Q99N73_MOUSE Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession Q99N73, Species MOUSE (Mus musculus, Mouse), Gene Raf1, Length 146 aa.

						>Q99N73_MOUSE|Q99N73|Raf1
EQPTGSVLWMAPEVIRMQDDNPFSFQSDVYSYGIVLYELMAGELPYAHINNRDQIIFMVGRGYASPDLSRLYKNCPKAMKRLVADCVKKVKEERPLFPQILSSIELLQHSLPKINRSASEPSLHRAAHTEDINACTLTTSPRLPVF
					

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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	E	53.9	Low	81.6	Confident	238 Å²	238	70.1 Å²	70.1	100%	1.112	39%	0.387	S	S	*	.				0	145.3	0	-58.8	-161.6	137.3	0	0	109
2	Q	59.8	Low	82.8	Confident	110 Å²	110	64.6 Å²	64.6	51%	0.514	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-86.6	132.7	-179.2	-158.1	166.6	30.5	0	0	109.2	T4 D53	Q2-T4 PolarHBondContact O-N 2.7Å; Q2-D53 PolarHBondContact NE2-OD1 3.4Å
3	P	65.1	Low	83.8	Confident	11 Å²	11	59.9 Å²	59.9	7%	0.071	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-57.3	128.5	177.3	7.7	-16.6	0	0	0	111.6	M10 M17	P3-M10 HydrophobicContact CB-CE 3.44Å; P3-M10 VanDerWaalsContact CB-CE 3.44Å; P3-M10 HydrophobicContact CB-SD 4.1Å; P3-M10 HydrophobicContact CG-CE 4.24Å; P3-M17 HydrophobicContact CB-CE 4.12Å
4	T	74.4	Confident	84.6	Confident	145 Å²	145	56 Å²	56	89%	0.89	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-89.2	126	173.6	-53.9	0	0	0	0	109.1	Q2	Q2-T4 PolarHBondContact O-N 2.7Å
5	G	77.6	Confident	85.2	Confident	46 Å²	46	53.2 Å²	53.2	47%	0.474	29%	0.294	S	S	.	.	S	Bend	trans	147.8	-177.8	-180	0	0	0	0	0	113.8	V7	G5-V7 PolarHBondContact O-N 3.12Å; G5-V7 VanDerWaalsContact O-N 3.15Å
6	S	89.1	Confident	85.5	Confident	81 Å²	81	54.6 Å²	54.6	57%	0.566	29%	0.293	S	S	*	.			trans	-79.4	93.2	178.9	-58.6	0	0	0	0	110.8	L8 W9	S6-L8 PolarHBondContact O-N 3.29Å; S6-W9 VanDerWaalsContact CB-CE3 3.42Å; S6-W9 PolarHBondContact O-N 3.48Å; S6-W9 VanDerWaalsContact O-N 3.17Å
7	V	92.6	Very high	85.7	Confident	14 Å²	14	56.9 Å²	56.9	9%	0.085	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-49.3	-37	-171.3	172	0	0	0	0	114.5	G5 W9 M10 R52 I55 I56	G5-V7 PolarHBondContact O-N 3.12Å; G5-V7 VanDerWaalsContact O-N 3.15Å; V7-W9 PolarHBondContact O-N 3.1Å; V7-M10 PolarHBondContact O-N 2.99Å; V7-M10 VanDerWaalsContact O-N 3.11Å; V7-R52 HydrophobicContact CG2-CG 4.15Å; V7-I55 HydrophobicContact CG1-CG2 4.06Å; V7-I56 HydrophobicContact CB-CG1 4.42Å; V7-I56 HydrophobicContact CG1-CD1 4.39Å; V7-I56 HydrophobicContact CG1-CG1 3.51Å; V7-I56 HydrophobicContact CG2-CD1 3.93Å; V7-I56 HydrophobicContact CG2-CG1 3.95Å
8	L	95.8	Very high	85.1	Confident	32 Å²	32	60 Å²	60	17%	0.168	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.9	-26.8	-173.4	-55.2	179.8	0	0	0	113.3	S6 L44 P45 Y46 I55	S6-L8 PolarHBondContact O-N 3.29Å; L8-L44 HydrophobicContact CD1-CB 4.16Å; L8-L44 HydrophobicContact CD1-CD1 3.92Å; L8-L44 HydrophobicContact CD1-CD2 4.03Å; L8-L44 HydrophobicContact CD1-CG 4.27Å; L8-P45 HydrophobicContact CB-CG 4.11Å; L8-Y46 HydrophobicContact CD2-CD2 4.09Å; L8-I55 HydrophobicContact CD2-CD1 3.99Å; L8-I55 HydrophobicContact CD2-CG2 4.35Å
9	W	97.3	Very high	84.9	Confident	71 Å²	71	60.7 Å²	60.7	27%	0.269	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-96.2	-9.9	178.9	-63.3	-93.5	0	0	0	112.8	S6 V7 A11 Y30 S31 I34 E38 L44	S6-W9 VanDerWaalsContact CB-CE3 3.42Å; S6-W9 PolarHBondContact O-N 3.48Å; S6-W9 VanDerWaalsContact O-N 3.17Å; V7-W9 PolarHBondContact O-N 3.1Å; W9-A11 PolarHBondContact O-N 3.43Å; W9-Y30 WeakPolarHBondContact O-CD1 3.34Å; W9-S31 PolarHBondContact O-OG 3.31Å; W9-I34 HydrophobicContact CD2-CG2 4.5Å; W9-I34 HydrophobicContact CG-CB 4.39Å; W9-I34 HydrophobicContact CG-CG2 4.09Å; W9-E38 VanDerWaalsContact CE2-OE1 3.31Å; W9-E38 WeakPolarHBondContact CZ2-OE1 3.28Å; W9-E38 WeakPolarHBondContact CZ2-OE2 3.18Å; W9-E38 PolarHBondContact NE1-OE1 3.19Å; W9-L44 HydrophobicContact CH2-CD2 3.93Å; W9-L44 HydrophobicContact CZ2-CD2 4Å
10	M	96.1	Very high	84.6	Confident	23 Å²	23	66.9 Å²	66.9	11%	0.113	35%	0.353	C	S	.	.			trans	-71.9	128.2	-174.9	-62.6	-173	69.8	0	0	111.2	P3 V7 V14 I15 Y30	P3-M10 HydrophobicContact CB-CE 3.44Å; P3-M10 VanDerWaalsContact CB-CE 3.44Å; P3-M10 HydrophobicContact CB-SD 4.1Å; P3-M10 HydrophobicContact CG-CE 4.24Å; V7-M10 PolarHBondContact O-N 2.99Å; V7-M10 VanDerWaalsContact O-N 3.11Å; M10-V14 HydrophobicContact CE-CB 4.32Å; M10-V14 HydrophobicContact CE-CG1 3.48Å; M10-V14 VanDerWaalsContact CE-CG1 3.48Å; M10-I15 HydrophobicContact CB-CD1 4.11Å; M10-I15 HydrophobicContact CB-CG1 3.66Å; M10-Y30 VanDerWaalsContact O-CE1 3.29Å; M10-Y30 WeakPolarHBondContact O-CE1 3.36Å
11	A	96.4	Very high	84.7	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.363	C	S	.	.			trans	-65.9	150.2	175.1	0	0	0	0	0	111.4	W9 E13 V14 I15 Y30	W9-A11 PolarHBondContact O-N 3.43Å; A11-E13 VanDerWaalsContact C-N 3.27Å; A11-E13 VanDerWaalsContact CB-CD 3.45Å; A11-E13 WeakPolarHBondContact CB-OE1 3.32Å; A11-E13 WeakPolarHBondContact CB-OE2 3.48Å; A11-E13 PolarHBondContact O-N 3.25Å; A11-V14 HydrophobicContact CB-CG2 4.09Å; A11-V14 WeakPolarHBondContact O-CB 3.41Å; A11-V14 PolarHBondContact O-N 3.36Å; A11-I15 PolarHBondContact O-N 3.08Å; A11-Y30 VanDerWaalsContact CA-CD1 3.43Å; A11-Y30 HydrophobicContact CB-CD1 3.81Å; A11-Y30 HydrophobicContact CB-CD2 4.36Å; A11-Y30 HydrophobicContact CB-CG 3.71Å
12	P	95.9	Very high	86.2	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-55.1	-38.2	-177.2	-27.1	34.6	0	0	0	114.2	I15 R16 Y30 V59	P12-I15 PolarHBondContact O-N 3.11Å; P12-R16 WeakPolarHBondContact O-CG 3.1Å; P12-R16 PolarHBondContact O-N 3.22Å; P12-R16 VanDerWaalsContact O-N 3.09Å; P12-R16 PolarHBondContact O-NH1 2.83Å; P12-Y30 HydrophobicContact CG-CE2 4.19Å; P12-V59 HydrophobicContact CG-CG1 4.1Å
13	E	95.2	Very high	87.8	Confident	4 Å²	4	58 Å²	58	2%	0.019	31%	0.312	C	S	.	.	H	α-helix	trans	-68	-34.1	176.9	67.3	-79.9	-170.6	0	0	113.1	A11 R16 M17 Q18 K91 R94	A11-E13 VanDerWaalsContact C-N 3.27Å; A11-E13 VanDerWaalsContact CB-CD 3.45Å; A11-E13 WeakPolarHBondContact CB-OE1 3.32Å; A11-E13 WeakPolarHBondContact CB-OE2 3.48Å; A11-E13 PolarHBondContact O-N 3.25Å; E13-R16 PolarHBondContact O-N 2.88Å; E13-M17 PolarHBondContact O-N 2.87Å; E13-M17 VanDerWaalsContact O-N 3.15Å; E13-Q18 PolarHBondContact O-N 3.43Å; E13-K91 HydrophobicContact CG-CD 4.22Å; E13-R94 IonicContact OE1-CZ 3.65Å; E13-R94 IonicContact OE1-NH1 3.61Å; E13-R94 PolarHBondContact OE1-NH1 3.02Å; E13-R94 IonicContact OE1-NH2 2.79Å; E13-R94 PolarHBondContact OE1-NH2 2.92Å; E13-R94 IonicContact OE2-CZ 3.4Å; E13-R94 IonicContact OE2-NH1 3.39Å; E13-R94 IonicContact OE2-NH2 3.47Å; E13-R94 PolarHBondContact OE2-NH2 2.84Å
14	V	94.8	Very high	89.2	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.03	32%	0.319	C	S	.	.	H	α-helix	trans	-72.5	-40.6	175.5	-174.7	0	0	0	0	110.4	M10 A11 R16 M17 P22 F23	M10-V14 HydrophobicContact CE-CB 4.32Å; M10-V14 HydrophobicContact CE-CG1 3.48Å; M10-V14 VanDerWaalsContact CE-CG1 3.48Å; A11-V14 HydrophobicContact CB-CG2 4.09Å; A11-V14 WeakPolarHBondContact O-CB 3.41Å; A11-V14 PolarHBondContact O-N 3.36Å; V14-R16 VanDerWaalsContact C-N 3.29Å; V14-R16 PolarHBondContact O-N 3.06Å; V14-M17 PolarHBondContact O-N 3.08Å; V14-P22 HydrophobicContact CG2-CB 4.33Å; V14-F23 HydrophobicContact CG1-CD1 4.06Å; V14-F23 HydrophobicContact CG1-CE1 3.48Å; V14-F23 VanDerWaalsContact CG1-CE1 3.48Å; V14-F23 HydrophobicContact CG1-CZ 3.85Å; V14-F23 HydrophobicContact CG2-CD1 4.38Å
15	I	93.9	Very high	90.3	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.072	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-42.6	174	-70.2	173.7	0	0	0	111.1	M10 A11 P12 M17 I56 V59	M10-I15 HydrophobicContact CB-CD1 4.11Å; M10-I15 HydrophobicContact CB-CG1 3.66Å; A11-I15 PolarHBondContact O-N 3.08Å; P12-I15 PolarHBondContact O-N 3.11Å; I15-M17 VanDerWaalsContact C-N 3.32Å; I15-I56 HydrophobicContact CG2-CG2 3.67Å; I15-V59 HydrophobicContact CD1-CB 3.94Å; I15-V59 HydrophobicContact CD1-CG1 3.68Å
16	R	90.9	Very high	91.3	Very high	75 Å²	75	59.4 Å²	59.4	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-79.4	-11.7	-176.9	-70.6	-168.7	-63.7	-77.3	-5.2	114	P12 E13 V14 Q18 G60	P12-R16 WeakPolarHBondContact O-CG 3.1Å; P12-R16 PolarHBondContact O-N 3.22Å; P12-R16 VanDerWaalsContact O-N 3.09Å; P12-R16 PolarHBondContact O-NH1 2.83Å; E13-R16 PolarHBondContact O-N 2.88Å; V14-R16 VanDerWaalsContact C-N 3.29Å; V14-R16 PolarHBondContact O-N 3.06Å; R16-Q18 HydrophobicContact CB-CB 4.46Å; R16-Q18 HydrophobicContact CB-CG 3.88Å; R16-Q18 VanDerWaalsContact NH2-CD 3.34Å; R16-Q18 PolarHBondContact O-N 3.02Å; R16-G60 WeakPolarHBondContact CD-O 3.41Å; R16-G60 WeakPolarHBondContact CG-O 3.4Å; R16-G60 PolarHBondContact NH1-O 2.68Å
17	M	87.7	Confident	91.6	Very high	95 Å²	95	55.7 Å²	55.7	47%	0.468	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	48.6	-169.5	-64.4	-67.7	-173.4	0	0	111.1	P3 E13 V14 I15 D19 P22	P3-M17 HydrophobicContact CB-CE 4.12Å; E13-M17 PolarHBondContact O-N 2.87Å; E13-M17 VanDerWaalsContact O-N 3.15Å; V14-M17 PolarHBondContact O-N 3.08Å; I15-M17 VanDerWaalsContact C-N 3.32Å; M17-D19 VanDerWaalsContact C-N 3.34Å; M17-D19 PolarHBondContact O-N 2.95Å; M17-P22 HydrophobicContact SD-CG 3.8Å
