A0A077YV69_TRITR Loading...

DUF4588 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YV69, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 211 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	48.1	Very low	44.7	Very low	245 Å²	245	160.3 Å²	160.3	100%	1.207	85%	0.845	S	S	*	*				0	80.5	0	-64.6	-176.6	172.2	0	0	106.1
2	A	43	Very low	45.1	Very low	96 Å²	96	165.8 Å²	165.8	79%	0.793	85%	0.846	S	S	*	*				71.1	102.4	75.6	0	0	0	0	0	113.8
3	E	43.6	Very low	44.9	Very low	184 Å²	184	171.4 Å²	171.4	86%	0.86	85%	0.85	S	S	*	*			trans	64.1	102.8	142.4	-61	-160.8	116.2	0	0	123
4	Q	41.7	Very low	44.7	Very low	195 Å²	195	173.9 Å²	173.9	91%	0.911	85%	0.854	S	S	*	*				28.1	119.4	109.9	-145.9	158.9	13	0	0	119.1
5	G	44.6	Very low	44.2	Very low	78 Å²	78	169.5 Å²	169.5	80%	0.804	85%	0.847	S	S	*	*			trans	-137.9	109.1	170.9	0	0	0	0	0	112.1
6	D	46	Very low	44.3	Very low	127 Å²	127	165.4 Å²	165.4	68%	0.679	84%	0.836	S	S	*	*			trans	-59.5	145.9	177.1	-175.4	10	0	0	0	113.7	S8	D6-S8 PolarHBondContact OD1-N 2.91Å
7	N	47.2	Very low	44	Very low	167 Å²	167	162.2 Å²	162.2	89%	0.893	83%	0.827	S	S	*	*			trans	-148.2	65.3	157.5	-91.6	-40.1	0	0	0	110.9	R9	N7-R9 PolarHBondContact O-N 3.49Å
8	S	47.1	Very low	44.1	Very low	84 Å²	84	161.8 Å²	161.8	59%	0.587	83%	0.826	S	S	*	*			trans	12.3	103.7	134.8	-84.9	0	0	0	0	118.4	D6	D6-S8 PolarHBondContact OD1-N 2.91Å
9	R	42.9	Very low	44.1	Very low	235 Å²	235	162 Å²	162	89%	0.887	82%	0.823	S	S	*	*				30.2	106	123	-59.2	179.4	-177.9	-168.9	0.4	117.5	N7	N7-R9 PolarHBondContact O-N 3.49Å
10	R	44.5	Very low	43.6	Very low	237 Å²	237	161.4 Å²	161.4	89%	0.894	82%	0.822	S	S	*	*			trans	-125.7	78	149	-95.8	-172.4	179.1	-161.9	0.3	110.8	R12	R10-R12 PolarHBondContact O-N 2.86Å
11	C	43.6	Very low	43.5	Very low	115 Å²	115	159.5 Å²	159.5	78%	0.777	82%	0.823	S	S	*	*			trans	-71.9	106.8	157.5	-70.7	0	0	0	0	107.9	R13	C11-R13 PolarHBondContact O-N 3.39Å; C11-R13 VanDerWaalsContact O-N 3.14Å
12	R	48.6	Very low	42.8	Very low	227 Å²	227	157 Å²	157	86%	0.857	81%	0.809	S	S	*	*			trans	-67	107.6	170.2	-67.7	-174.2	-173.4	-171.7	2.2	108.1	R10 F14	R10-R12 PolarHBondContact O-N 2.86Å; R12-F14 PolarHBondContact O-N 2.87Å
13	R	43.1	Very low	42.3	Very low	238 Å²	238	155.6 Å²	155.6	90%	0.898	80%	0.804	S	S	*	*			trans	-59.8	120.3	161.9	-91.9	-176.7	-175	170.2	1.9	107.9	C11 S15	C11-R13 PolarHBondContact O-N 3.39Å; C11-R13 VanDerWaalsContact O-N 3.14Å; R13-S15 PolarHBondContact O-N 2.92Å
14	F	41.7	Very low	42.1	Very low	207 Å²	207	155.1 Å²	155.1	91%	0.908	81%	0.805	S	S	*	*			trans	-68.4	108.9	159.7	-86.8	-89.9	0	0	0	108	R12	R12-F14 PolarHBondContact O-N 2.87Å
15	S	37.6	Very low	41.8	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	79%	0.792	S	S	*	*			trans	-107.3	101.9	164	-125.2	0	0	0	0	106.6	R13 V17	R13-S15 PolarHBondContact O-N 2.92Å; S15-V17 PolarHBondContact O-N 3.25Å
16	P	46.4	Very low	41.5	Very low	104 Å²	104	154.5 Å²	154.5	68%	0.675	79%	0.794	S	S	*	*			trans	-82.6	104	164	29.6	-24.2	0	0	0	107.4	L18	P16-L18 PolarHBondContact O-N 3.5Å
17	V	39.3	Very low	41.1	Very low	111 Å²	111	155.4 Å²	155.4	67%	0.673	80%	0.799	S	S	*	*			trans	-56.6	113.6	157.7	165.1	0	0	0	0	106.4	S15 E19	S15-V17 PolarHBondContact O-N 3.25Å; V17-E19 VanDerWaalsContact C-N 3.26Å; V17-E19 HydrophobicContact CG1-CB 4.37Å; V17-E19 HydrophobicContact CG1-CG 3.73Å; V17-E19 PolarHBondContact O-N 3.19Å; V17-E19 VanDerWaalsContact O-N 3.15Å
18	L	45.7	Very low	41	Very low	156 Å²	156	151.3 Å²	151.3	82%	0.817	78%	0.784	S	S	*	*			trans	-79.3	85.3	167.2	-85.2	161.1	0	0	0	106.4	P16	P16-L18 PolarHBondContact O-N 3.5Å
19	E	44.1	Very low	41	Very low	165 Å²	165	151.2 Å²	151.2	77%	0.771	78%	0.783	S	S	*	*			trans	-76.5	143.1	160.4	-91.9	169.4	168.3	0	0	109.2	V17	V17-E19 VanDerWaalsContact C-N 3.26Å; V17-E19 HydrophobicContact CG1-CB 4.37Å; V17-E19 HydrophobicContact CG1-CG 3.73Å; V17-E19 PolarHBondContact O-N 3.19Å; V17-E19 VanDerWaalsContact O-N 3.15Å
20	D	33.2	Very low	41.5	Very low	149 Å²	149	144.4 Å²	144.4	80%	0.797	76%	0.764	S	S	*	*			trans	-52.4	138.9	-172	-59.6	-61.4	0	0	0	114
21	S	41	Very low	42	Very low	122 Å²	122	135.5 Å²	135.5	85%	0.853	74%	0.737	S	S	*	*			trans	-143.4	70.1	153.7	-75	0	0	0	0	108
22	E	34.6	Very low	42.7	Very low	192 Å²	192	134.1 Å²	134.1	90%	0.897	72%	0.721	S	S	*	*			trans	-56.2	134.9	144	-63.7	-145.2	125.3	0	0	108.4
23	G	31.8	Very low	43.5	Very low	68 Å²	68	127.1 Å²	127.1	70%	0.701	70%	0.704	S	S	*	*			trans	118.4	70.1	168.8	0	0	0	0	0	115.4
24	I	39.8	Very low	44.8	Very low	173 Å²	173	120.2 Å²	120.2	89%	0.887	69%	0.686	S	S	*	*			trans	-130.4	82.6	130.6	-57.9	-179	0	0	0	106.5
25	A	35.2	Very low	46.1	Very low	76 Å²	76	114.8 Å²	114.8	63%	0.628	66%	0.663	S	S	*	*			trans	-65.7	152	161.5	0	0	0	0	0	109.5
26	H	38.4	Very low	47.6	Very low	185 Å²	185	112.3 Å²	112.3	86%	0.856	64%	0.64	S	S	*	*	S	Bend	trans	74	128.5	154.9	-81.1	-81.6	0	0	0	119.7
27	D	38	Very low	48.9	Very low	145 Å²	145	113.3 Å²	113.3	78%	0.775	64%	0.636	S	S	*	*			trans	93	68.8	151.6	-142.9	24.4	0	0	0	117.1
28	S	45.2	Very low	50.8	Low	82 Å²	82	114 Å²	114	57%	0.573	63%	0.632	S	S	*	*			trans	-137.7	44.3	165.9	42.5	0	0	0	0	112.7	L30	S28-L30 PolarHBondContact O-N 2.79Å
29	S	46.8	Very low	52.5	Low	82 Å²	82	111.2 Å²	111.2	57%	0.573	61%	0.611	S	S	*	*			trans	-77.1	95.7	156.3	57.6	0	0	0	0	107.8
30	L	54.2	Low	54.2	Low	92 Å²	92	106.2 Å²	106.2	48%	0.482	59%	0.589	S	S	.	*			trans	-45	139.7	150.7	-70.4	171.4	0	0	0	107.2	S28 I32 A89 I92	S28-L30 PolarHBondContact O-N 2.79Å; L30-I32 PolarHBondContact O-N 3.15Å; L30-A89 HydrophobicContact CD2-CB 3.95Å; L30-I92 HydrophobicContact CD2-CD1 4.31Å
31	P	53.6	Low	56.7	Low	50 Å²	50	103.1 Å²	103.1	33%	0.325	57%	0.567	S	S	.	*			trans	-53.6	112.7	174.8	-17	27.3	0	0	0	106.9
32	I	58.8	Low	58.9	Low	85 Å²	85	103.2 Å²	103.2	44%	0.436	55%	0.554	S	S	.	*			trans	-53.5	134.9	172.2	-59.3	175.4	0	0	0	104.6	L30 D34 Q35 M36	L30-I32 PolarHBondContact O-N 3.15Å; I32-D34 HydrophobicContact CG2-CB 4.03Å; I32-D34 CarbonylContact O-C 3.6Å; I32-D34 PolarHBondContact O-N 2.84Å; I32-Q35 HydrophobicContact CB-CG 4.25Å; I32-Q35 WeakPolarHBondContact O-CA 3.39Å; I32-Q35 WeakPolarHBondContact O-CB 3.25Å; I32-Q35 PolarHBondContact O-N 3.23Å; I32-M36 PolarHBondContact O-N 2.66Å
33	P	64.7	Low	61.4	Low	80 Å²	80	95 Å²	95	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-44.9	-38.6	-178.5	16.3	-31.7	0	0	0	111.8	Q35 M36 E37	P33-Q35 PolarHBondContact O-N 3.26Å; P33-M36 WeakPolarHBondContact O-CB 3.3Å; P33-M36 PolarHBondContact O-N 3.22Å; P33-E37 WeakPolarHBondContact O-CG 3.43Å; P33-E37 PolarHBondContact O-N 3.27Å
34	D	70.4	Confident	64.2	Low	94 Å²	94	95.9 Å²	95.9	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-57.6	-41.5	174.6	-50.8	-13.3	0	0	0	114.3	I32 M36 E37 Q38	I32-D34 HydrophobicContact CG2-CB 4.03Å; I32-D34 CarbonylContact O-C 3.6Å; I32-D34 PolarHBondContact O-N 2.84Å; D34-M36 VanDerWaalsContact C-N 3.35Å; D34-E37 PolarHBondContact O-N 3.34Å; D34-Q38 WeakPolarHBondContact O-CB 3.34Å; D34-Q38 WeakPolarHBondContact O-CG 3.19Å; D34-Q38 PolarHBondContact O-N 3.11Å
35	Q	69.4	Low	66.5	Low	93 Å²	93	88.1 Å²	88.1	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-69.6	-35	177.6	-68.3	-179.4	46.9	0	0	111.8	I32 P33 Y39	I32-Q35 HydrophobicContact CB-CG 4.25Å; I32-Q35 WeakPolarHBondContact O-CA 3.39Å; I32-Q35 WeakPolarHBondContact O-CB 3.25Å; I32-Q35 PolarHBondContact O-N 3.23Å; P33-Q35 PolarHBondContact O-N 3.26Å; Q35-Y39 WeakPolarHBondContact O-CB 3.32Å; Q35-Y39 PolarHBondContact O-N 3.46Å
36	M	69.3	Low	69.2	Low	54 Å²	54	87.5 Å²	87.5	27%	0.266	45%	0.453	S	S	.	.	H	α-helix	trans	-69.9	-43.5	176.2	-176.7	-172.3	71.1	0	0	110.8	I32 P33 D34 Y39 L40 G81	I32-M36 PolarHBondContact O-N 2.66Å; P33-M36 WeakPolarHBondContact O-CB 3.3Å; P33-M36 PolarHBondContact O-N 3.22Å; D34-M36 VanDerWaalsContact C-N 3.35Å; M36-Y39 PolarHBondContact O-N 2.97Å; M36-L40 HydrophobicContact CG-CD1 4.38Å; M36-L40 WeakPolarHBondContact O-CB 3.28Å; M36-L40 WeakPolarHBondContact O-CG 3.44Å; M36-L40 PolarHBondContact O-N 2.99Å; M36-G81 WeakPolarHBondContact SD-CA 3.38Å
37	E	72.8	Confident	71.7	Confident	125 Å²	125	79.7 Å²	79.7	58%	0.584	42%	0.418	S	S	*	.	H	α-helix	trans	-61.3	-44.4	174.4	-73.9	-177.9	-173.4	0	0	111.4	P33 D34 Y39 L40 Y41	P33-E37 WeakPolarHBondContact O-CG 3.43Å; P33-E37 PolarHBondContact O-N 3.27Å; D34-E37 PolarHBondContact O-N 3.34Å; E37-Y39 PolarHBondContact O-N 2.98Å; E37-L40 PolarHBondContact O-N 2.89Å; E37-Y41 WeakPolarHBondContact O-CB 3.35Å; E37-Y41 PolarHBondContact O-N 3.34Å
38	Q	80.1	Confident	74.3	Confident	125 Å²	125	73.5 Å²	73.5	58%	0.584	39%	0.387	S	S	*	.	H	α-helix	trans	-58.1	-48.7	173.4	-76.2	169.8	11.9	0	0	111.4	D34 L40 Y41 E42	D34-Q38 WeakPolarHBondContact O-CB 3.34Å; D34-Q38 WeakPolarHBondContact O-CG 3.19Å; D34-Q38 PolarHBondContact O-N 3.11Å; Q38-L40 PolarHBondContact O-N 3.49Å; Q38-Y41 WeakPolarHBondContact O-CB 3.49Å; Q38-Y41 PolarHBondContact O-N 2.9Å; Q38-E42 WeakPolarHBondContact O-CG 3.28Å; Q38-E42 PolarHBondContact O-N 2.84Å
39	Y	80.3	Confident	76.6	Confident	98 Å²	98	71.4 Å²	71.4	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-46.1	177.3	177.3	-87.2	0	0	0	112.2	Q35 M36 E37 Y41 E42 V43 I80	Q35-Y39 WeakPolarHBondContact O-CB 3.32Å; Q35-Y39 PolarHBondContact O-N 3.46Å; M36-Y39 PolarHBondContact O-N 2.97Å; E37-Y39 PolarHBondContact O-N 2.98Å; Y39-Y41 VanDerWaalsContact C-N 3.28Å; Y39-Y41 PolarHBondContact O-N 3.16Å; Y39-E42 PolarHBondContact O-N 3Å; Y39-V43 HydrophobicContact CD1-CG2 3.95Å; Y39-V43 HydrophobicContact CE1-CG2 3.41Å; Y39-V43 VanDerWaalsContact CE1-CG2 3.41Å; Y39-V43 HydrophobicContact CE2-CG2 4.13Å; Y39-V43 WeakPolarHBondContact O-CG2 3.4Å; Y39-V43 PolarHBondContact O-N 3.46Å; Y39-I80 HydrophobicContact CD1-CB 3.97Å; Y39-I80 HydrophobicContact CD1-CG1 4.09Å; Y39-I80 HydrophobicContact CD1-CG2 3.38Å; Y39-I80 HydrophobicContact CE1-CB 3.67Å; Y39-I80 HydrophobicContact CE1-CD1 3.53Å; Y39-I80 HydrophobicContact CE1-CG1 3.37Å; Y39-I80 HydrophobicContact CE1-CG2 3.61Å; Y39-I80 HydrophobicContact CE2-CG1 4.42Å; Y39-I80 HydrophobicContact CG-CG2 3.95Å; Y39-I80 VanDerWaalsContact OH-CD1 3.23Å; Y39-I80 WeakPolarHBondContact OH-CD1 3.44Å
40	L	81.8	Confident	78.8	Confident	61 Å²	61	67.6 Å²	67.6	32%	0.319	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-38.9	178.3	-76.4	173.5	0	0	0	111.5	M36 E37 Q38 V43 F44	M36-L40 HydrophobicContact CG-CD1 4.38Å; M36-L40 WeakPolarHBondContact O-CB 3.28Å; M36-L40 WeakPolarHBondContact O-CG 3.44Å; M36-L40 PolarHBondContact O-N 2.99Å; E37-L40 PolarHBondContact O-N 2.89Å; Q38-L40 PolarHBondContact O-N 3.49Å; L40-V43 PolarHBondContact O-N 3.29Å; L40-F44 VanDerWaalsContact O-CB 3.31Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 3.4Å
41	Y	85.3	Confident	80.7	Confident	83 Å²	83	65.2 Å²	65.2	33%	0.325	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-48.7	173.6	-175.7	-100.8	0	0	0	111.2	E37 Q38 Y39 V43 F44 I45	E37-Y41 WeakPolarHBondContact O-CB 3.35Å; E37-Y41 PolarHBondContact O-N 3.34Å; Q38-Y41 WeakPolarHBondContact O-CB 3.49Å; Q38-Y41 PolarHBondContact O-N 2.9Å; Y39-Y41 VanDerWaalsContact C-N 3.28Å; Y39-Y41 PolarHBondContact O-N 3.16Å; Y41-V43 VanDerWaalsContact C-N 3.35Å; Y41-V43 PolarHBondContact O-N 3.14Å; Y41-F44 WeakPolarHBondContact O-CA 3.33Å; Y41-F44 WeakPolarHBondContact O-CB 3.49Å; Y41-F44 PolarHBondContact O-N 2.7Å; Y41-F44 VanDerWaalsContact O-N 3.09Å; Y41-I45 HydrophobicContact CD1-CG1 4.06Å; Y41-I45 HydrophobicContact CE1-CD1 4.05Å; Y41-I45 HydrophobicContact CE1-CG1 3.74Å; Y41-I45 HydrophobicContact CE2-CD1 4.12Å; Y41-I45 HydrophobicContact CE2-CG1 4.37Å; Y41-I45 VanDerWaalsContact O-CG1 3.3Å; Y41-I45 WeakPolarHBondContact O-CG1 3.32Å; Y41-I45 PolarHBondContact O-N 3Å
