A0A3Q0KJS5_SCHMA Loading...

PRKR-interacting protein 1

AlphaFold DB , UniProt , Accession A0A3Q0KJS5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 199 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	55.7	Low	228 Å²	228	130.3 Å²	130.3	100%	1.123	68%	0.684	S	S	*	*				0	121.1	0	-66.6	-168.4	176.3	0	0	107.5	L3	M1-L3 PolarHBondContact O-N 3.42Å
2	N	44.5	Very low	56.2	Low	158 Å²	158	129.1 Å²	129.1	85%	0.845	69%	0.69	S	S	*	*			trans	-70.6	110	-176.5	-76.9	-26.7	0	0	0	109.9	N4	N2-N4 PolarHBondContact O-N 3.13Å
3	L	54.5	Low	57	Low	162 Å²	162	124.4 Å²	124.4	85%	0.848	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	16.1	-177	-69.3	164.1	0	0	0	113.9	M1	M1-L3 PolarHBondContact O-N 3.42Å
4	N	56.2	Low	57.4	Low	147 Å²	147	120.9 Å²	120.9	79%	0.786	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	4.6	-168.3	-68.3	-14.2	0	0	0	115.2	N2 A6	N2-N4 PolarHBondContact O-N 3.13Å; N4-A6 PolarHBondContact O-N 3.11Å
5	N	54.9	Low	57.9	Low	162 Å²	162	116.8 Å²	116.8	87%	0.866	67%	0.67	S	S	*	*			trans	-94.9	73.1	170.4	-74	-15.8	0	0	0	109.6	H7	N5-H7 PolarHBondContact O-N 3.39Å
6	A	56.9	Low	58.3	Low	83 Å²	83	117.6 Å²	117.6	69%	0.686	67%	0.666	S	S	*	*			trans	-73.6	113	169.8	0	0	0	0	0	108.7	N4 K8	N4-A6 PolarHBondContact O-N 3.11Å; A6-K8 PolarHBondContact O-N 3.01Å; A6-K8 VanDerWaalsContact O-N 3.16Å
7	H	57.4	Low	58.7	Low	160 Å²	160	116.7 Å²	116.7	74%	0.741	66%	0.655	S	S	*	*			trans	-55.6	118.8	164.9	-176.9	-84.9	0	0	0	107.8	N5 D9	N5-H7 PolarHBondContact O-N 3.39Å; H7-D9 IonicContact ND1-OD1 3.89Å; H7-D9 PolarHBondContact O-N 2.99Å
8	K	61.5	Low	58.8	Low	110 Å²	110	113.7 Å²	113.7	48%	0.478	64%	0.637	S	S	.	*			trans	-77.1	118	178.8	-69.2	176.8	168	-151.8	0	108.2	A6 M10 E17	A6-K8 PolarHBondContact O-N 3.01Å; A6-K8 VanDerWaalsContact O-N 3.16Å; K8-M10 HydrophobicContact CB-CE 3.96Å; K8-M10 HydrophobicContact CD-CE 4.34Å; K8-M10 PolarHBondContact O-N 3.19Å; K8-E17 HydrophobicContact CB-CG 4.5Å; K8-E17 HydrophobicContact CD-CG 4.34Å; K8-E17 VanDerWaalsContact CD-OE1 3.31Å; K8-E17 WeakPolarHBondContact CD-OE1 3.38Å; K8-E17 WeakPolarHBondContact CE-OE1 3.49Å; K8-E17 VanDerWaalsContact NZ-CD 3.26Å; K8-E17 IonicContact NZ-OE1 3.01Å; K8-E17 PolarHBondContact NZ-OE1 3.47Å; K8-E17 IonicContact NZ-OE2 2.81Å; K8-E17 PolarHBondContact NZ-OE2 3.25Å
9	D	61.4	Low	58.9	Low	96 Å²	96	115.4 Å²	115.4	51%	0.513	64%	0.636	S	S	.	*			trans	-68	114.2	174.4	-61.7	-27.4	0	0	0	108.8	H7 I18	H7-D9 IonicContact ND1-OD1 3.89Å; H7-D9 PolarHBondContact O-N 2.99Å; D9-I18 HydrophobicContact CB-CD1 4.11Å; D9-I18 WeakPolarHBondContact O-CB 3.5Å; D9-I18 WeakPolarHBondContact O-CG1 3.35Å; D9-I18 PolarHBondContact O-N 3.01Å
10	M	64.4	Low	58.8	Low	104 Å²	104	121 Å²	121	51%	0.512	65%	0.647	S	S	.	*	B	Isolated β-bridge	trans	-95.2	140.8	178.2	-60.6	-63.2	-176.2	0	0	109.8	K8 P12 E17	K8-M10 HydrophobicContact CB-CE 3.96Å; K8-M10 HydrophobicContact CD-CE 4.34Å; K8-M10 PolarHBondContact O-N 3.19Å; M10-P12 WeakPolarHBondContact O-CD 3.41Å; M10-E17 HydrophobicContact SD-CB 4.13Å
11	N	61.9	Low	58.6	Low	23 Å²	23	122.5 Å²	122.5	12%	0.123	66%	0.655	C	S	.	*			trans	-70.7	119.2	174.6	-179.7	-2.7	0	0	0	110.3	G13 T14 G15 E16 I18 R24	N11-G13 PolarHBondContact O-N 3.38Å; N11-G13 VanDerWaalsContact O-N 3.09Å; N11-G13 PolarHBondContact OD1-N 3.29Å; N11-T14 PolarHBondContact ND2-OG1 3.03Å; N11-T14 PolarHBondContact O-N 3.47Å; N11-G15 WeakPolarHBondContact O-CA 3.24Å; N11-G15 PolarHBondContact O-N 3.37Å; N11-E16 PolarHBondContact N-O 3.21Å; N11-I18 HydrophobicContact CB-CG1 4.27Å; N11-R24 PolarHBondContact ND2-NH2 3.18Å
12	P	62.1	Low	59.6	Low	116 Å²	116	117.4 Å²	117.4	75%	0.753	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-16.1	-178	26.7	-35.3	0	0	0	113.8	M10	M10-P12 WeakPolarHBondContact O-CD 3.41Å
13	G	65.8	Low	60.3	Low	68 Å²	68	119.8 Å²	119.8	70%	0.701	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-33.8	177.3	0	0	0	0	0	115	N11	N11-G13 PolarHBondContact O-N 3.38Å; N11-G13 VanDerWaalsContact O-N 3.09Å; N11-G13 PolarHBondContact OD1-N 3.29Å
14	T	63.4	Low	60.7	Low	76 Å²	76	119.8 Å²	119.8	47%	0.466	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.7	-10.4	-174.6	63.7	0	0	0	0	114	N11 E16	N11-T14 PolarHBondContact ND2-OG1 3.03Å; N11-T14 PolarHBondContact O-N 3.47Å; T14-E16 PolarHBondContact O-N 2.94Å; T14-E16 VanDerWaalsContact O-N 3.13Å; T14-E16 PolarHBondContact OG1-OE2 3.43Å
15	G	64	Low	61.3	Low	59 Å²	59	123 Å²	123	61%	0.608	62%	0.623	S	S	*	*			trans	66.8	4.9	-175.6	0	0	0	0	0	114	N11	N11-G15 WeakPolarHBondContact O-CA 3.24Å; N11-G15 PolarHBondContact O-N 3.37Å
16	E	65	Low	62.1	Low	129 Å²	129	119.4 Å²	119.4	60%	0.603	60%	0.602	S	S	*	*			trans	-83.9	144.3	-179.1	-65.8	167.6	151.2	0	0	111.1	N11 T14 I18	N11-E16 PolarHBondContact N-O 3.21Å; T14-E16 PolarHBondContact O-N 2.94Å; T14-E16 VanDerWaalsContact O-N 3.13Å; T14-E16 PolarHBondContact OG1-OE2 3.43Å; E16-I18 PolarHBondContact O-N 2.84Å
17	E	64.5	Low	63.3	Low	103 Å²	103	117 Å²	117	48%	0.481	59%	0.586	S	S	.	*	B	Isolated β-bridge	trans	-62.2	121.4	173.1	-179	172.9	-180	0	0	109.6	K8 M10 K19	K8-E17 HydrophobicContact CB-CG 4.5Å; K8-E17 HydrophobicContact CD-CG 4.34Å; K8-E17 VanDerWaalsContact CD-OE1 3.31Å; K8-E17 WeakPolarHBondContact CD-OE1 3.38Å; K8-E17 WeakPolarHBondContact CE-OE1 3.49Å; K8-E17 VanDerWaalsContact NZ-CD 3.26Å; K8-E17 IonicContact NZ-OE1 3.01Å; K8-E17 PolarHBondContact NZ-OE1 3.47Å; K8-E17 IonicContact NZ-OE2 2.81Å; K8-E17 PolarHBondContact NZ-OE2 3.25Å; M10-E17 HydrophobicContact SD-CB 4.13Å; E17-K19 PolarHBondContact O-N 3.43Å; E17-K19 VanDerWaalsContact O-N 3.08Å
18	I	61.5	Low	64.6	Low	63 Å²	63	114.5 Å²	114.5	32%	0.323	58%	0.582	S	S	.	*			trans	-68.8	110.3	175.3	-59.7	172.1	0	0	0	107.2	D9 N11 E16 R20 E22	D9-I18 HydrophobicContact CB-CD1 4.11Å; D9-I18 WeakPolarHBondContact O-CB 3.5Å; D9-I18 WeakPolarHBondContact O-CG1 3.35Å; D9-I18 PolarHBondContact O-N 3.01Å; N11-I18 HydrophobicContact CB-CG1 4.27Å; E16-I18 PolarHBondContact O-N 2.84Å; I18-R20 PolarHBondContact O-N 2.92Å; I18-E22 WeakPolarHBondContact CG2-O 3.16Å
19	K	61.1	Low	66	Low	146 Å²	146	118.7 Å²	118.7	64%	0.635	60%	0.596	S	S	*	*			trans	-57.6	137.2	175.4	-69.9	175.5	-177.6	168.2	0	108.6	E17 N21 E22	E17-K19 PolarHBondContact O-N 3.43Å; E17-K19 VanDerWaalsContact O-N 3.08Å; K19-N21 PolarHBondContact O-N 3.39Å; K19-E22 HydrophobicContact CB-CB 4.3Å; K19-E22 PolarHBondContact O-N 2.81Å
20	R	55.9	Low	67.3	Low	227 Å²	227	117 Å²	117	86%	0.857	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.2	-12.8	179.9	-86.7	-176.5	-80.1	170.3	-4.7	115.5	I18	I18-R20 PolarHBondContact O-N 2.92Å
21	N	54.9	Low	68.3	Low	152 Å²	152	116.9 Å²	116.9	81%	0.813	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-3.3	-173	-40.6	11.2	0	0	0	111.5	K19	K19-N21 PolarHBondContact O-N 3.39Å
22	E	60.4	Low	69.7	Low	121 Å²	121	119.7 Å²	119.7	57%	0.565	60%	0.602	S	S	*	*			trans	-116.1	63.9	-169.2	-161.5	157.6	-161.3	0	0	109.6	I18 K19 R24	I18-E22 WeakPolarHBondContact CG2-O 3.16Å; K19-E22 HydrophobicContact CB-CB 4.3Å; K19-E22 PolarHBondContact O-N 2.81Å; E22-R24 PolarHBondContact O-N 3.43Å
23	Y	58.1	Low	71	Confident	209 Å²	209	120.8 Å²	120.8	82%	0.82	59%	0.591	S	S	*	*			trans	-68.4	101.7	169.3	-71.9	-83.4	0	0	0	108.4	K25	Y23-K25 PolarHBondContact O-N 3.32Å
24	R	62.9	Low	72	Confident	161 Å²	161	123.5 Å²	123.5	61%	0.608	58%	0.58	S	S	*	*			trans	-52.4	141.2	158.6	-76.9	-173.9	-176.2	-105.7	-1.5	107.4	N11 E22 M26	N11-R24 PolarHBondContact ND2-NH2 3.18Å; E22-R24 PolarHBondContact O-N 3.43Å; R24-M26 HydrophobicContact CB-SD 4.14Å; R24-M26 PolarHBondContact O-N 3.4Å
25	K	70.5	Confident	73.3	Confident	216 Å²	216	122.5 Å²	122.5	94%	0.939	57%	0.571	S	S	*	*			trans	-64.4	85.5	168	-69	-179.2	-178.8	178.6	0	107.6	Y23 G27	Y23-K25 PolarHBondContact O-N 3.32Å; K25-G27 PolarHBondContact O-N 3.43Å
26	M	70.4	Confident	74.5	Confident	85 Å²	85	123.3 Å²	123.3	42%	0.419	56%	0.561	S	S	.	*			trans	-63.3	128.3	178.1	-66	-56.1	-101.3	0	0	108.5	R24 D30 F31	R24-M26 HydrophobicContact CB-SD 4.14Å; R24-M26 PolarHBondContact O-N 3.4Å; M26-D30 HydrophobicContact CB-CB 3.73Å; M26-D30 HydrophobicContact CE-CB 3.58Å; M26-D30 HydrophobicContact CG-CB 4.25Å; M26-D30 HydrophobicContact SD-CB 3.88Å; M26-F31 HydrophobicContact CB-CE1 4.41Å; M26-F31 HydrophobicContact CB-CE2 4.21Å; M26-F31 HydrophobicContact CB-CZ 4.08Å; M26-F31 WeakPolarHBondContact O-CE2 3.38Å
27	G	82.8	Confident	75.8	Confident	33 Å²	33	122.5 Å²	122.5	34%	0.34	56%	0.557	S	S	.	*			trans	-72.6	174	173.2	0	0	0	0	0	111.7	K25 Y29 D30 F31	K25-G27 PolarHBondContact O-N 3.43Å; G27-Y29 PolarHBondContact O-N 3.01Å; G27-D30 PolarHBondContact N-OD2 3.3Å; G27-D30 WeakPolarHBondContact O-CB 3.41Å; G27-D30 PolarHBondContact O-N 3.23Å; G27-F31 WeakPolarHBondContact O-CD2 3.3Å; G27-F31 PolarHBondContact O-N 3.12Å
28	T	85.4	Confident	76.9	Confident	107 Å²	107	124.2 Å²	124.2	66%	0.656	56%	0.563	S	S	*	*	H	α-helix	trans	-55	-40.6	177.3	50.5	0	0	0	0	112.6	D30 V32	T28-D30 VanDerWaalsContact C-N 3.32Å; T28-D30 PolarHBondContact O-N 3.15Å; T28-V32 PolarHBondContact O-N 2.96Å
29	Y	90.8	Very high	78.2	Confident	198 Å²	198	127.4 Å²	127.4	78%	0.776	57%	0.572	S	S	*	*	H	α-helix	trans	-67.6	-31.4	178.7	-64.3	-74.2	0	0	0	113.3	G27 V32 R33	G27-Y29 PolarHBondContact O-N 3.01Å; Y29-V32 PolarHBondContact O-N 2.79Å; Y29-R33 WeakPolarHBondContact O-CB 3.26Å; Y29-R33 PolarHBondContact O-N 3.26Å
30	D	87.8	Confident	79.6	Confident	60 Å²	60	128 Å²	128	32%	0.321	58%	0.575	S	S	.	*	H	α-helix	trans	-70.5	-36.6	-178.8	-66.4	-36.6	0	0	0	111.3	M26 G27 T28 R33 R34	M26-D30 HydrophobicContact CB-CB 3.73Å; M26-D30 HydrophobicContact CE-CB 3.58Å; M26-D30 HydrophobicContact CG-CB 4.25Å; M26-D30 HydrophobicContact SD-CB 3.88Å; G27-D30 PolarHBondContact N-OD2 3.3Å; G27-D30 WeakPolarHBondContact O-CB 3.41Å; G27-D30 PolarHBondContact O-N 3.23Å; T28-D30 VanDerWaalsContact C-N 3.32Å; T28-D30 PolarHBondContact O-N 3.15Å; D30-R33 PolarHBondContact O-N 3.19Å; D30-R34 WeakPolarHBondContact O-CB 3.37Å; D30-R34 PolarHBondContact O-N 3.01Å
