A0A5K4FD32_SCHMA Loading...

BHLH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FD32, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 195 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	46.3	Very low	63.7	Low	214 Å²	214	131.2 Å²	131.2	100%	1.054	63%	0.632	S	S	*	*				0	114.1	0	-82.2	-80.2	136.7	0	0	109
2	S	49.2	Very low	64.7	Low	70 Å²	70	130.8 Å²	130.8	49%	0.49	63%	0.634	S	S	.	*			trans	-64.6	131.1	-176.8	169.5	0	0	0	0	111.4	N4 R5	S2-N4 PolarHBondContact O-N 3.37Å; S2-N4 PolarHBondContact OG-N 3.48Å; S2-R5 PolarHBondContact O-N 2.89Å; S2-R5 VanDerWaalsContact O-N 3.13Å
3	R	58.5	Low	65.6	Low	220 Å²	220	128.2 Å²	128.2	83%	0.83	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	-26	179.4	-76.6	-179.4	177.1	153.5	-0.7	112.8	R5 I6	R3-R5 VanDerWaalsContact C-N 3.35Å; R3-R5 PolarHBondContact O-N 3.44Å; R3-I6 PolarHBondContact O-N 2.96Å
4	N	58	Low	65.8	Low	117 Å²	117	127.1 Å²	127.1	63%	0.626	61%	0.606	S	S	*	*	H	α-helix	trans	-69	-29.4	-176.9	-66.6	-7.1	0	0	0	113	S2 I6 R7	S2-N4 PolarHBondContact O-N 3.37Å; S2-N4 PolarHBondContact OG-N 3.48Å; N4-I6 VanDerWaalsContact C-N 3.28Å; N4-I6 PolarHBondContact O-N 3.28Å; N4-R7 PolarHBondContact O-N 3.32Å
5	R	60.2	Low	66.3	Low	183 Å²	183	128.2 Å²	128.2	69%	0.691	61%	0.607	S	S	*	*	H	α-helix	trans	-69.3	-26.1	179.1	-69.4	-166.9	-161.1	-164	5.5	113.1	S2 R3	S2-R5 PolarHBondContact O-N 2.89Å; S2-R5 VanDerWaalsContact O-N 3.13Å; R3-R5 VanDerWaalsContact C-N 3.35Å; R3-R5 PolarHBondContact O-N 3.44Å
6	I	59.6	Low	66.5	Low	86 Å²	86	127.9 Å²	127.9	44%	0.441	61%	0.609	S	S	.	*	H	α-helix	trans	-74.2	-29.8	-176.1	-58.8	171.9	0	0	0	111.4	R3 N4 N8 L9 R14	R3-I6 PolarHBondContact O-N 2.96Å; N4-I6 VanDerWaalsContact C-N 3.28Å; N4-I6 PolarHBondContact O-N 3.28Å; I6-N8 VanDerWaalsContact C-N 3.28Å; I6-N8 PolarHBondContact O-N 3.22Å; I6-L9 PolarHBondContact O-N 3.15Å; I6-R14 HydrophobicContact CG2-CG 4.23Å
7	R	66.4	Low	66.3	Low	207 Å²	207	125.1 Å²	125.1	78%	0.781	60%	0.598	S	S	*	*	H	α-helix	trans	-66.8	-29.9	179.1	-80.3	-172.5	178.7	-179.1	-0.1	113	N4 L9	N4-R7 PolarHBondContact O-N 3.32Å; R7-L9 VanDerWaalsContact C-N 3.27Å; R7-L9 PolarHBondContact O-N 3.18Å
8	N	74.7	Confident	66.1	Low	147 Å²	147	122.4 Å²	122.4	79%	0.786	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-1.4	-177.7	-62.9	-3.1	0	0	0	113.2	I6	I6-N8 VanDerWaalsContact C-N 3.28Å; I6-N8 PolarHBondContact O-N 3.22Å
9	L	73.5	Confident	65.6	Low	51 Å²	51	123.6 Å²	123.6	27%	0.267	59%	0.593	S	S	.	*	S	Bend	trans	-85.5	145.1	-179.1	-63.8	174.3	0	0	0	111.3	I6 R7 Q13 R14 L17	I6-L9 PolarHBondContact O-N 3.15Å; R7-L9 VanDerWaalsContact C-N 3.27Å; R7-L9 PolarHBondContact O-N 3.18Å; L9-Q13 HydrophobicContact CB-CB 3.98Å; L9-Q13 VanDerWaalsContact CD2-OE1 3.31Å; L9-R14 HydrophobicContact CB-CG 4.16Å; L9-R14 PolarHBondContact O-NE 3.41Å; L9-R14 PolarHBondContact O-NH2 3.41Å; L9-L17 HydrophobicContact CD1-CD1 3.33Å
10	S	78.1	Confident	65.1	Low	53 Å²	53	127.7 Å²	127.7	37%	0.371	60%	0.602	S	S	.	*			trans	-59.1	153.1	176.4	76	0	0	0	0	110.6	I12 Q13 R14	S10-I12 PolarHBondContact O-N 3.24Å; S10-I12 VanDerWaalsContact O-N 3.1Å; S10-Q13 VanDerWaalsContact N-OE1 3.16Å; S10-Q13 PolarHBondContact O-N 3.34Å; S10-Q13 WeakPolarHBondContact OG-CG 3.23Å; S10-Q13 PolarHBondContact OG-N 3.02Å; S10-Q13 PolarHBondContact OG-OE1 3Å; S10-R14 PolarHBondContact O-N 3.09Å
11	P	76	Confident	64.5	Low	95 Å²	95	125.3 Å²	125.3	62%	0.617	60%	0.598	S	S	*	*	H	α-helix	trans	-53	-34.4	-179.5	-27.8	35.2	0	0	0	113.6	K15	P11-K15 PolarHBondContact O-N 2.94Å; P11-K15 VanDerWaalsContact O-N 3.08Å
12	I	76	Confident	64.7	Low	127 Å²	127	121.2 Å²	121.2	65%	0.651	58%	0.577	S	S	*	*	H	α-helix	trans	-68.4	-45.7	178.6	-58.8	173.8	0	0	0	110.8	S10 R14 K15 L16	S10-I12 PolarHBondContact O-N 3.24Å; S10-I12 VanDerWaalsContact O-N 3.1Å; I12-R14 PolarHBondContact O-N 3.42Å; I12-K15 PolarHBondContact O-N 3.16Å; I12-L16 HydrophobicContact CG2-CD1 4.19Å; I12-L16 PolarHBondContact O-N 2.95Å
13	Q	75.9	Confident	64.9	Low	96 Å²	96	121.7 Å²	121.7	45%	0.449	58%	0.58	S	S	.	*	H	α-helix	trans	-62.9	-40.8	176.8	-72.4	171.8	-26	0	0	111.8	L9 S10 K15 L16 L17	L9-Q13 HydrophobicContact CB-CB 3.98Å; L9-Q13 VanDerWaalsContact CD2-OE1 3.31Å; S10-Q13 VanDerWaalsContact N-OE1 3.16Å; S10-Q13 PolarHBondContact O-N 3.34Å; S10-Q13 WeakPolarHBondContact OG-CG 3.23Å; S10-Q13 PolarHBondContact OG-N 3.02Å; S10-Q13 PolarHBondContact OG-OE1 3Å; Q13-K15 VanDerWaalsContact C-N 3.34Å; Q13-K15 PolarHBondContact O-N 3.32Å; Q13-L16 PolarHBondContact O-N 3.39Å; Q13-L17 PolarHBondContact O-N 2.92Å
14	R	69.6	Low	64.5	Low	113 Å²	113	115 Å²	115	43%	0.426	56%	0.564	S	S	.	*	H	α-helix	trans	-60.1	-41.6	174	-82.8	-173.2	-90.1	154.1	-9.1	112.2	I6 L9 S10 I12 L17 T18	I6-R14 HydrophobicContact CG2-CG 4.23Å; L9-R14 HydrophobicContact CB-CG 4.16Å; L9-R14 PolarHBondContact O-NE 3.41Å; L9-R14 PolarHBondContact O-NH2 3.41Å; S10-R14 PolarHBondContact O-N 3.09Å; I12-R14 PolarHBondContact O-N 3.42Å; R14-L17 PolarHBondContact O-N 3.33Å; R14-T18 WeakPolarHBondContact O-CG2 3.24Å; R14-T18 PolarHBondContact O-N 2.73Å; R14-T18 PolarHBondContact O-OG1 2.92Å
15	K	72.5	Confident	64.2	Low	144 Å²	144	117.1 Å²	117.1	63%	0.626	57%	0.568	S	S	*	*	H	α-helix	trans	-66.7	-37.8	178.1	-164.2	173.2	-176.5	177.2	0	112.3	P11 I12 Q13 T18 K19	P11-K15 PolarHBondContact O-N 2.94Å; P11-K15 VanDerWaalsContact O-N 3.08Å; I12-K15 PolarHBondContact O-N 3.16Å; Q13-K15 VanDerWaalsContact C-N 3.34Å; Q13-K15 PolarHBondContact O-N 3.32Å; K15-T18 WeakPolarHBondContact CA-OG1 3.39Å; K15-T18 PolarHBondContact O-OG1 3.47Å; K15-K19 WeakPolarHBondContact O-CG 3.28Å; K15-K19 PolarHBondContact O-N 3.31Å
16	L	69.6	Low	63.8	Low	123 Å²	123	116.5 Å²	116.5	64%	0.644	57%	0.57	S	S	*	*	H	α-helix	trans	-66.2	-44.8	175.1	-102.5	132.2	0	0	0	112.6	I12 Q13 K19 R20	I12-L16 HydrophobicContact CG2-CD1 4.19Å; I12-L16 PolarHBondContact O-N 2.95Å; Q13-L16 PolarHBondContact O-N 3.39Å; L16-K19 PolarHBondContact O-N 3.17Å; L16-R20 PolarHBondContact O-N 3.44Å; L16-R20 VanDerWaalsContact O-N 3.1Å
