N 3.3Å
531	K	91.6	Very high	93.6	Very high	133 Å²	133	61.5 Å²	61.5	58%	0.578	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.7	170.7	-56.9	169.1	-176.2	164.3	0	112.1	N527 H528 L529	N527-K531 VanDerWaalsContact O-CE 3.26Å; N527-K531 WeakPolarHBondContact O-CE 3.41Å; H528-K531 PolarHBondContact CD2-NZ 2.87Å; H528-K531 PolarHBondContact NE2-NZ 3.17Å; H528-K531 VanDerWaalsContact O-CB 3.27Å; H528-K531 WeakPolarHBondContact O-CB 3.45Å; H528-K531 WeakPolarHBondContact O-CD 3.27Å; H528-K531 VanDerWaalsContact O-CG 3.3Å; H528-K531 WeakPolarHBondContact O-CG 3.47Å; H528-K531 PolarHBondContact O-N 2.91Å; H528-K531 VanDerWaalsContact O-N 3.15Å; L529-K531 PolarHBondContact O-N 3.15Å
532	F	87.9	Confident	93.2	Very high	100 Å²	100	66.5 Å²	66.5	44%	0.439	30%	0.299	S	S	.	.			trans	-115.7	20.6	-179	-54	-93.6	0	0	0	111.2	F465 F466 K494 A495 H528 L529 R530	F465-F532 HydrophobicContact CD1-CB 4.29Å; F466-F532 AromaticContact CE1-CD1 3.96Å; F466-F532 HydrophobicContact CE1-CD1 3.96Å; F466-F532 HydrophobicContact CE1-CE1 4.24Å; F466-F532 HydrophobicContact CE1-CG 4.21Å; F466-F532 HydrophobicContact CZ-CD1 4.03Å; F466-F532 HydrophobicContact CZ-CD2 4.01Å; F466-F532 HydrophobicContact CZ-CE1 4.18Å; F466-F532 HydrophobicContact CZ-CE2 4.18Å; F466-F532 AromaticContact CZ-CG 3.94Å; F466-F532 HydrophobicContact CZ-CG 3.94Å; F466-F532 HydrophobicContact CZ-CZ 4.26Å; K494-F532 WeakPolarHBondContact O-CZ 2.79Å; A495-F532 HydrophobicContact CB-CE2 3.87Å; A495-F532 HydrophobicContact CB-CZ 4.47Å; H528-F532 WeakPolarHBondContact O-CD2 3.46Å; H528-F532 WeakPolarHBondContact O-CE2 3.41Å; L529-F532 PolarHBondContact O-N 3.18Å; R530-F532 VanDerWaalsContact C-N 3.3Å
533	E	79.9	Confident	92.9	Very high	166 Å²	166	72.5 Å²	72.5	78%	0.776	33%	0.326	S	S	*	.			trans	-113.4	0	173.8	169	160.8	-144.4	0	0	109.6	K436 F465	K436-E533 WeakPolarHBondContact CE-OE1 3.36Å; K436-E533 VanDerWaalsContact CE-OE2 3.32Å; K436-E533 WeakPolarHBondContact CE-OE2 3.49Å; K436-E533 IonicContact NZ-OE1 3.6Å; K436-E533 PolarHBondContact NZ-OE1 2.99Å; K436-E533 IonicContact NZ-OE2 3.94Å; K436-E533 PolarHBondContact NZ-OE2 3.35Å; K436-E533 VanDerWaalsContact NZ-OE2 3.11Å; F465-E533 HydrophobicContact CE1-CB 4.23Å

Retrieved 533 of 533 residues in 472.5 ms (Link to these results)

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