18	Q	75.6	Confident	91.9	Very high	112 Å²	112	59.1 Å²	59.1	52%	0.523	29%	0.288	S	S	.	.			trans	-69.2	-31.1	-169.3	-107.1	-178.2	-19.5	0	0	114.3	E13 R16	E13-Q18 PolarHBondContact O-N 3.43Å; R16-Q18 HydrophobicContact CB-CB 4.46Å; R16-Q18 HydrophobicContact CB-CG 3.88Å; R16-Q18 VanDerWaalsContact NH2-CD 3.34Å; R16-Q18 PolarHBondContact O-N 3.02Å
19	D	80.9	Confident	92	Very high	74 Å²	74	57.6 Å²	57.6	40%	0.396	28%	0.28	S	S	.	.	S	Bend	trans	-118.5	159.7	-177.9	-58.9	-35.9	0	0	0	108.9	M17 N21 P22 K91	M17-D19 VanDerWaalsContact C-N 3.34Å; M17-D19 PolarHBondContact O-N 2.95Å; D19-N21 PolarHBondContact O-N 3.29Å; D19-N21 VanDerWaalsContact O-N 3.12Å; D19-P22 WeakPolarHBondContact O-CD 3.4Å; D19-K91 IonicContact OD2-NZ 2.68Å; D19-K91 PolarHBondContact OD2-NZ 2.73Å
20	D	80.1	Confident	92.1	Very high	184 Å²	184	54.4 Å²	54.4	98%	0.984	27%	0.268	S	S	*	.	S	Bend	trans	-55.2	-30.8	174.4	-69.6	-23.4	0	0	0	112.2
21	N	84.8	Confident	92.2	Very high	104 Å²	104	55 Å²	55	56%	0.556	27%	0.274	S	S	*	.			trans	-133.1	97.9	167.8	178.7	26.5	0	0	0	110.1	D19 F23	D19-N21 PolarHBondContact O-N 3.29Å; D19-N21 VanDerWaalsContact O-N 3.12Å; N21-F23 VanDerWaalsContact C-N 3.26Å; N21-F23 PolarHBondContact ND2-O 2.97Å; N21-F23 PolarHBondContact O-N 3.43Å; N21-F23 WeakPolarHBondContact OD1-CB 3.44Å; N21-F23 PolarHBondContact OD1-N 3.46Å
22	P	86.7	Confident	92.3	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.032	29%	0.288	C	S	.	.			trans	-80.4	-8.9	-179.9	34.7	-36.4	0	0	0	112.8	V14 M17 D19	V14-P22 HydrophobicContact CG2-CB 4.33Å; M17-P22 HydrophobicContact SD-CG 3.8Å; D19-P22 WeakPolarHBondContact O-CD 3.4Å
23	F	93.1	Very high	92.4	Very high	118 Å²	118	58.3 Å²	58.3	52%	0.518	29%	0.287	S	S	.	.			trans	-80.1	126	179.1	-57.2	-81.5	0	0	0	110.4	V14 N21	V14-F23 HydrophobicContact CG1-CD1 4.06Å; V14-F23 HydrophobicContact CG1-CE1 3.48Å; V14-F23 VanDerWaalsContact CG1-CE1 3.48Å; V14-F23 HydrophobicContact CG1-CZ 3.85Å; V14-F23 HydrophobicContact CG2-CD1 4.38Å; N21-F23 VanDerWaalsContact C-N 3.26Å; N21-F23 PolarHBondContact ND2-O 2.97Å; N21-F23 PolarHBondContact O-N 3.43Å; N21-F23 WeakPolarHBondContact OD1-CB 3.44Å; N21-F23 PolarHBondContact OD1-N 3.46Å
24	S	94.9	Very high	92.6	Very high	31 Å²	31	58.1 Å²	58.1	22%	0.217	29%	0.286	C	S	.	.			trans	-151.5	169	-175.3	60.4	0	0	0	0	110.7	Q26 S27 D28	S24-Q26 PolarHBondContact O-N 2.9Å; S24-Q26 VanDerWaalsContact O-N 3.14Å; S24-Q26 PolarHBondContact OG-N 2.92Å; S24-Q26 PolarHBondContact OG-OE1 3.24Å; S24-S27 PolarHBondContact N-OG 3.07Å; S24-S27 PolarHBondContact O-N 2.78Å; S24-S27 PolarHBondContact O-OG 3.03Å; S24-S27 PolarHBondContact OG-N 3.23Å; S24-D28 PolarHBondContact O-N 3.14Å
25	F	97.1	Very high	92.7	Very high	152 Å²	152	60.6 Å²	60.6	67%	0.667	30%	0.301	S	S	*	.	H	α-helix	trans	-55.6	-32.6	170.9	-63.4	-56.3	0	0	0	111.9	D28 V29	F25-D28 PolarHBondContact O-N 3.3Å; F25-V29 VanDerWaalsContact O-CG2 3.3Å; F25-V29 WeakPolarHBondContact O-CG2 3.45Å; F25-V29 PolarHBondContact O-N 2.94Å
26	Q	97.7	Very high	92.9	Very high	49 Å²	49	60.3 Å²	60.3	23%	0.229	30%	0.3	C	S	.	.	H	α-helix	trans	-71.2	-31.3	178.3	-65.4	73.1	26	0	0	112.5	S24 D28 V29 Y30 K91 R94	S24-Q26 PolarHBondContact O-N 2.9Å; S24-Q26 VanDerWaalsContact O-N 3.14Å; S24-Q26 PolarHBondContact OG-N 2.92Å; S24-Q26 PolarHBondContact OG-OE1 3.24Å; Q26-D28 VanDerWaalsContact C-N 3.34Å; Q26-V29 PolarHBondContact O-N 3.05Å; Q26-Y30 PolarHBondContact O-N 3.22Å; Q26-K91 HydrophobicContact CB-CB 3.87Å; Q26-K91 HydrophobicContact CG-CB 4.45Å; Q26-K91 VanDerWaalsContact CG-O 3.26Å; Q26-K91 WeakPolarHBondContact CG-O 3.48Å; Q26-R94 WeakPolarHBondContact O-CD 3.26Å; Q26-R94 PolarHBondContact O-NH1 3.23Å
27	S	96.7	Very high	93.3	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-69.6	-35.4	173.9	62.1	0	0	0	0	111.6	S24 Y30 S31	S24-S27 PolarHBondContact N-OG 3.07Å; S24-S27 PolarHBondContact O-N 2.78Å; S24-S27 PolarHBondContact O-OG 3.03Å; S24-S27 PolarHBondContact OG-N 3.23Å; S27-Y30 PolarHBondContact O-N 2.86Å; S27-S31 PolarHBondContact O-N 3.12Å; S27-S31 VanDerWaalsContact O-N 3.08Å; S27-S31 PolarHBondContact O-OG 3.07Å
28	D	98.2	Very high	93.8	Very high	86 Å²	86	54.5 Å²	54.5	46%	0.46	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-39.8	173	-66.1	-13.5	0	0	0	111.2	S24 F25 Q26 Y30 S31 Y32 F97	S24-D28 PolarHBondContact O-N 3.14Å; F25-D28 PolarHBondContact O-N 3.3Å; Q26-D28 VanDerWaalsContact C-N 3.34Å; D28-Y30 VanDerWaalsContact C-N 3.33Å; D28-Y30 PolarHBondContact O-N 3.14Å; D28-S31 WeakPolarHBondContact O-CB 3.41Å; D28-S31 PolarHBondContact O-N 2.89Å; D28-Y32 WeakPolarHBondContact O-CB 3.38Å; D28-Y32 PolarHBondContact O-N 3.07Å; D28-F97 HydrophobicContact CB-CE2 4.21Å
29	V	98.6	Very high	94.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-42.3	174	167	0	0	0	0	111.7	F25 Q26 S31 Y32 G33 C86 R94 P95 F97 I100	F25-V29 VanDerWaalsContact O-CG2 3.3Å; F25-V29 WeakPolarHBondContact O-CG2 3.45Å; F25-V29 PolarHBondContact O-N 2.94Å; Q26-V29 PolarHBondContact O-N 3.05Å; V29-S31 VanDerWaalsContact C-N 3.35Å; V29-Y32 PolarHBondContact O-N 3.16Å; V29-G33 PolarHBondContact O-N 2.9Å; V29-C86 HydrophobicContact CG1-CB 4.04Å; V29-R94 HydrophobicContact CG1-CB 3.93Å; V29-P95 WeakPolarHBondContact CG1-O 3.04Å; V29-P95 WeakPolarHBondContact CG2-O 3.33Å; V29-F97 HydrophobicContact CG2-CD2 3.99Å; V29-F97 HydrophobicContact CG2-CE2 3.83Å; V29-F97 HydrophobicContact CG2-CZ 4.29Å; V29-I100 HydrophobicContact CB-CD1 4.45Å; V29-I100 HydrophobicContact CG1-CD1 3.8Å; V29-I100 HydrophobicContact CG2-CD1 3.97Å
30	Y	98.4	Very high	95.5	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-47.2	175.4	-178.7	-82.6	0	0	0	111.2	W9 M10 A11 P12 Q26 S27 D28 Y32 G33 I34 C86 V87	W9-Y30 WeakPolarHBondContact O-CD1 3.34Å; M10-Y30 VanDerWaalsContact O-CE1 3.29Å; M10-Y30 WeakPolarHBondContact O-CE1 3.36Å; A11-Y30 VanDerWaalsContact CA-CD1 3.43Å; A11-Y30 HydrophobicContact CB-CD1 3.81Å; A11-Y30 HydrophobicContact CB-CD2 4.36Å; A11-Y30 HydrophobicContact CB-CG 3.71Å; P12-Y30 HydrophobicContact CG-CE2 4.19Å; Q26-Y30 PolarHBondContact O-N 3.22Å; S27-Y30 PolarHBondContact O-N 2.86Å; D28-Y30 VanDerWaalsContact C-N 3.33Å; D28-Y30 PolarHBondContact O-N 3.14Å; Y30-Y32 VanDerWaalsContact C-N 3.28Å; Y30-Y32 PolarHBondContact O-N 3.05Å; Y30-G33 WeakPolarHBondContact O-CA 3.41Å; Y30-G33 PolarHBondContact O-N 2.88Å; Y30-I34 HydrophobicContact CD1-CG1 4.15Å; Y30-I34 HydrophobicContact CE1-CD1 4.05Å; Y30-I34 HydrophobicContact CE1-CG1 3.79Å; Y30-I34 PolarHBondContact O-N 2.9Å; Y30-C86 WeakPolarHBondContact CA-O 3.21Å; Y30-V87 HydrophobicContact CD2-CB 4.32Å; Y30-V87 HydrophobicContact CE2-CB 4.07Å; Y30-V87 WeakPolarHBondContact CE2-O 3.45Å
31	S	98.3	Very high	96.2	Very high	35 Å²	35	45.3 Å²	45.3	25%	0.245	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-42.2	178.7	-54	0	0	0	0	110.9	W9 S27 D28 V29 I34 V35	W9-S31 PolarHBondContact O-OG 3.31Å; S27-S31 PolarHBondContact O-N 3.12Å; S27-S31 VanDerWaalsContact O-N 3.08Å; S27-S31 PolarHBondContact O-OG 3.07Å; D28-S31 WeakPolarHBondContact O-CB 3.41Å; D28-S31 PolarHBondContact O-N 2.89Å; V29-S31 VanDerWaalsContact C-N 3.35Å; S31-I34 WeakPolarHBondContact O-CB 3.42Å; S31-I34 PolarHBondContact O-N 2.93Å; S31-V35 PolarHBondContact O-N 2.96Å; S31-V35 VanDerWaalsContact O-N 3.14Å
32	Y	98.6	Very high	96.8	Very high	75 Å²	75	43.9 Å²	43.9	29%	0.294	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-38.2	173.1	-176.5	-106.8	0	0	0	112.6	D28 V29 Y30 I34 V35 L36 F97 I100 I104	D28-Y32 WeakPolarHBondContact O-CB 3.38Å; D28-Y32 PolarHBondContact O-N 3.07Å; V29-Y32 PolarHBondContact O-N 3.16Å; Y30-Y32 VanDerWaalsContact C-N 3.28Å; Y30-Y32 PolarHBondContact O-N 3.05Å; Y32-I34 VanDerWaalsContact C-N 3.27Å; Y32-I34 PolarHBondContact O-N 3.45Å; Y32-V35 WeakPolarHBondContact O-CB 3.41Å; Y32-V35 PolarHBondContact O-N 3.37Å; Y32-V35 VanDerWaalsContact O-N 3.11Å; Y32-L36 HydrophobicContact CD1-CD1 4.02Å; Y32-L36 HydrophobicContact CD1-CG 4.13Å; Y32-L36 HydrophobicContact CE1-CD1 3.63Å; Y32-L36 HydrophobicContact CE1-CD2 3.96Å; Y32-L36 HydrophobicContact CE1-CG 3.77Å; Y32-L36 WeakPolarHBondContact O-CG 3.42Å; Y32-L36 PolarHBondContact O-N 3.4Å; Y32-F97 AromaticContact CD1-CE1 3.85Å; Y32-F97 HydrophobicContact CD1-CE1 3.85Å; Y32-F97 HydrophobicContact CD2-CE1 4.22Å; Y32-F97 HydrophobicContact CE1-CE1 4.36Å; Y32-F97 AromaticContact CG-CE1 3.77Å; Y32-F97 HydrophobicContact CG-CE1 3.77Å; Y32-F97 HydrophobicContact CG-CZ 4.18Å; Y32-I100 HydrophobicContact CD1-CD1 4.49Å; Y32-I100 HydrophobicContact CD1-CG2 4.28Å; Y32-I100 HydrophobicContact CE1-CG2 3.7Å; Y32-I104 HydrophobicContact CE1-CD1 4.44Å
33	G	98.5	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-37.5	172.7	0	0	0	0	0	113	V29 Y30 L36 Y37	V29-G33 PolarHBondContact O-N 2.9Å; Y30-G33 WeakPolarHBondContact O-CA 3.41Å; Y30-G33 PolarHBondContact O-N 2.88Å; G33-L36 PolarHBondContact O-N 2.83Å; G33-Y37 PolarHBondContact O-N 2.96Å