17	L	63.9	Low	63.5	Low	81 Å²	81	118.8 Å²	118.8	42%	0.424	58%	0.582	S	S	.	*	H	α-helix	trans	-64.9	-43	178.8	-80.8	160	0	0	0	112.5	L9 Q13 R14 K19 R20 C21	L9-L17 HydrophobicContact CD1-CD1 3.33Å; Q13-L17 PolarHBondContact O-N 2.92Å; R14-L17 PolarHBondContact O-N 3.33Å; L17-K19 PolarHBondContact O-N 3.31Å; L17-R20 PolarHBondContact O-N 2.96Å; L17-C21 PolarHBondContact O-N 3.4Å
18	T	62.4	Low	62.8	Low	76 Å²	76	114.4 Å²	114.4	47%	0.466	57%	0.574	S	S	.	*	H	α-helix	trans	-64.8	-39.2	178.5	45.8	0	0	0	0	111.9	R14 K15 R20 C21 Q22	R14-T18 WeakPolarHBondContact O-CG2 3.24Å; R14-T18 PolarHBondContact O-N 2.73Å; R14-T18 PolarHBondContact O-OG1 2.92Å; K15-T18 WeakPolarHBondContact CA-OG1 3.39Å; K15-T18 PolarHBondContact O-OG1 3.47Å; T18-R20 PolarHBondContact O-N 3.4Å; T18-C21 PolarHBondContact O-N 3.15Å; T18-Q22 WeakPolarHBondContact O-CG 3.46Å; T18-Q22 PolarHBondContact O-N 3.38Å
19	K	57.2	Low	61.8	Low	145 Å²	145	111.5 Å²	111.5	63%	0.63	57%	0.565	S	S	*	*	H	α-helix	trans	-62.3	-40.4	172.1	-76.6	-167.5	174.2	-166.9	0	112.6	K15 L16 L17	K15-K19 WeakPolarHBondContact O-CG 3.28Å; K15-K19 PolarHBondContact O-N 3.31Å; L16-K19 PolarHBondContact O-N 3.17Å; L17-K19 PolarHBondContact O-N 3.31Å
20	R	53.8	Low	60.8	Low	206 Å²	206	111.5 Å²	111.5	78%	0.777	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-36.3	178.4	-160.2	173.9	-176.4	125.6	-0.8	112.5	L16 L17 T18	L16-R20 PolarHBondContact O-N 3.44Å; L16-R20 VanDerWaalsContact O-N 3.1Å; L17-R20 PolarHBondContact O-N 2.96Å; T18-R20 PolarHBondContact O-N 3.4Å
21	C	53.2	Low	59.5	Low	77 Å²	77	115.9 Å²	115.9	52%	0.52	60%	0.596	S	S	.	*	H	α-helix	trans	-76.2	-29.2	177.4	-78.7	0	0	0	0	114.3	L17 T18 T24 F25	L17-C21 PolarHBondContact O-N 3.4Å; T18-C21 PolarHBondContact O-N 3.15Å; C21-T24 PolarHBondContact O-OG1 3.36Å; C21-F25 PolarHBondContact O-N 3.16Å
22	Q	51.4	Low	58.4	Low	129 Å²	129	116.2 Å²	116.2	60%	0.603	59%	0.592	S	S	*	*	H	α-helix	trans	-71.4	-31	-179.8	-77.5	-178.2	3	0	0	113.1	T18 K26	T18-Q22 WeakPolarHBondContact O-CG 3.46Å; T18-Q22 PolarHBondContact O-N 3.38Å; Q22-K26 PolarHBondContact O-N 3.48Å
23	S	51.8	Low	57.4	Low	79 Å²	79	118.9 Å²	118.9	55%	0.552	60%	0.599	S	S	*	*	H	α-helix	trans	-64.2	-44	176.9	178.6	0	0	0	0	111.8
24	T	50.5	Low	56.2	Low	79 Å²	79	121.7 Å²	121.7	49%	0.485	62%	0.617	S	S	.	*	H	α-helix	trans	-76	-31.8	-179.1	51.8	0	0	0	0	113.1	C21 K26 L27	C21-T24 PolarHBondContact O-OG1 3.36Å; T24-K26 PolarHBondContact O-N 3.26Å; T24-L27 PolarHBondContact O-N 3.49Å
25	F	51.4	Low	55.2	Low	163 Å²	163	121.7 Å²	121.7	72%	0.715	63%	0.625	S	S	*	*	H	α-helix	trans	-70.8	-31.2	-179.4	-117.4	-88	0	0	0	113.7	C21 L28 S29	C21-F25 PolarHBondContact O-N 3.16Å; F25-L28 PolarHBondContact O-N 2.93Å; F25-S29 PolarHBondContact O-N 3.44Å
26	K	51.9	Low	54.2	Low	170 Å²	170	125.6 Å²	125.6	74%	0.739	64%	0.636	S	S	*	*	H	α-helix	trans	-73.7	-27.4	177.3	-74.3	-172.2	177.8	-175.4	0	113.3	Q22 T24 L28 S29	Q22-K26 PolarHBondContact O-N 3.48Å; T24-K26 PolarHBondContact O-N 3.26Å; K26-L28 VanDerWaalsContact C-N 3.31Å; K26-S29 PolarHBondContact O-OG 2.93Å
27	L	53.5	Low	53.2	Low	133 Å²	133	129.1 Å²	129.1	70%	0.696	65%	0.646	S	S	*	*	H	α-helix	trans	-70.4	-28	175.8	-87.5	156.4	0	0	0	112.6	T24	T24-L27 PolarHBondContact O-N 3.49Å
28	L	53.1	Low	52.7	Low	116 Å²	116	135.9 Å²	135.9	61%	0.607	67%	0.666	S	S	*	*	H	α-helix	trans	-95.2	-15.1	-174.2	-69.9	163.3	0	0	0	114.4	F25 K26 G30	F25-L28 PolarHBondContact O-N 2.93Å; K26-L28 VanDerWaalsContact C-N 3.31Å; L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 3.25Å
29	S	53.2	Low	52.2	Low	86 Å²	86	137.6 Å²	137.6	60%	0.601	68%	0.676	S	S	*	*	S	Bend	trans	-73.8	-19.2	179.4	61.8	0	0	0	0	113.6	F25 K26	F25-S29 PolarHBondContact O-N 3.44Å; K26-S29 PolarHBondContact O-OG 2.93Å
30	G	51.1	Low	51.6	Low	51 Å²	51	136.3 Å²	136.3	53%	0.526	68%	0.684	S	S	.	*	S	Bend	trans	-78	-25.7	179.5	0	0	0	0	0	114.8	L28 N32	L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 3.25Å; G30-N32 VanDerWaalsContact C-N 3.34Å; G30-N32 PolarHBondContact O-N 2.74Å
31	L	52.4	Low	51.5	Low	145 Å²	145	130.2 Å²	130.2	76%	0.759	67%	0.666	S	S	*	*	S	Bend	trans	-85.9	-3.5	-172.4	-66.2	172.2	0	0	0	113.9
32	N	51.8	Low	51.5	Low	101 Å²	101	135.8 Å²	135.8	54%	0.54	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99	20.9	-169.9	-151.5	-11.3	0	0	0	114.4	G30 I35	G30-N32 VanDerWaalsContact C-N 3.34Å; G30-N32 PolarHBondContact O-N 2.74Å; N32-I35 WeakPolarHBondContact OD1-CD1 3.36Å; N32-I35 WeakPolarHBondContact OD1-CG1 3.4Å
33	K	55.8	Low	51.3	Low	183 Å²	183	140.4 Å²	140.4	80%	0.796	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-19.2	178.7	-65.3	-174.1	-178.2	179	0	113.7
34	N	50.9	Low	51.2	Low	155 Å²	155	141.4 Å²	141.4	83%	0.829	69%	0.692	S	S	*	*			trans	-102.5	6.7	-175.9	-63.9	-17.3	0	0	0	113.8	R36	N34-R36 PolarHBondContact O-N 2.81Å
35	I	48.5	Very low	51.1	Low	114 Å²	114	145.3 Å²	145.3	59%	0.585	71%	0.71	S	S	*	*	S	Bend	trans	-67.5	96.3	163.4	-59.4	-167.5	0	0	0	105.2	N32 K37	N32-I35 WeakPolarHBondContact OD1-CD1 3.36Å; N32-I35 WeakPolarHBondContact OD1-CG1 3.4Å; I35-K37 PolarHBondContact O-N 2.83Å
36	R	50.5	Low	51	Low	226 Å²	226	140 Å²	140	85%	0.853	70%	0.701	S	S	*	*			trans	-34.8	110.6	161.3	174.1	-176.9	-76	-176.8	-3.8	104.4	N34 R38	N34-R36 PolarHBondContact O-N 2.81Å; R36-R38 PolarHBondContact O-N 3.28Å
37	K	49.8	Very low	51.2	Low	196 Å²	196	140.2 Å²	140.2	85%	0.852	71%	0.71	S	S	*	*			trans	-57.3	92.3	-177.5	-67.6	-179.2	-179.3	177.3	0	105.2	I35 T39	I35-K37 PolarHBondContact O-N 2.83Å; K37-T39 PolarHBondContact O-N 3.18Å
38	R	52	Low	51.7	Low	224 Å²	224	138.3 Å²	138.3	85%	0.845	71%	0.709	S	S	*	*			trans	-51.9	108.2	158.6	-92.2	-177.1	175.9	149.6	-0.6	101	R36 C40	R36-R38 PolarHBondContact O-N 3.28Å; R38-C40 WeakPolarHBondContact O-CA 3.41Å; R38-C40 PolarHBondContact O-N 2.97Å
39	T	51.6	Low	52.8	Low	111 Å²	111	138.2 Å²	138.2	68%	0.681	72%	0.717	S	S	*	*			trans	-41.4	105	168.2	17.1	0	0	0	0	103.9	K37 L41	K37-T39 PolarHBondContact O-N 3.18Å; T39-L41 VanDerWaalsContact C-N 3.3Å; T39-L41 PolarHBondContact O-N 3.01Å