42	E	86	Confident	82.6	Confident	124 Å²	124	63.2 Å²	63.2	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-58.9	-43.5	177.2	-69.6	-56.4	144.2	0	0	112.5	Q38 Y39 F44 I45 S46	Q38-E42 WeakPolarHBondContact O-CG 3.28Å; Q38-E42 PolarHBondContact O-N 2.84Å; Y39-E42 PolarHBondContact O-N 3Å; E42-F44 VanDerWaalsContact C-N 3.34Å; E42-F44 PolarHBondContact O-N 2.81Å; E42-I45 PolarHBondContact O-N 3.08Å; E42-S46 WeakPolarHBondContact O-CB 3.26Å; E42-S46 PolarHBondContact O-N 2.94Å
43	V	87.7	Confident	84.1	Confident	20 Å²	20	62.3 Å²	62.3	12%	0.121	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-38.6	176	-176.8	0	0	0	0	110.9	Y39 L40 Y41 S46 V47 F73	Y39-V43 HydrophobicContact CD1-CG2 3.95Å; Y39-V43 HydrophobicContact CE1-CG2 3.41Å; Y39-V43 VanDerWaalsContact CE1-CG2 3.41Å; Y39-V43 HydrophobicContact CE2-CG2 4.13Å; Y39-V43 WeakPolarHBondContact O-CG2 3.4Å; Y39-V43 PolarHBondContact O-N 3.46Å; L40-V43 PolarHBondContact O-N 3.29Å; Y41-V43 VanDerWaalsContact C-N 3.35Å; Y41-V43 PolarHBondContact O-N 3.14Å; V43-S46 WeakPolarHBondContact O-CB 3.46Å; V43-S46 PolarHBondContact O-N 3.43Å; V43-V47 WeakPolarHBondContact O-CG2 3.16Å; V43-V47 PolarHBondContact O-N 3.13Å; V43-F73 HydrophobicContact CB-CD2 4.44Å; V43-F73 HydrophobicContact CG1-CB 3.98Å; V43-F73 HydrophobicContact CG1-CD2 3.9Å; V43-F73 HydrophobicContact CG1-CG 4.45Å
44	F	89.6	Confident	85.5	Confident	87 Å²	87	60.5 Å²	60.5	38%	0.382	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-49.2	174.6	169.1	-96.4	0	0	0	111.9	L40 Y41 E42 S46 V47 A48 F73 F181	L40-F44 VanDerWaalsContact O-CB 3.31Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 3.4Å; Y41-F44 WeakPolarHBondContact O-CA 3.33Å; Y41-F44 WeakPolarHBondContact O-CB 3.49Å; Y41-F44 PolarHBondContact O-N 2.7Å; Y41-F44 VanDerWaalsContact O-N 3.09Å; E42-F44 VanDerWaalsContact C-N 3.34Å; E42-F44 PolarHBondContact O-N 2.81Å; F44-S46 VanDerWaalsContact C-N 3.28Å; F44-S46 PolarHBondContact O-N 3.17Å; F44-V47 PolarHBondContact O-N 3.06Å; F44-V47 VanDerWaalsContact O-N 3.16Å; F44-A48 PolarHBondContact O-N 2.85Å; F44-F73 HydrophobicContact CB-CE2 4Å; F44-F73 HydrophobicContact CD2-CE2 4.44Å; F44-F181 HydrophobicContact CE1-CD1 4.18Å; F44-F181 HydrophobicContact CE1-CD2 4.49Å; F44-F181 AromaticContact CE1-CE1 3.93Å; F44-F181 HydrophobicContact CE1-CE1 3.93Å; F44-F181 HydrophobicContact CE1-CE2 4.22Å; F44-F181 HydrophobicContact CE1-CG 4.45Å; F44-F181 AromaticContact CE1-CZ 3.94Å; F44-F181 HydrophobicContact CE1-CZ 3.94Å; F44-F181 HydrophobicContact CZ-CE1 4.08Å; F44-F181 HydrophobicContact CZ-CZ 4.14Å
45	I	89.8	Confident	86.4	Confident	9 Å²	9	61.8 Å²	61.8	5%	0.046	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-41.8	177.6	-61.9	-65.1	0	0	0	110.5	Y41 E42 V47 A48 N49 F181	Y41-I45 HydrophobicContact CD1-CG1 4.06Å; Y41-I45 HydrophobicContact CE1-CD1 4.05Å; Y41-I45 HydrophobicContact CE1-CG1 3.74Å; Y41-I45 HydrophobicContact CE2-CD1 4.12Å; Y41-I45 HydrophobicContact CE2-CG1 4.37Å; Y41-I45 VanDerWaalsContact O-CG1 3.3Å; Y41-I45 WeakPolarHBondContact O-CG1 3.32Å; Y41-I45 PolarHBondContact O-N 3Å; E42-I45 PolarHBondContact O-N 3.08Å; I45-V47 PolarHBondContact O-N 3.4Å; I45-A48 PolarHBondContact O-N 2.99Å; I45-N49 WeakPolarHBondContact O-CB 3.37Å; I45-N49 PolarHBondContact O-N 3.26Å; I45-N49 PolarHBondContact O-ND2 3.44Å; I45-F181 HydrophobicContact CD1-CB 3.79Å; I45-F181 HydrophobicContact CD1-CD2 3.18Å; I45-F181 HydrophobicContact CD1-CE2 3.91Å; I45-F181 HydrophobicContact CD1-CG 3.71Å
46	S	90.5	Very high	87.4	Confident	64 Å²	64	61.2 Å²	61.2	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-44.1	175.9	-173.1	0	0	0	0	112.8	E42 V43 F44 A50	E42-S46 WeakPolarHBondContact O-CB 3.26Å; E42-S46 PolarHBondContact O-N 2.94Å; V43-S46 WeakPolarHBondContact O-CB 3.46Å; V43-S46 PolarHBondContact O-N 3.43Å; F44-S46 VanDerWaalsContact C-N 3.28Å; F44-S46 PolarHBondContact O-N 3.17Å; S46-A50 WeakPolarHBondContact O-CB 3.44Å; S46-A50 PolarHBondContact O-N 3.24Å; S46-A50 VanDerWaalsContact O-N 3.13Å
47	V	92.6	Very high	88.4	Confident	20 Å²	20	62.7 Å²	62.7	12%	0.121	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-48.9	175.4	176.6	0	0	0	0	110.9	V43 F44 I45 N49 A50 V51 A69 F73	V43-V47 WeakPolarHBondContact O-CG2 3.16Å; V43-V47 PolarHBondContact O-N 3.13Å; F44-V47 PolarHBondContact O-N 3.06Å; F44-V47 VanDerWaalsContact O-N 3.16Å; I45-V47 PolarHBondContact O-N 3.4Å; V47-N49 VanDerWaalsContact C-N 3.33Å; V47-N49 PolarHBondContact O-N 3.32Å; V47-A50 PolarHBondContact O-N 3.5Å; V47-A50 VanDerWaalsContact O-N 3.14Å; V47-V51 HydrophobicContact CG1-CG2 4.12Å; V47-V51 WeakPolarHBondContact O-CG2 3.41Å; V47-V51 PolarHBondContact O-N 2.85Å; V47-A69 HydrophobicContact CB-CB 4.47Å; V47-A69 HydrophobicContact CG2-CB 4.01Å; V47-A69 WeakPolarHBondContact CG2-O 3.37Å; V47-F73 HydrophobicContact CG2-CB 3.56Å; V47-F73 HydrophobicContact CG2-CD2 4.29Å; V47-F73 HydrophobicContact CG2-CG 4.07Å
48	A	92.6	Very high	89.3	Confident	15 Å²	15	62 Å²	62	12%	0.124	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-49.1	-178.5	0	0	0	0	0	110.7	F44 I45 A50 V51 T52 L177 F181	F44-A48 PolarHBondContact O-N 2.85Å; I45-A48 PolarHBondContact O-N 2.99Å; A48-A50 VanDerWaalsContact C-N 3.33Å; A48-A50 PolarHBondContact O-N 3.28Å; A48-V51 PolarHBondContact O-N 3.31Å; A48-T52 WeakPolarHBondContact O-CB 3.39Å; A48-T52 PolarHBondContact O-N 3.28Å; A48-T52 PolarHBondContact O-OG1 3.46Å; A48-L177 HydrophobicContact CB-CD1 4.07Å; A48-F181 HydrophobicContact CB-CE2 3.43Å; A48-F181 VanDerWaalsContact CB-CE2 3.43Å; A48-F181 HydrophobicContact CB-CZ 3.56Å
49	N	92.9	Very high	90	Very high	38 Å²	38	58 Å²	58	20%	0.203	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-43.1	176.2	-77.6	-30.2	0	0	0	112.9	I45 V47 T52 E53 D176 L177	I45-N49 WeakPolarHBondContact O-CB 3.37Å; I45-N49 PolarHBondContact O-N 3.26Å; I45-N49 PolarHBondContact O-ND2 3.44Å; V47-N49 VanDerWaalsContact C-N 3.33Å; V47-N49 PolarHBondContact O-N 3.32Å; N49-T52 PolarHBondContact O-N 2.92Å; N49-E53 WeakPolarHBondContact O-CB 3.46Å; N49-E53 PolarHBondContact O-N 2.74Å; N49-D176 PolarHBondContact ND2-OD1 3.47Å; N49-D176 PolarHBondContact OD1-OD1 2.77Å; N49-L177 WeakPolarHBondContact OD1-CB 3.32Å; N49-L177 WeakPolarHBondContact OD1-CG 3.37Å; N49-L177 PolarHBondContact OD1-N 3.37Å
50	A	93.1	Very high	90.7	Very high	2 Å²	2	62.3 Å²	62.3	2%	0.017	32%	0.32	C	S	.	.	H	α-helix	trans	-67	-37.6	178.9	0	0	0	0	0	112.7	S46 V47 A48 L54 K65 A69	S46-A50 WeakPolarHBondContact O-CB 3.44Å; S46-A50 PolarHBondContact O-N 3.24Å; S46-A50 VanDerWaalsContact O-N 3.13Å; V47-A50 PolarHBondContact O-N 3.5Å; V47-A50 VanDerWaalsContact O-N 3.14Å; A48-A50 VanDerWaalsContact C-N 3.33Å; A48-A50 PolarHBondContact O-N 3.28Å; A50-L54 PolarHBondContact O-N 2.9Å; A50-L54 VanDerWaalsContact O-N 3.13Å; A50-K65 HydrophobicContact CB-CG 4.17Å; A50-A69 HydrophobicContact CB-CB 4.02Å
51	V	93.5	Very high	91.4	Very high	42 Å²	42	66 Å²	66	26%	0.255	34%	0.34	S	S	.	.	H	α-helix	trans	-68.1	-43.2	174.7	172.3	0	0	0	0	110.5	V47 A48 E53 L54 F55 S66	V47-V51 HydrophobicContact CG1-CG2 4.12Å; V47-V51 WeakPolarHBondContact O-CG2 3.41Å; V47-V51 PolarHBondContact O-N 2.85Å; A48-V51 PolarHBondContact O-N 3.31Å; V51-E53 VanDerWaalsContact C-N 3.34Å; V51-E53 PolarHBondContact O-N 2.97Å; V51-L54 WeakPolarHBondContact O-CB 3.47Å; V51-L54 PolarHBondContact O-N 3.35Å; V51-L54 VanDerWaalsContact O-N 3.16Å; V51-F55 HydrophobicContact CG1-CD2 3.89Å; V51-F55 HydrophobicContact CG1-CE2 3.6Å; V51-F55 WeakPolarHBondContact O-CD2 3.38Å; V51-F55 PolarHBondContact O-N 3.22Å; V51-F55 VanDerWaalsContact O-N 3.14Å; V51-S66 WeakPolarHBondContact CG2-OG 3.44Å
52	T	92.5	Very high	91.8	Very high	8 Å²	8	62.3 Å²	62.3	5%	0.049	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-38.8	178.8	-57.1	0	0	0	0	111.6	A48 N49 L54 F55 R56 L171 L177	A48-T52 WeakPolarHBondContact O-CB 3.39Å; A48-T52 PolarHBondContact O-N 3.28Å; A48-T52 PolarHBondContact O-OG1 3.46Å; N49-T52 PolarHBondContact O-N 2.92Å; T52-L54 VanDerWaalsContact C-N 3.35Å; T52-F55 PolarHBondContact O-N 2.77Å; T52-R56 WeakPolarHBondContact O-CG 3.37Å; T52-R56 PolarHBondContact O-N 3.32Å; T52-L171 HydrophobicContact CG2-CD2 3.9Å; T52-L177 HydrophobicContact CG2-CD1 4.11Å; T52-L177 HydrophobicContact CG2-CD2 4.46Å; T52-L177 HydrophobicContact CG2-CG 4.45Å; T52-L177 WeakPolarHBondContact OG1-CD1 3.35Å
53	E	91.4	Very high	92.3	Very high	67 Å²	67	61.5 Å²	61.5	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-59.9	-43.7	170.8	-174.5	179.8	172.6	0	0	111.8	N49 V51 F55 R56 T57 K65	N49-E53 WeakPolarHBondContact O-CB 3.46Å; N49-E53 PolarHBondContact O-N 2.74Å; V51-E53 VanDerWaalsContact C-N 3.34Å; V51-E53 PolarHBondContact O-N 2.97Å; E53-F55 PolarHBondContact O-N 2.99Å; E53-R56 PolarHBondContact O-N 3.38Å; E53-R56 VanDerWaalsContact O-N 3.09Å; E53-T57 PolarHBondContact O-N 3.46Å; E53-T57 PolarHBondContact O-OG1 3Å; E53-K65 IonicContact OE1-NZ 3.99Å; E53-K65 WeakPolarHBondContact OE2-CD 3.2Å; E53-K65 WeakPolarHBondContact OE2-CE 3.37Å; E53-K65 IonicContact OE2-NZ 2.74Å; E53-K65 PolarHBondContact OE2-NZ 3.15Å
54	L	93	Very high	92.7	Very high	42 Å²	42	63.3 Å²	63.3	22%	0.22	34%	0.335	C	S	.	.	H	α-helix	trans	-56.8	-37.7	175.3	173.7	62.2	0	0	0	112.7	A50 V51 T52 P58 F63	A50-L54 PolarHBondContact O-N 2.9Å; A50-L54 VanDerWaalsContact O-N 3.13Å; V51-L54 WeakPolarHBondContact O-CB 3.47Å; V51-L54 PolarHBondContact O-N 3.35Å; V51-L54 VanDerWaalsContact O-N 3.16Å; T52-L54 VanDerWaalsContact C-N 3.35Å; L54-P58 WeakPolarHBondContact O-CA 3.38Å; L54-F63 HydrophobicContact CD1-CB 3.96Å; L54-F63 HydrophobicContact CD2-CD2 4.35Å
55	F	91.2	Very high	92.9	Very high	120 Å²	120	64.5 Å²	64.5	53%	0.526	34%	0.34	S	S	.	.	H	α-helix	trans	-76.3	-27.3	176.7	-77.1	-72	0	0	0	114	V51 T52 E53 F167 L171	V51-F55 HydrophobicContact CG1-CD2 3.89Å; V51-F55 HydrophobicContact CG1-CE2 3.6Å; V51-F55 WeakPolarHBondContact O-CD2 3.38Å; V51-F55 PolarHBondContact O-N 3.22Å; V51-F55 VanDerWaalsContact O-N 3.14Å; T52-F55 PolarHBondContact O-N 2.77Å; E53-F55 PolarHBondContact O-N 2.99Å; F55-F167 HydrophobicContact CD1-CZ 4.27Å; F55-F167 HydrophobicContact CD2-CE2 4.2Å; F55-F167 AromaticContact CD2-CZ 3.81Å; F55-F167 HydrophobicContact CD2-CZ 3.81Å; F55-F167 HydrophobicContact CE1-CZ 4.26Å; F55-F167 HydrophobicContact CE2-CE2 4.13Å; F55-F167 AromaticContact CE2-CZ 3.82Å; F55-F167 HydrophobicContact CE2-CZ 3.82Å; F55-F167 HydrophobicContact CG-CZ 4.06Å; F55-F167 HydrophobicContact CZ-CZ 4.05Å; F55-L171 HydrophobicContact CB-CD2 3.48Å; F55-L171 VanDerWaalsContact CB-CD2 3.48Å; F55-L171 HydrophobicContact CG-CD2 4.23Å
56	R	89.9	Confident	93.2	Very high	82 Å²	82	64.7 Å²	64.7	31%	0.309	34%	0.342	S	S	.	.	H	α-helix	trans	-79.7	-46.8	177	-71.8	-178.7	-177.3	117.6	13.1	112.6	T52 E53 A170 L171 V173	T52-R56 WeakPolarHBondContact O-CG 3.37Å; T52-R56 PolarHBondContact O-N 3.32Å; E53-R56 PolarHBondContact O-N 3.38Å; E53-R56 VanDerWaalsContact O-N 3.09Å; R56-A170 PolarHBondContact NH2-O 3.07Å; R56-L171 VanDerWaalsContact CZ-O 3.3Å; R56-L171 PolarHBondContact NE-O 2.88Å; R56-L171 PolarHBondContact NH2-O 3.47Å; R56-V173 PolarHBondContact NH1-O 3.29Å; R56-V173 PolarHBondContact NH2-O 3.47Å
57	T	90.1	Very high	93.4	Very high	85 Å²	85	63.6 Å²	63.6	52%	0.521	34%	0.337	S	S	.	.	S	Bend	trans	-128.4	80.4	-175.9	47.4	0	0	0	0	108.8	E53 G59 S62	E53-T57 PolarHBondContact O-N 3.46Å; E53-T57 PolarHBondContact O-OG1 3Å; T57-G59 PolarHBondContact O-N 3.47Å; T57-S62 PolarHBondContact O-OG 2.93Å
58	P	91.2	Very high	93.4	Very high	111 Å²	111	64.8 Å²	64.8	72%	0.721	35%	0.349	S	S	*	.			trans	-62.3	126.2	179.7	25.6	-33.7	0	0	0	110	L54	L54-P58 WeakPolarHBondContact O-CA 3.38Å