31	F	86.2	Confident	81.2	Confident	102 Å²	102	120.4 Å²	120.4	45%	0.447	56%	0.557	S	S	.	*	H	α-helix	trans	-62.4	-47.3	172.3	-66.7	-72.1	0	0	0	111.7	M26 G27 R33 R34 D35	M26-F31 HydrophobicContact CB-CE1 4.41Å; M26-F31 HydrophobicContact CB-CE2 4.21Å; M26-F31 HydrophobicContact CB-CZ 4.08Å; M26-F31 WeakPolarHBondContact O-CE2 3.38Å; G27-F31 WeakPolarHBondContact O-CD2 3.3Å; G27-F31 PolarHBondContact O-N 3.12Å; F31-R33 VanDerWaalsContact C-N 3.34Å; F31-R33 PolarHBondContact O-N 3.17Å; F31-R34 PolarHBondContact O-N 3.41Å; F31-D35 PolarHBondContact O-N 2.93Å
32	V	90.8	Very high	82.8	Confident	83 Å²	83	117.8 Å²	117.8	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-44	178.7	176	0	0	0	0	110.5	T28 Y29 D35 I36	T28-V32 PolarHBondContact O-N 2.96Å; Y29-V32 PolarHBondContact O-N 2.79Å; V32-D35 PolarHBondContact O-N 2.84Å; V32-I36 HydrophobicContact CG1-CD1 3.6Å; V32-I36 HydrophobicContact CG1-CG1 4.23Å; V32-I36 WeakPolarHBondContact O-CB 3.46Å; V32-I36 WeakPolarHBondContact O-CG1 3.42Å; V32-I36 PolarHBondContact O-N 3.47Å
33	R	89.2	Confident	84.2	Confident	139 Å²	139	117 Å²	117	53%	0.525	55%	0.545	S	S	.	.	H	α-helix	trans	-59.3	-49.3	177.1	-173.1	-175.9	-161.7	143.8	10.5	111.7	Y29 D30 F31 D35 I36 E37	Y29-R33 WeakPolarHBondContact O-CB 3.26Å; Y29-R33 PolarHBondContact O-N 3.26Å; D30-R33 PolarHBondContact O-N 3.19Å; F31-R33 VanDerWaalsContact C-N 3.34Å; F31-R33 PolarHBondContact O-N 3.17Å; R33-D35 VanDerWaalsContact C-N 3.32Å; R33-D35 PolarHBondContact O-N 2.97Å; R33-I36 PolarHBondContact O-N 3.46Å; R33-E37 HydrophobicContact CG-CG 4.47Å; R33-E37 VanDerWaalsContact CG-OE1 3.3Å; R33-E37 WeakPolarHBondContact CG-OE1 3.41Å; R33-E37 IonicContact NE-OE1 3.13Å; R33-E37 PolarHBondContact NE-OE1 2.93Å; R33-E37 VanDerWaalsContact NE-OE1 3.13Å; R33-E37 WeakPolarHBondContact O-CB 3.3Å; R33-E37 WeakPolarHBondContact O-CG 3.46Å; R33-E37 PolarHBondContact O-N 3.24Å
34	R	87.7	Confident	85.7	Confident	125 Å²	125	114 Å²	114	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-56.9	-45.9	176.9	-177.3	-156.8	68.7	169	-2.9	111.5	D30 F31 E37 K38	D30-R34 WeakPolarHBondContact O-CB 3.37Å; D30-R34 PolarHBondContact O-N 3.01Å; F31-R34 PolarHBondContact O-N 3.41Å; R34-E37 PolarHBondContact O-N 2.96Å; R34-K38 WeakPolarHBondContact O-CB 3.42Å; R34-K38 PolarHBondContact O-N 3.38Å
35	D	88.8	Confident	86.9	Confident	54 Å²	54	112.8 Å²	112.8	29%	0.289	54%	0.54	S	S	.	.	H	α-helix	trans	-67.9	-40.6	-178.7	-66.1	-13.4	0	0	0	111.2	F31 V32 R33 K38 Y39	F31-D35 PolarHBondContact O-N 2.93Å; V32-D35 PolarHBondContact O-N 2.84Å; R33-D35 VanDerWaalsContact C-N 3.32Å; R33-D35 PolarHBondContact O-N 2.97Å; D35-K38 WeakPolarHBondContact O-CB 3.15Å; D35-K38 PolarHBondContact O-N 2.95Å; D35-Y39 HydrophobicContact CB-CE2 4.26Å; D35-Y39 WeakPolarHBondContact O-CD2 3.13Å; D35-Y39 PolarHBondContact O-N 3.05Å
36	I	91	Very high	87.6	Confident	77 Å²	77	106.5 Å²	106.5	40%	0.395	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-48.2	174.2	-73.5	174.1	0	0	0	111.2	V32 R33 K38 Y39 F40	V32-I36 HydrophobicContact CG1-CD1 3.6Å; V32-I36 HydrophobicContact CG1-CG1 4.23Å; V32-I36 WeakPolarHBondContact O-CB 3.46Å; V32-I36 WeakPolarHBondContact O-CG1 3.42Å; V32-I36 PolarHBondContact O-N 3.47Å; R33-I36 PolarHBondContact O-N 3.46Å; I36-K38 VanDerWaalsContact C-N 3.29Å; I36-K38 PolarHBondContact O-N 3.41Å; I36-Y39 PolarHBondContact O-N 3.01Å; I36-Y39 VanDerWaalsContact O-N 3.15Å; I36-F40 HydrophobicContact CG2-CD2 3.38Å; I36-F40 HydrophobicContact CG2-CE2 3.28Å; I36-F40 WeakPolarHBondContact O-CD2 3.28Å; I36-F40 PolarHBondContact O-N 3.4Å
37	E	91.3	Very high	88.3	Confident	112 Å²	112	107.9 Å²	107.9	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-60.6	-39.1	177.7	-74	170.1	-174.6	0	0	111.4	R33 R34 F40 S41	R33-E37 HydrophobicContact CG-CG 4.47Å; R33-E37 VanDerWaalsContact CG-OE1 3.3Å; R33-E37 WeakPolarHBondContact CG-OE1 3.41Å; R33-E37 IonicContact NE-OE1 3.13Å; R33-E37 PolarHBondContact NE-OE1 2.93Å; R33-E37 VanDerWaalsContact NE-OE1 3.13Å; R33-E37 WeakPolarHBondContact O-CB 3.3Å; R33-E37 WeakPolarHBondContact O-CG 3.46Å; R33-E37 PolarHBondContact O-N 3.24Å; R34-E37 PolarHBondContact O-N 2.96Å; E37-F40 PolarHBondContact O-N 3.22Å; E37-S41 PolarHBondContact O-N 2.92Å; E37-S41 VanDerWaalsContact O-N 3.14Å
38	K	87.9	Confident	88.5	Confident	138 Å²	138	112.7 Å²	112.7	60%	0.6	56%	0.559	S	S	*	*	H	α-helix	trans	-63.7	-39.7	173.1	-178.5	-175	175	-171.3	0	112.9	R34 D35 I36 S41	R34-K38 WeakPolarHBondContact O-CB 3.42Å; R34-K38 PolarHBondContact O-N 3.38Å; D35-K38 WeakPolarHBondContact O-CB 3.15Å; D35-K38 PolarHBondContact O-N 2.95Å; I36-K38 VanDerWaalsContact C-N 3.29Å; I36-K38 PolarHBondContact O-N 3.41Å; K38-S41 PolarHBondContact O-OG 3.09Å
39	Y	88.2	Confident	88.5	Confident	130 Å²	130	113 Å²	113	51%	0.51	56%	0.561	S	S	.	*	H	α-helix	trans	-74.3	-33.2	177.4	-65.6	-48.3	0	0	0	112.4	D35 I36 S41 H42 L47	D35-Y39 HydrophobicContact CB-CE2 4.26Å; D35-Y39 WeakPolarHBondContact O-CD2 3.13Å; D35-Y39 PolarHBondContact O-N 3.05Å; I36-Y39 PolarHBondContact O-N 3.01Å; I36-Y39 VanDerWaalsContact O-N 3.15Å; Y39-S41 VanDerWaalsContact C-N 3.27Å; Y39-S41 PolarHBondContact O-N 2.91Å; Y39-H42 CarbonylContact O-C 3.59Å; Y39-H42 PolarHBondContact O-N 2.94Å; Y39-L47 HydrophobicContact CD1-CD2 3.26Å; Y39-L47 HydrophobicContact CD2-CD2 4.34Å; Y39-L47 HydrophobicContact CE1-CD2 3.54Å; Y39-L47 HydrophobicContact CG-CD2 3.72Å
40	F	90.5	Very high	88.3	Confident	160 Å²	160	109 Å²	109	70%	0.702	56%	0.559	S	S	*	*	H	α-helix	trans	-71	-18.9	174.6	-81.9	-61.8	0	0	0	113.8	I36 E37 H42	I36-F40 HydrophobicContact CG2-CD2 3.38Å; I36-F40 HydrophobicContact CG2-CE2 3.28Å; I36-F40 WeakPolarHBondContact O-CD2 3.28Å; I36-F40 PolarHBondContact O-N 3.4Å; E37-F40 PolarHBondContact O-N 3.22Å; F40-H42 VanDerWaalsContact C-N 3.26Å; F40-H42 PolarHBondContact O-N 3.16Å
41	S	90	Very high	88.3	Confident	67 Å²	67	114.5 Å²	114.5	47%	0.469	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-23.2	174.7	74.4	0	0	0	0	113.1	E37 K38 Y39	E37-S41 PolarHBondContact O-N 2.92Å; E37-S41 VanDerWaalsContact O-N 3.14Å; K38-S41 PolarHBondContact O-OG 3.09Å; Y39-S41 VanDerWaalsContact C-N 3.27Å; Y39-S41 PolarHBondContact O-N 2.91Å
42	H	87.9	Confident	88.5	Confident	96 Å²	96	117.1 Å²	117.1	44%	0.444	60%	0.6	S	S	.	*			trans	-132.3	66.6	-179.7	-60.7	-58.9	0	0	0	111.3	Y39 F40 E44 E45	Y39-H42 CarbonylContact O-C 3.59Å; Y39-H42 PolarHBondContact O-N 2.94Å; F40-H42 VanDerWaalsContact C-N 3.26Å; F40-H42 PolarHBondContact O-N 3.16Å; H42-E44 IonicContact CG-OE1 3.97Å; H42-E44 IonicContact ND1-OE1 3.44Å; H42-E44 PolarHBondContact ND1-OE1 3.45Å; H42-E44 PolarHBondContact O-N 3.24Å; H42-E44 VanDerWaalsContact O-N 3.15Å; H42-E45 HydrophobicContact CB-CB 4.32Å; H42-E45 PolarHBondContact O-N 3.48Å; H42-E45 VanDerWaalsContact O-N 3.16Å
43	P	90.4	Very high	88.4	Confident	105 Å²	105	117.9 Å²	117.9	68%	0.682	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-17	-177.8	28.8	-36.7	0	0	0	113.7
44	E	90.4	Very high	88.2	Confident	145 Å²	145	118.3 Å²	118.3	68%	0.678	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-22.7	176.2	68.5	-76.1	177.3	0	0	114.2	H42	H42-E44 IonicContact CG-OE1 3.97Å; H42-E44 IonicContact ND1-OE1 3.44Å; H42-E44 PolarHBondContact ND1-OE1 3.45Å; H42-E44 PolarHBondContact O-N 3.24Å; H42-E44 VanDerWaalsContact O-N 3.15Å
45	E	87.5	Confident	88.1	Confident	137 Å²	137	116.8 Å²	116.8	64%	0.64	63%	0.63	S	S	*	*	S	Bend	trans	-83.4	120	-178.9	-170.9	177.1	175.5	0	0	110.3	H42 L47	H42-E45 HydrophobicContact CB-CB 4.32Å; H42-E45 PolarHBondContact O-N 3.48Å; H42-E45 VanDerWaalsContact O-N 3.16Å; E45-L47 PolarHBondContact O-N 3.05Å
46	A	85.5	Confident	88	Confident	84 Å²	84	122 Å²	122	69%	0.694	65%	0.653	S	S	*	*			trans	-65.9	130.8	176	0	0	0	0	0	110.6	V48	A46-V48 PolarHBondContact O-N 2.96Å; A46-V48 VanDerWaalsContact O-N 3.09Å
47	L	84.4	Confident	87.8	Confident	114 Å²	114	124.7 Å²	124.7	60%	0.597	67%	0.667	S	S	*	*			trans	-65.3	111	176.8	-59.4	179.5	0	0	0	110.5	Y39 E45 T49	Y39-L47 HydrophobicContact CD1-CD2 3.26Å; Y39-L47 HydrophobicContact CD2-CD2 4.34Å; Y39-L47 HydrophobicContact CE1-CD2 3.54Å; Y39-L47 HydrophobicContact CG-CD2 3.72Å; E45-L47 PolarHBondContact O-N 3.05Å; L47-T49 PolarHBondContact O-N 3.14Å; L47-T49 VanDerWaalsContact O-N 3.1Å
48	V	86.5	Confident	87.6	Confident	133 Å²	133	122.2 Å²	122.2	81%	0.806	66%	0.661	S	S	*	*			trans	-73.5	101.1	173.6	-176.8	0	0	0	0	108.8	A46	A46-V48 PolarHBondContact O-N 2.96Å; A46-V48 VanDerWaalsContact O-N 3.09Å
49	T	85.7	Confident	87.7	Confident	114 Å²	114	125 Å²	125	70%	0.699	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-70.7	128.2	168.3	-59.2	0	0	0	0	107.9	L47 E51	L47-T49 PolarHBondContact O-N 3.14Å; L47-T49 VanDerWaalsContact O-N 3.1Å; T49-E51 PolarHBondContact O-N 3.35Å
50	P	86.8	Confident	87.9	Confident	114 Å²	114	124 Å²	124	74%	0.74	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.7	178.9	25.6	-33.5	0	0	0	109.2
51	E	88.8	Confident	87.9	Confident	176 Å²	176	121.9 Å²	121.9	82%	0.822	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-62.9	149.2	169.1	-65	-174.8	177.4	0	0	109.4	T49 A53	T49-E51 PolarHBondContact O-N 3.35Å; E51-A53 PolarHBondContact O-N 3.19Å
52	L	89.4	Confident	88.1	Confident	156 Å²	156	122.8 Å²	122.8	82%	0.817	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-56.8	126.2	174.7	-65.5	173.4	0	0	0	108.8	Q54	L52-Q54 PolarHBondContact O-N 3.08Å; L52-Q54 VanDerWaalsContact O-N 3.11Å; L52-Q54 PolarHBondContact O-NE2 2.86Å
53	A	88.8	Confident	88.4	Confident	100 Å²	100	126.1 Å²	126.1	83%	0.826	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-57.6	119.9	178.9	0	0	0	0	0	109.4	E51	E51-A53 PolarHBondContact O-N 3.19Å