34	I	98.4	Very high	97.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.4	-42.7	172.5	-59.4	-60.7	0	0	0	111.2	W9 Y30 S31 Y32 L36 Y37 E38 P45 P66 V87	W9-I34 HydrophobicContact CD2-CG2 4.5Å; W9-I34 HydrophobicContact CG-CB 4.39Å; W9-I34 HydrophobicContact CG-CG2 4.09Å; Y30-I34 HydrophobicContact CD1-CG1 4.15Å; Y30-I34 HydrophobicContact CE1-CD1 4.05Å; Y30-I34 HydrophobicContact CE1-CG1 3.79Å; Y30-I34 PolarHBondContact O-N 2.9Å; S31-I34 WeakPolarHBondContact O-CB 3.42Å; S31-I34 PolarHBondContact O-N 2.93Å; Y32-I34 VanDerWaalsContact C-N 3.27Å; Y32-I34 PolarHBondContact O-N 3.45Å; I34-L36 VanDerWaalsContact C-N 3.31Å; I34-L36 PolarHBondContact O-N 3.29Å; I34-Y37 WeakPolarHBondContact O-CA 3.37Å; I34-Y37 VanDerWaalsContact O-CB 3.3Å; I34-Y37 WeakPolarHBondContact O-CB 3.47Å; I34-Y37 PolarHBondContact O-N 3.43Å; I34-Y37 VanDerWaalsContact O-N 3.09Å; I34-E38 WeakPolarHBondContact O-CG 3.22Å; I34-E38 PolarHBondContact O-N 2.95Å; I34-P45 HydrophobicContact CG2-CG 3.81Å; I34-P66 HydrophobicContact CD1-CG 3.39Å; I34-V87 HydrophobicContact CD1-CG1 4.01Å
35	V	98.4	Very high	97.4	Very high	57 Å²	57	43.8 Å²	43.8	35%	0.345	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-43.1	173.8	173.9	0	0	0	0	111.3	S31 Y32 Y37 E38 L39	S31-V35 PolarHBondContact O-N 2.96Å; S31-V35 VanDerWaalsContact O-N 3.14Å; Y32-V35 WeakPolarHBondContact O-CB 3.41Å; Y32-V35 PolarHBondContact O-N 3.37Å; Y32-V35 VanDerWaalsContact O-N 3.11Å; V35-Y37 VanDerWaalsContact C-N 3.32Å; V35-Y37 PolarHBondContact O-N 3.13Å; V35-E38 WeakPolarHBondContact CA-OE1 3.39Å; V35-E38 PolarHBondContact O-N 3.15Å; V35-L39 HydrophobicContact CG1-CD1 4.27Å; V35-L39 WeakPolarHBondContact O-CG 3.41Å; V35-L39 PolarHBondContact O-N 3.44Å
36	L	98.1	Very high	97.3	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-41	174.6	-66.7	-179.3	0	0	0	111.6	Y32 G33 I34 L39 M40 L82 V83	Y32-L36 HydrophobicContact CD1-CD1 4.02Å; Y32-L36 HydrophobicContact CD1-CG 4.13Å; Y32-L36 HydrophobicContact CE1-CD1 3.63Å; Y32-L36 HydrophobicContact CE1-CD2 3.96Å; Y32-L36 HydrophobicContact CE1-CG 3.77Å; Y32-L36 WeakPolarHBondContact O-CG 3.42Å; Y32-L36 PolarHBondContact O-N 3.4Å; G33-L36 PolarHBondContact O-N 2.83Å; I34-L36 VanDerWaalsContact C-N 3.31Å; I34-L36 PolarHBondContact O-N 3.29Å; L36-L39 PolarHBondContact O-N 3.12Å; L36-M40 WeakPolarHBondContact O-CB 3.47Å; L36-M40 WeakPolarHBondContact O-CG 3.35Å; L36-M40 PolarHBondContact O-N 3.33Å; L36-L82 HydrophobicContact CD1-CD2 4.26Å; L36-L82 HydrophobicContact CD1-CG 4.31Å; L36-V83 HydrophobicContact CB-CG2 3.75Å; L36-V83 HydrophobicContact CD1-CG2 4.45Å
37	Y	98.3	Very high	97	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-57	-49.3	173.1	172.6	-84.7	0	0	0	111	G33 I34 V35 L39 M40 A41 E43 P45 P66 D67 L68 R70 L71	G33-Y37 PolarHBondContact O-N 2.96Å; I34-Y37 WeakPolarHBondContact O-CA 3.37Å; I34-Y37 VanDerWaalsContact O-CB 3.3Å; I34-Y37 WeakPolarHBondContact O-CB 3.47Å; I34-Y37 PolarHBondContact O-N 3.43Å; I34-Y37 VanDerWaalsContact O-N 3.09Å; V35-Y37 VanDerWaalsContact C-N 3.32Å; V35-Y37 PolarHBondContact O-N 3.13Å; Y37-L39 VanDerWaalsContact C-N 3.32Å; Y37-L39 PolarHBondContact O-N 3.33Å; Y37-M40 CarbonylContact O-C 3.59Å; Y37-M40 PolarHBondContact O-N 3.26Å; Y37-M40 VanDerWaalsContact O-N 3.12Å; Y37-A41 HydrophobicContact CD1-CB 4.27Å; Y37-A41 HydrophobicContact CE1-CB 3.84Å; Y37-A41 HydrophobicContact CE2-CB 4.3Å; Y37-A41 VanDerWaalsContact O-CB 3.25Å; Y37-A41 WeakPolarHBondContact O-CB 3.48Å; Y37-A41 PolarHBondContact O-N 3Å; Y37-E43 WeakPolarHBondContact CE1-O 3.35Å; Y37-P45 HydrophobicContact CD1-CB 4.13Å; Y37-P45 HydrophobicContact CE1-CB 3.98Å; Y37-P66 HydrophobicContact CD2-CB 3.53Å; Y37-P66 HydrophobicContact CE2-CB 3.73Å; Y37-P66 HydrophobicContact CG-CB 3.96Å; Y37-D67 WeakPolarHBondContact CE2-O 3.35Å; Y37-L68 HydrophobicContact CD2-CD2 4.17Å; Y37-R70 WeakPolarHBondContact OH-CB 3.46Å; Y37-L71 HydrophobicContact CD2-CD1 4.06Å; Y37-L71 HydrophobicContact CE2-CD1 4.14Å
38	E	97.8	Very high	96.8	Very high	46 Å²	46	44.3 Å²	44.3	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-42.9	179.4	-68.8	172.3	-92.5	0	0	111.9	W9 I34 V35 M40 G42 L44	W9-E38 VanDerWaalsContact CE2-OE1 3.31Å; W9-E38 WeakPolarHBondContact CZ2-OE1 3.28Å; W9-E38 WeakPolarHBondContact CZ2-OE2 3.18Å; W9-E38 PolarHBondContact NE1-OE1 3.19Å; I34-E38 WeakPolarHBondContact O-CG 3.22Å; I34-E38 PolarHBondContact O-N 2.95Å; V35-E38 WeakPolarHBondContact CA-OE1 3.39Å; V35-E38 PolarHBondContact O-N 3.15Å; E38-M40 VanDerWaalsContact C-N 3.31Å; E38-M40 PolarHBondContact O-N 3.4Å; E38-G42 VanDerWaalsContact O-CA 3.29Å; E38-G42 WeakPolarHBondContact O-CA 3.41Å; E38-G42 PolarHBondContact O-N 2.77Å; E38-L44 HydrophobicContact CG-CD2 4.28Å; E38-L44 WeakPolarHBondContact OE2-CD2 3.44Å
39	L	96.8	Very high	96.6	Very high	119 Å²	119	41.2 Å²	41.2	62%	0.623	24%	0.237	S	C	*	.	H	α-helix	trans	-63.4	-37.1	176.9	-69.7	172.3	0	0	0	112.5	V35 L36 Y37	V35-L39 HydrophobicContact CG1-CD1 4.27Å; V35-L39 WeakPolarHBondContact O-CG 3.41Å; V35-L39 PolarHBondContact O-N 3.44Å; L36-L39 PolarHBondContact O-N 3.12Å; Y37-L39 VanDerWaalsContact C-N 3.32Å; Y37-L39 PolarHBondContact O-N 3.33Å
40	M	95.9	Very high	96.2	Very high	33 Å²	33	49 Å²	49	16%	0.163	28%	0.279	C	S	.	.	H	α-helix	trans	-88.1	-24.8	-176.7	-61	-61.4	98.6	0	0	113.1	L36 Y37 E38 L71 Y72 M79	L36-M40 WeakPolarHBondContact O-CB 3.47Å; L36-M40 WeakPolarHBondContact O-CG 3.35Å; L36-M40 PolarHBondContact O-N 3.33Å; Y37-M40 CarbonylContact O-C 3.59Å; Y37-M40 PolarHBondContact O-N 3.26Å; Y37-M40 VanDerWaalsContact O-N 3.12Å; E38-M40 VanDerWaalsContact C-N 3.31Å; E38-M40 PolarHBondContact O-N 3.4Å; M40-L71 HydrophobicContact CB-CB 4.38Å; M40-L71 HydrophobicContact CB-CD2 3.83Å; M40-L71 HydrophobicContact CB-CG 3.74Å; M40-L71 HydrophobicContact CG-CD2 4.36Å; M40-L71 WeakPolarHBondContact O-CA 3.28Å; M40-Y72 HydrophobicContact CB-CD1 4.47Å; M40-Y72 HydrophobicContact CB-CE1 4.5Å; M40-Y72 HydrophobicContact CE-CE1 4.47Å; M40-Y72 VanDerWaalsContact O-CD1 3.26Å; M40-Y72 WeakPolarHBondContact O-CD1 3.38Å; M40-Y72 PolarHBondContact O-N 3.46Å; M40-Y72 HydrophobicContact SD-CD1 4.44Å; M40-Y72 HydrophobicContact SD-CE1 3.59Å; M40-Y72 VanDerWaalsContact SD-CE1 3.59Å; M40-M79 HydrophobicContact CG-CG 3.96Å; M40-M79 HydrophobicContact SD-CG 3.55Å; M40-M79 VanDerWaalsContact SD-CG 3.55Å; M40-M79 HydrophobicContact SD-SD 4.43Å
41	A	96.1	Very high	96	Very high	25 Å²	25	52.8 Å²	52.8	21%	0.207	30%	0.3	C	S	.	.	H	α-helix	trans	-96.3	-28.6	178.9	0	0	0	0	0	112.2	Y37 E43 R70	Y37-A41 HydrophobicContact CD1-CB 4.27Å; Y37-A41 HydrophobicContact CE1-CB 3.84Å; Y37-A41 HydrophobicContact CE2-CB 4.3Å; Y37-A41 VanDerWaalsContact O-CB 3.25Å; Y37-A41 WeakPolarHBondContact O-CB 3.48Å; Y37-A41 PolarHBondContact O-N 3Å; A41-E43 HydrophobicContact CB-CG 3.98Å; A41-E43 PolarHBondContact O-N 3.28Å; A41-R70 HydrophobicContact CB-CB 4.31Å
42	G	96.3	Very high	95.7	Very high	73 Å²	73	56.4 Å²	56.4	75%	0.753	31%	0.308	S	S	*	.	S	Bend	trans	72.3	11.6	-171.5	0	0	0	0	0	113.6	E38	E38-G42 VanDerWaalsContact O-CA 3.29Å; E38-G42 WeakPolarHBondContact O-CA 3.41Å; E38-G42 PolarHBondContact O-N 2.77Å
43	E	95.4	Very high	95.5	Very high	72 Å²	72	56.9 Å²	56.9	34%	0.336	32%	0.316	S	S	.	.	S	Bend	trans	-143.2	159.7	-179.5	64	176.3	-165.9	0	0	111.4	Y37 A41 R70	Y37-E43 WeakPolarHBondContact CE1-O 3.35Å; A41-E43 HydrophobicContact CB-CG 3.98Å; A41-E43 PolarHBondContact O-N 3.28Å; E43-R70 WeakPolarHBondContact OE1-CD 3.26Å; E43-R70 WeakPolarHBondContact OE1-CG 3.25Å
44	L	95.8	Very high	95.4	Very high	78 Å²	78	61.4 Å²	61.4	41%	0.408	34%	0.337	S	S	.	.			trans	-69.3	147.4	175	-70.6	174	0	0	0	111.4	L8 W9 E38	L8-L44 HydrophobicContact CD1-CB 4.16Å; L8-L44 HydrophobicContact CD1-CD1 3.92Å; L8-L44 HydrophobicContact CD1-CD2 4.03Å; L8-L44 HydrophobicContact CD1-CG 4.27Å; W9-L44 HydrophobicContact CH2-CD2 3.93Å; W9-L44 HydrophobicContact CZ2-CD2 4Å; E38-L44 HydrophobicContact CG-CD2 4.28Å; E38-L44 WeakPolarHBondContact OE2-CD2 3.44Å
45	P	95.6	Very high	95.2	Very high	2 Å²	2	62 Å²	62	1%	0.013	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	151.4	172	32.9	-39.1	0	0	0	109.8	L8 I34 Y37 A47 P66	L8-P45 HydrophobicContact CB-CG 4.11Å; I34-P45 HydrophobicContact CG2-CG 3.81Å; Y37-P45 HydrophobicContact CD1-CB 4.13Å; Y37-P45 HydrophobicContact CE1-CB 3.98Å; P45-A47 PolarHBondContact O-N 3Å; P45-P66 HydrophobicContact CB-CB 4.33Å; P45-P66 HydrophobicContact CB-CG 4.41Å
46	Y	95.6	Very high	95	Very high	12 Å²	12	60.3 Å²	60.3	5%	0.047	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	21	176.1	-39.9	-61	0	0	0	115	L8 H48 I49 I55 V59 A64 P66	L8-Y46 HydrophobicContact CD2-CD2 4.09Å; Y46-H48 PolarHBondContact O-N 2.83Å; Y46-I49 HydrophobicContact CD1-CD1 4.31Å; Y46-I49 HydrophobicContact CG-CD1 4.45Å; Y46-I49 PolarHBondContact O-N 2.8Å; Y46-I55 HydrophobicContact CD2-CG2 3.79Å; Y46-I55 HydrophobicContact CE2-CG2 4.25Å; Y46-I55 HydrophobicContact CG-CG2 4.29Å; Y46-V59 HydrophobicContact CE1-CG2 4.17Å; Y46-V59 HydrophobicContact CE2-CG2 3.76Å; Y46-A64 HydrophobicContact CD1-CB 4.44Å; Y46-A64 HydrophobicContact CE1-CB 3.96Å; Y46-P66 WeakPolarHBondContact OH-CD 3.32Å