59	G	94.2	Very high	93.3	Very high	39 Å²	39	64.5 Å²	64.5	40%	0.402	35%	0.346	S	S	.	.	S	Bend	trans	-175.8	166.5	-179.4	0	0	0	0	0	111.9	T57 N61 S62 F63	T57-G59 PolarHBondContact O-N 3.47Å; G59-N61 VanDerWaalsContact C-N 3.3Å; G59-N61 PolarHBondContact O-N 3.38Å; G59-S62 PolarHBondContact N-OG 3.11Å; G59-S62 PolarHBondContact O-N 3.47Å; G59-S62 PolarHBondContact O-OG 3Å; G59-F63 WeakPolarHBondContact O-CB 3.4Å; G59-F63 PolarHBondContact O-N 2.87Å
60	W	96.5	Very high	93.2	Very high	190 Å²	190	65.7 Å²	65.7	72%	0.72	36%	0.355	S	S	*	.	H	α-helix	trans	-60.7	-39.6	-179.4	179	-111.5	0	0	0	112.7	F63 S64	W60-F63 AromaticContact CE3-CD1 3.91Å; W60-F63 HydrophobicContact CE3-CD1 3.91Å; W60-F63 HydrophobicContact CH2-CD1 4.38Å; W60-F63 HydrophobicContact CH2-CE1 4.41Å; W60-F63 AromaticContact CZ3-CD1 3.66Å; W60-F63 HydrophobicContact CZ3-CD1 3.66Å; W60-F63 AromaticContact CZ3-CE1 3.86Å; W60-F63 HydrophobicContact CZ3-CE1 3.86Å; W60-F63 PolarHBondContact O-N 3.29Å; W60-S64 WeakPolarHBondContact O-CB 3.41Å; W60-S64 PolarHBondContact O-N 2.85Å
61	N	95.4	Very high	93.1	Very high	138 Å²	138	68.9 Å²	68.9	74%	0.738	38%	0.375	S	S	*	.	H	α-helix	trans	-65.2	-45.7	-179.8	-68.5	-19.7	0	0	0	112.2	G59 S64 K65	G59-N61 VanDerWaalsContact C-N 3.3Å; G59-N61 PolarHBondContact O-N 3.38Å; N61-S64 PolarHBondContact O-N 3.04Å; N61-K65 VanDerWaalsContact O-CB 3.3Å; N61-K65 WeakPolarHBondContact O-CB 3.33Å; N61-K65 PolarHBondContact O-N 3.32Å
62	S	94.3	Very high	92.6	Very high	5 Å²	5	75.5 Å²	75.5	4%	0.035	40%	0.395	C	S	.	.	H	α-helix	trans	-68.4	-36.4	177.8	54.4	0	0	0	0	111.5	T57 G59 K65 S66	T57-S62 PolarHBondContact O-OG 2.93Å; G59-S62 PolarHBondContact N-OG 3.11Å; G59-S62 PolarHBondContact O-N 3.47Å; G59-S62 PolarHBondContact O-OG 3Å; S62-K65 PolarHBondContact O-N 3.33Å; S62-S66 VanDerWaalsContact O-CB 3.32Å; S62-S66 WeakPolarHBondContact O-CB 3.38Å; S62-S66 PolarHBondContact O-N 3.45Å
63	F	96	Very high	92.3	Very high	107 Å²	107	79.3 Å²	79.3	47%	0.469	41%	0.411	S	S	.	.	H	α-helix	trans	-62.5	-50.5	173	176	-99.8	0	0	0	111.9	L54 G59 W60 K65 S66 A67	L54-F63 HydrophobicContact CD1-CB 3.96Å; L54-F63 HydrophobicContact CD2-CD2 4.35Å; G59-F63 WeakPolarHBondContact O-CB 3.4Å; G59-F63 PolarHBondContact O-N 2.87Å; W60-F63 AromaticContact CE3-CD1 3.91Å; W60-F63 HydrophobicContact CE3-CD1 3.91Å; W60-F63 HydrophobicContact CH2-CD1 4.38Å; W60-F63 HydrophobicContact CH2-CE1 4.41Å; W60-F63 AromaticContact CZ3-CD1 3.66Å; W60-F63 HydrophobicContact CZ3-CD1 3.66Å; W60-F63 AromaticContact CZ3-CE1 3.86Å; W60-F63 HydrophobicContact CZ3-CE1 3.86Å; W60-F63 PolarHBondContact O-N 3.29Å; F63-K65 VanDerWaalsContact C-N 3.31Å; F63-K65 PolarHBondContact O-N 3.39Å; F63-S66 PolarHBondContact O-N 3.29Å; F63-A67 WeakPolarHBondContact O-CB 3.44Å; F63-A67 PolarHBondContact O-N 2.87Å
64	S	96.4	Very high	91.7	Very high	59 Å²	59	83.6 Å²	83.6	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-61.7	-39.6	178.4	-176.3	0	0	0	0	111.9	W60 N61 A68	W60-S64 WeakPolarHBondContact O-CB 3.41Å; W60-S64 PolarHBondContact O-N 2.85Å; N61-S64 PolarHBondContact O-N 3.04Å; S64-A68 VanDerWaalsContact O-CB 3.27Å; S64-A68 WeakPolarHBondContact O-CB 3.45Å; S64-A68 PolarHBondContact O-N 3.28Å
65	K	94.7	Very high	91	Very high	111 Å²	111	87.7 Å²	87.7	48%	0.483	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-47.2	176.9	-174.7	-178	178.4	-175.2	0	111.3	A50 E53 N61 S62 F63 A68 A69	A50-K65 HydrophobicContact CB-CG 4.17Å; E53-K65 IonicContact OE1-NZ 3.99Å; E53-K65 WeakPolarHBondContact OE2-CD 3.2Å; E53-K65 WeakPolarHBondContact OE2-CE 3.37Å; E53-K65 IonicContact OE2-NZ 2.74Å; E53-K65 PolarHBondContact OE2-NZ 3.15Å; N61-K65 VanDerWaalsContact O-CB 3.3Å; N61-K65 WeakPolarHBondContact O-CB 3.33Å; N61-K65 PolarHBondContact O-N 3.32Å; S62-K65 PolarHBondContact O-N 3.33Å; F63-K65 VanDerWaalsContact C-N 3.31Å; F63-K65 PolarHBondContact O-N 3.39Å; K65-A68 PolarHBondContact O-N 2.8Å; K65-A69 WeakPolarHBondContact O-CB 3.38Å; K65-A69 PolarHBondContact O-N 3.45Å
66	S	94.5	Very high	89.8	Confident	13 Å²	13	82.1 Å²	82.1	9%	0.091	42%	0.418	C	S	.	.	H	α-helix	trans	-58.3	-51.6	175.2	179.3	0	0	0	0	111.5	V51 S62 F63 A68 A69 T70	V51-S66 WeakPolarHBondContact CG2-OG 3.44Å; S62-S66 VanDerWaalsContact O-CB 3.32Å; S62-S66 WeakPolarHBondContact O-CB 3.38Å; S62-S66 PolarHBondContact O-N 3.45Å; F63-S66 PolarHBondContact O-N 3.29Å; S66-A68 VanDerWaalsContact C-N 3.33Å; S66-A68 PolarHBondContact O-N 3.49Å; S66-A69 PolarHBondContact O-N 3.2Å; S66-A69 VanDerWaalsContact O-N 3.16Å; S66-T70 PolarHBondContact O-N 3.08Å; S66-T70 PolarHBondContact O-OG1 3.46Å
67	A	95.5	Very high	88.5	Confident	41 Å²	41	80 Å²	80	34%	0.339	42%	0.421	S	S	.	.	H	α-helix	trans	-60.1	-40.5	178.5	0	0	0	0	0	112.9	F63 T71	F63-A67 WeakPolarHBondContact O-CB 3.44Å; F63-A67 PolarHBondContact O-N 2.87Å; A67-T71 WeakPolarHBondContact O-CB 3.23Å; A67-T71 PolarHBondContact O-N 3.34Å; A67-T71 PolarHBondContact O-OG1 3.37Å
68	A	92.3	Very high	86.8	Confident	45 Å²	45	82.5 Å²	82.5	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-42.9	176	0	0	0	0	0	111.9	S64 K65 S66 T71 R72	S64-A68 VanDerWaalsContact O-CB 3.27Å; S64-A68 WeakPolarHBondContact O-CB 3.45Å; S64-A68 PolarHBondContact O-N 3.28Å; K65-A68 PolarHBondContact O-N 2.8Å; S66-A68 VanDerWaalsContact C-N 3.33Å; S66-A68 PolarHBondContact O-N 3.49Å; A68-T71 PolarHBondContact O-N 3.41Å; A68-R72 WeakPolarHBondContact O-CG 3.2Å; A68-R72 PolarHBondContact O-N 2.81Å
69	A	91	Very high	85.1	Confident	9 Å²	9	81 Å²	81	7%	0.074	41%	0.408	C	S	.	.	H	α-helix	trans	-63.1	-47.2	175.9	0	0	0	0	0	111.2	V47 A50 K65 S66 T71 R72 F73	V47-A69 HydrophobicContact CB-CB 4.47Å; V47-A69 HydrophobicContact CG2-CB 4.01Å; V47-A69 WeakPolarHBondContact CG2-O 3.37Å; A50-A69 HydrophobicContact CB-CB 4.02Å; K65-A69 WeakPolarHBondContact O-CB 3.38Å; K65-A69 PolarHBondContact O-N 3.45Å; S66-A69 PolarHBondContact O-N 3.2Å; S66-A69 VanDerWaalsContact O-N 3.16Å; A69-T71 VanDerWaalsContact C-N 3.31Å; A69-T71 PolarHBondContact O-N 2.93Å; A69-R72 CarbonylContact O-C 3.56Å; A69-R72 WeakPolarHBondContact O-CB 3.43Å; A69-R72 PolarHBondContact O-N 3.33Å; A69-R72 VanDerWaalsContact O-N 3.11Å; A69-F73 PolarHBondContact O-N 2.87Å
70	T	91.4	Very high	83.2	Confident	64 Å²	64	81.5 Å²	81.5	39%	0.393	40%	0.401	S	S	.	.	H	α-helix	trans	-61.4	-40.1	176.8	-52.5	0	0	0	0	111.8	S66 R72 F73 Y74	S66-T70 PolarHBondContact O-N 3.08Å; S66-T70 PolarHBondContact O-OG1 3.46Å; T70-R72 VanDerWaalsContact C-N 3.33Å; T70-R72 PolarHBondContact O-N 2.91Å; T70-F73 WeakPolarHBondContact O-CB 3.47Å; T70-F73 PolarHBondContact O-N 3.43Å; T70-Y74 PolarHBondContact O-N 2.81Å
71	T	89.3	Confident	81.2	Confident	69 Å²	69	73.1 Å²	73.1	42%	0.423	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-41.7	174.7	-60.1	0	0	0	0	111.1	A67 A68 A69 Y74 K75	A67-T71 WeakPolarHBondContact O-CB 3.23Å; A67-T71 PolarHBondContact O-N 3.34Å; A67-T71 PolarHBondContact O-OG1 3.37Å; A68-T71 PolarHBondContact O-N 3.41Å; A69-T71 VanDerWaalsContact C-N 3.31Å; A69-T71 PolarHBondContact O-N 2.93Å; T71-Y74 PolarHBondContact O-N 3.34Å; T71-K75 HydrophobicContact CG2-CD 3.94Å; T71-K75 HydrophobicContact CG2-CG 4.26Å; T71-K75 VanDerWaalsContact O-CB 3.29Å; T71-K75 WeakPolarHBondContact O-CB 3.49Å; T71-K75 WeakPolarHBondContact O-CG 2.89Å; T71-K75 PolarHBondContact O-N 2.94Å
72	R	84.7	Confident	79.3	Confident	181 Å²	181	69.1 Å²	69.1	68%	0.683	36%	0.357	S	S	*	.	H	α-helix	trans	-65.5	-36.7	174.4	-74.5	175.6	-176.1	-179.9	1.2	112.1	A68 A69 T70 G76	A68-R72 WeakPolarHBondContact O-CG 3.2Å; A68-R72 PolarHBondContact O-N 2.81Å; A69-R72 CarbonylContact O-C 3.56Å; A69-R72 WeakPolarHBondContact O-CB 3.43Å; A69-R72 PolarHBondContact O-N 3.33Å; A69-R72 VanDerWaalsContact O-N 3.11Å; T70-R72 VanDerWaalsContact C-N 3.33Å; T70-R72 PolarHBondContact O-N 2.91Å; R72-G76 WeakPolarHBondContact O-CA 3.21Å; R72-G76 PolarHBondContact O-N 3.42Å
73	F	84.5	Confident	77.6	Confident	88 Å²	88	72.5 Å²	72.5	39%	0.386	38%	0.379	S	S	.	.	H	α-helix	trans	-64.9	-44.6	174.5	-177.7	-99.7	0	0	0	111.5	V43 F44 V47 A69 T70 G76 G77	V43-F73 HydrophobicContact CB-CD2 4.44Å; V43-F73 HydrophobicContact CG1-CB 3.98Å; V43-F73 HydrophobicContact CG1-CD2 3.9Å; V43-F73 HydrophobicContact CG1-CG 4.45Å; F44-F73 HydrophobicContact CB-CE2 4Å; F44-F73 HydrophobicContact CD2-CE2 4.44Å; V47-F73 HydrophobicContact CG2-CB 3.56Å; V47-F73 HydrophobicContact CG2-CD2 4.29Å; V47-F73 HydrophobicContact CG2-CG 4.07Å; A69-F73 PolarHBondContact O-N 2.87Å; T70-F73 WeakPolarHBondContact O-CB 3.47Å; T70-F73 PolarHBondContact O-N 3.43Å; F73-G76 PolarHBondContact O-N 2.78Å; F73-G77 PolarHBondContact O-N 3.37Å
74	Y	79.9	Confident	76.2	Confident	157 Å²	157	70.5 Å²	70.5	62%	0.616	37%	0.371	S	S	*	.	H	α-helix	trans	-65.2	-50.3	176.2	-174	-95.9	0	0	0	112.4	T70 T71 G76 G77 Y78	T70-Y74 PolarHBondContact O-N 2.81Å; T71-Y74 PolarHBondContact O-N 3.34Å; Y74-G76 VanDerWaalsContact C-N 3.28Å; Y74-G76 PolarHBondContact O-N 2.9Å; Y74-G77 PolarHBondContact O-N 2.8Å; Y74-Y78 HydrophobicContact CE1-CD2 4.36Å; Y74-Y78 HydrophobicContact CE1-CE2 4.22Å; Y74-Y78 HydrophobicContact CE2-CE2 4.41Å; Y74-Y78 AromaticContact CZ-CE2 3.95Å
75	K	77.2	Confident	74.7	Confident	127 Å²	127	68.5 Å²	68.5	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-66.6	-33.5	176.7	-72.5	-175.6	177.7	-176.7	0	112	T71 Y78 N79	T71-K75 HydrophobicContact CG2-CD 3.94Å; T71-K75 HydrophobicContact CG2-CG 4.26Å; T71-K75 VanDerWaalsContact O-CB 3.29Å; T71-K75 WeakPolarHBondContact O-CB 3.49Å; T71-K75 WeakPolarHBondContact O-CG 2.89Å; T71-K75 PolarHBondContact O-N 2.94Å; K75-Y78 PolarHBondContact O-N 3.44Å; K75-N79 WeakPolarHBondContact O-CB 3.26Å; K75-N79 PolarHBondContact O-N 2.95Å; K75-N79 PolarHBondContact O-ND2 3.41Å
76	G	66.8	Low	73.5	Confident	4 Å²	4	71.1 Å²	71.1	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-71	-36.2	-177.7	0	0	0	0	0	111.7	R72 F73 Y74 Y78 N79 I80	R72-G76 WeakPolarHBondContact O-CA 3.21Å; R72-G76 PolarHBondContact O-N 3.42Å; F73-G76 PolarHBondContact O-N 2.78Å; Y74-G76 VanDerWaalsContact C-N 3.28Å; Y74-G76 PolarHBondContact O-N 2.9Å; G76-Y78 VanDerWaalsContact C-N 3.27Å; G76-Y78 PolarHBondContact O-N 3.37Å; G76-N79 PolarHBondContact O-N 2.83Å; G76-I80 VanDerWaalsContact O-CB 3.3Å; G76-I80 WeakPolarHBondContact O-CB 3.19Å; G76-I80 WeakPolarHBondContact O-CD1 3.43Å; G76-I80 PolarHBondContact O-N 3.2Å
77	G	62	Low	72.7	Confident	36 Å²	36	77 Å²	77	37%	0.371	39%	0.386	S	S	.	.	I	π-helix	trans	-59.3	-37.6	168.9	0	0	0	0	0	112.9	F73 Y74	F73-G77 PolarHBondContact O-N 3.37Å; Y74-G77 PolarHBondContact O-N 2.8Å
78	Y	55	Low	71.9	Confident	138 Å²	138	79.8 Å²	79.8	54%	0.541	39%	0.388	S	S	.	.	I	π-helix	trans	-77.8	-40.4	177.1	-87.4	-85.5	0	0	0	113.9	Y74 K75 G76	Y74-Y78 HydrophobicContact CE1-CD2 4.36Å; Y74-Y78 HydrophobicContact CE1-CE2 4.22Å; Y74-Y78 HydrophobicContact CE2-CE2 4.41Å; Y74-Y78 AromaticContact CZ-CE2 3.95Å; K75-Y78 PolarHBondContact O-N 3.44Å; G76-Y78 VanDerWaalsContact C-N 3.27Å; G76-Y78 PolarHBondContact O-N 3.37Å
79	N	54.7	Low	71.2	Confident	79 Å²	79	79.4 Å²	79.4	42%	0.422	39%	0.385	S	S	.	.	I	π-helix	trans	-91.1	-29.3	-174.2	-79.5	-54.9	0	0	0	114.7	K75 G76 E84	K75-N79 WeakPolarHBondContact O-CB 3.26Å; K75-N79 PolarHBondContact O-N 2.95Å; K75-N79 PolarHBondContact O-ND2 3.41Å; G76-N79 PolarHBondContact O-N 2.83Å; N79-E84 WeakPolarHBondContact O-CB 3.32Å; N79-E84 WeakPolarHBondContact O-CG 3.23Å; N79-E84 PolarHBondContact OD1-OE1 2.85Å
80	I	55.8	Low	70.8	Confident	50 Å²	50	85.6 Å²	85.6	26%	0.256	41%	0.41	S	S	.	.	I	π-helix	trans	-91.1	-34.4	-170.7	-73.4	93.5	0	0	0	113.8	Y39 G76	Y39-I80 HydrophobicContact CD1-CB 3.97Å; Y39-I80 HydrophobicContact CD1-CG1 4.09Å; Y39-I80 HydrophobicContact CD1-CG2 3.38Å; Y39-I80 HydrophobicContact CE1-CB 3.67Å; Y39-I80 HydrophobicContact CE1-CD1 3.53Å; Y39-I80 HydrophobicContact CE1-CG1 3.37Å; Y39-I80 HydrophobicContact CE1-CG2 3.61Å; Y39-I80 HydrophobicContact CE2-CG1 4.42Å; Y39-I80 HydrophobicContact CG-CG2 3.95Å; Y39-I80 VanDerWaalsContact OH-CD1 3.23Å; Y39-I80 WeakPolarHBondContact OH-CD1 3.44Å; G76-I80 VanDerWaalsContact O-CB 3.3Å; G76-I80 WeakPolarHBondContact O-CB 3.19Å; G76-I80 WeakPolarHBondContact O-CD1 3.43Å; G76-I80 PolarHBondContact O-N 3.2Å
