A0A077Z7A7_TRITR Loading...

Protein kinase domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z7A7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 139 aa.

						>A0A077Z7A7_TRITR|A0A077Z7A7
MKKRKKGKRRILRKKPNALRAPKERRRKNEEGRTLRTVVQEKIDQPKERRMFKIRFPENLLKQLMVTLCILEKKFNFEHRDLHTGNILLKYTKLQPYVVDGKRYQPRASGSLCYMMDFGLSLFGMGCCATLLLLYYLGT
					

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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	46.9	Very low	44.4	Very low	243 Å²	243	204 Å²	204	100%	1.197	91%	0.913	S	S	*	*				0	109.6	0	-72.8	166.6	81.3	0	0	110.3
2	K	45.5	Very low	43.7	Very low	216 Å²	216	200.3 Å²	200.3	94%	0.939	91%	0.906	S	S	*	*			trans	-90.4	111.6	-178.2	-76.1	178.8	176.2	175.7	0	110.9	R4	K2-R4 PolarHBondContact O-N 3.05Å
3	K	44.6	Very low	43.3	Very low	211 Å²	211	202.5 Å²	202.5	92%	0.917	90%	0.903	S	S	*	*			trans	-76.6	112.4	174.8	-73.4	-177.8	177.7	177.3	0	110.5
4	R	44.4	Very low	43	Very low	245 Å²	245	202.2 Å²	202.2	93%	0.925	90%	0.9	S	S	*	*			trans	-82.5	118	171.1	-93.2	177.6	150.7	175.9	-6.1	110.5	K2 K6	K2-R4 PolarHBondContact O-N 3.05Å; R4-K6 PolarHBondContact O-N 2.85Å
5	K	47.9	Very low	42.6	Very low	212 Å²	212	201.3 Å²	201.3	92%	0.922	89%	0.894	S	S	*	*			trans	-69.3	118	170.5	-73.4	179.8	175.9	177.4	0	110	G7	K5-G7 PolarHBondContact O-N 2.64Å
6	K	48.7	Very low	42.4	Very low	209 Å²	209	195.8 Å²	195.8	91%	0.909	89%	0.885	S	S	*	*			trans	-77.7	112.4	170.9	-82.4	-179	176	176.4	0	109.7	R4	R4-K6 PolarHBondContact O-N 2.85Å
7	G	40.8	Very low	42.4	Very low	74 Å²	74	194.3 Å²	194.3	76%	0.763	89%	0.886	S	S	*	*			trans	-66.8	128.1	172.7	0	0	0	0	0	112	K5 R9	K5-G7 PolarHBondContact O-N 2.64Å; G7-R9 PolarHBondContact O-N 2.83Å
8	K	45.7	Very low	42.7	Very low	215 Å²	215	188.1 Å²	188.1	94%	0.935	88%	0.875	S	S	*	*			trans	-66.3	106.7	171.4	-81.5	176.5	173.7	175.9	0	109.3	R10	K8-R10 PolarHBondContact O-N 2.81Å
9	R	42	Very low	43.2	Very low	237 Å²	237	184.2 Å²	184.2	89%	0.894	86%	0.86	S	S	*	*			trans	-69.2	109.5	165.9	-82.8	-176.6	170.2	179.2	-3.1	108.9	G7 I11	G7-R9 PolarHBondContact O-N 2.83Å; R9-I11 PolarHBondContact O-N 2.91Å; R9-I11 VanDerWaalsContact O-N 3.13Å
10	R	37.5	Very low	44	Very low	237 Å²	237	184.8 Å²	184.8	89%	0.894	85%	0.854	S	S	*	*			trans	-68.4	102.3	171.8	-149.6	176.8	-175.1	-177.1	0.9	107.7	K8 L12	K8-R10 PolarHBondContact O-N 2.81Å; R10-L12 PolarHBondContact O-N 2.97Å
11	I	43.9	Very low	44.8	Very low	145 Å²	145	179.8 Å²	179.8	74%	0.744	85%	0.845	S	S	*	*			trans	-70.2	99.4	174.7	-60.7	172.7	0	0	0	107.1	R9 R13	R9-I11 PolarHBondContact O-N 2.91Å; R9-I11 VanDerWaalsContact O-N 3.13Å; I11-R13 VanDerWaalsContact C-N 3.32Å; I11-R13 HydrophobicContact CG2-CG 4.47Å; I11-R13 PolarHBondContact O-N 3.03Å
12	L	36.3	Very low	45.6	Very low	159 Å²	159	171.8 Å²	171.8	83%	0.832	81%	0.811	S	S	*	*			trans	-65	94.1	166.2	-93.2	135.9	0	0	0	108	R10 K14	R10-L12 PolarHBondContact O-N 2.97Å; L12-K14 VanDerWaalsContact C-N 3.33Å; L12-K14 PolarHBondContact O-N 3.21Å
13	R	38.2	Very low	46.9	Very low	230 Å²	230	168 Å²	168	87%	0.868	80%	0.795	S	S	*	*			trans	-65.2	96.4	162.8	-72.7	-175.3	174.1	-170	-0.9	107.1	I11 K15	I11-R13 VanDerWaalsContact C-N 3.32Å; I11-R13 HydrophobicContact CG2-CG 4.47Å; I11-R13 PolarHBondContact O-N 3.03Å; R13-K15 PolarHBondContact O-N 3.43Å; R13-K15 VanDerWaalsContact O-N 3.13Å
14	K	39.2	Very low	48.1	Very low	198 Å²	198	162.7 Å²	162.7	86%	0.861	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.9	161.9	-79	-173	175.2	-177.2	0	106.5	L12	L12-K14 VanDerWaalsContact C-N 3.33Å; L12-K14 PolarHBondContact O-N 3.21Å
15	K	37.5	Very low	49.6	Very low	188 Å²	188	157.8 Å²	157.8	82%	0.817	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-53.6	136.3	168	-74.4	-175.5	176.2	-177.2	0	107	R13 N17	R13-K15 PolarHBondContact O-N 3.43Å; R13-K15 VanDerWaalsContact O-N 3.13Å; K15-N17 PolarHBondContact O-N 2.94Å
16	P	38.7	Very low	50.9	Low	114 Å²	114	155 Å²	155	74%	0.74	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-54.8	141.2	171.5	25.1	-31.6	0	0	0	107.6	A18	P16-A18 PolarHBondContact O-N 3.47Å
17	N	43.4	Very low	52.4	Low	170 Å²	170	153 Å²	153	91%	0.909	73%	0.725	S	S	*	*			trans	-57.7	92.1	170	-86.4	-8.7	0	0	0	107.3	K15 L19	K15-N17 PolarHBondContact O-N 2.94Å; N17-L19 PolarHBondContact O-N 3.48Å
18	A	46.6	Very low	54.2	Low	82 Å²	82	157.3 Å²	157.3	68%	0.678	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-67.5	116.9	170.7	0	0	0	0	0	105.7	P16 R20	P16-A18 PolarHBondContact O-N 3.47Å; A18-R20 PolarHBondContact O-N 2.88Å
19	L	53.9	Low	55.8	Low	115 Å²	115	149.2 Å²	149.2	60%	0.602	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-48.1	126	167.4	-79.5	152.2	0	0	0	107.2	N17 A21	N17-L19 PolarHBondContact O-N 3.48Å; L19-A21 PolarHBondContact O-N 2.99Å
20	R	57.7	Low	57.7	Low	195 Å²	195	147.8 Å²	147.8	74%	0.736	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-65.3	134.3	-179.3	-76.2	-176.9	-176.3	-169.6	0.1	108.3	A18 E41	A18-R20 PolarHBondContact O-N 2.88Å; R20-E41 PolarHBondContact N-OE2 3.36Å
21	A	60.9	Low	59.9	Low	81 Å²	81	142.6 Å²	142.6	67%	0.669	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-54.1	142	171.8	0	0	0	0	0	109.9	L19 K23	L19-A21 PolarHBondContact O-N 2.99Å; A21-K23 PolarHBondContact O-N 3.45Å
22	P	63.4	Low	61.5	Low	74 Å²	74	137.8 Å²	137.8	48%	0.481	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-56.8	140	178.2	-20.8	30.7	0	0	0	110.9	V38 V39 Q40	P22-V38 HydrophobicContact CB-CG1 3.61Å; P22-V39 VanDerWaalsContact CA-O 3.26Å; P22-V39 WeakPolarHBondContact CA-O 3.3Å; P22-Q40 HydrophobicContact CB-CG 4.22Å; P22-Q40 HydrophobicContact CG-CG 4.23Å
23	K	73.1	Confident	63.4	Low	138 Å²	138	138.2 Å²	138.2	60%	0.6	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94	125.2	174.9	-68	-173.4	176.8	-171.7	0	109.6	A21 V39	A21-K23 PolarHBondContact O-N 3.45Å; K23-V39 PolarHBondContact N-O 3.11Å; K23-V39 PolarHBondContact O-N 3.2Å
24	E	70.8	Confident	65.4	Low	98 Å²	98	131.1 Å²	131.1	46%	0.458	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	131.5	169.6	-166.2	-175	151.6	0	0	109.6	R26 R36 T37	E24-R26 IonicContact OE1-CZ 2.8Å; E24-R26 IonicContact OE1-NE 3.96Å; E24-R26 PolarHBondContact OE1-NE 2.78Å; E24-R26 IonicContact OE1-NH2 2.8Å; E24-R26 PolarHBondContact OE1-NH2 3.1Å; E24-R26 VanDerWaalsContact OE1-NH2 3.15Å; E24-R26 IonicContact OE2-NH2 3.25Å; E24-R36 WeakPolarHBondContact OE1-CD 3.22Å; E24-R36 IonicContact OE1-NE 2.7Å; E24-T37 WeakPolarHBondContact CA-O 3.43Å
25	R	74.5	Confident	67.1	Low	143 Å²	143	126 Å²	126	54%	0.54	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.9	135.3	169.5	-70.6	-174.6	175	-158	-2.2	109.2	R36 T37	R25-R36 WeakPolarHBondContact O-CA 3.37Å; R25-T37 PolarHBondContact N-O 3.09Å; R25-T37 PolarHBondContact O-N 3.49Å
26	R	76.9	Confident	69	Low	152 Å²	152	124.9 Å²	124.9	57%	0.574	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.7	130.2	173.7	-62.3	-173.4	177.7	173.9	5.5	109.3	E24 T34 L35 R36	E24-R26 IonicContact OE1-CZ 2.8Å; E24-R26 IonicContact OE1-NE 3.96Å; E24-R26 PolarHBondContact OE1-NE 2.78Å; E24-R26 IonicContact OE1-NH2 2.8Å; E24-R26 PolarHBondContact OE1-NH2 3.1Å; E24-R26 VanDerWaalsContact OE1-NH2 3.15Å; E24-R26 IonicContact OE2-NH2 3.25Å; R26-T34 HydrophobicContact CB-CG2 4.26Å; R26-T34 HydrophobicContact CG-CG2 4.5Å; R26-L35 WeakPolarHBondContact CA-O 3.45Å; R26-R36 HydrophobicContact CG-CG 4.34Å
27	R	80.3	Confident	70.8	Confident	167 Å²	167	123 Å²	123	63%	0.63	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-136.3	151.3	173.1	-71	-175.2	172.2	-176.3	-5	108.8	T34 L35	R27-T34 CarbonylContact O-C 3.55Å; R27-L35 PolarHBondContact N-O 3.41Å; R27-L35 WeakPolarHBondContact O-CA 3.26Å; R27-L35 PolarHBondContact O-N 2.83Å
28	K	77	Confident	72.2	Confident	165 Å²	165	119.3 Å²	119.3	72%	0.717	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.4	137.6	167.7	-68.6	-172.2	178.1	-175.6	0	108.9	R33	K28-R33 CarbonylContact C-O 3.44Å; K28-R33 VanDerWaalsContact CA-O 3.3Å; K28-R33 WeakPolarHBondContact CA-O 3.19Å
