A0A674F3Y6_SALTR Loading...

SRY-box transcription factor 21b

AlphaFold DB , UniProt , Accession A0A674F3Y6, Species SALTR (Salmo trutta, Brown trout), Gene SOX21, Length 243 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	47.2	Very low	77.8	Confident	248 Å²	248	139.5 Å²	139.5	100%	1.222	70%	0.702	S	S	*	*				0	97.4	0	-69.9	138.1	178.8	0	0	108.5
2	S	58.1	Low	79.5	Confident	115 Å²	115	132.8 Å²	132.8	80%	0.804	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-60.2	139	170.3	35.9	0	0	0	0	109.1
3	K	64.4	Low	80.9	Confident	190 Å²	190	129.3 Å²	129.3	83%	0.826	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-62.4	134.7	172.7	-73.4	170.3	-178.5	158.7	0	107.5	M5	K3-M5 PolarHBondContact O-N 3.07Å; K3-M5 VanDerWaalsContact O-N 3.14Å
4	P	62.4	Low	82.1	Confident	101 Å²	101	121.3 Å²	121.3	66%	0.656	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-56.9	123.9	172.5	23.3	-31	0	0	0	108.1	D6 H7	P4-D6 PolarHBondContact O-N 3.17Å; P4-D6 VanDerWaalsContact O-N 3.14Å; P4-H7 PolarHBondContact O-N 3.45Å
5	M	69.1	Low	83.2	Confident	186 Å²	186	116.3 Å²	116.3	92%	0.916	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-17.3	-176	-71.1	-77.6	-169.6	0	0	112.1	K3 H7	K3-M5 PolarHBondContact O-N 3.07Å; K3-M5 VanDerWaalsContact O-N 3.14Å; M5-H7 PolarHBondContact O-N 3.11Å
6	D	84.3	Confident	84.1	Confident	151 Å²	151	114.3 Å²	114.3	81%	0.807	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	2.9	-173.9	-54.4	-37.6	0	0	0	114.7	P4 V8	P4-D6 PolarHBondContact O-N 3.17Å; P4-D6 VanDerWaalsContact O-N 3.14Å; D6-V8 PolarHBondContact O-N 2.86Å; D6-V8 VanDerWaalsContact O-N 3.08Å
7	H	88.8	Confident	84.9	Confident	140 Å²	140	109 Å²	109	65%	0.648	55%	0.552	S	S	*	*			trans	-75.3	103.5	176	-178.1	55.5	0	0	0	111.8	P4 M5 K9	P4-H7 PolarHBondContact O-N 3.45Å; M5-H7 PolarHBondContact O-N 3.11Å; H7-K9 PolarHBondContact O-N 3.46Å
8	V	93	Very high	85.7	Confident	45 Å²	45	103.6 Å²	103.6	27%	0.273	52%	0.524	S	S	.	.			trans	-63.6	114.6	172	-178.6	0	0	0	0	110.6	D6 H68 H72 Y75	D6-V8 PolarHBondContact O-N 2.86Å; D6-V8 VanDerWaalsContact O-N 3.08Å; V8-H68 WeakPolarHBondContact CG1-CE1 3.23Å; V8-H72 HydrophobicContact CG1-CB 4.44Å; V8-Y75 HydrophobicContact CB-CD2 3.99Å; V8-Y75 HydrophobicContact CB-CE2 4.13Å; V8-Y75 HydrophobicContact CG1-CD2 3.53Å; V8-Y75 HydrophobicContact CG1-CE2 3.78Å
9	K	94.4	Very high	86.3	Confident	168 Å²	168	98.2 Å²	98.2	73%	0.73	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-74	152.1	177.4	-69	-179.2	-177.9	169.7	0	110.8	H7 H68	H7-K9 PolarHBondContact O-N 3.46Å; K9-H68 PolarHBondContact O-CE1 3.4Å; K9-H68 PolarHBondContact O-NE2 3.02Å
10	R	96.8	Very high	86.8	Confident	148 Å²	148	101 Å²	101	56%	0.558	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-62.9	147	173.3	-59.1	175.2	-160.4	-155.3	15	110.9	Y75 Y77	R10-Y75 VanDerWaalsContact CG-OH 3.25Å; R10-Y75 WeakPolarHBondContact CG-OH 3.17Å; R10-Y77 VanDerWaalsContact CZ-OH 3.3Å; R10-Y77 VanDerWaalsContact NH1-CE2 3.28Å; R10-Y77 PolarHBondContact NH1-OH 3.01Å; R10-Y77 PolarHBondContact NH2-OH 3.32Å
11	P	97.3	Very high	87.3	Confident	43 Å²	43	98.3 Å²	98.3	28%	0.279	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-64.7	148	168.3	28.4	-32.2	0	0	0	109.9	H68	P11-H68 HydrophobicContact CB-CB 4.02Å; P11-H68 HydrophobicContact CG-CB 4.23Å
12	M	97.9	Very high	89.7	Confident	58 Å²	58	89.2 Å²	89.2	29%	0.286	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-71.1	135.3	178.6	-68.6	-174.6	-65.5	0	0	110.4	M16 V17 L64	M12-M16 HydrophobicContact CB-CB 3.95Å; M12-M16 HydrophobicContact CG-CB 4.23Å; M12-V17 HydrophobicContact CB-CG2 3.8Å; M12-V17 HydrophobicContact CE-CG2 4.41Å; M12-L64 HydrophobicContact CB-CD1 4.34Å; M12-L64 HydrophobicContact CE-CD1 4.01Å
13	N	98.3	Very high	91.5	Very high	88 Å²	88	86.6 Å²	86.6	47%	0.471	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-77.9	172.3	168.5	71.2	23.1	0	0	0	110.9	F15 M16 V17	N13-F15 PolarHBondContact O-N 3.36Å; N13-F15 PolarHBondContact OD1-N 2.89Å; N13-M16 PolarHBondContact O-N 2.97Å; N13-M16 WeakPolarHBondContact OD1-CB 3.5Å; N13-M16 WeakPolarHBondContact OD1-CG 2.9Å; N13-M16 PolarHBondContact OD1-N 3.12Å; N13-V17 WeakPolarHBondContact O-CG2 3.34Å; N13-V17 PolarHBondContact O-N 3.24Å
14	A	97.8	Very high	93.1	Very high	17 Å²	17	85.9 Å²	85.9	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-53.9	-48.2	-176.4	0	0	0	0	0	113.2	M16 V17 W18 W46 I58 A61	A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 3.41Å; A14-V17 PolarHBondContact O-N 3.08Å; A14-W18 PolarHBondContact O-N 3.31Å; A14-W46 HydrophobicContact CB-CH2 4.18Å; A14-W46 HydrophobicContact CB-CZ2 4.12Å; A14-I58 HydrophobicContact CB-CB 4.47Å; A14-I58 HydrophobicContact CB-CG1 3.84Å; A14-A61 HydrophobicContact CB-CB 4.13Å; A14-A61 VanDerWaalsContact N-CB 3.3Å
15	F	98.1	Very high	94.7	Very high	46 Å²	46	86.7 Å²	86.7	20%	0.202	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-39.2	176.7	171.4	-102	0	0	0	112.5	N13 W18 S19 W46	N13-F15 PolarHBondContact O-N 3.36Å; N13-F15 PolarHBondContact OD1-N 2.89Å; F15-W18 AromaticContact CD2-CE3 3.96Å; F15-W18 HydrophobicContact CD2-CE3 3.96Å; F15-W18 HydrophobicContact CD2-CZ3 4.14Å; F15-W18 HydrophobicContact CE2-CE3 4.06Å; F15-W18 AromaticContact CE2-CZ3 3.82Å; F15-W18 HydrophobicContact CE2-CZ3 3.82Å; F15-S19 WeakPolarHBondContact O-CB 3.3Å; F15-S19 PolarHBondContact O-N 3.44Å; F15-S19 PolarHBondContact O-OG 2.95Å; F15-W46 HydrophobicContact CB-CD2 4.42Å; F15-W46 HydrophobicContact CD2-CB 3.73Å; F15-W46 AromaticContact CD2-CD1 3.89Å; F15-W46 AromaticContact CD2-CD2 3.91Å; F15-W46 HydrophobicContact CD2-CD2 3.91Å; F15-W46 HydrophobicContact CD2-CE3 4.49Å; F15-W46 AromaticContact CD2-CG 3.54Å; F15-W46 HydrophobicContact CD2-CG 3.54Å; F15-W46 HydrophobicContact CE2-CB 3.89Å; F15-W46 HydrophobicContact CE2-CG 4.2Å
16	M	98.1	Very high	95.9	Very high	84 Å²	84	78.6 Å²	78.6	41%	0.414	37%	0.367	S	S	.	.	H	α-helix	trans	-69.6	-34.5	178.9	-69.8	-64.6	173.2	0	0	112	M12 N13 A14 R20	M12-M16 HydrophobicContact CB-CB 3.95Å; M12-M16 HydrophobicContact CG-CB 4.23Å; N13-M16 PolarHBondContact O-N 2.97Å; N13-M16 WeakPolarHBondContact OD1-CB 3.5Å; N13-M16 WeakPolarHBondContact OD1-CG 2.9Å; N13-M16 PolarHBondContact OD1-N 3.12Å; A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 3.41Å; M16-R20 PolarHBondContact O-N 3.19Å
17	V	98	Very high	96.5	Very high	25 Å²	25	73.4 Å²	73.4	15%	0.152	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-53.1	172.7	176.5	0	0	0	0	110	M12 N13 A14 R20 F57 E60 A61 L64	M12-V17 HydrophobicContact CB-CG2 3.8Å; M12-V17 HydrophobicContact CE-CG2 4.41Å; N13-V17 WeakPolarHBondContact O-CG2 3.34Å; N13-V17 PolarHBondContact O-N 3.24Å; A14-V17 PolarHBondContact O-N 3.08Å; V17-R20 PolarHBondContact O-N 3.45Å; V17-F57 HydrophobicContact CG1-CD1 4.19Å; V17-E60 HydrophobicContact CG1-CB 4.34Å; V17-E60 HydrophobicContact CG1-CG 3.82Å; V17-A61 HydrophobicContact CG2-CB 4.38Å; V17-L64 HydrophobicContact CG2-CD1 3.7Å
18	W	97.9	Very high	96.8	Very high	12 Å²	12	74.2 Å²	74.2	5%	0.045	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-50.8	-180	171.8	81.8	0	0	0	112.7	A14 F15 R20 A21 Q22 L42 E45 W46 L49 F57	A14-W18 PolarHBondContact O-N 3.31Å; F15-W18 AromaticContact CD2-CE3 3.96Å; F15-W18 HydrophobicContact CD2-CE3 3.96Å; F15-W18 HydrophobicContact CD2-CZ3 4.14Å; F15-W18 HydrophobicContact CE2-CE3 4.06Å; F15-W18 AromaticContact CE2-CZ3 3.82Å; F15-W18 HydrophobicContact CE2-CZ3 3.82Å; W18-R20 PolarHBondContact O-N 2.86Å; W18-R20 VanDerWaalsContact O-N 3.11Å; W18-A21 PolarHBondContact O-N 3.21Å; W18-Q22 HydrophobicContact CD2-CG 4.07Å; W18-Q22 HydrophobicContact CH2-CG 4.29Å; W18-Q22 HydrophobicContact CZ2-CG 3.72Å; W18-Q22 PolarHBondContact O-N 2.82Å; W18-L42 HydrophobicContact CH2-CB 4.31Å; W18-L42 HydrophobicContact CH2-CD2 3.92Å; W18-L42 WeakPolarHBondContact CH2-O 3.46Å; W18-L42 HydrophobicContact CZ3-CB 4Å; W18-L42 HydrophobicContact CZ3-CD2 4.19Å; W18-L42 VanDerWaalsContact CZ3-O 3.26Å; W18-L42 WeakPolarHBondContact CZ3-O 3.47Å; W18-E45 HydrophobicContact CH2-CB 3.85Å; W18-E45 HydrophobicContact CZ2-CB 4.34Å; W18-W46 HydrophobicContact CB-CE3 4.13Å; W18-W46 HydrophobicContact CB-CH2 4.47Å; W18-W46 HydrophobicContact CB-CZ3 3.66Å; W18-W46 AromaticContact CD2-CE3 3.51Å; W18-W46 HydrophobicContact CD2-CE3 3.51Å; W18-W46 AromaticContact CD2-CZ3 3.9Å; W18-W46 HydrophobicContact CD2-CZ3 3.9Å; W18-W46 HydrophobicContact CE3-CB 4.23Å; W18-W46 HydrophobicContact CE3-CD2 4.25Å; W18-W46 AromaticContact CE3-CE3 3.55Å; W18-W46 HydrophobicContact CE3-CE3 3.55Å; W18-W46 HydrophobicContact CE3-CZ3 4.28Å; W18-W46 AromaticContact CG-CE3 3.78Å; W18-W46 HydrophobicContact CG-CE3 3.78Å; W18-W46 AromaticContact CG-CZ3 3.62Å; W18-W46 HydrophobicContact CG-CZ3 3.62Å; W18-W46 HydrophobicContact CH2-CB 4.17Å; W18-W46 HydrophobicContact CZ3-CB 3.76Å; W18-W46 HydrophobicContact CZ3-CE3 4.19Å; W18-L49 HydrophobicContact CZ2-CD1 4.03Å; W18-L49 HydrophobicContact CZ2-CD2 4.28Å; W18-F57 HydrophobicContact CB-CB 4.28Å; W18-F57 HydrophobicContact CB-CD1 3.82Å; W18-F57 HydrophobicContact CB-CD2 4.18Å; W18-F57 HydrophobicContact CB-CE1 4.22Å; W18-F57 HydrophobicContact CB-CG 3.81Å; W18-F57 AromaticContact CD1-CD2 3.87Å; W18-F57 AromaticContact CD1-CE1 3.98Å; W18-F57 AromaticContact CD1-CE2 3.51Å; W18-F57 AromaticContact CD1-CZ 3.58Å; W18-F57 HydrophobicContact CG-CD2 4.34Å; W18-F57 HydrophobicContact CG-CE2 4.37Å; W18-F57 HydrophobicContact CG-CG 4.43Å; W18-F57 HydrophobicContact CG-CZ 4.48Å