40	C	46.4	Very low	54	Low	118 Å²	118	136.6 Å²	136.6	80%	0.797	70%	0.702	S	S	*	*			trans	-61.1	107.3	-170.8	-161.9	0	0	0	0	102.4	R38 K42	R38-C40 WeakPolarHBondContact O-CA 3.41Å; R38-C40 PolarHBondContact O-N 2.97Å; C40-K42 PolarHBondContact O-N 3.35Å
41	L	51.6	Low	55.5	Low	79 Å²	79	140.3 Å²	140.3	41%	0.414	70%	0.703	S	S	.	*			trans	-39.5	112.5	-178.4	-123.1	93	0	0	0	104.8	T39 R43 L50 E58	T39-L41 VanDerWaalsContact C-N 3.3Å; T39-L41 PolarHBondContact O-N 3.01Å; L41-R43 PolarHBondContact O-N 2.87Å; L41-L50 HydrophobicContact CD2-CD1 3.58Å; L41-E58 HydrophobicContact CD2-CB 4.02Å; L41-E58 HydrophobicContact CD2-CG 3.99Å
42	K	52.3	Low	57	Low	193 Å²	193	138.3 Å²	138.3	84%	0.839	70%	0.699	S	S	*	*			trans	-50.8	116.7	178	-92.9	-179.9	175.8	176	0	103.3	C40 L44	C40-K42 PolarHBondContact O-N 3.35Å; K42-L44 PolarHBondContact O-N 3.45Å
43	R	47.3	Very low	58.5	Low	227 Å²	227	137.3 Å²	137.3	86%	0.857	69%	0.691	S	S	*	*			trans	-58.4	97.1	177.6	-73.8	-175.6	-176.1	178.1	1.2	104.9	L41 N45	L41-R43 PolarHBondContact O-N 2.87Å; R43-N45 PolarHBondContact O-N 3.35Å; R43-N45 VanDerWaalsContact O-N 3.13Å
44	L	50.5	Low	60	Low	100 Å²	100	131.2 Å²	131.2	52%	0.524	67%	0.665	S	S	.	*			trans	-54.4	123	171.5	-91.7	158.5	0	0	0	104.8	K42 G46	K42-L44 PolarHBondContact O-N 3.45Å; L44-G46 PolarHBondContact O-N 3.17Å
45	N	48.3	Very low	61.6	Low	160 Å²	160	127.2 Å²	127.2	86%	0.856	64%	0.643	S	S	*	*	S	Bend	trans	-22.1	119.6	-168.9	-67.1	-30.3	0	0	0	115.5	R43	R43-N45 PolarHBondContact O-N 3.35Å; R43-N45 VanDerWaalsContact O-N 3.13Å
46	G	49.5	Very low	63.5	Low	51 Å²	51	126.2 Å²	126.2	53%	0.526	64%	0.636	S	S	.	*	S	Bend	trans	91.2	98.9	159.6	0	0	0	0	0	115	L44 S48	L44-G46 PolarHBondContact O-N 3.17Å; G46-S48 PolarHBondContact O-N 3.36Å; G46-S48 PolarHBondContact O-OG 2.67Å
47	N	54.7	Low	65.2	Low	175 Å²	175	115.8 Å²	115.8	94%	0.936	60%	0.598	S	S	*	*	S	Bend	trans	29.9	2.9	148.4	-63.2	-13.9	0	0	0	122.3
48	S	65.3	Low	66.9	Low	94 Å²	94	108.3 Å²	108.3	66%	0.657	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-91.8	127.1	174.9	54.8	0	0	0	0	107	G46 L50	G46-S48 PolarHBondContact O-N 3.36Å; G46-S48 PolarHBondContact O-OG 2.67Å; S48-L50 PolarHBondContact O-N 3Å
49	S	76.1	Confident	68.6	Low	113 Å²	113	104 Å²	104	79%	0.79	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-63.2	130.5	166.6	42.1	0	0	0	0	107.3	K51	S49-K51 PolarHBondContact O-N 3.45Å
50	L	76.8	Confident	70.4	Confident	53 Å²	53	101.2 Å²	101.2	28%	0.277	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-57.4	138.3	170.6	-70.6	174.2	0	0	0	108.7	L41 S48 Q54 I55	L41-L50 HydrophobicContact CD2-CD1 3.58Å; S48-L50 PolarHBondContact O-N 3Å; L50-Q54 HydrophobicContact CB-CB 4.2Å; L50-Q54 HydrophobicContact CD2-CB 4.15Å; L50-I55 HydrophobicContact CB-CD1 4.43Å; L50-I55 HydrophobicContact CB-CG1 3.8Å; L50-I55 HydrophobicContact CD1-CG1 4.43Å
51	K	84.2	Confident	72.3	Confident	129 Å²	129	96.1 Å²	96.1	56%	0.561	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-64.9	152.5	171.1	-63.7	-179.1	-176.1	174.6	0	109	S49 H53 Q54 I55	S49-K51 PolarHBondContact O-N 3.45Å; K51-H53 VanDerWaalsContact C-N 3.29Å; K51-H53 WeakPolarHBondContact CB-CE1 3.45Å; K51-H53 WeakPolarHBondContact CD-CE1 3.35Å; K51-H53 PolarHBondContact O-N 3.07Å; K51-Q54 HydrophobicContact CB-CG 4.28Å; K51-Q54 WeakPolarHBondContact O-CB 3.34Å; K51-Q54 PolarHBondContact O-N 3.44Å; K51-I55 PolarHBondContact O-N 3.4Å
52	P	84.2	Confident	74	Confident	103 Å²	103	100 Å²	100	67%	0.669	51%	0.51	S	S	*	.	H	α-helix	trans	-51.1	-42.6	-178.2	-30.2	36	0	0	0	114.7	Q54 I55 E56	P52-Q54 VanDerWaalsContact C-N 3.32Å; P52-Q54 PolarHBondContact O-N 3.01Å; P52-I55 WeakPolarHBondContact O-CB 3.15Å; P52-I55 PolarHBondContact O-N 2.7Å; P52-E56 PolarHBondContact O-N 3.17Å; P52-E56 VanDerWaalsContact O-N 3.14Å
53	H	83.3	Confident	75.6	Confident	79 Å²	79	96 Å²	96	37%	0.366	50%	0.497	S	S	.	.	H	α-helix	trans	-64.4	-33.5	178.2	57.1	-97.2	0	0	0	113.3	K51 I55 E56 C57 E75	K51-H53 VanDerWaalsContact C-N 3.29Å; K51-H53 WeakPolarHBondContact CB-CE1 3.45Å; K51-H53 WeakPolarHBondContact CD-CE1 3.35Å; K51-H53 PolarHBondContact O-N 3.07Å; H53-I55 VanDerWaalsContact C-N 3.33Å; H53-E56 PolarHBondContact O-N 3.4Å; H53-C57 PolarHBondContact O-N 3.05Å; H53-C57 PolarHBondContact O-SG 2.9Å; H53-E75 IonicContact CD2-OE1 3.5Å; H53-E75 PolarHBondContact CD2-OE1 3.02Å; H53-E75 IonicContact CD2-OE2 3.8Å; H53-E75 IonicContact NE2-OE1 3.6Å; H53-E75 PolarHBondContact NE2-OE1 2.82Å
54	Q	85.4	Confident	77.6	Confident	55 Å²	55	85.3 Å²	85.3	26%	0.257	46%	0.457	S	S	.	.	H	α-helix	trans	-68.1	-37.1	177	-60.6	177.9	-50	0	0	110.9	L50 K51 P52 E56 C57 E58 L73	L50-Q54 HydrophobicContact CB-CB 4.2Å; L50-Q54 HydrophobicContact CD2-CB 4.15Å; K51-Q54 HydrophobicContact CB-CG 4.28Å; K51-Q54 WeakPolarHBondContact O-CB 3.34Å; K51-Q54 PolarHBondContact O-N 3.44Å; P52-Q54 VanDerWaalsContact C-N 3.32Å; P52-Q54 PolarHBondContact O-N 3.01Å; Q54-E56 VanDerWaalsContact C-N 3.32Å; Q54-C57 PolarHBondContact O-N 3.4Å; Q54-E58 WeakPolarHBondContact O-CG 3.48Å; Q54-E58 PolarHBondContact O-N 2.86Å; Q54-L73 HydrophobicContact CB-CD1 4.42Å
55	I	85.7	Confident	79	Confident	72 Å²	72	85 Å²	85	37%	0.369	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-44.4	173.9	-59.8	172.2	0	0	0	109.8	L50 K51 P52 H53 E58 R59	L50-I55 HydrophobicContact CB-CD1 4.43Å; L50-I55 HydrophobicContact CB-CG1 3.8Å; L50-I55 HydrophobicContact CD1-CG1 4.43Å; K51-I55 PolarHBondContact O-N 3.4Å; P52-I55 WeakPolarHBondContact O-CB 3.15Å; P52-I55 PolarHBondContact O-N 2.7Å; H53-I55 VanDerWaalsContact C-N 3.33Å; I55-E58 PolarHBondContact O-N 2.94Å; I55-R59 WeakPolarHBondContact O-CG 3.21Å; I55-R59 PolarHBondContact O-N 3.13Å