29	N	81	Confident	73.4	Confident	46 Å²	46	118.7 Å²	118.7	25%	0.246	57%	0.568	C	S	.	*			trans	-78.6	176.6	167.4	74.1	-10.9	0	0	0	110.1	E31 G32 R33 L35	N29-E31 PolarHBondContact ND2-OE2 3.36Å; N29-E31 PolarHBondContact O-N 3.04Å; N29-E31 PolarHBondContact OD1-N 3.36Å; N29-G32 PolarHBondContact O-N 3.39Å; N29-G32 PolarHBondContact OD1-N 3.24Å; N29-G32 VanDerWaalsContact OD1-N 3.16Å; N29-R33 PolarHBondContact N-O 3.2Å; N29-R33 WeakPolarHBondContact OD1-CA 3.34Å; N29-R33 WeakPolarHBondContact OD1-CB 3.39Å; N29-R33 PolarHBondContact OD1-N 3.48Å; N29-R33 PolarHBondContact OD1-O 3.04Å; N29-L35 HydrophobicContact CB-CD1 3.82Å; N29-L35 HydrophobicContact CB-CG 4.08Å
30	E	80.9	Confident	74.1	Confident	207 Å²	207	119.7 Å²	119.7	97%	0.967	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-25.8	178.6	-64	174.7	-179.3	0	0	112.7	G32	E30-G32 VanDerWaalsContact C-N 3.3Å; E30-G32 PolarHBondContact O-N 2.92Å
31	E	83	Confident	74.7	Confident	128 Å²	128	115.7 Å²	115.7	60%	0.598	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	6.6	176.1	-52.1	173.4	155.7	0	0	113.6	N29 R33	N29-E31 PolarHBondContact ND2-OE2 3.36Å; N29-E31 PolarHBondContact O-N 3.04Å; N29-E31 PolarHBondContact OD1-N 3.36Å; E31-R33 HydrophobicContact CB-CG 4.39Å; E31-R33 PolarHBondContact O-N 2.91Å; E31-R33 WeakPolarHBondContact OE2-CD 3.48Å; E31-R33 IonicContact OE2-CZ 3.32Å; E31-R33 IonicContact OE2-NE 3.52Å; E31-R33 IonicContact OE2-NH1 2.8Å; E31-R33 PolarHBondContact OE2-NH1 3.13Å
32	G	78	Confident	75	Confident	44 Å²	44	120.1 Å²	120.1	45%	0.454	56%	0.564	S	S	.	*	S	Bend	trans	75	1	-178.1	0	0	0	0	0	115.7	N29 E30	N29-G32 PolarHBondContact O-N 3.39Å; N29-G32 PolarHBondContact OD1-N 3.24Å; N29-G32 VanDerWaalsContact OD1-N 3.16Å; E30-G32 VanDerWaalsContact C-N 3.3Å; E30-G32 PolarHBondContact O-N 2.92Å
33	R	76.5	Confident	75.1	Confident	167 Å²	167	118.5 Å²	118.5	63%	0.63	55%	0.55	S	S	*	*			trans	-73.5	140	176.3	-60.2	178.5	175.2	160.3	-10.7	111	K28 N29 E31 L35	K28-R33 CarbonylContact C-O 3.44Å; K28-R33 VanDerWaalsContact CA-O 3.3Å; K28-R33 WeakPolarHBondContact CA-O 3.19Å; N29-R33 PolarHBondContact N-O 3.2Å; N29-R33 WeakPolarHBondContact OD1-CA 3.34Å; N29-R33 WeakPolarHBondContact OD1-CB 3.39Å; N29-R33 PolarHBondContact OD1-N 3.48Å; N29-R33 PolarHBondContact OD1-O 3.04Å; E31-R33 HydrophobicContact CB-CG 4.39Å; E31-R33 PolarHBondContact O-N 2.91Å; E31-R33 WeakPolarHBondContact OE2-CD 3.48Å; E31-R33 IonicContact OE2-CZ 3.32Å; E31-R33 IonicContact OE2-NE 3.52Å; E31-R33 IonicContact OE2-NH1 2.8Å; E31-R33 PolarHBondContact OE2-NH1 3.13Å; R33-L35 PolarHBondContact O-N 3.42Å
34	T	80.1	Confident	74.5	Confident	82 Å²	82	117.1 Å²	117.1	50%	0.503	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	108.8	178.6	-58.4	0	0	0	0	110.6	R26 R27	R26-T34 HydrophobicContact CB-CG2 4.26Å; R26-T34 HydrophobicContact CG-CG2 4.5Å; R27-T34 CarbonylContact O-C 3.55Å
35	L	74.6	Confident	73.8	Confident	90 Å²	90	117.6 Å²	117.6	47%	0.471	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	126.7	167.4	-63.5	176.1	0	0	0	109.9	R26 R27 N29 R33	R26-L35 WeakPolarHBondContact CA-O 3.45Å; R27-L35 PolarHBondContact N-O 3.41Å; R27-L35 WeakPolarHBondContact O-CA 3.26Å; R27-L35 PolarHBondContact O-N 2.83Å; N29-L35 HydrophobicContact CB-CD1 3.82Å; N29-L35 HydrophobicContact CB-CG 4.08Å; R33-L35 PolarHBondContact O-N 3.42Å
36	R	77.9	Confident	72.7	Confident	164 Å²	164	113.4 Å²	113.4	62%	0.619	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.9	170.7	-62.4	-174.3	-178.8	-174.1	4.4	108.8	E24 R25 R26	E24-R36 WeakPolarHBondContact OE1-CD 3.22Å; E24-R36 IonicContact OE1-NE 2.7Å; R25-R36 WeakPolarHBondContact O-CA 3.37Å; R26-R36 HydrophobicContact CG-CG 4.34Å
37	T	75.8	Confident	71.3	Confident	75 Å²	75	116.6 Å²	116.6	46%	0.46	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.3	120.6	177.1	-52.2	0	0	0	0	108.7	E24 R25 V39	E24-T37 WeakPolarHBondContact CA-O 3.43Å; R25-T37 PolarHBondContact N-O 3.09Å; R25-T37 PolarHBondContact O-N 3.49Å; T37-V39 HydrophobicContact CG2-CG2 4.37Å
38	V	72.4	Confident	69.8	Low	93 Å²	93	113.7 Å²	113.7	56%	0.564	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92	116.2	172.6	-179.6	0	0	0	0	108.2	P22 Q40	P22-V38 HydrophobicContact CB-CG1 3.61Å; V38-Q40 HydrophobicContact CG1-CG 4.35Å
39	V	73.1	Confident	68.6	Low	68 Å²	68	117.4 Å²	117.4	41%	0.412	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	110.7	178.1	-175.8	0	0	0	0	108.6	P22 K23 T37	P22-V39 VanDerWaalsContact CA-O 3.26Å; P22-V39 WeakPolarHBondContact CA-O 3.3Å; K23-V39 PolarHBondContact N-O 3.11Å; K23-V39 PolarHBondContact O-N 3.2Å; T37-V39 HydrophobicContact CG2-CG2 4.37Å
40	Q	68.6	Low	67.2	Low	137 Å²	137	123.2 Å²	123.2	64%	0.64	58%	0.583	S	S	*	*			trans	-93.7	152	173.3	-67.8	-178.7	-30.5	0	0	110.9	P22 V38 K42	P22-Q40 HydrophobicContact CB-CG 4.22Å; P22-Q40 HydrophobicContact CG-CG 4.23Å; V38-Q40 HydrophobicContact CG1-CG 4.35Å; Q40-K42 PolarHBondContact O-N 3.03Å
41	E	69.6	Low	65.8	Low	111 Å²	111	122.3 Å²	122.3	52%	0.519	58%	0.581	S	S	.	*			trans	-60.3	129.2	172.1	-173.6	174	165	0	0	109.2	R20 I43	R20-E41 PolarHBondContact N-OE2 3.36Å; E41-I43 PolarHBondContact O-N 2.8Å
42	K	67.3	Low	64.7	Low	173 Å²	173	119.3 Å²	119.3	75%	0.752	57%	0.566	S	S	*	*			trans	-69	107.1	178	-170.9	178.9	-177.3	-179.3	0	108.4	Q40 D44	Q40-K42 PolarHBondContact O-N 3.03Å; K42-D44 PolarHBondContact O-N 2.8Å
43	I	65.9	Low	63.9	Low	40 Å²	40	126.2 Å²	126.2	21%	0.205	58%	0.583	C	S	.	*			trans	-73.8	122	161.7	-58	177.7	0	0	0	105.6	E41 Q45 L88 Y114 M116	E41-I43 PolarHBondContact O-N 2.8Å; I43-Q45 VanDerWaalsContact C-N 3.31Å; I43-Q45 PolarHBondContact O-N 3.09Å; I43-L88 HydrophobicContact CB-CD1 3.89Å; I43-L88 HydrophobicContact CD1-CD1 4.12Å; I43-L88 HydrophobicContact CG2-CD1 3.76Å; I43-Y114 HydrophobicContact CD1-CD1 4.36Å; I43-Y114 HydrophobicContact CD1-CG 4.18Å; I43-Y114 HydrophobicContact CG2-CD2 4.42Å; I43-M116 HydrophobicContact CD1-SD 4.29Å
44	D	61.1	Low	63.5	Low	109 Å²	109	121.1 Å²	121.1	58%	0.583	57%	0.568	S	S	*	*			trans	-57.6	95.1	176.2	-67.9	-45.4	0	0	0	109.6	K42	K42-D44 PolarHBondContact O-N 2.8Å
45	Q	56	Low	63	Low	109 Å²	109	127.4 Å²	127.4	51%	0.509	58%	0.583	S	S	.	*			trans	-80.2	139.5	167.5	-62	-167.2	26.6	0	0	107.7	I43 K47 L88	I43-Q45 VanDerWaalsContact C-N 3.31Å; I43-Q45 PolarHBondContact O-N 3.09Å; Q45-K47 PolarHBondContact O-N 2.89Å; Q45-L88 VanDerWaalsContact CD-CD2 3.45Å; Q45-L88 HydrophobicContact CG-CD1 3.82Å; Q45-L88 HydrophobicContact CG-CD2 3.8Å; Q45-L88 HydrophobicContact CG-CG 4.46Å
46	P	50.6	Low	62.9	Low	54 Å²	54	127.4 Å²	127.4	35%	0.351	58%	0.579	S	S	.	*			trans	-54.6	132.7	166	30.8	-39.5	0	0	0	108.4	E48 F52	P46-E48 WeakPolarHBondContact CB-O 3.47Å; P46-E48 WeakPolarHBondContact CG-O 3.2Å; P46-E48 PolarHBondContact O-N 3.44Å; P46-F52 HydrophobicContact CB-CE2 4.39Å; P46-F52 HydrophobicContact CB-CZ 3.73Å; P46-F52 HydrophobicContact CG-CE2 3.59Å; P46-F52 HydrophobicContact CG-CZ 3.44Å; P46-F52 VanDerWaalsContact CG-CZ 3.44Å
47	K	48	Very low	63	Low	219 Å²	219	123.3 Å²	123.3	95%	0.952	57%	0.573	S	S	*	*	S	Bend	trans	-59.4	-17.9	-179.6	-74	-176.6	175.9	-178.5	0	113.2	Q45	Q45-K47 PolarHBondContact O-N 2.89Å
48	E	47.8	Very low	63.4	Low	107 Å²	107	123.9 Å²	123.9	50%	0.5	57%	0.571	S	S	.	*	S	Bend	trans	-116.5	138.7	172	-76.9	162	-170.8	0	0	108	P46 R50	P46-E48 WeakPolarHBondContact CB-O 3.47Å; P46-E48 WeakPolarHBondContact CG-O 3.2Å; P46-E48 PolarHBondContact O-N 3.44Å; E48-R50 HydrophobicContact CB-CG 3.85Å; E48-R50 PolarHBondContact O-N 3.45Å; E48-R50 IonicContact OE2-CZ 3.85Å; E48-R50 IonicContact OE2-NE 3.49Å; E48-R50 PolarHBondContact OE2-NE 3.32Å; E48-R50 IonicContact OE2-NH2 3.46Å; E48-R50 PolarHBondContact OE2-NH2 2.81Å
49	R	52.9	Low	63.6	Low	243 Å²	243	120.7 Å²	120.7	92%	0.917	55%	0.551	S	S	*	*			trans	-65.7	58.2	163.2	-67.2	-173.7	-179.6	-166.8	0.9	109.5	M51	R49-M51 PolarHBondContact O-N 3.28Å; R49-M51 VanDerWaalsContact O-N 3.11Å