81	G	53.7	Low	70.7	Confident	14 Å²	14	85.4 Å²	85.4	14%	0.144	41%	0.407	C	S	.	.	I	π-helix	trans	-117.7	-39.9	-163.9	0	0	0	0	0	116.6	M36 A85	M36-G81 WeakPolarHBondContact SD-CA 3.38Å; G81-A85 VanDerWaalsContact O-CB 3.23Å; G81-A85 WeakPolarHBondContact O-CB 3.23Å
82	S	55.6	Low	70.5	Confident	55 Å²	55	85 Å²	85	39%	0.385	40%	0.401	S	S	.	.	I	π-helix	trans	-106.5	-74.8	-168.3	-173.6	0	0	0	0	110.4	E84 A85 Y86	S82-E84 PolarHBondContact O-N 3.34Å; S82-A85 PolarHBondContact O-N 3.41Å; S82-Y86 VanDerWaalsContact C-CD2 3.41Å; S82-Y86 WeakPolarHBondContact O-CB 3.35Å; S82-Y86 WeakPolarHBondContact O-CD2 3.5Å; S82-Y86 VanDerWaalsContact O-CG 3.31Å; S82-Y86 PolarHBondContact O-N 2.89Å; S82-Y86 WeakPolarHBondContact OG-CD2 3.12Å; S82-Y86 VanDerWaalsContact OG-CE2 3.26Å; S82-Y86 WeakPolarHBondContact OG-CE2 3.26Å
83	C	59.9	Low	70.6	Confident	75 Å²	75	78.3 Å²	78.3	51%	0.507	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-48.7	-167.7	-70.9	0	0	0	0	113.3	R87	C83-R87 WeakPolarHBondContact O-CB 3.3Å; C83-R87 PolarHBondContact O-N 3.44Å
84	E	65.7	Low	70.9	Confident	66 Å²	66	77.7 Å²	77.7	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-70.9	-38.2	179.3	-70	-159.1	165.9	0	0	113.3	N79 S82 R87 R88	N79-E84 WeakPolarHBondContact O-CB 3.32Å; N79-E84 WeakPolarHBondContact O-CG 3.23Å; N79-E84 PolarHBondContact OD1-OE1 2.85Å; S82-E84 PolarHBondContact O-N 3.34Å; E84-R87 PolarHBondContact O-N 3.49Å; E84-R88 WeakPolarHBondContact O-CB 3.29Å; E84-R88 WeakPolarHBondContact O-CG 3.34Å; E84-R88 PolarHBondContact O-N 3.45Å; E84-R88 IonicContact OE2-CZ 3.39Å; E84-R88 IonicContact OE2-NH2 2.66Å; E84-R88 PolarHBondContact OE2-NH2 3.38Å
85	A	64.4	Low	71.4	Confident	16 Å²	16	74.9 Å²	74.9	13%	0.132	38%	0.384	C	S	.	.	H	α-helix	trans	-68.2	-43.3	179.2	0	0	0	0	0	110.8	G81 S82 R87 R88 A89	G81-A85 VanDerWaalsContact O-CB 3.23Å; G81-A85 WeakPolarHBondContact O-CB 3.23Å; S82-A85 PolarHBondContact O-N 3.41Å; A85-R87 VanDerWaalsContact C-N 3.34Å; A85-R88 PolarHBondContact O-N 2.83Å; A85-A89 WeakPolarHBondContact O-CB 3.4Å; A85-A89 PolarHBondContact O-N 3.19Å
86	Y	70.4	Confident	71.8	Confident	166 Å²	166	76 Å²	76	65%	0.651	39%	0.385	S	S	*	.	H	α-helix	trans	-62.2	-41.8	172	-74.6	-56.8	0	0	0	111.4	S82 A89 F90	S82-Y86 VanDerWaalsContact C-CD2 3.41Å; S82-Y86 WeakPolarHBondContact O-CB 3.35Å; S82-Y86 WeakPolarHBondContact O-CD2 3.5Å; S82-Y86 VanDerWaalsContact O-CG 3.31Å; S82-Y86 PolarHBondContact O-N 2.89Å; S82-Y86 WeakPolarHBondContact OG-CD2 3.12Å; S82-Y86 VanDerWaalsContact OG-CE2 3.26Å; S82-Y86 WeakPolarHBondContact OG-CE2 3.26Å; Y86-A89 PolarHBondContact O-N 3.37Å; Y86-F90 WeakPolarHBondContact O-CB 3.48Å; Y86-F90 PolarHBondContact O-N 3.33Å
87	R	78	Confident	72.9	Confident	136 Å²	136	77.5 Å²	77.5	51%	0.513	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-48.4	175.6	-170.6	-174.9	68.2	77.3	-7.7	111.4	C83 E84 A85 F90 D91	C83-R87 WeakPolarHBondContact O-CB 3.3Å; C83-R87 PolarHBondContact O-N 3.44Å; E84-R87 PolarHBondContact O-N 3.49Å; A85-R87 VanDerWaalsContact C-N 3.34Å; R87-F90 WeakPolarHBondContact O-CB 3.45Å; R87-F90 PolarHBondContact O-N 3.09Å; R87-D91 IonicContact CZ-OD2 3.7Å; R87-D91 IonicContact NH1-OD2 3.32Å; R87-D91 PolarHBondContact NH1-OD2 3.24Å; R87-D91 PolarHBondContact O-N 2.77Å
88	R	77.4	Confident	74.2	Confident	101 Å²	101	83.4 Å²	83.4	38%	0.381	41%	0.411	S	S	.	.	H	α-helix	trans	-63.2	-42.7	177	-77	-172.3	-113	126	-1.4	111.8	E84 A85 F90 D91 I92	E84-R88 WeakPolarHBondContact O-CB 3.29Å; E84-R88 WeakPolarHBondContact O-CG 3.34Å; E84-R88 PolarHBondContact O-N 3.45Å; E84-R88 IonicContact OE2-CZ 3.39Å; E84-R88 IonicContact OE2-NH2 2.66Å; E84-R88 PolarHBondContact OE2-NH2 3.38Å; A85-R88 PolarHBondContact O-N 2.83Å; R88-F90 VanDerWaalsContact C-N 3.33Å; R88-F90 PolarHBondContact O-N 3.25Å; R88-D91 PolarHBondContact O-N 2.82Å; R88-I92 WeakPolarHBondContact O-CB 3.43Å; R88-I92 WeakPolarHBondContact O-CD1 3.49Å; R88-I92 VanDerWaalsContact O-CG1 3.23Å; R88-I92 WeakPolarHBondContact O-CG1 3.44Å; R88-I92 PolarHBondContact O-N 3.23Å
89	A	77.2	Confident	75.8	Confident	36 Å²	36	82 Å²	82	30%	0.298	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-40.9	175.8	0	0	0	0	0	111.6	L30 A85 Y86 G93	L30-A89 HydrophobicContact CD2-CB 3.95Å; A85-A89 WeakPolarHBondContact O-CB 3.4Å; A85-A89 PolarHBondContact O-N 3.19Å; Y86-A89 PolarHBondContact O-N 3.37Å; A89-G93 PolarHBondContact O-N 2.9Å
90	F	84.4	Confident	77.5	Confident	139 Å²	139	83.1 Å²	83.1	61%	0.61	42%	0.415	S	S	*	.	H	α-helix	trans	-62.7	-47.8	173.8	179.2	-92.7	0	0	0	111.7	Y86 R87 R88 I92 G93 L94	Y86-F90 WeakPolarHBondContact O-CB 3.48Å; Y86-F90 PolarHBondContact O-N 3.33Å; R87-F90 WeakPolarHBondContact O-CB 3.45Å; R87-F90 PolarHBondContact O-N 3.09Å; R88-F90 VanDerWaalsContact C-N 3.33Å; R88-F90 PolarHBondContact O-N 3.25Å; F90-I92 PolarHBondContact O-N 2.91Å; F90-G93 PolarHBondContact O-N 3.43Å; F90-L94 HydrophobicContact CE1-CD2 4.5Å; F90-L94 WeakPolarHBondContact O-CB 3.28Å; F90-L94 PolarHBondContact O-N 2.66Å
91	D	87.3	Confident	79	Confident	60 Å²	60	84.4 Å²	84.4	32%	0.321	42%	0.42	S	S	.	.	H	α-helix	trans	-60	-44.5	178.6	-69	-25.8	0	0	0	111.3	R87 R88 L94 I95	R87-D91 IonicContact CZ-OD2 3.7Å; R87-D91 IonicContact NH1-OD2 3.32Å; R87-D91 PolarHBondContact NH1-OD2 3.24Å; R87-D91 PolarHBondContact O-N 2.77Å; R88-D91 PolarHBondContact O-N 2.82Å; D91-L94 PolarHBondContact O-N 2.96Å; D91-I95 WeakPolarHBondContact O-CG1 3.33Å; D91-I95 PolarHBondContact O-N 3.41Å; D91-I95 VanDerWaalsContact O-N 3.08Å
92	I	85.4	Confident	80.6	Confident	60 Å²	60	86.9 Å²	86.9	31%	0.308	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-46	175.1	-67.3	164.7	0	0	0	110.9	L30 R88 F90 L94 I95 R96	L30-I92 HydrophobicContact CD2-CD1 4.31Å; R88-I92 WeakPolarHBondContact O-CB 3.43Å; R88-I92 WeakPolarHBondContact O-CD1 3.49Å; R88-I92 VanDerWaalsContact O-CG1 3.23Å; R88-I92 WeakPolarHBondContact O-CG1 3.44Å; R88-I92 PolarHBondContact O-N 3.23Å; F90-I92 PolarHBondContact O-N 2.91Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 2.83Å; I92-I95 PolarHBondContact O-N 2.9Å; I92-R96 HydrophobicContact CG2-CG 4.39Å; I92-R96 WeakPolarHBondContact O-CB 3.42Å; I92-R96 WeakPolarHBondContact O-CG 3.43Å; I92-R96 PolarHBondContact O-N 3.17Å
93	G	86.8	Confident	82.2	Confident	41 Å²	41	91.1 Å²	91.1	42%	0.423	45%	0.447	S	S	.	.	H	α-helix	trans	-59.9	-41.2	177.8	0	0	0	0	0	112.3	A89 F90 R96 G97	A89-G93 PolarHBondContact O-N 2.9Å; F90-G93 PolarHBondContact O-N 3.43Å; G93-R96 PolarHBondContact O-N 3.28Å; G93-G97 PolarHBondContact O-N 3.41Å
94	L	90.6	Very high	83.6	Confident	76 Å²	76	91.1 Å²	91.1	40%	0.398	44%	0.439	S	S	.	.	H	α-helix	trans	-63.2	-46.7	176.7	-176.6	66.9	0	0	0	111.7	F90 D91 I92 G97 R98	F90-L94 HydrophobicContact CE1-CD2 4.5Å; F90-L94 WeakPolarHBondContact O-CB 3.28Å; F90-L94 PolarHBondContact O-N 2.66Å; D91-L94 PolarHBondContact O-N 2.96Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 2.83Å; L94-G97 PolarHBondContact O-N 3.49Å; L94-R98 WeakPolarHBondContact O-CG 3.36Å; L94-R98 PolarHBondContact O-N 2.97Å
95	I	90.6	Very high	84.6	Confident	98 Å²	98	90.4 Å²	90.4	50%	0.503	44%	0.437	S	S	.	.	H	α-helix	trans	-63.2	-47.2	177.9	-66.4	165.1	0	0	0	110.4	D91 I92 G97 R98 Q99	D91-I95 WeakPolarHBondContact O-CG1 3.33Å; D91-I95 PolarHBondContact O-N 3.41Å; D91-I95 VanDerWaalsContact O-N 3.08Å; I92-I95 PolarHBondContact O-N 2.9Å; I95-G97 VanDerWaalsContact C-N 3.33Å; I95-G97 PolarHBondContact O-N 2.9Å; I95-R98 PolarHBondContact O-N 3.32Å; I95-Q99 WeakPolarHBondContact O-CG 3.42Å; I95-Q99 PolarHBondContact O-N 3.32Å
96	R	87.3	Confident	85.7	Confident	149 Å²	149	94 Å²	94	56%	0.562	45%	0.454	S	S	*	.	H	α-helix	trans	-61.4	-41	177	-74.4	-177.9	178.7	-166.9	1.2	111.8	I92 G93 Q99 L100	I92-R96 HydrophobicContact CG2-CG 4.39Å; I92-R96 WeakPolarHBondContact O-CB 3.42Å; I92-R96 WeakPolarHBondContact O-CG 3.43Å; I92-R96 PolarHBondContact O-N 3.17Å; G93-R96 PolarHBondContact O-N 3.28Å; R96-Q99 PolarHBondContact O-N 3.41Å; R96-L100 WeakPolarHBondContact O-CB 3.37Å; R96-L100 PolarHBondContact O-N 3.33Å
97	G	88.4	Confident	86.5	Confident	36 Å²	36	88.7 Å²	88.7	37%	0.371	44%	0.444	S	S	.	.	H	α-helix	trans	-60.4	-45.6	175.9	0	0	0	0	0	112.2	G93 L94 I95 Q99 L100 Q101	G93-G97 PolarHBondContact O-N 3.41Å; L94-G97 PolarHBondContact O-N 3.49Å; I95-G97 VanDerWaalsContact C-N 3.33Å; I95-G97 PolarHBondContact O-N 2.9Å; G97-Q99 PolarHBondContact O-N 2.93Å; G97-L100 PolarHBondContact O-N 2.76Å; G97-Q101 WeakPolarHBondContact O-CB 3.49Å; G97-Q101 PolarHBondContact O-N 2.95Å
98	R	89.2	Confident	86.9	Confident	160 Å²	160	84.2 Å²	84.2	60%	0.604	43%	0.428	S	S	*	.	H	α-helix	trans	-62.2	-41.4	175	-70.9	177.9	-177.8	-164.2	1.4	112.5	L94 I95 S102	L94-R98 WeakPolarHBondContact O-CG 3.36Å; L94-R98 PolarHBondContact O-N 2.97Å; I95-R98 PolarHBondContact O-N 3.32Å; R98-S102 WeakPolarHBondContact O-CB 3.36Å; R98-S102 PolarHBondContact O-N 3.39Å; R98-S102 PolarHBondContact O-OG 3.16Å
99	Q	89.9	Confident	87.3	Confident	109 Å²	109	82.8 Å²	82.8	51%	0.509	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-42.7	175.8	-72	178.7	-6.1	0	0	111.8	I95 R96 G97 S102 K103	I95-Q99 WeakPolarHBondContact O-CG 3.42Å; I95-Q99 PolarHBondContact O-N 3.32Å; R96-Q99 PolarHBondContact O-N 3.41Å; G97-Q99 PolarHBondContact O-N 2.93Å; Q99-S102 PolarHBondContact O-N 3.03Å; Q99-K103 WeakPolarHBondContact O-CG 3.44Å; Q99-K103 PolarHBondContact O-N 3.38Å
100	L	89.9	Confident	87.6	Confident	102 Å²	102	89.4 Å²	89.4	53%	0.534	44%	0.444	S	S	.	.	H	α-helix	trans	-63.3	-48.8	177	-175.7	65.5	0	0	0	111	R96 G97 S102 K103 E104	R96-L100 WeakPolarHBondContact O-CB 3.37Å; R96-L100 PolarHBondContact O-N 3.33Å; G97-L100 PolarHBondContact O-N 2.76Å; L100-S102 VanDerWaalsContact C-N 3.28Å; L100-S102 PolarHBondContact O-N 2.88Å; L100-K103 WeakPolarHBondContact O-CB 3.33Å; L100-K103 PolarHBondContact O-N 2.94Å; L100-K103 VanDerWaalsContact O-N 3.11Å; L100-E104 WeakPolarHBondContact O-CG 3.31Å; L100-E104 PolarHBondContact O-N 2.91Å
101	Q	86.9	Confident	87.6	Confident	77 Å²	77	86.4 Å²	86.4	36%	0.36	44%	0.441	S	S	.	.	H	α-helix	trans	-57	-41.8	176.1	-172.9	-178.7	46.1	0	0	111.7	G97 E104 L105	G97-Q101 WeakPolarHBondContact O-CB 3.49Å; G97-Q101 PolarHBondContact O-N 2.95Å; Q101-E104 PolarHBondContact O-N 3.11Å; Q101-L105 WeakPolarHBondContact O-CB 3.43Å; Q101-L105 PolarHBondContact O-N 3.48Å
102	S	87.4	Confident	87.3	Confident	67 Å²	67	87 Å²	87	47%	0.469	44%	0.439	S	S	.	.	H	α-helix	trans	-63.7	-41.3	177.1	-58.8	0	0	0	0	112.1	R98 Q99 L100 L105 L106	R98-S102 WeakPolarHBondContact O-CB 3.36Å; R98-S102 PolarHBondContact O-N 3.39Å; R98-S102 PolarHBondContact O-OG 3.16Å; Q99-S102 PolarHBondContact O-N 3.03Å; L100-S102 VanDerWaalsContact C-N 3.28Å; L100-S102 PolarHBondContact O-N 2.88Å; S102-L105 PolarHBondContact O-N 2.83Å; S102-L106 WeakPolarHBondContact O-CG 3.34Å; S102-L106 PolarHBondContact O-N 3.49Å
103	K	90.1	Very high	86.6	Confident	143 Å²	143	91.9 Å²	91.9	62%	0.622	47%	0.466	S	S	*	.	H	α-helix	trans	-64.9	-43.1	175.7	-73	175.5	179.4	-179.3	0	111.9	Q99 L100 L106 A107	Q99-K103 WeakPolarHBondContact O-CG 3.44Å; Q99-K103 PolarHBondContact O-N 3.38Å; L100-K103 WeakPolarHBondContact O-CB 3.33Å; L100-K103 PolarHBondContact O-N 2.94Å; L100-K103 VanDerWaalsContact O-N 3.11Å; K103-L106 PolarHBondContact O-N 2.95Å; K103-A107 WeakPolarHBondContact O-CB 3.17Å; K103-A107 PolarHBondContact O-N 3.41Å