19	S	97.7	Very high	96.9	Very high	0 Å²	0	77.6 Å²	77.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-18.4	-175.8	66.1	0	0	0	0	113.2	F15 R23	F15-S19 WeakPolarHBondContact O-CB 3.3Å; F15-S19 PolarHBondContact O-N 3.44Å; F15-S19 PolarHBondContact O-OG 2.95Å; S19-R23 WeakPolarHBondContact O-CB 3.45Å; S19-R23 PolarHBondContact O-N 3.49Å; S19-R23 PolarHBondContact O-NH1 3.25Å
20	R	97.2	Very high	96.7	Very high	155 Å²	155	72.7 Å²	72.7	59%	0.585	34%	0.344	S	S	*	.	H	α-helix	trans	-62.2	-47.7	175.5	178.7	178.8	-98.7	-174.7	-5.7	111.5	M16 V17 W18 R24	M16-R20 PolarHBondContact O-N 3.19Å; V17-R20 PolarHBondContact O-N 3.45Å; W18-R20 PolarHBondContact O-N 2.86Å; W18-R20 VanDerWaalsContact O-N 3.11Å; R20-R24 PolarHBondContact O-N 2.8Å
21	A	96.4	Very high	96.4	Very high	45 Å²	45	70.9 Å²	70.9	37%	0.372	35%	0.351	S	S	.	.	H	α-helix	trans	-70.5	-45.5	178.9	0	0	0	0	0	111.1	W18 R24 K25	W18-A21 PolarHBondContact O-N 3.21Å; A21-R24 PolarHBondContact O-N 3.18Å; A21-K25 PolarHBondContact O-N 2.73Å; A21-K25 VanDerWaalsContact O-N 3.08Å
22	Q	97.1	Very high	96.2	Very high	56 Å²	56	78.9 Å²	78.9	26%	0.262	38%	0.381	S	S	.	.	H	α-helix	trans	-66.9	-41	-177.6	-59.8	-55.6	-26.6	0	0	112.9	W18 R24 K25 M26 L42	W18-Q22 HydrophobicContact CD2-CG 4.07Å; W18-Q22 HydrophobicContact CH2-CG 4.29Å; W18-Q22 HydrophobicContact CZ2-CG 3.72Å; W18-Q22 PolarHBondContact O-N 2.82Å; Q22-R24 VanDerWaalsContact C-N 3.27Å; Q22-R24 PolarHBondContact O-N 3.11Å; Q22-K25 WeakPolarHBondContact O-CB 3.21Å; Q22-K25 PolarHBondContact O-N 3.39Å; Q22-M26 WeakPolarHBondContact O-CG 3.48Å; Q22-M26 PolarHBondContact O-N 3.33Å; Q22-L42 HydrophobicContact CB-CD1 4.39Å; Q22-L42 HydrophobicContact CB-CD2 3.4Å; Q22-L42 HydrophobicContact CG-CD2 4.39Å
23	R	97.3	Very high	96	Very high	61 Å²	61	77.9 Å²	77.9	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-58.5	-39.8	174.4	-178.2	-172	-72.8	108.3	1.1	111.8	S19 A27 N35 I38 L42	S19-R23 WeakPolarHBondContact O-CB 3.45Å; S19-R23 PolarHBondContact O-N 3.49Å; S19-R23 PolarHBondContact O-NH1 3.25Å; R23-A27 WeakPolarHBondContact O-CB 3.34Å; R23-A27 PolarHBondContact O-N 3.1Å; R23-N35 WeakPolarHBondContact CD-ND2 3.28Å; R23-I38 HydrophobicContact CB-CG2 4.3Å; R23-I38 HydrophobicContact CG-CG2 3.96Å; R23-L42 HydrophobicContact CB-CD1 3.72Å
24	R	96.9	Very high	95.9	Very high	175 Å²	175	80.3 Å²	80.3	66%	0.66	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-44.1	177.2	-178.1	174.2	61.1	-142.6	-1	111.1	R20 A21 Q22 A27 Q28	R20-R24 PolarHBondContact O-N 2.8Å; A21-R24 PolarHBondContact O-N 3.18Å; Q22-R24 VanDerWaalsContact C-N 3.27Å; Q22-R24 PolarHBondContact O-N 3.11Å; R24-A27 PolarHBondContact O-N 2.94Å; R24-Q28 PolarHBondContact O-N 2.97Å
25	K	96.7	Very high	95.7	Very high	117 Å²	117	83.1 Å²	83.1	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-58.8	-53	175.6	-178	-179.5	172.1	-175.5	0	111.4	A21 Q22 A27 Q28 E29	A21-K25 PolarHBondContact O-N 2.73Å; A21-K25 VanDerWaalsContact O-N 3.08Å; Q22-K25 WeakPolarHBondContact O-CB 3.21Å; Q22-K25 PolarHBondContact O-N 3.39Å; K25-A27 VanDerWaalsContact C-N 3.33Å; K25-A27 PolarHBondContact O-N 3.4Å; K25-Q28 WeakPolarHBondContact O-CB 3.41Å; K25-Q28 PolarHBondContact O-N 3.29Å; K25-Q28 VanDerWaalsContact O-N 3.11Å; K25-E29 WeakPolarHBondContact CE-OE1 3.02Å; K25-E29 WeakPolarHBondContact CG-OE1 3.25Å; K25-E29 WeakPolarHBondContact O-CG 3.44Å; K25-E29 PolarHBondContact O-N 3.02Å
26	M	94.9	Very high	95.6	Very high	16 Å²	16	83.9 Å²	83.9	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-37.2	179.6	-68.8	-173.8	76.5	0	0	113.3	Q22 Q28 E29 N30 I38 R41 L42	Q22-M26 WeakPolarHBondContact O-CG 3.48Å; Q22-M26 PolarHBondContact O-N 3.33Å; M26-Q28 VanDerWaalsContact C-N 3.31Å; M26-E29 PolarHBondContact O-N 3.29Å; M26-N30 WeakPolarHBondContact O-CB 2.97Å; M26-N30 PolarHBondContact O-N 3.11Å; M26-I38 HydrophobicContact CB-CG2 3.98Å; M26-I38 HydrophobicContact CE-CG2 4.5Å; M26-I38 HydrophobicContact SD-CG2 3.89Å; M26-R41 HydrophobicContact CE-CB 3.94Å; M26-R41 HydrophobicContact CE-CG 4.49Å; M26-L42 HydrophobicContact SD-CD2 3.48Å; M26-L42 WeakPolarHBondContact SD-CD2 3.45Å; M26-L42 HydrophobicContact SD-CG 3.78Å
27	A	95.6	Very high	95.6	Very high	42 Å²	42	82.9 Å²	82.9	35%	0.347	40%	0.403	S	S	.	.	H	α-helix	trans	-67.6	-32.4	176.7	0	0	0	0	0	112.3	R23 R24 K25 N30 P31 I38	R23-A27 WeakPolarHBondContact O-CB 3.34Å; R23-A27 PolarHBondContact O-N 3.1Å; R24-A27 PolarHBondContact O-N 2.94Å; K25-A27 VanDerWaalsContact C-N 3.33Å; K25-A27 PolarHBondContact O-N 3.4Å; A27-N30 CarbonylContact O-C 3.45Å; A27-P31 VanDerWaalsContact O-CA 3.3Å; A27-P31 WeakPolarHBondContact O-CA 3.41Å; A27-I38 HydrophobicContact CB-CD1 4.08Å
28	Q	95.9	Very high	95.5	Very high	158 Å²	158	81.9 Å²	81.9	74%	0.738	40%	0.396	S	S	*	.	H	α-helix	trans	-72.3	-41.4	175.4	-170.4	63.7	38.5	0	0	111.7	R24 K25 M26	R24-Q28 PolarHBondContact O-N 2.97Å; K25-Q28 WeakPolarHBondContact O-CB 3.41Å; K25-Q28 PolarHBondContact O-N 3.29Å; K25-Q28 VanDerWaalsContact O-N 3.11Å; M26-Q28 VanDerWaalsContact C-N 3.31Å
29	E	94.1	Very high	95.5	Very high	115 Å²	115	83.2 Å²	83.2	54%	0.537	41%	0.408	S	S	.	.	H	α-helix	trans	-70.6	-33.4	177.4	-68.8	168.9	-177	0	0	112	K25 M26	K25-E29 WeakPolarHBondContact CE-OE1 3.02Å; K25-E29 WeakPolarHBondContact CG-OE1 3.25Å; K25-E29 WeakPolarHBondContact O-CG 3.44Å; K25-E29 PolarHBondContact O-N 3.02Å; M26-E29 PolarHBondContact O-N 3.29Å
30	N	90.1	Very high	95.5	Very high	66 Å²	66	89.6 Å²	89.6	35%	0.353	44%	0.435	S	S	.	.			trans	-130.4	72.6	-176.7	-63.8	-92.8	0	0	0	111.2	M26 A27 K32 M33	M26-N30 WeakPolarHBondContact O-CB 2.97Å; M26-N30 PolarHBondContact O-N 3.11Å; A27-N30 CarbonylContact O-C 3.45Å; N30-K32 PolarHBondContact O-N 3.16Å; N30-K32 VanDerWaalsContact O-N 3.12Å; N30-M33 HydrophobicContact CB-CB 3.76Å; N30-M33 HydrophobicContact CB-CE 3.87Å; N30-M33 WeakPolarHBondContact O-CB 3.26Å; N30-M33 PolarHBondContact O-N 3.22Å
31	P	91.6	Very high	95.5	Very high	110 Å²	110	87.6 Å²	87.6	71%	0.714	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.1	-175.2	25	-34.5	0	0	0	113.9	A27	A27-P31 VanDerWaalsContact O-CA 3.3Å; A27-P31 WeakPolarHBondContact O-CA 3.41Å
32	K	93.2	Very high	95.5	Very high	210 Å²	210	85.5 Å²	85.5	91%	0.913	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.9	174.6	-65.1	-177.7	179.7	178.3	0	113.4	N30	N30-K32 PolarHBondContact O-N 3.16Å; N30-K32 VanDerWaalsContact O-N 3.12Å
33	M	93.5	Very high	95.6	Very high	38 Å²	38	83.9 Å²	83.9	19%	0.187	41%	0.409	C	S	.	.	S	Bend	trans	-78.4	128.2	-177.1	-171	-179.6	-63.4	0	0	110.8	N30 E37 I38	N30-M33 HydrophobicContact CB-CB 3.76Å; N30-M33 HydrophobicContact CB-CE 3.87Å; N30-M33 WeakPolarHBondContact O-CB 3.26Å; N30-M33 PolarHBondContact O-N 3.22Å; M33-E37 HydrophobicContact CG-CB 4.09Å; M33-E37 HydrophobicContact CG-CG 4.24Å; M33-E37 HydrophobicContact SD-CG 4.29Å; M33-I38 HydrophobicContact CB-CG1 4.34Å; M33-I38 HydrophobicContact CG-CG1 3.85Å; M33-I38 HydrophobicContact SD-CG1 3.62Å
34	H	95.7	Very high	95.6	Very high	139 Å²	139	83.5 Å²	83.5	64%	0.644	42%	0.419	S	S	*	.			trans	-71.9	146.9	179	-165.5	55.1	0	0	0	111.9	S36 E37 I38	H34-S36 PolarHBondContact CD2-OG 2.91Å; H34-S36 PolarHBondContact O-N 3.33Å; H34-E37 WeakPolarHBondContact O-CB 3.5Å; H34-E37 PolarHBondContact O-N 3.44Å; H34-I38 PolarHBondContact O-N 3.14Å
35	N	94.1	Very high	95.6	Very high	76 Å²	76	78.8 Å²	78.8	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-61.2	-30.1	-174.5	-165.8	-86	0	0	0	113.9	R23 E37 I38 S39	R23-N35 WeakPolarHBondContact CD-ND2 3.28Å; N35-E37 VanDerWaalsContact C-N 3.26Å; N35-E37 PolarHBondContact O-N 2.89Å; N35-I38 PolarHBondContact O-N 3.14Å; N35-S39 WeakPolarHBondContact O-CB 3.42Å; N35-S39 PolarHBondContact O-N 2.91Å; N35-S39 PolarHBondContact O-OG 3.16Å; N35-S39 PolarHBondContact OD1-OG 3.32Å
36	S	96.3	Very high	95.7	Very high	62 Å²	62	75.2 Å²	75.2	43%	0.434	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-40.8	175.1	64.7	0	0	0	0	111.1	H34 S39 K40	H34-S36 PolarHBondContact CD2-OG 2.91Å; H34-S36 PolarHBondContact O-N 3.33Å; S36-S39 PolarHBondContact O-N 3.01Å; S36-K40 WeakPolarHBondContact O-CG 3.44Å; S36-K40 PolarHBondContact O-N 3.12Å; S36-K40 VanDerWaalsContact O-N 3.14Å
37	E	96.8	Very high	95.8	Very high	62 Å²	62	82.6 Å²	82.6	29%	0.29	42%	0.419	S	S	.	.	H	α-helix	trans	-73.2	-42.8	179.8	-169.1	55.2	-150.2	0	0	111.5	M33 H34 N35 S39 K40 R41	M33-E37 HydrophobicContact CG-CB 4.09Å; M33-E37 HydrophobicContact CG-CG 4.24Å; M33-E37 HydrophobicContact SD-CG 4.29Å; H34-E37 WeakPolarHBondContact O-CB 3.5Å; H34-E37 PolarHBondContact O-N 3.44Å; N35-E37 VanDerWaalsContact C-N 3.26Å; N35-E37 PolarHBondContact O-N 2.89Å; E37-S39 VanDerWaalsContact C-N 3.25Å; E37-S39 PolarHBondContact O-N 2.87Å; E37-K40 WeakPolarHBondContact O-CB 3.36Å; E37-K40 PolarHBondContact O-N 3.41Å; E37-K40 VanDerWaalsContact O-N 3.14Å; E37-K40 IonicContact OE2-NZ 3.28Å; E37-K40 PolarHBondContact OE2-NZ 3.43Å; E37-R41 PolarHBondContact O-N 3.49Å; E37-R41 VanDerWaalsContact O-N 3.11Å; E37-R41 IonicContact OE1-NE 3.7Å