47	A	91.5	Very high	94.9	Very high	62 Å²	62	65.3 Å²	65.3	51%	0.512	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-15.9	-179.1	0	0	0	0	0	115.1	P45	P45-A47 PolarHBondContact O-N 3Å
48	H	92.1	Very high	94.8	Very high	141 Å²	141	66.8 Å²	66.8	65%	0.653	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.6	174.7	63.7	-79.4	0	0	0	114	Y46	Y46-H48 PolarHBondContact O-N 2.83Å
49	I	93.3	Very high	94.7	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.108	35%	0.348	C	S	.	.			trans	-110.6	109.1	-176.9	-60.6	150.7	0	0	0	108.7	Y46 N51 Q54 I55 M58	Y46-I49 HydrophobicContact CD1-CD1 4.31Å; Y46-I49 HydrophobicContact CG-CD1 4.45Å; Y46-I49 PolarHBondContact O-N 2.8Å; I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 3.2Å; I49-Q54 HydrophobicContact CG2-CB 4.1Å; I49-Q54 HydrophobicContact CG2-CG 4.26Å; I49-I55 HydrophobicContact CB-CD1 4.28Å; I49-I55 HydrophobicContact CB-CG1 3.99Å; I49-I55 HydrophobicContact CD1-CG1 4.44Å; I49-I55 HydrophobicContact CG2-CD1 4.21Å; I49-I55 HydrophobicContact CG2-CG1 3.59Å; I49-M58 HydrophobicContact CD1-CE 3.21Å; I49-M58 HydrophobicContact CG1-CE 3.97Å; I49-M58 HydrophobicContact CG2-CE 4.17Å
50	N	91.5	Very high	94.6	Very high	165 Å²	165	59.3 Å²	59.3	88%	0.882	32%	0.321	S	S	*	.			trans	-82.4	-9.5	-177.3	-64.8	-23	0	0	0	113.6
51	N	94.1	Very high	94.5	Very high	82 Å²	82	65 Å²	65	44%	0.439	34%	0.34	S	S	.	.			trans	-104.2	114.4	-176.8	-174.3	-33.1	0	0	0	111.2	I49 D53 Q54 I55	I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 3.2Å; N51-D53 PolarHBondContact O-N 2.63Å; N51-D53 PolarHBondContact OD1-N 3.12Å; N51-Q54 HydrophobicContact CB-CB 3.85Å; N51-Q54 WeakPolarHBondContact O-CB 3.47Å; N51-Q54 PolarHBondContact O-N 2.95Å; N51-Q54 PolarHBondContact OD1-N 3.02Å; N51-I55 PolarHBondContact O-N 2.98Å
52	R	92.4	Very high	94.3	Very high	111 Å²	111	65.1 Å²	65.1	42%	0.419	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-45.3	177.7	177.8	-179.6	170.9	-98	1	112.8	V7 Q54 I55 I56	V7-R52 HydrophobicContact CG2-CG 4.15Å; R52-Q54 VanDerWaalsContact C-N 3.26Å; R52-Q54 PolarHBondContact O-N 3.4Å; R52-I55 WeakPolarHBondContact O-CB 3.19Å; R52-I55 PolarHBondContact O-N 3.45Å; R52-I55 VanDerWaalsContact O-N 3.15Å; R52-I56 HydrophobicContact CG-CD1 4.14Å; R52-I56 WeakPolarHBondContact O-CG1 3.41Å; R52-I56 PolarHBondContact O-N 3.07Å
53	D	93.6	Very high	94.3	Very high	85 Å²	85	69.8 Å²	69.8	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-67.9	-31.1	-178.3	-63.4	-37.5	0	0	0	111.6	Q2 N51 I56 F57	Q2-D53 PolarHBondContact NE2-OD1 3.4Å; N51-D53 PolarHBondContact O-N 2.63Å; N51-D53 PolarHBondContact OD1-N 3.12Å; D53-I56 PolarHBondContact O-N 2.83Å; D53-F57 WeakPolarHBondContact O-CB 3.25Å; D53-F57 PolarHBondContact O-N 3.48Å
54	Q	95.5	Very high	94.2	Very high	95 Å²	95	67.5 Å²	67.5	44%	0.444	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-43.1	172.1	-166.8	-177.8	10.1	0	0	111.1	I49 N51 R52 F57 M58	I49-Q54 HydrophobicContact CG2-CB 4.1Å; I49-Q54 HydrophobicContact CG2-CG 4.26Å; N51-Q54 HydrophobicContact CB-CB 3.85Å; N51-Q54 WeakPolarHBondContact O-CB 3.47Å; N51-Q54 PolarHBondContact O-N 2.95Å; N51-Q54 PolarHBondContact OD1-N 3.02Å; R52-Q54 VanDerWaalsContact C-N 3.26Å; R52-Q54 PolarHBondContact O-N 3.4Å; Q54-F57 PolarHBondContact O-N 3.09Å; Q54-M58 HydrophobicContact CG-CE 3.81Å; Q54-M58 HydrophobicContact CG-CG 4.38Å; Q54-M58 HydrophobicContact CG-SD 4Å; Q54-M58 WeakPolarHBondContact O-CB 3.37Å; Q54-M58 VanDerWaalsContact O-CG 3.26Å; Q54-M58 WeakPolarHBondContact O-CG 3.35Å; Q54-M58 PolarHBondContact O-N 2.77Å
55	I	95	Very high	94.2	Very high	12 Å²	12	67.6 Å²	67.6	6%	0.062	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-49.4	174.9	-62.7	171.4	0	0	0	110.2	V7 L8 Y46 I49 N51 R52 F57 M58 V59	V7-I55 HydrophobicContact CG1-CG2 4.06Å; L8-I55 HydrophobicContact CD2-CD1 3.99Å; L8-I55 HydrophobicContact CD2-CG2 4.35Å; Y46-I55 HydrophobicContact CD2-CG2 3.79Å; Y46-I55 HydrophobicContact CE2-CG2 4.25Å; Y46-I55 HydrophobicContact CG-CG2 4.29Å; I49-I55 HydrophobicContact CB-CD1 4.28Å; I49-I55 HydrophobicContact CB-CG1 3.99Å; I49-I55 HydrophobicContact CD1-CG1 4.44Å; I49-I55 HydrophobicContact CG2-CD1 4.21Å; I49-I55 HydrophobicContact CG2-CG1 3.59Å; N51-I55 PolarHBondContact O-N 2.98Å; R52-I55 WeakPolarHBondContact O-CB 3.19Å; R52-I55 PolarHBondContact O-N 3.45Å; R52-I55 VanDerWaalsContact O-N 3.15Å; I55-F57 VanDerWaalsContact C-N 3.28Å; I55-F57 PolarHBondContact O-N 3.43Å; I55-M58 PolarHBondContact O-N 3.12Å; I55-V59 HydrophobicContact CG2-CG2 3.97Å; I55-V59 WeakPolarHBondContact O-CB 3.42Å; I55-V59 WeakPolarHBondContact O-CG2 3.49Å; I55-V59 PolarHBondContact O-N 3.38Å
56	I	94.6	Very high	94.3	Very high	22 Å²	22	67.6 Å²	67.6	11%	0.113	34%	0.341	C	S	.	.	H	α-helix	trans	-52.9	-48.8	176.5	-68.3	173.8	0	0	0	110.1	V7 I15 R52 D53 G60	V7-I56 HydrophobicContact CB-CG1 4.42Å; V7-I56 HydrophobicContact CG1-CD1 4.39Å; V7-I56 HydrophobicContact CG1-CG1 3.51Å; V7-I56 HydrophobicContact CG2-CD1 3.93Å; V7-I56 HydrophobicContact CG2-CG1 3.95Å; I15-I56 HydrophobicContact CG2-CG2 3.67Å; R52-I56 HydrophobicContact CG-CD1 4.14Å; R52-I56 WeakPolarHBondContact O-CG1 3.41Å; R52-I56 PolarHBondContact O-N 3.07Å; D53-I56 PolarHBondContact O-N 2.83Å; I56-G60 VanDerWaalsContact O-CA 3.29Å; I56-G60 WeakPolarHBondContact O-CA 3.26Å; I56-G60 PolarHBondContact O-N 3.39Å
57	F	94.8	Very high	94.3	Very high	113 Å²	113	70.2 Å²	70.2	50%	0.496	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-48.6	-179.8	177.6	-97.2	0	0	0	112.5	D53 Q54 I55 R61 Y63	D53-F57 WeakPolarHBondContact O-CB 3.25Å; D53-F57 PolarHBondContact O-N 3.48Å; Q54-F57 PolarHBondContact O-N 3.09Å; I55-F57 VanDerWaalsContact C-N 3.28Å; I55-F57 PolarHBondContact O-N 3.43Å; F57-R61 HydrophobicContact CD2-CG 4.21Å; F57-R61 HydrophobicContact CE1-CG 4.44Å; F57-R61 HydrophobicContact CE2-CG 3.95Å; F57-R61 HydrophobicContact CZ-CG 4.07Å; F57-R61 VanDerWaalsContact O-CB 3.3Å; F57-R61 WeakPolarHBondContact O-CB 3.46Å; F57-R61 VanDerWaalsContact O-CG 3.26Å; F57-R61 WeakPolarHBondContact O-CG 3.41Å; F57-R61 PolarHBondContact O-N 2.8Å; F57-Y63 HydrophobicContact CE1-CD2 4.12Å; F57-Y63 HydrophobicContact CE1-CE2 4.01Å; F57-Y63 HydrophobicContact CZ-CE2 4.27Å
58	M	96.7	Very high	94.5	Very high	34 Å²	34	69 Å²	69	17%	0.167	34%	0.34	C	S	.	.	H	α-helix	trans	-70.1	-44.8	-175.1	-67.6	-176.5	-52.9	0	0	112.1	I49 Q54 I55 R61 G62 Y63 A64	I49-M58 HydrophobicContact CD1-CE 3.21Å; I49-M58 HydrophobicContact CG1-CE 3.97Å; I49-M58 HydrophobicContact CG2-CE 4.17Å; Q54-M58 HydrophobicContact CG-CE 3.81Å; Q54-M58 HydrophobicContact CG-CG 4.38Å; Q54-M58 HydrophobicContact CG-SD 4Å; Q54-M58 WeakPolarHBondContact O-CB 3.37Å; Q54-M58 VanDerWaalsContact O-CG 3.26Å; Q54-M58 WeakPolarHBondContact O-CG 3.35Å; Q54-M58 PolarHBondContact O-N 2.77Å; I55-M58 PolarHBondContact O-N 3.12Å; M58-R61 PolarHBondContact O-N 3.42Å; M58-G62 CarbonylContact O-C 3.56Å; M58-G62 WeakPolarHBondContact O-CA 3.35Å; M58-G62 PolarHBondContact O-N 3.37Å; M58-Y63 PolarHBondContact O-N 3.45Å; M58-A64 HydrophobicContact CB-CB 3.68Å; M58-A64 PolarHBondContact O-N 3.02Å
59	V	95.9	Very high	94.7	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-67.8	-45.5	176	179.4	0	0	0	0	109.8	P12 I15 Y46 I55 R61 G62 A64	P12-V59 HydrophobicContact CG-CG1 4.1Å; I15-V59 HydrophobicContact CD1-CB 3.94Å; I15-V59 HydrophobicContact CD1-CG1 3.68Å; Y46-V59 HydrophobicContact CE1-CG2 4.17Å; Y46-V59 HydrophobicContact CE2-CG2 3.76Å; I55-V59 HydrophobicContact CG2-CG2 3.97Å; I55-V59 WeakPolarHBondContact O-CB 3.42Å; I55-V59 WeakPolarHBondContact O-CG2 3.49Å; I55-V59 PolarHBondContact O-N 3.38Å; V59-R61 VanDerWaalsContact C-N 3.29Å; V59-R61 PolarHBondContact O-N 2.79Å; V59-G62 WeakPolarHBondContact O-CA 3.41Å; V59-G62 PolarHBondContact O-N 3.04Å; V59-A64 HydrophobicContact CG2-CB 4.25Å
60	G	94.3	Very high	94.8	Very high	4 Å²	4	71.6 Å²	71.6	4%	0.041	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-35.8	176	0	0	0	0	0	112.9	R16 I56	R16-G60 WeakPolarHBondContact CD-O 3.41Å; R16-G60 WeakPolarHBondContact CG-O 3.4Å; R16-G60 PolarHBondContact NH1-O 2.68Å; I56-G60 VanDerWaalsContact O-CA 3.29Å; I56-G60 WeakPolarHBondContact O-CA 3.26Å; I56-G60 PolarHBondContact O-N 3.39Å
61	R	94.1	Very high	95	Very high	152 Å²	152	64.4 Å²	64.4	57%	0.574	32%	0.318	S	S	*	.	H	α-helix	trans	-85.6	-12.1	173.7	-66.9	-68.1	-176	162.9	-1	113.1	F57 M58 V59 Y63 K89	F57-R61 HydrophobicContact CD2-CG 4.21Å; F57-R61 HydrophobicContact CE1-CG 4.44Å; F57-R61 HydrophobicContact CE2-CG 3.95Å; F57-R61 HydrophobicContact CZ-CG 4.07Å; F57-R61 VanDerWaalsContact O-CB 3.3Å; F57-R61 WeakPolarHBondContact O-CB 3.46Å; F57-R61 VanDerWaalsContact O-CG 3.26Å; F57-R61 WeakPolarHBondContact O-CG 3.41Å; F57-R61 PolarHBondContact O-N 2.8Å; M58-R61 PolarHBondContact O-N 3.42Å; V59-R61 VanDerWaalsContact C-N 3.29Å; V59-R61 PolarHBondContact O-N 2.79Å; R61-Y63 HydrophobicContact CB-CD2 3.58Å; R61-Y63 HydrophobicContact CB-CE1 4.49Å; R61-Y63 HydrophobicContact CB-CE2 3.51Å; R61-Y63 HydrophobicContact CB-CG 4.13Å; R61-Y63 HydrophobicContact CG-CD2 4.38Å; R61-Y63 HydrophobicContact CG-CE2 4.01Å; R61-K89 PolarHBondContact O-NZ 3.38Å