50	R	51.1	Low	63.9	Low	167 Å²	167	118.5 Å²	118.5	63%	0.63	54%	0.537	S	S	*	.			trans	-64.5	115.9	168.6	-70.7	-172.2	-176.1	-169.2	-0.3	105	E48 F52	E48-R50 HydrophobicContact CB-CG 3.85Å; E48-R50 PolarHBondContact O-N 3.45Å; E48-R50 IonicContact OE2-CZ 3.85Å; E48-R50 IonicContact OE2-NE 3.49Å; E48-R50 PolarHBondContact OE2-NE 3.32Å; E48-R50 IonicContact OE2-NH2 3.46Å; E48-R50 PolarHBondContact OE2-NH2 2.81Å; R50-F52 VanDerWaalsContact C-N 3.28Å; R50-F52 PolarHBondContact O-N 2.99Å
51	M	52.1	Low	64.6	Low	189 Å²	189	117 Å²	117	93%	0.931	53%	0.532	S	S	*	.			trans	-52.4	103.6	163.4	-77.4	-159.1	-62	0	0	106.6	R49 K53	R49-M51 PolarHBondContact O-N 3.28Å; R49-M51 VanDerWaalsContact O-N 3.11Å; M51-K53 PolarHBondContact O-N 3.4Å
52	F	58.9	Low	65.3	Low	64 Å²	64	117.6 Å²	117.6	28%	0.281	53%	0.533	S	S	.	.			trans	-65.1	130	174.6	-70.6	-63.4	0	0	0	107	P46 R50 I54 L89 Y91	P46-F52 HydrophobicContact CB-CE2 4.39Å; P46-F52 HydrophobicContact CB-CZ 3.73Å; P46-F52 HydrophobicContact CG-CE2 3.59Å; P46-F52 HydrophobicContact CG-CZ 3.44Å; P46-F52 VanDerWaalsContact CG-CZ 3.44Å; R50-F52 VanDerWaalsContact C-N 3.28Å; R50-F52 PolarHBondContact O-N 2.99Å; F52-I54 PolarHBondContact O-N 3.05Å; F52-L89 HydrophobicContact CD2-CB 4.33Å; F52-L89 HydrophobicContact CD2-CD1 4.39Å; F52-Y91 AromaticContact CD1-CE2 3.53Å; F52-Y91 HydrophobicContact CD1-CE2 3.53Å; F52-Y91 AromaticContact CD1-CZ 3.98Å; F52-Y91 WeakPolarHBondContact CD1-OH 3.11Å; F52-Y91 HydrophobicContact CE1-CD2 4.46Å; F52-Y91 AromaticContact CE1-CE2 3.62Å; F52-Y91 HydrophobicContact CE1-CE2 3.62Å; F52-Y91 HydrophobicContact CG-CE2 4.12Å; F52-Y91 HydrophobicContact CZ-CE2 4.25Å
53	K	62.3	Low	66.1	Low	189 Å²	189	110 Å²	110	82%	0.822	50%	0.5	S	S	*	.			trans	-68	90.7	165.9	-170.6	172	-176.8	173.6	0	107.2	M51 R55	M51-K53 PolarHBondContact O-N 3.4Å; K53-R55 PolarHBondContact O-N 3.32Å; K53-R55 VanDerWaalsContact O-N 3.14Å
54	I	68.4	Low	67.1	Low	60 Å²	60	108.9 Å²	108.9	31%	0.308	50%	0.495	S	S	.	.			trans	-67.8	112.3	178.3	-59.1	162.7	0	0	0	106.6	F52 F56 P57 L60 L89	F52-I54 PolarHBondContact O-N 3.05Å; I54-F56 PolarHBondContact O-N 3.17Å; I54-P57 HydrophobicContact CG2-CB 4.27Å; I54-L60 HydrophobicContact CD1-CD2 3.74Å; I54-L89 HydrophobicContact CD1-CD1 3.85Å; I54-L89 HydrophobicContact CG1-CD1 3.92Å
55	R	68.4	Low	68.4	Low	214 Å²	214	109.4 Å²	109.4	81%	0.808	50%	0.495	S	S	*	.	S	Bend	trans	-65.9	-28.8	-178.5	-72.1	-174.4	174.1	-178.7	-2.8	113	K53	K53-R55 PolarHBondContact O-N 3.32Å; K53-R55 VanDerWaalsContact O-N 3.14Å
56	F	73.3	Confident	69.8	Low	91 Å²	91	107 Å²	107	40%	0.399	49%	0.488	S	S	.	.			trans	-143.3	77	-174.1	-60.3	-74.1	0	0	0	109.9	I54 E58 N59 S109	I54-F56 PolarHBondContact O-N 3.17Å; F56-E58 VanDerWaalsContact C-OE2 3.24Å; F56-E58 WeakPolarHBondContact CA-OE2 3.32Å; F56-E58 WeakPolarHBondContact CB-OE1 3.46Å; F56-E58 VanDerWaalsContact CD1-OE1 3.3Å; F56-E58 WeakPolarHBondContact CD1-OE1 3.22Å; F56-E58 PolarHBondContact O-N 2.87Å; F56-N59 HydrophobicContact CB-CB 4.34Å; F56-N59 PolarHBondContact O-N 3.24Å; F56-N59 VanDerWaalsContact O-N 3.17Å; F56-S109 VanDerWaalsContact CD2-CB 3.41Å
57	P	79.8	Confident	71.5	Confident	77 Å²	77	106.6 Å²	106.6	50%	0.5	48%	0.484	S	S	.	.	H	α-helix	trans	-59.8	-29.4	-178.2	25.1	-34.9	0	0	0	113.2	I54 N59 L60 L61	I54-P57 HydrophobicContact CG2-CB 4.27Å; P57-N59 VanDerWaalsContact C-N 3.26Å; P57-N59 PolarHBondContact O-N 3.18Å; P57-L60 WeakPolarHBondContact O-CB 3.36Å; P57-L60 PolarHBondContact O-N 3.14Å; P57-L60 VanDerWaalsContact O-N 3.17Å; P57-L61 PolarHBondContact O-N 3.42Å
58	E	83	Confident	73.5	Confident	88 Å²	88	98.5 Å²	98.5	41%	0.411	45%	0.451	S	S	.	.	H	α-helix	trans	-62.1	-32.8	176.9	68.6	-76	178.9	0	0	112.8	F56 K62	F56-E58 VanDerWaalsContact C-OE2 3.24Å; F56-E58 WeakPolarHBondContact CA-OE2 3.32Å; F56-E58 WeakPolarHBondContact CB-OE1 3.46Å; F56-E58 VanDerWaalsContact CD1-OE1 3.3Å; F56-E58 WeakPolarHBondContact CD1-OE1 3.22Å; F56-E58 PolarHBondContact O-N 2.87Å; E58-K62 WeakPolarHBondContact O-CB 3.46Å; E58-K62 WeakPolarHBondContact O-CG 3.41Å; E58-K62 PolarHBondContact O-N 2.71Å
59	N	77.1	Confident	75.4	Confident	26 Å²	26	95.9 Å²	95.9	14%	0.139	44%	0.444	C	S	.	.	H	α-helix	trans	-73.9	-34.8	176.8	-74.8	-15.1	0	0	0	111.8	F56 P57 Q63 R107 S109	F56-N59 HydrophobicContact CB-CB 4.34Å; F56-N59 PolarHBondContact O-N 3.24Å; F56-N59 VanDerWaalsContact O-N 3.17Å; P57-N59 VanDerWaalsContact C-N 3.26Å; P57-N59 PolarHBondContact O-N 3.18Å; N59-Q63 VanDerWaalsContact O-CG 3.3Å; N59-Q63 WeakPolarHBondContact O-CG 3.14Å; N59-Q63 PolarHBondContact O-N 2.99Å; N59-R107 PolarHBondContact ND2-O 3.31Å; N59-S109 WeakPolarHBondContact CB-OG 3.47Å; N59-S109 VanDerWaalsContact ND2-CB 3.28Å; N59-S109 WeakPolarHBondContact ND2-CB 3.38Å; N59-S109 PolarHBondContact ND2-OG 3.02Å; N59-S109 VanDerWaalsContact ND2-OG 3.09Å
60	L	79.2	Confident	76.9	Confident	22 Å²	22	87.6 Å²	87.6	12%	0.115	42%	0.417	C	S	.	.	H	α-helix	trans	-63	-49.7	173.1	171.2	58.5	0	0	0	110.4	I54 P57 K62 Q63 L64 I87 L89 C113	I54-L60 HydrophobicContact CD1-CD2 3.74Å; P57-L60 WeakPolarHBondContact O-CB 3.36Å; P57-L60 PolarHBondContact O-N 3.14Å; P57-L60 VanDerWaalsContact O-N 3.17Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 3.02Å; L60-Q63 WeakPolarHBondContact O-CB 3.37Å; L60-Q63 PolarHBondContact O-N 3.49Å; L60-Q63 VanDerWaalsContact O-N 3.14Å; L60-L64 HydrophobicContact CD1-CD1 4.22Å; L60-L64 HydrophobicContact CD1-CG 4.47Å; L60-L64 HydrophobicContact CG-CD1 4.31Å; L60-L64 PolarHBondContact O-N 2.86Å; L60-I87 HydrophobicContact CD1-CG2 4.43Å; L60-L89 HydrophobicContact CD1-CD2 3.35Å; L60-L89 HydrophobicContact CD2-CD1 4.23Å; L60-L89 HydrophobicContact CD2-CD2 3.8Å; L60-L89 HydrophobicContact CG-CD2 4.19Å; L60-C113 HydrophobicContact CD1-CB 3.32Å; L60-C113 WeakPolarHBondContact CD1-SG 3.33Å
61	L	84.6	Confident	78.7	Confident	104 Å²	104	81.3 Å²	81.3	55%	0.545	40%	0.396	S	S	.	.	H	α-helix	trans	-60.2	-43.4	178.9	-172.3	62.8	0	0	0	111.4	P57 Q63 L64 M65	P57-L61 PolarHBondContact O-N 3.42Å; L61-Q63 PolarHBondContact O-N 3.44Å; L61-L64 PolarHBondContact O-N 2.87Å; L61-M65 HydrophobicContact CD1-CG 4.46Å; L61-M65 HydrophobicContact CG-CG 4.39Å; L61-M65 HydrophobicContact CG-SD 4.15Å; L61-M65 WeakPolarHBondContact O-CB 3.42Å; L61-M65 VanDerWaalsContact O-CG 3.3Å; L61-M65 WeakPolarHBondContact O-CG 3.3Å; L61-M65 PolarHBondContact O-N 3.03Å
62	K	83.4	Confident	80.4	Confident	124 Å²	124	78 Å²	78	54%	0.539	38%	0.378	S	S	.	.	H	α-helix	trans	-59.3	-42.4	174.5	-75.9	170.1	-174.5	172.4	0	112.7	E58 L60 V66	E58-K62 WeakPolarHBondContact O-CB 3.46Å; E58-K62 WeakPolarHBondContact O-CG 3.41Å; E58-K62 PolarHBondContact O-N 2.71Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 3.02Å; K62-V66 WeakPolarHBondContact O-CB 3.45Å; K62-V66 VanDerWaalsContact O-CG2 3.22Å; K62-V66 WeakPolarHBondContact O-CG2 3.46Å; K62-V66 PolarHBondContact O-N 3.21Å
63	Q	84.2	Confident	81.7	Confident	14 Å²	14	82.5 Å²	82.5	7%	0.065	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-44.8	176.6	-72.9	174.8	48.1	0	0	111.4	N59 L60 L61 T67 Y97 S111 C113	N59-Q63 VanDerWaalsContact O-CG 3.3Å; N59-Q63 WeakPolarHBondContact O-CG 3.14Å; N59-Q63 PolarHBondContact O-N 2.99Å; L60-Q63 WeakPolarHBondContact O-CB 3.37Å; L60-Q63 PolarHBondContact O-N 3.49Å; L60-Q63 VanDerWaalsContact O-N 3.14Å; L61-Q63 PolarHBondContact O-N 3.44Å; Q63-T67 WeakPolarHBondContact O-CB 3.38Å; Q63-T67 PolarHBondContact O-N 3.1Å; Q63-T67 PolarHBondContact O-OG1 3.17Å; Q63-Y97 VanDerWaalsContact CD-OH 3.23Å; Q63-Y97 HydrophobicContact CG-CE2 4.09Å; Q63-Y97 VanDerWaalsContact CG-OH 3.32Å; Q63-Y97 WeakPolarHBondContact CG-OH 3.44Å; Q63-Y97 PolarHBondContact OE1-OH 3.07Å; Q63-S111 PolarHBondContact NE2-O 2.8Å; Q63-C113 HydrophobicContact CB-CB 4.16Å
64	L	87.4	Confident	82.8	Confident	17 Å²	17	78.1 Å²	78.1	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-62.9	-49.9	177.3	-74.4	168	0	0	0	111.7	L60 L61 V66 T67 L68 I87 C113	L60-L64 HydrophobicContact CD1-CD1 4.22Å; L60-L64 HydrophobicContact CD1-CG 4.47Å; L60-L64 HydrophobicContact CG-CD1 4.31Å; L60-L64 PolarHBondContact O-N 2.86Å; L61-L64 PolarHBondContact O-N 2.87Å; L64-V66 PolarHBondContact O-N 3.13Å; L64-T67 PolarHBondContact O-N 2.94Å; L64-L68 WeakPolarHBondContact O-CB 3.41Å; L64-L68 WeakPolarHBondContact O-CG 3.23Å; L64-L68 PolarHBondContact O-N 3.43Å; L64-I87 HydrophobicContact CD1-CD1 3.65Å; L64-I87 HydrophobicContact CD1-CG1 4.29Å; L64-I87 HydrophobicContact CD1-CG2 4.33Å; L64-I87 HydrophobicContact CD2-CD1 4.34Å; L64-I87 HydrophobicContact CD2-CG1 4.18Å; L64-C113 WeakPolarHBondContact CD2-SG 3.36Å; L64-C113 VanDerWaalsContact CG-SG 3.57Å