56	E	87.4	Confident	80.6	Confident	92 Å²	92	81.5 Å²	81.5	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-66.1	-37.8	177.1	-65.4	-53.7	137.8	0	0	112.5	P52 H53 Q54 E58 R59 L60	P52-E56 PolarHBondContact O-N 3.17Å; P52-E56 VanDerWaalsContact O-N 3.14Å; H53-E56 PolarHBondContact O-N 3.4Å; Q54-E56 VanDerWaalsContact C-N 3.32Å; E56-E58 PolarHBondContact O-N 3.42Å; E56-R59 VanDerWaalsContact CD-NH1 3.32Å; E56-R59 WeakPolarHBondContact O-CB 3.41Å; E56-R59 PolarHBondContact O-N 3.08Å; E56-R59 IonicContact OE1-CZ 3.53Å; E56-R59 IonicContact OE1-NH1 2.92Å; E56-R59 PolarHBondContact OE1-NH1 3.26Å; E56-R59 IonicContact OE2-CZ 2.86Å; E56-R59 IonicContact OE2-NE 2.87Å; E56-R59 IonicContact OE2-NH1 3.94Å; E56-R59 PolarHBondContact OE2-NH1 2.89Å; E56-L60 WeakPolarHBondContact O-CG 3.41Å; E56-L60 PolarHBondContact O-N 3.3Å
57	C	87.3	Confident	82.3	Confident	8 Å²	8	79.7 Å²	79.7	5%	0.054	42%	0.424	C	S	.	.	H	α-helix	trans	-66.1	-37.6	175.2	-66.3	0	0	0	0	112.7	H53 Q54 R59 L60 K61 L73 I78	H53-C57 PolarHBondContact O-N 3.05Å; H53-C57 PolarHBondContact O-SG 2.9Å; Q54-C57 PolarHBondContact O-N 3.4Å; C57-R59 VanDerWaalsContact C-N 3.32Å; C57-L60 PolarHBondContact O-N 2.91Å; C57-K61 PolarHBondContact O-N 3.13Å; C57-L73 HydrophobicContact CB-CD2 3.75Å; C57-I78 HydrophobicContact CB-CD1 4.11Å
58	E	84.8	Confident	83.5	Confident	38 Å²	38	73.6 Å²	73.6	18%	0.178	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-34.9	173.4	-74.3	-69.3	133.9	0	0	111.9	L41 Q54 I55 E56 K61 E62 L73	L41-E58 HydrophobicContact CD2-CB 4.02Å; L41-E58 HydrophobicContact CD2-CG 3.99Å; Q54-E58 WeakPolarHBondContact O-CG 3.48Å; Q54-E58 PolarHBondContact O-N 2.86Å; I55-E58 PolarHBondContact O-N 2.94Å; E56-E58 PolarHBondContact O-N 3.42Å; E58-K61 WeakPolarHBondContact O-CB 3.43Å; E58-K61 PolarHBondContact O-N 3.43Å; E58-K61 IonicContact OE1-NZ 2.97Å; E58-K61 PolarHBondContact OE1-NZ 2.93Å; E58-E62 PolarHBondContact O-N 2.89Å; E58-L73 HydrophobicContact CG-CD1 4.17Å; E58-L73 HydrophobicContact CG-CD2 4.43Å; E58-L73 WeakPolarHBondContact OE1-CD2 3.49Å
59	R	88.8	Confident	84.2	Confident	134 Å²	134	76.5 Å²	76.5	51%	0.506	41%	0.406	S	S	.	.	H	α-helix	trans	-65.8	-39.9	171.3	-68.7	172.5	67.7	-167.1	-2.1	111.8	I55 E56 C57 K61 E62	I55-R59 WeakPolarHBondContact O-CG 3.21Å; I55-R59 PolarHBondContact O-N 3.13Å; E56-R59 VanDerWaalsContact CD-NH1 3.32Å; E56-R59 WeakPolarHBondContact O-CB 3.41Å; E56-R59 PolarHBondContact O-N 3.08Å; E56-R59 IonicContact OE1-CZ 3.53Å; E56-R59 IonicContact OE1-NH1 2.92Å; E56-R59 PolarHBondContact OE1-NH1 3.26Å; E56-R59 IonicContact OE2-CZ 2.86Å; E56-R59 IonicContact OE2-NE 2.87Å; E56-R59 IonicContact OE2-NH1 3.94Å; E56-R59 PolarHBondContact OE2-NH1 2.89Å; C57-R59 VanDerWaalsContact C-N 3.32Å; R59-K61 VanDerWaalsContact C-N 3.34Å; R59-E62 WeakPolarHBondContact O-CB 3.46Å; R59-E62 PolarHBondContact O-N 3.19Å
60	L	89.2	Confident	84.2	Confident	52 Å²	52	73.8 Å²	73.8	27%	0.272	39%	0.387	S	S	.	.	H	α-helix	trans	-63.7	-38.7	175.2	-73.5	172.9	0	0	0	111.7	E56 C57 E62 I63 L64 I78 A82	E56-L60 WeakPolarHBondContact O-CG 3.41Å; E56-L60 PolarHBondContact O-N 3.3Å; C57-L60 PolarHBondContact O-N 2.91Å; L60-E62 VanDerWaalsContact C-N 3.26Å; L60-E62 PolarHBondContact O-N 2.9Å; L60-I63 PolarHBondContact O-N 3.35Å; L60-L64 HydrophobicContact CB-CD1 4.2Å; L60-L64 WeakPolarHBondContact O-CB 3.2Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.35Å; L60-L64 PolarHBondContact O-N 2.95Å; L60-I78 HydrophobicContact CB-CG2 3.67Å; L60-I78 HydrophobicContact CD1-CG2 3.87Å; L60-I78 HydrophobicContact CG-CG2 4.43Å; L60-A82 HydrophobicContact CD2-CB 4.34Å
61	K	86.1	Confident	84.2	Confident	12 Å²	12	79.3 Å²	79.3	5%	0.052	41%	0.411	C	S	.	.	H	α-helix	trans	-57.6	-35.8	174.2	-79.4	-176.7	170.6	166.5	0	113.7	C57 E58 R59 I63 V67 A68 C70 L73 I78	C57-K61 PolarHBondContact O-N 3.13Å; E58-K61 WeakPolarHBondContact O-CB 3.43Å; E58-K61 PolarHBondContact O-N 3.43Å; E58-K61 IonicContact OE1-NZ 2.97Å; E58-K61 PolarHBondContact OE1-NZ 2.93Å; R59-K61 VanDerWaalsContact C-N 3.34Å; K61-I63 PolarHBondContact O-N 3.48Å; K61-V67 HydrophobicContact CG-CG2 4.39Å; K61-A68 WeakPolarHBondContact O-CA 3.4Å; K61-A68 WeakPolarHBondContact O-CB 3.28Å; K61-C70 VanDerWaalsContact CE-O 3.28Å; K61-C70 WeakPolarHBondContact CE-O 3.31Å; K61-C70 PolarHBondContact NZ-O 3.35Å; K61-L73 HydrophobicContact CD-CD2 4Å; K61-L73 VanDerWaalsContact NZ-CD2 3.34Å; K61-I78 HydrophobicContact CG-CD1 4.28Å
62	E	86.6	Confident	83.9	Confident	159 Å²	159	79.6 Å²	79.6	74%	0.743	42%	0.419	S	S	*	.	H	α-helix	trans	-65.4	-30.7	177.3	-171.5	178.5	179	0	0	112	E58 R59 L60	E58-E62 PolarHBondContact O-N 2.89Å; R59-E62 WeakPolarHBondContact O-CB 3.46Å; R59-E62 PolarHBondContact O-N 3.19Å; L60-E62 VanDerWaalsContact C-N 3.26Å; L60-E62 PolarHBondContact O-N 2.9Å
63	I	87.3	Confident	83.3	Confident	109 Å²	109	76.8 Å²	76.8	56%	0.559	40%	0.398	S	S	*	.	H	α-helix	trans	-88.7	-36.5	-177.2	-59.7	167.9	0	0	0	111.1	L60 K61 P65	L60-I63 PolarHBondContact O-N 3.35Å; K61-I63 PolarHBondContact O-N 3.48Å; I63-P65 WeakPolarHBondContact O-CD 3.26Å
64	L	87.7	Confident	83.4	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.021	40%	0.398	C	S	.	.			trans	-95.2	107	-171.1	-60.8	174.1	0	0	0	111.5	L60 T66 V67 A68 I78 A82 H85	L60-L64 HydrophobicContact CB-CD1 4.2Å; L60-L64 WeakPolarHBondContact O-CB 3.2Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.35Å; L60-L64 PolarHBondContact O-N 2.95Å; L64-T66 VanDerWaalsContact C-N 3.26Å; L64-T66 PolarHBondContact O-N 3.4Å; L64-V67 HydrophobicContact CB-CG2 3.4Å; L64-V67 VanDerWaalsContact CB-CG2 3.4Å; L64-V67 HydrophobicContact CD1-CG2 3.82Å; L64-V67 HydrophobicContact CG-CG2 4.27Å; L64-V67 PolarHBondContact O-N 3.41Å; L64-A68 PolarHBondContact O-N 3.2Å; L64-A68 VanDerWaalsContact O-N 3.08Å; L64-I78 HydrophobicContact CD1-CG2 4.29Å; L64-A82 HydrophobicContact CD1-CB 3.76Å; L64-A82 HydrophobicContact CD2-CB 4.4Å; L64-H85 HydrophobicContact CD2-CB 3.5Å
65	P	80.6	Confident	83.4	Confident	92 Å²	92	76.9 Å²	76.9	60%	0.597	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.4	-171	23.6	-33	0	0	0	113.5	I63	I63-P65 WeakPolarHBondContact O-CD 3.26Å
66	T	82.6	Confident	83.6	Confident	87 Å²	87	77.8 Å²	77.8	53%	0.534	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-30.8	-177.6	40.9	0	0	0	0	113.3	L64 E81	L64-T66 VanDerWaalsContact C-N 3.26Å; L64-T66 PolarHBondContact O-N 3.4Å; T66-E81 WeakPolarHBondContact CB-OE1 3.49Å; T66-E81 WeakPolarHBondContact CG2-OE1 3.21Å; T66-E81 WeakPolarHBondContact OG1-CG 3.41Å; T66-E81 PolarHBondContact OG1-OE1 2.92Å