62	G	93.1	Very high	95	Very high	28 Å²	28	65.6 Å²	65.6	29%	0.289	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	32.6	-174.2	0	0	0	0	0	113.5	M58 V59	M58-G62 CarbonylContact O-C 3.56Å; M58-G62 WeakPolarHBondContact O-CA 3.35Å; M58-G62 PolarHBondContact O-N 3.37Å; V59-G62 WeakPolarHBondContact O-CA 3.41Å; V59-G62 PolarHBondContact O-N 3.04Å
63	Y	95.1	Very high	95	Very high	172 Å²	172	70.3 Å²	70.3	68%	0.675	34%	0.34	S	S	*	.	S	Bend	trans	-85	-18.4	168.1	-60.2	-37.9	0	0	0	112.5	F57 M58 R61	F57-Y63 HydrophobicContact CE1-CD2 4.12Å; F57-Y63 HydrophobicContact CE1-CE2 4.01Å; F57-Y63 HydrophobicContact CZ-CE2 4.27Å; M58-Y63 PolarHBondContact O-N 3.45Å; R61-Y63 HydrophobicContact CB-CD2 3.58Å; R61-Y63 HydrophobicContact CB-CE1 4.49Å; R61-Y63 HydrophobicContact CB-CE2 3.51Å; R61-Y63 HydrophobicContact CB-CG 4.13Å; R61-Y63 HydrophobicContact CG-CD2 4.38Å; R61-Y63 HydrophobicContact CG-CE2 4.01Å
64	A	94.4	Very high	94.8	Very high	23 Å²	23	73.1 Å²	73.1	19%	0.19	36%	0.355	C	S	.	.			trans	-124.6	144.6	176.9	0	0	0	0	0	111.3	Y46 M58 V59	Y46-A64 HydrophobicContact CD1-CB 4.44Å; Y46-A64 HydrophobicContact CE1-CB 3.96Å; M58-A64 HydrophobicContact CB-CB 3.68Å; M58-A64 PolarHBondContact O-N 3.02Å; V59-A64 HydrophobicContact CG2-CB 4.25Å
65	S	95.4	Very high	94.6	Very high	80 Å²	80	69.5 Å²	69.5	56%	0.559	34%	0.34	S	S	*	.			trans	-141.4	160.6	168.6	59.6	0	0	0	0	108.5	D67	S65-D67 PolarHBondContact O-N 3.02Å
66	P	96.2	Very high	94.6	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.019	35%	0.346	C	S	.	.			trans	-56.5	135.7	176.7	-23.4	34.3	0	0	0	111.5	I34 Y37 P45 Y46 L68 V87	I34-P66 HydrophobicContact CD1-CG 3.39Å; Y37-P66 HydrophobicContact CD2-CB 3.53Å; Y37-P66 HydrophobicContact CE2-CB 3.73Å; Y37-P66 HydrophobicContact CG-CB 3.96Å; P45-P66 HydrophobicContact CB-CB 4.33Å; P45-P66 HydrophobicContact CB-CG 4.41Å; Y46-P66 WeakPolarHBondContact OH-CD 3.32Å; P66-L68 PolarHBondContact O-N 3.24Å; P66-L68 VanDerWaalsContact O-N 3.09Å; P66-V87 HydrophobicContact CG-CB 4.35Å; P66-V87 HydrophobicContact CG-CG1 4.29Å; P66-V87 HydrophobicContact CG-CG2 4.31Å
67	D	96.4	Very high	94.6	Very high	66 Å²	66	78.2 Å²	78.2	35%	0.353	38%	0.38	S	S	.	.			trans	-78.3	96.6	-176.2	175.7	7.7	0	0	0	110.5	Y37 S65 S69 R70	Y37-D67 WeakPolarHBondContact CE2-O 3.35Å; S65-D67 PolarHBondContact O-N 3.02Å; D67-S69 PolarHBondContact O-N 3.41Å; D67-S69 VanDerWaalsContact OD1-CB 3.22Å; D67-S69 WeakPolarHBondContact OD1-CB 3.3Å; D67-S69 PolarHBondContact OD1-N 3.38Å; D67-S69 PolarHBondContact OD1-OG 2.83Å; D67-S69 PolarHBondContact OD2-OG 3.02Å; D67-R70 HydrophobicContact CB-CG 3.96Å; D67-R70 WeakPolarHBondContact O-CB 3.42Å; D67-R70 WeakPolarHBondContact O-CG 3.47Å; D67-R70 PolarHBondContact O-N 3.34Å; D67-R70 IonicContact OD2-NE 2.82Å; D67-R70 PolarHBondContact OD2-NE 2.92Å
68	L	96.1	Very high	94.7	Very high	36 Å²	36	75.4 Å²	75.4	19%	0.188	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-0.5	-177.1	-53	-178.5	0	0	0	114.4	Y37 P66 R70 L71 K80 V83 A84	Y37-L68 HydrophobicContact CD2-CD2 4.17Å; P66-L68 PolarHBondContact O-N 3.24Å; P66-L68 VanDerWaalsContact O-N 3.09Å; L68-R70 VanDerWaalsContact C-N 3.29Å; L68-L71 HydrophobicContact CB-CD1 3.96Å; L68-L71 HydrophobicContact CD2-CD1 3.86Å; L68-L71 WeakPolarHBondContact O-CD1 3.5Å; L68-K80 HydrophobicContact CB-CG 4.5Å; L68-K80 VanDerWaalsContact O-CE 3.28Å; L68-K80 WeakPolarHBondContact O-CE 3.45Å; L68-K80 PolarHBondContact O-NZ 3.41Å; L68-V83 HydrophobicContact CD2-CB 4.36Å; L68-V83 HydrophobicContact CD2-CG1 3.63Å; L68-A84 HydrophobicContact CD1-CB 3.4Å
69	S	95.2	Very high	94.6	Very high	86 Å²	86	75.1 Å²	75.1	60%	0.601	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-18	168.5	77.8	0	0	0	0	112.7	D67 L71	D67-S69 PolarHBondContact O-N 3.41Å; D67-S69 VanDerWaalsContact OD1-CB 3.22Å; D67-S69 WeakPolarHBondContact OD1-CB 3.3Å; D67-S69 PolarHBondContact OD1-N 3.38Å; D67-S69 PolarHBondContact OD1-OG 2.83Å; D67-S69 PolarHBondContact OD2-OG 3.02Å; S69-L71 VanDerWaalsContact C-N 3.34Å
70	R	96	Very high	94.7	Very high	131 Å²	131	79 Å²	79	49%	0.494	39%	0.393	S	S	.	.	S	Bend	trans	-78.4	-12.1	179.8	-60.9	-66.7	176.9	152.4	-3.2	114.8	Y37 A41 E43 D67 L68	Y37-R70 WeakPolarHBondContact OH-CB 3.46Å; A41-R70 HydrophobicContact CB-CB 4.31Å; E43-R70 WeakPolarHBondContact OE1-CD 3.26Å; E43-R70 WeakPolarHBondContact OE1-CG 3.25Å; D67-R70 HydrophobicContact CB-CG 3.96Å; D67-R70 WeakPolarHBondContact O-CB 3.42Å; D67-R70 WeakPolarHBondContact O-CG 3.47Å; D67-R70 PolarHBondContact O-N 3.34Å; D67-R70 IonicContact OD2-NE 2.82Å; D67-R70 PolarHBondContact OD2-NE 2.92Å; L68-R70 VanDerWaalsContact C-N 3.29Å
71	L	96	Very high	94.9	Very high	15 Å²	15	87.4 Å²	87.4	8%	0.079	42%	0.423	C	S	.	.	S	Bend	trans	-62.1	149.5	176.6	-75.7	73.8	0	0	0	110.3	Y37 M40 L68 S69 C75 K80	Y37-L71 HydrophobicContact CD2-CD1 4.06Å; Y37-L71 HydrophobicContact CE2-CD1 4.14Å; M40-L71 HydrophobicContact CB-CB 4.38Å; M40-L71 HydrophobicContact CB-CD2 3.83Å; M40-L71 HydrophobicContact CB-CG 3.74Å; M40-L71 HydrophobicContact CG-CD2 4.36Å; M40-L71 WeakPolarHBondContact O-CA 3.28Å; L68-L71 HydrophobicContact CB-CD1 3.96Å; L68-L71 HydrophobicContact CD2-CD1 3.86Å; L68-L71 WeakPolarHBondContact O-CD1 3.5Å; S69-L71 VanDerWaalsContact C-N 3.34Å; L71-C75 HydrophobicContact CB-CB 4.19Å; L71-K80 HydrophobicContact CD2-CB 4.11Å; L71-K80 HydrophobicContact CD2-CG 4.15Å
72	Y	94.5	Very high	95.1	Very high	107 Å²	107	80.5 Å²	80.5	42%	0.42	40%	0.397	S	S	.	.			trans	-55.5	146.6	-179.4	71.8	-91.3	0	0	0	112.5	M40 N74 C75 P76	M40-Y72 HydrophobicContact CB-CD1 4.47Å; M40-Y72 HydrophobicContact CB-CE1 4.5Å; M40-Y72 HydrophobicContact CE-CE1 4.47Å; M40-Y72 VanDerWaalsContact O-CD1 3.26Å; M40-Y72 WeakPolarHBondContact O-CD1 3.38Å; M40-Y72 PolarHBondContact O-N 3.46Å; M40-Y72 HydrophobicContact SD-CD1 4.44Å; M40-Y72 HydrophobicContact SD-CE1 3.59Å; M40-Y72 VanDerWaalsContact SD-CE1 3.59Å; Y72-N74 HydrophobicContact CD2-CB 4.16Å; Y72-N74 HydrophobicContact CE2-CB 4.1Å; Y72-N74 WeakPolarHBondContact CE2-O 3.4Å; Y72-N74 PolarHBondContact O-N 3.36Å; Y72-C75 HydrophobicContact CD1-CB 4.02Å; Y72-C75 HydrophobicContact CD2-CB 4.24Å; Y72-C75 VanDerWaalsContact CD2-N 3.35Å; Y72-C75 HydrophobicContact CE1-CB 3.84Å; Y72-C75 HydrophobicContact CE2-CB 4.08Å; Y72-C75 HydrophobicContact CG-CB 4.2Å; Y72-C75 VanDerWaalsContact CZ-CA 3.4Å; Y72-C75 WeakPolarHBondContact O-CB 3.43Å; Y72-C75 PolarHBondContact O-N 3.09Å; Y72-P76 WeakPolarHBondContact OH-CD 3.43Å
73	K	91.3	Very high	95.3	Very high	210 Å²	210	79.2 Å²	79.2	91%	0.913	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-35.2	-169.3	-68.3	-178.9	179.8	176.7	0	114.7
74	N	89.3	Confident	95.5	Very high	144 Å²	144	72.5 Å²	72.5	77%	0.77	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	20	-177.5	-63.5	-24.8	0	0	0	113	Y72 P76	Y72-N74 HydrophobicContact CD2-CB 4.16Å; Y72-N74 HydrophobicContact CE2-CB 4.1Å; Y72-N74 WeakPolarHBondContact CE2-O 3.4Å; Y72-N74 PolarHBondContact O-N 3.36Å; N74-P76 WeakPolarHBondContact O-CD 3.3Å
75	C	92.9	Very high	95.7	Very high	19 Å²	19	73.9 Å²	73.9	13%	0.128	37%	0.368	C	S	.	.			trans	-60.4	125.5	-179.9	-175.5	0	0	0	0	110.5	L71 Y72 K77	L71-C75 HydrophobicContact CB-CB 4.19Å; Y72-C75 HydrophobicContact CD1-CB 4.02Å; Y72-C75 HydrophobicContact CD2-CB 4.24Å; Y72-C75 VanDerWaalsContact CD2-N 3.35Å; Y72-C75 HydrophobicContact CE1-CB 3.84Å; Y72-C75 HydrophobicContact CE2-CB 4.08Å; Y72-C75 HydrophobicContact CG-CB 4.2Å; Y72-C75 VanDerWaalsContact CZ-CA 3.4Å; Y72-C75 WeakPolarHBondContact O-CB 3.43Å; Y72-C75 PolarHBondContact O-N 3.09Å; C75-K77 PolarHBondContact O-N 3.4Å
76	P	94.6	Very high	95.8	Very high	26 Å²	26	70.1 Å²	70.1	17%	0.169	34%	0.342	C	S	.	.			trans	-53.1	131.5	177.1	-28.2	34.7	0	0	0	111	Y72 N74 A78 M79 K80 L107 L111	Y72-P76 WeakPolarHBondContact OH-CD 3.43Å; N74-P76 WeakPolarHBondContact O-CD 3.3Å; P76-A78 PolarHBondContact O-N 2.98Å; P76-A78 VanDerWaalsContact O-N 3.14Å; P76-M79 HydrophobicContact CB-CB 4.1Å; P76-M79 WeakPolarHBondContact O-CA 3.46Å; P76-M79 WeakPolarHBondContact O-CB 3.34Å; P76-M79 PolarHBondContact O-N 2.88Å; P76-K80 PolarHBondContact O-N 3.46Å; P76-L107 HydrophobicContact CB-CD2 3.92Å; P76-L111 HydrophobicContact CG-CD2 3.7Å
77	K	94.7	Very high	95.9	Very high	191 Å²	191	70.6 Å²	70.6	83%	0.83	34%	0.344	S	S	*	.	H	α-helix	trans	-55.2	-37.2	-178.9	-67.2	-176.8	-179.1	178	0	112.3	C75 K80 R81	C75-K77 PolarHBondContact O-N 3.4Å; K77-K80 PolarHBondContact O-N 3.14Å; K77-R81 WeakPolarHBondContact O-CB 3.48Å; K77-R81 PolarHBondContact O-N 2.99Å
78	A	95.6	Very high	96	Very high	53 Å²	53	70.6 Å²	70.6	44%	0.438	34%	0.341	S	S	.	.	H	α-helix	trans	-68.5	-34.7	176.4	0	0	0	0	0	112.6	P76 R81 L82 L107	P76-A78 PolarHBondContact O-N 2.98Å; P76-A78 VanDerWaalsContact O-N 3.14Å; A78-R81 PolarHBondContact O-N 3.37Å; A78-L82 WeakPolarHBondContact O-CB 3.49Å; A78-L82 PolarHBondContact O-N 3.3Å; A78-L107 HydrophobicContact CB-CD1 4.17Å; A78-L107 HydrophobicContact CB-CD2 3.51Å; A78-L107 HydrophobicContact CB-CG 4.01Å