65	M	88.7	Confident	83.6	Confident	120 Å²	120	78.3 Å²	78.3	59%	0.591	38%	0.378	S	S	*	.	H	α-helix	trans	-60	-44.6	179.2	-70.9	-177.3	79.2	0	0	112.3	L61 T67 L68 C69	L61-M65 HydrophobicContact CD1-CG 4.46Å; L61-M65 HydrophobicContact CG-CG 4.39Å; L61-M65 HydrophobicContact CG-SD 4.15Å; L61-M65 WeakPolarHBondContact O-CB 3.42Å; L61-M65 VanDerWaalsContact O-CG 3.3Å; L61-M65 WeakPolarHBondContact O-CG 3.3Å; L61-M65 PolarHBondContact O-N 3.03Å; M65-T67 VanDerWaalsContact C-N 3.33Å; M65-T67 PolarHBondContact O-N 2.83Å; M65-L68 PolarHBondContact O-N 3.45Å; M65-C69 WeakPolarHBondContact O-CB 3.42Å; M65-C69 PolarHBondContact O-N 3.19Å
66	V	84.9	Confident	84.6	Confident	57 Å²	57	72.8 Å²	72.8	35%	0.345	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-41.8	177	170	0	0	0	0	110.7	K62 L64 C69 I70 V99	K62-V66 WeakPolarHBondContact O-CB 3.45Å; K62-V66 VanDerWaalsContact O-CG2 3.22Å; K62-V66 WeakPolarHBondContact O-CG2 3.46Å; K62-V66 PolarHBondContact O-N 3.21Å; L64-V66 PolarHBondContact O-N 3.13Å; V66-C69 PolarHBondContact O-N 2.96Å; V66-I70 HydrophobicContact CG1-CD1 3.79Å; V66-I70 HydrophobicContact CG1-CG1 4.47Å; V66-I70 WeakPolarHBondContact O-CD1 3.21Å; V66-I70 VanDerWaalsContact O-CG1 3.22Å; V66-I70 WeakPolarHBondContact O-CG1 3.4Å; V66-I70 PolarHBondContact O-N 3.44Å; V66-V99 HydrophobicContact CG1-CG2 3.9Å
67	T	86.2	Confident	85.4	Confident	46 Å²	46	68.9 Å²	68.9	28%	0.282	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-47.7	178.7	-57.1	0	0	0	0	111.3	Q63 L64 M65 I70 L71 M115	Q63-T67 WeakPolarHBondContact O-CB 3.38Å; Q63-T67 PolarHBondContact O-N 3.1Å; Q63-T67 PolarHBondContact O-OG1 3.17Å; L64-T67 PolarHBondContact O-N 2.94Å; M65-T67 VanDerWaalsContact C-N 3.33Å; M65-T67 PolarHBondContact O-N 2.83Å; T67-I70 PolarHBondContact O-N 3.37Å; T67-L71 HydrophobicContact CG2-CD1 4.11Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.42Å; T67-L71 PolarHBondContact O-N 2.99Å; T67-M115 HydrophobicContact CG2-CE 4.29Å
68	L	89.3	Confident	85.9	Confident	49 Å²	49	69.7 Å²	69.7	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-46.4	176.6	-72.9	170.3	0	0	0	111.5	L64 M65 I70 L71 E72 F77 L82 M115	L64-L68 WeakPolarHBondContact O-CB 3.41Å; L64-L68 WeakPolarHBondContact O-CG 3.23Å; L64-L68 PolarHBondContact O-N 3.43Å; M65-L68 PolarHBondContact O-N 3.45Å; L68-I70 VanDerWaalsContact C-N 3.33Å; L68-I70 PolarHBondContact O-N 3.09Å; L68-L71 PolarHBondContact O-N 3.17Å; L68-L71 VanDerWaalsContact O-N 3.1Å; L68-E72 VanDerWaalsContact O-CB 3.32Å; L68-E72 WeakPolarHBondContact O-CB 3.3Å; L68-E72 PolarHBondContact O-N 2.92Å; L68-F77 HydrophobicContact CD2-CD1 4.43Å; L68-F77 HydrophobicContact CD2-CE1 4.07Å; L68-L82 HydrophobicContact CD1-CD2 3.79Å; L68-L82 HydrophobicContact CD2-CD2 4.42Å; L68-M115 HydrophobicContact CD2-CE 4Å; L68-M115 HydrophobicContact CD2-SD 3.76Å
69	C	87.8	Confident	86.2	Confident	53 Å²	53	66 Å²	66	36%	0.358	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-41.2	178.1	178.7	0	0	0	0	112.4	M65 V66 K73	M65-C69 WeakPolarHBondContact O-CB 3.42Å; M65-C69 PolarHBondContact O-N 3.19Å; V66-C69 PolarHBondContact O-N 2.96Å; C69-K73 WeakPolarHBondContact O-CB 3.5Å; C69-K73 WeakPolarHBondContact O-CG 3.35Å; C69-K73 PolarHBondContact O-N 3.32Å
70	I	85.5	Confident	86.8	Confident	68 Å²	68	72 Å²	72	35%	0.349	35%	0.347	S	S	.	.	H	α-helix	trans	-64	-43.8	175.1	-68.8	164.9	0	0	0	110.7	V66 T67 L68 K74 V99	V66-I70 HydrophobicContact CG1-CD1 3.79Å; V66-I70 HydrophobicContact CG1-CG1 4.47Å; V66-I70 WeakPolarHBondContact O-CD1 3.21Å; V66-I70 VanDerWaalsContact O-CG1 3.22Å; V66-I70 WeakPolarHBondContact O-CG1 3.4Å; V66-I70 PolarHBondContact O-N 3.44Å; T67-I70 PolarHBondContact O-N 3.37Å; L68-I70 VanDerWaalsContact C-N 3.33Å; L68-I70 PolarHBondContact O-N 3.09Å; I70-K74 WeakPolarHBondContact O-CB 3.31Å; I70-K74 PolarHBondContact O-N 3.01Å; I70-K74 VanDerWaalsContact O-N 3.13Å; I70-V99 HydrophobicContact CD1-CG2 3.99Å; I70-V99 HydrophobicContact CG1-CG1 4.45Å
71	L	87.8	Confident	87.4	Confident	35 Å²	35	74 Å²	74	18%	0.183	36%	0.358	C	S	.	.	H	α-helix	trans	-69.1	-42.6	-178.8	-69.7	172.8	0	0	0	111.9	T67 L68 K74 F75 F77 M115	T67-L71 HydrophobicContact CG2-CD1 4.11Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.42Å; T67-L71 PolarHBondContact O-N 2.99Å; L68-L71 PolarHBondContact O-N 3.17Å; L68-L71 VanDerWaalsContact O-N 3.1Å; L71-K74 PolarHBondContact O-N 3.18Å; L71-F75 HydrophobicContact CD2-CD2 3.85Å; L71-F75 HydrophobicContact CD2-CE2 4.03Å; L71-F75 WeakPolarHBondContact O-CA 3.46Å; L71-F75 WeakPolarHBondContact O-CB 3.1Å; L71-F75 PolarHBondContact O-N 2.82Å; L71-F77 HydrophobicContact CB-CB 3.68Å; L71-F77 HydrophobicContact CB-CD1 3.57Å; L71-F77 HydrophobicContact CB-CE1 4.43Å; L71-F77 HydrophobicContact CB-CG 3.78Å; L71-F77 HydrophobicContact CD1-CD1 3.75Å; L71-F77 HydrophobicContact CD1-CE1 3.77Å; L71-F77 HydrophobicContact CD1-CG 4.32Å; L71-F77 HydrophobicContact CD1-CZ 4.35Å; L71-F77 HydrophobicContact CG-CD1 4.28Å; L71-F77 WeakPolarHBondContact O-CB 3.24Å; L71-M115 HydrophobicContact CD1-CE 3.38Å
72	E	88.3	Confident	87.5	Confident	120 Å²	120	72 Å²	72	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-59.2	-54	176.6	-173.6	-176	172.6	0	0	110.3	L68 K74 N76	L68-E72 VanDerWaalsContact O-CB 3.32Å; L68-E72 WeakPolarHBondContact O-CB 3.3Å; L68-E72 PolarHBondContact O-N 2.92Å; E72-K74 VanDerWaalsContact C-N 3.27Å; E72-K74 PolarHBondContact O-N 3.38Å; E72-N76 WeakPolarHBondContact O-CA 3.41Å; E72-N76 PolarHBondContact O-N 2.98Å
73	K	86.7	Confident	87.7	Confident	158 Å²	158	70.4 Å²	70.4	69%	0.687	34%	0.342	S	S	*	.	H	α-helix	trans	-61.3	-33.6	179.8	-74.8	-176.3	174.6	-175	0	113.9	C69	C69-K73 WeakPolarHBondContact O-CB 3.5Å; C69-K73 WeakPolarHBondContact O-CG 3.35Å; C69-K73 PolarHBondContact O-N 3.32Å
74	K	83.8	Confident	87.7	Confident	98 Å²	98	75.9 Å²	75.9	43%	0.426	38%	0.377	S	S	.	.	H	α-helix	trans	-93.2	-29.9	-171.8	-169.4	171.1	-178.8	-179.6	0	113.3	I70 L71 E72 L132	I70-K74 WeakPolarHBondContact O-CB 3.31Å; I70-K74 PolarHBondContact O-N 3.01Å; I70-K74 VanDerWaalsContact O-N 3.13Å; L71-K74 PolarHBondContact O-N 3.18Å; E72-K74 VanDerWaalsContact C-N 3.27Å; E72-K74 PolarHBondContact O-N 3.38Å; K74-L132 HydrophobicContact CD-CD1 4.24Å; K74-L132 HydrophobicContact CG-CD1 4Å
75	F	86.9	Confident	87.6	Confident	64 Å²	64	76.6 Å²	76.6	28%	0.281	39%	0.388	S	S	.	.	H	α-helix	trans	-134.6	6.2	-169	-56.6	-68.2	0	0	0	113.8	L71 F77 F123 G124 L132	L71-F75 HydrophobicContact CD2-CD2 3.85Å; L71-F75 HydrophobicContact CD2-CE2 4.03Å; L71-F75 WeakPolarHBondContact O-CA 3.46Å; L71-F75 WeakPolarHBondContact O-CB 3.1Å; L71-F75 PolarHBondContact O-N 2.82Å; F75-F77 HydrophobicContact CB-CB 4.25Å; F75-F77 PolarHBondContact O-N 2.96Å; F75-F123 HydrophobicContact CB-CD1 4.14Å; F75-G124 CarbonylContact O-C 3.59Å; F75-G124 PolarHBondContact O-N 3.36Å; F75-L132 HydrophobicContact CE1-CD1 3.95Å; F75-L132 HydrophobicContact CE1-CD2 3.71Å; F75-L132 HydrophobicContact CE1-CG 4.29Å; F75-L132 HydrophobicContact CZ-CD1 4.34Å; F75-L132 HydrophobicContact CZ-CD2 3.66Å
76	N	87.9	Confident	87.4	Confident	98 Å²	98	71.5 Å²	71.5	52%	0.524	36%	0.363	S	S	.	.			trans	45.2	48.1	-169.2	-63.3	-37.8	0	0	0	110.2	E72 G124	E72-N76 WeakPolarHBondContact O-CA 3.41Å; E72-N76 PolarHBondContact O-N 2.98Å; N76-G124 PolarHBondContact O-N 2.78Å; N76-G124 VanDerWaalsContact O-N 3.09Å