104	E	87.6	Confident	86	Confident	75 Å²	75	92.8 Å²	92.8	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-65.2	-40.2	177.1	-70.7	-169	178.6	0	0	112.5	L100 Q101 A107 W108 K129	L100-E104 WeakPolarHBondContact O-CG 3.31Å; L100-E104 PolarHBondContact O-N 2.91Å; Q101-E104 PolarHBondContact O-N 3.11Å; E104-A107 PolarHBondContact O-N 2.94Å; E104-W108 WeakPolarHBondContact O-CB 3.06Å; E104-W108 PolarHBondContact O-N 3.49Å; E104-K129 IonicContact OE2-NZ 3.94Å; E104-K129 PolarHBondContact OE2-NZ 3.09Å
105	L	87.5	Confident	85.2	Confident	51 Å²	51	94.5 Å²	94.5	27%	0.267	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-44.9	176	-177.2	64.6	0	0	0	110.8	Q101 S102 A107 W108 L109 L122	Q101-L105 WeakPolarHBondContact O-CB 3.43Å; Q101-L105 PolarHBondContact O-N 3.48Å; S102-L105 PolarHBondContact O-N 2.83Å; L105-A107 PolarHBondContact O-N 2.89Å; L105-W108 HydrophobicContact CD1-CE3 3.88Å; L105-W108 HydrophobicContact CD1-CZ3 4.12Å; L105-W108 PolarHBondContact O-N 3.03Å; L105-L109 HydrophobicContact CG-CD1 4.26Å; L105-L109 WeakPolarHBondContact O-CB 3.21Å; L105-L109 VanDerWaalsContact O-CG 3.28Å; L105-L109 WeakPolarHBondContact O-CG 3.34Å; L105-L109 PolarHBondContact O-N 3.33Å; L105-L122 HydrophobicContact CD1-CD1 3.61Å; L105-L122 HydrophobicContact CD2-CD1 4.35Å
106	L	87	Confident	84.7	Confident	92 Å²	92	97.2 Å²	97.2	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174.7	-73.2	172.2	0	0	0	112.5	S102 K103 L109 R110	S102-L106 WeakPolarHBondContact O-CG 3.34Å; S102-L106 PolarHBondContact O-N 3.49Å; K103-L106 PolarHBondContact O-N 2.95Å; L106-L109 PolarHBondContact O-N 3.37Å; L106-R110 WeakPolarHBondContact O-CG 3.37Å; L106-R110 PolarHBondContact O-N 3.43Å
107	A	87.2	Confident	84.4	Confident	54 Å²	54	93 Å²	93	45%	0.446	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-42.8	175.9	0	0	0	0	0	111.4	K103 E104 L105 R110 S111	K103-A107 WeakPolarHBondContact O-CB 3.17Å; K103-A107 PolarHBondContact O-N 3.41Å; E104-A107 PolarHBondContact O-N 2.94Å; L105-A107 PolarHBondContact O-N 2.89Å; A107-R110 PolarHBondContact O-N 3.31Å; A107-S111 PolarHBondContact O-N 2.95Å; A107-S111 VanDerWaalsContact O-N 3.08Å
108	W	86.2	Confident	84.3	Confident	43 Å²	43	98.7 Å²	98.7	16%	0.163	49%	0.487	C	S	.	.	H	α-helix	trans	-64	-46	175.8	175.1	75.3	0	0	0	111.5	E104 L105 R110 S111 Y112 I117 Q125	E104-W108 WeakPolarHBondContact O-CB 3.06Å; E104-W108 PolarHBondContact O-N 3.49Å; L105-W108 HydrophobicContact CD1-CE3 3.88Å; L105-W108 HydrophobicContact CD1-CZ3 4.12Å; L105-W108 PolarHBondContact O-N 3.03Å; W108-R110 VanDerWaalsContact C-N 3.25Å; W108-R110 PolarHBondContact O-N 3.5Å; W108-S111 WeakPolarHBondContact CA-OG 3.1Å; W108-S111 CarbonylContact O-C 3.52Å; W108-S111 WeakPolarHBondContact O-CA 3.25Å; W108-S111 PolarHBondContact O-N 3.23Å; W108-S111 PolarHBondContact O-OG 2.89Å; W108-Y112 AromaticContact CZ2-CD2 3.92Å; W108-Y112 HydrophobicContact CZ2-CD2 3.92Å; W108-Y112 HydrophobicContact CZ2-CE2 4.21Å; W108-Y112 HydrophobicContact CZ2-CG 4.36Å; W108-Y112 WeakPolarHBondContact O-CB 3.27Å; W108-Y112 PolarHBondContact O-N 2.86Å; W108-I117 HydrophobicContact CE3-CD1 4.43Å; W108-I117 HydrophobicContact CH2-CD1 3.3Å; W108-I117 HydrophobicContact CH2-CG1 3.98Å; W108-I117 HydrophobicContact CZ3-CD1 3.15Å; W108-I117 HydrophobicContact CZ3-CG1 4.27Å; W108-Q125 HydrophobicContact CD2-CG 3.75Å; W108-Q125 HydrophobicContact CE3-CG 3.92Å; W108-Q125 HydrophobicContact CG-CG 4.18Å; W108-Q125 VanDerWaalsContact CG-NE2 3.29Å; W108-Q125 HydrophobicContact CH2-CB 4.16Å; W108-Q125 HydrophobicContact CH2-CG 4.28Å; W108-Q125 HydrophobicContact CZ2-CB 4.22Å; W108-Q125 HydrophobicContact CZ2-CG 4.18Å; W108-Q125 HydrophobicContact CZ3-CB 4.34Å; W108-Q125 HydrophobicContact CZ3-CG 4.13Å
109	L	85.4	Confident	84.2	Confident	70 Å²	70	98.7 Å²	98.7	37%	0.366	49%	0.487	S	S	.	.	H	α-helix	trans	-59.2	-34.7	175	-73.2	171.9	0	0	0	112.7	L105 L106 Y112 I117	L105-L109 HydrophobicContact CG-CD1 4.26Å; L105-L109 WeakPolarHBondContact O-CB 3.21Å; L105-L109 VanDerWaalsContact O-CG 3.28Å; L105-L109 WeakPolarHBondContact O-CG 3.34Å; L105-L109 PolarHBondContact O-N 3.33Å; L106-L109 PolarHBondContact O-N 3.37Å; L109-Y112 PolarHBondContact O-N 3.24Å; L109-I117 HydrophobicContact CD2-CD1 3.91Å
110	R	85.3	Confident	84.2	Confident	176 Å²	176	98.4 Å²	98.4	66%	0.664	49%	0.486	S	S	*	.	H	α-helix	trans	-68.7	-33.6	173.7	-74.9	177.1	-178.8	125.6	-2.7	113	L106 A107 W108	L106-R110 WeakPolarHBondContact O-CG 3.37Å; L106-R110 PolarHBondContact O-N 3.43Å; A107-R110 PolarHBondContact O-N 3.31Å; W108-R110 VanDerWaalsContact C-N 3.25Å; W108-R110 PolarHBondContact O-N 3.5Å
111	S	83.9	Confident	83.9	Confident	76 Å²	76	95.1 Å²	95.1	53%	0.531	47%	0.469	S	S	.	.	H	α-helix	trans	-80.7	-22.4	175.4	70.3	0	0	0	0	113.2	A107 W108 N113	A107-S111 PolarHBondContact O-N 2.95Å; A107-S111 VanDerWaalsContact O-N 3.08Å; W108-S111 WeakPolarHBondContact CA-OG 3.1Å; W108-S111 CarbonylContact O-C 3.52Å; W108-S111 WeakPolarHBondContact O-CA 3.25Å; W108-S111 PolarHBondContact O-N 3.23Å; W108-S111 PolarHBondContact O-OG 2.89Å; S111-N113 PolarHBondContact O-N 2.9Å; S111-N113 VanDerWaalsContact O-N 3.16Å; S111-N113 PolarHBondContact O-ND2 2.74Å
112	Y	80.2	Confident	84	Confident	71 Å²	71	94 Å²	94	28%	0.278	47%	0.465	S	S	.	.			trans	-77.6	100.1	-179.9	-166	-108.8	0	0	0	109	W108 L109 C114	W108-Y112 AromaticContact CZ2-CD2 3.92Å; W108-Y112 HydrophobicContact CZ2-CD2 3.92Å; W108-Y112 HydrophobicContact CZ2-CE2 4.21Å; W108-Y112 HydrophobicContact CZ2-CG 4.36Å; W108-Y112 WeakPolarHBondContact O-CB 3.27Å; W108-Y112 PolarHBondContact O-N 2.86Å; L109-Y112 PolarHBondContact O-N 3.24Å; Y112-C114 HydrophobicContact CD1-CB 3.85Å; Y112-C114 HydrophobicContact CE1-CB 3.49Å; Y112-C114 VanDerWaalsContact CE1-CB 3.49Å; Y112-C114 PolarHBondContact O-N 3Å
113	N	71.4	Confident	84.1	Confident	164 Å²	164	95 Å²	95	88%	0.877	46%	0.463	S	S	*	.			trans	-72.4	28.3	-175	-69.9	-57.4	0	0	0	114.4	S111	S111-N113 PolarHBondContact O-N 2.9Å; S111-N113 VanDerWaalsContact O-N 3.16Å; S111-N113 PolarHBondContact O-ND2 2.74Å
114	C	73.4	Confident	83.8	Confident	59 Å²	59	93 Å²	93	40%	0.399	46%	0.458	S	S	.	.			trans	-125.2	130.9	179.2	-172.2	0	0	0	0	110.4	Y112 F116	Y112-C114 HydrophobicContact CD1-CB 3.85Å; Y112-C114 HydrophobicContact CE1-CB 3.49Å; Y112-C114 VanDerWaalsContact CE1-CB 3.49Å; Y112-C114 PolarHBondContact O-N 3Å; C114-F116 PolarHBondContact O-N 3.4Å; C114-F116 PolarHBondContact SG-O 2.89Å
115	P	74.3	Confident	83.6	Confident	113 Å²	113	91.2 Å²	91.2	73%	0.734	45%	0.45	S	S	*	.	S	Bend	trans	-68.7	-13.5	179.1	26.5	-33.7	0	0	0	113.8
116	F	80.4	Confident	83.5	Confident	155 Å²	155	92.1 Å²	92.1	68%	0.68	45%	0.454	S	S	*	.			trans	-123.7	125.1	179.4	-60.5	-76.9	0	0	0	110.1	C114	C114-F116 PolarHBondContact O-N 3.4Å; C114-F116 PolarHBondContact SG-O 2.89Å
117	I	81.8	Confident	83.3	Confident	61 Å²	61	90 Å²	90	31%	0.313	45%	0.45	S	S	.	.			trans	-98.1	127.2	170.6	-176.4	173	0	0	0	108.6	W108 L109 L122	W108-I117 HydrophobicContact CE3-CD1 4.43Å; W108-I117 HydrophobicContact CH2-CD1 3.3Å; W108-I117 HydrophobicContact CH2-CG1 3.98Å; W108-I117 HydrophobicContact CZ3-CD1 3.15Å; W108-I117 HydrophobicContact CZ3-CG1 4.27Å; L109-I117 HydrophobicContact CD2-CD1 3.91Å; I117-L122 HydrophobicContact CD1-CB 3.63Å; I117-L122 HydrophobicContact CD1-CD1 3.8Å; I117-L122 HydrophobicContact CD1-CG 4.19Å; I117-L122 HydrophobicContact CG1-CB 4.11Å
118	R	85.1	Confident	82.5	Confident	154 Å²	154	92 Å²	92	58%	0.581	45%	0.453	S	S	*	.			trans	-76.6	147.5	172.9	-56	-178.4	-66.5	175.6	6.3	109.2	E120 D121 L122	R118-E120 VanDerWaalsContact CB-OE2 3.3Å; R118-E120 WeakPolarHBondContact CB-OE2 3.32Å; R118-E120 PolarHBondContact O-N 3.2Å; R118-D121 WeakPolarHBondContact CB-OD2 3.48Å; R118-D121 IonicContact CZ-OD1 3.67Å; R118-D121 IonicContact CZ-OD2 3.43Å; R118-D121 IonicContact NE-OD1 2.79Å; R118-D121 IonicContact NE-OD2 2.65Å; R118-D121 PolarHBondContact NE-OD2 3.45Å; R118-D121 IonicContact NH2-OD1 3.19Å; R118-D121 PolarHBondContact NH2-OD1 3.48Å; R118-D121 IonicContact NH2-OD2 3.91Å; R118-D121 PolarHBondContact NH2-OD2 3.45Å; R118-D121 PolarHBondContact O-N 3.41Å; R118-D121 VanDerWaalsContact O-N 3.15Å; R118-L122 PolarHBondContact O-N 2.85Å; R118-L122 VanDerWaalsContact O-N 3.11Å
119	R	87.8	Confident	81.5	Confident	161 Å²	161	93.6 Å²	93.6	61%	0.608	46%	0.461	S	S	*	.	H	α-helix	trans	-56.2	-39.7	-178.5	-179.3	-178.1	178.7	-72.3	-11.4	110.9	L122 E123	R119-L122 WeakPolarHBondContact O-CB 3.41Å; R119-L122 PolarHBondContact O-N 3.49Å; R119-E123 IonicContact CZ-OE1 2.92Å; R119-E123 IonicContact CZ-OE2 3.7Å; R119-E123 IonicContact NE-OE1 3.86Å; R119-E123 IonicContact NH1-OE1 2.86Å; R119-E123 PolarHBondContact NH1-OE1 3.13Å; R119-E123 IonicContact NH1-OE2 2.87Å; R119-E123 PolarHBondContact NH1-OE2 3.27Å; R119-E123 IonicContact NH2-OE1 2.84Å; R119-E123 PolarHBondContact NH2-OE1 3.25Å; R119-E123 WeakPolarHBondContact O-CG 3.34Å; R119-E123 PolarHBondContact O-N 2.94Å
120	E	89.5	Confident	80.2	Confident	103 Å²	103	96.3 Å²	96.3	48%	0.481	48%	0.475	S	S	.	.	H	α-helix	trans	-67.3	-40.6	-178.5	-53.1	72	-151.9	0	0	111.2	R118 L122 E123 L124	R118-E120 VanDerWaalsContact CB-OE2 3.3Å; R118-E120 WeakPolarHBondContact CB-OE2 3.32Å; R118-E120 PolarHBondContact O-N 3.2Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-L122 PolarHBondContact O-N 3.06Å; E120-E123 PolarHBondContact O-N 3.33Å; E120-L124 WeakPolarHBondContact O-CB 3.33Å; E120-L124 VanDerWaalsContact O-CG 3.25Å; E120-L124 WeakPolarHBondContact O-CG 3.33Å; E120-L124 PolarHBondContact O-N 2.93Å
121	D	84.3	Confident	78.8	Confident	32 Å²	32	93.8 Å²	93.8	17%	0.171	48%	0.475	C	S	.	.	H	α-helix	trans	-67	-37	177.7	-60.5	-33.3	0	0	0	110.9	R118 Q125	R118-D121 WeakPolarHBondContact CB-OD2 3.48Å; R118-D121 IonicContact CZ-OD1 3.67Å; R118-D121 IonicContact CZ-OD2 3.43Å; R118-D121 IonicContact NE-OD1 2.79Å; R118-D121 IonicContact NE-OD2 2.65Å; R118-D121 PolarHBondContact NE-OD2 3.45Å; R118-D121 IonicContact NH2-OD1 3.19Å; R118-D121 PolarHBondContact NH2-OD1 3.48Å; R118-D121 IonicContact NH2-OD2 3.91Å; R118-D121 PolarHBondContact NH2-OD2 3.45Å; R118-D121 PolarHBondContact O-N 3.41Å; R118-D121 VanDerWaalsContact O-N 3.15Å; D121-Q125 VanDerWaalsContact O-CB 3.32Å; D121-Q125 WeakPolarHBondContact O-CB 3.44Å; D121-Q125 PolarHBondContact O-N 2.84Å
122	L	87.9	Confident	77	Confident	55 Å²	55	94.5 Å²	94.5	29%	0.288	47%	0.472	S	S	.	.	H	α-helix	trans	-65.7	-46.5	174.5	-179.1	59.4	0	0	0	111.8	L105 I117 R118 R119 E120 Q125 I126	L105-L122 HydrophobicContact CD1-CD1 3.61Å; L105-L122 HydrophobicContact CD2-CD1 4.35Å; I117-L122 HydrophobicContact CD1-CB 3.63Å; I117-L122 HydrophobicContact CD1-CD1 3.8Å; I117-L122 HydrophobicContact CD1-CG 4.19Å; I117-L122 HydrophobicContact CG1-CB 4.11Å; R118-L122 PolarHBondContact O-N 2.85Å; R118-L122 VanDerWaalsContact O-N 3.11Å; R119-L122 WeakPolarHBondContact O-CB 3.41Å; R119-L122 PolarHBondContact O-N 3.49Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-L122 PolarHBondContact O-N 3.06Å; L122-Q125 PolarHBondContact O-N 2.89Å; L122-I126 HydrophobicContact CD1-CD1 3.92Å; L122-I126 HydrophobicContact CD1-CG1 4.31Å; L122-I126 HydrophobicContact CG-CD1 3.96Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.31Å
123	E	88.9	Confident	75.1	Confident	88 Å²	88	97.1 Å²	97.1	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-45.3	178.2	-74.6	-179.7	149.7	0	0	111.3	R119 E120 Q125 I126 A127	R119-E123 IonicContact CZ-OE1 2.92Å; R119-E123 IonicContact CZ-OE2 3.7Å; R119-E123 IonicContact NE-OE1 3.86Å; R119-E123 IonicContact NH1-OE1 2.86Å; R119-E123 PolarHBondContact NH1-OE1 3.13Å; R119-E123 IonicContact NH1-OE2 2.87Å; R119-E123 PolarHBondContact NH1-OE2 3.27Å; R119-E123 IonicContact NH2-OE1 2.84Å; R119-E123 PolarHBondContact NH2-OE1 3.25Å; R119-E123 WeakPolarHBondContact O-CG 3.34Å; R119-E123 PolarHBondContact O-N 2.94Å; E120-E123 PolarHBondContact O-N 3.33Å; E123-Q125 VanDerWaalsContact C-N 3.34Å; E123-Q125 PolarHBondContact O-N 3.27Å; E123-I126 PolarHBondContact O-N 3.13Å; E123-A127 VanDerWaalsContact O-CB 3.28Å; E123-A127 WeakPolarHBondContact O-CB 3.14Å; E123-A127 PolarHBondContact O-N 3.2Å