38	I	96.6	Very high	95.9	Very high	4 Å²	4	87.7 Å²	87.7	2%	0.021	44%	0.44	C	S	.	.	H	α-helix	trans	-55.2	-45.6	172.1	-61.8	174.3	0	0	0	110.1	R23 M26 A27 M33 H34 N35 K40 R41 L42	R23-I38 HydrophobicContact CB-CG2 4.3Å; R23-I38 HydrophobicContact CG-CG2 3.96Å; M26-I38 HydrophobicContact CB-CG2 3.98Å; M26-I38 HydrophobicContact CE-CG2 4.5Å; M26-I38 HydrophobicContact SD-CG2 3.89Å; A27-I38 HydrophobicContact CB-CD1 4.08Å; M33-I38 HydrophobicContact CB-CG1 4.34Å; M33-I38 HydrophobicContact CG-CG1 3.85Å; M33-I38 HydrophobicContact SD-CG1 3.62Å; H34-I38 PolarHBondContact O-N 3.14Å; N35-I38 PolarHBondContact O-N 3.14Å; I38-K40 VanDerWaalsContact C-N 3.33Å; I38-K40 PolarHBondContact O-N 2.82Å; I38-R41 PolarHBondContact O-N 2.99Å; I38-L42 HydrophobicContact CG2-CD1 3.83Å; I38-L42 HydrophobicContact CG2-CG 4.2Å; I38-L42 WeakPolarHBondContact O-CB 3.33Å; I38-L42 VanDerWaalsContact O-CG 3.28Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 3.24Å
39	S	97.1	Very high	95.9	Very high	40 Å²	40	81.8 Å²	81.8	28%	0.28	41%	0.413	S	S	.	.	H	α-helix	trans	-65.7	-33.8	-179	-62.1	0	0	0	0	112.9	N35 S36 E37 G43	N35-S39 WeakPolarHBondContact O-CB 3.42Å; N35-S39 PolarHBondContact O-N 2.91Å; N35-S39 PolarHBondContact O-OG 3.16Å; N35-S39 PolarHBondContact OD1-OG 3.32Å; S36-S39 PolarHBondContact O-N 3.01Å; E37-S39 VanDerWaalsContact C-N 3.25Å; E37-S39 PolarHBondContact O-N 2.87Å; S39-G43 PolarHBondContact O-N 3.05Å; S39-G43 VanDerWaalsContact O-N 3.1Å
40	K	97.7	Very high	96.1	Very high	134 Å²	134	79.6 Å²	79.6	58%	0.583	41%	0.408	S	S	*	.	H	α-helix	trans	-64.3	-48.2	173.3	-70.2	179.6	-151	156.3	0	111.4	S36 E37 I38 G43 A44	S36-K40 WeakPolarHBondContact O-CG 3.44Å; S36-K40 PolarHBondContact O-N 3.12Å; S36-K40 VanDerWaalsContact O-N 3.14Å; E37-K40 WeakPolarHBondContact O-CB 3.36Å; E37-K40 PolarHBondContact O-N 3.41Å; E37-K40 VanDerWaalsContact O-N 3.14Å; E37-K40 IonicContact OE2-NZ 3.28Å; E37-K40 PolarHBondContact OE2-NZ 3.43Å; I38-K40 VanDerWaalsContact C-N 3.33Å; I38-K40 PolarHBondContact O-N 2.82Å; K40-G43 PolarHBondContact O-N 3.44Å; K40-A44 PolarHBondContact O-N 3.31Å; K40-A44 VanDerWaalsContact O-N 3.16Å
41	R	97.1	Very high	96.4	Very high	114 Å²	114	81.8 Å²	81.8	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-46.7	-179.6	-66.4	-177.3	-173.8	-161.4	3.4	111.9	M26 E37 I38 G43 A44 E45	M26-R41 HydrophobicContact CE-CB 3.94Å; M26-R41 HydrophobicContact CE-CG 4.49Å; E37-R41 PolarHBondContact O-N 3.49Å; E37-R41 VanDerWaalsContact O-N 3.11Å; E37-R41 IonicContact OE1-NE 3.7Å; I38-R41 PolarHBondContact O-N 2.99Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 2.7Å; R41-A44 WeakPolarHBondContact O-CB 3.5Å; R41-A44 PolarHBondContact O-N 2.8Å; R41-E45 PolarHBondContact O-N 2.99Å
42	L	97.7	Very high	96.7	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-59.9	-36.4	175.2	-68.4	179.1	0	0	0	112.7	W18 Q22 R23 M26 I38 A44 W46	W18-L42 HydrophobicContact CH2-CB 4.31Å; W18-L42 HydrophobicContact CH2-CD2 3.92Å; W18-L42 WeakPolarHBondContact CH2-O 3.46Å; W18-L42 HydrophobicContact CZ3-CB 4Å; W18-L42 HydrophobicContact CZ3-CD2 4.19Å; W18-L42 VanDerWaalsContact CZ3-O 3.26Å; W18-L42 WeakPolarHBondContact CZ3-O 3.47Å; Q22-L42 HydrophobicContact CB-CD1 4.39Å; Q22-L42 HydrophobicContact CB-CD2 3.4Å; Q22-L42 HydrophobicContact CG-CD2 4.39Å; R23-L42 HydrophobicContact CB-CD1 3.72Å; M26-L42 HydrophobicContact SD-CD2 3.48Å; M26-L42 WeakPolarHBondContact SD-CD2 3.45Å; M26-L42 HydrophobicContact SD-CG 3.78Å; I38-L42 HydrophobicContact CG2-CD1 3.83Å; I38-L42 HydrophobicContact CG2-CG 4.2Å; I38-L42 WeakPolarHBondContact O-CB 3.33Å; I38-L42 VanDerWaalsContact O-CG 3.28Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 3.24Å; L42-A44 VanDerWaalsContact C-N 3.3Å; L42-A44 PolarHBondContact O-N 3.28Å; L42-W46 WeakPolarHBondContact O-CB 3.43Å; L42-W46 PolarHBondContact O-N 2.99Å
43	G	97.9	Very high	96.8	Very high	23 Å²	23	75.2 Å²	75.2	24%	0.237	39%	0.388	C	S	.	.	H	α-helix	trans	-64.6	-34.5	175	0	0	0	0	0	113.1	S39 K40 R41 K47	S39-G43 PolarHBondContact O-N 3.05Å; S39-G43 VanDerWaalsContact O-N 3.1Å; K40-G43 PolarHBondContact O-N 3.44Å; R41-G43 VanDerWaalsContact C-N 3.26Å; R41-G43 PolarHBondContact O-N 2.7Å; G43-K47 WeakPolarHBondContact O-CG 3.45Å
44	A	97.8	Very high	97	Very high	53 Å²	53	74.8 Å²	74.8	44%	0.438	39%	0.385	S	S	.	.	H	α-helix	trans	-72.3	-48.8	174.7	0	0	0	0	0	111.3	K40 R41 L42 W46 K47 L48	K40-A44 PolarHBondContact O-N 3.31Å; K40-A44 VanDerWaalsContact O-N 3.16Å; R41-A44 WeakPolarHBondContact O-CB 3.5Å; R41-A44 PolarHBondContact O-N 2.8Å; L42-A44 VanDerWaalsContact C-N 3.3Å; L42-A44 PolarHBondContact O-N 3.28Å; A44-W46 VanDerWaalsContact C-N 3.34Å; A44-W46 PolarHBondContact O-N 2.92Å; A44-K47 WeakPolarHBondContact O-CB 3.25Å; A44-K47 PolarHBondContact O-N 3.01Å; A44-L48 PolarHBondContact O-N 3.28Å
45	E	97.5	Very high	97.1	Very high	76 Å²	76	75.9 Å²	75.9	36%	0.355	38%	0.384	S	S	.	.	H	α-helix	trans	-56.7	-46	176.7	-74.1	174.9	-164.4	0	0	111.7	W18 R41 K47 L48 L49	W18-E45 HydrophobicContact CH2-CB 3.85Å; W18-E45 HydrophobicContact CZ2-CB 4.34Å; R41-E45 PolarHBondContact O-N 2.99Å; E45-K47 PolarHBondContact O-N 2.92Å; E45-K47 VanDerWaalsContact O-N 3.15Å; E45-L48 WeakPolarHBondContact O-CA 3.28Å; E45-L48 WeakPolarHBondContact O-CB 3.35Å; E45-L48 PolarHBondContact O-N 2.92Å; E45-L49 WeakPolarHBondContact O-CD1 3.31Å; E45-L49 PolarHBondContact O-N 2.95Å
46	W	97.8	Very high	97.3	Very high	42 Å²	42	75.9 Å²	75.9	16%	0.159	39%	0.388	C	S	.	.	H	α-helix	trans	-56.5	-34.4	177.1	179.9	-105	0	0	0	113.2	A14 F15 W18 L42 A44 L48 L49 K54 F57	A14-W46 HydrophobicContact CB-CH2 4.18Å; A14-W46 HydrophobicContact CB-CZ2 4.12Å; F15-W46 HydrophobicContact CB-CD2 4.42Å; F15-W46 HydrophobicContact CD2-CB 3.73Å; F15-W46 AromaticContact CD2-CD1 3.89Å; F15-W46 AromaticContact CD2-CD2 3.91Å; F15-W46 HydrophobicContact CD2-CD2 3.91Å; F15-W46 HydrophobicContact CD2-CE3 4.49Å; F15-W46 AromaticContact CD2-CG 3.54Å; F15-W46 HydrophobicContact CD2-CG 3.54Å; F15-W46 HydrophobicContact CE2-CB 3.89Å; F15-W46 HydrophobicContact CE2-CG 4.2Å; W18-W46 HydrophobicContact CB-CE3 4.13Å; W18-W46 HydrophobicContact CB-CH2 4.47Å; W18-W46 HydrophobicContact CB-CZ3 3.66Å; W18-W46 AromaticContact CD2-CE3 3.51Å; W18-W46 HydrophobicContact CD2-CE3 3.51Å; W18-W46 AromaticContact CD2-CZ3 3.9Å; W18-W46 HydrophobicContact CD2-CZ3 3.9Å; W18-W46 HydrophobicContact CE3-CB 4.23Å; W18-W46 HydrophobicContact CE3-CD2 4.25Å; W18-W46 AromaticContact CE3-CE3 3.55Å; W18-W46 HydrophobicContact CE3-CE3 3.55Å; W18-W46 HydrophobicContact CE3-CZ3 4.28Å; W18-W46 AromaticContact CG-CE3 3.78Å; W18-W46 HydrophobicContact CG-CE3 3.78Å; W18-W46 AromaticContact CG-CZ3 3.62Å; W18-W46 HydrophobicContact CG-CZ3 3.62Å; W18-W46 HydrophobicContact CH2-CB 4.17Å; W18-W46 HydrophobicContact CZ3-CB 3.76Å; W18-W46 HydrophobicContact CZ3-CE3 4.19Å; L42-W46 WeakPolarHBondContact O-CB 3.43Å; L42-W46 PolarHBondContact O-N 2.99Å; A44-W46 VanDerWaalsContact C-N 3.34Å; A44-W46 PolarHBondContact O-N 2.92Å; W46-L48 VanDerWaalsContact C-N 3.33Å; W46-L49 HydrophobicContact CE3-CD2 4.2Å; W46-L49 HydrophobicContact CZ3-CD2 4.33Å; W46-K54 HydrophobicContact CE3-CG 4.42Å; W46-K54 HydrophobicContact CH2-CB 3.95Å; W46-K54 HydrophobicContact CH2-CD 4.4Å; W46-K54 HydrophobicContact CH2-CG 3.63Å; W46-K54 HydrophobicContact CZ2-CB 4.31Å; W46-K54 HydrophobicContact CZ2-CD 4.12Å; W46-K54 HydrophobicContact CZ2-CG 3.85Å; W46-K54 HydrophobicContact CZ3-CG 3.93Å; W46-K54 WeakPolarHBondContact O-CE 3.13Å; W46-K54 PolarHBondContact O-NZ 2.74Å; W46-F57 HydrophobicContact CH2-CB 4.23Å; W46-F57 HydrophobicContact CZ3-CD2 4.28Å
47	K	97.4	Very high	97.4	Very high	171 Å²	171	75.9 Å²	75.9	74%	0.743	38%	0.38	S	S	*	.	H	α-helix	trans	-70.4	-33.4	176.8	-70.7	175.7	-179.2	-176.9	0	111.7	G43 A44 E45	G43-K47 WeakPolarHBondContact O-CG 3.45Å; A44-K47 WeakPolarHBondContact O-CB 3.25Å; A44-K47 PolarHBondContact O-N 3.01Å; E45-K47 PolarHBondContact O-N 2.92Å; E45-K47 VanDerWaalsContact O-N 3.15Å
48	L	97.4	Very high	97.5	Very high	149 Å²	149	75 Å²	75	78%	0.78	38%	0.377	S	S	*	.	H	α-helix	trans	-76.5	-26.3	179.2	-63.2	173.5	0	0	0	113.2	A44 E45 W46 T50	A44-L48 PolarHBondContact O-N 3.28Å; E45-L48 WeakPolarHBondContact O-CA 3.28Å; E45-L48 WeakPolarHBondContact O-CB 3.35Å; E45-L48 PolarHBondContact O-N 2.92Å; W46-L48 VanDerWaalsContact C-N 3.33Å; L48-T50 PolarHBondContact O-N 3.01Å
49	L	96.8	Very high	97.5	Very high	34 Å²	34	78.6 Å²	78.6	18%	0.178	40%	0.396	C	S	.	.	S	Bend	trans	-57.4	138.6	175.8	-92.6	73.7	0	0	0	111.4	W18 E45 W46 E53 K54	W18-L49 HydrophobicContact CZ2-CD1 4.03Å; W18-L49 HydrophobicContact CZ2-CD2 4.28Å; E45-L49 WeakPolarHBondContact O-CD1 3.31Å; E45-L49 PolarHBondContact O-N 2.95Å; W46-L49 HydrophobicContact CE3-CD2 4.2Å; W46-L49 HydrophobicContact CZ3-CD2 4.33Å; L49-E53 HydrophobicContact CB-CB 4.45Å; L49-E53 HydrophobicContact CD2-CB 4.15Å; L49-E53 HydrophobicContact CG-CB 4.3Å; L49-K54 HydrophobicContact CB-CG 4.11Å; L49-K54 WeakPolarHBondContact O-CE 3.33Å; L49-K54 PolarHBondContact O-NZ 3.26Å
50	T	98	Very high	97.6	Very high	69 Å²	69	79.7 Å²	79.7	42%	0.423	40%	0.397	S	S	.	.			trans	-70.6	158.5	174.2	60.7	0	0	0	0	111.3	L48 S52 E53 K54	L48-T50 PolarHBondContact O-N 3.01Å; T50-S52 PolarHBondContact O-N 3.31Å; T50-S52 PolarHBondContact OG1-OG 3.01Å; T50-E53 PolarHBondContact N-OE2 3.29Å; T50-E53 PolarHBondContact O-N 3.4Å; T50-E53 VanDerWaalsContact O-N 3.12Å; T50-E53 VanDerWaalsContact OG1-CD 3.28Å; T50-E53 VanDerWaalsContact OG1-CG 3.25Å; T50-E53 WeakPolarHBondContact OG1-CG 3.44Å; T50-E53 PolarHBondContact OG1-N 2.81Å; T50-E53 PolarHBondContact OG1-OE2 3.15Å; T50-K54 WeakPolarHBondContact O-CG 3.41Å; T50-K54 PolarHBondContact O-N 3.06Å