67	V	83.4	Confident	83.7	Confident	13 Å²	13	79.3 Å²	79.3	8%	0.079	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-2.2	179	-63.8	0	0	0	0	113.7	K61 L64 N69 C70 I78 E81	K61-V67 HydrophobicContact CG-CG2 4.39Å; L64-V67 HydrophobicContact CB-CG2 3.4Å; L64-V67 VanDerWaalsContact CB-CG2 3.4Å; L64-V67 HydrophobicContact CD1-CG2 3.82Å; L64-V67 HydrophobicContact CG-CG2 4.27Å; L64-V67 PolarHBondContact O-N 3.41Å; V67-N69 PolarHBondContact O-N 3.45Å; V67-N69 VanDerWaalsContact O-N 3.13Å; V67-C70 WeakPolarHBondContact O-CB 3.41Å; V67-C70 PolarHBondContact O-N 2.98Å; V67-C70 VanDerWaalsContact O-N 3.11Å; V67-I78 HydrophobicContact CB-CG1 4.37Å; V67-I78 HydrophobicContact CG1-CG1 4.46Å; V67-I78 HydrophobicContact CG2-CG1 4.37Å; V67-E81 HydrophobicContact CG1-CB 4.28Å; V67-E81 HydrophobicContact CG1-CG 4.25Å
68	A	81.4	Confident	83.8	Confident	47 Å²	47	79.1 Å²	79.1	39%	0.388	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.3	-179.2	0	0	0	0	0	113.6	K61 L64	K61-A68 WeakPolarHBondContact O-CA 3.4Å; K61-A68 WeakPolarHBondContact O-CB 3.28Å; L64-A68 PolarHBondContact O-N 3.2Å; L64-A68 VanDerWaalsContact O-N 3.08Å
69	N	78.8	Confident	84	Confident	155 Å²	155	81.4 Å²	81.4	83%	0.829	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	4.6	-177	-62.2	-36.9	0	0	0	114	V67 E71	V67-N69 PolarHBondContact O-N 3.45Å; V67-N69 VanDerWaalsContact O-N 3.13Å; N69-E71 PolarHBondContact O-N 3.07Å
70	C	76.5	Confident	84.2	Confident	57 Å²	57	80.8 Å²	80.8	39%	0.385	43%	0.429	S	S	.	.			trans	-72.7	120.8	179.7	-66.1	0	0	0	0	110.7	K61 V67	K61-C70 VanDerWaalsContact CE-O 3.28Å; K61-C70 WeakPolarHBondContact CE-O 3.31Å; K61-C70 PolarHBondContact NZ-O 3.35Å; V67-C70 WeakPolarHBondContact O-CB 3.41Å; V67-C70 PolarHBondContact O-N 2.98Å; V67-C70 VanDerWaalsContact O-N 3.11Å
71	E	76.9	Confident	84.3	Confident	168 Å²	168	80.5 Å²	80.5	79%	0.785	43%	0.426	S	S	*	.	S	Bend	trans	-66.6	-44.7	179.3	-171.4	171.8	-162.8	0	0	111.7	N69	N69-E71 PolarHBondContact O-N 3.07Å
72	N	78	Confident	84.6	Confident	136 Å²	136	80.5 Å²	80.5	73%	0.727	43%	0.428	S	S	*	.	S	Bend	trans	-99.5	142.3	177.3	-66.6	-37.3	0	0	0	111.6	D74	N72-D74 PolarHBondContact O-N 2.98Å
73	L	70.8	Confident	84.8	Confident	43 Å²	43	77.2 Å²	77.2	23%	0.225	41%	0.414	C	S	.	.			trans	-83.8	95.4	177.1	-72.6	164.9	0	0	0	110	Q54 C57 E58 K61 E75 I78	Q54-L73 HydrophobicContact CB-CD1 4.42Å; C57-L73 HydrophobicContact CB-CD2 3.75Å; E58-L73 HydrophobicContact CG-CD1 4.17Å; E58-L73 HydrophobicContact CG-CD2 4.43Å; E58-L73 WeakPolarHBondContact OE1-CD2 3.49Å; K61-L73 HydrophobicContact CD-CD2 4Å; K61-L73 VanDerWaalsContact NZ-CD2 3.34Å; L73-E75 PolarHBondContact O-N 2.71Å; L73-I78 HydrophobicContact CD2-CD1 3.44Å; L73-I78 VanDerWaalsContact CD2-CD1 3.44Å
74	D	85.4	Confident	85.1	Confident	67 Å²	67	78.4 Å²	78.4	36%	0.358	42%	0.416	S	S	.	.			trans	-86.8	91.9	162.1	-172	-14.9	0	0	0	107.8	N72 V76 K77 I78	N72-D74 PolarHBondContact O-N 2.98Å; D74-V76 PolarHBondContact O-N 3.4Å; D74-K77 HydrophobicContact CB-CB 4.16Å; D74-K77 HydrophobicContact CB-CD 4.12Å; D74-K77 HydrophobicContact CB-CG 4.27Å; D74-K77 PolarHBondContact O-N 2.72Å; D74-K77 VanDerWaalsContact O-N 3.09Å; D74-K77 WeakPolarHBondContact OD2-CD 3.09Å; D74-K77 WeakPolarHBondContact OD2-CE 3.33Å; D74-K77 WeakPolarHBondContact OD2-CG 3.45Å; D74-K77 IonicContact OD2-NZ 3.11Å; D74-K77 PolarHBondContact OD2-NZ 3.15Å; D74-I78 WeakPolarHBondContact O-CG1 3.33Å; D74-I78 PolarHBondContact O-N 3.15Å
75	E	85.8	Confident	85.4	Confident	70 Å²	70	80.6 Å²	80.6	33%	0.327	43%	0.426	S	S	.	.	H	α-helix	trans	-54.1	-39.4	-171.7	-62	-178.6	-162.9	0	0	112	H53 L73 I78 I79	H53-E75 IonicContact CD2-OE1 3.5Å; H53-E75 PolarHBondContact CD2-OE1 3.02Å; H53-E75 IonicContact CD2-OE2 3.8Å; H53-E75 IonicContact NE2-OE1 3.6Å; H53-E75 PolarHBondContact NE2-OE1 2.82Å; L73-E75 PolarHBondContact O-N 2.71Å; E75-I78 PolarHBondContact O-N 2.71Å; E75-I79 VanDerWaalsContact O-CG1 3.27Å; E75-I79 WeakPolarHBondContact O-CG1 3.31Å; E75-I79 PolarHBondContact O-N 2.79Å
76	V	89.9	Confident	85.9	Confident	90 Å²	90	81.2 Å²	81.2	55%	0.545	42%	0.423	S	S	.	.	H	α-helix	trans	-64.3	-45	-179.9	-179.5	0	0	0	0	110.8	D74 I78 I79 Q80	D74-V76 PolarHBondContact O-N 3.4Å; V76-I78 PolarHBondContact O-N 2.86Å; V76-I79 PolarHBondContact O-N 2.84Å; V76-Q80 HydrophobicContact CG1-CG 4.5Å; V76-Q80 WeakPolarHBondContact O-CG 3.24Å; V76-Q80 PolarHBondContact O-N 3.38Å
77	K	89.7	Confident	86.3	Confident	124 Å²	124	81 Å²	81	54%	0.539	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-39.1	177.5	-72.9	-177.1	-174.6	140.7	0	112.4	D74 I79 Q80 E81	D74-K77 HydrophobicContact CB-CB 4.16Å; D74-K77 HydrophobicContact CB-CD 4.12Å; D74-K77 HydrophobicContact CB-CG 4.27Å; D74-K77 PolarHBondContact O-N 2.72Å; D74-K77 VanDerWaalsContact O-N 3.09Å; D74-K77 WeakPolarHBondContact OD2-CD 3.09Å; D74-K77 WeakPolarHBondContact OD2-CE 3.33Å; D74-K77 WeakPolarHBondContact OD2-CG 3.45Å; D74-K77 IonicContact OD2-NZ 3.11Å; D74-K77 PolarHBondContact OD2-NZ 3.15Å; K77-I79 VanDerWaalsContact C-N 3.33Å; K77-Q80 PolarHBondContact O-N 3.3Å; K77-E81 WeakPolarHBondContact O-CB 3.49Å; K77-E81 PolarHBondContact O-N 3.29Å
78	I	89.9	Confident	86.7	Confident	4 Å²	4	87.9 Å²	87.9	2%	0.021	44%	0.444	C	S	.	.	H	α-helix	trans	-62.3	-44.2	177	-67.2	169.6	0	0	0	110.2	C57 L60 K61 L64 V67 L73 D74 E75 V76 E81 A82	C57-I78 HydrophobicContact CB-CD1 4.11Å; L60-I78 HydrophobicContact CB-CG2 3.67Å; L60-I78 HydrophobicContact CD1-CG2 3.87Å; L60-I78 HydrophobicContact CG-CG2 4.43Å; K61-I78 HydrophobicContact CG-CD1 4.28Å; L64-I78 HydrophobicContact CD1-CG2 4.29Å; V67-I78 HydrophobicContact CB-CG1 4.37Å; V67-I78 HydrophobicContact CG1-CG1 4.46Å; V67-I78 HydrophobicContact CG2-CG1 4.37Å; L73-I78 HydrophobicContact CD2-CD1 3.44Å; L73-I78 VanDerWaalsContact CD2-CD1 3.44Å; D74-I78 WeakPolarHBondContact O-CG1 3.33Å; D74-I78 PolarHBondContact O-N 3.15Å; E75-I78 PolarHBondContact O-N 2.71Å; V76-I78 PolarHBondContact O-N 2.86Å; I78-E81 PolarHBondContact O-N 3.39Å; I78-A82 WeakPolarHBondContact O-CB 3.05Å; I78-A82 PolarHBondContact O-N 3.24Å