79	M	96.5	Very high	95.9	Very high	28 Å²	28	74 Å²	74	14%	0.138	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-46.5	172.2	-177.4	57.8	76.9	0	0	111.1	M40 P76 R81 L82 V83 L107	M40-M79 HydrophobicContact CG-CG 3.96Å; M40-M79 HydrophobicContact SD-CG 3.55Å; M40-M79 VanDerWaalsContact SD-CG 3.55Å; M40-M79 HydrophobicContact SD-SD 4.43Å; P76-M79 HydrophobicContact CB-CB 4.1Å; P76-M79 WeakPolarHBondContact O-CA 3.46Å; P76-M79 WeakPolarHBondContact O-CB 3.34Å; P76-M79 PolarHBondContact O-N 2.88Å; M79-R81 PolarHBondContact O-N 2.81Å; M79-L82 WeakPolarHBondContact O-CB 3.42Å; M79-L82 PolarHBondContact O-N 3.11Å; M79-L82 VanDerWaalsContact O-N 3.15Å; M79-L82 HydrophobicContact SD-CD2 4.27Å; M79-V83 WeakPolarHBondContact O-CG2 3.42Å; M79-V83 PolarHBondContact O-N 3.46Å; M79-L107 HydrophobicContact CB-CD1 4.1Å; M79-L107 HydrophobicContact CE-CD1 4.07Å
80	K	97.2	Very high	96	Very high	86 Å²	86	73 Å²	73	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-56.9	-40	175.1	-179.9	167.9	176.4	157	0	112.1	L68 L71 P76 K77 A84	L68-K80 HydrophobicContact CB-CG 4.5Å; L68-K80 VanDerWaalsContact O-CE 3.28Å; L68-K80 WeakPolarHBondContact O-CE 3.45Å; L68-K80 PolarHBondContact O-NZ 3.41Å; L71-K80 HydrophobicContact CD2-CB 4.11Å; L71-K80 HydrophobicContact CD2-CG 4.15Å; P76-K80 PolarHBondContact O-N 3.46Å; K77-K80 PolarHBondContact O-N 3.14Å; K80-A84 PolarHBondContact O-N 3.39Å; K80-A84 VanDerWaalsContact O-N 3.12Å
81	R	97.8	Very high	95.9	Very high	179 Å²	179	68.9 Å²	68.9	68%	0.675	33%	0.331	S	S	*	.	H	α-helix	trans	-66.1	-45.5	175.9	-162.3	-178.3	-152.6	128	3.8	111.9	K77 A78 M79 V83 A84 D85	K77-R81 WeakPolarHBondContact O-CB 3.48Å; K77-R81 PolarHBondContact O-N 2.99Å; A78-R81 PolarHBondContact O-N 3.37Å; M79-R81 PolarHBondContact O-N 2.81Å; R81-V83 VanDerWaalsContact C-N 3.34Å; R81-V83 PolarHBondContact O-N 2.77Å; R81-A84 WeakPolarHBondContact O-CA 3.36Å; R81-A84 VanDerWaalsContact O-CB 3.32Å; R81-A84 WeakPolarHBondContact O-CB 3.41Å; R81-A84 PolarHBondContact O-N 2.93Å; R81-A84 VanDerWaalsContact O-N 3.08Å; R81-D85 PolarHBondContact O-N 2.95Å
82	L	98.2	Very high	96	Very high	8 Å²	8	74.4 Å²	74.4	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-45.9	176.9	-179.1	63.6	0	0	0	111.8	L36 A78 M79 A84 D85 C86 I100 I104	L36-L82 HydrophobicContact CD1-CD2 4.26Å; L36-L82 HydrophobicContact CD1-CG 4.31Å; A78-L82 WeakPolarHBondContact O-CB 3.49Å; A78-L82 PolarHBondContact O-N 3.3Å; M79-L82 WeakPolarHBondContact O-CB 3.42Å; M79-L82 PolarHBondContact O-N 3.11Å; M79-L82 VanDerWaalsContact O-N 3.15Å; M79-L82 HydrophobicContact SD-CD2 4.27Å; L82-A84 VanDerWaalsContact C-N 3.32Å; L82-A84 PolarHBondContact O-N 3.27Å; L82-D85 PolarHBondContact O-N 2.89Å; L82-C86 PolarHBondContact O-N 2.79Å; L82-C86 PolarHBondContact O-SG 3.2Å; L82-I100 HydrophobicContact CD1-CB 4.44Å; L82-I100 HydrophobicContact CD1-CG1 4.24Å; L82-I100 HydrophobicContact CD1-CG2 4.25Å; L82-I100 HydrophobicContact CD2-CG2 4.31Å; L82-I104 HydrophobicContact CD2-CD1 4.1Å; L82-I104 HydrophobicContact CD2-CG1 3.56Å
83	V	98.3	Very high	96.1	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-56.8	-48.3	173.8	177.9	0	0	0	0	110.3	L36 L68 M79 R81 D85 C86 V87	L36-V83 HydrophobicContact CB-CG2 3.75Å; L36-V83 HydrophobicContact CD1-CG2 4.45Å; L68-V83 HydrophobicContact CD2-CB 4.36Å; L68-V83 HydrophobicContact CD2-CG1 3.63Å; M79-V83 WeakPolarHBondContact O-CG2 3.42Å; M79-V83 PolarHBondContact O-N 3.46Å; R81-V83 VanDerWaalsContact C-N 3.34Å; R81-V83 PolarHBondContact O-N 2.77Å; V83-D85 VanDerWaalsContact C-N 3.33Å; V83-D85 PolarHBondContact O-N 3.24Å; V83-C86 PolarHBondContact O-N 3.45Å; V83-V87 VanDerWaalsContact O-CG2 3.32Å; V83-V87 WeakPolarHBondContact O-CG2 3.29Å; V83-V87 PolarHBondContact O-N 3.25Å; V83-V87 VanDerWaalsContact O-N 3.13Å
84	A	98.3	Very high	96.5	Very high	31 Å²	31	64.9 Å²	64.9	26%	0.256	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-43	179.9	0	0	0	0	0	112.7	L68 K80 R81 L82 V87 K88	L68-A84 HydrophobicContact CD1-CB 3.4Å; K80-A84 PolarHBondContact O-N 3.39Å; K80-A84 VanDerWaalsContact O-N 3.12Å; R81-A84 WeakPolarHBondContact O-CA 3.36Å; R81-A84 VanDerWaalsContact O-CB 3.32Å; R81-A84 WeakPolarHBondContact O-CB 3.41Å; R81-A84 PolarHBondContact O-N 2.93Å; R81-A84 VanDerWaalsContact O-N 3.08Å; L82-A84 VanDerWaalsContact C-N 3.32Å; L82-A84 PolarHBondContact O-N 3.27Å; A84-V87 PolarHBondContact O-N 3.22Å; A84-K88 WeakPolarHBondContact O-CG 3.47Å; A84-K88 PolarHBondContact O-N 3.25Å
85	D	98.4	Very high	96.9	Very high	53 Å²	53	59 Å²	59	28%	0.283	29%	0.287	S	S	.	.	H	α-helix	trans	-68.7	-38.8	-179.1	-69.2	-29.9	0	0	0	111.7	R81 L82 V83 K88 P95	R81-D85 PolarHBondContact O-N 2.95Å; L82-D85 PolarHBondContact O-N 2.89Å; V83-D85 VanDerWaalsContact C-N 3.33Å; V83-D85 PolarHBondContact O-N 3.24Å; D85-K88 WeakPolarHBondContact O-CG 3.46Å; D85-P95 HydrophobicContact CB-CG 4.46Å
86	C	98.6	Very high	97.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-35.5	175.9	-67.8	0	0	0	0	112.8	V29 Y30 L82 V83 K88 R94	V29-C86 HydrophobicContact CG1-CB 4.04Å; Y30-C86 WeakPolarHBondContact CA-O 3.21Å; L82-C86 PolarHBondContact O-N 2.79Å; L82-C86 PolarHBondContact O-SG 3.2Å; V83-C86 PolarHBondContact O-N 3.45Å; C86-K88 VanDerWaalsContact C-N 3.34Å; C86-K88 PolarHBondContact O-N 3.39Å; C86-R94 VanDerWaalsContact O-CD 3.28Å; C86-R94 WeakPolarHBondContact O-CD 3.3Å
87	V	98.3	Very high	97.3	Very high	13 Å²	13	64.6 Å²	64.6	8%	0.079	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	17.1	-175.9	-54.4	0	0	0	0	113.8	Y30 I34 P66 V83 A84	Y30-V87 HydrophobicContact CD2-CB 4.32Å; Y30-V87 HydrophobicContact CE2-CB 4.07Å; Y30-V87 WeakPolarHBondContact CE2-O 3.45Å; I34-V87 HydrophobicContact CD1-CG1 4.01Å; P66-V87 HydrophobicContact CG-CB 4.35Å; P66-V87 HydrophobicContact CG-CG1 4.29Å; P66-V87 HydrophobicContact CG-CG2 4.31Å; V83-V87 VanDerWaalsContact O-CG2 3.32Å; V83-V87 WeakPolarHBondContact O-CG2 3.29Å; V83-V87 PolarHBondContact O-N 3.25Å; V83-V87 VanDerWaalsContact O-N 3.13Å; A84-V87 PolarHBondContact O-N 3.22Å
88	K	98	Very high	97.5	Very high	66 Å²	66	59.8 Å²	59.8	29%	0.287	30%	0.299	S	S	.	.			trans	-60.4	144.7	176.4	-76.8	-174.6	170.1	-162.4	0	112.4	A84 D85 C86 E93 R94	A84-K88 WeakPolarHBondContact O-CG 3.47Å; A84-K88 PolarHBondContact O-N 3.25Å; D85-K88 WeakPolarHBondContact O-CG 3.46Å; C86-K88 VanDerWaalsContact C-N 3.34Å; C86-K88 PolarHBondContact O-N 3.39Å; K88-E93 HydrophobicContact CB-CB 4.43Å; K88-E93 HydrophobicContact CD-CB 3.48Å; K88-E93 VanDerWaalsContact CD-CB 3.48Å; K88-E93 WeakPolarHBondContact CD-OE2 3.26Å; K88-E93 IonicContact NZ-OE2 2.83Å; K88-E93 PolarHBondContact NZ-OE2 3.23Å; K88-R94 HydrophobicContact CB-CG 4.15Å; K88-R94 PolarHBondContact O-NE 2.95Å; K88-R94 PolarHBondContact O-NH2 3.14Å; K88-R94 VanDerWaalsContact O-NH2 3.07Å
89	K	95.5	Very high	97.6	Very high	108 Å²	108	62.6 Å²	62.6	47%	0.47	30%	0.303	S	S	.	.	S	Bend	trans	-64.8	-44.6	179.2	-176.7	-175.9	-177.6	173.3	0	112.4	R61 R94	R61-K89 PolarHBondContact O-NZ 3.38Å; K89-R94 PolarHBondContact O-NH2 3.08Å
90	V	95.3	Very high	97.7	Very high	65 Å²	65	61.4 Å²	61.4	39%	0.394	30%	0.297	S	S	.	.	S	Bend	trans	-80	120.7	178.3	-178.7	0	0	0	0	108	E92 E93	V90-E92 VanDerWaalsContact C-N 3.31Å; V90-E92 HydrophobicContact CG1-CB 4.42Å; V90-E92 VanDerWaalsContact CG1-OE2 3.25Å; V90-E92 WeakPolarHBondContact CG1-OE2 3.4Å; V90-E92 PolarHBondContact O-N 2.82Å; V90-E93 HydrophobicContact CB-CB 4.37Å; V90-E93 HydrophobicContact CB-CG 3.93Å; V90-E93 HydrophobicContact CG1-CG 3.96Å; V90-E93 PolarHBondContact O-N 2.75Å
91	K	95.8	Very high	97.8	Very high	45 Å²	45	61.8 Å²	61.8	20%	0.196	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-66.3	-34.7	-171.2	67.9	-176.9	177.9	-175.2	0	111.9	E13 D19 Q26 E93 R94	E13-K91 HydrophobicContact CG-CD 4.22Å; D19-K91 IonicContact OD2-NZ 2.68Å; D19-K91 PolarHBondContact OD2-NZ 2.73Å; Q26-K91 HydrophobicContact CB-CB 3.87Å; Q26-K91 HydrophobicContact CG-CB 4.45Å; Q26-K91 VanDerWaalsContact CG-O 3.26Å; Q26-K91 WeakPolarHBondContact CG-O 3.48Å; K91-E93 PolarHBondContact O-N 2.92Å; K91-R94 WeakPolarHBondContact O-CB 3.44Å; K91-R94 PolarHBondContact O-N 3.26Å
92	E	96.3	Very high	97.8	Very high	131 Å²	131	56.7 Å²	56.7	61%	0.612	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20	180	-61.7	72.7	-158.8	0	0	113.2	V90 R94	V90-E92 VanDerWaalsContact C-N 3.31Å; V90-E92 HydrophobicContact CG1-CB 4.42Å; V90-E92 VanDerWaalsContact CG1-OE2 3.25Å; V90-E92 WeakPolarHBondContact CG1-OE2 3.4Å; V90-E92 PolarHBondContact O-N 2.82Å; E92-R94 VanDerWaalsContact C-N 3.3Å
93	E	97.9	Very high	97.7	Very high	106 Å²	106	58.7 Å²	58.7	50%	0.495	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-84.3	-7.5	176.6	-66.5	-173.2	-155.6	0	0	113.3	K88 V90 K91	K88-E93 HydrophobicContact CB-CB 4.43Å; K88-E93 HydrophobicContact CD-CB 3.48Å; K88-E93 VanDerWaalsContact CD-CB 3.48Å; K88-E93 WeakPolarHBondContact CD-OE2 3.26Å; K88-E93 IonicContact NZ-OE2 2.83Å; K88-E93 PolarHBondContact NZ-OE2 3.23Å; V90-E93 HydrophobicContact CB-CB 4.37Å; V90-E93 HydrophobicContact CB-CG 3.93Å; V90-E93 HydrophobicContact CG1-CG 3.96Å; V90-E93 PolarHBondContact O-N 2.75Å; K91-E93 PolarHBondContact O-N 2.92Å