51	E	96.3	Very high	97.6	Very high	112 Å²	112	73.9 Å²	73.9	52%	0.523	37%	0.374	S	S	.	.	H	α-helix	trans	-61.5	-34.4	178.1	-170.1	58.3	-151.6	0	0	111.8	E53 K54 R55 I58	E51-E53 VanDerWaalsContact C-N 3.32Å; E51-E53 PolarHBondContact O-N 2.79Å; E51-K54 PolarHBondContact O-N 3.38Å; E51-K54 VanDerWaalsContact O-N 3.16Å; E51-R55 WeakPolarHBondContact O-CG 3.44Å; E51-R55 PolarHBondContact O-N 3.49Å; E51-I58 WeakPolarHBondContact OE1-CD1 3.2Å
52	S	97.3	Very high	97.7	Very high	82 Å²	82	74.5 Å²	74.5	57%	0.573	38%	0.38	S	S	*	.	H	α-helix	trans	-59.1	-40.7	173.7	36	0	0	0	0	112.9	T50 K54 P56	T50-S52 PolarHBondContact O-N 3.31Å; T50-S52 PolarHBondContact OG1-OG 3.01Å; S52-K54 VanDerWaalsContact C-N 3.35Å; S52-P56 WeakPolarHBondContact O-CD 3.39Å
53	E	96.8	Very high	97.7	Very high	100 Å²	100	80.2 Å²	80.2	47%	0.467	40%	0.401	S	S	.	.	H	α-helix	trans	-74.4	-29.1	177.2	-66.7	166.6	125.1	0	0	111.8	L49 T50 E51 P56 F57	L49-E53 HydrophobicContact CB-CB 4.45Å; L49-E53 HydrophobicContact CD2-CB 4.15Å; L49-E53 HydrophobicContact CG-CB 4.3Å; T50-E53 PolarHBondContact N-OE2 3.29Å; T50-E53 PolarHBondContact O-N 3.4Å; T50-E53 VanDerWaalsContact O-N 3.12Å; T50-E53 VanDerWaalsContact OG1-CD 3.28Å; T50-E53 VanDerWaalsContact OG1-CG 3.25Å; T50-E53 WeakPolarHBondContact OG1-CG 3.44Å; T50-E53 PolarHBondContact OG1-N 2.81Å; T50-E53 PolarHBondContact OG1-OE2 3.15Å; E51-E53 VanDerWaalsContact C-N 3.32Å; E51-E53 PolarHBondContact O-N 2.79Å; E53-P56 WeakPolarHBondContact O-CD 3.5Å; E53-P56 WeakPolarHBondContact O-CG 3.37Å; E53-F57 VanDerWaalsContact O-CD2 3.25Å; E53-F57 WeakPolarHBondContact O-CD2 2.82Å; E53-F57 VanDerWaalsContact O-CE2 3.28Å; E53-F57 WeakPolarHBondContact O-CE2 3.46Å
54	K	97.6	Very high	97.7	Very high	29 Å²	29	81 Å²	81	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-76	-32.4	177.3	-69.4	169.5	170.5	152.4	0	112.9	W46 L49 T50 E51 S52 F57 I58	W46-K54 HydrophobicContact CE3-CG 4.42Å; W46-K54 HydrophobicContact CH2-CB 3.95Å; W46-K54 HydrophobicContact CH2-CD 4.4Å; W46-K54 HydrophobicContact CH2-CG 3.63Å; W46-K54 HydrophobicContact CZ2-CB 4.31Å; W46-K54 HydrophobicContact CZ2-CD 4.12Å; W46-K54 HydrophobicContact CZ2-CG 3.85Å; W46-K54 HydrophobicContact CZ3-CG 3.93Å; W46-K54 WeakPolarHBondContact O-CE 3.13Å; W46-K54 PolarHBondContact O-NZ 2.74Å; L49-K54 HydrophobicContact CB-CG 4.11Å; L49-K54 WeakPolarHBondContact O-CE 3.33Å; L49-K54 PolarHBondContact O-NZ 3.26Å; T50-K54 WeakPolarHBondContact O-CG 3.41Å; T50-K54 PolarHBondContact O-N 3.06Å; E51-K54 PolarHBondContact O-N 3.38Å; E51-K54 VanDerWaalsContact O-N 3.16Å; S52-K54 VanDerWaalsContact C-N 3.35Å; K54-F57 PolarHBondContact O-N 2.9Å; K54-I58 HydrophobicContact CB-CD1 3.85Å; K54-I58 HydrophobicContact CB-CG1 4.42Å; K54-I58 WeakPolarHBondContact O-CG1 3.4Å; K54-I58 PolarHBondContact O-N 2.93Å
55	R	97.9	Very high	97.7	Very high	162 Å²	162	86.6 Å²	86.6	61%	0.611	41%	0.409	S	S	*	.	H	α-helix	trans	-44.4	-54	-178.2	-87.7	-173.3	-176.7	176.1	1.9	114.9	E51 F57 I58 D59	E51-R55 WeakPolarHBondContact O-CG 3.44Å; E51-R55 PolarHBondContact O-N 3.49Å; R55-F57 PolarHBondContact O-N 3.43Å; R55-I58 WeakPolarHBondContact O-CB 3.44Å; R55-I58 PolarHBondContact O-N 3.14Å; R55-I58 VanDerWaalsContact O-N 3.09Å; R55-D59 PolarHBondContact O-N 3.2Å
56	P	98.1	Very high	97.7	Very high	76 Å²	76	86 Å²	86	49%	0.494	42%	0.418	S	S	.	.	H	α-helix	trans	-58.6	-35.8	-179.6	21.8	-34.1	0	0	0	112.8	S52 E53 E60	S52-P56 WeakPolarHBondContact O-CD 3.39Å; E53-P56 WeakPolarHBondContact O-CD 3.5Å; E53-P56 WeakPolarHBondContact O-CG 3.37Å; P56-E60 WeakPolarHBondContact O-CB 3.18Å; P56-E60 PolarHBondContact O-N 2.89Å
57	F	98	Very high	97.6	Very high	62 Å²	62	87.4 Å²	87.4	27%	0.272	43%	0.427	S	S	.	.	H	α-helix	trans	-78.1	-30.6	178.6	-53.8	-70.9	0	0	0	112.9	V17 W18 W46 E53 K54 R55 A61	V17-F57 HydrophobicContact CG1-CD1 4.19Å; W18-F57 HydrophobicContact CB-CB 4.28Å; W18-F57 HydrophobicContact CB-CD1 3.82Å; W18-F57 HydrophobicContact CB-CD2 4.18Å; W18-F57 HydrophobicContact CB-CE1 4.22Å; W18-F57 HydrophobicContact CB-CG 3.81Å; W18-F57 AromaticContact CD1-CD2 3.87Å; W18-F57 AromaticContact CD1-CE1 3.98Å; W18-F57 AromaticContact CD1-CE2 3.51Å; W18-F57 AromaticContact CD1-CZ 3.58Å; W18-F57 HydrophobicContact CG-CD2 4.34Å; W18-F57 HydrophobicContact CG-CE2 4.37Å; W18-F57 HydrophobicContact CG-CG 4.43Å; W18-F57 HydrophobicContact CG-CZ 4.48Å; W46-F57 HydrophobicContact CH2-CB 4.23Å; W46-F57 HydrophobicContact CZ3-CD2 4.28Å; E53-F57 VanDerWaalsContact O-CD2 3.25Å; E53-F57 WeakPolarHBondContact O-CD2 2.82Å; E53-F57 VanDerWaalsContact O-CE2 3.28Å; E53-F57 WeakPolarHBondContact O-CE2 3.46Å; K54-F57 PolarHBondContact O-N 2.9Å; R55-F57 PolarHBondContact O-N 3.43Å; F57-A61 VanDerWaalsContact O-CB 3.31Å; F57-A61 WeakPolarHBondContact O-CB 3.09Å; F57-A61 PolarHBondContact O-N 3.09Å
58	I	97.8	Very high	97.7	Very high	42 Å²	42	80.1 Å²	80.1	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-66.2	-47	172.9	-69.3	167.9	0	0	0	109.9	A14 E51 K54 R55 A61 K62	A14-I58 HydrophobicContact CB-CB 4.47Å; A14-I58 HydrophobicContact CB-CG1 3.84Å; E51-I58 WeakPolarHBondContact OE1-CD1 3.2Å; K54-I58 HydrophobicContact CB-CD1 3.85Å; K54-I58 HydrophobicContact CB-CG1 4.42Å; K54-I58 WeakPolarHBondContact O-CG1 3.4Å; K54-I58 PolarHBondContact O-N 2.93Å; R55-I58 WeakPolarHBondContact O-CB 3.44Å; R55-I58 PolarHBondContact O-N 3.14Å; R55-I58 VanDerWaalsContact O-N 3.09Å; I58-A61 PolarHBondContact O-N 3.22Å; I58-K62 WeakPolarHBondContact O-CG 3.38Å; I58-K62 PolarHBondContact O-N 2.86Å
59	D	98.2	Very high	97.6	Very high	81 Å²	81	77 Å²	77	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-68.7	-38	-179.5	-66.5	-24.8	0	0	0	111.5	R55 A61 K62 R63	R55-D59 PolarHBondContact O-N 3.2Å; D59-A61 PolarHBondContact O-N 3.41Å; D59-K62 WeakPolarHBondContact O-CB 3.39Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 2.89Å; D59-K62 PolarHBondContact OD1-NZ 2.91Å; D59-R63 WeakPolarHBondContact O-CB 3.33Å; D59-R63 PolarHBondContact O-N 3.23Å
60	E	98	Very high	97.6	Very high	62 Å²	62	83.5 Å²	83.5	29%	0.29	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-40.4	171.9	-179.1	56.8	-163.7	0	0	112.2	V17 P56 K62 R63 L64	V17-E60 HydrophobicContact CG1-CB 4.34Å; V17-E60 HydrophobicContact CG1-CG 3.82Å; P56-E60 WeakPolarHBondContact O-CB 3.18Å; P56-E60 PolarHBondContact O-N 2.89Å; E60-K62 VanDerWaalsContact C-N 3.34Å; E60-K62 PolarHBondContact O-N 2.87Å; E60-R63 WeakPolarHBondContact O-CB 3.41Å; E60-R63 PolarHBondContact O-N 2.94Å; E60-R63 IonicContact OE1-CZ 3.7Å; E60-R63 IonicContact OE1-NE 2.8Å; E60-R63 PolarHBondContact OE1-NE 3.27Å; E60-R63 IonicContact OE1-NH2 3.74Å; E60-R63 PolarHBondContact OE1-NH2 2.93Å; E60-R63 IonicContact OE2-CZ 2.82Å; E60-R63 IonicContact OE2-NE 2.7Å; E60-R63 PolarHBondContact OE2-NE 3.29Å; E60-R63 IonicContact OE2-NH2 3.4Å; E60-L64 HydrophobicContact CG-CD1 4.36Å; E60-L64 WeakPolarHBondContact O-CB 3.45Å; E60-L64 WeakPolarHBondContact O-CG 3.47Å; E60-L64 PolarHBondContact O-N 3.13Å
61	A	98.1	Very high	97.5	Very high	12 Å²	12	86 Å²	86	10%	0.099	41%	0.411	C	S	.	.	H	α-helix	trans	-64.9	-37.6	174.8	0	0	0	0	0	112.5	A14 V17 F57 I58 D59 R65	A14-A61 HydrophobicContact CB-CB 4.13Å; A14-A61 VanDerWaalsContact N-CB 3.3Å; V17-A61 HydrophobicContact CG2-CB 4.38Å; F57-A61 VanDerWaalsContact O-CB 3.31Å; F57-A61 WeakPolarHBondContact O-CB 3.09Å; F57-A61 PolarHBondContact O-N 3.09Å; I58-A61 PolarHBondContact O-N 3.22Å; D59-A61 PolarHBondContact O-N 3.41Å; A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 3.25Å
62	K	98.4	Very high	97.4	Very high	127 Å²	127	83.9 Å²	83.9	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-62.8	-45	172.2	-70.1	172.5	-167.4	156	0	110.7	I58 D59 E60 R65 A66	I58-K62 WeakPolarHBondContact O-CG 3.38Å; I58-K62 PolarHBondContact O-N 2.86Å; D59-K62 WeakPolarHBondContact O-CB 3.39Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 2.89Å; D59-K62 PolarHBondContact OD1-NZ 2.91Å; E60-K62 VanDerWaalsContact C-N 3.34Å; E60-K62 PolarHBondContact O-N 2.87Å; K62-R65 WeakPolarHBondContact O-CB 3.49Å; K62-R65 PolarHBondContact O-N 3.22Å; K62-A66 PolarHBondContact O-N 3.47Å
63	R	98.3	Very high	97.3	Very high	120 Å²	120	85 Å²	85	45%	0.453	41%	0.407	S	S	.	.	H	α-helix	trans	-58.9	-48.8	177.1	-168.2	-164.5	70.3	78.5	0.9	111.3	D59 E60 R65 A66 M67	D59-R63 WeakPolarHBondContact O-CB 3.33Å; D59-R63 PolarHBondContact O-N 3.23Å; E60-R63 WeakPolarHBondContact O-CB 3.41Å; E60-R63 PolarHBondContact O-N 2.94Å; E60-R63 IonicContact OE1-CZ 3.7Å; E60-R63 IonicContact OE1-NE 2.8Å; E60-R63 PolarHBondContact OE1-NE 3.27Å; E60-R63 IonicContact OE1-NH2 3.74Å; E60-R63 PolarHBondContact OE1-NH2 2.93Å; E60-R63 IonicContact OE2-CZ 2.82Å; E60-R63 IonicContact OE2-NE 2.7Å; E60-R63 PolarHBondContact OE2-NE 3.29Å; E60-R63 IonicContact OE2-NH2 3.4Å; R63-R65 VanDerWaalsContact C-N 3.31Å; R63-R65 PolarHBondContact O-N 2.96Å; R63-A66 PolarHBondContact O-N 3.47Å; R63-M67 WeakPolarHBondContact O-CG 3.45Å; R63-M67 PolarHBondContact O-N 3.45Å