124	L	85.4	Confident	73.8	Confident	100 Å²	100	98.8 Å²	98.8	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-42.1	174.6	-73.6	170.4	0	0	0	111.7	E120 A127 N128	E120-L124 WeakPolarHBondContact O-CB 3.33Å; E120-L124 VanDerWaalsContact O-CG 3.25Å; E120-L124 WeakPolarHBondContact O-CG 3.33Å; E120-L124 PolarHBondContact O-N 2.93Å; L124-A127 PolarHBondContact O-N 2.9Å; L124-N128 WeakPolarHBondContact O-CB 3.36Å; L124-N128 PolarHBondContact O-N 3.35Å; L124-N128 PolarHBondContact O-ND2 2.83Å
125	Q	83.1	Confident	72	Confident	38 Å²	38	104.9 Å²	104.9	18%	0.178	52%	0.515	C	S	.	.	H	α-helix	trans	-64.9	-40.2	178.8	-177.3	66.4	3.5	0	0	112.4	W108 D121 L122 E123 K129	W108-Q125 HydrophobicContact CD2-CG 3.75Å; W108-Q125 HydrophobicContact CE3-CG 3.92Å; W108-Q125 HydrophobicContact CG-CG 4.18Å; W108-Q125 VanDerWaalsContact CG-NE2 3.29Å; W108-Q125 HydrophobicContact CH2-CB 4.16Å; W108-Q125 HydrophobicContact CH2-CG 4.28Å; W108-Q125 HydrophobicContact CZ2-CB 4.22Å; W108-Q125 HydrophobicContact CZ2-CG 4.18Å; W108-Q125 HydrophobicContact CZ3-CB 4.34Å; W108-Q125 HydrophobicContact CZ3-CG 4.13Å; D121-Q125 VanDerWaalsContact O-CB 3.32Å; D121-Q125 WeakPolarHBondContact O-CB 3.44Å; D121-Q125 PolarHBondContact O-N 2.84Å; L122-Q125 PolarHBondContact O-N 2.89Å; E123-Q125 VanDerWaalsContact C-N 3.34Å; E123-Q125 PolarHBondContact O-N 3.27Å; Q125-K129 HydrophobicContact CG-CD 4.42Å; Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 WeakPolarHBondContact O-CG 3.3Å; Q125-K129 PolarHBondContact O-N 2.93Å
126	I	86	Confident	70.4	Confident	70 Å²	70	106.1 Å²	106.1	36%	0.359	52%	0.52	S	S	.	.	H	α-helix	trans	-70	-44.6	177.9	-67.2	168.7	0	0	0	110.5	L122 E123 L130	L122-I126 HydrophobicContact CD1-CD1 3.92Å; L122-I126 HydrophobicContact CD1-CG1 4.31Å; L122-I126 HydrophobicContact CG-CD1 3.96Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.31Å; E123-I126 PolarHBondContact O-N 3.13Å; I126-L130 PolarHBondContact O-N 3.14Å; I126-L130 VanDerWaalsContact O-N 3.13Å
127	A	82.3	Confident	68.2	Low	48 Å²	48	104.2 Å²	104.2	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-67.4	-49.2	-178.8	0	0	0	0	0	112.4	E123 L124 K129 L130 D131	E123-A127 VanDerWaalsContact O-CB 3.28Å; E123-A127 WeakPolarHBondContact O-CB 3.14Å; E123-A127 PolarHBondContact O-N 3.2Å; L124-A127 PolarHBondContact O-N 2.9Å; A127-K129 PolarHBondContact O-N 3.4Å; A127-K129 VanDerWaalsContact O-N 3.17Å; A127-L130 WeakPolarHBondContact O-CA 3.47Å; A127-L130 VanDerWaalsContact O-CB 3.26Å; A127-L130 WeakPolarHBondContact O-CB 3.22Å; A127-L130 PolarHBondContact O-N 3.43Å; A127-D131 PolarHBondContact O-N 3.38Å
128	N	70.6	Confident	65.8	Low	94 Å²	94	104.2 Å²	104.2	50%	0.503	55%	0.548	S	S	.	.	H	α-helix	trans	-62.9	-26.4	179.9	-73	-36.4	0	0	0	112.9	L124	L124-N128 WeakPolarHBondContact O-CB 3.36Å; L124-N128 PolarHBondContact O-N 3.35Å; L124-N128 PolarHBondContact O-ND2 2.83Å
129	K	65.3	Low	63.3	Low	77 Å²	77	103.9 Å²	103.9	34%	0.335	56%	0.563	S	S	.	*	H	α-helix	trans	-83.2	-23.2	174.2	-76.2	179.1	161.6	-74.7	0	113	E104 Q125 A127 D131	E104-K129 IonicContact OE2-NZ 3.94Å; E104-K129 PolarHBondContact OE2-NZ 3.09Å; Q125-K129 HydrophobicContact CG-CD 4.42Å; Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 WeakPolarHBondContact O-CG 3.3Å; Q125-K129 PolarHBondContact O-N 2.93Å; A127-K129 PolarHBondContact O-N 3.4Å; A127-K129 VanDerWaalsContact O-N 3.17Å; K129-D131 VanDerWaalsContact C-N 3.28Å
130	L	58.4	Low	61.1	Low	127 Å²	127	103.9 Å²	103.9	67%	0.665	57%	0.574	S	S	*	*	H	α-helix	trans	-68.2	-31.7	172.1	-124.8	79.6	0	0	0	111.4	I126 A127 L132	I126-L130 PolarHBondContact O-N 3.14Å; I126-L130 VanDerWaalsContact O-N 3.13Å; A127-L130 WeakPolarHBondContact O-CA 3.47Å; A127-L130 VanDerWaalsContact O-CB 3.26Å; A127-L130 WeakPolarHBondContact O-CB 3.22Å; A127-L130 PolarHBondContact O-N 3.43Å; L130-L132 VanDerWaalsContact C-N 3.31Å; L130-L132 PolarHBondContact O-N 3.16Å
131	D	55	Low	59	Low	124 Å²	124	104.6 Å²	104.6	66%	0.663	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	4.3	-179.3	-66.7	-31.9	0	0	0	114.4	A127 K129 P133	A127-D131 PolarHBondContact O-N 3.38Å; K129-D131 VanDerWaalsContact C-N 3.28Å; D131-P133 WeakPolarHBondContact O-CD 3.4Å
132	L	46.1	Very low	56.8	Low	90 Å²	90	111.6 Å²	111.6	47%	0.471	62%	0.62	S	S	.	*			trans	-99.4	105.6	-176.3	-118.8	72.6	0	0	0	112	L130 R134	L130-L132 VanDerWaalsContact C-N 3.31Å; L130-L132 PolarHBondContact O-N 3.16Å; L132-R134 HydrophobicContact CB-CB 4.32Å; L132-R134 HydrophobicContact CD2-CB 3.97Å; L132-R134 HydrophobicContact CD2-CG 4.34Å; L132-R134 HydrophobicContact CG-CB 4.23Å; L132-R134 PolarHBondContact O-N 2.98Å
133	P	39.2	Very low	54.2	Low	126 Å²	126	115.8 Å²	115.8	82%	0.818	65%	0.648	S	S	*	*			trans	-77.4	77.4	159.3	32.7	-30.1	0	0	0	107.5	D131	D131-P133 WeakPolarHBondContact O-CD 3.4Å
134	R	45.4	Very low	52.1	Low	200 Å²	200	117.1 Å²	117.1	76%	0.755	66%	0.662	S	S	*	*			trans	-104	84.7	-177.1	-155.4	170.1	-174.6	164.8	2.4	111.8	L132	L132-R134 HydrophobicContact CB-CB 4.32Å; L132-R134 HydrophobicContact CD2-CB 3.97Å; L132-R134 HydrophobicContact CD2-CG 4.34Å; L132-R134 HydrophobicContact CG-CB 4.23Å; L132-R134 PolarHBondContact O-N 2.98Å
135	Q	34.4	Very low	49.9	Very low	187 Å²	187	117.7 Å²	117.7	87%	0.874	67%	0.674	S	S	*	*			trans	31	91.7	140.9	-61.9	179.5	30.9	0	0	116
136	T	40.6	Very low	47.5	Very low	139 Å²	139	121.1 Å²	121.1	85%	0.853	71%	0.709	S	S	*	*			trans	-107.3	124.4	142.2	43.1	0	0	0	0	107.8	G138	T136-G138 PolarHBondContact O-N 3.38Å
137	A	34.4	Very low	45.2	Very low	115 Å²	115	122.7 Å²	122.7	95%	0.95	73%	0.726	S	S	*	*			trans	-49.5	126.5	178.7	0	0	0	0	0	112
138	G	32.8	Very low	42.9	Very low	60 Å²	60	125.8 Å²	125.8	62%	0.619	75%	0.745	S	S	*	*			trans	167.1	85.3	179.2	0	0	0	0	0	108.8	T136 L140	T136-G138 PolarHBondContact O-N 3.38Å; G138-L140 PolarHBondContact O-N 2.92Å
139	T	31.8	Very low	41.8	Very low	148 Å²	148	128.4 Å²	128.4	91%	0.908	76%	0.758	S	S	*	*			trans	-52.8	101.5	178.4	-36.8	0	0	0	0	110.2
140	L	42.1	Very low	40.2	Very low	160 Å²	160	136.1 Å²	136.1	84%	0.838	79%	0.785	S	S	*	*			trans	-123.2	114.6	166.4	-91.3	163.6	0	0	0	106.4	G138	G138-L140 PolarHBondContact O-N 2.92Å
141	P	44.5	Very low	39.4	Very low	119 Å²	119	136.5 Å²	136.5	77%	0.773	79%	0.793	S	S	*	*			trans	-74	136.5	-177.9	28.6	-31	0	0	0	110.7
142	E	39.3	Very low	38.4	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	79%	0.792	S	S	*	*			trans	-48.9	136.7	177.3	-78.1	169.2	116.6	0	0	113.7	V144	E142-V144 PolarHBondContact O-N 3.41Å
143	T	33.3	Very low	38.5	Very low	144 Å²	144	135 Å²	135	88%	0.883	81%	0.807	S	S	*	*			trans	-67.5	109.9	161.8	-46.1	0	0	0	0	108.9
144	V	44.9	Very low	39	Very low	116 Å²	116	133.1 Å²	133.1	70%	0.703	80%	0.795	S	S	*	*			trans	-144.8	118.8	161.5	-90.2	0	0	0	0	111.8	E142	E142-V144 PolarHBondContact O-N 3.41Å
145	S	38.4	Very low	38.8	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	79%	0.786	S	S	*	*			trans	67.1	97.5	141.9	-60.9	0	0	0	0	118.1	S147	S145-S147 PolarHBondContact O-N 2.89Å
146	A	31.9	Very low	39.8	Very low	111 Å²	111	123.2 Å²	123.2	92%	0.917	77%	0.774	S	S	*	*			trans	-42.8	122.7	155.2	0	0	0	0	0	111.8
147	S	38.1	Very low	40.3	Very low	103 Å²	103	119.8 Å²	119.8	72%	0.72	76%	0.76	S	S	*	*			trans	-132.4	107.9	159.5	-169.7	0	0	0	0	109	S145 L149	S145-S147 PolarHBondContact O-N 2.89Å; S147-L149 PolarHBondContact O-N 3.34Å
148	S	34.7	Very low	41.2	Very low	113 Å²	113	122.9 Å²	122.9	79%	0.79	75%	0.752	S	S	*	*			trans	-66.3	110.2	175.1	-175.3	0	0	0	0	109.5
149	L	46.4	Very low	42.2	Very low	149 Å²	149	124.8 Å²	124.8	78%	0.78	75%	0.745	S	S	*	*			trans	-119.9	89	168.6	-84.4	157.4	0	0	0	109.4	S147 T151	S147-L149 PolarHBondContact O-N 3.34Å; L149-T151 PolarHBondContact O-N 3.01Å
150	R	31.8	Very low	43.4	Very low	238 Å²	238	124.1 Å²	124.1	90%	0.898	73%	0.732	S	S	*	*			trans	-14	104.6	149.9	-65.7	169.6	152.3	-155.8	-7.1	113.7
151	T	41.8	Very low	44.3	Very low	136 Å²	136	119.2 Å²	119.2	83%	0.834	71%	0.714	S	S	*	*			trans	-114.5	126.7	152.1	44.4	0	0	0	0	107.2	L149	L149-T151 PolarHBondContact O-N 3.01Å
152	G	34.6	Very low	45.4	Very low	63 Å²	63	117.3 Å²	117.3	65%	0.649	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-58.8	156.5	-161.8	0	0	0	0	0	114.2
153	P	48	Very low	46.8	Very low	120 Å²	120	112.2 Å²	112.2	78%	0.779	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-60.2	128.7	-179.8	26.9	-31.8	0	0	0	108.5	S155	P153-S155 PolarHBondContact O-N 2.83Å
154	P	49.2	Very low	48.8	Very low	86 Å²	86	110.4 Å²	110.4	56%	0.558	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-57.7	136.3	160.1	28.4	-33.2	0	0	0	106.9	P156 E159	P154-P156 VanDerWaalsContact O-N 3.16Å; P154-E159 VanDerWaalsContact CG-OE2 3.28Å; P154-E159 WeakPolarHBondContact CG-OE2 3.15Å
155	S	41.2	Very low	50.5	Low	81 Å²	81	109.1 Å²	109.1	57%	0.566	65%	0.654	S	S	*	*			trans	-43.5	122.4	-177	177.8	0	0	0	0	111.4	P153 A157 K158	P153-S155 PolarHBondContact O-N 2.83Å; S155-A157 PolarHBondContact O-N 3.05Å; S155-K158 PolarHBondContact O-N 3.3Å
156	P	55.6	Low	52.5	Low	97 Å²	97	106 Å²	106	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-61.7	-18.7	-168.3	23.2	-34	0	0	0	113.2	P154 Q160	P154-P156 VanDerWaalsContact O-N 3.16Å; P156-Q160 WeakPolarHBondContact O-CB 3.34Å; P156-Q160 PolarHBondContact O-N 3.03Å; P156-Q160 VanDerWaalsContact O-N 3.13Å
157	A	52.6	Low	54.9	Low	68 Å²	68	104.4 Å²	104.4	56%	0.562	60%	0.6	S	S	*	*	H	α-helix	trans	-73.6	-33.5	-175.9	0	0	0	0	0	114.2	S155 A161	S155-A157 PolarHBondContact O-N 3.05Å; A157-A161 PolarHBondContact O-N 3.34Å
158	K	52.6	Low	57.1	Low	179 Å²	179	102.7 Å²	102.7	78%	0.778	59%	0.588	S	S	*	*	H	α-helix	trans	-84.2	-35.9	-177.9	-75.6	-173.5	177.9	-178.8	0	112.5	S155 D162	S155-K158 PolarHBondContact O-N 3.3Å; K158-D162 PolarHBondContact O-N 3.48Å
159	E	54	Low	59.5	Low	101 Å²	101	100.9 Å²	100.9	47%	0.472	57%	0.567	S	S	.	*	H	α-helix	trans	-75.7	-35	177.8	-166.1	169.9	-166.6	0	0	111.5	P154 A161 D162 T163	P154-E159 VanDerWaalsContact CG-OE2 3.28Å; P154-E159 WeakPolarHBondContact CG-OE2 3.15Å; E159-A161 VanDerWaalsContact C-N 3.35Å; E159-A161 PolarHBondContact O-N 3.05Å; E159-D162 PolarHBondContact O-N 3.29Å; E159-T163 HydrophobicContact CG-CG2 4.34Å; E159-T163 WeakPolarHBondContact O-CB 3.31Å; E159-T163 WeakPolarHBondContact O-CG2 3.37Å; E159-T163 PolarHBondContact O-N 2.75Å; E159-T163 PolarHBondContact O-OG1 3.46Å
160	Q	57.1	Low	61.3	Low	133 Å²	133	94.1 Å²	94.1	62%	0.621	53%	0.533	S	S	*	.	H	α-helix	trans	-66.1	-36.5	174.9	-167.7	169.3	61.5	0	0	112.3	P156 T163 M164	P156-Q160 WeakPolarHBondContact O-CB 3.34Å; P156-Q160 PolarHBondContact O-N 3.03Å; P156-Q160 VanDerWaalsContact O-N 3.13Å; Q160-T163 VanDerWaalsContact CA-OG1 3.25Å; Q160-T163 WeakPolarHBondContact CA-OG1 3.31Å; Q160-T163 PolarHBondContact O-OG1 3.09Å; Q160-M164 WeakPolarHBondContact O-CB 3.35Å; Q160-M164 WeakPolarHBondContact O-CG 3.3Å; Q160-M164 PolarHBondContact O-N 3.37Å
161	A	61.5	Low	63.9	Low	58 Å²	58	85.2 Å²	85.2	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-46.4	174.4	0	0	0	0	0	111.9	A157 E159 M164 V165	A157-A161 PolarHBondContact O-N 3.34Å; E159-A161 VanDerWaalsContact C-N 3.35Å; E159-A161 PolarHBondContact O-N 3.05Å; A161-M164 PolarHBondContact O-N 2.86Å; A161-V165 VanDerWaalsContact O-CG2 3.31Å; A161-V165 WeakPolarHBondContact O-CG2 3.15Å; A161-V165 PolarHBondContact O-N 3.36Å