77	F	90.4	Very high	87.4	Confident	9 Å²	9	70.5 Å²	70.5	4%	0.039	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.1	-170.8	173.5	-99.9	0	0	0	111.9	L68 L71 F75 H79 M115 F118 L122 F123	L68-F77 HydrophobicContact CD2-CD1 4.43Å; L68-F77 HydrophobicContact CD2-CE1 4.07Å; L71-F77 HydrophobicContact CB-CB 3.68Å; L71-F77 HydrophobicContact CB-CD1 3.57Å; L71-F77 HydrophobicContact CB-CE1 4.43Å; L71-F77 HydrophobicContact CB-CG 3.78Å; L71-F77 HydrophobicContact CD1-CD1 3.75Å; L71-F77 HydrophobicContact CD1-CE1 3.77Å; L71-F77 HydrophobicContact CD1-CG 4.32Å; L71-F77 HydrophobicContact CD1-CZ 4.35Å; L71-F77 HydrophobicContact CG-CD1 4.28Å; L71-F77 WeakPolarHBondContact O-CB 3.24Å; F75-F77 HydrophobicContact CB-CB 4.25Å; F75-F77 PolarHBondContact O-N 2.96Å; F77-H79 HydrophobicContact CE1-CB 3.82Å; F77-H79 HydrophobicContact CZ-CB 3.91Å; F77-M115 HydrophobicContact CE1-CE 3.8Å; F77-M115 HydrophobicContact CE1-SD 4.47Å; F77-M115 HydrophobicContact CZ-CE 4.15Å; F77-F118 HydrophobicContact CE2-CD1 4.07Å; F77-F118 HydrophobicContact CE2-CE1 4.5Å; F77-F118 AromaticContact CZ-CD1 3.73Å; F77-F118 HydrophobicContact CZ-CD1 3.73Å; F77-F118 AromaticContact CZ-CE1 3.89Å; F77-F118 HydrophobicContact CZ-CE1 3.89Å; F77-L122 WeakPolarHBondContact CA-O 3.5Å; F77-F123 AromaticContact CD2-CD1 3.71Å; F77-F123 HydrophobicContact CD2-CD1 3.71Å; F77-F123 HydrophobicContact CD2-CD2 4.4Å; F77-F123 AromaticContact CD2-CE1 3.35Å; F77-F123 HydrophobicContact CD2-CE1 3.35Å; F77-F123 HydrophobicContact CD2-CE2 4.1Å; F77-F123 HydrophobicContact CD2-CG 4.23Å; F77-F123 AromaticContact CD2-CZ 3.57Å; F77-F123 HydrophobicContact CD2-CZ 3.57Å; F77-F123 HydrophobicContact CE2-CD1 4.45Å; F77-F123 AromaticContact CE2-CE1 3.75Å; F77-F123 HydrophobicContact CE2-CE1 3.75Å; F77-F123 AromaticContact CE2-CE2 3.94Å; F77-F123 HydrophobicContact CE2-CE2 3.94Å; F77-F123 AromaticContact CE2-CZ 3.46Å; F77-F123 HydrophobicContact CE2-CZ 3.46Å; F77-F123 VanDerWaalsContact CE2-CZ 3.46Å; F77-F123 HydrophobicContact CG-CE1 4.39Å
78	E	90.2	Very high	87.1	Confident	94 Å²	94	69 Å²	69	44%	0.439	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.7	169.7	-63.5	172.1	-163	0	0	109	R80 S121 L122	E78-R80 HydrophobicContact CB-CG 3.94Å; E78-R80 IonicContact OE2-CZ 3.15Å; E78-R80 VanDerWaalsContact OE2-CZ 3.25Å; E78-R80 IonicContact OE2-NE 3.96Å; E78-R80 PolarHBondContact OE2-NE 3.27Å; E78-R80 IonicContact OE2-NH2 2.91Å; E78-R80 PolarHBondContact OE2-NH2 3.46Å; E78-S121 CarbonylContact O-C 3.12Å; E78-S121 WeakPolarHBondContact O-CA 3.26Å; E78-S121 VanDerWaalsContact O-CB 3.27Å; E78-S121 WeakPolarHBondContact O-CB 3.5Å; E78-L122 HydrophobicContact CB-CB 4.32Å; E78-L122 PolarHBondContact N-O 3.08Å; E78-L122 PolarHBondContact O-N 3.33Å
79	H	89.3	Confident	86.5	Confident	9 Å²	9	68.4 Å²	68.4	4%	0.042	34%	0.343	C	S	.	.			trans	-71.5	-39.3	-179.9	-171.7	-77.5	0	0	0	112.6	F77 D81 L82 M115 M116 D117 F118 S121	F77-H79 HydrophobicContact CE1-CB 3.82Å; F77-H79 HydrophobicContact CZ-CB 3.91Å; H79-D81 PolarHBondContact CE1-O 2.81Å; H79-D81 PolarHBondContact ND1-N 3.03Å; H79-D81 PolarHBondContact O-N 3.09Å; H79-L82 HydrophobicContact CB-CB 4.25Å; H79-L82 PolarHBondContact ND1-N 2.83Å; H79-L82 VanDerWaalsContact ND1-N 3.18Å; H79-M115 HydrophobicContact CB-SD 4.29Å; H79-M115 PolarHBondContact CD2-SD 2.69Å; H79-M116 PolarHBondContact NE2-O 3.14Å; H79-D117 PolarHBondContact CE1-O 2.98Å; H79-D117 PolarHBondContact NE2-O 3.1Å; H79-F118 AromaticContact CD2-CD1 3.68Å; H79-F118 AromaticContact CD2-CE1 3.71Å; H79-F118 AromaticContact NE2-CD1 3.89Å; H79-S121 WeakPolarHBondContact CA-OG 3.37Å; H79-S121 VanDerWaalsContact O-CA 3.29Å; H79-S121 WeakPolarHBondContact O-CA 3.46Å; H79-S121 PolarHBondContact O-N 3.29Å; H79-S121 PolarHBondContact O-OG 3.22Å
80	R	90.5	Very high	85.9	Confident	152 Å²	152	69.8 Å²	69.8	57%	0.574	34%	0.343	S	S	*	.	S	Bend	trans	64.3	-11.6	179.1	-59.8	-174.9	169.3	-175.3	-6.3	117.5	E78 L120	E78-R80 HydrophobicContact CB-CG 3.94Å; E78-R80 IonicContact OE2-CZ 3.15Å; E78-R80 VanDerWaalsContact OE2-CZ 3.25Å; E78-R80 IonicContact OE2-NE 3.96Å; E78-R80 PolarHBondContact OE2-NE 3.27Å; E78-R80 IonicContact OE2-NH2 2.91Å; E78-R80 PolarHBondContact OE2-NH2 3.46Å; R80-L120 HydrophobicContact CB-CB 4.41Å; R80-L120 WeakPolarHBondContact CB-O 3.29Å; R80-L120 VanDerWaalsContact CD-O 3.27Å; R80-L120 WeakPolarHBondContact CD-O 3.25Å
81	D	90.9	Very high	85.1	Confident	64 Å²	64	72.8 Å²	72.8	34%	0.342	35%	0.351	S	S	.	.			trans	-143.2	46.4	176.6	-168.1	27.7	0	0	0	112.5	H79 H83 N86 L120	H79-D81 PolarHBondContact CE1-O 2.81Å; H79-D81 PolarHBondContact ND1-N 3.03Å; H79-D81 PolarHBondContact O-N 3.09Å; D81-H83 PolarHBondContact O-CD2 3.25Å; D81-H83 PolarHBondContact O-N 2.85Å; D81-H83 IonicContact OD1-CD2 2.77Å; D81-H83 PolarHBondContact OD1-CD2 3.13Å; D81-H83 IonicContact OD2-CD2 3.17Å; D81-H83 IonicContact OD2-NE2 3.82Å; D81-N86 PolarHBondContact O-ND2 3.41Å; D81-L120 HydrophobicContact CB-CB 4.4Å; D81-L120 HydrophobicContact CB-CD1 3.99Å
82	L	88	Confident	84.1	Confident	64 Å²	64	73 Å²	73	34%	0.335	35%	0.353	S	S	.	.			trans	-84.7	78	-175.8	-170.1	62.9	0	0	0	111.3	L68 H79 I87 M115	L68-L82 HydrophobicContact CD1-CD2 3.79Å; L68-L82 HydrophobicContact CD2-CD2 4.42Å; H79-L82 HydrophobicContact CB-CB 4.25Å; H79-L82 PolarHBondContact ND1-N 2.83Å; H79-L82 VanDerWaalsContact ND1-N 3.18Å; L82-I87 HydrophobicContact CD1-CD1 4.2Å; L82-I87 HydrophobicContact CD1-CG1 3.9Å; L82-I87 HydrophobicContact CG-CD1 4.4Å; L82-M115 HydrophobicContact CD1-CG 3.77Å; L82-M115 HydrophobicContact CD1-SD 3.84Å; L82-M115 HydrophobicContact CD2-SD 4.3Å
83	H	87.4	Confident	82.6	Confident	90 Å²	90	76.8 Å²	76.8	42%	0.417	37%	0.368	S	S	.	.			trans	-99.1	169.4	169.7	67.5	92.8	0	0	0	111.5	D81 G85 N86	D81-H83 PolarHBondContact O-CD2 3.25Å; D81-H83 PolarHBondContact O-N 2.85Å; D81-H83 IonicContact OD1-CD2 2.77Å; D81-H83 PolarHBondContact OD1-CD2 3.13Å; D81-H83 IonicContact OD2-CD2 3.17Å; D81-H83 IonicContact OD2-NE2 3.82Å; H83-G85 WeakPolarHBondContact ND1-CA 3.27Å; H83-G85 PolarHBondContact ND1-N 2.71Å; H83-G85 PolarHBondContact O-N 2.78Å; H83-N86 PolarHBondContact CD2-ND2 2.81Å; H83-N86 PolarHBondContact NE2-ND2 3.2Å; H83-N86 VanDerWaalsContact NE2-ND2 3.18Å; H83-N86 PolarHBondContact O-N 3.22Å
84	T	84.7	Confident	81.1	Confident	129 Å²	129	74 Å²	74	79%	0.791	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-59.5	-21.2	-176.9	52.4	0	0	0	0	114.2
85	G	84	Confident	79.9	Confident	32 Å²	32	74.2 Å²	74.2	33%	0.33	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-75.5	-22.4	175.5	0	0	0	0	0	113.9	H83 I87	H83-G85 WeakPolarHBondContact ND1-CA 3.27Å; H83-G85 PolarHBondContact ND1-N 2.71Å; H83-G85 PolarHBondContact O-N 2.78Å; G85-I87 VanDerWaalsContact C-N 3.29Å
86	N	85.5	Confident	78.6	Confident	12 Å²	12	75 Å²	75	6%	0.064	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-93.1	10.5	177	-70.9	-13.3	0	0	0	112.5	D81 H83 M116	D81-N86 PolarHBondContact O-ND2 3.41Å; H83-N86 PolarHBondContact CD2-ND2 2.81Å; H83-N86 PolarHBondContact NE2-ND2 3.2Å; H83-N86 VanDerWaalsContact NE2-ND2 3.18Å; H83-N86 PolarHBondContact O-N 3.22Å; N86-M116 PolarHBondContact O-N 3.27Å
87	I	84	Confident	77.3	Confident	36 Å²	36	73 Å²	73	19%	0.185	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.1	177.9	-64.9	165.6	0	0	0	108.6	L60 L64 L82 G85 L89 C113	L60-I87 HydrophobicContact CD1-CG2 4.43Å; L64-I87 HydrophobicContact CD1-CD1 3.65Å; L64-I87 HydrophobicContact CD1-CG1 4.29Å; L64-I87 HydrophobicContact CD1-CG2 4.33Å; L64-I87 HydrophobicContact CD2-CD1 4.34Å; L64-I87 HydrophobicContact CD2-CG1 4.18Å; L82-I87 HydrophobicContact CD1-CD1 4.2Å; L82-I87 HydrophobicContact CD1-CG1 3.9Å; L82-I87 HydrophobicContact CG-CD1 4.4Å; G85-I87 VanDerWaalsContact C-N 3.29Å; I87-L89 HydrophobicContact CG2-CD2 4.46Å; I87-C113 WeakPolarHBondContact CG2-SG 3.44Å