54	Q	85.9	Confident	88.6	Confident	147 Å²	147	127.9 Å²	127.9	69%	0.687	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-66.5	143.5	176.3	-61	-59.6	-39.7	0	0	109.6	L52 Q56	L52-Q54 PolarHBondContact O-N 3.08Å; L52-Q54 VanDerWaalsContact O-N 3.11Å; L52-Q54 PolarHBondContact O-NE2 2.86Å; Q54-Q56 PolarHBondContact O-N 3.34Å
55	P	85.1	Confident	88.7	Confident	93 Å²	93	125.8 Å²	125.8	60%	0.604	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-59.3	142	176.6	25.7	-33.7	0	0	0	110.1	L57	P55-L57 PolarHBondContact O-N 2.99Å
56	Q	85.3	Confident	89	Confident	165 Å²	165	129.9 Å²	129.9	77%	0.771	71%	0.708	S	S	*	*			trans	-70.5	96	178.9	-64.5	-68	-14.5	0	0	109.5	Q54 M96	Q54-Q56 PolarHBondContact O-N 3.34Å; Q56-M96 WeakPolarHBondContact O-CE 3.3Å
57	L	86.8	Confident	89.1	Confident	133 Å²	133	132 Å²	132	70%	0.696	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-81.5	143.1	177.5	-63.9	173.7	0	0	0	110.7	P55 K59	P55-L57 PolarHBondContact O-N 2.99Å; L57-K59 PolarHBondContact O-N 3.47Å
58	P	88.3	Confident	89.3	Confident	60 Å²	60	132 Å²	132	39%	0.39	71%	0.712	S	S	.	*	P	Polyproline II helix	trans	-59.9	138.1	170	26.8	-33.2	0	0	0	109.1	R93	P58-R93 HydrophobicContact CB-CG 4.5Å; P58-R93 HydrophobicContact CG-CG 4.38Å
59	K	89.7	Confident	89.3	Confident	195 Å²	195	135.5 Å²	135.5	85%	0.848	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.8	176.6	-66.2	-177.9	-179.9	-176.9	0	109.1	L57	L57-K59 PolarHBondContact O-N 3.47Å
60	P	91.5	Very high	89.5	Confident	110 Å²	110	132.7 Å²	132.7	71%	0.714	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-59.6	146.3	177.1	25.4	-33.6	0	0	0	110
61	P	91.7	Very high	89.5	Confident	115 Å²	115	134 Å²	134	75%	0.747	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60.9	141.2	175.3	26.3	-33	0	0	0	109.9	E63	P61-E63 PolarHBondContact O-N 3.06Å
62	P	93	Very high	89.7	Confident	87 Å²	87	130.6 Å²	130.6	57%	0.565	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-58	136.7	173.7	-22.2	32.7	0	0	0	111.1	F64	P62-F64 PolarHBondContact O-N 3.47Å
63	E	95.5	Very high	89.7	Confident	166 Å²	166	125.7 Å²	125.7	78%	0.776	70%	0.7	S	S	*	*	S	Bend	trans	-62.3	-43.4	-179.5	-170.4	-175.1	178.1	0	0	112	P61	P61-E63 PolarHBondContact O-N 3.06Å
64	F	94.5	Very high	89.7	Confident	142 Å²	142	124.3 Å²	124.3	62%	0.623	70%	0.696	S	S	*	*			trans	-127.9	128.9	179.1	-56.7	-72	0	0	0	111.1	P62	P62-F64 PolarHBondContact O-N 3.47Å
65	V	92.1	Very high	89.9	Confident	101 Å²	101	123.4 Å²	123.4	61%	0.612	70%	0.701	S	S	*	*			trans	-97.8	110	168.3	-176.8	0	0	0	0	107.6	N67 V68	V65-N67 VanDerWaalsContact C-N 3.34Å; V65-V68 HydrophobicContact CB-CG2 4.05Å; V65-V68 HydrophobicContact CG1-CG2 3.84Å
66	R	93.1	Very high	90.2	Very high	223 Å²	223	121 Å²	121	84%	0.842	69%	0.693	S	S	*	*	S	Bend	trans	-79.7	-15.4	-173.9	-61.4	-176.1	-177.7	100.3	1	113.9
67	N	88.7	Confident	90.6	Very high	128 Å²	128	119.2 Å²	119.2	68%	0.684	70%	0.699	S	S	*	*			trans	-106.6	31.4	-166.8	-54.4	59.9	0	0	0	112.2	V65 W69	V65-N67 VanDerWaalsContact C-N 3.34Å; N67-W69 PolarHBondContact O-N 3.45Å
68	V	87.9	Confident	90.8	Very high	114 Å²	114	114.5 Å²	114.5	69%	0.691	68%	0.682	S	S	*	*			trans	-82.6	115.7	179.5	-179.5	0	0	0	0	108.7	V65	V65-V68 HydrophobicContact CB-CG2 4.05Å; V65-V68 HydrophobicContact CG1-CG2 3.84Å
69	W	86.9	Confident	91	Very high	207 Å²	207	115.3 Å²	115.3	78%	0.784	68%	0.683	S	S	*	*			trans	-75.2	158.4	168.2	-97.4	-96.6	0	0	0	110.4	N67 A73	N67-W69 PolarHBondContact O-N 3.45Å; W69-A73 HydrophobicContact CB-CB 4.07Å
70	G	89.6	Confident	91.2	Very high	54 Å²	54	112.5 Å²	112.5	56%	0.557	67%	0.671	S	S	*	*			trans	-58.2	152.7	-176.8	0	0	0	0	0	113.4	A72 A73	G70-A72 PolarHBondContact O-N 3.17Å; G70-A73 WeakPolarHBondContact O-CB 3.29Å; G70-A73 PolarHBondContact O-N 3.16Å
71	S	87.7	Confident	91.5	Very high	141 Å²	141	112.5 Å²	112.5	99%	0.986	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-23.1	-171.9	-45.4	0	0	0	0	115.1
72	A	92.5	Very high	91.6	Very high	106 Å²	106	111.7 Å²	111.7	88%	0.876	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	2.5	177.4	0	0	0	0	0	113.5	G70	G70-A72 PolarHBondContact O-N 3.17Å
73	A	88.7	Confident	91.7	Very high	52 Å²	52	113.2 Å²	113.2	43%	0.43	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-67.9	144.8	175.7	0	0	0	0	0	110.5	W69 G70	W69-A73 HydrophobicContact CB-CB 4.07Å; G70-A73 WeakPolarHBondContact O-CB 3.29Å; G70-A73 PolarHBondContact O-N 3.16Å
74	G	89.2	Confident	91.7	Very high	72 Å²	72	110.4 Å²	110.4	74%	0.742	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-69.2	169.1	176.8	0	0	0	0	0	113.4	G76	G74-G76 PolarHBondContact O-N 2.91Å
75	V	91	Very high	91.8	Very high	128 Å²	128	104.8 Å²	104.8	78%	0.776	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-65.3	116.9	176.5	-179.7	0	0	0	0	110	D79	V75-D79 HydrophobicContact CG1-CB 3.98Å
76	G	89.8	Confident	91.9	Very high	43 Å²	43	104 Å²	104	44%	0.443	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-79.2	158.7	176.1	0	0	0	0	0	112.8	G74 G78 D79	G74-G76 PolarHBondContact O-N 2.91Å; G76-G78 PolarHBondContact O-N 2.99Å; G76-G78 VanDerWaalsContact O-N 3.14Å; G76-D79 VanDerWaalsContact O-CB 3.29Å; G76-D79 WeakPolarHBondContact O-CB 3.3Å; G76-D79 PolarHBondContact O-N 3.42Å
77	S	93.8	Very high	92.1	Very high	127 Å²	127	98.8 Å²	98.8	89%	0.888	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-25.1	179.6	56.5	0	0	0	0	114.1
78	G	92.1	Very high	92.5	Very high	33 Å²	33	98.8 Å²	98.8	34%	0.34	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-12.8	175.9	0	0	0	0	0	114.9	G76 F80 H81 I82	G76-G78 PolarHBondContact O-N 2.99Å; G76-G78 VanDerWaalsContact O-N 3.14Å; G78-F80 VanDerWaalsContact C-N 3.31Å; G78-F80 PolarHBondContact O-N 2.85Å; G78-H81 PolarHBondContact O-N 3.4Å; G78-I82 WeakPolarHBondContact O-CG1 3.42Å; G78-I82 PolarHBondContact O-N 2.92Å; G78-I82 VanDerWaalsContact O-N 3.13Å
79	D	92.5	Very high	92.9	Very high	78 Å²	78	100.6 Å²	100.6	42%	0.417	57%	0.565	S	S	.	*	H	α-helix	trans	-64.8	-37	-170.1	-166	53.8	0	0	0	112.1	V75 G76 H81 I82 Y83	V75-D79 HydrophobicContact CG1-CB 3.98Å; G76-D79 VanDerWaalsContact O-CB 3.29Å; G76-D79 WeakPolarHBondContact O-CB 3.3Å; G76-D79 PolarHBondContact O-N 3.42Å; D79-H81 VanDerWaalsContact C-N 3.31Å; D79-H81 PolarHBondContact O-N 3.34Å; D79-I82 WeakPolarHBondContact O-CB 3.45Å; D79-I82 PolarHBondContact O-N 3.47Å; D79-Y83 PolarHBondContact O-N 3.22Å
80	F	94.3	Very high	93.3	Very high	135 Å²	135	94.2 Å²	94.2	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-57.5	-42	172.5	174.9	-106.9	0	0	0	112.8	G78 R84	G78-F80 VanDerWaalsContact C-N 3.31Å; G78-F80 PolarHBondContact O-N 2.85Å; F80-R84 WeakPolarHBondContact O-CB 3.4Å; F80-R84 PolarHBondContact O-N 2.96Å
81	H	96.5	Very high	93.7	Very high	110 Å²	110	98.3 Å²	98.3	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-72	-33.3	179.7	-70.1	-43.5	0	0	0	112.5	G78 D79 G85	G78-H81 PolarHBondContact O-N 3.4Å; D79-H81 VanDerWaalsContact C-N 3.31Å; D79-H81 PolarHBondContact O-N 3.34Å; H81-G85 PolarHBondContact O-N 3.24Å
82	I	93.6	Very high	94	Very high	99 Å²	99	95.1 Å²	95.1	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-51.7	173.2	-63.5	168.5	0	0	0	109.4	G78 D79 R84 G85 I86	G78-I82 WeakPolarHBondContact O-CG1 3.42Å; G78-I82 PolarHBondContact O-N 2.92Å; G78-I82 VanDerWaalsContact O-N 3.13Å; D79-I82 WeakPolarHBondContact O-CB 3.45Å; D79-I82 PolarHBondContact O-N 3.47Å; I82-R84 VanDerWaalsContact C-N 3.35Å; I82-R84 PolarHBondContact O-N 2.92Å; I82-G85 PolarHBondContact O-N 3.43Å; I82-G85 VanDerWaalsContact O-N 3.08Å; I82-I86 HydrophobicContact CG2-CD1 3.71Å; I82-I86 HydrophobicContact CG2-CG1 4.42Å; I82-I86 WeakPolarHBondContact O-CG1 3.46Å; I82-I86 PolarHBondContact O-N 3.45Å
83	Y	94.8	Very high	94.2	Very high	119 Å²	119	94.3 Å²	94.3	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-54.5	-48.6	176.4	176.4	-110.3	0	0	0	112.3	D79 G85 I86 R87	D79-Y83 PolarHBondContact O-N 3.22Å; Y83-G85 VanDerWaalsContact C-N 3.3Å; Y83-G85 PolarHBondContact O-N 3.07Å; Y83-I86 PolarHBondContact O-N 2.94Å; Y83-R87 VanDerWaalsContact CE1-NH2 3.33Å; Y83-R87 WeakPolarHBondContact O-CB 3.44Å; Y83-R87 PolarHBondContact O-N 3.01Å; Y83-R87 VanDerWaalsContact OH-CZ 3.26Å; Y83-R87 PolarHBondContact OH-NE 3.21Å; Y83-R87 PolarHBondContact OH-NH2 3.35Å
84	R	97.4	Very high	94.5	Very high	107 Å²	107	95.7 Å²	95.7	40%	0.404	49%	0.493	S	S	.	.	H	α-helix	trans	-57.2	-41.9	176.6	-175.8	-167.1	67.1	120.5	10	112.2	F80 I82 R88	F80-R84 WeakPolarHBondContact O-CB 3.4Å; F80-R84 PolarHBondContact O-N 2.96Å; I82-R84 VanDerWaalsContact C-N 3.35Å; I82-R84 PolarHBondContact O-N 2.92Å; R84-R88 WeakPolarHBondContact O-CG 3.39Å; R84-R88 PolarHBondContact O-N 3.42Å
85	G	96	Very high	94.9	Very high	23 Å²	23	96.7 Å²	96.7	24%	0.237	48%	0.478	C	S	.	.	H	α-helix	trans	-67.9	-43.2	177.6	0	0	0	0	0	113	H81 I82 Y83 R89	H81-G85 PolarHBondContact O-N 3.24Å; I82-G85 PolarHBondContact O-N 3.43Å; I82-G85 VanDerWaalsContact O-N 3.08Å; Y83-G85 VanDerWaalsContact C-N 3.3Å; Y83-G85 PolarHBondContact O-N 3.07Å; G85-R89 WeakPolarHBondContact O-CG 3.35Å; G85-R89 PolarHBondContact O-N 2.82Å; G85-R89 VanDerWaalsContact O-N 3.16Å
86	I	95	Very high	95	Very high	85 Å²	85	92.8 Å²	92.8	44%	0.436	45%	0.452	S	S	.	.	H	α-helix	trans	-62.6	-49.2	175.8	-66.8	168.2	0	0	0	110.4	I82 Y83 R88 R89 E90	I82-I86 HydrophobicContact CG2-CD1 3.71Å; I82-I86 HydrophobicContact CG2-CG1 4.42Å; I82-I86 WeakPolarHBondContact O-CG1 3.46Å; I82-I86 PolarHBondContact O-N 3.45Å; Y83-I86 PolarHBondContact O-N 2.94Å; I86-R88 VanDerWaalsContact C-N 3.32Å; I86-R88 PolarHBondContact O-N 3.42Å; I86-R89 PolarHBondContact O-N 2.9Å; I86-E90 WeakPolarHBondContact O-CB 3.41Å; I86-E90 PolarHBondContact O-N 2.94Å