94	R	98.5	Very high	97.6	Very high	10 Å²	10	60.7 Å²	60.7	4%	0.038	32%	0.32	C	S	.	.	S	Bend	trans	-79.6	141.1	178.4	-58.2	176.9	-164.7	144.8	11.6	109.7	E13 Q26 V29 C86 K88 K89 K91 E92	E13-R94 IonicContact OE1-CZ 3.65Å; E13-R94 IonicContact OE1-NH1 3.61Å; E13-R94 PolarHBondContact OE1-NH1 3.02Å; E13-R94 IonicContact OE1-NH2 2.79Å; E13-R94 PolarHBondContact OE1-NH2 2.92Å; E13-R94 IonicContact OE2-CZ 3.4Å; E13-R94 IonicContact OE2-NH1 3.39Å; E13-R94 IonicContact OE2-NH2 3.47Å; E13-R94 PolarHBondContact OE2-NH2 2.84Å; Q26-R94 WeakPolarHBondContact O-CD 3.26Å; Q26-R94 PolarHBondContact O-NH1 3.23Å; V29-R94 HydrophobicContact CG1-CB 3.93Å; C86-R94 VanDerWaalsContact O-CD 3.28Å; C86-R94 WeakPolarHBondContact O-CD 3.3Å; K88-R94 HydrophobicContact CB-CG 4.15Å; K88-R94 PolarHBondContact O-NE 2.95Å; K88-R94 PolarHBondContact O-NH2 3.14Å; K88-R94 VanDerWaalsContact O-NH2 3.07Å; K89-R94 PolarHBondContact O-NH2 3.08Å; K91-R94 WeakPolarHBondContact O-CB 3.44Å; K91-R94 PolarHBondContact O-N 3.26Å; E92-R94 VanDerWaalsContact C-N 3.3Å
95	P	98.4	Very high	97.4	Very high	20 Å²	20	63.6 Å²	63.6	13%	0.13	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-68.2	158.6	175.2	30.1	-35	0	0	0	111.1	V29 D85 Q99 I100	V29-P95 WeakPolarHBondContact CG1-O 3.04Å; V29-P95 WeakPolarHBondContact CG2-O 3.33Å; D85-P95 HydrophobicContact CB-CG 4.46Å; P95-Q99 HydrophobicContact CB-CB 4.14Å; P95-I100 HydrophobicContact CB-CG1 4.02Å; P95-I100 HydrophobicContact CG-CD1 4.1Å; P95-I100 HydrophobicContact CG-CG1 3.68Å
96	L	98.2	Very high	97.2	Very high	77 Å²	77	67.1 Å²	67.1	40%	0.403	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-85.8	157	168	-62.2	176.5	0	0	0	110.7	P98 Q99 I100	L96-P98 VanDerWaalsContact C-CD 3.41Å; L96-P98 VanDerWaalsContact C-N 3.3Å; L96-P98 VanDerWaalsContact O-N 3.13Å; L96-Q99 WeakPolarHBondContact O-CB 3.35Å; L96-Q99 PolarHBondContact O-N 3.33Å; L96-I100 WeakPolarHBondContact O-CG1 3.47Å; L96-I100 PolarHBondContact O-N 2.9Å
97	F	98.5	Very high	96.9	Very high	86 Å²	86	67.8 Å²	67.8	38%	0.377	35%	0.349	S	S	.	.	H	α-helix	trans	-49.4	-38.5	179	-81.9	-71.7	0	0	0	115.6	D28 V29 Y32 Q99 I100 L101	D28-F97 HydrophobicContact CB-CE2 4.21Å; V29-F97 HydrophobicContact CG2-CD2 3.99Å; V29-F97 HydrophobicContact CG2-CE2 3.83Å; V29-F97 HydrophobicContact CG2-CZ 4.29Å; Y32-F97 AromaticContact CD1-CE1 3.85Å; Y32-F97 HydrophobicContact CD1-CE1 3.85Å; Y32-F97 HydrophobicContact CD2-CE1 4.22Å; Y32-F97 HydrophobicContact CE1-CE1 4.36Å; Y32-F97 AromaticContact CG-CE1 3.77Å; Y32-F97 HydrophobicContact CG-CE1 3.77Å; Y32-F97 HydrophobicContact CG-CZ 4.18Å; F97-Q99 VanDerWaalsContact C-N 3.31Å; F97-Q99 PolarHBondContact O-N 3.26Å; F97-I100 HydrophobicContact CD1-CD1 4.13Å; F97-I100 HydrophobicContact CE1-CD1 4.43Å; F97-I100 PolarHBondContact O-N 2.83Å; F97-L101 WeakPolarHBondContact O-CB 3.29Å; F97-L101 PolarHBondContact O-N 2.65Å
98	P	98.4	Very high	96.5	Very high	91 Å²	91	73.7 Å²	73.7	59%	0.591	38%	0.376	S	S	*	.	H	α-helix	trans	-58	-41.1	173.9	-27.2	36.6	0	0	0	113.3	L96 S102	L96-P98 VanDerWaalsContact C-CD 3.41Å; L96-P98 VanDerWaalsContact C-N 3.3Å; L96-P98 VanDerWaalsContact O-N 3.13Å; P98-S102 PolarHBondContact O-N 2.86Å; P98-S102 VanDerWaalsContact O-N 3.07Å; P98-S102 PolarHBondContact O-OG 3.26Å; P98-S102 VanDerWaalsContact O-OG 3.07Å
99	Q	98.1	Very high	96	Very high	111 Å²	111	78.3 Å²	78.3	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-71.1	-37.3	177.7	-61.4	170.2	-54.7	0	0	111.7	P95 L96 F97 S103	P95-Q99 HydrophobicContact CB-CB 4.14Å; L96-Q99 WeakPolarHBondContact O-CB 3.35Å; L96-Q99 PolarHBondContact O-N 3.33Å; F97-Q99 VanDerWaalsContact C-N 3.31Å; F97-Q99 PolarHBondContact O-N 3.26Å; Q99-S103 WeakPolarHBondContact O-CB 3.35Å; Q99-S103 PolarHBondContact O-N 2.84Å; Q99-S103 PolarHBondContact O-OG 3.32Å
100	I	98.4	Very high	95.5	Very high	3 Å²	3	77.2 Å²	77.2	2%	0.015	40%	0.404	C	S	.	.	H	α-helix	trans	-61.5	-49.4	174.8	-63	172.9	0	0	0	109.8	V29 Y32 L82 P95 L96 F97 S103 I104	V29-I100 HydrophobicContact CB-CD1 4.45Å; V29-I100 HydrophobicContact CG1-CD1 3.8Å; V29-I100 HydrophobicContact CG2-CD1 3.97Å; Y32-I100 HydrophobicContact CD1-CD1 4.49Å; Y32-I100 HydrophobicContact CD1-CG2 4.28Å; Y32-I100 HydrophobicContact CE1-CG2 3.7Å; L82-I100 HydrophobicContact CD1-CB 4.44Å; L82-I100 HydrophobicContact CD1-CG1 4.24Å; L82-I100 HydrophobicContact CD1-CG2 4.25Å; L82-I100 HydrophobicContact CD2-CG2 4.31Å; P95-I100 HydrophobicContact CB-CG1 4.02Å; P95-I100 HydrophobicContact CG-CD1 4.1Å; P95-I100 HydrophobicContact CG-CG1 3.68Å; L96-I100 WeakPolarHBondContact O-CG1 3.47Å; L96-I100 PolarHBondContact O-N 2.9Å; F97-I100 HydrophobicContact CD1-CD1 4.13Å; F97-I100 HydrophobicContact CE1-CD1 4.43Å; F97-I100 PolarHBondContact O-N 2.83Å; I100-S103 WeakPolarHBondContact O-CB 3.29Å; I100-S103 PolarHBondContact O-N 2.87Å; I100-S103 VanDerWaalsContact O-N 3.16Å; I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 HydrophobicContact CG2-CG1 4.49Å; I100-I104 WeakPolarHBondContact O-CG1 3.39Å; I100-I104 PolarHBondContact O-N 3.34Å
101	L	98	Very high	95	Very high	95 Å²	95	78 Å²	78	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-58.6	-51.4	178.9	177.6	61.2	0	0	0	111.1	F97 S103 I104 E105	F97-L101 WeakPolarHBondContact O-CB 3.29Å; F97-L101 PolarHBondContact O-N 2.65Å; L101-S103 PolarHBondContact O-N 2.88Å; L101-I104 PolarHBondContact O-N 3.21Å; L101-E105 HydrophobicContact CD1-CG 4.09Å; L101-E105 HydrophobicContact CG-CG 4.39Å; L101-E105 WeakPolarHBondContact O-CG 3.49Å; L101-E105 PolarHBondContact O-N 3.3Å
102	S	97.4	Very high	94.2	Very high	71 Å²	71	81.2 Å²	81.2	50%	0.497	43%	0.431	S	S	.	.	H	α-helix	trans	-57.6	-36.3	177.1	-59.4	0	0	0	0	112.6	P98 L106	P98-S102 PolarHBondContact O-N 2.86Å; P98-S102 VanDerWaalsContact O-N 3.07Å; P98-S102 PolarHBondContact O-OG 3.26Å; P98-S102 VanDerWaalsContact O-OG 3.07Å; S102-L106 WeakPolarHBondContact O-CB 3.39Å; S102-L106 PolarHBondContact O-N 3.09Å; S102-L106 VanDerWaalsContact O-N 3.1Å
103	S	96.6	Very high	93.3	Very high	51 Å²	51	84 Å²	84	36%	0.357	44%	0.442	S	S	.	.	H	α-helix	trans	-67.9	-40.5	176.4	-58.7	0	0	0	0	112.2	Q99 I100 L101 L107	Q99-S103 WeakPolarHBondContact O-CB 3.35Å; Q99-S103 PolarHBondContact O-N 2.84Å; Q99-S103 PolarHBondContact O-OG 3.32Å; I100-S103 WeakPolarHBondContact O-CB 3.29Å; I100-S103 PolarHBondContact O-N 2.87Å; I100-S103 VanDerWaalsContact O-N 3.16Å; L101-S103 PolarHBondContact O-N 2.88Å; S103-L107 WeakPolarHBondContact O-CB 3.22Å; S103-L107 WeakPolarHBondContact O-CG 3.48Å; S103-L107 PolarHBondContact O-N 3.4Å; S103-L107 VanDerWaalsContact O-N 3.08Å
104	I	96	Very high	92.3	Very high	42 Å²	42	86.7 Å²	86.7	22%	0.215	46%	0.457	C	S	.	.	H	α-helix	trans	-68.9	-42.9	177.9	-68.2	171.9	0	0	0	111.1	Y32 L82 I100 L101 L107 Q108	Y32-I104 HydrophobicContact CE1-CD1 4.44Å; L82-I104 HydrophobicContact CD2-CD1 4.1Å; L82-I104 HydrophobicContact CD2-CG1 3.56Å; I100-I104 HydrophobicContact CG2-CD1 3.82Å; I100-I104 HydrophobicContact CG2-CG1 4.49Å; I100-I104 WeakPolarHBondContact O-CG1 3.39Å; I100-I104 PolarHBondContact O-N 3.34Å; L101-I104 PolarHBondContact O-N 3.21Å; I104-L107 WeakPolarHBondContact O-CB 3.47Å; I104-L107 PolarHBondContact O-N 3.48Å; I104-Q108 PolarHBondContact O-N 3.11Å
105	E	95.5	Very high	90.9	Very high	91 Å²	91	93.2 Å²	93.2	43%	0.425	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-46.8	177.1	-71.8	174.5	157.3	0	0	111.1	L101 L107 Q108 H109	L101-E105 HydrophobicContact CD1-CG 4.09Å; L101-E105 HydrophobicContact CG-CG 4.39Å; L101-E105 WeakPolarHBondContact O-CG 3.49Å; L101-E105 PolarHBondContact O-N 3.3Å; E105-L107 VanDerWaalsContact C-N 3.28Å; E105-L107 PolarHBondContact O-N 3.5Å; E105-Q108 WeakPolarHBondContact O-CB 3.37Å; E105-Q108 PolarHBondContact O-N 3.21Å; E105-Q108 VanDerWaalsContact O-N 3.14Å; E105-H109 PolarHBondContact O-CD2 3.46Å; E105-H109 PolarHBondContact O-N 3.05Å; E105-H109 VanDerWaalsContact O-N 3.11Å
106	L	94	Very high	89.6	Confident	128 Å²	128	103 Å²	103	67%	0.67	53%	0.528	S	S	*	.	H	α-helix	trans	-58.6	-42.5	175.6	-178.6	63.1	0	0	0	111.7	S102 H109 S110	S102-L106 WeakPolarHBondContact O-CB 3.39Å; S102-L106 PolarHBondContact O-N 3.09Å; S102-L106 VanDerWaalsContact O-N 3.1Å; L106-H109 PolarHBondContact O-N 3.44Å; L106-S110 PolarHBondContact O-N 3.34Å
107	L	91.9	Very high	88.3	Confident	13 Å²	13	104.5 Å²	104.5	7%	0.068	54%	0.544	C	S	.	.	H	α-helix	trans	-60.7	-46.6	174.6	-86.9	166.3	0	0	0	111.8	P76 A78 M79 S103 I104 E105 H109 S110 L111	P76-L107 HydrophobicContact CB-CD2 3.92Å; A78-L107 HydrophobicContact CB-CD1 4.17Å; A78-L107 HydrophobicContact CB-CD2 3.51Å; A78-L107 HydrophobicContact CB-CG 4.01Å; M79-L107 HydrophobicContact CB-CD1 4.1Å; M79-L107 HydrophobicContact CE-CD1 4.07Å; S103-L107 WeakPolarHBondContact O-CB 3.22Å; S103-L107 WeakPolarHBondContact O-CG 3.48Å; S103-L107 PolarHBondContact O-N 3.4Å; S103-L107 VanDerWaalsContact O-N 3.08Å; I104-L107 WeakPolarHBondContact O-CB 3.47Å; I104-L107 PolarHBondContact O-N 3.48Å; E105-L107 VanDerWaalsContact C-N 3.28Å; E105-L107 PolarHBondContact O-N 3.5Å; L107-H109 VanDerWaalsContact C-N 3.27Å; L107-H109 PolarHBondContact O-N 3.14Å; L107-S110 PolarHBondContact O-N 3.15Å; L107-S110 PolarHBondContact O-OG 2.95Å; L107-L111 WeakPolarHBondContact O-CG 3.36Å; L107-L111 PolarHBondContact O-N 2.99Å; L107-L111 VanDerWaalsContact O-N 3.12Å