162	D	66.6	Low	65.9	Low	78 Å²	78	82.8 Å²	82.8	42%	0.417	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-39.9	-179.7	-159.8	26.3	0	0	0	111.9	K158 E159 V165 M166	K158-D162 PolarHBondContact O-N 3.48Å; E159-D162 PolarHBondContact O-N 3.29Å; D162-V165 PolarHBondContact O-N 3.42Å; D162-M166 PolarHBondContact O-N 3.34Å
163	T	68.6	Low	68.3	Low	71 Å²	71	81.3 Å²	81.3	44%	0.436	47%	0.47	S	S	.	.	H	α-helix	trans	-66.1	-38	175.3	50.6	0	0	0	0	112.7	E159 Q160 M166 F167	E159-T163 HydrophobicContact CG-CG2 4.34Å; E159-T163 WeakPolarHBondContact O-CB 3.31Å; E159-T163 WeakPolarHBondContact O-CG2 3.37Å; E159-T163 PolarHBondContact O-N 2.75Å; E159-T163 PolarHBondContact O-OG1 3.46Å; Q160-T163 VanDerWaalsContact CA-OG1 3.25Å; Q160-T163 WeakPolarHBondContact CA-OG1 3.31Å; Q160-T163 PolarHBondContact O-OG1 3.09Å; T163-M166 PolarHBondContact O-N 2.86Å; T163-F167 WeakPolarHBondContact O-CB 3.45Å; T163-F167 PolarHBondContact O-N 3.03Å
164	M	75.9	Confident	69.5	Low	107 Å²	107	81.1 Å²	81.1	53%	0.527	47%	0.468	S	S	.	.	H	α-helix	trans	-68.8	-32.4	174.7	-73.6	-63.7	-63.8	0	0	112.8	Q160 A161 S168	Q160-M164 WeakPolarHBondContact O-CB 3.35Å; Q160-M164 WeakPolarHBondContact O-CG 3.3Å; Q160-M164 PolarHBondContact O-N 3.37Å; A161-M164 PolarHBondContact O-N 2.86Å; M164-S168 WeakPolarHBondContact O-CB 3.33Å; M164-S168 PolarHBondContact O-N 3.17Å; M164-S168 PolarHBondContact O-OG 3.24Å
165	V	80.6	Confident	70.6	Confident	88 Å²	88	85.3 Å²	85.3	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-49.7	173.3	171.3	0	0	0	0	110.4	A161 D162 F167 S168 E169	A161-V165 VanDerWaalsContact O-CG2 3.31Å; A161-V165 WeakPolarHBondContact O-CG2 3.15Å; A161-V165 PolarHBondContact O-N 3.36Å; D162-V165 PolarHBondContact O-N 3.42Å; V165-F167 VanDerWaalsContact C-N 3.28Å; V165-F167 PolarHBondContact O-N 2.98Å; V165-S168 PolarHBondContact O-N 2.75Å; V165-S168 VanDerWaalsContact O-N 3.14Å; V165-E169 PolarHBondContact O-N 3.13Å
166	M	80.5	Confident	72.5	Confident	46 Å²	46	84.6 Å²	84.6	23%	0.227	47%	0.471	C	S	.	.	H	α-helix	trans	-60.1	-38.8	176.8	-70.3	-173.3	-135.4	0	0	112.3	D162 T163 E169 A170 F180 H188	D162-M166 PolarHBondContact O-N 3.34Å; T163-M166 PolarHBondContact O-N 2.86Å; M166-E169 PolarHBondContact O-N 2.65Å; M166-A170 VanDerWaalsContact O-CB 3.3Å; M166-A170 WeakPolarHBondContact O-CB 3.44Å; M166-A170 PolarHBondContact O-N 3.09Å; M166-F180 HydrophobicContact CB-CZ 4.32Å; M166-F180 WeakPolarHBondContact O-CZ 3.25Å; M166-H188 WeakPolarHBondContact CE-CE1 3.4Å; M166-H188 VanDerWaalsContact CE-NE2 3.31Å; M166-H188 WeakPolarHBondContact CE-NE2 3.4Å
167	F	82.2	Confident	74.1	Confident	77 Å²	77	80.1 Å²	80.1	34%	0.338	44%	0.441	S	S	.	.	H	α-helix	trans	-63	-44.4	175.9	-179.3	-105.5	0	0	0	111.8	F55 T163 V165 A170 L171	F55-F167 HydrophobicContact CD1-CZ 4.27Å; F55-F167 HydrophobicContact CD2-CE2 4.2Å; F55-F167 AromaticContact CD2-CZ 3.81Å; F55-F167 HydrophobicContact CD2-CZ 3.81Å; F55-F167 HydrophobicContact CE1-CZ 4.26Å; F55-F167 HydrophobicContact CE2-CE2 4.13Å; F55-F167 AromaticContact CE2-CZ 3.82Å; F55-F167 HydrophobicContact CE2-CZ 3.82Å; F55-F167 HydrophobicContact CG-CZ 4.06Å; F55-F167 HydrophobicContact CZ-CZ 4.05Å; T163-F167 WeakPolarHBondContact O-CB 3.45Å; T163-F167 PolarHBondContact O-N 3.03Å; V165-F167 VanDerWaalsContact C-N 3.28Å; V165-F167 PolarHBondContact O-N 2.98Å; F167-A170 WeakPolarHBondContact O-CB 3.43Å; F167-A170 PolarHBondContact O-N 3.41Å; F167-L171 HydrophobicContact CD1-CD1 4.01Å; F167-L171 HydrophobicContact CD1-CG 4.44Å; F167-L171 HydrophobicContact CE1-CD1 3.46Å; F167-L171 VanDerWaalsContact CE1-CD1 3.46Å; F167-L171 HydrophobicContact CE1-CG 4.1Å; F167-L171 HydrophobicContact CZ-CD1 3.86Å; F167-L171 HydrophobicContact CZ-CD2 4.2Å; F167-L171 HydrophobicContact CZ-CG 4.14Å; F167-L171 WeakPolarHBondContact O-CG 3.18Å; F167-L171 PolarHBondContact O-N 3.22Å
168	S	84.2	Confident	75.6	Confident	68 Å²	68	78.5 Å²	78.5	48%	0.476	43%	0.426	S	S	.	.	H	α-helix	trans	-66.1	-39.8	178.1	-55.4	0	0	0	0	111.9	M164 V165 L171 S172	M164-S168 WeakPolarHBondContact O-CB 3.33Å; M164-S168 PolarHBondContact O-N 3.17Å; M164-S168 PolarHBondContact O-OG 3.24Å; V165-S168 PolarHBondContact O-N 2.75Å; V165-S168 VanDerWaalsContact O-N 3.14Å; S168-L171 PolarHBondContact O-N 3.14Å; S168-S172 PolarHBondContact O-N 2.9Å
169	E	84.6	Confident	77.1	Confident	74 Å²	74	72.9 Å²	72.9	35%	0.346	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-46.3	173.6	-170	178.7	-176.3	0	0	110.4	V165 M166 L171 S172 V173 F180 R187	V165-E169 PolarHBondContact O-N 3.13Å; M166-E169 PolarHBondContact O-N 2.65Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 3.16Å; E169-S172 WeakPolarHBondContact O-CB 3.49Å; E169-S172 PolarHBondContact O-N 3.39Å; E169-S172 PolarHBondContact O-OG 3.4Å; E169-V173 PolarHBondContact O-N 2.75Å; E169-F180 HydrophobicContact CB-CE2 3.87Å; E169-F180 HydrophobicContact CB-CZ 4.49Å; E169-F180 HydrophobicContact CG-CD2 4.16Å; E169-F180 HydrophobicContact CG-CE2 3.65Å; E169-R187 IonicContact OE1-NH1 2.89Å; E169-R187 PolarHBondContact OE1-NH1 3.25Å
170	A	84.2	Confident	78.8	Confident	8 Å²	8	69.4 Å²	69.4	7%	0.066	40%	0.396	C	S	.	.	H	α-helix	trans	-56.6	-45.7	175.4	0	0	0	0	0	111.4	R56 M166 F167 S172 V173 L177 F180	R56-A170 PolarHBondContact NH2-O 3.07Å; M166-A170 VanDerWaalsContact O-CB 3.3Å; M166-A170 WeakPolarHBondContact O-CB 3.44Å; M166-A170 PolarHBondContact O-N 3.09Å; F167-A170 WeakPolarHBondContact O-CB 3.43Å; F167-A170 PolarHBondContact O-N 3.41Å; A170-S172 PolarHBondContact O-N 3.28Å; A170-V173 WeakPolarHBondContact O-CB 3.35Å; A170-V173 PolarHBondContact O-N 2.89Å; A170-V173 VanDerWaalsContact O-N 3.13Å; A170-L177 HydrophobicContact CB-CD1 4.45Å; A170-L177 HydrophobicContact CB-CD2 3.78Å; A170-L177 VanDerWaalsContact O-CD2 3.32Å; A170-L177 WeakPolarHBondContact O-CD2 3.47Å; A170-F180 HydrophobicContact CB-CD1 4.13Å; A170-F180 HydrophobicContact CB-CE1 3.71Å; A170-F180 HydrophobicContact CB-CE2 4.5Å; A170-F180 HydrophobicContact CB-CZ 3.92Å
171	L	85.7	Confident	80.2	Confident	50 Å²	50	65 Å²	65	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-27	177.3	-70.3	-178.7	0	0	0	113.4	T52 F55 R56 F167 S168 E169 V173	T52-L171 HydrophobicContact CG2-CD2 3.9Å; F55-L171 HydrophobicContact CB-CD2 3.48Å; F55-L171 VanDerWaalsContact CB-CD2 3.48Å; F55-L171 HydrophobicContact CG-CD2 4.23Å; R56-L171 VanDerWaalsContact CZ-O 3.3Å; R56-L171 PolarHBondContact NE-O 2.88Å; R56-L171 PolarHBondContact NH2-O 3.47Å; F167-L171 HydrophobicContact CD1-CD1 4.01Å; F167-L171 HydrophobicContact CD1-CG 4.44Å; F167-L171 HydrophobicContact CE1-CD1 3.46Å; F167-L171 VanDerWaalsContact CE1-CD1 3.46Å; F167-L171 HydrophobicContact CE1-CG 4.1Å; F167-L171 HydrophobicContact CZ-CD1 3.86Å; F167-L171 HydrophobicContact CZ-CD2 4.2Å; F167-L171 HydrophobicContact CZ-CG 4.14Å; F167-L171 WeakPolarHBondContact O-CG 3.18Å; F167-L171 PolarHBondContact O-N 3.22Å; S168-L171 PolarHBondContact O-N 3.14Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 3.16Å; L171-V173 VanDerWaalsContact C-N 3.34Å
172	S	85.1	Confident	81.2	Confident	85 Å²	85	67.4 Å²	67.4	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-75.3	-18.2	177	79.1	0	0	0	0	114.6	S168 E169 A170 P174	S168-S172 PolarHBondContact O-N 2.9Å; E169-S172 WeakPolarHBondContact O-CB 3.49Å; E169-S172 PolarHBondContact O-N 3.39Å; E169-S172 PolarHBondContact O-OG 3.4Å; A170-S172 PolarHBondContact O-N 3.28Å; S172-P174 WeakPolarHBondContact O-CD 3.44Å
173	V	85	Confident	82.1	Confident	33 Å²	33	67.7 Å²	67.7	20%	0.2	38%	0.375	C	S	.	.			trans	-73.3	113.9	-176.1	-179.1	0	0	0	0	111.5	R56 E169 A170 L171 Q175 D176 L177 F180	R56-V173 PolarHBondContact NH1-O 3.29Å; R56-V173 PolarHBondContact NH2-O 3.47Å; E169-V173 PolarHBondContact O-N 2.75Å; A170-V173 WeakPolarHBondContact O-CB 3.35Å; A170-V173 PolarHBondContact O-N 2.89Å; A170-V173 VanDerWaalsContact O-N 3.13Å; L171-V173 VanDerWaalsContact C-N 3.34Å; V173-Q175 VanDerWaalsContact C-N 3.31Å; V173-Q175 PolarHBondContact O-N 2.91Å; V173-Q175 VanDerWaalsContact O-N 3.08Å; V173-D176 VanDerWaalsContact CG1-O 3.28Å; V173-D176 WeakPolarHBondContact CG1-O 3.38Å; V173-L177 HydrophobicContact CB-CD2 3.97Å; V173-L177 HydrophobicContact CG1-CD2 4.43Å; V173-L177 HydrophobicContact CG2-CD2 4.17Å; V173-F180 HydrophobicContact CG2-CB 4.07Å; V173-F180 HydrophobicContact CG2-CD2 4.28Å; V173-F180 HydrophobicContact CG2-CG 4.35Å
174	P	71.8	Confident	82.8	Confident	115 Å²	115	65.2 Å²	65.2	75%	0.747	36%	0.362	S	S	*	.	S	Bend	trans	-65.8	-22.7	-163.3	-24.9	34.4	0	0	0	117	S172	S172-P174 WeakPolarHBondContact O-CD 3.44Å
175	Q	73	Confident	82.8	Confident	175 Å²	175	68.3 Å²	68.3	82%	0.818	37%	0.369	S	S	*	.	S	Bend	trans	-131.1	-70.6	-164.8	-71.1	176.6	-0.4	0	0	112.7	V173	V173-Q175 VanDerWaalsContact C-N 3.31Å; V173-Q175 PolarHBondContact O-N 2.91Å; V173-Q175 VanDerWaalsContact O-N 3.08Å
176	D	82.3	Confident	82.7	Confident	66 Å²	66	70.5 Å²	70.5	35%	0.353	37%	0.371	S	S	.	.			trans	-132.7	131.6	-172	-177.8	7.4	0	0	0	109.6	N49 V173 S178	N49-D176 PolarHBondContact ND2-OD1 3.47Å; N49-D176 PolarHBondContact OD1-OD1 2.77Å; V173-D176 VanDerWaalsContact CG1-O 3.28Å; V173-D176 WeakPolarHBondContact CG1-O 3.38Å; D176-S178 PolarHBondContact O-N 3.33Å; D176-S178 WeakPolarHBondContact OD1-CB 3.32Å; D176-S178 PolarHBondContact OD1-N 3.05Å; D176-S178 PolarHBondContact OD1-OG 3.33Å; D176-S178 VanDerWaalsContact OD2-CB 3.25Å; D176-S178 WeakPolarHBondContact OD2-CB 3.14Å; D176-S178 PolarHBondContact OD2-OG 2.91Å
177	L	87.7	Confident	82.4	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	38%	0.384	C	S	.	.	S	Bend	trans	-76.5	-6.5	175.3	-66.6	-179.6	0	0	0	113.5	A48 N49 T52 A170 V173 A179 F180 F181	A48-L177 HydrophobicContact CB-CD1 4.07Å; N49-L177 WeakPolarHBondContact OD1-CB 3.32Å; N49-L177 WeakPolarHBondContact OD1-CG 3.37Å; N49-L177 PolarHBondContact OD1-N 3.37Å; T52-L177 HydrophobicContact CG2-CD1 4.11Å; T52-L177 HydrophobicContact CG2-CD2 4.46Å; T52-L177 HydrophobicContact CG2-CG 4.45Å; T52-L177 WeakPolarHBondContact OG1-CD1 3.35Å; A170-L177 HydrophobicContact CB-CD1 4.45Å; A170-L177 HydrophobicContact CB-CD2 3.78Å; A170-L177 VanDerWaalsContact O-CD2 3.32Å; A170-L177 WeakPolarHBondContact O-CD2 3.47Å; V173-L177 HydrophobicContact CB-CD2 3.97Å; V173-L177 HydrophobicContact CG1-CD2 4.43Å; V173-L177 HydrophobicContact CG2-CD2 4.17Å; L177-A179 PolarHBondContact O-N 3.27Å; L177-F180 HydrophobicContact CD2-CB 4.26Å; L177-F180 HydrophobicContact CD2-CD1 4.14Å; L177-F180 HydrophobicContact CD2-CG 4.32Å; L177-F180 CarbonylContact O-C 3.54Å; L177-F180 WeakPolarHBondContact O-CA 3.38Å; L177-F180 WeakPolarHBondContact O-CB 3.46Å; L177-F180 PolarHBondContact O-N 3.45Å; L177-F181 HydrophobicContact CB-CD2 3.56Å; L177-F181 HydrophobicContact CB-CE2 3.38Å; L177-F181 HydrophobicContact CB-CZ 4.35Å; L177-F181 HydrophobicContact CD1-CE2 3.73Å; L177-F181 HydrophobicContact CD1-CZ 4.05Å; L177-F181 HydrophobicContact CG-CE2 4.21Å; L177-F181 WeakPolarHBondContact O-CD2 2.97Å; L177-F181 PolarHBondContact O-N 2.95Å
178	S	84.8	Confident	81.8	Confident	34 Å²	34	74.1 Å²	74.1	24%	0.238	38%	0.383	C	S	.	.	H	α-helix	trans	-50.2	-51.9	179.6	61.2	0	0	0	0	112.8	D176 F180 F181 Q182	D176-S178 PolarHBondContact O-N 3.33Å; D176-S178 WeakPolarHBondContact OD1-CB 3.32Å; D176-S178 PolarHBondContact OD1-N 3.05Å; D176-S178 PolarHBondContact OD1-OG 3.33Å; D176-S178 VanDerWaalsContact OD2-CB 3.25Å; D176-S178 WeakPolarHBondContact OD2-CB 3.14Å; D176-S178 PolarHBondContact OD2-OG 2.91Å; S178-F180 VanDerWaalsContact C-N 3.35Å; S178-F180 PolarHBondContact O-N 3.36Å; S178-F181 PolarHBondContact O-N 2.88Å; S178-Q182 WeakPolarHBondContact O-CG 3.45Å; S178-Q182 PolarHBondContact O-N 3.44Å