87	R	97	Very high	95.3	Very high	113 Å²	113	94.9 Å²	94.9	43%	0.426	45%	0.452	S	S	.	.	H	α-helix	trans	-56.8	-43.6	179.6	-171.3	-167.8	-82.3	-169.2	-7.2	111.9	Y83 E90 Y91	Y83-R87 VanDerWaalsContact CE1-NH2 3.33Å; Y83-R87 WeakPolarHBondContact O-CB 3.44Å; Y83-R87 PolarHBondContact O-N 3.01Å; Y83-R87 VanDerWaalsContact OH-CZ 3.26Å; Y83-R87 PolarHBondContact OH-NE 3.21Å; Y83-R87 PolarHBondContact OH-NH2 3.35Å; R87-E90 PolarHBondContact O-N 2.78Å; R87-Y91 HydrophobicContact CG-CD1 4.33Å; R87-Y91 HydrophobicContact CG-CD2 4.28Å; R87-Y91 HydrophobicContact CG-CE1 3.94Å; R87-Y91 HydrophobicContact CG-CE2 3.87Å; R87-Y91 HydrophobicContact CG-CG 4.5Å; R87-Y91 WeakPolarHBondContact O-CB 3.46Å; R87-Y91 PolarHBondContact O-N 2.83Å
88	R	97	Very high	95.5	Very high	129 Å²	129	95.9 Å²	95.9	49%	0.487	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-46.5	176.8	-72.6	-169.7	-161.3	122.5	-7.3	113	R84 I86 E90 Y91 T92	R84-R88 WeakPolarHBondContact O-CG 3.39Å; R84-R88 PolarHBondContact O-N 3.42Å; I86-R88 VanDerWaalsContact C-N 3.32Å; I86-R88 PolarHBondContact O-N 3.42Å; R88-E90 PolarHBondContact O-N 3.34Å; R88-Y91 PolarHBondContact O-N 2.93Å; R88-T92 PolarHBondContact O-N 3.42Å; R88-T92 PolarHBondContact O-OG1 2.83Å; R88-T92 VanDerWaalsContact O-OG1 3.08Å
89	R	95.8	Very high	95.7	Very high	151 Å²	151	98.9 Å²	98.9	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-58	-40.6	176.7	-73.6	-174.2	-68	-158.4	0.6	111.1	G85 I86 R93	G85-R89 WeakPolarHBondContact O-CG 3.35Å; G85-R89 PolarHBondContact O-N 2.82Å; G85-R89 VanDerWaalsContact O-N 3.16Å; I86-R89 PolarHBondContact O-N 2.9Å; R89-R93 WeakPolarHBondContact O-CB 3.43Å; R89-R93 PolarHBondContact O-N 2.76Å
90	E	95.6	Very high	95.9	Very high	73 Å²	73	98.9 Å²	98.9	34%	0.341	45%	0.446	S	S	.	.	H	α-helix	trans	-69.1	-45.3	179	-178.4	60.1	-173	0	0	112.6	I86 R87 R88 T92 R93 L94	I86-E90 WeakPolarHBondContact O-CB 3.41Å; I86-E90 PolarHBondContact O-N 2.94Å; R87-E90 PolarHBondContact O-N 2.78Å; R88-E90 PolarHBondContact O-N 3.34Å; E90-T92 PolarHBondContact O-N 2.99Å; E90-R93 WeakPolarHBondContact O-CB 3.32Å; E90-R93 PolarHBondContact O-N 3.31Å; E90-R93 VanDerWaalsContact O-N 3.13Å; E90-R93 IonicContact OE1-CZ 3.57Å; E90-R93 IonicContact OE1-NE 2.77Å; E90-R93 PolarHBondContact OE1-NE 3.4Å; E90-R93 IonicContact OE1-NH2 2.65Å; E90-R93 PolarHBondContact OE1-NH2 3.26Å; E90-R93 IonicContact OE2-CZ 3.44Å; E90-R93 IonicContact OE2-NE 3.45Å; E90-R93 PolarHBondContact OE2-NE 2.94Å; E90-R93 IonicContact OE2-NH2 3.55Å; E90-L94 HydrophobicContact CG-CD1 4.13Å; E90-L94 HydrophobicContact CG-CG 4.48Å; E90-L94 WeakPolarHBondContact O-CG 3.37Å; E90-L94 PolarHBondContact O-N 3.46Å
91	Y	96.8	Very high	96.1	Very high	140 Å²	140	95 Å²	95	55%	0.549	44%	0.44	S	S	.	.	H	α-helix	trans	-60.2	-44.8	174.7	-73.8	-2.1	0	0	0	111.8	R87 R88 R93 L94 E95	R87-Y91 HydrophobicContact CG-CD1 4.33Å; R87-Y91 HydrophobicContact CG-CD2 4.28Å; R87-Y91 HydrophobicContact CG-CE1 3.94Å; R87-Y91 HydrophobicContact CG-CE2 3.87Å; R87-Y91 HydrophobicContact CG-CG 4.5Å; R87-Y91 WeakPolarHBondContact O-CB 3.46Å; R87-Y91 PolarHBondContact O-N 2.83Å; R88-Y91 PolarHBondContact O-N 2.93Å; Y91-R93 VanDerWaalsContact C-N 3.3Å; Y91-R93 PolarHBondContact O-N 2.81Å; Y91-L94 PolarHBondContact O-N 3.28Å; Y91-E95 VanDerWaalsContact O-CB 3.29Å; Y91-E95 WeakPolarHBondContact O-CB 3.45Å; Y91-E95 PolarHBondContact O-N 2.96Å
92	T	95.3	Very high	96.2	Very high	74 Å²	74	93.7 Å²	93.7	45%	0.454	43%	0.434	S	S	.	.	H	α-helix	trans	-60.3	-40.7	174	-58.4	0	0	0	0	111.5	R88 E90 M96	R88-T92 PolarHBondContact O-N 3.42Å; R88-T92 PolarHBondContact O-OG1 2.83Å; R88-T92 VanDerWaalsContact O-OG1 3.08Å; E90-T92 PolarHBondContact O-N 2.99Å; T92-M96 WeakPolarHBondContact O-CB 3.38Å; T92-M96 WeakPolarHBondContact O-CG 3.45Å; T92-M96 PolarHBondContact O-N 3.36Å
93	R	95.4	Very high	96.3	Very high	90 Å²	90	94.4 Å²	94.4	34%	0.34	44%	0.435	S	S	.	.	H	α-helix	trans	-62.3	-46.8	176.4	-173.1	-167.1	71.9	79.2	0.9	111.7	P58 R89 E90 Y91 M96 I97	P58-R93 HydrophobicContact CB-CG 4.5Å; P58-R93 HydrophobicContact CG-CG 4.38Å; R89-R93 WeakPolarHBondContact O-CB 3.43Å; R89-R93 PolarHBondContact O-N 2.76Å; E90-R93 WeakPolarHBondContact O-CB 3.32Å; E90-R93 PolarHBondContact O-N 3.31Å; E90-R93 VanDerWaalsContact O-N 3.13Å; E90-R93 IonicContact OE1-CZ 3.57Å; E90-R93 IonicContact OE1-NE 2.77Å; E90-R93 PolarHBondContact OE1-NE 3.4Å; E90-R93 IonicContact OE1-NH2 2.65Å; E90-R93 PolarHBondContact OE1-NH2 3.26Å; E90-R93 IonicContact OE2-CZ 3.44Å; E90-R93 IonicContact OE2-NE 3.45Å; E90-R93 PolarHBondContact OE2-NE 2.94Å; E90-R93 IonicContact OE2-NH2 3.55Å; Y91-R93 VanDerWaalsContact C-N 3.3Å; Y91-R93 PolarHBondContact O-N 2.81Å; R93-M96 PolarHBondContact O-N 2.97Å; R93-I97 HydrophobicContact CG-CD1 4.22Å; R93-I97 WeakPolarHBondContact O-CG1 3.5Å; R93-I97 PolarHBondContact O-N 3.39Å; R93-I97 VanDerWaalsContact O-N 3.11Å
94	L	96.3	Very high	96.5	Very high	80 Å²	80	93.7 Å²	93.7	42%	0.419	44%	0.436	S	S	.	.	H	α-helix	trans	-65	-45.6	179.4	-70.4	172.5	0	0	0	111.7	E90 Y91 M96 I97 E98	E90-L94 HydrophobicContact CG-CD1 4.13Å; E90-L94 HydrophobicContact CG-CG 4.48Å; E90-L94 WeakPolarHBondContact O-CG 3.37Å; E90-L94 PolarHBondContact O-N 3.46Å; Y91-L94 PolarHBondContact O-N 3.28Å; L94-M96 VanDerWaalsContact C-N 3.31Å; L94-M96 PolarHBondContact O-N 3.37Å; L94-I97 PolarHBondContact O-N 2.93Å; L94-I97 VanDerWaalsContact O-N 3.15Å; L94-E98 PolarHBondContact O-N 3.41Å
95	E	96.5	Very high	96.5	Very high	93 Å²	93	93.9 Å²	93.9	44%	0.435	44%	0.436	S	S	.	.	H	α-helix	trans	-58.2	-43.2	176.6	-177.5	-175.5	-177.1	0	0	111.5	Y91 E98 K99	Y91-E95 VanDerWaalsContact O-CB 3.29Å; Y91-E95 WeakPolarHBondContact O-CB 3.45Å; Y91-E95 PolarHBondContact O-N 2.96Å; E95-E98 PolarHBondContact O-N 2.86Å; E95-K99 HydrophobicContact CG-CD 4.25Å; E95-K99 WeakPolarHBondContact O-CB 3.49Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.23Å; E95-K99 PolarHBondContact O-N 3.32Å; E95-K99 VanDerWaalsContact OE1-CE 3.29Å; E95-K99 WeakPolarHBondContact OE1-CE 3.48Å; E95-K99 IonicContact OE1-NZ 2.66Å; E95-K99 PolarHBondContact OE1-NZ 3.18Å
96	M	94.7	Very high	96.7	Very high	47 Å²	47	96.6 Å²	96.6	23%	0.232	45%	0.445	C	S	.	.	H	α-helix	trans	-65	-39	176.4	-71.8	-63	-57.1	0	0	112.5	Q56 T92 R93 L94 N100	Q56-M96 WeakPolarHBondContact O-CE 3.3Å; T92-M96 WeakPolarHBondContact O-CB 3.38Å; T92-M96 WeakPolarHBondContact O-CG 3.45Å; T92-M96 PolarHBondContact O-N 3.36Å; R93-M96 PolarHBondContact O-N 2.97Å; L94-M96 VanDerWaalsContact C-N 3.31Å; L94-M96 PolarHBondContact O-N 3.37Å; M96-N100 VanDerWaalsContact O-CB 3.32Å; M96-N100 WeakPolarHBondContact O-CB 3.34Å; M96-N100 PolarHBondContact O-N 3.01Å; M96-N100 PolarHBondContact O-ND2 3.24Å; M96-N100 PolarHBondContact O-OD1 2.67Å
97	I	96	Very high	96.8	Very high	87 Å²	87	97 Å²	97	45%	0.446	45%	0.448	S	S	.	.	H	α-helix	trans	-64.8	-45	177	-72	166.2	0	0	0	110.7	R93 L94 N100 A101	R93-I97 HydrophobicContact CG-CD1 4.22Å; R93-I97 WeakPolarHBondContact O-CG1 3.5Å; R93-I97 PolarHBondContact O-N 3.39Å; R93-I97 VanDerWaalsContact O-N 3.11Å; L94-I97 PolarHBondContact O-N 2.93Å; L94-I97 VanDerWaalsContact O-N 3.15Å; I97-N100 PolarHBondContact O-N 2.87Å; I97-A101 WeakPolarHBondContact O-CB 3.43Å; I97-A101 PolarHBondContact O-N 2.65Å
98	E	97.5	Very high	96.9	Very high	147 Å²	147	97 Å²	97	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-62.4	-46.7	178.2	-175	174	-160.5	0	0	111.4	L94 E95 A101 E102	L94-E98 PolarHBondContact O-N 3.41Å; E95-E98 PolarHBondContact O-N 2.86Å; E98-A101 PolarHBondContact O-N 2.86Å; E98-E102 PolarHBondContact O-N 3.4Å
99	K	96.8	Very high	97	Very high	97 Å²	97	94.4 Å²	94.4	42%	0.422	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-49.9	175.7	-74.5	177.1	-175.7	171.9	0	112.3	E95 A101 E102 E103	E95-K99 HydrophobicContact CG-CD 4.25Å; E95-K99 WeakPolarHBondContact O-CB 3.49Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.23Å; E95-K99 PolarHBondContact O-N 3.32Å; E95-K99 VanDerWaalsContact OE1-CE 3.29Å; E95-K99 WeakPolarHBondContact OE1-CE 3.48Å; E95-K99 IonicContact OE1-NZ 2.66Å; E95-K99 PolarHBondContact OE1-NZ 3.18Å; K99-A101 VanDerWaalsContact C-N 3.3Å; K99-A101 PolarHBondContact O-N 3.4Å; K99-E102 PolarHBondContact O-N 3.32Å; K99-E103 WeakPolarHBondContact O-CG 3.28Å; K99-E103 PolarHBondContact O-N 3.49Å
100	N	96.4	Very high	97.1	Very high	78 Å²	78	93.3 Å²	93.3	42%	0.417	44%	0.444	S	S	.	.	H	α-helix	trans	-61.3	-39.1	179.5	-69.9	-6.6	0	0	0	111.8	M96 I97 E104	M96-N100 VanDerWaalsContact O-CB 3.32Å; M96-N100 WeakPolarHBondContact O-CB 3.34Å; M96-N100 PolarHBondContact O-N 3.01Å; M96-N100 PolarHBondContact O-ND2 3.24Å; M96-N100 PolarHBondContact O-OD1 2.67Å; I97-N100 PolarHBondContact O-N 2.87Å; N100-E104 VanDerWaalsContact O-CB 3.29Å; N100-E104 WeakPolarHBondContact O-CB 3.49Å; N100-E104 PolarHBondContact O-N 3.35Å
101	A	97.6	Very high	97.2	Very high	54 Å²	54	94.6 Å²	94.6	45%	0.446	45%	0.45	S	S	.	.	H	α-helix	trans	-66.3	-40.1	178.1	0	0	0	0	0	112.1	I97 E98 K99 R105	I97-A101 WeakPolarHBondContact O-CB 3.43Å; I97-A101 PolarHBondContact O-N 2.65Å; E98-A101 PolarHBondContact O-N 2.86Å; K99-A101 VanDerWaalsContact C-N 3.3Å; K99-A101 PolarHBondContact O-N 3.4Å; A101-R105 WeakPolarHBondContact O-CB 3.41Å; A101-R105 PolarHBondContact O-N 3.02Å
102	E	98.1	Very high	97.3	Very high	82 Å²	82	94 Å²	94	38%	0.383	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-44.8	175.5	179	58.2	-167.2	0	0	111.8	E98 K99 E104 R105 L106	E98-E102 PolarHBondContact O-N 3.4Å; K99-E102 PolarHBondContact O-N 3.32Å; E102-E104 PolarHBondContact O-N 3.48Å; E102-R105 WeakPolarHBondContact O-CB 3.41Å; E102-R105 PolarHBondContact O-N 2.88Å; E102-R105 IonicContact OE1-CZ 3.58Å; E102-R105 IonicContact OE1-NE 3.7Å; E102-R105 IonicContact OE1-NH2 2.67Å; E102-R105 PolarHBondContact OE1-NH2 3.47Å; E102-R105 IonicContact OE2-CZ 3.47Å; E102-R105 IonicContact OE2-NE 2.84Å; E102-R105 PolarHBondContact OE2-NE 2.95Å; E102-R105 IonicContact OE2-NH2 3.24Å; E102-R105 PolarHBondContact OE2-NH2 2.96Å; E102-L106 HydrophobicContact CG-CD1 4.2Å; E102-L106 VanDerWaalsContact O-CG 3.31Å; E102-L106 WeakPolarHBondContact O-CG 3.4Å; E102-L106 PolarHBondContact O-N 3.42Å