108	Q	90.2	Very high	86.7	Confident	138 Å²	138	105 Å²	105	65%	0.645	56%	0.564	S	S	*	*	H	α-helix	trans	-58.9	-38.4	-179.6	-173.7	179.9	2	0	0	112.2	I104 E105 S110	I104-Q108 PolarHBondContact O-N 3.11Å; E105-Q108 WeakPolarHBondContact O-CB 3.37Å; E105-Q108 PolarHBondContact O-N 3.21Å; E105-Q108 VanDerWaalsContact O-N 3.14Å; Q108-S110 VanDerWaalsContact C-N 3.3Å; Q108-S110 PolarHBondContact O-N 3.3Å
109	H	87.8	Confident	85.4	Confident	162 Å²	162	105.8 Å²	105.8	75%	0.75	57%	0.572	S	S	*	*	H	α-helix	trans	-69.6	-26.4	175.6	-70.4	-61.4	0	0	0	113.6	E105 L106 L107	E105-H109 PolarHBondContact O-CD2 3.46Å; E105-H109 PolarHBondContact O-N 3.05Å; E105-H109 VanDerWaalsContact O-N 3.11Å; L106-H109 PolarHBondContact O-N 3.44Å; L107-H109 VanDerWaalsContact C-N 3.27Å; L107-H109 PolarHBondContact O-N 3.14Å
110	S	84.5	Confident	84	Confident	85 Å²	85	109 Å²	109	59%	0.594	59%	0.587	S	S	*	*	H	α-helix	trans	-85.8	-16.6	179.6	73.7	0	0	0	0	114.2	L106 L107 Q108	L106-S110 PolarHBondContact O-N 3.34Å; L107-S110 PolarHBondContact O-N 3.15Å; L107-S110 PolarHBondContact O-OG 2.95Å; Q108-S110 VanDerWaalsContact C-N 3.3Å; Q108-S110 PolarHBondContact O-N 3.3Å
111	L	84	Confident	82.6	Confident	82 Å²	82	113.9 Å²	113.9	43%	0.429	62%	0.619	S	S	.	*	S	Bend	trans	-82.3	141.9	-178.2	-73.8	176.2	0	0	0	111.6	P76 L107 K113	P76-L111 HydrophobicContact CG-CD2 3.7Å; L107-L111 WeakPolarHBondContact O-CG 3.36Å; L107-L111 PolarHBondContact O-N 2.99Å; L107-L111 VanDerWaalsContact O-N 3.12Å; L111-K113 PolarHBondContact O-N 3.17Å
112	P	79.8	Confident	81.1	Confident	112 Å²	112	114 Å²	114	73%	0.727	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-60	127.1	173.3	24	-30.8	0	0	0	109.1	I114	P112-I114 PolarHBondContact O-N 3.45Å
113	K	76.5	Confident	79.6	Confident	191 Å²	191	117.7 Å²	117.7	83%	0.83	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-60.3	126.4	174.7	-66.4	-177.3	-179.4	179.4	0	108	L111 N115	L111-K113 PolarHBondContact O-N 3.17Å; K113-N115 VanDerWaalsContact C-N 3.33Å; K113-N115 PolarHBondContact O-N 3.12Å
114	I	77.4	Confident	77.8	Confident	161 Å²	161	123.8 Å²	123.8	83%	0.826	66%	0.663	S	S	*	*			trans	-66.1	99.1	172.7	-58.5	173.5	0	0	0	106.5	P112 R116	P112-I114 PolarHBondContact O-N 3.45Å; I114-R116 PolarHBondContact O-N 3.48Å
115	N	69.8	Low	75.8	Confident	147 Å²	147	132.7 Å²	132.7	79%	0.786	69%	0.694	S	S	*	*			trans	-68	104.6	162.9	-72.8	-42.9	0	0	0	105.4	K113 S117	K113-N115 VanDerWaalsContact C-N 3.33Å; K113-N115 PolarHBondContact O-N 3.12Å; N115-S117 PolarHBondContact O-N 3.25Å; N115-S117 VanDerWaalsContact O-N 3.12Å
116	R	71.3	Confident	73.8	Confident	227 Å²	227	133 Å²	133	86%	0.857	71%	0.712	S	S	*	*			trans	-51.4	124.7	164.1	-69.6	-177.6	178	145.6	0	105.6	I114 A118	I114-R116 PolarHBondContact O-N 3.48Å; R116-A118 PolarHBondContact O-N 3.43Å
117	S	69.2	Low	71.8	Confident	108 Å²	108	130.5 Å²	130.5	76%	0.755	71%	0.71	S	S	*	*			trans	-48.8	114.6	168.6	-50.1	0	0	0	0	105.7	N115 S119	N115-S117 PolarHBondContact O-N 3.25Å; N115-S117 VanDerWaalsContact O-N 3.12Å; S117-S119 PolarHBondContact O-N 2.89Å
118	A	65.4	Low	69.6	Low	96 Å²	96	137.7 Å²	137.7	79%	0.793	74%	0.743	S	S	*	*			trans	-67.2	91	173.8	0	0	0	0	0	104.8	R116 E120	R116-A118 PolarHBondContact O-N 3.43Å; A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 2.98Å
119	S	72.1	Confident	67.6	Low	108 Å²	108	138 Å²	138	76%	0.755	75%	0.754	S	S	*	*			trans	-58.4	107.4	162.7	-47.8	0	0	0	0	104.1	S117 P121	S117-S119 PolarHBondContact O-N 2.89Å; S119-P121 WeakPolarHBondContact O-CD 3.38Å; S119-P121 VanDerWaalsContact O-N 3.12Å
120	E	69	Low	65.7	Low	178 Å²	178	137.9 Å²	137.9	83%	0.832	75%	0.754	S	S	*	*			trans	-55.3	124.1	170.4	-79.8	-168.7	153.9	0	0	106.6	A118 S122	A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 2.98Å; E120-S122 PolarHBondContact O-N 3.15Å
121	P	67.4	Low	63.5	Low	106 Å²	106	141.5 Å²	141.5	69%	0.688	77%	0.767	S	S	*	*			trans	-59.2	117.3	172	23.9	-29.6	0	0	0	106.2	S119 L123	S119-P121 WeakPolarHBondContact O-CD 3.38Å; S119-P121 VanDerWaalsContact O-N 3.12Å; P121-L123 VanDerWaalsContact C-N 3.33Å; P121-L123 PolarHBondContact O-N 3.17Å
122	S	67.6	Low	61.8	Low	97 Å²	97	145.5 Å²	145.5	68%	0.678	79%	0.787	S	S	*	*			trans	-64.8	94.9	179.1	60.2	0	0	0	0	108.8	E120 H124	E120-S122 PolarHBondContact O-N 3.15Å; S122-H124 PolarHBondContact O-N 3.23Å
123	L	66.3	Low	59.6	Low	148 Å²	148	147.5 Å²	147.5	78%	0.775	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-69.7	-7.3	179.1	-74.7	170.2	0	0	0	113.1	P121 R125	P121-L123 VanDerWaalsContact C-N 3.33Å; P121-L123 PolarHBondContact O-N 3.17Å; L123-R125 PolarHBondContact O-N 3.4Å; L123-R125 VanDerWaalsContact O-N 3.12Å
124	H	58.3	Low	57.8	Low	179 Å²	179	142.7 Å²	142.7	83%	0.829	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-70.7	-3.4	-175.2	-89.2	83.5	0	0	0	115.8	S122	S122-H124 PolarHBondContact O-N 3.23Å
125	R	54.4	Low	56.2	Low	230 Å²	230	140.4 Å²	140.4	87%	0.868	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-91.9	-11.1	179.9	-167.1	166.6	-71.3	166.4	-0	114.6	L123	L123-R125 PolarHBondContact O-N 3.4Å; L123-R125 VanDerWaalsContact O-N 3.12Å
126	A	52.6	Low	54.6	Low	96 Å²	96	139.2 Å²	139.2	79%	0.793	78%	0.783	S	S	*	*	S	Bend	trans	-102.5	4.3	-171.8	0	0	0	0	0	115.6
127	A	52.2	Low	53.5	Low	76 Å²	76	136.6 Å²	136.6	63%	0.628	79%	0.785	S	S	*	*	S	Bend	trans	-112.2	-5.6	-173.1	0	0	0	0	0	116
128	H	46.8	Very low	52	Low	164 Å²	164	137.6 Å²	137.6	76%	0.759	79%	0.786	S	S	*	*			trans	-123.1	83.5	178.1	-69.5	-78.5	0	0	0	110.8	E130	H128-E130 VanDerWaalsContact C-N 3.25Å
129	T	46.9	Very low	50.8	Low	144 Å²	144	139.2 Å²	139.2	88%	0.883	79%	0.787	S	S	*	*			trans	-90.2	24.6	163.5	39	0	0	0	0	112.6
130	E	48.4	Very low	49.5	Very low	160 Å²	160	138.9 Å²	138.9	75%	0.748	78%	0.784	S	S	*	*			trans	-130.6	91.7	167.3	-65.6	-164	164.7	0	0	107.5	H128	H128-E130 VanDerWaalsContact C-N 3.25Å
131	D	37.3	Very low	48.3	Very low	161 Å²	161	135.9 Å²	135.9	86%	0.861	78%	0.78	S	S	*	*			trans	168.1	85.3	135.5	-79.9	-24.3	0	0	0	109	N133	D131-N133 PolarHBondContact O-N 3.44Å
132	I	50.3	Low	47.1	Very low	166 Å²	166	142.3 Å²	142.3	85%	0.851	79%	0.791	S	S	*	*			trans	-72.8	104.6	159.8	-66.9	171.5	0	0	0	106.3
133	N	33.2	Very low	46	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	80%	0.798	S	S	*	*			trans	-157.4	118.2	142.5	-102.5	-18.5	0	0	0	114	D131	D131-N133 PolarHBondContact O-N 3.44Å
134	A	37.4	Very low	44.7	Very low	90 Å²	90	143 Å²	143	74%	0.744	79%	0.793	S	S	*	*			trans	16	127.5	156	0	0	0	0	0	122
135	C	44.3	Very low	44	Very low	113 Å²	113	141.2 Å²	141.2	76%	0.764	79%	0.794	S	S	*	*			trans	73.5	100.8	142	-153.9	0	0	0	0	117.6
136	T	37.3	Very low	43.4	Very low	121 Å²	121	142.9 Å²	142.9	74%	0.742	81%	0.808	S	S	*	*				-167.8	112.8	111.3	21.7	0	0	0	0	109.3	T138	T136-T138 PolarHBondContact O-N 3.15Å; T136-T138 VanDerWaalsContact O-N 3.14Å
137	L	46.6	Very low	43	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	81%	0.809	S	S	*	*			trans	-57.5	110.5	161.8	-72.9	139.3	0	0	0	107.6
138	T	38.9	Very low	42.5	Very low	128 Å²	128	148.9 Å²	148.9	79%	0.785	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-100.2	117.9	166	76.9	0	0	0	0	108.8	T136 S140	T136-T138 PolarHBondContact O-N 3.15Å; T136-T138 VanDerWaalsContact O-N 3.14Å; T138-S140 PolarHBondContact O-N 3.19Å
139	T	39.6	Very low	42.3	Very low	131 Å²	131	148.1 Å²	148.1	80%	0.804	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-60.2	121.7	-175.9	-37	0	0	0	0	110.3
140	S	45.7	Very low	42	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-63	124.3	166.8	179.5	0	0	0	0	109.7	T138 R142	T138-S140 PolarHBondContact O-N 3.19Å; S140-R142 PolarHBondContact O-N 2.87Å
141	P	42.1	Very low	41.6	Very low	116 Å²	116	147.6 Å²	147.6	75%	0.753	82%	0.822	S	S	*	*			trans	-73.1	113.8	169.9	29.6	-28.8	0	0	0	107.8	L143	P141-L143 PolarHBondContact O-N 2.85Å
142	R	43.8	Very low	41.9	Very low	240 Å²	240	146.7 Å²	146.7	91%	0.906	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-53.6	125.3	168.5	-72.6	179.8	-179.8	171.2	-0.2	108.9	S140	S140-R142 PolarHBondContact O-N 2.87Å
143	L	43.1	Very low	41.3	Very low	159 Å²	159	145.3 Å²	145.3	83%	0.832	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61.9	135.6	163.8	-76.7	158.4	0	0	0	108.8	P141 V145	P141-L143 PolarHBondContact O-N 2.85Å; L143-V145 PolarHBondContact O-N 3.29Å
144	P	40.3	Very low	41.9	Very low	102 Å²	102	144.5 Å²	144.5	66%	0.662	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.9	174	28.2	-30.5	0	0	0	108.9
145	V	43.9	Very low	42.3	Very low	141 Å²	141	149.1 Å²	149.1	86%	0.855	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.2	122.9	165.7	-179.8	0	0	0	0	106.4	L143	L143-V145 PolarHBondContact O-N 3.29Å
146	F	41.8	Very low	42.1	Very low	265 Å²	265	152.4 Å²	152.4	100%	1.162	83%	0.828	S	S	*	*			trans	-78.1	0	167.2	-76.2	-80.6	0	0	0	110.4

Retrieved 146 of 146 residues in 353.8 ms (Link to these results)

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