64	L	98.1	Very high	97.1	Very high	40 Å²	40	87.6 Å²	87.6	21%	0.209	42%	0.424	C	S	.	.	H	α-helix	trans	-61	-39.6	176.8	-72.2	173.3	0	0	0	112.1	M12 V17 E60 H68	M12-L64 HydrophobicContact CB-CD1 4.34Å; M12-L64 HydrophobicContact CE-CD1 4.01Å; V17-L64 HydrophobicContact CG2-CD1 3.7Å; E60-L64 HydrophobicContact CG-CD1 4.36Å; E60-L64 WeakPolarHBondContact O-CB 3.45Å; E60-L64 WeakPolarHBondContact O-CG 3.47Å; E60-L64 PolarHBondContact O-N 3.13Å; L64-H68 VanDerWaalsContact O-CB 3.23Å; L64-H68 WeakPolarHBondContact O-CB 3.4Å; L64-H68 PolarHBondContact O-N 3.46Å
65	R	97.3	Very high	97	Very high	170 Å²	170	88.9 Å²	88.9	64%	0.642	43%	0.428	S	S	*	.	H	α-helix	trans	-63.7	-45.8	175.1	-175.6	179.5	-179.2	-178.8	-1.1	111.4	A61 K62 R63 H68 M69	A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 3.25Å; K62-R65 WeakPolarHBondContact O-CB 3.49Å; K62-R65 PolarHBondContact O-N 3.22Å; R63-R65 VanDerWaalsContact C-N 3.31Å; R63-R65 PolarHBondContact O-N 2.96Å; R65-H68 WeakPolarHBondContact O-CB 3.48Å; R65-H68 PolarHBondContact O-N 3.05Å; R65-M69 WeakPolarHBondContact O-CG 3.45Å; R65-M69 PolarHBondContact O-N 3.01Å
66	A	97.5	Very high	96.8	Very high	64 Å²	64	88.2 Å²	88.2	53%	0.529	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-46.7	178.8	0	0	0	0	0	111.6	K62 R63 H68 M69 K70	K62-A66 PolarHBondContact O-N 3.47Å; R63-A66 PolarHBondContact O-N 3.47Å; A66-H68 VanDerWaalsContact C-N 3.3Å; A66-H68 PolarHBondContact O-N 3.4Å; A66-M69 PolarHBondContact O-N 2.87Å; A66-K70 PolarHBondContact O-N 2.98Å
67	M	97.4	Very high	96.7	Very high	72 Å²	72	90.1 Å²	90.1	36%	0.355	43%	0.428	S	S	.	.	H	α-helix	trans	-57.3	-44.8	174.1	-73	-61.2	-60.6	0	0	111.5	R63 M69 K70 E71	R63-M67 WeakPolarHBondContact O-CG 3.45Å; R63-M67 PolarHBondContact O-N 3.45Å; M67-M69 VanDerWaalsContact C-N 3.35Å; M67-M69 PolarHBondContact O-N 3.2Å; M67-K70 PolarHBondContact O-N 3.08Å; M67-K70 VanDerWaalsContact O-N 3.13Å; M67-E71 WeakPolarHBondContact CE-OE1 3.39Å; M67-E71 WeakPolarHBondContact O-CB 3.4Å; M67-E71 WeakPolarHBondContact O-CG 3.34Å; M67-E71 PolarHBondContact O-N 3.14Å
68	H	97.6	Very high	96.4	Very high	17 Å²	17	96.7 Å²	96.7	8%	0.079	45%	0.451	C	S	.	.	H	α-helix	trans	-62.5	-38.7	178.8	-169	75.3	0	0	0	113.3	V8 K9 P11 L64 R65 A66 K70 H72 Y75	V8-H68 WeakPolarHBondContact CG1-CE1 3.23Å; K9-H68 PolarHBondContact O-CE1 3.4Å; K9-H68 PolarHBondContact O-NE2 3.02Å; P11-H68 HydrophobicContact CB-CB 4.02Å; P11-H68 HydrophobicContact CG-CB 4.23Å; L64-H68 VanDerWaalsContact O-CB 3.23Å; L64-H68 WeakPolarHBondContact O-CB 3.4Å; L64-H68 PolarHBondContact O-N 3.46Å; R65-H68 WeakPolarHBondContact O-CB 3.48Å; R65-H68 PolarHBondContact O-N 3.05Å; A66-H68 VanDerWaalsContact C-N 3.3Å; A66-H68 PolarHBondContact O-N 3.4Å; H68-K70 VanDerWaalsContact C-N 3.33Å; H68-H72 AromaticContact CE1-CD2 3.54Å; H68-H72 AromaticContact ND1-CD2 3.55Å; H68-H72 WeakPolarHBondContact O-CB 3.5Å; H68-H72 PolarHBondContact O-N 3.23Å; H68-Y75 AromaticContact CD2-CD1 3.94Å; H68-Y75 AromaticContact NE2-CD1 3.65Å; H68-Y75 AromaticContact NE2-CD2 3.55Å; H68-Y75 AromaticContact NE2-CE1 3.77Å; H68-Y75 AromaticContact NE2-CE2 3.67Å; H68-Y75 AromaticContact NE2-CG 3.52Å; H68-Y75 AromaticContact NE2-CZ 3.76Å
69	M	96.4	Very high	96.2	Very high	83 Å²	83	98.4 Å²	98.4	41%	0.409	47%	0.465	S	S	.	.	H	α-helix	trans	-68.8	-32.8	175.4	-61.8	-65.2	78.3	0	0	112.1	R65 A66 M67 H72 P73 Y75	R65-M69 WeakPolarHBondContact O-CG 3.45Å; R65-M69 PolarHBondContact O-N 3.01Å; A66-M69 PolarHBondContact O-N 2.87Å; M67-M69 VanDerWaalsContact C-N 3.35Å; M67-M69 PolarHBondContact O-N 3.2Å; M69-H72 CarbonylContact O-C 3.39Å; M69-P73 WeakPolarHBondContact O-CA 3.28Å; M69-Y75 HydrophobicContact CE-CD1 3.78Å; M69-Y75 HydrophobicContact CE-CG 4.36Å
70	K	96.6	Very high	95.9	Very high	172 Å²	172	104.4 Å²	104.4	75%	0.748	48%	0.481	S	S	*	.	H	α-helix	trans	-72	-44.8	176.5	-175.8	-177.7	177.3	-176.9	0	112	A66 M67 H68	A66-K70 PolarHBondContact O-N 2.98Å; M67-K70 PolarHBondContact O-N 3.08Å; M67-K70 VanDerWaalsContact O-N 3.13Å; H68-K70 VanDerWaalsContact C-N 3.33Å
71	E	96.1	Very high	95.5	Very high	120 Å²	120	112.6 Å²	112.6	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-73.3	-30	-180	-70.6	171.4	-177.4	0	0	112.3	M67	M67-E71 WeakPolarHBondContact CE-OE1 3.39Å; M67-E71 WeakPolarHBondContact O-CB 3.4Å; M67-E71 WeakPolarHBondContact O-CG 3.34Å; M67-E71 PolarHBondContact O-N 3.14Å
72	H	94.3	Very high	95.1	Very high	69 Å²	69	120.2 Å²	120.2	32%	0.319	54%	0.541	S	S	.	.			trans	-130.6	76	-179.5	-54.3	-69.2	0	0	0	110.8	V8 H68 M69 D74 Y75	V8-H72 HydrophobicContact CG1-CB 4.44Å; H68-H72 AromaticContact CE1-CD2 3.54Å; H68-H72 AromaticContact ND1-CD2 3.55Å; H68-H72 WeakPolarHBondContact O-CB 3.5Å; H68-H72 PolarHBondContact O-N 3.23Å; M69-H72 CarbonylContact O-C 3.39Å; H72-D74 VanDerWaalsContact C-N 3.27Å; H72-D74 PolarHBondContact O-N 2.93Å; H72-Y75 WeakPolarHBondContact O-CB 3.41Å; H72-Y75 PolarHBondContact O-N 3.07Å
73	P	94.1	Very high	94.6	Very high	104 Å²	104	119.6 Å²	119.6	68%	0.675	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.8	-178.5	24.1	-33.6	0	0	0	113	M69 Y75	M69-P73 WeakPolarHBondContact O-CA 3.28Å; P73-Y75 VanDerWaalsContact C-N 3.27Å; P73-Y75 PolarHBondContact O-N 3.32Å
74	D	93.8	Very high	93.8	Very high	156 Å²	156	123.6 Å²	123.6	83%	0.834	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	6.9	177.8	-60.4	-45.2	0	0	0	113.6	H72 K76	H72-D74 VanDerWaalsContact C-N 3.27Å; H72-D74 PolarHBondContact O-N 2.93Å; D74-K76 PolarHBondContact O-N 2.9Å; D74-K76 VanDerWaalsContact O-N 3.11Å
75	Y	95.4	Very high	92.9	Very high	56 Å²	56	127.4 Å²	127.4	22%	0.22	60%	0.595	C	S	.	*			trans	-62.6	117.7	-179.2	179.9	-99.5	0	0	0	111.4	V8 R10 H68 M69 H72 P73	V8-Y75 HydrophobicContact CB-CD2 3.99Å; V8-Y75 HydrophobicContact CB-CE2 4.13Å; V8-Y75 HydrophobicContact CG1-CD2 3.53Å; V8-Y75 HydrophobicContact CG1-CE2 3.78Å; R10-Y75 VanDerWaalsContact CG-OH 3.25Å; R10-Y75 WeakPolarHBondContact CG-OH 3.17Å; H68-Y75 AromaticContact CD2-CD1 3.94Å; H68-Y75 AromaticContact NE2-CD1 3.65Å; H68-Y75 AromaticContact NE2-CD2 3.55Å; H68-Y75 AromaticContact NE2-CE1 3.77Å; H68-Y75 AromaticContact NE2-CE2 3.67Å; H68-Y75 AromaticContact NE2-CG 3.52Å; H68-Y75 AromaticContact NE2-CZ 3.76Å; M69-Y75 HydrophobicContact CE-CD1 3.78Å; M69-Y75 HydrophobicContact CE-CG 4.36Å; H72-Y75 WeakPolarHBondContact O-CB 3.41Å; H72-Y75 PolarHBondContact O-N 3.07Å; P73-Y75 VanDerWaalsContact C-N 3.27Å; P73-Y75 PolarHBondContact O-N 3.32Å
76	K	94	Very high	91.5	Very high	147 Å²	147	126.9 Å²	126.9	64%	0.639	61%	0.605	S	S	*	*			trans	-124.6	124.6	174.5	-170.9	168.5	-175.8	170.2	0	111.3	D74 R78	D74-K76 PolarHBondContact O-N 2.9Å; D74-K76 VanDerWaalsContact O-N 3.11Å; K76-R78 HydrophobicContact CG-CG 4.44Å; K76-R78 PolarHBondContact O-N 3.2Å
77	Y	95.1	Very high	89.9	Confident	116 Å²	116	130.5 Å²	130.5	46%	0.455	61%	0.612	S	S	.	*			trans	-68.5	114.7	175	176.1	-133.9	0	0	0	111.2	R10 P79	R10-Y77 VanDerWaalsContact CZ-OH 3.3Å; R10-Y77 VanDerWaalsContact NH1-CE2 3.28Å; R10-Y77 PolarHBondContact NH1-OH 3.01Å; R10-Y77 PolarHBondContact NH2-OH 3.32Å; Y77-P79 HydrophobicContact CD1-CG 4.38Å; Y77-P79 HydrophobicContact CE1-CB 4.42Å; Y77-P79 HydrophobicContact CE1-CG 3.7Å; Y77-P79 HydrophobicContact CE2-CB 4.01Å; Y77-P79 HydrophobicContact CE2-CG 3.96Å; Y77-P79 VanDerWaalsContact CZ-CG 3.47Å; Y77-P79 WeakPolarHBondContact OH-CB 3.25Å
78	R	92.8	Very high	88.1	Confident	200 Å²	200	134.8 Å²	134.8	76%	0.755	63%	0.629	S	S	*	*			trans	-122.9	87.6	178	-65.5	-179.1	-179.5	-131.1	4.6	110.5	K76 R80	K76-R78 HydrophobicContact CG-CG 4.44Å; K76-R78 PolarHBondContact O-N 3.2Å; R78-R80 PolarHBondContact O-N 2.94Å
79	P	93.1	Very high	86.2	Confident	78 Å²	78	143.7 Å²	143.7	51%	0.506	67%	0.667	S	S	.	*			trans	-60	128.1	175.1	7.9	-11.8	0	0	0	111.4	Y77 R81	Y77-P79 HydrophobicContact CD1-CG 4.38Å; Y77-P79 HydrophobicContact CE1-CB 4.42Å; Y77-P79 HydrophobicContact CE1-CG 3.7Å; Y77-P79 HydrophobicContact CE2-CB 4.01Å; Y77-P79 HydrophobicContact CE2-CG 3.96Å; Y77-P79 VanDerWaalsContact CZ-CG 3.47Å; Y77-P79 WeakPolarHBondContact OH-CB 3.25Å; P79-R81 PolarHBondContact O-N 3.49Å
80	R	91.3	Very high	84.5	Confident	207 Å²	207	146.8 Å²	146.8	78%	0.781	69%	0.686	S	S	*	*			trans	-74.6	113.4	175.6	-171.6	174.7	-171.3	-83	2.9	109.8	R78	R78-R80 PolarHBondContact O-N 2.94Å
81	R	90.6	Very high	82.7	Confident	234 Å²	234	146.8 Å²	146.8	88%	0.883	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-73.6	128.4	170.2	-57.4	-172.9	98.4	171.4	5.8	108.6	P79	P79-R81 PolarHBondContact O-N 3.49Å
82	K	88.8	Confident	80.7	Confident	173 Å²	173	150 Å²	150	75%	0.752	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-87.1	135.1	167.8	-67.2	-174	178.6	-176.9	0	107.9	K84	K82-K84 PolarHBondContact O-N 3.11Å
83	P	87.7	Confident	78.8	Confident	114 Å²	114	151.2 Å²	151.2	74%	0.74	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55.1	127.4	170.7	-21.7	31.8	0	0	0	109.2	T85	P83-T85 PolarHBondContact O-N 3.42Å
84	K	82.4	Confident	76.5	Confident	204 Å²	204	154.7 Å²	154.7	89%	0.887	72%	0.724	S	S	*	*			trans	-77.2	106.4	169.6	-67.1	-176.6	-180	-178.2	0	106.3	K82 L86	K82-K84 PolarHBondContact O-N 3.11Å; K84-L86 PolarHBondContact O-N 3.18Å