103	E	97.7	Very high	97.5	Very high	114 Å²	114	96.6 Å²	96.6	53%	0.533	46%	0.459	S	S	.	.	H	α-helix	trans	-57.4	-47.7	173.8	-73.6	175.8	-174.6	0	0	111.3	K99 R105 L106 D107	K99-E103 WeakPolarHBondContact O-CG 3.28Å; K99-E103 PolarHBondContact O-N 3.49Å; E103-R105 VanDerWaalsContact C-N 3.32Å; E103-R105 PolarHBondContact O-N 2.92Å; E103-L106 PolarHBondContact O-N 3.22Å; E103-D107 WeakPolarHBondContact O-CB 3.31Å; E103-D107 PolarHBondContact O-N 3.5Å
104	E	97.9	Very high	97.6	Very high	104 Å²	104	96 Å²	96	49%	0.486	46%	0.46	S	S	.	.	H	α-helix	trans	-62.2	-38.4	177.8	-173.3	-176.7	177.5	0	0	112.1	N100 E102 K108	N100-E104 VanDerWaalsContact O-CB 3.29Å; N100-E104 WeakPolarHBondContact O-CB 3.49Å; N100-E104 PolarHBondContact O-N 3.35Å; E102-E104 PolarHBondContact O-N 3.48Å; E104-K108 HydrophobicContact CG-CD 4.19Å; E104-K108 WeakPolarHBondContact O-CB 3.24Å; E104-K108 WeakPolarHBondContact O-CD 3.48Å; E104-K108 WeakPolarHBondContact O-CG 3.43Å; E104-K108 PolarHBondContact O-N 3.28Å; E104-K108 WeakPolarHBondContact OE1-CE 3.38Å; E104-K108 IonicContact OE1-NZ 2.62Å; E104-K108 PolarHBondContact OE1-NZ 3.37Å; E104-K108 IonicContact OE2-NZ 4Å
105	R	98.4	Very high	97.7	Very high	110 Å²	110	97.6 Å²	97.6	42%	0.415	46%	0.464	S	S	.	.	H	α-helix	trans	-63	-49.8	175.6	-173.7	-172.2	70.7	84.6	-3.1	110.9	A101 E102 E103 D107 K108 E109	A101-R105 WeakPolarHBondContact O-CB 3.41Å; A101-R105 PolarHBondContact O-N 3.02Å; E102-R105 WeakPolarHBondContact O-CB 3.41Å; E102-R105 PolarHBondContact O-N 2.88Å; E102-R105 IonicContact OE1-CZ 3.58Å; E102-R105 IonicContact OE1-NE 3.7Å; E102-R105 IonicContact OE1-NH2 2.67Å; E102-R105 PolarHBondContact OE1-NH2 3.47Å; E102-R105 IonicContact OE2-CZ 3.47Å; E102-R105 IonicContact OE2-NE 2.84Å; E102-R105 PolarHBondContact OE2-NE 2.95Å; E102-R105 IonicContact OE2-NH2 3.24Å; E102-R105 PolarHBondContact OE2-NH2 2.96Å; E103-R105 VanDerWaalsContact C-N 3.32Å; E103-R105 PolarHBondContact O-N 2.92Å; R105-D107 PolarHBondContact O-N 2.89Å; R105-K108 PolarHBondContact O-N 3.41Å; R105-E109 IonicContact CZ-OE1 3.74Å; R105-E109 IonicContact NH1-OE1 2.65Å; R105-E109 PolarHBondContact NH1-OE1 2.84Å; R105-E109 IonicContact NH1-OE2 3.71Å; R105-E109 WeakPolarHBondContact O-CG 3.39Å; R105-E109 PolarHBondContact O-N 3.38Å
106	L	98.5	Very high	97.8	Very high	81 Å²	81	95.5 Å²	95.5	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-42.7	179.7	-68.2	173.7	0	0	0	111.6	E102 E103 E109 F110	E102-L106 HydrophobicContact CG-CD1 4.2Å; E102-L106 VanDerWaalsContact O-CG 3.31Å; E102-L106 WeakPolarHBondContact O-CG 3.4Å; E102-L106 PolarHBondContact O-N 3.42Å; E103-L106 PolarHBondContact O-N 3.22Å; L106-E109 PolarHBondContact O-N 3Å; L106-F110 WeakPolarHBondContact O-CB 3.31Å; L106-F110 PolarHBondContact O-N 3.24Å
107	D	98.5	Very high	98	Very high	93 Å²	93	98.2 Å²	98.2	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-43.9	177.5	-82.2	-10.5	0	0	0	112	E103 R105 E109 F110 Q111	E103-D107 WeakPolarHBondContact O-CB 3.31Å; E103-D107 PolarHBondContact O-N 3.5Å; R105-D107 PolarHBondContact O-N 2.89Å; D107-E109 PolarHBondContact O-N 3Å; D107-F110 PolarHBondContact O-N 3.02Å; D107-Q111 WeakPolarHBondContact O-CB 3.29Å; D107-Q111 VanDerWaalsContact O-CG 3.23Å; D107-Q111 WeakPolarHBondContact O-CG 3.27Å; D107-Q111 PolarHBondContact O-N 2.97Å
108	K	98.6	Very high	98.1	Very high	112 Å²	112	98.3 Å²	98.3	49%	0.487	48%	0.478	S	S	.	.	H	α-helix	trans	-59.6	-47.2	174.9	-77.2	169.7	-177.9	166.8	0	111.2	E104 R105 F110 Q111 M112	E104-K108 HydrophobicContact CG-CD 4.19Å; E104-K108 WeakPolarHBondContact O-CB 3.24Å; E104-K108 WeakPolarHBondContact O-CD 3.48Å; E104-K108 WeakPolarHBondContact O-CG 3.43Å; E104-K108 PolarHBondContact O-N 3.28Å; E104-K108 WeakPolarHBondContact OE1-CE 3.38Å; E104-K108 IonicContact OE1-NZ 2.62Å; E104-K108 PolarHBondContact OE1-NZ 3.37Å; E104-K108 IonicContact OE2-NZ 4Å; R105-K108 PolarHBondContact O-N 3.41Å; K108-F110 VanDerWaalsContact C-N 3.35Å; K108-F110 PolarHBondContact O-N 3.37Å; K108-Q111 PolarHBondContact O-N 2.97Å; K108-M112 WeakPolarHBondContact O-CB 3.25Å; K108-M112 VanDerWaalsContact O-CG 3.23Å; K108-M112 WeakPolarHBondContact O-CG 3.43Å; K108-M112 PolarHBondContact O-N 2.91Å
109	E	98.5	Very high	98.2	Very high	75 Å²	75	95.8 Å²	95.8	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177.3	-74.4	179.3	-162.6	0	0	112.2	R105 L106 D107 M112 K113	R105-E109 IonicContact CZ-OE1 3.74Å; R105-E109 IonicContact NH1-OE1 2.65Å; R105-E109 PolarHBondContact NH1-OE1 2.84Å; R105-E109 IonicContact NH1-OE2 3.71Å; R105-E109 WeakPolarHBondContact O-CG 3.39Å; R105-E109 PolarHBondContact O-N 3.38Å; L106-E109 PolarHBondContact O-N 3Å; D107-E109 PolarHBondContact O-N 3Å; E109-M112 PolarHBondContact O-N 2.89Å; E109-K113 WeakPolarHBondContact O-CB 3.23Å; E109-K113 VanDerWaalsContact O-CG 3.27Å; E109-K113 WeakPolarHBondContact O-CG 3.44Å; E109-K113 PolarHBondContact O-N 2.62Å
110	F	98.6	Very high	98.2	Very high	128 Å²	128	95.4 Å²	95.4	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-61.7	-48.6	177.1	176.7	-101.5	0	0	0	111.5	L106 D107 K108 M112 K113 Q114	L106-F110 WeakPolarHBondContact O-CB 3.31Å; L106-F110 PolarHBondContact O-N 3.24Å; D107-F110 PolarHBondContact O-N 3.02Å; K108-F110 VanDerWaalsContact C-N 3.35Å; K108-F110 PolarHBondContact O-N 3.37Å; F110-M112 VanDerWaalsContact C-N 3.33Å; F110-M112 PolarHBondContact O-N 3.33Å; F110-K113 PolarHBondContact O-N 2.74Å; F110-Q114 WeakPolarHBondContact O-CB 3.42Å; F110-Q114 PolarHBondContact O-N 3.44Å
111	Q	98.5	Very high	98.3	Very high	100 Å²	100	94 Å²	94	47%	0.467	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-41.2	178	-72.2	176.8	29.7	0	0	111.9	D107 K108 Q114 K115	D107-Q111 WeakPolarHBondContact O-CB 3.29Å; D107-Q111 VanDerWaalsContact O-CG 3.23Å; D107-Q111 WeakPolarHBondContact O-CG 3.27Å; D107-Q111 PolarHBondContact O-N 2.97Å; K108-Q111 PolarHBondContact O-N 2.97Å; Q111-Q114 PolarHBondContact O-N 2.79Å; Q111-K115 WeakPolarHBondContact O-CB 3.42Å; Q111-K115 VanDerWaalsContact O-CG 3.25Å; Q111-K115 WeakPolarHBondContact O-CG 3.35Å; Q111-K115 PolarHBondContact O-N 3.48Å
112	M	98.4	Very high	98.3	Very high	127 Å²	127	94.2 Å²	94.2	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-64.2	-44.9	176.6	-72	-60.2	-68.4	0	0	111.8	K108 E109 F110 K115 A116	K108-M112 WeakPolarHBondContact O-CB 3.25Å; K108-M112 VanDerWaalsContact O-CG 3.23Å; K108-M112 WeakPolarHBondContact O-CG 3.43Å; K108-M112 PolarHBondContact O-N 2.91Å; E109-M112 PolarHBondContact O-N 2.89Å; F110-M112 VanDerWaalsContact C-N 3.33Å; F110-M112 PolarHBondContact O-N 3.33Å; M112-K115 PolarHBondContact O-N 3.45Å; M112-A116 PolarHBondContact O-N 2.9Å
113	K	98.5	Very high	98.3	Very high	130 Å²	130	95.3 Å²	95.3	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-60.2	-45.7	174.6	-72.3	168.7	-172.6	166.7	0	111.3	E109 F110 A116 L117	E109-K113 WeakPolarHBondContact O-CB 3.23Å; E109-K113 VanDerWaalsContact O-CG 3.27Å; E109-K113 WeakPolarHBondContact O-CG 3.44Å; E109-K113 PolarHBondContact O-N 2.62Å; F110-K113 PolarHBondContact O-N 2.74Å; K113-A116 PolarHBondContact O-N 3.47Å; K113-L117 WeakPolarHBondContact O-CG 3.23Å; K113-L117 PolarHBondContact O-N 3.44Å
114	Q	98.5	Very high	98.3	Very high	78 Å²	78	96.6 Å²	96.6	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-42.9	179.6	-173.3	61	59.6	0	0	112.1	F110 Q111 L117 N118	F110-Q114 WeakPolarHBondContact O-CB 3.42Å; F110-Q114 PolarHBondContact O-N 3.44Å; Q111-Q114 PolarHBondContact O-N 2.79Å; Q114-L117 PolarHBondContact O-N 2.96Å; Q114-N118 PolarHBondContact NE2-OD1 3.07Å; Q114-N118 WeakPolarHBondContact O-CB 3.46Å; Q114-N118 PolarHBondContact O-N 3.39Å; Q114-N118 PolarHBondContact O-ND2 3.25Å
115	K	98.5	Very high	98.3	Very high	113 Å²	113	94.9 Å²	94.9	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-59.3	-48.4	174.3	-74.4	172.9	-173.8	175.8	0	111.1	Q111 M112 L117 N118 D119	Q111-K115 WeakPolarHBondContact O-CB 3.42Å; Q111-K115 VanDerWaalsContact O-CG 3.25Å; Q111-K115 WeakPolarHBondContact O-CG 3.35Å; Q111-K115 PolarHBondContact O-N 3.48Å; M112-K115 PolarHBondContact O-N 3.45Å; K115-L117 VanDerWaalsContact C-N 3.35Å; K115-L117 PolarHBondContact O-N 3.15Å; K115-N118 PolarHBondContact O-N 3.4Å; K115-D119 VanDerWaalsContact O-CG 3.25Å; K115-D119 PolarHBondContact O-N 3.47Å
116	A	98.3	Very high	98.3	Very high	49 Å²	49	92.2 Å²	92.2	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-59.2	-43.1	177.6	0	0	0	0	0	112.6	M112 K113 D119 L120	M112-A116 PolarHBondContact O-N 2.9Å; K113-A116 PolarHBondContact O-N 3.47Å; A116-D119 PolarHBondContact O-N 3.4Å; A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.31Å; A116-L120 PolarHBondContact O-N 2.66Å
117	L	98.3	Very high	98.2	Very high	104 Å²	104	95.2 Å²	95.2	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-43.4	175.8	-70.7	175.9	0	0	0	112.2	K113 Q114 K115 L120 A121	K113-L117 WeakPolarHBondContact O-CG 3.23Å; K113-L117 PolarHBondContact O-N 3.44Å; Q114-L117 PolarHBondContact O-N 2.96Å; K115-L117 VanDerWaalsContact C-N 3.35Å; K115-L117 PolarHBondContact O-N 3.15Å; L117-L120 PolarHBondContact O-N 3.11Å; L117-A121 WeakPolarHBondContact O-CB 3.4Å; L117-A121 PolarHBondContact O-N 2.86Å
118	N	98.5	Very high	98.2	Very high	88 Å²	88	97.3 Å²	97.3	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-42.9	177	-71.3	-13.5	0	0	0	111.3	Q114 K115 A121 A122	Q114-N118 PolarHBondContact NE2-OD1 3.07Å; Q114-N118 WeakPolarHBondContact O-CB 3.46Å; Q114-N118 PolarHBondContact O-N 3.39Å; Q114-N118 PolarHBondContact O-ND2 3.25Å; K115-N118 PolarHBondContact O-N 3.4Å; N118-A121 PolarHBondContact O-N 3.36Å; N118-A122 VanDerWaalsContact O-CB 3.31Å; N118-A122 WeakPolarHBondContact O-CB 3.4Å; N118-A122 PolarHBondContact O-N 3.49Å