79	I	89.6	Confident	87.1	Confident	86 Å²	86	89.7 Å²	89.7	44%	0.441	45%	0.447	S	S	.	.	H	α-helix	trans	-64.9	-45.9	177.7	-67.3	164.7	0	0	0	111	E75 V76 K77 E81 A82 I83	E75-I79 VanDerWaalsContact O-CG1 3.27Å; E75-I79 WeakPolarHBondContact O-CG1 3.31Å; E75-I79 PolarHBondContact O-N 2.79Å; V76-I79 PolarHBondContact O-N 2.84Å; K77-I79 VanDerWaalsContact C-N 3.33Å; I79-E81 VanDerWaalsContact C-N 3.32Å; I79-E81 PolarHBondContact O-N 2.97Å; I79-A82 WeakPolarHBondContact O-CB 3.49Å; I79-A82 PolarHBondContact O-N 3.32Å; I79-I83 HydrophobicContact CG2-CD1 4.01Å; I79-I83 WeakPolarHBondContact O-CG1 3.28Å; I79-I83 PolarHBondContact O-N 3.11Å
80	Q	92	Very high	87.6	Confident	122 Å²	122	84 Å²	84	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-59.4	-43.5	178.1	-75.6	175.5	-15.2	0	0	112	V76 K77 I83 K84	V76-Q80 HydrophobicContact CG1-CG 4.5Å; V76-Q80 WeakPolarHBondContact O-CG 3.24Å; V76-Q80 PolarHBondContact O-N 3.38Å; K77-Q80 PolarHBondContact O-N 3.3Å; Q80-I83 PolarHBondContact O-N 2.99Å; Q80-K84 PolarHBondContact O-N 3.33Å
81	E	91.8	Very high	88.1	Confident	45 Å²	45	85.3 Å²	85.3	21%	0.21	42%	0.416	C	S	.	.	H	α-helix	trans	-70.9	-33	178.1	-167.5	64.3	-172.2	0	0	112	T66 V67 K77 I78 I79 K84 H85	T66-E81 WeakPolarHBondContact CB-OE1 3.49Å; T66-E81 WeakPolarHBondContact CG2-OE1 3.21Å; T66-E81 WeakPolarHBondContact OG1-CG 3.41Å; T66-E81 PolarHBondContact OG1-OE1 2.92Å; V67-E81 HydrophobicContact CG1-CB 4.28Å; V67-E81 HydrophobicContact CG1-CG 4.25Å; K77-E81 WeakPolarHBondContact O-CB 3.49Å; K77-E81 PolarHBondContact O-N 3.29Å; I78-E81 PolarHBondContact O-N 3.39Å; I79-E81 VanDerWaalsContact C-N 3.32Å; I79-E81 PolarHBondContact O-N 2.97Å; E81-K84 PolarHBondContact O-N 2.81Å; E81-H85 WeakPolarHBondContact O-CB 3.48Å; E81-H85 PolarHBondContact O-N 2.96Å
82	A	91.9	Very high	88.6	Confident	12 Å²	12	77.8 Å²	77.8	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-60.4	-47.6	171.9	0	0	0	0	0	111.7	L60 L64 I78 I79 K84 H85 I86	L60-A82 HydrophobicContact CD2-CB 4.34Å; L64-A82 HydrophobicContact CD1-CB 3.76Å; L64-A82 HydrophobicContact CD2-CB 4.4Å; I78-A82 WeakPolarHBondContact O-CB 3.05Å; I78-A82 PolarHBondContact O-N 3.24Å; I79-A82 WeakPolarHBondContact O-CB 3.49Å; I79-A82 PolarHBondContact O-N 3.32Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 3.49Å; A82-H85 PolarHBondContact O-N 3.41Å; A82-I86 WeakPolarHBondContact O-CG1 3.49Å; A82-I86 PolarHBondContact O-N 3.34Å
83	I	91.7	Very high	89.1	Confident	90 Å²	90	73.7 Å²	73.7	46%	0.462	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-45.9	177.2	-67.6	165.1	0	0	0	109.9	I79 Q80 H85 I86 N87	I79-I83 HydrophobicContact CG2-CD1 4.01Å; I79-I83 WeakPolarHBondContact O-CG1 3.28Å; I79-I83 PolarHBondContact O-N 3.11Å; Q80-I83 PolarHBondContact O-N 2.99Å; I83-H85 VanDerWaalsContact C-N 3.32Å; I83-H85 PolarHBondContact O-N 2.94Å; I83-I86 PolarHBondContact O-N 3.46Å; I83-N87 VanDerWaalsContact O-CG 3.3Å; I83-N87 PolarHBondContact O-N 3.33Å
84	K	92.7	Very high	89.8	Confident	134 Å²	134	72.3 Å²	72.3	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-59.6	-42.5	176.7	-173.5	-177	177	-171.9	0	112.2	Q80 E81 A82 N87 Y88	Q80-K84 PolarHBondContact O-N 3.33Å; E81-K84 PolarHBondContact O-N 2.81Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 3.49Å; K84-N87 PolarHBondContact O-N 3.07Å; K84-Y88 PolarHBondContact O-N 2.86Å
85	H	93.2	Very high	89.6	Confident	51 Å²	51	74 Å²	74	24%	0.236	36%	0.36	C	S	.	.	H	α-helix	trans	-66.9	-41	178.3	-171.6	65.2	0	0	0	112.5	L64 E81 A82 I83 Y88 L89	L64-H85 HydrophobicContact CD2-CB 3.5Å; E81-H85 WeakPolarHBondContact O-CB 3.48Å; E81-H85 PolarHBondContact O-N 2.96Å; A82-H85 PolarHBondContact O-N 3.41Å; I83-H85 VanDerWaalsContact C-N 3.32Å; I83-H85 PolarHBondContact O-N 2.94Å; H85-Y88 WeakPolarHBondContact O-CB 3.47Å; H85-Y88 PolarHBondContact O-N 3.09Å; H85-L89 WeakPolarHBondContact O-CG 3.34Å; H85-L89 PolarHBondContact O-N 3.05Å
86	I	91.4	Very high	89.4	Confident	104 Å²	104	80.5 Å²	80.5	53%	0.533	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-48.5	174.3	-69.8	165.3	0	0	0	110.2	A82 I83 Y88 L89 E90	A82-I86 WeakPolarHBondContact O-CG1 3.49Å; A82-I86 PolarHBondContact O-N 3.34Å; I83-I86 PolarHBondContact O-N 3.46Å; I86-Y88 VanDerWaalsContact C-N 3.29Å; I86-Y88 PolarHBondContact O-N 2.68Å; I86-L89 PolarHBondContact O-N 2.73Å; I86-L89 VanDerWaalsContact O-N 3.17Å; I86-E90 PolarHBondContact O-N 3.23Å
87	N	90.9	Very high	89.1	Confident	83 Å²	83	79.1 Å²	79.1	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-40.6	178	-69.2	-8.7	0	0	0	111.7	I83 K84 E90 Q91	I83-N87 VanDerWaalsContact O-CG 3.3Å; I83-N87 PolarHBondContact O-N 3.33Å; K84-N87 PolarHBondContact O-N 3.07Å; N87-E90 PolarHBondContact O-N 2.79Å; N87-Q91 WeakPolarHBondContact O-CG 3.37Å; N87-Q91 PolarHBondContact O-N 2.93Å
88	Y	91.8	Very high	88.4	Confident	158 Å²	158	80.2 Å²	80.2	62%	0.62	38%	0.383	S	S	*	.	H	α-helix	trans	-61.3	-46.8	174.9	170.8	-97.5	0	0	0	112.3	K84 H85 I86 E90 Q91 A92	K84-Y88 PolarHBondContact O-N 2.86Å; H85-Y88 WeakPolarHBondContact O-CB 3.47Å; H85-Y88 PolarHBondContact O-N 3.09Å; I86-Y88 VanDerWaalsContact C-N 3.29Å; I86-Y88 PolarHBondContact O-N 2.68Å; Y88-E90 VanDerWaalsContact C-N 3.3Å; Y88-E90 PolarHBondContact O-N 2.88Å; Y88-Q91 PolarHBondContact O-N 3.46Å; Y88-A92 WeakPolarHBondContact O-CB 3.14Å; Y88-A92 PolarHBondContact O-N 3.09Å
89	L	91.3	Very high	87.2	Confident	84 Å²	84	83.3 Å²	83.3	44%	0.44	40%	0.399	S	S	.	.	H	α-helix	trans	-63.4	-37.9	177.2	-70.2	177.5	0	0	0	111.7	H85 I86 A92 V93	H85-L89 WeakPolarHBondContact O-CG 3.34Å; H85-L89 PolarHBondContact O-N 3.05Å; I86-L89 PolarHBondContact O-N 2.73Å; I86-L89 VanDerWaalsContact O-N 3.17Å; L89-A92 PolarHBondContact O-N 2.82Å; L89-V93 WeakPolarHBondContact O-CG2 3.4Å; L89-V93 PolarHBondContact O-N 2.62Å