85	T	78	Confident	74.7	Confident	120 Å²	120	153.1 Å²	153.1	74%	0.736	72%	0.723	S	S	*	*			trans	-67.6	105.1	171.3	51.8	0	0	0	0	107.8	P83 M87	P83-T85 PolarHBondContact O-N 3.42Å; T85-M87 PolarHBondContact O-N 3.32Å
86	L	68.7	Low	72.5	Confident	159 Å²	159	156 Å²	156	83%	0.832	75%	0.746	S	S	*	*			trans	-75.1	22	176.7	-159.2	102	0	0	0	112.4	K84	K84-L86 PolarHBondContact O-N 3.18Å
87	M	64.1	Low	70.6	Confident	139 Å²	139	154.5 Å²	154.5	69%	0.685	75%	0.751	S	S	*	*			trans	-104.9	119.1	-163.5	-39.2	-80.6	84.8	0	0	109.9	T85	T85-M87 PolarHBondContact O-N 3.32Å
88	K	59.1	Low	68.1	Low	163 Å²	163	159.2 Å²	159.2	71%	0.709	77%	0.77	S	S	*	*			trans	80.1	65.9	168.8	-65.5	160.8	179.7	169.4	0	116.8
89	K	58.3	Low	66.1	Low	203 Å²	203	156.5 Å²	156.5	88%	0.883	77%	0.77	S	S	*	*	S	Bend	trans	-90.6	34	149.7	-159.3	-177.5	172.4	177.2	0	111.5
90	D	60.4	Low	63.6	Low	149 Å²	149	161 Å²	161	80%	0.797	79%	0.789	S	S	*	*	S	Bend	trans	-116.9	11.1	176.4	-55.6	-41.9	0	0	0	112.8
91	K	58.6	Low	60.9	Low	171 Å²	171	154.8 Å²	154.8	74%	0.743	79%	0.789	S	S	*	*	S	Bend	trans	-126.8	8.5	-179.3	-70.4	-168.4	173.9	-161.1	0	115.7
92	F	53.8	Low	58.5	Low	189 Å²	189	152 Å²	152	83%	0.829	79%	0.787	S	S	*	*			trans	-111.6	64.5	164	-83.2	-88.2	0	0	0	109	F94	F92-F94 PolarHBondContact O-N 3.3Å
93	A	55.4	Low	56.3	Low	93 Å²	93	152.5 Å²	152.5	77%	0.769	79%	0.791	S	S	*	*			trans	-64.5	108	150.4	0	0	0	0	0	105.9
94	F	45.2	Very low	53.8	Low	177 Å²	177	155 Å²	155	78%	0.776	80%	0.798	S	S	*	*			trans	-55.4	125.2	167.2	-94.6	-102.1	0	0	0	108	F92 V96	F92-F94 PolarHBondContact O-N 3.3Å; F94-V96 VanDerWaalsContact C-N 3.31Å; F94-V96 PolarHBondContact O-N 3.27Å
95	P	56.3	Low	51.6	Low	124 Å²	124	149.9 Å²	149.9	81%	0.805	79%	0.794	S	S	*	*			trans	-71.4	96.1	166.7	27.9	-27	0	0	0	106.7	P97	P95-P97 WeakPolarHBondContact O-CD 3.4Å
96	V	48	Very low	49.8	Very low	117 Å²	117	151.9 Å²	151.9	71%	0.709	80%	0.799	S	S	*	*			trans	-78.5	119	165.2	176.9	0	0	0	0	106.4	F94 Y98	F94-V96 VanDerWaalsContact C-N 3.31Å; F94-V96 PolarHBondContact O-N 3.27Å; V96-Y98 PolarHBondContact O-N 3.27Å
97	P	55.9	Low	48.2	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	80%	0.8	S	S	*	*			trans	-81.6	116.5	171	32.4	-26	0	0	0	107.4	P95	P95-P97 WeakPolarHBondContact O-CD 3.4Å
98	Y	42.3	Very low	46.8	Very low	215 Å²	215	153 Å²	153	84%	0.843	80%	0.803	S	S	*	*			trans	-134.7	111.7	156.7	-144.9	-92	0	0	0	109	V96	V96-Y98 PolarHBondContact O-N 3.27Å
99	N	49.3	Very low	45.7	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	81%	0.805	S	S	*	*			trans	-73.9	132.2	166.5	-71.1	-45.9	0	0	0	108.8
100	L	41.3	Very low	44.5	Very low	173 Å²	173	143.8 Å²	143.8	91%	0.906	80%	0.796	S	S	*	*			trans	-180	130	131	-129.9	68.7	0	0	0	110.1
101	G	35	Very low	43.4	Very low	76 Å²	76	145.3 Å²	145.3	78%	0.784	80%	0.804	S	S	*	*			trans	125.6	87.2	161.6	0	0	0	0	0	114.5
102	E	40.2	Very low	42.3	Very low	176 Å²	176	142.1 Å²	142.1	82%	0.822	80%	0.803	S	S	*	*			trans	-45.9	138.8	158.2	-166.6	177.2	174.1	0	0	111.8
103	H	41.7	Very low	41.6	Very low	182 Å²	182	143 Å²	143	84%	0.843	81%	0.809	S	S	*	*			trans	172.3	120.5	137.7	-87.1	-62.8	0	0	0	110.4
104	D	36	Very low	41.2	Very low	168 Å²	168	142 Å²	142	90%	0.898	81%	0.808	S	S	*	*			trans	-52.1	136.5	163	-94.5	-46	0	0	0	111.8
105	A	35.2	Very low	41.2	Very low	95 Å²	95	138 Å²	138	79%	0.785	81%	0.807	S	S	*	*			trans	164.2	117.9	130.9	0	0	0	0	0	113.2
106	L	40.9	Very low	40.5	Very low	163 Å²	163	140.7 Å²	140.7	85%	0.853	81%	0.814	S	S	*	*			trans	-0.1	138.3	143.9	-61.2	162.3	0	0	0	120.1
107	K	35.3	Very low	40.4	Very low	196 Å²	196	143.3 Å²	143.3	85%	0.852	82%	0.818	S	S	*	*			trans	85.4	145.2	137.7	-101.2	179.1	-175.7	176	0	120.4
108	V	34.3	Very low	39.9	Very low	124 Å²	124	145.3 Å²	145.3	75%	0.752	82%	0.817	S	S	*	*			trans	99.9	100.4	145.9	160	0	0	0	0	118.1
109	S	35.9	Very low	40.2	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	82%	0.818	S	S	*	*			trans	37.4	121.9	135.1	59.6	0	0	0	0	121
110	G	32.8	Very low	40.4	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	82%	0.824	S	S	*	*				71.1	117	127.7	0	0	0	0	0	117.7
111	L	38.7	Very low	41	Very low	181 Å²	181	142.5 Å²	142.5	95%	0.948	83%	0.826	S	S	*	*				177.4	159.8	121.7	-89.2	159.1	0	0	0	111.1
112	S	33.7	Very low	41.7	Very low	104 Å²	104	142.2 Å²	142.2	73%	0.727	82%	0.823	S	S	*	*			trans	-60.5	142.5	-160.6	44.5	0	0	0	0	118.2	G114	S112-G114 PolarHBondContact O-N 3.06Å
113	H	41	Very low	42.2	Very low	207 Å²	207	140.1 Å²	140.1	96%	0.958	82%	0.817	S	S	*	*	S	Bend	trans	-59.1	107.9	155.6	-96.7	61.2	0	0	0	109.9
114	G	45.4	Very low	42.9	Very low	73 Å²	73	136.2 Å²	136.2	75%	0.753	81%	0.808	S	S	*	*			trans	165.4	68.7	171.9	0	0	0	0	0	114.4	S112	S112-G114 PolarHBondContact O-N 3.06Å
115	A	45.4	Very low	43.9	Very low	91 Å²	91	134.7 Å²	134.7	75%	0.752	80%	0.8	S	S	*	*			trans	-173.7	83.2	157.4	0	0	0	0	0	109.7
116	L	42.9	Very low	44.8	Very low	182 Å²	182	139.1 Å²	139.1	95%	0.953	80%	0.801	S	S	*	*			trans	-163.9	38.7	151.9	-76.5	-162.8	0	0	0	111.2
117	H	44.4	Very low	45.4	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.796	79%	0.787	S	S	*	*	S	Bend	trans	-82.8	-14.7	166.1	-175.7	-93.1	0	0	0	112.9
118	E	45.9	Very low	46.2	Very low	156 Å²	156	128.5 Å²	128.5	73%	0.729	77%	0.774	S	S	*	*			trans	-113.7	82.1	-164	-140.6	79.9	160.5	0	0	112.6
119	S	49	Very low	47.1	Very low	122 Å²	122	125.9 Å²	125.9	85%	0.853	77%	0.765	S	S	*	*			trans	-163.3	33	161.6	-82.8	0	0	0	0	114.6
120	L	52.8	Low	47.9	Very low	170 Å²	170	124.2 Å²	124.2	89%	0.89	76%	0.758	S	S	*	*	S	Bend	trans	-103.7	36.8	170.6	-155.1	84.1	0	0	0	113
121	L	54.6	Low	48.9	Very low	180 Å²	180	123.9 Å²	123.9	94%	0.942	75%	0.748	S	S	*	*	S	Bend	trans	-144.3	80.3	169.7	-68	176.1	0	0	0	109.3
122	G	49.1	Very low	49.5	Very low	70 Å²	70	118.5 Å²	118.5	72%	0.722	73%	0.73	S	S	*	*	S	Bend	trans	173.4	73.5	176.4	0	0	0	0	0	115.4
123	N	51.8	Low	50.3	Low	132 Å²	132	116 Å²	116	71%	0.706	72%	0.716	S	S	*	*			trans	131.7	123	148	-90.7	-29.2	0	0	0	115.1	D125	N123-D125 PolarHBondContact O-N 3.04Å
124	P	56.2	Low	50.8	Low	100 Å²	100	109 Å²	109	65%	0.649	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-16	-179.3	29.5	-33.6	0	0	0	114.9	K126	P124-K126 PolarHBondContact O-N 3.35Å
125	D	56.4	Low	51	Low	136 Å²	136	108.3 Å²	108.3	73%	0.727	68%	0.68	S	S	*	*	H	α-helix	trans	-81.5	-16.3	-171.4	-60.7	-40.8	0	0	0	115	N123	N123-D125 PolarHBondContact O-N 3.04Å
126	K	54.2	Low	51.1	Low	188 Å²	188	107.4 Å²	107.4	82%	0.817	67%	0.673	S	S	*	*	H	α-helix	trans	-91.6	-11.4	175.3	-82.6	-178.2	178.3	175.2	0	114.1	P124	P124-K126 PolarHBondContact O-N 3.35Å
127	A	52.8	Low	51.6	Low	67 Å²	67	108.5 Å²	108.5	55%	0.554	67%	0.665	S	S	*	*	H	α-helix	trans	-76.5	-33.1	177.5	0	0	0	0	0	112.5	A130 A131	A127-A130 PolarHBondContact O-N 3.28Å; A127-A131 PolarHBondContact O-N 3.23Å
128	A	53.1	Low	52	Low	69 Å²	69	105.7 Å²	105.7	57%	0.57	66%	0.66	S	S	*	*	H	α-helix	trans	-69.4	-37.2	-179.2	0	0	0	0	0	113.1	A130 A131 A132	A128-A130 VanDerWaalsContact C-N 3.32Å; A128-A130 PolarHBondContact O-N 3.38Å; A128-A131 PolarHBondContact O-N 3.45Å; A128-A132 PolarHBondContact O-N 3.37Å
129	A	52.5	Low	52.2	Low	70 Å²	70	107.4 Å²	107.4	58%	0.579	67%	0.665	S	S	*	*	H	α-helix	trans	-66.6	-32.3	178	0	0	0	0	0	112.7
130	A	53	Low	51.8	Low	70 Å²	70	110 Å²	110	58%	0.579	66%	0.661	S	S	*	*	H	α-helix	trans	-72.6	-31.2	176.6	0	0	0	0	0	112.7	A127 A128	A127-A130 PolarHBondContact O-N 3.28Å; A128-A130 VanDerWaalsContact C-N 3.32Å; A128-A130 PolarHBondContact O-N 3.38Å
131	A	53.3	Low	51.3	Low	62 Å²	62	108.6 Å²	108.6	51%	0.512	65%	0.654	S	S	.	*	H	α-helix	trans	-74.4	-37.5	178.3	0	0	0	0	0	112.9	A127 A128 A133 A134 A135	A127-A131 PolarHBondContact O-N 3.23Å; A128-A131 PolarHBondContact O-N 3.45Å; A131-A133 PolarHBondContact O-N 3.4Å; A131-A134 PolarHBondContact O-N 3.29Å; A131-A135 PolarHBondContact O-N 3.27Å
132	A	52	Low	50.6	Low	67 Å²	67	105.5 Å²	105.5	55%	0.554	65%	0.645	S	S	*	*	H	α-helix	trans	-66.3	-37	178.8	0	0	0	0	0	112.9	A128 A134 A135 A136	A128-A132 PolarHBondContact O-N 3.37Å; A132-A134 VanDerWaalsContact C-N 3.28Å; A132-A134 PolarHBondContact O-N 3.37Å; A132-A135 PolarHBondContact O-N 3.22Å; A132-A136 PolarHBondContact O-N 3.41Å
133	A	51.2	Low	50	Low	53 Å²	53	106.9 Å²	106.9	44%	0.438	64%	0.644	S	S	.	*	H	α-helix	trans	-70.7	-21.4	177.2	0	0	0	0	0	113.6	A131	A131-A133 PolarHBondContact O-N 3.4Å
134	A	50.8	Low	49.4	Very low	58 Å²	58	108.5 Å²	108.5	48%	0.479	65%	0.649	S	S	.	*	H	α-helix	trans	-78.6	-36.1	174.4	0	0	0	0	0	112.1	A131 A132 R137	A131-A134 PolarHBondContact O-N 3.29Å; A132-A134 VanDerWaalsContact C-N 3.28Å; A132-A134 PolarHBondContact O-N 3.37Å; A134-R137 PolarHBondContact O-N 3.49Å
135	A	48.9	Very low	48.8	Very low	59 Å²	59	109.2 Å²	109.2	49%	0.488	65%	0.652	S	S	.	*	H	α-helix	trans	-67.7	-35.2	179.3	0	0	0	0	0	113.1	A131 A132 R137 V138	A131-A135 PolarHBondContact O-N 3.27Å; A132-A135 PolarHBondContact O-N 3.22Å; A135-R137 PolarHBondContact O-N 3.3Å; A135-V138 PolarHBondContact O-N 3.46Å
136	A	48.5	Very low	47.9	Very low	73 Å²	73	109.5 Å²	109.5	60%	0.603	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-16.3	178.9	0	0	0	0	0	114.1	A132	A132-A136 PolarHBondContact O-N 3.41Å
137	R	53.9	Low	47.4	Very low	205 Å²	205	107.6 Å²	107.6	77%	0.774	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-7.2	178.1	-67.8	-171	170.2	120.4	-2.3	114.2	A134 A135	A134-R137 PolarHBondContact O-N 3.49Å; A135-R137 PolarHBondContact O-N 3.3Å