88	L	80.2	Confident	76	Confident	16 Å²	16	77 Å²	77	8%	0.084	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.8	173.5	-61.1	-171.9	0	0	0	111.7	I43 Q45 C113 Y114 M116	I43-L88 HydrophobicContact CB-CD1 3.89Å; I43-L88 HydrophobicContact CD1-CD1 4.12Å; I43-L88 HydrophobicContact CG2-CD1 3.76Å; Q45-L88 VanDerWaalsContact CD-CD2 3.45Å; Q45-L88 HydrophobicContact CG-CD1 3.82Å; Q45-L88 HydrophobicContact CG-CD2 3.8Å; Q45-L88 HydrophobicContact CG-CG 4.46Å; L88-C113 CarbonylContact O-C 3.54Å; L88-C113 WeakPolarHBondContact O-CA 3.08Å; L88-Y114 PolarHBondContact N-O 2.91Å; L88-Y114 PolarHBondContact O-N 3.15Å; L88-M116 HydrophobicContact CD1-CE 3.53Å; L88-M116 HydrophobicContact CD1-CG 3.9Å; L88-M116 HydrophobicContact CD1-SD 3.25Å; L88-M116 WeakPolarHBondContact CD1-SD 3.43Å; L88-M116 HydrophobicContact CD2-CE 4.01Å; L88-M116 HydrophobicContact CG-CE 3.76Å; L88-M116 HydrophobicContact CG-CG 3.88Å; L88-M116 HydrophobicContact CG-SD 3.83Å
89	L	76.8	Confident	74.8	Confident	35 Å²	35	73.8 Å²	73.8	18%	0.183	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.9	174.5	-60.6	178.6	0	0	0	109.8	F52 I54 L60 I87 L112 C113	F52-L89 HydrophobicContact CD2-CB 4.33Å; F52-L89 HydrophobicContact CD2-CD1 4.39Å; I54-L89 HydrophobicContact CD1-CD1 3.85Å; I54-L89 HydrophobicContact CG1-CD1 3.92Å; L60-L89 HydrophobicContact CD1-CD2 3.35Å; L60-L89 HydrophobicContact CD2-CD1 4.23Å; L60-L89 HydrophobicContact CD2-CD2 3.8Å; L60-L89 HydrophobicContact CG-CD2 4.19Å; I87-L89 HydrophobicContact CG2-CD2 4.46Å; L89-L112 WeakPolarHBondContact CA-O 3.43Å; L89-C113 HydrophobicContact CD2-CB 4.38Å
90	K	75	Confident	73.6	Confident	83 Å²	83	79.8 Å²	79.8	36%	0.361	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126	170.8	-175	170.1	-176.8	164.5	0	109.3	T92 L112 Y114	K90-T92 PolarHBondContact O-N 2.83Å; K90-L112 PolarHBondContact N-O 2.85Å; K90-L112 PolarHBondContact O-N 3.49Å; K90-Y114 HydrophobicContact CB-CD2 4.48Å; K90-Y114 HydrophobicContact CB-CE2 3.85Å; K90-Y114 HydrophobicContact CD-CE2 4.31Å
91	Y	69.3	Low	72.7	Confident	131 Å²	131	75.8 Å²	75.8	51%	0.514	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	123.8	169.5	-69.6	-79.6	0	0	0	109.6	F52 G110	F52-Y91 AromaticContact CD1-CE2 3.53Å; F52-Y91 HydrophobicContact CD1-CE2 3.53Å; F52-Y91 AromaticContact CD1-CZ 3.98Å; F52-Y91 WeakPolarHBondContact CD1-OH 3.11Å; F52-Y91 HydrophobicContact CE1-CD2 4.46Å; F52-Y91 AromaticContact CE1-CE2 3.62Å; F52-Y91 HydrophobicContact CE1-CE2 3.62Å; F52-Y91 HydrophobicContact CG-CE2 4.12Å; F52-Y91 HydrophobicContact CZ-CE2 4.25Å; Y91-G110 CarbonylContact C-O 3.56Å; Y91-G110 WeakPolarHBondContact CA-O 3.12Å; Y91-G110 WeakPolarHBondContact CD1-O 3.16Å
92	T	66.5	Low	71.6	Confident	38 Å²	38	79.4 Å²	79.4	23%	0.233	42%	0.422	C	S	.	.			trans	-139.2	145.7	178.3	-167.2	0	0	0	0	110.8	K90 L94 G110 L112	K90-T92 PolarHBondContact O-N 2.83Å; T92-L94 PolarHBondContact O-N 2.81Å; T92-G110 PolarHBondContact N-O 3.02Å; T92-G110 CarbonylContact O-C 3.53Å; T92-G110 WeakPolarHBondContact O-CA 3.26Å; T92-G110 VanDerWaalsContact O-O 3.12Å; T92-L112 HydrophobicContact CG2-CB 3.59Å; T92-L112 HydrophobicContact CG2-CD2 4.37Å
93	K	56.8	Low	70.6	Confident	200 Å²	200	86 Å²	86	87%	0.87	44%	0.443	S	S	*	.	S	Bend	trans	-82	98.9	167	-66.7	179	177.5	178.4	0	107.4
94	L	55.9	Low	69.5	Low	100 Å²	100	87.1 Å²	87.1	52%	0.524	44%	0.444	S	S	.	.			trans	52.3	115.6	167.1	-74	128.3	0	0	0	116.8	T92 A108	T92-L94 PolarHBondContact O-N 2.81Å; L94-A108 HydrophobicContact CD1-CB 4.08Å; L94-A108 HydrophobicContact CD2-CB 3.96Å; L94-A108 HydrophobicContact CG-CB 3.88Å
95	Q	57.4	Low	68.5	Low	102 Å²	102	87.9 Å²	87.9	48%	0.477	44%	0.439	S	S	.	.			trans	-123	124.5	159.5	-74.9	-162.5	-14.6	0	0	111.1	P106	Q95-P106 WeakPolarHBondContact O-CD 3.18Å
96	P	60.4	Low	67.2	Low	81 Å²	81	88.2 Å²	88.2	53%	0.526	44%	0.435	S	S	.	.			trans	-74.5	139.7	172.2	28.8	-31.5	0	0	0	111	Y104 Q105	P96-Y104 CarbonylContact C-O 3.58Å; P96-Y104 WeakPolarHBondContact CA-O 3.38Å; P96-Q105 HydrophobicContact CB-CG 4Å
97	Y	60.3	Low	65.7	Low	56 Å²	56	98.5 Å²	98.5	22%	0.22	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	156.6	168.6	-62.5	-90.1	0	0	0	110.3	Q63 R103 Y104 P106 L112	Q63-Y97 VanDerWaalsContact CD-OH 3.23Å; Q63-Y97 HydrophobicContact CG-CE2 4.09Å; Q63-Y97 VanDerWaalsContact CG-OH 3.32Å; Q63-Y97 WeakPolarHBondContact CG-OH 3.44Å; Q63-Y97 PolarHBondContact OE1-OH 3.07Å; Y97-R103 CarbonylContact O-C 3.42Å; Y97-R103 WeakPolarHBondContact O-CA 3.28Å; Y97-Y104 PolarHBondContact N-O 3.41Å; Y97-Y104 PolarHBondContact O-N 3.18Å; Y97-P106 HydrophobicContact CD2-CG 3.67Å; Y97-P106 HydrophobicContact CE2-CG 3.59Å; Y97-L112 WeakPolarHBondContact OH-CD1 3.46Å
98	V	63.6	Low	64.1	Low	93 Å²	93	99.8 Å²	99.8	56%	0.564	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	119	168.6	-175.8	0	0	0	0	107.6	K102 R103	V98-K102 WeakPolarHBondContact CA-O 3.4Å; V98-R103 HydrophobicContact CG2-CG 4.21Å
99	V	65.3	Low	62.9	Low	26 Å²	26	100 Å²	100	16%	0.158	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.9	176.6	-170.3	0	0	0	0	107.1	V66 I70 G101 K102 Y104	V66-V99 HydrophobicContact CG1-CG2 3.9Å; I70-V99 HydrophobicContact CD1-CG2 3.99Å; I70-V99 HydrophobicContact CG1-CG1 4.45Å; V99-G101 PolarHBondContact O-N 3.38Å; V99-K102 PolarHBondContact N-O 3.04Å; V99-K102 WeakPolarHBondContact O-CB 3.27Å; V99-K102 PolarHBondContact O-N 2.95Å; V99-Y104 HydrophobicContact CB-CD2 3.92Å; V99-Y104 HydrophobicContact CB-CE2 3.66Å; V99-Y104 HydrophobicContact CG2-CD2 3.97Å; V99-Y104 HydrophobicContact CG2-CE2 4.2Å
100	D	62.8	Low	62.3	Low	135 Å²	135	99.7 Å²	99.7	72%	0.722	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	41.3	-177.7	-53.4	-30.8	0	0	0	113.6	K102	D100-K102 PolarHBondContact O-N 3.08Å
101	G	71.2	Confident	62	Low	69 Å²	69	96.6 Å²	96.6	71%	0.711	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	-8.6	-177.2	0	0	0	0	0	114.9	V99	V99-G101 PolarHBondContact O-N 3.38Å
102	K	69	Low	62.3	Low	139 Å²	139	90.8 Å²	90.8	60%	0.604	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	131.2	177	-64.7	178	-178.2	175.7	0	110	V98 V99 D100 Y104	V98-K102 WeakPolarHBondContact CA-O 3.4Å; V99-K102 PolarHBondContact N-O 3.04Å; V99-K102 WeakPolarHBondContact O-CB 3.27Å; V99-K102 PolarHBondContact O-N 2.95Å; D100-K102 PolarHBondContact O-N 3.08Å; K102-Y104 HydrophobicContact CB-CD2 4.42Å; K102-Y104 HydrophobicContact CB-CE2 3.67Å; K102-Y104 VanDerWaalsContact O-CD2 3.26Å; K102-Y104 WeakPolarHBondContact O-CD2 3.32Å; K102-Y104 WeakPolarHBondContact O-CE2 3.49Å
103	R	65.7	Low	62.8	Low	203 Å²	203	89.6 Å²	89.6	77%	0.766	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	119.6	174.8	-72.5	-173.3	173.5	-158.2	-1.9	109.7	Y97 V98	Y97-R103 CarbonylContact O-C 3.42Å; Y97-R103 WeakPolarHBondContact O-CA 3.28Å; V98-R103 HydrophobicContact CG2-CG 4.21Å
104	Y	65.4	Low	64	Low	113 Å²	113	82.9 Å²	82.9	44%	0.443	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.7	172.5	-65.9	-89.9	0	0	0	108.4	P96 Y97 V99 K102 P106	P96-Y104 CarbonylContact C-O 3.58Å; P96-Y104 WeakPolarHBondContact CA-O 3.38Å; Y97-Y104 PolarHBondContact N-O 3.41Å; Y97-Y104 PolarHBondContact O-N 3.18Å; V99-Y104 HydrophobicContact CB-CD2 3.92Å; V99-Y104 HydrophobicContact CB-CE2 3.66Å; V99-Y104 HydrophobicContact CG2-CD2 3.97Å; V99-Y104 HydrophobicContact CG2-CE2 4.2Å; K102-Y104 HydrophobicContact CB-CD2 4.42Å; K102-Y104 HydrophobicContact CB-CE2 3.67Å; K102-Y104 VanDerWaalsContact O-CD2 3.26Å; K102-Y104 WeakPolarHBondContact O-CD2 3.32Å; K102-Y104 WeakPolarHBondContact O-CE2 3.49Å; Y104-P106 WeakPolarHBondContact O-CD 3.3Å
105	Q	63.7	Low	65.5	Low	145 Å²	145	79.2 Å²	79.2	68%	0.678	41%	0.407	S	S	*	.			trans	-96.5	108.2	167.7	-75	-177.6	45.1	0	0	107.6	P96 R107	P96-Q105 HydrophobicContact CB-CG 4Å; Q105-R107 PolarHBondContact O-N 3.27Å
106	P	56.9	Low	66.9	Low	40 Å²	40	76.6 Å²	76.6	26%	0.26	40%	0.396	S	S	.	.			trans	-60	131.6	170.3	-11.3	24.1	0	0	0	108	Q95 Y97 Y104 A108	Q95-P106 WeakPolarHBondContact O-CD 3.18Å; Y97-P106 HydrophobicContact CD2-CG 3.67Å; Y97-P106 HydrophobicContact CE2-CG 3.59Å; Y104-P106 WeakPolarHBondContact O-CD 3.3Å; P106-A108 PolarHBondContact O-N 3.11Å; P106-A108 VanDerWaalsContact O-N 3.1Å
107	R	54.2	Low	67.9	Low	228 Å²	228	77.1 Å²	77.1	86%	0.86	39%	0.394	S	S	*	.			trans	-55.1	121.4	167.8	-79.4	-178.4	168.9	161.1	-3.3	107.2	N59 Q105 S109	N59-R107 PolarHBondContact ND2-O 3.31Å; Q105-R107 PolarHBondContact O-N 3.27Å; R107-S109 PolarHBondContact O-N 2.8Å