90	E	88.3	Confident	85.7	Confident	36 Å²	36	83.1 Å²	83.1	17%	0.168	40%	0.398	C	S	.	.	H	α-helix	trans	-59.8	-50.4	175	163.2	161.7	-136.9	0	0	111.5	I86 N87 Y88 A92 V93 L94 S120 L122	I86-E90 PolarHBondContact O-N 3.23Å; N87-E90 PolarHBondContact O-N 2.79Å; Y88-E90 VanDerWaalsContact C-N 3.3Å; Y88-E90 PolarHBondContact O-N 2.88Å; E90-A92 VanDerWaalsContact C-N 3.31Å; E90-A92 PolarHBondContact O-N 2.73Å; E90-V93 PolarHBondContact O-N 2.97Å; E90-V93 VanDerWaalsContact O-N 3.16Å; E90-L94 HydrophobicContact CG-CD1 3.95Å; E90-L94 WeakPolarHBondContact O-CG 3.08Å; E90-L94 PolarHBondContact O-N 3.36Å; E90-S120 WeakPolarHBondContact OE1-CB 3.35Å; E90-L122 HydrophobicContact CB-CD1 3.47Å; E90-L122 VanDerWaalsContact CB-CD1 3.47Å; E90-L122 HydrophobicContact CG-CD1 3.36Å; E90-L122 HydrophobicContact CG-CG 4.03Å
91	Q	87.1	Confident	83.8	Confident	84 Å²	84	84.9 Å²	84.9	39%	0.393	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-41	176.4	-66.7	-58.7	-32.2	0	0	111.8	N87 Y88 V93 L94 Q95	N87-Q91 WeakPolarHBondContact O-CG 3.37Å; N87-Q91 PolarHBondContact O-N 2.93Å; Y88-Q91 PolarHBondContact O-N 3.46Å; Q91-V93 VanDerWaalsContact C-N 3.32Å; Q91-V93 PolarHBondContact O-N 3.06Å; Q91-L94 PolarHBondContact O-N 2.91Å; Q91-Q95 WeakPolarHBondContact O-CB 3.34Å; Q91-Q95 VanDerWaalsContact O-CG 3.24Å; Q91-Q95 WeakPolarHBondContact O-CG 3.44Å; Q91-Q95 PolarHBondContact O-N 3.38Å
92	A	86.7	Confident	81.8	Confident	11 Å²	11	86.1 Å²	86.1	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-63.2	-36.4	177	0	0	0	0	0	112.7	Y88 L89 E90 R96	Y88-A92 WeakPolarHBondContact O-CB 3.14Å; Y88-A92 PolarHBondContact O-N 3.09Å; L89-A92 PolarHBondContact O-N 2.82Å; E90-A92 VanDerWaalsContact C-N 3.31Å; E90-A92 PolarHBondContact O-N 2.73Å; A92-R96 VanDerWaalsContact O-CG 3.23Å; A92-R96 WeakPolarHBondContact O-CG 3.48Å; A92-R96 PolarHBondContact O-N 3.34Å; A92-R96 VanDerWaalsContact O-N 3.15Å
93	V	88.2	Confident	79.5	Confident	49 Å²	49	94 Å²	94	30%	0.297	46%	0.457	S	S	.	.	H	α-helix	trans	-69.6	-46.1	175.2	169.6	0	0	0	0	110.8	L89 E90 Q91 Q95 R96 L97 L122	L89-V93 WeakPolarHBondContact O-CG2 3.4Å; L89-V93 PolarHBondContact O-N 2.62Å; E90-V93 PolarHBondContact O-N 2.97Å; E90-V93 VanDerWaalsContact O-N 3.16Å; Q91-V93 VanDerWaalsContact C-N 3.32Å; Q91-V93 PolarHBondContact O-N 3.06Å; V93-Q95 VanDerWaalsContact C-N 3.32Å; V93-Q95 PolarHBondContact O-N 3.35Å; V93-R96 PolarHBondContact O-N 3.45Å; V93-L97 HydrophobicContact CG1-CD1 3.61Å; V93-L97 HydrophobicContact CG1-CG 4.39Å; V93-L97 VanDerWaalsContact O-CG 3.28Å; V93-L97 WeakPolarHBondContact O-CG 3.31Å; V93-L97 PolarHBondContact O-N 3.32Å; V93-L122 HydrophobicContact CB-CD2 4.41Å; V93-L122 HydrophobicContact CG1-CD2 3.8Å
94	L	85.5	Confident	76.9	Confident	14 Å²	14	95.6 Å²	95.6	7%	0.073	47%	0.471	C	S	.	.	H	α-helix	trans	-60.9	-40.2	178.3	-69.3	169.2	0	0	0	112.4	E90 Q91 L97 N98 I99 I100 L122	E90-L94 HydrophobicContact CG-CD1 3.95Å; E90-L94 WeakPolarHBondContact O-CG 3.08Å; E90-L94 PolarHBondContact O-N 3.36Å; Q91-L94 PolarHBondContact O-N 2.91Å; L94-L97 PolarHBondContact O-N 3.24Å; L94-N98 PolarHBondContact O-N 2.77Å; L94-I99 HydrophobicContact CD2-CB 4.37Å; L94-I99 HydrophobicContact CD2-CD1 4.36Å; L94-I99 HydrophobicContact CD2-CG2 4.33Å; L94-I99 PolarHBondContact O-N 3.48Å; L94-I99 VanDerWaalsContact O-N 3.09Å; L94-I100 HydrophobicContact CD1-CD1 4.07Å; L94-I100 HydrophobicContact CD2-CD1 4.5Å; L94-L122 HydrophobicContact CD2-CD2 4.05Å; L94-L122 HydrophobicContact CG-CD2 4.25Å
95	Q	82.4	Confident	74.6	Confident	102 Å²	102	94.2 Å²	94.2	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-49.6	172.7	-78	173.4	14.1	0	0	112.2	Q91 V93 L97 N98 V102	Q91-Q95 WeakPolarHBondContact O-CB 3.34Å; Q91-Q95 VanDerWaalsContact O-CG 3.24Å; Q91-Q95 WeakPolarHBondContact O-CG 3.44Å; Q91-Q95 PolarHBondContact O-N 3.38Å; V93-Q95 VanDerWaalsContact C-N 3.32Å; V93-Q95 PolarHBondContact O-N 3.35Å; Q95-L97 PolarHBondContact O-N 3.48Å; Q95-N98 PolarHBondContact O-N 3.44Å; Q95-V102 HydrophobicContact CG-CG2 3.42Å; Q95-V102 VanDerWaalsContact CG-CG2 3.42Å; Q95-V102 VanDerWaalsContact NE2-CG2 3.31Å
96	R	82.3	Confident	72.2	Confident	207 Å²	207	100.2 Å²	100.2	78%	0.781	51%	0.507	S	S	*	.	H	α-helix	trans	-63.2	-32	179.9	-74.3	172.1	-169.6	170.6	5	112.8	A92 V93 N98	A92-R96 VanDerWaalsContact O-CG 3.23Å; A92-R96 WeakPolarHBondContact O-CG 3.48Å; A92-R96 PolarHBondContact O-N 3.34Å; A92-R96 VanDerWaalsContact O-N 3.15Å; V93-R96 PolarHBondContact O-N 3.45Å; R96-N98 PolarHBondContact O-N 3.27Å
97	L	81.8	Confident	69.6	Low	62 Å²	62	102.9 Å²	102.9	33%	0.325	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.6	176.3	-65	165.6	0	0	0	112.6	V93 L94 Q95 I99 F125 L129	V93-L97 HydrophobicContact CG1-CD1 3.61Å; V93-L97 HydrophobicContact CG1-CG 4.39Å; V93-L97 VanDerWaalsContact O-CG 3.28Å; V93-L97 WeakPolarHBondContact O-CG 3.31Å; V93-L97 PolarHBondContact O-N 3.32Å; L94-L97 PolarHBondContact O-N 3.24Å; Q95-L97 PolarHBondContact O-N 3.48Å; L97-I99 HydrophobicContact CB-CB 4.49Å; L97-I99 HydrophobicContact CB-CD1 3.39Å; L97-I99 HydrophobicContact CB-CG1 3.56Å; L97-I99 HydrophobicContact CD1-CD1 3.66Å; L97-I99 HydrophobicContact CG-CD1 4.13Å; L97-I99 PolarHBondContact O-N 2.83Å; L97-F125 HydrophobicContact CD1-CD1 4.02Å; L97-F125 HydrophobicContact CD1-CE1 3.68Å; L97-F125 HydrophobicContact CD2-CE1 4.35Å; L97-F125 HydrophobicContact CG-CE1 4.47Å; L97-L129 HydrophobicContact CD2-CD2 4.44Å
98	N	75.8	Confident	67	Low	146 Å²	146	106.7 Å²	106.7	78%	0.781	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	28.4	-176.4	-160.7	39.2	0	0	0	112.6	L94 Q95 R96	L94-N98 PolarHBondContact O-N 2.77Å; Q95-N98 PolarHBondContact O-N 3.44Å; R96-N98 PolarHBondContact O-N 3.27Å