119	D	98.4	Very high	98.2	Very high	95 Å²	95	99 Å²	99	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-44.2	177.6	-69.1	-22.5	0	0	0	111.5	K115 A116 A121 A122 Q123	K115-D119 VanDerWaalsContact O-CG 3.25Å; K115-D119 PolarHBondContact O-N 3.47Å; A116-D119 PolarHBondContact O-N 3.4Å; D119-A121 VanDerWaalsContact C-N 3.34Å; D119-A121 PolarHBondContact O-N 3.42Å; D119-A122 PolarHBondContact O-N 2.95Å; D119-Q123 WeakPolarHBondContact O-CB 3.08Å; D119-Q123 VanDerWaalsContact O-CG 3.24Å; D119-Q123 WeakPolarHBondContact O-CG 3.5Å; D119-Q123 PolarHBondContact O-N 3.05Å
120	L	98.1	Very high	98.1	Very high	88 Å²	88	98 Å²	98	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-41.6	175	-70.8	176.2	0	0	0	111.8	A116 L117 K124	A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.31Å; A116-L120 PolarHBondContact O-N 2.66Å; L117-L120 PolarHBondContact O-N 3.11Å; L120-K124 WeakPolarHBondContact O-CB 3.41Å; L120-K124 VanDerWaalsContact O-CG 3.3Å; L120-K124 WeakPolarHBondContact O-CG 3.34Å; L120-K124 PolarHBondContact O-N 3.09Å
121	A	98.2	Very high	98	Very high	50 Å²	50	99 Å²	99	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-41.6	175.6	0	0	0	0	0	111.8	L117 N118 D119 K124 T125	L117-A121 WeakPolarHBondContact O-CB 3.4Å; L117-A121 PolarHBondContact O-N 2.86Å; N118-A121 PolarHBondContact O-N 3.36Å; D119-A121 VanDerWaalsContact C-N 3.34Å; D119-A121 PolarHBondContact O-N 3.42Å; A121-K124 PolarHBondContact O-N 2.97Å; A121-T125 VanDerWaalsContact O-CB 3.31Å; A121-T125 WeakPolarHBondContact O-CB 3.22Å; A121-T125 PolarHBondContact O-N 3.13Å; A121-T125 PolarHBondContact O-OG1 3.47Å
122	A	98.1	Very high	98	Very high	58 Å²	58	100.9 Å²	100.9	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-44.7	176	0	0	0	0	0	111.4	N118 D119 T125 A126	N118-A122 VanDerWaalsContact O-CB 3.31Å; N118-A122 WeakPolarHBondContact O-CB 3.4Å; N118-A122 PolarHBondContact O-N 3.49Å; D119-A122 PolarHBondContact O-N 2.95Å; A122-T125 CarbonylContact O-C 3.47Å; A122-T125 PolarHBondContact O-N 2.96Å; A122-A126 VanDerWaalsContact O-CB 3.29Å; A122-A126 WeakPolarHBondContact O-CB 3.38Å; A122-A126 PolarHBondContact O-N 3.02Å
123	Q	97.9	Very high	97.9	Very high	105 Å²	105	100 Å²	100	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-61.2	-46.6	175.5	-72.6	175.2	37.6	0	0	112.1	D119 T125 A126 K127	D119-Q123 WeakPolarHBondContact O-CB 3.08Å; D119-Q123 VanDerWaalsContact O-CG 3.24Å; D119-Q123 WeakPolarHBondContact O-CG 3.5Å; D119-Q123 PolarHBondContact O-N 3.05Å; Q123-T125 VanDerWaalsContact C-N 3.3Å; Q123-T125 PolarHBondContact O-N 3.35Å; Q123-A126 PolarHBondContact O-N 3.32Å; Q123-K127 WeakPolarHBondContact O-CB 3.38Å; Q123-K127 WeakPolarHBondContact O-CG 3.29Å; Q123-K127 PolarHBondContact O-N 3.04Å
124	K	97.9	Very high	97.8	Very high	141 Å²	141	99.8 Å²	99.8	61%	0.613	51%	0.506	S	S	*	.	H	α-helix	trans	-59.9	-42.8	175.4	-73.5	174.6	-175.4	178.1	0	111.1	L120 A121 K128	L120-K124 WeakPolarHBondContact O-CB 3.41Å; L120-K124 VanDerWaalsContact O-CG 3.3Å; L120-K124 WeakPolarHBondContact O-CG 3.34Å; L120-K124 PolarHBondContact O-N 3.09Å; A121-K124 PolarHBondContact O-N 2.97Å; K124-K128 WeakPolarHBondContact O-CG 3.29Å; K124-K128 PolarHBondContact O-N 3.47Å
125	T	97.7	Very high	97.6	Very high	68 Å²	68	103.3 Å²	103.3	42%	0.417	52%	0.52	S	S	.	.	H	α-helix	trans	-67.1	-41.6	178.5	-60.6	0	0	0	0	111.8	A121 A122 Q123 K128 R129	A121-T125 VanDerWaalsContact O-CB 3.31Å; A121-T125 WeakPolarHBondContact O-CB 3.22Å; A121-T125 PolarHBondContact O-N 3.13Å; A121-T125 PolarHBondContact O-OG1 3.47Å; A122-T125 CarbonylContact O-C 3.47Å; A122-T125 PolarHBondContact O-N 2.96Å; Q123-T125 VanDerWaalsContact C-N 3.3Å; Q123-T125 PolarHBondContact O-N 3.35Å; T125-K128 PolarHBondContact O-N 3.32Å; T125-R129 VanDerWaalsContact O-CB 3.23Å; T125-R129 WeakPolarHBondContact O-CB 3.43Å; T125-R129 PolarHBondContact O-N 2.94Å
126	A	97.7	Very high	97.5	Very high	53 Å²	53	104.8 Å²	104.8	44%	0.438	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-46.5	176.1	0	0	0	0	0	111.5	A122 Q123 K128 R129 A130	A122-A126 VanDerWaalsContact O-CB 3.29Å; A122-A126 WeakPolarHBondContact O-CB 3.38Å; A122-A126 PolarHBondContact O-N 3.02Å; Q123-A126 PolarHBondContact O-N 3.32Å; A126-K128 PolarHBondContact O-N 3.19Å; A126-R129 PolarHBondContact O-N 3.46Å; A126-A130 WeakPolarHBondContact O-CB 3.12Å; A126-A130 PolarHBondContact O-N 2.88Å
127	K	97.6	Very high	97.4	Very high	145 Å²	145	104.8 Å²	104.8	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-57.2	-46.3	174	-72.7	176.8	-178.2	179.7	0	111.6	Q123 K131	Q123-K127 WeakPolarHBondContact O-CB 3.38Å; Q123-K127 WeakPolarHBondContact O-CG 3.29Å; Q123-K127 PolarHBondContact O-N 3.04Å; K127-K131 WeakPolarHBondContact O-CG 3.45Å; K127-K131 PolarHBondContact O-N 3.29Å
128	K	97.6	Very high	97.2	Very high	137 Å²	137	107.1 Å²	107.1	60%	0.596	53%	0.532	S	S	*	.	H	α-helix	trans	-66.6	-40.4	176.7	-73.7	178.9	178.9	-178.4	0	112.1	K124 T125 A126 K131 R132	K124-K128 WeakPolarHBondContact O-CG 3.29Å; K124-K128 PolarHBondContact O-N 3.47Å; T125-K128 PolarHBondContact O-N 3.32Å; A126-K128 PolarHBondContact O-N 3.19Å; K128-K131 PolarHBondContact O-N 3.08Å; K128-R132 WeakPolarHBondContact O-CG 3.32Å; K128-R132 PolarHBondContact O-N 2.85Å
129	R	97.7	Very high	96.9	Very high	146 Å²	146	112.1 Å²	112.1	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-62.7	-46.1	176.6	-176.7	-179	-73	164	-2.3	110.9	T125 A126 K131 R132 Q133	T125-R129 VanDerWaalsContact O-CB 3.23Å; T125-R129 WeakPolarHBondContact O-CB 3.43Å; T125-R129 PolarHBondContact O-N 2.94Å; A126-R129 PolarHBondContact O-N 3.46Å; R129-K131 PolarHBondContact O-N 3.4Å; R129-R132 PolarHBondContact O-N 3.13Å; R129-R132 VanDerWaalsContact O-N 3.14Å; R129-Q133 WeakPolarHBondContact O-CG 3.31Å; R129-Q133 PolarHBondContact O-N 3.5Å
130	A	97.3	Very high	96.7	Very high	54 Å²	54	111.8 Å²	111.8	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-57.1	-47.9	175.7	0	0	0	0	0	111.5	A126 R132 Q133 M134	A126-A130 WeakPolarHBondContact O-CB 3.12Å; A126-A130 PolarHBondContact O-N 2.88Å; A130-R132 VanDerWaalsContact C-N 3.33Å; A130-R132 PolarHBondContact O-N 2.94Å; A130-Q133 PolarHBondContact O-N 2.7Å; A130-Q133 VanDerWaalsContact O-N 3.16Å; A130-M134 WeakPolarHBondContact O-CG 3.41Å; A130-M134 PolarHBondContact O-N 3.07Å
131	K	97.5	Very high	96.3	Very high	149 Å²	149	111.9 Å²	111.9	65%	0.648	54%	0.543	S	S	*	.	H	α-helix	trans	-57.7	-42.2	174.7	-70.5	-177.8	-178.5	-172.5	0	112.6	K127 K128 R129 K135	K127-K131 WeakPolarHBondContact O-CG 3.45Å; K127-K131 PolarHBondContact O-N 3.29Å; K128-K131 PolarHBondContact O-N 3.08Å; R129-K131 PolarHBondContact O-N 3.4Å; K131-K135 WeakPolarHBondContact O-CG 3.29Å; K131-K135 PolarHBondContact O-N 2.87Å; K131-K135 VanDerWaalsContact O-N 3.08Å
132	R	97.4	Very high	95.9	Very high	141 Å²	141	116.1 Å²	116.1	53%	0.532	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-41.3	176.1	-72.3	-170.3	-63.1	-105.7	2.5	112.2	K128 R129 A130 K135 K136	K128-R132 WeakPolarHBondContact O-CG 3.32Å; K128-R132 PolarHBondContact O-N 2.85Å; R129-R132 PolarHBondContact O-N 3.13Å; R129-R132 VanDerWaalsContact O-N 3.14Å; A130-R132 VanDerWaalsContact C-N 3.33Å; A130-R132 PolarHBondContact O-N 2.94Å; R132-K135 PolarHBondContact O-N 2.65Å; R132-K136 WeakPolarHBondContact O-CB 3.32Å; R132-K136 PolarHBondContact O-N 2.75Å
133	Q	96.7	Very high	95.5	Very high	107 Å²	107	122.5 Å²	122.5	50%	0.5	56%	0.564	S	S	.	*	H	α-helix	trans	-66.4	-41.7	177.7	-66	-59.8	-4.7	0	0	111.9	R129 A130 K135 K136 A137	R129-Q133 WeakPolarHBondContact O-CG 3.31Å; R129-Q133 PolarHBondContact O-N 3.5Å; A130-Q133 PolarHBondContact O-N 2.7Å; A130-Q133 VanDerWaalsContact O-N 3.16Å; Q133-K135 VanDerWaalsContact C-N 3.34Å; Q133-K135 PolarHBondContact O-N 3.13Å; Q133-K136 PolarHBondContact O-N 3.42Å; Q133-A137 WeakPolarHBondContact O-CB 3.44Å; Q133-A137 PolarHBondContact O-N 3.45Å
134	M	95.4	Very high	94.9	Very high	127 Å²	127	123.6 Å²	123.6	63%	0.626	57%	0.567	S	S	*	*	H	α-helix	trans	-59.7	-43.4	173.4	-67.1	-176.5	101	0	0	111.8	A130 A137 K138	A130-M134 WeakPolarHBondContact O-CG 3.41Å; A130-M134 PolarHBondContact O-N 3.07Å; M134-A137 PolarHBondContact O-N 2.77Å; M134-K138 WeakPolarHBondContact O-CG 3.3Å; M134-K138 PolarHBondContact O-N 2.96Å
135	K	95.9	Very high	94.1	Very high	151 Å²	151	122.2 Å²	122.2	66%	0.657	57%	0.566	S	S	*	*	H	α-helix	trans	-64.7	-40.7	175	-71.7	-178.4	-179.8	-170.1	0	112.1	K131 R132 Q133 K138 R139	K131-K135 WeakPolarHBondContact O-CG 3.29Å; K131-K135 PolarHBondContact O-N 2.87Å; K131-K135 VanDerWaalsContact O-N 3.08Å; R132-K135 PolarHBondContact O-N 2.65Å; Q133-K135 VanDerWaalsContact C-N 3.34Å; Q133-K135 PolarHBondContact O-N 3.13Å; K135-K138 PolarHBondContact O-N 2.86Å; K135-R139 WeakPolarHBondContact O-CG 3.35Å; K135-R139 PolarHBondContact O-N 2.88Å
136	K	96.4	Very high	93.2	Very high	144 Å²	144	124.4 Å²	124.4	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-62.5	-45	176.3	-172.2	179.3	178.3	-177.2	0	111.3	R132 Q133 R139 L140	R132-K136 WeakPolarHBondContact O-CB 3.32Å; R132-K136 PolarHBondContact O-N 2.75Å; Q133-K136 PolarHBondContact O-N 3.42Å; K136-R139 PolarHBondContact O-N 3.33Å; K136-L140 WeakPolarHBondContact O-CB 3.36Å; K136-L140 PolarHBondContact O-N 3.08Å
137	A	94.5	Very high	92	Very high	49 Å²	49	125.5 Å²	125.5	41%	0.405	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-46.7	176.2	0	0	0	0	0	112.1	Q133 M134 R139 L140 N141	Q133-A137 WeakPolarHBondContact O-CB 3.44Å; Q133-A137 PolarHBondContact O-N 3.45Å; M134-A137 PolarHBondContact O-N 2.77Å; A137-R139 VanDerWaalsContact C-N 3.34Å; A137-R139 PolarHBondContact O-N 3.4Å; A137-L140 PolarHBondContact O-N 3.33Å; A137-N141 PolarHBondContact O-N 3.01Å