179	A	84.8	Confident	80.5	Confident	61 Å²	61	72.3 Å²	72.3	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-39	177	0	0	0	0	0	112.4	L177 Q182 E183	L177-A179 PolarHBondContact O-N 3.27Å; A179-Q182 PolarHBondContact O-N 2.85Å; A179-E183 WeakPolarHBondContact O-CB 3.35Å; A179-E183 PolarHBondContact O-N 2.97Å
180	F	88	Confident	78.9	Confident	28 Å²	28	77.2 Å²	77.2	12%	0.123	40%	0.395	C	S	.	.	H	α-helix	trans	-62.5	-43.5	175.2	170.1	-94.4	0	0	0	111.6	M166 E169 A170 V173 L177 S178 E183 A184	M166-F180 HydrophobicContact CB-CZ 4.32Å; M166-F180 WeakPolarHBondContact O-CZ 3.25Å; E169-F180 HydrophobicContact CB-CE2 3.87Å; E169-F180 HydrophobicContact CB-CZ 4.49Å; E169-F180 HydrophobicContact CG-CD2 4.16Å; E169-F180 HydrophobicContact CG-CE2 3.65Å; A170-F180 HydrophobicContact CB-CD1 4.13Å; A170-F180 HydrophobicContact CB-CE1 3.71Å; A170-F180 HydrophobicContact CB-CE2 4.5Å; A170-F180 HydrophobicContact CB-CZ 3.92Å; V173-F180 HydrophobicContact CG2-CB 4.07Å; V173-F180 HydrophobicContact CG2-CD2 4.28Å; V173-F180 HydrophobicContact CG2-CG 4.35Å; L177-F180 HydrophobicContact CD2-CB 4.26Å; L177-F180 HydrophobicContact CD2-CD1 4.14Å; L177-F180 HydrophobicContact CD2-CG 4.32Å; L177-F180 CarbonylContact O-C 3.54Å; L177-F180 WeakPolarHBondContact O-CA 3.38Å; L177-F180 WeakPolarHBondContact O-CB 3.46Å; L177-F180 PolarHBondContact O-N 3.45Å; S178-F180 VanDerWaalsContact C-N 3.35Å; S178-F180 PolarHBondContact O-N 3.36Å; F180-E183 PolarHBondContact O-N 3.14Å; F180-A184 VanDerWaalsContact O-CB 3.25Å; F180-A184 WeakPolarHBondContact O-CB 3.3Å; F180-A184 PolarHBondContact O-N 3.02Å
181	F	86.5	Confident	77.2	Confident	42 Å²	42	87.2 Å²	87.2	18%	0.184	43%	0.431	C	S	.	.	H	α-helix	trans	-70.7	-36.1	178	-75.2	-59.1	0	0	0	112.8	F44 I45 A48 L177 S178 Y185	F44-F181 HydrophobicContact CE1-CD1 4.18Å; F44-F181 HydrophobicContact CE1-CD2 4.49Å; F44-F181 AromaticContact CE1-CE1 3.93Å; F44-F181 HydrophobicContact CE1-CE1 3.93Å; F44-F181 HydrophobicContact CE1-CE2 4.22Å; F44-F181 HydrophobicContact CE1-CG 4.45Å; F44-F181 AromaticContact CE1-CZ 3.94Å; F44-F181 HydrophobicContact CE1-CZ 3.94Å; F44-F181 HydrophobicContact CZ-CE1 4.08Å; F44-F181 HydrophobicContact CZ-CZ 4.14Å; I45-F181 HydrophobicContact CD1-CB 3.79Å; I45-F181 HydrophobicContact CD1-CD2 3.18Å; I45-F181 HydrophobicContact CD1-CE2 3.91Å; I45-F181 HydrophobicContact CD1-CG 3.71Å; A48-F181 HydrophobicContact CB-CE2 3.43Å; A48-F181 VanDerWaalsContact CB-CE2 3.43Å; A48-F181 HydrophobicContact CB-CZ 3.56Å; L177-F181 HydrophobicContact CB-CD2 3.56Å; L177-F181 HydrophobicContact CB-CE2 3.38Å; L177-F181 HydrophobicContact CB-CZ 4.35Å; L177-F181 HydrophobicContact CD1-CE2 3.73Å; L177-F181 HydrophobicContact CD1-CZ 4.05Å; L177-F181 HydrophobicContact CG-CE2 4.21Å; L177-F181 WeakPolarHBondContact O-CD2 2.97Å; L177-F181 PolarHBondContact O-N 2.95Å; S178-F181 PolarHBondContact O-N 2.88Å; F181-Y185 VanDerWaalsContact O-CB 3.22Å; F181-Y185 WeakPolarHBondContact O-CB 3.25Å; F181-Y185 PolarHBondContact O-N 3.32Å
182	Q	84.5	Confident	75.3	Confident	107 Å²	107	95.7 Å²	95.7	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-60.6	-49	171.7	-74.2	175.7	3.8	0	0	110.4	S178 A179 Y185 F186	S178-Q182 WeakPolarHBondContact O-CG 3.45Å; S178-Q182 PolarHBondContact O-N 3.44Å; A179-Q182 PolarHBondContact O-N 2.85Å; Q182-Y185 WeakPolarHBondContact O-CB 3.47Å; Q182-Y185 PolarHBondContact O-N 2.82Å; Q182-F186 WeakPolarHBondContact O-CD2 3.4Å; Q182-F186 PolarHBondContact O-N 3.43Å
183	E	84.4	Confident	72.9	Confident	85 Å²	85	96.5 Å²	96.5	40%	0.397	47%	0.465	S	S	.	.	H	α-helix	trans	-62.8	-45.7	177.4	179.7	61.3	-166.1	0	0	111.9	A179 F180 Y185 F186 R187	A179-E183 WeakPolarHBondContact O-CB 3.35Å; A179-E183 PolarHBondContact O-N 2.97Å; F180-E183 PolarHBondContact O-N 3.14Å; E183-Y185 VanDerWaalsContact C-N 3.28Å; E183-Y185 PolarHBondContact O-N 2.83Å; E183-F186 PolarHBondContact O-N 3.39Å; E183-F186 VanDerWaalsContact O-N 3.09Å; E183-R187 HydrophobicContact CG-CG 4.39Å; E183-R187 WeakPolarHBondContact O-CG 3.35Å; E183-R187 PolarHBondContact O-N 2.74Å; E183-R187 IonicContact OE1-CZ 2.91Å; E183-R187 VanDerWaalsContact OE1-CZ 3.32Å; E183-R187 IonicContact OE1-NE 2.74Å; E183-R187 PolarHBondContact OE1-NE 3.06Å; E183-R187 IonicContact OE1-NH2 3.06Å; E183-R187 PolarHBondContact OE1-NH2 3.26Å
184	A	82.3	Confident	70.7	Confident	19 Å²	19	100.1 Å²	100.1	16%	0.157	49%	0.492	C	S	.	.	H	α-helix	trans	-60.9	-38.7	176.1	0	0	0	0	0	111.6	F180 F186 R187 H188	F180-A184 VanDerWaalsContact O-CB 3.25Å; F180-A184 WeakPolarHBondContact O-CB 3.3Å; F180-A184 PolarHBondContact O-N 3.02Å; A184-F186 VanDerWaalsContact C-N 3.33Å; A184-F186 PolarHBondContact O-N 3.06Å; A184-R187 PolarHBondContact O-N 3.23Å; A184-H188 WeakPolarHBondContact O-CB 3.28Å; A184-H188 PolarHBondContact O-CD2 2.63Å; A184-H188 VanDerWaalsContact O-CD2 3.29Å; A184-H188 PolarHBondContact O-N 3.44Å
185	Y	76.6	Confident	69.2	Low	171 Å²	171	102.8 Å²	102.8	67%	0.671	49%	0.494	S	S	*	.	H	α-helix	trans	-60.7	-41.1	173.7	-177	-97.1	0	0	0	111.5	F181 Q182 E183 G189	F181-Y185 VanDerWaalsContact O-CB 3.22Å; F181-Y185 WeakPolarHBondContact O-CB 3.25Å; F181-Y185 PolarHBondContact O-N 3.32Å; Q182-Y185 WeakPolarHBondContact O-CB 3.47Å; Q182-Y185 PolarHBondContact O-N 2.82Å; E183-Y185 VanDerWaalsContact C-N 3.28Å; E183-Y185 PolarHBondContact O-N 2.83Å; Y185-G189 WeakPolarHBondContact O-CA 3.41Å; Y185-G189 PolarHBondContact O-N 2.87Å
186	F	77.9	Confident	67.5	Low	134 Å²	134	98.4 Å²	98.4	59%	0.588	48%	0.476	S	S	*	.	H	α-helix	trans	-71.1	-39.7	175.3	-70.4	-65.7	0	0	0	113.4	Q182 E183 A184	Q182-F186 WeakPolarHBondContact O-CD2 3.4Å; Q182-F186 PolarHBondContact O-N 3.43Å; E183-F186 PolarHBondContact O-N 3.39Å; E183-F186 VanDerWaalsContact O-N 3.09Å; A184-F186 VanDerWaalsContact C-N 3.33Å; A184-F186 PolarHBondContact O-N 3.06Å
187	R	75.5	Confident	65.7	Low	131 Å²	131	103.2 Å²	103.2	49%	0.494	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-43.6	179	-72.6	-178.3	-177.7	176.2	8.1	112.3	E169 E183 A184	E169-R187 IonicContact OE1-NH1 2.89Å; E169-R187 PolarHBondContact OE1-NH1 3.25Å; E183-R187 HydrophobicContact CG-CG 4.39Å; E183-R187 WeakPolarHBondContact O-CG 3.35Å; E183-R187 PolarHBondContact O-N 2.74Å; E183-R187 IonicContact OE1-CZ 2.91Å; E183-R187 VanDerWaalsContact OE1-CZ 3.32Å; E183-R187 IonicContact OE1-NE 2.74Å; E183-R187 PolarHBondContact OE1-NE 3.06Å; E183-R187 IonicContact OE1-NH2 3.06Å; E183-R187 PolarHBondContact OE1-NH2 3.26Å; A184-R187 PolarHBondContact O-N 3.23Å
188	H	68.6	Low	63.6	Low	69 Å²	69	109.4 Å²	109.4	32%	0.319	53%	0.534	S	S	.	.	H	α-helix	trans	-102.5	-22.1	-172.9	-63	-78.8	0	0	0	113.6	M166 A184 K190 R191	M166-H188 WeakPolarHBondContact CE-CE1 3.4Å; M166-H188 VanDerWaalsContact CE-NE2 3.31Å; M166-H188 WeakPolarHBondContact CE-NE2 3.4Å; A184-H188 WeakPolarHBondContact O-CB 3.28Å; A184-H188 PolarHBondContact O-CD2 2.63Å; A184-H188 VanDerWaalsContact O-CD2 3.29Å; A184-H188 PolarHBondContact O-N 3.44Å; H188-K190 VanDerWaalsContact C-N 3.26Å; H188-K190 PolarHBondContact O-N 2.83Å; H188-R191 PolarHBondContact O-N 3.08Å
189	G	58.6	Low	61.7	Low	29 Å²	29	111.7 Å²	111.7	30%	0.299	54%	0.544	S	S	.	.	H	α-helix	trans	-63.1	-31.5	177.7	0	0	0	0	0	112.9	Y185 R191 R192	Y185-G189 WeakPolarHBondContact O-CA 3.41Å; Y185-G189 PolarHBondContact O-N 2.87Å; G189-R191 PolarHBondContact O-N 2.67Å; G189-R192 PolarHBondContact O-N 3.13Å
190	K	48.9	Very low	59.9	Low	177 Å²	177	116.7 Å²	116.7	77%	0.77	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-19	174.3	-71	-175.3	179.5	176.8	0	113.9	H188	H188-K190 VanDerWaalsContact C-N 3.26Å; H188-K190 PolarHBondContact O-N 2.83Å
191	R	49	Very low	57.9	Low	218 Å²	218	120.5 Å²	120.5	82%	0.823	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-7.3	179.2	-71.4	-166.3	167.8	-167.5	-1.6	114.3	H188 G189	H188-R191 PolarHBondContact O-N 3.08Å; G189-R191 PolarHBondContact O-N 2.67Å
192	R	46	Very low	56.3	Low	229 Å²	229	122.6 Å²	122.6	86%	0.864	59%	0.593	S	S	*	*	S	Bend	trans	-106.4	1.9	178.3	-67.7	-171.3	171	-141.3	-1.6	114.1	G189	G189-R192 PolarHBondContact O-N 3.13Å
193	S	35.8	Very low	54.8	Low	102 Å²	102	120.5 Å²	120.5	71%	0.713	59%	0.594	S	S	*	*			trans	-127.2	65.2	-177.8	176	0	0	0	0	111.8
194	S	38.3	Very low	53.2	Low	108 Å²	108	121 Å²	121	76%	0.755	60%	0.602	S	S	*	*			trans	-143.8	25.3	160.4	81.3	0	0	0	0	112.6	N196	S194-N196 VanDerWaalsContact C-N 3.31Å; S194-N196 PolarHBondContact O-N 2.71Å; S194-N196 VanDerWaalsContact O-N 3.09Å
195	H	40.9	Very low	51.8	Low	171 Å²	171	129.1 Å²	129.1	79%	0.792	63%	0.629	S	S	*	*	S	Bend	trans	-79.7	92.8	164.3	-164	-75.2	0	0	0	107.5	L197	H195-L197 PolarHBondContact O-N 3.49Å
196	N	36.3	Very low	50.8	Low	84 Å²	84	129.4 Å²	129.4	45%	0.449	63%	0.633	S	S	.	*			trans	-10.3	107.9	166.1	-92.5	-33.8	0	0	0	114.2	S194 D198 D199	S194-N196 VanDerWaalsContact C-N 3.31Å; S194-N196 PolarHBondContact O-N 2.71Å; S194-N196 VanDerWaalsContact O-N 3.09Å; N196-D198 PolarHBondContact O-N 3.23Å; N196-D199 HydrophobicContact CB-CB 3.75Å; N196-D199 PolarHBondContact ND2-OD2 3.19Å
197	L	45.5	Very low	49.5	Very low	166 Å²	166	133.5 Å²	133.5	87%	0.869	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-8.1	157.4	-90.2	159.8	0	0	0	111.7	H195	H195-L197 PolarHBondContact O-N 3.49Å
198	D	43.6	Very low	48.2	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-9.6	177	-69.8	-56.5	0	0	0	115	N196	N196-D198 PolarHBondContact O-N 3.23Å
199	D	44.7	Very low	47.7	Very low	83 Å²	83	143 Å²	143	44%	0.444	69%	0.685	S	S	.	*	H	α-helix	trans	-86	-10.9	177.2	-101.8	-44	0	0	0	112.8	N196	N196-D199 HydrophobicContact CB-CB 3.75Å; N196-D199 PolarHBondContact ND2-OD2 3.19Å
200	F	45.4	Very low	47.4	Very low	166 Å²	166	152.4 Å²	152.4	73%	0.728	71%	0.711	S	S	*	*	H	α-helix	trans	-75	-30.2	179	-141.2	-92.7	0	0	0	111.8	V204	F200-V204 WeakPolarHBondContact O-CG2 3.32Å
201	D	47.2	Very low	47.5	Very low	107 Å²	107	153.3 Å²	153.3	57%	0.572	74%	0.738	S	S	*	*	H	α-helix	trans	-82	-25.7	-176.1	-117.6	-36.3	0	0	0	113.6
202	T	52.6	Low	47.4	Very low	87 Å²	87	150.1 Å²	150.1	53%	0.534	73%	0.734	S	S	.	*	H	α-helix	trans	-86.4	-24.4	177.5	35	0	0	0	0	113.1
203	A	52.5	Low	47.5	Very low	63 Å²	63	145.9 Å²	145.9	52%	0.521	73%	0.727	S	S	.	*	H	α-helix	trans	-76.5	-30.6	177.7	0	0	0	0	0	113.3
204	V	50.7	Low	48.2	Very low	94 Å²	94	148.3 Å²	148.3	57%	0.57	73%	0.727	S	S	*	*	H	α-helix	trans	-76.6	-33.1	179.7	175.1	0	0	0	0	111.9	F200 K206	F200-V204 WeakPolarHBondContact O-CG2 3.32Å; V204-K206 VanDerWaalsContact C-N 3.34Å; V204-K206 PolarHBondContact O-N 3.02Å
205	R	53.8	Low	48.7	Very low	191 Å²	191	150.7 Å²	150.7	72%	0.721	73%	0.726	S	S	*	*	H	α-helix	trans	-74.8	-17.8	179.9	-68.4	-178.4	-177.3	175.2	4	114.6
206	K	54.2	Low	49.2	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-14	-178.9	-109.6	175.8	179.7	172.8	0	114.6	V204	V204-K206 VanDerWaalsContact C-N 3.34Å; V204-K206 PolarHBondContact O-N 3.02Å
207	R	51.3	Low	50.1	Low	220 Å²	220	153.8 Å²	153.8	83%	0.83	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-14	179.5	-81.4	-179.9	172.6	170.9	-1.6	114.8	R209	R207-R209 PolarHBondContact O-N 2.63Å
208	Q	49.4	Very low	50.4	Low	170 Å²	170	152.9 Å²	152.9	79%	0.794	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-2.5	179.9	-159.6	69.7	20.8	0	0	114.3
209	R	57	Low	50.9	Low	230 Å²	230	154.5 Å²	154.5	87%	0.868	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	19.4	-176.8	-68.7	-169	173	-171.7	-1.6	114.5	R207	R207-R209 PolarHBondContact O-N 2.63Å
210	R	52.8	Low	51.5	Low	226 Å²	226	160.5 Å²	160.5	85%	0.853	76%	0.757	S	S	*	*			trans	-126.1	18.1	-176	-76.8	-166.1	176	-164.9	-0.7	115
211	C	50.8	Low	52	Low	196 Å²	196	160 Å²	160	100%	1.324	76%	0.759	S	S	*	*			trans	-135.2	0	174.2	-60.4	0	0	0	0	109.3

Retrieved 211 of 211 residues in 91.2 ms (Link to these results)

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