108	A	49.9	Very low	69.2	Low	63 Å²	63	78.7 Å²	78.7	52%	0.521	40%	0.402	S	S	.	.			trans	-51.8	102	-164.5	0	0	0	0	0	113.5	L94 P106	L94-A108 HydrophobicContact CD1-CB 4.08Å; L94-A108 HydrophobicContact CD2-CB 3.96Å; L94-A108 HydrophobicContact CG-CB 3.88Å; P106-A108 PolarHBondContact O-N 3.11Å; P106-A108 VanDerWaalsContact O-N 3.1Å
109	S	55	Low	70.2	Confident	19 Å²	19	77.4 Å²	77.4	13%	0.133	41%	0.407	C	S	.	.			trans	-96.4	6.5	163	54.5	0	0	0	0	113.5	F56 N59 R107 S111	F56-S109 VanDerWaalsContact CD2-CB 3.41Å; N59-S109 WeakPolarHBondContact CB-OG 3.47Å; N59-S109 VanDerWaalsContact ND2-CB 3.28Å; N59-S109 WeakPolarHBondContact ND2-CB 3.38Å; N59-S109 PolarHBondContact ND2-OG 3.02Å; N59-S109 VanDerWaalsContact ND2-OG 3.09Å; R107-S109 PolarHBondContact O-N 2.8Å; S109-S111 PolarHBondContact O-N 3.46Å; S109-S111 VanDerWaalsContact O-N 3.1Å
110	G	63.5	Low	71.1	Confident	29 Å²	29	81.6 Å²	81.6	30%	0.299	43%	0.429	S	S	.	.	S	Bend	trans	68.4	10.3	172.1	0	0	0	0	0	114.7	Y91 T92	Y91-G110 CarbonylContact C-O 3.56Å; Y91-G110 WeakPolarHBondContact CA-O 3.12Å; Y91-G110 WeakPolarHBondContact CD1-O 3.16Å; T92-G110 PolarHBondContact N-O 3.02Å; T92-G110 CarbonylContact O-C 3.53Å; T92-G110 WeakPolarHBondContact O-CA 3.26Å; T92-G110 VanDerWaalsContact O-O 3.12Å
111	S	68.4	Low	72.3	Confident	18 Å²	18	76.1 Å²	76.1	13%	0.126	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.5	-172.8	60.3	0	0	0	0	111.4	Q63 S109	Q63-S111 PolarHBondContact NE2-O 2.8Å; S109-S111 PolarHBondContact O-N 3.46Å; S109-S111 VanDerWaalsContact O-N 3.1Å
112	L	75.7	Confident	73.1	Confident	10 Å²	10	76.2 Å²	76.2	5%	0.052	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.9	174.4	-178.4	60.1	0	0	0	109.7	L89 K90 T92 Y97 Y114	L89-L112 WeakPolarHBondContact CA-O 3.43Å; K90-L112 PolarHBondContact N-O 2.85Å; K90-L112 PolarHBondContact O-N 3.49Å; T92-L112 HydrophobicContact CG2-CB 3.59Å; T92-L112 HydrophobicContact CG2-CD2 4.37Å; Y97-L112 WeakPolarHBondContact OH-CD1 3.46Å; L112-Y114 HydrophobicContact CB-CE2 4.44Å; L112-Y114 HydrophobicContact CD2-CE1 4.14Å; L112-Y114 HydrophobicContact CD2-CE2 3.82Å; L112-Y114 VanDerWaalsContact CD2-CZ 3.41Å; L112-Y114 WeakPolarHBondContact CD2-OH 3.47Å; L112-Y114 HydrophobicContact CG-CD2 4.49Å; L112-Y114 HydrophobicContact CG-CE1 4.47Å; L112-Y114 HydrophobicContact CG-CE2 3.86Å
113	C	77.8	Confident	73.9	Confident	13 Å²	13	74.2 Å²	74.2	9%	0.088	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.3	177.1	-173.5	0	0	0	0	111.5	L60 Q63 L64 I87 L88 L89	L60-C113 HydrophobicContact CD1-CB 3.32Å; L60-C113 WeakPolarHBondContact CD1-SG 3.33Å; Q63-C113 HydrophobicContact CB-CB 4.16Å; L64-C113 WeakPolarHBondContact CD2-SG 3.36Å; L64-C113 VanDerWaalsContact CG-SG 3.57Å; I87-C113 WeakPolarHBondContact CG2-SG 3.44Å; L88-C113 CarbonylContact O-C 3.54Å; L88-C113 WeakPolarHBondContact O-CA 3.08Å; L89-C113 HydrophobicContact CD2-CB 4.38Å
114	Y	82.4	Confident	74.5	Confident	58 Å²	58	65.8 Å²	65.8	23%	0.227	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.4	168.1	-58.4	-88.9	0	0	0	109.7	I43 L88 K90 L112	I43-Y114 HydrophobicContact CD1-CD1 4.36Å; I43-Y114 HydrophobicContact CD1-CG 4.18Å; I43-Y114 HydrophobicContact CG2-CD2 4.42Å; L88-Y114 PolarHBondContact N-O 2.91Å; L88-Y114 PolarHBondContact O-N 3.15Å; K90-Y114 HydrophobicContact CB-CD2 4.48Å; K90-Y114 HydrophobicContact CB-CE2 3.85Å; K90-Y114 HydrophobicContact CD-CE2 4.31Å; L112-Y114 HydrophobicContact CB-CE2 4.44Å; L112-Y114 HydrophobicContact CD2-CE1 4.14Å; L112-Y114 HydrophobicContact CD2-CE2 3.82Å; L112-Y114 VanDerWaalsContact CD2-CZ 3.41Å; L112-Y114 WeakPolarHBondContact CD2-OH 3.47Å; L112-Y114 HydrophobicContact CG-CD2 4.49Å; L112-Y114 HydrophobicContact CG-CE1 4.47Å; L112-Y114 HydrophobicContact CG-CE2 3.86Å
115	M	86.6	Confident	74.3	Confident	24 Å²	24	67.9 Å²	67.9	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135.8	168.9	-176	168.6	57.7	0	0	108.8	T67 L68 L71 F77 H79 L82 F118	T67-M115 HydrophobicContact CG2-CE 4.29Å; L68-M115 HydrophobicContact CD2-CE 4Å; L68-M115 HydrophobicContact CD2-SD 3.76Å; L71-M115 HydrophobicContact CD1-CE 3.38Å; F77-M115 HydrophobicContact CE1-CE 3.8Å; F77-M115 HydrophobicContact CE1-SD 4.47Å; F77-M115 HydrophobicContact CZ-CE 4.15Å; H79-M115 HydrophobicContact CB-SD 4.29Å; H79-M115 PolarHBondContact CD2-SD 2.69Å; L82-M115 HydrophobicContact CD1-CG 3.77Å; L82-M115 HydrophobicContact CD1-SD 3.84Å; L82-M115 HydrophobicContact CD2-SD 4.3Å; M115-F118 HydrophobicContact CB-CZ 4.47Å; M115-F118 HydrophobicContact CE-CE1 3.75Å; M115-F118 HydrophobicContact CE-CZ 4.32Å; M115-F118 HydrophobicContact CG-CE1 3.92Å; M115-F118 HydrophobicContact CG-CZ 4.27Å; M115-F118 WeakPolarHBondContact O-CZ 3.49Å; M115-F118 HydrophobicContact SD-CE1 4.32Å
116	M	86.2	Confident	73.8	Confident	47 Å²	47	62.9 Å²	62.9	23%	0.232	36%	0.356	C	S	.	.			trans	-127.9	178.1	-179.4	-66.3	-139.2	-48.8	0	0	111.4	I43 H79 N86 L88	I43-M116 HydrophobicContact CD1-SD 4.29Å; H79-M116 PolarHBondContact NE2-O 3.14Å; N86-M116 PolarHBondContact O-N 3.27Å; L88-M116 HydrophobicContact CD1-CE 3.53Å; L88-M116 HydrophobicContact CD1-CG 3.9Å; L88-M116 HydrophobicContact CD1-SD 3.25Å; L88-M116 WeakPolarHBondContact CD1-SD 3.43Å; L88-M116 HydrophobicContact CD2-CE 4.01Å; L88-M116 HydrophobicContact CG-CE 3.76Å; L88-M116 HydrophobicContact CG-CG 3.88Å; L88-M116 HydrophobicContact CG-SD 3.83Å
117	D	83.1	Confident	73.7	Confident	91 Å²	91	67.2 Å²	67.2	49%	0.487	39%	0.386	S	S	.	.			trans	52.8	85.9	176	-158.4	-12	0	0	0	113.3	H79 G119	H79-D117 PolarHBondContact CE1-O 2.98Å; H79-D117 PolarHBondContact NE2-O 3.1Å; D117-G119 VanDerWaalsContact C-N 3.31Å; D117-G119 PolarHBondContact OD1-N 2.76Å
118	F	86.1	Confident	73.6	Confident	89 Å²	89	60.4 Å²	60.4	39%	0.39	37%	0.372	S	S	.	.			trans	-96.2	17.6	179.1	-54.9	-67.7	0	0	0	112.1	F77 H79 M115 L120 S121	F77-F118 HydrophobicContact CE2-CD1 4.07Å; F77-F118 HydrophobicContact CE2-CE1 4.5Å; F77-F118 AromaticContact CZ-CD1 3.73Å; F77-F118 HydrophobicContact CZ-CD1 3.73Å; F77-F118 AromaticContact CZ-CE1 3.89Å; F77-F118 HydrophobicContact CZ-CE1 3.89Å; H79-F118 AromaticContact CD2-CD1 3.68Å; H79-F118 AromaticContact CD2-CE1 3.71Å; H79-F118 AromaticContact NE2-CD1 3.89Å; M115-F118 HydrophobicContact CB-CZ 4.47Å; M115-F118 HydrophobicContact CE-CE1 3.75Å; M115-F118 HydrophobicContact CE-CZ 4.32Å; M115-F118 HydrophobicContact CG-CE1 3.92Å; M115-F118 HydrophobicContact CG-CZ 4.27Å; M115-F118 WeakPolarHBondContact O-CZ 3.49Å; M115-F118 HydrophobicContact SD-CE1 4.32Å; F118-L120 VanDerWaalsContact C-N 3.26Å; F118-L120 PolarHBondContact O-N 3.45Å; F118-S121 VanDerWaalsContact CA-OG 3.26Å; F118-S121 WeakPolarHBondContact CA-OG 3.42Å; F118-S121 WeakPolarHBondContact O-CB 3.38Å; F118-S121 PolarHBondContact O-N 3.04Å; F118-S121 VanDerWaalsContact O-N 3.09Å
119	G	84.4	Confident	73.4	Confident	66 Å²	66	59.3 Å²	59.3	68%	0.68	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.3	-173.1	0	0	0	0	0	113.8	D117	D117-G119 VanDerWaalsContact C-N 3.31Å; D117-G119 PolarHBondContact OD1-N 2.76Å
120	L	85	Confident	73	Confident	115 Å²	115	62.9 Å²	62.9	60%	0.602	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	0.1	176.4	-63.6	178.8	0	0	0	113.1	R80 D81 F118	R80-L120 HydrophobicContact CB-CB 4.41Å; R80-L120 WeakPolarHBondContact CB-O 3.29Å; R80-L120 VanDerWaalsContact CD-O 3.27Å; R80-L120 WeakPolarHBondContact CD-O 3.25Å; D81-L120 HydrophobicContact CB-CB 4.4Å; D81-L120 HydrophobicContact CB-CD1 3.99Å; F118-L120 VanDerWaalsContact C-N 3.26Å; F118-L120 PolarHBondContact O-N 3.45Å
121	S	88.3	Confident	72.3	Confident	19 Å²	19	67.3 Å²	67.3	13%	0.133	40%	0.4	C	S	.	.			trans	-72.8	141.6	-175.1	-56.7	0	0	0	0	112.1	E78 H79 F118	E78-S121 CarbonylContact O-C 3.12Å; E78-S121 WeakPolarHBondContact O-CA 3.26Å; E78-S121 VanDerWaalsContact O-CB 3.27Å; E78-S121 WeakPolarHBondContact O-CB 3.5Å; H79-S121 WeakPolarHBondContact CA-OG 3.37Å; H79-S121 VanDerWaalsContact O-CA 3.29Å; H79-S121 WeakPolarHBondContact O-CA 3.46Å; H79-S121 PolarHBondContact O-N 3.29Å; H79-S121 PolarHBondContact O-OG 3.22Å; F118-S121 VanDerWaalsContact CA-OG 3.26Å; F118-S121 WeakPolarHBondContact CA-OG 3.42Å; F118-S121 WeakPolarHBondContact O-CB 3.38Å; F118-S121 PolarHBondContact O-N 3.04Å; F118-S121 VanDerWaalsContact O-N 3.09Å