138	K	94.4	Very high	90.5	Very high	154 Å²	154	126.1 Å²	126.1	67%	0.67	58%	0.577	S	S	*	*	H	α-helix	trans	-58.3	-43.4	174.8	-73.2	-178.7	179.9	-169.9	0	112.2	M134 K135 N141 K142	M134-K138 WeakPolarHBondContact O-CG 3.3Å; M134-K138 PolarHBondContact O-N 2.96Å; K135-K138 PolarHBondContact O-N 2.86Å; K138-N141 PolarHBondContact O-N 2.94Å; K138-K142 PolarHBondContact O-N 2.85Å
139	R	93	Very high	88.5	Confident	192 Å²	192	123.3 Å²	123.3	73%	0.725	57%	0.573	S	S	*	*	H	α-helix	trans	-63.8	-42.6	176.1	-73.6	175.9	71.1	-172.5	3.3	112.1	K135 K136 A137 K142 R143	K135-R139 WeakPolarHBondContact O-CG 3.35Å; K135-R139 PolarHBondContact O-N 2.88Å; K136-R139 PolarHBondContact O-N 3.33Å; A137-R139 VanDerWaalsContact C-N 3.34Å; A137-R139 PolarHBondContact O-N 3.4Å; R139-K142 PolarHBondContact O-N 3.35Å; R139-R143 WeakPolarHBondContact O-CG 3.49Å; R139-R143 PolarHBondContact O-N 2.97Å
140	L	93	Very high	86.3	Confident	88 Å²	88	124.6 Å²	124.6	46%	0.461	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-43.8	177.4	-174.9	63.1	0	0	0	111.5	K136 A137 R143 K144	K136-L140 WeakPolarHBondContact O-CB 3.36Å; K136-L140 PolarHBondContact O-N 3.08Å; A137-L140 PolarHBondContact O-N 3.33Å; L140-R143 PolarHBondContact O-N 3.3Å; L140-K144 WeakPolarHBondContact O-CG 3.2Å; L140-K144 PolarHBondContact O-N 3.46Å
141	N	90.7	Very high	84	Confident	91 Å²	91	126.7 Å²	126.7	49%	0.487	59%	0.594	S	S	.	*	H	α-helix	trans	-63.3	-43	177.1	-70.1	-9.1	0	0	0	112	A137 K138 R143 K144 L145	A137-N141 PolarHBondContact O-N 3.01Å; K138-N141 PolarHBondContact O-N 2.94Å; N141-R143 VanDerWaalsContact C-N 3.31Å; N141-R143 PolarHBondContact O-N 2.96Å; N141-K144 PolarHBondContact O-N 2.87Å; N141-L145 WeakPolarHBondContact O-CD1 3.33Å; N141-L145 PolarHBondContact O-N 3.15Å
142	K	90.5	Very high	81.5	Confident	139 Å²	139	128.9 Å²	128.9	60%	0.604	60%	0.604	S	S	*	*	H	α-helix	trans	-61.5	-38	174.9	-170	173.4	-177.6	177.9	0	111.9	K138 R139 K146	K138-K142 PolarHBondContact O-N 2.85Å; R139-K142 PolarHBondContact O-N 3.35Å; K142-K146 WeakPolarHBondContact O-CB 3.2Å; K142-K146 WeakPolarHBondContact O-CG 3.35Å; K142-K146 PolarHBondContact O-N 2.9Å
143	R	88.1	Confident	78.6	Confident	191 Å²	191	126 Å²	126	72%	0.721	61%	0.605	S	S	*	*	H	α-helix	trans	-65.8	-42.6	174.5	-71.5	178.4	74.4	177.1	5.1	112.1	R139 L140 N141 K146 S147	R139-R143 WeakPolarHBondContact O-CG 3.49Å; R139-R143 PolarHBondContact O-N 2.97Å; L140-R143 PolarHBondContact O-N 3.3Å; N141-R143 VanDerWaalsContact C-N 3.31Å; N141-R143 PolarHBondContact O-N 2.96Å; R143-K146 PolarHBondContact O-N 3.21Å; R143-S147 PolarHBondContact O-N 3.32Å; R143-S147 PolarHBondContact O-OG 3.42Å
144	K	86.5	Confident	75.7	Confident	128 Å²	128	125.9 Å²	125.9	56%	0.557	62%	0.616	S	S	*	*	H	α-helix	trans	-64	-39.2	175.9	-71.3	-177.7	177.2	-171.9	0	112.9	L140 N141 S147 K148	L140-K144 WeakPolarHBondContact O-CG 3.2Å; L140-K144 PolarHBondContact O-N 3.46Å; N141-K144 PolarHBondContact O-N 2.87Å; K144-S147 WeakPolarHBondContact CA-OG 3.39Å; K144-S147 PolarHBondContact O-OG 3.17Å; K144-K148 WeakPolarHBondContact O-CB 3.36Å; K144-K148 PolarHBondContact O-N 3.1Å; K144-K148 VanDerWaalsContact O-N 3.09Å
145	L	80.2	Confident	73	Confident	113 Å²	113	128 Å²	128	59%	0.592	63%	0.625	S	S	*	*	H	α-helix	trans	-67.3	-46.3	174.7	-78.7	150.9	0	0	0	111.2	N141 S147 K148 C149	N141-L145 WeakPolarHBondContact O-CD1 3.33Å; N141-L145 PolarHBondContact O-N 3.15Å; L145-S147 VanDerWaalsContact C-N 3.32Å; L145-S147 PolarHBondContact O-N 3.16Å; L145-K148 PolarHBondContact O-N 3.43Å; L145-K148 VanDerWaalsContact O-N 3.16Å; L145-C149 PolarHBondContact O-N 3.11Å; L145-C149 PolarHBondContact O-SG 3.37Å
146	K	79.8	Confident	70.1	Confident	114 Å²	114	128.3 Å²	128.3	50%	0.496	63%	0.633	S	S	.	*	H	α-helix	trans	-59.7	-39.5	175.4	-77.9	-169	171.3	-159.6	0	112.4	K142 R143 K150	K142-K146 WeakPolarHBondContact O-CB 3.2Å; K142-K146 WeakPolarHBondContact O-CG 3.35Å; K142-K146 PolarHBondContact O-N 2.9Å; R143-K146 PolarHBondContact O-N 3.21Å; K146-K150 WeakPolarHBondContact O-CB 3.34Å; K146-K150 WeakPolarHBondContact O-CG 3.37Å; K146-K150 PolarHBondContact O-N 2.85Å
147	S	71.1	Confident	67.3	Low	76 Å²	76	127 Å²	127	53%	0.531	64%	0.643	S	S	.	*	H	α-helix	trans	-69.9	-32.4	176.3	59.9	0	0	0	0	113.1	R143 K144 L145 S151	R143-S147 PolarHBondContact O-N 3.32Å; R143-S147 PolarHBondContact O-OG 3.42Å; K144-S147 WeakPolarHBondContact CA-OG 3.39Å; K144-S147 PolarHBondContact O-OG 3.17Å; L145-S147 VanDerWaalsContact C-N 3.32Å; L145-S147 PolarHBondContact O-N 3.16Å; S147-S151 PolarHBondContact O-N 3.19Å; S147-S151 PolarHBondContact O-OG 3.34Å
148	K	67.7	Low	64.9	Low	157 Å²	157	132.7 Å²	132.7	68%	0.683	67%	0.666	S	S	*	*	H	α-helix	trans	-76.6	-31.3	177.4	-167.7	175.9	-177.4	179	0	113.1	K144 L145 S151	K144-K148 WeakPolarHBondContact O-CB 3.36Å; K144-K148 PolarHBondContact O-N 3.1Å; K144-K148 VanDerWaalsContact O-N 3.09Å; L145-K148 PolarHBondContact O-N 3.43Å; L145-K148 VanDerWaalsContact O-N 3.16Å; K148-S151 PolarHBondContact O-OG 3.26Å
149	C	54.6	Low	62.6	Low	78 Å²	78	135.7 Å²	135.7	53%	0.527	68%	0.675	S	S	.	*	H	α-helix	trans	-77.7	-37.6	174.2	-65.8	0	0	0	0	111.8	L145 S151 K152 S153	L145-C149 PolarHBondContact O-N 3.11Å; L145-C149 PolarHBondContact O-SG 3.37Å; C149-S151 PolarHBondContact O-N 3.33Å; C149-K152 PolarHBondContact O-N 3.42Å; C149-S153 PolarHBondContact O-N 2.93Å; C149-S153 VanDerWaalsContact O-N 3.12Å; C149-S153 PolarHBondContact O-OG 2.92Å
150	K	52.1	Low	60.5	Low	174 Å²	174	134.8 Å²	134.8	76%	0.757	68%	0.683	S	S	*	*	H	α-helix	trans	-63.3	-22.5	174.3	-80.4	-167.8	172.5	-164.4	0	113.9	K146 K152	K146-K150 WeakPolarHBondContact O-CB 3.34Å; K146-K150 WeakPolarHBondContact O-CG 3.37Å; K146-K150 PolarHBondContact O-N 2.85Å; K150-K152 VanDerWaalsContact C-N 3.32Å
151	S	48.3	Very low	58.3	Low	97 Å²	97	135.6 Å²	135.6	68%	0.678	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	3.6	172.3	60.9	0	0	0	0	114.2	S147 K148 C149	S147-S151 PolarHBondContact O-N 3.19Å; S147-S151 PolarHBondContact O-OG 3.34Å; K148-S151 PolarHBondContact O-OG 3.26Å; C149-S151 PolarHBondContact O-N 3.33Å
152	K	45.5	Very low	56.4	Low	195 Å²	195	138.9 Å²	138.9	85%	0.848	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	-5	-178	-112.4	-178.7	178.2	-178.2	0	115.3	C149 K150	C149-K152 PolarHBondContact O-N 3.42Å; K150-K152 VanDerWaalsContact C-N 3.32Å
153	S	35.5	Very low	54.4	Low	81 Å²	81	140.7 Å²	140.7	57%	0.566	71%	0.711	S	S	*	*			trans	-130.3	78.7	173	68.9	0	0	0	0	109.5	C149	C149-S153 PolarHBondContact O-N 2.93Å; C149-S153 VanDerWaalsContact O-N 3.12Å; C149-S153 PolarHBondContact O-OG 2.92Å
154	S	37.1	Very low	52.6	Low	104 Å²	104	137.8 Å²	137.8	73%	0.727	71%	0.709	S	S	*	*			trans	-103.6	65.3	167.7	55.7	0	0	0	0	108.1
155	E	37.4	Very low	51.1	Low	173 Å²	173	137.4 Å²	137.4	81%	0.808	71%	0.71	S	S	*	*	S	Bend	trans	-176.6	118.1	168.3	-99.3	149.1	-148	0	0	105.6
156	D	36.1	Very low	49.8	Very low	156 Å²	156	136.8 Å²	136.8	83%	0.834	71%	0.707	S	S	*	*	S	Bend	trans	64.8	94.9	169.2	-56.1	-26.7	0	0	0	120
157	S	36.6	Very low	48.8	Very low	118 Å²	118	134.3 Å²	134.3	83%	0.825	70%	0.704	S	S	*	*			trans	168.9	65.1	135	49	0	0	0	0	113.6	Y159	S157-Y159 PolarHBondContact O-N 3.2Å
158	D	44	Very low	48.2	Very low	167 Å²	167	132.8 Å²	132.8	89%	0.893	70%	0.696	S	S	*	*			trans	-82.7	91.5	157.6	-93.7	-22.7	0	0	0	108.3
159	Y	46.2	Very low	47.7	Very low	218 Å²	218	131.5 Å²	131.5	86%	0.855	69%	0.693	S	S	*	*	S	Bend	trans	-164.2	5.3	162	-134.1	-98.7	0	0	0	117.5	S157	S157-Y159 PolarHBondContact O-N 3.2Å
160	L	48.8	Very low	47.9	Very low	172 Å²	172	134 Å²	134	90%	0.901	70%	0.7	S	S	*	*	S	Bend	trans	-134.8	40.6	-171.2	-67.1	176.2	0	0	0	115.7
161	D	48	Very low	48.4	Very low	106 Å²	106	129.6 Å²	129.6	57%	0.567	69%	0.69	S	S	*	*	S	Bend	trans	-124.8	-2.3	172.4	-146.3	28.3	0	0	0	114.2
162	E	50.5	Low	49.2	Very low	160 Å²	160	130.7 Å²	130.7	75%	0.748	69%	0.688	S	S	*	*	H	α-helix	trans	-88.2	-8.6	-171.4	-140	173.4	-170.6	0	0	114.9	N166	E162-N166 PolarHBondContact O-ND2 2.86Å
163	Q	48	Very low	50.2	Low	176 Å²	176	123 Å²	123	82%	0.822	66%	0.664	S	S	*	*	H	α-helix	trans	-91.7	-19.5	179.8	-69.8	-151.2	2	0	0	114.9
164	L	51	Low	51.7	Low	130 Å²	130	126.5 Å²	126.5	68%	0.681	67%	0.669	S	S	*	*	H	α-helix	trans	-82.7	-24.1	177.7	-89.5	157.4	0	0	0	112.8	S167 A168	L164-S167 PolarHBondContact O-OG 3.48Å; L164-A168 PolarHBondContact O-N 3.36Å
165	E	54	Low	53.3	Low	121 Å²	121	126.5 Å²	126.5	57%	0.565	66%	0.66	S	S	*	*	H	α-helix	trans	-77.4	-35.9	176.3	-64.3	-168.1	159.5	0	0	111.7	S167 A168 Q169	E165-S167 PolarHBondContact O-N 3.14Å; E165-A168 PolarHBondContact O-N 3.39Å; E165-Q169 WeakPolarHBondContact O-CB 3.43Å; E165-Q169 PolarHBondContact O-N 3.09Å; E165-Q169 PolarHBondContact O-OE1 3.38Å
166	N	54.3	Low	54.8	Low	99 Å²	99	125.7 Å²	125.7	53%	0.529	65%	0.654	S	S	.	*	H	α-helix	trans	-64.6	-36.1	177	-76.2	-44.5	0	0	0	113.6	E162 L170	E162-N166 PolarHBondContact O-ND2 2.86Å; N166-L170 WeakPolarHBondContact O-CB 3.45Å; N166-L170 WeakPolarHBondContact O-CD1 3.19Å; N166-L170 VanDerWaalsContact O-CG 3.24Å; N166-L170 WeakPolarHBondContact O-CG 3.35Å; N166-L170 PolarHBondContact O-N 3.43Å
167	S	57.9	Low	56.6	Low	62 Å²	62	122.8 Å²	122.8	43%	0.434	64%	0.642	S	S	.	*	H	α-helix	trans	-74.1	-29.4	174.5	62	0	0	0	0	113.2	L164 E165 C171	L164-S167 PolarHBondContact O-OG 3.48Å; E165-S167 PolarHBondContact O-N 3.14Å; S167-C171 WeakPolarHBondContact O-CB 3.46Å; S167-C171 PolarHBondContact O-N 3.42Å; S167-C171 VanDerWaalsContact O-N 3.11Å; S167-C171 PolarHBondContact O-SG 3.42Å
168	A	59.2	Low	58.2	Low	45 Å²	45	121.7 Å²	121.7	37%	0.372	63%	0.626	S	S	.	*	H	α-helix	trans	-75.9	-38	173.7	0	0	0	0	0	112	L164 E165 C171 L172	L164-A168 PolarHBondContact O-N 3.36Å; E165-A168 PolarHBondContact O-N 3.39Å; A168-C171 PolarHBondContact O-N 3.03Å; A168-L172 WeakPolarHBondContact O-CB 3.36Å; A168-L172 VanDerWaalsContact O-CG 3.26Å; A168-L172 WeakPolarHBondContact O-CG 3.38Å; A168-L172 PolarHBondContact O-N 3.33Å