138	V	51.1	Low	47	Very low	113 Å²	113	109.8 Å²	109.8	69%	0.685	67%	0.666	S	S	*	*	S	Bend	trans	-91.6	-15.7	-176.7	-159.8	0	0	0	0	112.3	A135	A135-V138 PolarHBondContact O-N 3.46Å
139	F	51.6	Low	46.3	Very low	192 Å²	192	117.4 Å²	117.4	84%	0.842	68%	0.682	S	S	*	*	S	Bend	trans	-113.8	2.1	-175.6	-74.8	-77.6	0	0	0	115.6
140	F	40.7	Very low	45.9	Very low	175 Å²	175	119.9 Å²	119.9	77%	0.768	70%	0.695	S	S	*	*			trans	-135.7	114.3	176.8	-136.4	-100.5	0	0	0	110.3	P142	F140-P142 WeakPolarHBondContact O-CD 3.37Å
141	N	41.1	Very low	45.2	Very low	141 Å²	141	125.1 Å²	125.1	75%	0.754	71%	0.705	S	S	*	*			trans	-91.5	107.8	172.1	177.4	25.2	0	0	0	108.6	S143	N141-S143 PolarHBondContact O-N 3.43Å
142	P	39.9	Very low	44.3	Very low	115 Å²	115	130.2 Å²	130.2	75%	0.747	72%	0.715	S	S	*	*			trans	-92.9	86	172.8	35.3	-25.1	0	0	0	108.1	F140	F140-P142 WeakPolarHBondContact O-CD 3.37Å
143	S	37.9	Very low	43.6	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	73%	0.726	S	S	*	*			trans	-132.3	66.9	156.4	-158.6	0	0	0	0	108.2	N141	N141-S143 PolarHBondContact O-N 3.43Å
144	M	39.2	Very low	42.9	Very low	166 Å²	166	138.1 Å²	138.1	82%	0.818	74%	0.74	S	S	*	*			trans	-115.9	117.4	160.5	-82.8	-69.9	157.8	0	0	107.2
145	T	43.6	Very low	42.2	Very low	114 Å²	114	138.7 Å²	138.7	70%	0.699	75%	0.752	S	S	*	*			trans	66.1	98.1	145.9	73.6	0	0	0	0	118.7
146	T	37.4	Very low	41.5	Very low	142 Å²	142	141 Å²	141	87%	0.871	77%	0.765	S	S	*	*			trans	-98.1	85.1	143.3	55.7	0	0	0	0	108.1
147	N	42.3	Very low	40.9	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	77%	0.772	S	S	*	*			trans	-111.2	110.5	160.4	-93.6	-13.1	0	0	0	106.8	Y149	N147-Y149 PolarHBondContact O-N 3.02Å
148	P	44.1	Very low	39.9	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	77%	0.765	S	S	*	*			trans	-84.4	94.6	173.8	31.6	-26	0	0	0	107.2
149	Y	38.3	Very low	39.1	Very low	230 Å²	230	141.7 Å²	141.7	90%	0.902	77%	0.767	S	S	*	*			trans	161.3	95.7	152.1	-88.4	-65	0	0	0	109.6	N147	N147-Y149 PolarHBondContact O-N 3.02Å
150	S	44.5	Very low	38.1	Very low	122 Å²	122	140.6 Å²	140.6	85%	0.853	77%	0.765	S	S	*	*			trans	-172	77	151.5	49.4	0	0	0	0	108.4
151	F	39.6	Very low	37.7	Very low	179 Å²	179	139.2 Å²	139.2	79%	0.785	77%	0.765	S	S	*	*			trans	-84.2	103.7	162.1	173.3	-99	0	0	0	106.2
152	F	33.7	Very low	37.2	Very low	169 Å²	169	138.2 Å²	138.2	74%	0.741	77%	0.768	S	S	*	*			trans	163.7	145.4	145	-100	-75.2	0	0	0	110.6
153	D	37.8	Very low	37	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	77%	0.771	S	S	*	*			trans	75.1	130.3	169.3	-90.5	-4.1	0	0	0	118.4
154	L	37.1	Very low	37.6	Very low	143 Å²	143	138.4 Å²	138.4	75%	0.749	77%	0.77	S	S	*	*			cis	-166.8	115.6	4.1	177.2	59.1	0	0	0	106.8
155	G	35	Very low	37.2	Very low	70 Å²	70	136.1 Å²	136.1	72%	0.722	77%	0.771	S	S	*	*			trans	-94.7	121.4	167	0	0	0	0	0	110.1
156	S	35.2	Very low	36.8	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	77%	0.771	S	S	*	*			trans	165.5	137.6	160	-81.8	0	0	0	0	106.9
157	K	34.8	Very low	37.2	Very low	172 Å²	172	137.9 Å²	137.9	75%	0.748	77%	0.77	S	S	*	*			cis	-170.6	138	8.5	-139.4	-168.1	177.8	-162.1	0	106.2
158	M	32.4	Very low	36.9	Very low	129 Å²	129	139 Å²	139	64%	0.635	76%	0.764	S	S	*	*			trans	31.8	115.5	136.5	82.5	-167.9	-80.4	0	0	119.4
159	S	35	Very low	37	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	77%	0.77	S	S	*	*				52.3	106.6	90.7	68.8	0	0	0	0	116
160	E	31.5	Very low	37.1	Very low	169 Å²	169	132.7 Å²	132.7	79%	0.79	75%	0.753	S	S	*	*			trans	-163.5	112.9	137	-81.9	-144.6	136.8	0	0	109.2
161	L	32	Very low	36.8	Very low	146 Å²	146	135 Å²	135	76%	0.764	76%	0.755	S	S	*	*				82.6	101	110	-65.2	174.6	0	0	0	116.2
162	S	30.3	Very low	36.3	Very low	119 Å²	119	129.7 Å²	129.7	83%	0.832	75%	0.751	S	S	*	*				172.5	123.5	113.3	49	0	0	0	0	112.1
163	S	34.8	Very low	36.6	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	76%	0.759	S	S	*	*			trans	-112.2	165.4	153.8	-79.2	0	0	0	0	105.3
164	P	50.9	Low	36.9	Very low	105 Å²	105	131.6 Å²	131.6	68%	0.682	76%	0.76	S	S	*	*			cis	-151.2	174.7	32.9	38.7	-16.5	0	0	0	116.8
165	S	31.3	Very low	36.8	Very low	119 Å²	119	128 Å²	128	83%	0.832	76%	0.758	S	S	*	*				-172.8	107	126.1	-78.1	0	0	0	0	110.4
166	F	35.3	Very low	36.8	Very low	162 Å²	162	128 Å²	128	71%	0.711	76%	0.758	S	S	*	*			trans	-82.4	171.8	164.4	-68.3	-86.5	0	0	0	109.6	Y168	F166-Y168 HydrophobicContact CD1-CD2 4.34Å; F166-Y168 HydrophobicContact CE1-CD2 4.42Å
167	P	45.4	Very low	36.8	Very low	130 Å²	130	129.7 Å²	129.7	84%	0.844	76%	0.764	S	S	*	*				-131.7	138.7	78.6	13.3	9.3	0	0	0	114.3
168	Y	35.9	Very low	36.9	Very low	172 Å²	172	126.3 Å²	126.3	68%	0.675	77%	0.768	S	S	*	*			trans	-65.3	171.5	156.3	-124	-104.3	0	0	0	110.3	F166	F166-Y168 HydrophobicContact CD1-CD2 4.34Å; F166-Y168 HydrophobicContact CE1-CD2 4.42Å
169	P	47	Very low	36.8	Very low	130 Å²	130	129.3 Å²	129.3	84%	0.844	78%	0.777	S	S	*	*				-131.7	146.8	112.1	35.9	-27.6	0	0	0	113.1
170	S	38.9	Very low	36.9	Very low	80 Å²	80	128.9 Å²	128.9	56%	0.559	78%	0.775	S	S	*	*			trans	-113.9	151.9	-172.3	-175.5	0	0	0	0	109.8
171	L	39.5	Very low	37	Very low	171 Å²	171	123.9 Å²	123.9	90%	0.895	77%	0.768	S	S	*	*			trans	71.4	130.2	149.2	-112	86.3	0	0	0	120.4
172	G	28.7	Very low	37.3	Very low	68 Å²	68	124.1 Å²	124.1	70%	0.701	78%	0.776	S	S	*	*			trans	178.9	85.3	157.6	0	0	0	0	0	112.2
173	Y	40.8	Very low	37.4	Very low	229 Å²	229	122.4 Å²	122.4	90%	0.898	78%	0.777	S	S	*	*			trans	-62.5	147.7	154.1	-114.6	-94.5	0	0	0	108.3
174	P	44.1	Very low	37.4	Very low	122 Å²	122	122.1 Å²	122.1	79%	0.792	78%	0.775	S	S	*	*				-140.7	136.4	121.4	33.2	-18.5	0	0	0	112.8
175	G	33.6	Very low	36.7	Very low	69 Å²	69	123.7 Å²	123.7	71%	0.711	78%	0.782	S	S	*	*			trans	-95	147.5	152.9	0	0	0	0	0	109.8
176	G	35.5	Very low	36.7	Very low	69 Å²	69	122.2 Å²	122.2	71%	0.711	79%	0.786	S	S	*	*			trans	101.6	112.2	150	0	0	0	0	0	118.2
177	T	34.9	Very low	36.5	Very low	144 Å²	144	117.8 Å²	117.8	88%	0.883	79%	0.786	S	S	*	*			trans	81.5	114.1	145.9	62.5	0	0	0	0	121.7
178	A	36.1	Very low	36	Very low	101 Å²	101	118.1 Å²	118.1	84%	0.835	79%	0.786	S	S	*	*				91.1	130.7	126	0	0	0	0	0	121
179	F	32	Very low	36.4	Very low	192 Å²	192	118 Å²	118	84%	0.842	79%	0.792	S	S	*	*			trans	98.9	104.6	148.4	-153.6	-105.7	0	0	0	118.6
180	S	37	Very low	36.4	Very low	96 Å²	96	117.4 Å²	117.4	67%	0.671	79%	0.785	S	S	*	*			trans	32.5	131.5	135.2	-54.1	0	0	0	0	121.1
181	G	33.6	Very low	37	Very low	63 Å²	63	120.7 Å²	120.7	65%	0.649	79%	0.791	S	S	*	*			trans	140	96.1	141.6	0	0	0	0	0	115.7
182	T	38.4	Very low	37.4	Very low	151 Å²	151	118.2 Å²	118.2	93%	0.926	78%	0.784	S	S	*	*			trans	44.9	119.9	134.8	57.2	0	0	0	0	120
183	G	32.3	Very low	39	Very low	83 Å²	83	120.4 Å²	120.4	86%	0.856	78%	0.776	S	S	*	*			trans	154.6	90	153.9	0	0	0	0	0	115.8
184	S	34.8	Very low	39.8	Very low	109 Å²	109	112.9 Å²	112.9	76%	0.762	76%	0.757	S	S	*	*			trans	-49.4	138.7	164.6	159.6	0	0	0	0	113.6
185	V	35.1	Very low	40.6	Very low	137 Å²	137	112.8 Å²	112.8	83%	0.83	75%	0.745	S	S	*	*				178.5	122.6	106.6	-82.1	0	0	0	0	113.3
186	G	31.9	Very low	41.6	Very low	89 Å²	89	113.8 Å²	113.8	92%	0.918	74%	0.739	S	S	*	*			trans	80.3	110.9	134.1	0	0	0	0	0	122.2
187	G	31.2	Very low	42.4	Very low	69 Å²	69	111.7 Å²	111.7	71%	0.711	72%	0.715	S	S	*	*			trans	144.3	107.2	140	0	0	0	0	0	118.6
188	T	35.1	Very low	43.5	Very low	136 Å²	136	111.6 Å²	111.6	83%	0.834	72%	0.717	S	S	*	*			trans	84	90.1	167.2	72.1	0	0	0	0	117.6	T190	T188-T190 PolarHBondContact O-N 3.41Å
189	H	43.2	Very low	44.7	Very low	171 Å²	171	110.7 Å²	110.7	79%	0.792	72%	0.717	S	S	*	*			trans	-76.6	104.2	170	-67.2	-100.9	0	0	0	110.3
190	T	47.4	Very low	45.7	Very low	116 Å²	116	106.1 Å²	106.1	71%	0.712	70%	0.701	S	S	*	*			trans	-80.1	110.8	161.5	53.8	0	0	0	0	108.5	T188 T192	T188-T190 PolarHBondContact O-N 3.41Å; T190-T192 PolarHBondContact O-N 3.21Å
191	H	50.8	Low	46.9	Very low	149 Å²	149	107.3 Å²	107.3	69%	0.69	71%	0.707	S	S	*	*			trans	-75	103.7	175.6	-63.9	-84.4	0	0	0	109.7
192	T	49	Very low	48.3	Very low	120 Å²	120	107.5 Å²	107.5	74%	0.736	71%	0.709	S	S	*	*			trans	-85.1	113.6	171.8	46.5	0	0	0	0	109.2	T190	T190-T192 PolarHBondContact O-N 3.21Å
193	H	61.1	Low	49.1	Very low	114 Å²	114	108 Å²	108	53%	0.528	70%	0.695	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	130.9	171.2	-76.8	-82.5	0	0	0	110	C207	H193-C207 PolarHBondContact O-SG 3.11Å
194	S	59.3	Low	50.9	Low	71 Å²	71	109.6 Å²	109.6	50%	0.497	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.3	126.2	175	-58.7	0	0	0	0	108.9
195	H	59.6	Low	52.3	Low	119 Å²	119	108.9 Å²	108.9	55%	0.551	67%	0.668	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.3	145	173.4	-68	-75.1	0	0	0	110.5
196	P	56.2	Low	53.5	Low	90 Å²	90	107.7 Å²	107.7	58%	0.584	66%	0.664	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68	134.4	176.5	26.8	-32	0	0	0	110.7
197	A	51.5	Low	55.2	Low	25 Å²	25	105.6 Å²	105.6	21%	0.207	64%	0.635	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.6	133.5	175.8	0	0	0	0	0	110.7	G199 N200 I205	A197-G199 PolarHBondContact O-N 3.48Å; A197-N200 PolarHBondContact O-N 3.16Å; A197-I205 HydrophobicContact CB-CD1 4.15Å
198	P	57.4	Low	56.6	Low	143 Å²	143	109.8 Å²	109.8	93%	0.929	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	95.1	178.7	27.5	-31.5	0	0	0	109.5
199	G	61.3	Low	57.6	Low	81 Å²	81	108 Å²	108	84%	0.835	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	133.6	-10.3	177.1	0	0	0	0	0	115.2	A197	A197-G199 PolarHBondContact O-N 3.48Å