122	L	87.5	Confident	71.2	Confident	72 Å²	72	68.6 Å²	68.6	38%	0.377	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.7	172.4	-174	65.5	0	0	0	109.9	F77 E78	F77-L122 WeakPolarHBondContact CA-O 3.5Å; E78-L122 HydrophobicContact CB-CB 4.32Å; E78-L122 PolarHBondContact N-O 3.08Å; E78-L122 PolarHBondContact O-N 3.33Å
123	F	86.1	Confident	69.9	Low	96 Å²	96	73.5 Å²	73.5	42%	0.421	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.6	166.6	-65.1	-95.8	0	0	0	107.2	F75 F77 M125	F75-F123 HydrophobicContact CB-CD1 4.14Å; F77-F123 AromaticContact CD2-CD1 3.71Å; F77-F123 HydrophobicContact CD2-CD1 3.71Å; F77-F123 HydrophobicContact CD2-CD2 4.4Å; F77-F123 AromaticContact CD2-CE1 3.35Å; F77-F123 HydrophobicContact CD2-CE1 3.35Å; F77-F123 HydrophobicContact CD2-CE2 4.1Å; F77-F123 HydrophobicContact CD2-CG 4.23Å; F77-F123 AromaticContact CD2-CZ 3.57Å; F77-F123 HydrophobicContact CD2-CZ 3.57Å; F77-F123 HydrophobicContact CE2-CD1 4.45Å; F77-F123 AromaticContact CE2-CE1 3.75Å; F77-F123 HydrophobicContact CE2-CE1 3.75Å; F77-F123 AromaticContact CE2-CE2 3.94Å; F77-F123 HydrophobicContact CE2-CE2 3.94Å; F77-F123 AromaticContact CE2-CZ 3.46Å; F77-F123 HydrophobicContact CE2-CZ 3.46Å; F77-F123 VanDerWaalsContact CE2-CZ 3.46Å; F77-F123 HydrophobicContact CG-CE1 4.39Å; F123-M125 VanDerWaalsContact C-N 3.26Å; F123-M125 PolarHBondContact O-N 2.83Å
124	G	79.1	Confident	68.6	Low	26 Å²	26	76.8 Å²	76.8	27%	0.268	45%	0.447	S	S	.	.			trans	-72.5	85.5	171.1	0	0	0	0	0	109.6	F75 N76 G126	F75-G124 CarbonylContact O-C 3.59Å; F75-G124 PolarHBondContact O-N 3.36Å; N76-G124 PolarHBondContact O-N 2.78Å; N76-G124 VanDerWaalsContact O-N 3.09Å; G124-G126 PolarHBondContact O-N 2.85Å
125	M	60.5	Low	67.1	Low	157 Å²	157	83.7 Å²	83.7	77%	0.773	47%	0.474	S	S	*	.			trans	-69.9	79.2	169.8	-67.5	-170.9	-65.7	0	0	109.5	F123 A129	F123-M125 VanDerWaalsContact C-N 3.26Å; F123-M125 PolarHBondContact O-N 2.83Å; M125-A129 HydrophobicContact CG-CB 4.39Å; M125-A129 HydrophobicContact SD-CB 4.39Å
126	G	53.1	Low	65.1	Low	41 Å²	41	91.1 Å²	91.1	42%	0.423	50%	0.502	S	S	.	.			trans	-64.7	162.1	153.7	0	0	0	0	0	109.3	G124 C128 A129	G124-G126 PolarHBondContact O-N 2.85Å; G126-C128 PolarHBondContact O-N 2.97Å; G126-A129 PolarHBondContact O-N 3.3Å
127	C	54	Low	63.3	Low	131 Å²	131	95.1 Å²	95.1	89%	0.885	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-1.4	-173.3	-61.6	0	0	0	0	117.7
128	C	52.3	Low	61	Low	85 Å²	85	93.7 Å²	93.7	57%	0.574	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-7.7	177.4	-69.9	0	0	0	0	115.5	G126 T130 L131 L132	G126-C128 PolarHBondContact O-N 2.97Å; C128-T130 PolarHBondContact O-N 2.77Å; C128-L131 PolarHBondContact O-N 2.89Å; C128-L131 VanDerWaalsContact O-N 3.09Å; C128-L132 PolarHBondContact O-N 2.8Å
129	A	46.9	Very low	58.7	Low	39 Å²	39	97.9 Å²	97.9	32%	0.322	56%	0.564	S	S	.	*	H	α-helix	trans	-58.3	-31.3	178.3	0	0	0	0	0	113	M125 G126 L131 L132 L133	M125-A129 HydrophobicContact CG-CB 4.39Å; M125-A129 HydrophobicContact SD-CB 4.39Å; G126-A129 PolarHBondContact O-N 3.3Å; A129-L131 PolarHBondContact O-N 3.27Å; A129-L132 PolarHBondContact O-N 2.76Å; A129-L133 PolarHBondContact O-N 2.72Å; A129-L133 VanDerWaalsContact O-N 3.11Å
130	T	46.6	Very low	57.5	Low	95 Å²	95	99.5 Å²	99.5	58%	0.583	56%	0.558	S	S	*	*	H	α-helix	trans	-64.6	-38.5	176.7	-35.3	0	0	0	0	112.1	C128 L134	C128-T130 PolarHBondContact O-N 2.77Å; T130-L134 HydrophobicContact CG2-CD1 4.34Å; T130-L134 WeakPolarHBondContact O-CB 3.35Å; T130-L134 WeakPolarHBondContact O-CD1 3.49Å; T130-L134 VanDerWaalsContact O-CG 3.23Å; T130-L134 WeakPolarHBondContact O-CG 3.49Å; T130-L134 PolarHBondContact O-N 2.7Å
131	L	48	Very low	56	Low	122 Å²	122	98.6 Å²	98.6	64%	0.639	56%	0.556	S	S	*	*	H	α-helix	trans	-71.4	-33.2	-179.9	-83.5	158.8	0	0	0	112.4	C128 A129 Y135	C128-L131 PolarHBondContact O-N 2.89Å; C128-L131 VanDerWaalsContact O-N 3.09Å; A129-L131 PolarHBondContact O-N 3.27Å; L131-Y135 WeakPolarHBondContact O-CB 3.32Å; L131-Y135 PolarHBondContact O-N 3.31Å
132	L	46.5	Very low	54.2	Low	45 Å²	45	103.1 Å²	103.1	24%	0.236	58%	0.579	C	S	.	*	H	α-helix	trans	-77.5	-34.5	177.1	-122.1	117.8	0	0	0	113.2	K74 F75 C128 A129 L134 Y135 Y136	K74-L132 HydrophobicContact CD-CD1 4.24Å; K74-L132 HydrophobicContact CG-CD1 4Å; F75-L132 HydrophobicContact CE1-CD1 3.95Å; F75-L132 HydrophobicContact CE1-CD2 3.71Å; F75-L132 HydrophobicContact CE1-CG 4.29Å; F75-L132 HydrophobicContact CZ-CD1 4.34Å; F75-L132 HydrophobicContact CZ-CD2 3.66Å; C128-L132 PolarHBondContact O-N 2.8Å; A129-L132 PolarHBondContact O-N 2.76Å; L132-L134 VanDerWaalsContact C-N 3.34Å; L132-Y135 PolarHBondContact O-N 3.25Å; L132-Y136 HydrophobicContact CD2-CD2 3.89Å; L132-Y136 HydrophobicContact CD2-CE2 4Å; L132-Y136 WeakPolarHBondContact O-CB 3.39Å; L132-Y136 PolarHBondContact O-N 3.16Å
133	L	46.8	Very low	52.2	Low	112 Å²	112	104.9 Å²	104.9	59%	0.586	59%	0.591	S	S	*	*	H	α-helix	trans	-61.3	-44.8	168.6	-114.5	94.7	0	0	0	110.3	A129 Y136 L137	A129-L133 PolarHBondContact O-N 2.72Å; A129-L133 VanDerWaalsContact O-N 3.11Å; L133-Y136 PolarHBondContact O-N 2.97Å; L133-L137 HydrophobicContact CB-CD1 4.28Å; L133-L137 HydrophobicContact CD2-CD1 3.66Å; L133-L137 HydrophobicContact CG-CD1 3.96Å; L133-L137 WeakPolarHBondContact O-CA 3.36Å; L133-L137 WeakPolarHBondContact O-CB 3.3Å; L133-L137 VanDerWaalsContact O-CG 3.24Å; L133-L137 WeakPolarHBondContact O-CG 3.47Å; L133-L137 PolarHBondContact O-N 3.18Å
134	L	50.3	Low	50.1	Low	82 Å²	82	105.4 Å²	105.4	43%	0.429	60%	0.602	S	S	.	*	H	α-helix	trans	-64.2	-41.3	177.4	-72.1	165.2	0	0	0	112.5	T130 L132 Y136 G138 T139	T130-L134 HydrophobicContact CG2-CD1 4.34Å; T130-L134 WeakPolarHBondContact O-CB 3.35Å; T130-L134 WeakPolarHBondContact O-CD1 3.49Å; T130-L134 VanDerWaalsContact O-CG 3.23Å; T130-L134 WeakPolarHBondContact O-CG 3.49Å; T130-L134 PolarHBondContact O-N 2.7Å; L132-L134 VanDerWaalsContact C-N 3.34Å; L134-Y136 PolarHBondContact O-N 3.46Å; L134-G138 PolarHBondContact O-N 3.19Å; L134-G138 VanDerWaalsContact O-N 3.17Å; L134-T139 HydrophobicContact CD2-CG2 4.17Å
135	Y	50.7	Low	48.2	Very low	203 Å²	203	110.7 Å²	110.7	80%	0.796	62%	0.624	S	S	*	*	H	α-helix	trans	-71.1	-29.5	179.8	-156.9	-89.8	0	0	0	113.6	L131 L132	L131-Y135 WeakPolarHBondContact O-CB 3.32Å; L131-Y135 PolarHBondContact O-N 3.31Å; L132-Y135 PolarHBondContact O-N 3.25Å
136	Y	46.6	Very low	47.3	Very low	181 Å²	181	107.4 Å²	107.4	71%	0.71	61%	0.613	S	S	*	*	H	α-helix	trans	-92.9	-25.7	176.5	-94.2	-91.1	0	0	0	114.3	L132 L133 L134 G138	L132-Y136 HydrophobicContact CD2-CD2 3.89Å; L132-Y136 HydrophobicContact CD2-CE2 4Å; L132-Y136 WeakPolarHBondContact O-CB 3.39Å; L132-Y136 PolarHBondContact O-N 3.16Å; L133-Y136 PolarHBondContact O-N 2.97Å; L134-Y136 PolarHBondContact O-N 3.46Å; Y136-G138 VanDerWaalsContact C-N 3.34Å
137	L	47.1	Very low	46.9	Very low	130 Å²	130	112.5 Å²	112.5	68%	0.681	63%	0.628	S	S	*	*	H	α-helix	trans	-86	-5	175.5	-68.3	170.5	0	0	0	113.4	L133	L133-L137 HydrophobicContact CB-CD1 4.28Å; L133-L137 HydrophobicContact CD2-CD1 3.66Å; L133-L137 HydrophobicContact CG-CD1 3.96Å; L133-L137 WeakPolarHBondContact O-CA 3.36Å; L133-L137 WeakPolarHBondContact O-CB 3.3Å; L133-L137 VanDerWaalsContact O-CG 3.24Å; L133-L137 WeakPolarHBondContact O-CG 3.47Å; L133-L137 PolarHBondContact O-N 3.18Å
138	G	34.7	Very low	46.3	Very low	62 Å²	62	111 Å²	111	64%	0.639	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.3	69.4	168.8	0	0	0	0	0	112.3	L134 Y136	L134-G138 PolarHBondContact O-N 3.19Å; L134-G138 VanDerWaalsContact O-N 3.17Å; Y136-G138 VanDerWaalsContact C-N 3.34Å
139	T	39	Very low	45.7	Very low	176 Å²	176	113.4 Å²	113.4	100%	1.08	61%	0.609	S	S	*	*			trans	-83.5	0	150.9	52.1	0	0	0	0	109.6	L134	L134-T139 HydrophobicContact CD2-CG2 4.17Å

Retrieved 139 of 139 residues in 56.7 ms (Link to these results)

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