169	Q	57.4	Low	59.6	Low	130 Å²	130	117.8 Å²	117.8	61%	0.607	61%	0.608	S	S	*	*	H	α-helix	trans	-63.3	-42.8	172.6	-123.4	86.2	-14.1	0	0	111.2	E165 L172 G173	E165-Q169 WeakPolarHBondContact O-CB 3.43Å; E165-Q169 PolarHBondContact O-N 3.09Å; E165-Q169 PolarHBondContact O-OE1 3.38Å; Q169-L172 PolarHBondContact O-N 3Å; Q169-G173 PolarHBondContact O-N 3.06Å
170	L	59.1	Low	61	Low	131 Å²	131	114 Å²	114	69%	0.686	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-40.5	175.6	-76.4	165.2	0	0	0	111.8	N166 F174	N166-L170 WeakPolarHBondContact O-CB 3.45Å; N166-L170 WeakPolarHBondContact O-CD1 3.19Å; N166-L170 VanDerWaalsContact O-CG 3.24Å; N166-L170 WeakPolarHBondContact O-CG 3.35Å; N166-L170 PolarHBondContact O-N 3.43Å; L170-F174 WeakPolarHBondContact O-CB 3Å; L170-F174 PolarHBondContact O-N 2.9Å
171	C	61.3	Low	62	Low	81 Å²	81	111 Å²	111	55%	0.547	57%	0.574	S	S	.	*	H	α-helix	trans	-67.1	-41.3	175.2	-70.4	0	0	0	0	113	S167 A168 I175	S167-C171 WeakPolarHBondContact O-CB 3.46Å; S167-C171 PolarHBondContact O-N 3.42Å; S167-C171 VanDerWaalsContact O-N 3.11Å; S167-C171 PolarHBondContact O-SG 3.42Å; A168-C171 PolarHBondContact O-N 3.03Å; C171-I175 WeakPolarHBondContact O-CD1 3.47Å; C171-I175 VanDerWaalsContact O-CG1 3.3Å; C171-I175 WeakPolarHBondContact O-CG1 3.36Å; C171-I175 PolarHBondContact O-N 3.2Å
172	L	66.5	Low	63	Low	120 Å²	120	110.9 Å²	110.9	63%	0.628	58%	0.58	S	S	*	*	H	α-helix	trans	-71.4	-37.7	178.7	-70.5	171.8	0	0	0	111.9	A168 Q169 I175 F176	A168-L172 WeakPolarHBondContact O-CB 3.36Å; A168-L172 VanDerWaalsContact O-CG 3.26Å; A168-L172 WeakPolarHBondContact O-CG 3.38Å; A168-L172 PolarHBondContact O-N 3.33Å; Q169-L172 PolarHBondContact O-N 3Å; L172-I175 PolarHBondContact O-N 2.92Å; L172-F176 PolarHBondContact O-N 3.46Å
173	G	66	Low	63.7	Low	34 Å²	34	112.2 Å²	112.2	35%	0.351	58%	0.583	S	S	.	*	H	α-helix	trans	-63.8	-42.5	173.5	0	0	0	0	0	112.5	Q169 I175 F176 V177	Q169-G173 PolarHBondContact O-N 3.06Å; G173-I175 VanDerWaalsContact C-N 3.33Å; G173-I175 PolarHBondContact O-N 3.08Å; G173-F176 PolarHBondContact O-N 3.34Å; G173-V177 WeakPolarHBondContact O-CG2 3.45Å; G173-V177 PolarHBondContact O-N 3.01Å
174	F	66.2	Low	64.6	Low	153 Å²	153	111.8 Å²	111.8	67%	0.671	57%	0.574	S	S	*	*	H	α-helix	trans	-64.6	-37.3	178.5	-143.5	-95.4	0	0	0	112.3	L170 L178	L170-F174 WeakPolarHBondContact O-CB 3Å; L170-F174 PolarHBondContact O-N 2.9Å; F174-L178 HydrophobicContact CD1-CD1 3.76Å; F174-L178 HydrophobicContact CE1-CD1 4Å; F174-L178 WeakPolarHBondContact O-CB 3.41Å; F174-L178 PolarHBondContact O-N 3.16Å
175	I	71.2	Confident	64.9	Low	105 Å²	105	109.7 Å²	109.7	54%	0.538	56%	0.563	S	S	.	*	H	α-helix	trans	-68.5	-39.9	174.7	-66.2	166.6	0	0	0	110.9	C171 L172 G173 L178 V179	C171-I175 WeakPolarHBondContact O-CD1 3.47Å; C171-I175 VanDerWaalsContact O-CG1 3.3Å; C171-I175 WeakPolarHBondContact O-CG1 3.36Å; C171-I175 PolarHBondContact O-N 3.2Å; L172-I175 PolarHBondContact O-N 2.92Å; G173-I175 VanDerWaalsContact C-N 3.33Å; G173-I175 PolarHBondContact O-N 3.08Å; I175-L178 PolarHBondContact O-N 3.35Å; I175-V179 HydrophobicContact CG2-CG2 4.4Å; I175-V179 WeakPolarHBondContact O-CB 3.42Å; I175-V179 VanDerWaalsContact O-CG2 3.29Å; I175-V179 WeakPolarHBondContact O-CG2 3.39Å; I175-V179 PolarHBondContact O-N 3.33Å
176	F	69.5	Low	65.5	Low	156 Å²	156	108.8 Å²	108.8	68%	0.684	57%	0.568	S	S	*	*	H	α-helix	trans	-67.8	-39.9	178.8	-156.8	-94.6	0	0	0	112.1	L172 G173 W180	L172-F176 PolarHBondContact O-N 3.46Å; G173-F176 PolarHBondContact O-N 3.34Å; F176-W180 VanDerWaalsContact O-CB 3.28Å; F176-W180 WeakPolarHBondContact O-CB 3.48Å; F176-W180 PolarHBondContact O-N 3.44Å
177	V	72.9	Confident	65.4	Low	95 Å²	95	113.1 Å²	113.1	58%	0.576	58%	0.582	S	S	*	*	H	α-helix	trans	-65.2	-44.4	174.5	174	0	0	0	0	111.1	G173 W180 H181	G173-V177 WeakPolarHBondContact O-CG2 3.45Å; G173-V177 PolarHBondContact O-N 3.01Å; V177-W180 PolarHBondContact O-N 2.81Å; V177-H181 VanDerWaalsContact O-CB 3.3Å; V177-H181 WeakPolarHBondContact O-CB 3.49Å; V177-H181 PolarHBondContact O-N 3.16Å
178	L	70.4	Confident	65.3	Low	95 Å²	95	120.8 Å²	120.8	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-62.6	-42.8	176.6	-90.7	161.2	0	0	0	112.7	F174 I175 C182	F174-L178 HydrophobicContact CD1-CD1 3.76Å; F174-L178 HydrophobicContact CE1-CD1 4Å; F174-L178 WeakPolarHBondContact O-CB 3.41Å; F174-L178 PolarHBondContact O-N 3.16Å; I175-L178 PolarHBondContact O-N 3.35Å; L178-C182 VanDerWaalsContact O-CB 3.3Å; L178-C182 WeakPolarHBondContact O-CB 3.41Å; L178-C182 PolarHBondContact O-N 3.15Å; L178-C182 PolarHBondContact O-SG 3.14Å
179	V	72.4	Confident	65.2	Low	85 Å²	85	127 Å²	127	52%	0.515	62%	0.617	S	S	.	*	H	α-helix	trans	-69.2	-37.2	178.1	172.4	0	0	0	0	111.5	I175 K183	I175-V179 HydrophobicContact CG2-CG2 4.4Å; I175-V179 WeakPolarHBondContact O-CB 3.42Å; I175-V179 VanDerWaalsContact O-CG2 3.29Å; I175-V179 WeakPolarHBondContact O-CG2 3.39Å; I175-V179 PolarHBondContact O-N 3.33Å; V179-K183 PolarHBondContact O-N 3.02Å; V179-K183 VanDerWaalsContact O-N 3.17Å
180	W	76	Confident	64.9	Low	138 Å²	138	127.8 Å²	127.8	52%	0.523	63%	0.625	S	S	.	*	H	α-helix	trans	-69.5	-41.1	175.8	-170.1	81.5	0	0	0	111.9	F176 V177 K183 R184	F176-W180 VanDerWaalsContact O-CB 3.28Å; F176-W180 WeakPolarHBondContact O-CB 3.48Å; F176-W180 PolarHBondContact O-N 3.44Å; V177-W180 PolarHBondContact O-N 2.81Å; W180-K183 PolarHBondContact O-N 3.25Å; W180-R184 WeakPolarHBondContact O-CB 3.14Å; W180-R184 PolarHBondContact O-N 3.33Å
181	H	71.2	Confident	64.8	Low	109 Å²	109	127.2 Å²	127.2	51%	0.505	63%	0.627	S	S	.	*	H	α-helix	trans	-69.1	-42.9	178.4	-146.5	60.7	0	0	0	111.3	V177 K183 R184 L185	V177-H181 VanDerWaalsContact O-CB 3.3Å; V177-H181 WeakPolarHBondContact O-CB 3.49Å; V177-H181 PolarHBondContact O-N 3.16Å; H181-K183 VanDerWaalsContact C-N 3.3Å; H181-K183 PolarHBondContact O-N 3.13Å; H181-R184 PolarHBondContact O-N 3.49Å; H181-L185 WeakPolarHBondContact CD2-CD1 3.29Å; H181-L185 WeakPolarHBondContact NE2-CD1 3.45Å; H181-L185 WeakPolarHBondContact O-CD1 3.31Å; H181-L185 PolarHBondContact O-N 3.24Å; H181-L185 VanDerWaalsContact O-N 3.15Å
182	C	67.8	Low	64.3	Low	104 Å²	104	131.6 Å²	131.6	70%	0.703	64%	0.637	S	S	*	*	H	α-helix	trans	-66.4	-25.1	176	-76.9	0	0	0	0	114.3	L178	L178-C182 VanDerWaalsContact O-CB 3.3Å; L178-C182 WeakPolarHBondContact O-CB 3.41Å; L178-C182 PolarHBondContact O-N 3.15Å; L178-C182 PolarHBondContact O-SG 3.14Å
183	K	65.7	Low	63.8	Low	187 Å²	187	135.3 Å²	135.3	81%	0.813	65%	0.648	S	S	*	*	H	α-helix	trans	-91.5	-12.5	173.6	-93.5	-177.7	172.8	-177.3	0	114.4	V179 W180 H181	V179-K183 PolarHBondContact O-N 3.02Å; V179-K183 VanDerWaalsContact O-N 3.17Å; W180-K183 PolarHBondContact O-N 3.25Å; H181-K183 VanDerWaalsContact C-N 3.3Å; H181-K183 PolarHBondContact O-N 3.13Å
184	R	67.4	Low	63.5	Low	168 Å²	168	138.6 Å²	138.6	63%	0.634	66%	0.658	S	S	*	*	H	α-helix	trans	-110.6	-3	-175.1	-162.8	158.5	-174.9	145.8	-0.9	114.5	W180 H181 P186	W180-R184 WeakPolarHBondContact O-CB 3.14Å; W180-R184 PolarHBondContact O-N 3.33Å; H181-R184 PolarHBondContact O-N 3.49Å; R184-P186 WeakPolarHBondContact O-CD 3.21Å
185	L	57.6	Low	63.1	Low	86 Å²	86	137.8 Å²	137.8	45%	0.45	66%	0.659	S	S	.	*			trans	-81.1	111.7	166.1	-89.9	110.8	0	0	0	110.5	H181 F187	H181-L185 WeakPolarHBondContact CD2-CD1 3.29Å; H181-L185 WeakPolarHBondContact NE2-CD1 3.45Å; H181-L185 WeakPolarHBondContact O-CD1 3.31Å; H181-L185 PolarHBondContact O-N 3.24Å; H181-L185 VanDerWaalsContact O-N 3.15Å; L185-F187 PolarHBondContact O-N 3.23Å
186	P	64.8	Low	62.6	Low	101 Å²	101	137.9 Å²	137.9	66%	0.656	67%	0.667	S	S	*	*			trans	-64.5	122.1	162.6	28.2	-31.6	0	0	0	107.6	R184 R188	R184-P186 WeakPolarHBondContact O-CD 3.21Å; P186-R188 VanDerWaalsContact C-N 3.28Å; P186-R188 PolarHBondContact O-N 3.48Å
187	F	53.1	Low	62.3	Low	191 Å²	191	138.4 Å²	138.4	84%	0.838	68%	0.677	S	S	*	*			trans	-59	90.2	173.1	-155.1	-96	0	0	0	108.6	L185	L185-F187 PolarHBondContact O-N 3.23Å
188	R	55.8	Low	62	Low	222 Å²	222	142.9 Å²	142.9	84%	0.838	69%	0.688	S	S	*	*			trans	-124.2	75.1	171.3	-87.2	-168.7	153.5	169.5	-4.4	108.1	P186	P186-R188 VanDerWaalsContact C-N 3.28Å; P186-R188 PolarHBondContact O-N 3.48Å
189	Y	56.9	Low	61.7	Low	176 Å²	176	150.3 Å²	150.3	69%	0.69	72%	0.721	S	S	*	*			trans	-118.1	92.1	156.4	-60.3	-72.2	0	0	0	107.1	V191	Y189-V191 PolarHBondContact O-N 2.91Å
190	N	51.9	Low	61.2	Low	147 Å²	147	153.6 Å²	153.6	79%	0.786	73%	0.731	S	S	*	*			trans	-74.7	96.5	163.2	-158.4	-10.9	0	0	0	105.3
191	V	57.2	Low	60.4	Low	119 Å²	119	154.4 Å²	154.4	72%	0.721	74%	0.742	S	S	*	*			trans	-107.9	94.9	168.7	-175.8	0	0	0	0	106.7	Y189 F193	Y189-V191 PolarHBondContact O-N 2.91Å; V191-F193 PolarHBondContact O-N 3.06Å
192	F	50.4	Low	59.8	Low	173 Å²	173	156.9 Å²	156.9	76%	0.759	76%	0.755	S	S	*	*			trans	-52.8	116.8	163.1	-135.1	-105.7	0	0	0	108.6
193	F	55.5	Low	59.3	Low	197 Å²	197	160.1 Å²	160.1	86%	0.864	76%	0.758	S	S	*	*			trans	-136.4	124.3	158.7	-126	-92.4	0	0	0	109.9	V191	V191-F193 PolarHBondContact O-N 3.06Å
194	N	58.7	Low	58.9	Low	104 Å²	104	158.4 Å²	158.4	56%	0.556	76%	0.755	S	S	*	*			trans	-70.3	138.1	-171.8	-112.7	-128.9	0	0	0	112.7
195	I	59.3	Low	58.4	Low	136 Å²	136	157.7 Å²	157.7	70%	0.697	76%	0.763	S	S	*	*				68.8	154.6	124.2	-61.5	-171.3	0	0	0	118.5
196	P	59.9	Low	58.4	Low	107 Å²	107	162.9 Å²	162.9	70%	0.695	79%	0.785	S	S	*	*			cis	-128.5	164.2	-14.7	25.4	-5.6	0	0	0	115.1
197	D	63.7	Low	57.9	Low	167 Å²	167	167.6 Å²	167.6	89%	0.893	80%	0.795	S	S	*	*			trans	-69	143	158.2	-64.9	-47.3	0	0	0	111.9
198	F	67.2	Low	58.3	Low	188 Å²	188	165.7 Å²	165.7	83%	0.825	79%	0.792	S	S	*	*			trans	-119.3	124.7	170.3	-143.4	-89.8	0	0	0	108.5
199	Q	63.4	Low	58.5	Low	252 Å²	252	160.5 Å²	160.5	100%	1.178	79%	0.788	S	S	*	*			trans	13.7	0	168.1	-74.3	-177.7	-32.6	0	0	120.3

Retrieved 199 of 199 residues in 43.6 ms (Link to these results)

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