200	N	54	Low	58.1	Low	96 Å²	96	105.9 Å²	105.9	51%	0.513	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-153.8	103.3	175	-163.7	-29	0	0	0	111.4	A197 G202 Y203	A197-N200 PolarHBondContact O-N 3.16Å; N200-G202 PolarHBondContact O-N 3.43Å; N200-G202 VanDerWaalsContact O-N 3.14Å; N200-G202 PolarHBondContact OD1-N 3.18Å; N200-Y203 PolarHBondContact O-N 3.09Å
201	P	61.4	Low	58.2	Low	121 Å²	121	103.5 Å²	103.5	79%	0.786	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.2	-7	-176.1	28.9	-34.1	0	0	0	113.9
202	G	62.7	Low	58	Low	68 Å²	68	108 Å²	108	70%	0.701	64%	0.642	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.5	-4	178.9	0	0	0	0	0	115.2	N200	N200-G202 PolarHBondContact O-N 3.43Å; N200-G202 VanDerWaalsContact O-N 3.14Å; N200-G202 PolarHBondContact OD1-N 3.18Å
203	Y	55.7	Low	57.8	Low	161 Å²	161	108.4 Å²	108.4	63%	0.631	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.6	115.1	-176	-152.2	-96.2	0	0	0	111.5	N200 I205	N200-Y203 PolarHBondContact O-N 3.09Å; Y203-I205 HydrophobicContact CD1-CG1 4.05Å; Y203-I205 HydrophobicContact CE1-CG1 4.35Å
204	M	69.3	Low	57	Low	117 Å²	117	108.9 Å²	108.9	58%	0.576	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	124.6	176.9	-65.7	-94.9	-179.4	0	0	108.7
205	I	64.3	Low	56.4	Low	93 Å²	93	110.2 Å²	110.2	48%	0.477	68%	0.678	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.5	118.7	177.4	-60.5	172.5	0	0	0	108.3	A197 Y203 C207	A197-I205 HydrophobicContact CB-CD1 4.15Å; Y203-I205 HydrophobicContact CD1-CG1 4.05Å; Y203-I205 HydrophobicContact CE1-CG1 4.35Å; I205-C207 PolarHBondContact O-N 2.88Å
206	P	61.9	Low	56.1	Low	113 Å²	113	108 Å²	108	73%	0.734	69%	0.687	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.2	122.9	173.6	26	-29.3	0	0	0	109.4
207	C	67.2	Low	55.8	Low	45 Å²	45	112.3 Å²	112.3	30%	0.304	71%	0.705	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	127.2	173.9	59	0	0	0	0	109.8	H193 I205 C209	H193-C207 PolarHBondContact O-SG 3.11Å; I205-C207 PolarHBondContact O-N 2.88Å; C207-C209 VanDerWaalsContact C-N 3.35Å; C207-C209 PolarHBondContact O-N 3.11Å
208	N	59.5	Low	55.7	Low	157 Å²	157	118.9 Å²	118.9	84%	0.84	73%	0.731	S	S	*	*			trans	-93.5	72.9	172.8	-165.1	34	0	0	0	108.6	T210	N208-T210 PolarHBondContact O-N 3.35Å
209	C	57.5	Low	55.5	Low	98 Å²	98	117 Å²	117	66%	0.662	72%	0.719	S	S	*	*			trans	-78.3	110.4	173.8	-62.2	0	0	0	0	107.8	C207 G211	C207-C209 VanDerWaalsContact C-N 3.35Å; C207-C209 PolarHBondContact O-N 3.11Å; C209-G211 PolarHBondContact O-N 3.32Å; C209-G211 VanDerWaalsContact O-N 3.11Å
210	T	52.1	Low	55.1	Low	126 Å²	126	119 Å²	119	77%	0.773	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-57.1	118.4	171.9	-36.8	0	0	0	0	107.9	N208 W212	N208-T210 PolarHBondContact O-N 3.35Å; T210-W212 PolarHBondContact O-N 3.35Å; T210-W212 VanDerWaalsContact O-N 3.11Å
211	G	49.7	Very low	54.9	Low	67 Å²	67	120.5 Å²	120.5	69%	0.691	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-51.7	119	-176.4	0	0	0	0	0	110.6	C209	C209-G211 PolarHBondContact O-N 3.32Å; C209-G211 VanDerWaalsContact O-N 3.11Å
212	W	47.4	Very low	54.3	Low	243 Å²	243	119.1 Å²	119.1	92%	0.92	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-58	130.6	164.2	-83.2	20.5	0	0	0	108.2	T210 S214	T210-W212 PolarHBondContact O-N 3.35Å; T210-W212 VanDerWaalsContact O-N 3.11Å; W212-S214 PolarHBondContact O-N 3.32Å
213	P	44.9	Very low	53.8	Low	129 Å²	129	125.5 Å²	125.5	84%	0.838	73%	0.727	S	S	*	*			trans	-70.3	104.1	170.9	28	-29.5	0	0	0	108.1	A215	P213-A215 PolarHBondContact O-N 3.01Å
214	S	43.3	Very low	54.1	Low	123 Å²	123	124.7 Å²	124.7	86%	0.86	73%	0.733	S	S	*	*			trans	-77.9	99.7	160.4	-91.6	0	0	0	0	108.6	W212	W212-S214 PolarHBondContact O-N 3.32Å
215	A	48.5	Very low	53.2	Low	99 Å²	99	127 Å²	127	82%	0.818	75%	0.747	S	S	*	*	S	Bend	trans	178.8	111.5	135.6	0	0	0	0	0	109.8	P213	P213-A215 PolarHBondContact O-N 3.01Å
216	G	53.3	Low	52.9	Low	73 Å²	73	129.4 Å²	129.4	75%	0.753	76%	0.76	S	S	*	*	S	Bend	trans	89	78	156.8	0	0	0	0	0	116.1
217	L	49.7	Very low	52.3	Low	181 Å²	181	130.4 Å²	130.4	95%	0.948	77%	0.766	S	S	*	*			trans	-172.6	133.8	139.9	-94.5	143.2	0	0	0	108
218	Q	47.8	Very low	51.6	Low	163 Å²	163	131.7 Å²	131.7	76%	0.762	79%	0.787	S	S	*	*			trans	-42.2	135.6	-174.1	-75.7	-95	-58.4	0	0	114.8
219	P	53.8	Low	50.9	Low	103 Å²	103	133.4 Å²	133.4	67%	0.669	79%	0.792	S	S	*	*			trans	-65.6	139.4	159.9	29.2	-31.5	0	0	0	108.8	L221	P219-L221 PolarHBondContact O-N 3.32Å
220	P	53.1	Low	50.5	Low	123 Å²	123	132.3 Å²	132.3	80%	0.799	80%	0.798	S	S	*	*			trans	-62.5	122.7	167.7	26.3	-31.4	0	0	0	108	A222	P220-A222 PolarHBondContact O-N 3.19Å
221	L	49.2	Very low	50.4	Low	127 Å²	127	136.1 Å²	136.1	67%	0.665	80%	0.804	S	S	*	*			trans	-51.5	103.1	169.7	-86.4	131.2	0	0	0	109	P219 Y223	P219-L221 PolarHBondContact O-N 3.32Å; L221-Y223 VanDerWaalsContact C-N 3.34Å; L221-Y223 HydrophobicContact CB-CD2 4.21Å; L221-Y223 HydrophobicContact CB-CE2 3.88Å; L221-Y223 PolarHBondContact O-N 2.86Å
222	A	49	Very low	50.5	Low	93 Å²	93	138.4 Å²	138.4	77%	0.769	81%	0.806	S	S	*	*			trans	-72.5	93.6	168.3	0	0	0	0	0	107.5	P220 I224	P220-A222 PolarHBondContact O-N 3.19Å; A222-I224 PolarHBondContact O-N 3.22Å; A222-I224 VanDerWaalsContact O-N 3.09Å
223	Y	53.1	Low	50.5	Low	201 Å²	201	134.6 Å²	134.6	79%	0.788	80%	0.798	S	S	*	*			trans	-66.5	109.4	168.6	-76.6	-85.6	0	0	0	108.6	L221 L225	L221-Y223 VanDerWaalsContact C-N 3.34Å; L221-Y223 HydrophobicContact CB-CD2 4.21Å; L221-Y223 HydrophobicContact CB-CE2 3.88Å; L221-Y223 PolarHBondContact O-N 2.86Å; Y223-L225 PolarHBondContact O-N 3.28Å; Y223-L225 VanDerWaalsContact O-N 3.16Å
224	I	60.9	Low	50.6	Low	145 Å²	145	136.1 Å²	136.1	74%	0.744	80%	0.799	S	S	*	*			trans	-67.9	105.6	166	-62.8	170.9	0	0	0	106.2	A222 L226	A222-I224 PolarHBondContact O-N 3.22Å; A222-I224 VanDerWaalsContact O-N 3.09Å; I224-L226 HydrophobicContact CG2-CD1 4.3Å; I224-L226 PolarHBondContact O-N 3.42Å
225	L	51.7	Low	50.3	Low	166 Å²	166	136.3 Å²	136.3	87%	0.869	79%	0.79	S	S	*	*			trans	-74.5	103.5	174.8	-169.3	70.9	0	0	0	108.6	Y223	Y223-L225 PolarHBondContact O-N 3.28Å; Y223-L225 VanDerWaalsContact O-N 3.16Å
226	L	56.8	Low	49.8	Very low	143 Å²	143	142.7 Å²	142.7	75%	0.749	80%	0.795	S	S	*	*			trans	-69.5	130.7	168.8	-81.6	80.1	0	0	0	109.5	I224 G228	I224-L226 HydrophobicContact CG2-CD1 4.3Å; I224-L226 PolarHBondContact O-N 3.42Å; L226-G228 PolarHBondContact O-N 3.14Å
227	P	49.7	Very low	49.9	Very low	133 Å²	133	144 Å²	144	86%	0.864	79%	0.79	S	S	*	*	S	Bend	trans	-80.9	111.8	174.7	29.3	-27.6	0	0	0	109.8
228	G	52.3	Low	49.8	Very low	73 Å²	73	140.2 Å²	140.2	75%	0.753	79%	0.785	S	S	*	*			trans	167.1	23.9	175.5	0	0	0	0	0	119.9	L226	L226-G228 PolarHBondContact O-N 3.14Å
229	M	45.8	Very low	49.7	Very low	192 Å²	192	142.9 Å²	142.9	95%	0.946	79%	0.789	S	S	*	*			trans	-132.6	128.1	172.2	-68.7	-175.7	70.5	0	0	111.6
230	G	47.3	Very low	49.1	Very low	75 Å²	75	142.8 Å²	142.8	77%	0.773	80%	0.797	S	S	*	*			trans	-64.6	157	-168.5	0	0	0	0	0	114.7	P232	G230-P232 WeakPolarHBondContact O-CD 3.44Å
231	K	52	Low	48.5	Very low	207 Å²	207	141.5 Å²	141.5	90%	0.9	80%	0.797	S	S	*	*			trans	-60.7	131.8	171.5	-55.9	172.7	-179	175.3	0	109.9
232	P	50.3	Low	48.1	Very low	114 Å²	114	140 Å²	140	74%	0.74	80%	0.802	S	S	*	*			trans	-87	115.9	145.9	29.8	-24.2	0	0	0	108.4	G230 L234	G230-P232 WeakPolarHBondContact O-CD 3.44Å; P232-L234 PolarHBondContact O-N 3.19Å
233	Q	47.9	Very low	47.7	Very low	163 Å²	163	147.5 Å²	147.5	76%	0.762	83%	0.829	S	S	*	*			trans	-43.4	121.5	156.5	-176.9	96.3	-4.5	0	0	109
234	L	45.9	Very low	47.4	Very low	162 Å²	162	144.9 Å²	144.9	85%	0.848	83%	0.831	S	S	*	*			trans	-134.1	118.4	164.1	-103.8	166.3	0	0	0	108.6	P232	P232-L234 PolarHBondContact O-N 3.19Å
235	D	38.6	Very low	46.7	Very low	126 Å²	126	144.8 Å²	144.8	67%	0.674	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-64	143.1	-170.3	-64.1	-61.6	0	0	0	113.1	P237	D235-P237 WeakPolarHBondContact O-CD 3.48Å
236	Y	38.4	Very low	46.4	Very low	233 Å²	233	143.7 Å²	143.7	91%	0.914	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-84.2	121	163.2	-112.9	-93.6	0	0	0	108.5
237	P	53.8	Low	45.8	Very low	100 Å²	100	143.7 Å²	143.7	65%	0.649	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-91.9	126.2	157.1	31.3	-23.9	0	0	0	109.5	D235	D235-P237 WeakPolarHBondContact O-CD 3.48Å
238	A	47.6	Very low	45.6	Very low	102 Å²	102	144.4 Å²	144.4	84%	0.843	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-57.4	133.4	169.3	0	0	0	0	0	111.4
239	Y	45.9	Very low	45.1	Very low	220 Å²	220	149.1 Å²	149.1	86%	0.863	84%	0.842	S	S	*	*			trans	-134.7	85.6	151.7	54.4	-88.1	0	0	0	108.7
240	A	42.4	Very low	45.1	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	84%	0.835	S	S	*	*			trans	-86.2	112.6	144.3	0	0	0	0	0	106.3
241	A	39.8	Very low	44.9	Very low	95 Å²	95	151.5 Å²	151.5	79%	0.785	84%	0.84	S	S	*	*			trans	173.9	133.1	148.8	0	0	0	0	0	111.7
242	A	41.1	Very low	44.3	Very low	95 Å²	95	146.9 Å²	146.9	79%	0.785	84%	0.835	S	S	*	*			trans	85.1	112.2	148.2	0	0	0	0	0	120
243	L	40.3	Very low	43.8	Very low	252 Å²	252	149.9 Å²	149.9	100%	1.319	84%	0.843	S	S	*	*			trans	83.8	0	155.9	-56.4	174.6	0	0	0	117.8

Retrieved 243 of 243 residues in 124.5 ms (Link to these results)

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