99	I	65	Low	64.3	Low	69 Å²	69	104.4 Å²	104.4	35%	0.354	55%	0.545	S	S	.	.			trans	-84.2	-28.4	-174.5	-63.8	170.3	0	0	0	110.9	L94 L97 F125	L94-I99 HydrophobicContact CD2-CB 4.37Å; L94-I99 HydrophobicContact CD2-CD1 4.36Å; L94-I99 HydrophobicContact CD2-CG2 4.33Å; L94-I99 PolarHBondContact O-N 3.48Å; L94-I99 VanDerWaalsContact O-N 3.09Å; L97-I99 HydrophobicContact CB-CB 4.49Å; L97-I99 HydrophobicContact CB-CD1 3.39Å; L97-I99 HydrophobicContact CB-CG1 3.56Å; L97-I99 HydrophobicContact CD1-CD1 3.66Å; L97-I99 HydrophobicContact CG-CD1 4.13Å; L97-I99 PolarHBondContact O-N 2.83Å; I99-F125 HydrophobicContact CD1-CD1 3.74Å; I99-F125 HydrophobicContact CD1-CD2 4.08Å; I99-F125 HydrophobicContact CD1-CE1 3.31Å; I99-F125 HydrophobicContact CD1-CE2 3.66Å; I99-F125 HydrophobicContact CD1-CG 4.12Å; I99-F125 HydrophobicContact CD1-CZ 3.26Å; I99-F125 HydrophobicContact CG1-CZ 4.2Å
100	I	59	Low	61.6	Low	82 Å²	82	108.2 Å²	108.2	42%	0.421	57%	0.566	S	S	.	*			trans	-140.9	118.3	-177.3	-53.9	-173.5	0	0	0	109	L94 V102	L94-I100 HydrophobicContact CD1-CD1 4.07Å; L94-I100 HydrophobicContact CD2-CD1 4.5Å; I100-V102 PolarHBondContact O-N 3.41Å
101	N	51.1	Low	59.2	Low	159 Å²	159	113.8 Å²	113.8	85%	0.85	60%	0.596	S	S	*	*			trans	-67.7	117.1	165.2	-149.6	25.9	0	0	0	107	E103	N101-E103 PolarHBondContact O-N 3.06Å
102	V	48.8	Very low	56.7	Low	72 Å²	72	117.8 Å²	117.8	44%	0.436	61%	0.614	S	S	.	*			trans	-82	100.4	-172.3	171.6	0	0	0	0	108.7	Q95 I100	Q95-V102 HydrophobicContact CG-CG2 3.42Å; Q95-V102 VanDerWaalsContact CG-CG2 3.42Å; Q95-V102 VanDerWaalsContact NE2-CG2 3.31Å; I100-V102 PolarHBondContact O-N 3.41Å
103	E	44	Very low	54.2	Low	177 Å²	177	122.5 Å²	122.5	83%	0.827	65%	0.647	S	S	*	*			trans	-178	104.6	160.2	-100.2	162.6	-146.8	0	0	102.9	N101	N101-E103 PolarHBondContact O-N 3.06Å
104	T	38.6	Very low	51.8	Low	124 Å²	124	125 Å²	125	76%	0.761	67%	0.667	S	S	*	*				-153.6	141.3	81.6	42.2	0	0	0	0	111.3	I106	T104-I106 PolarHBondContact O-N 2.68Å
105	P	43.3	Very low	49.7	Very low	104 Å²	104	129.5 Å²	129.5	68%	0.675	70%	0.699	S	S	*	*			trans	-60.6	134.4	167.7	27.5	-30.5	0	0	0	108	E107	P105-E107 PolarHBondContact O-N 3.05Å
106	I	42	Very low	48.1	Very low	177 Å²	177	132.3 Å²	132.3	91%	0.908	72%	0.716	S	S	*	*			trans	-66.9	79.8	177.1	-57.4	168.9	0	0	0	107.5	T104	T104-I106 PolarHBondContact O-N 2.68Å
107	E	37.3	Very low	46.2	Very low	160 Å²	160	126.3 Å²	126.3	75%	0.748	71%	0.706	S	S	*	*			trans	-112.2	100.9	165.3	-79.8	-169.3	161.8	0	0	107.8	P105 S109	P105-E107 PolarHBondContact O-N 3.05Å; E107-S109 PolarHBondContact O-N 3.22Å
108	N	36.3	Very low	44.6	Very low	163 Å²	163	129.2 Å²	129.2	87%	0.872	73%	0.732	S	S	*	*			trans	47.3	67.7	146.2	-54.4	-24.4	0	0	0	117.1
109	S	35	Very low	43.6	Very low	111 Å²	111	126.3 Å²	126.3	78%	0.776	72%	0.723	S	S	*	*			trans	-113.7	93.7	154.1	63.4	0	0	0	0	109.7	E107 L111	E107-S109 PolarHBondContact O-N 3.22Å; S109-L111 PolarHBondContact O-N 3.38Å; S109-L111 VanDerWaalsContact O-N 3.15Å
110	N	34.6	Very low	43.2	Very low	163 Å²	163	126 Å²	126	87%	0.872	73%	0.727	S	S	*	*			trans	-49.1	114.2	154	-79.8	-29.3	0	0	0	108.1
111	L	38.3	Very low	43.2	Very low	153 Å²	153	128.1 Å²	128.1	80%	0.801	74%	0.739	S	S	*	*			trans	-177.2	102.1	152.3	-97.9	150.6	0	0	0	109.4	S109	S109-L111 PolarHBondContact O-N 3.38Å; S109-L111 VanDerWaalsContact O-N 3.15Å
112	H	34.9	Very low	43.7	Very low	168 Å²	168	121.8 Å²	121.8	78%	0.778	70%	0.704	S	S	*	*			trans	38.3	109.5	140.1	-71.5	-77.8	0	0	0	119.7
113	S	34.7	Very low	44.6	Very low	111 Å²	111	122.4 Å²	122.4	78%	0.776	71%	0.71	S	S	*	*			trans	59.5	82.2	132.8	62.4	0	0	0	0	117.6
114	S	36.9	Very low	45.5	Very low	101 Å²	101	117.3 Å²	117.3	71%	0.706	70%	0.698	S	S	*	*				-157.4	126	108.9	41.7	0	0	0	0	107.6	L116	S114-L116 PolarHBondContact O-N 2.92Å
115	S	42	Very low	46.8	Very low	108 Å²	108	114.5 Å²	114.5	76%	0.755	68%	0.676	S	S	*	*			trans	-60.8	79.9	178.9	-174.9	0	0	0	0	109.4	S117	S115-S117 PolarHBondContact O-N 2.87Å; S115-S117 PolarHBondContact OG-OG 3.04Å; S115-S117 VanDerWaalsContact OG-OG 3.05Å
116	L	47.5	Very low	47.8	Very low	161 Å²	161	113.1 Å²	113.1	84%	0.843	66%	0.662	S	S	*	*			trans	-70	71.7	155.8	-77.3	158.9	0	0	0	105.3	S114 S118	S114-L116 PolarHBondContact O-N 2.92Å; L116-S118 PolarHBondContact O-N 2.97Å
117	S	44	Very low	49.1	Very low	81 Å²	81	111 Å²	111	57%	0.566	65%	0.646	S	S	*	*			trans	-46.7	117.6	166.8	-64.8	0	0	0	0	105.6	S115 S119	S115-S117 PolarHBondContact O-N 2.87Å; S115-S117 PolarHBondContact OG-OG 3.04Å; S115-S117 VanDerWaalsContact OG-OG 3.05Å; S117-S119 PolarHBondContact O-N 3.49Å
118	S	48.2	Very low	50.8	Low	124 Å²	124	110.3 Å²	110.3	87%	0.867	64%	0.641	S	S	*	*			trans	-66.5	51.7	177.2	43.9	0	0	0	0	110.7	L116 S120	L116-S118 PolarHBondContact O-N 2.97Å; S118-S120 PolarHBondContact O-N 2.9Å; S118-S120 VanDerWaalsContact O-N 3.15Å
119	S	53.2	Low	52.1	Low	84 Å²	84	106.4 Å²	106.4	59%	0.587	62%	0.619	S	S	*	*			trans	-70.5	105.5	159.4	55.2	0	0	0	0	105.2	S117 L121	S117-S119 PolarHBondContact O-N 3.49Å; S119-L121 PolarHBondContact O-N 3.34Å
120	S	57.8	Low	53.7	Low	64 Å²	64	105.8 Å²	105.8	45%	0.448	61%	0.607	S	S	.	*			trans	-39.3	113	174.6	57.2	0	0	0	0	108.7	E90 S118 L122 P123	E90-S120 WeakPolarHBondContact OE1-CB 3.35Å; S118-S120 PolarHBondContact O-N 2.9Å; S118-S120 VanDerWaalsContact O-N 3.15Å; S120-L122 PolarHBondContact O-N 3.39Å; S120-L122 VanDerWaalsContact O-N 3.13Å; S120-P123 WeakPolarHBondContact O-CD 3.4Å
121	L	59.1	Low	55.4	Low	126 Å²	126	100.4 Å²	100.4	66%	0.66	58%	0.582	S	S	*	*	S	Bend	trans	-69.7	-8.9	-176.9	-76	167	0	0	0	111.6	S119 A124 F125	S119-L121 PolarHBondContact O-N 3.34Å; L121-A124 PolarHBondContact O-N 3.2Å; L121-F125 WeakPolarHBondContact O-CB 3.35Å; L121-F125 PolarHBondContact O-N 3.43Å
122	L	61	Low	56.6	Low	25 Å²	25	96.5 Å²	96.5	13%	0.131	57%	0.567	C	S	.	*	H	α-helix	trans	-59.9	-47.6	-174	-79	-177.1	0	0	0	114.9	E90 V93 L94 S120 A124 F125 I126	E90-L122 HydrophobicContact CB-CD1 3.47Å; E90-L122 VanDerWaalsContact CB-CD1 3.47Å; E90-L122 HydrophobicContact CG-CD1 3.36Å; E90-L122 HydrophobicContact CG-CG 4.03Å; V93-L122 HydrophobicContact CB-CD2 4.41Å; V93-L122 HydrophobicContact CG1-CD2 3.8Å; L94-L122 HydrophobicContact CD2-CD2 4.05Å; L94-L122 HydrophobicContact CG-CD2 4.25Å; S120-L122 PolarHBondContact O-N 3.39Å; S120-L122 VanDerWaalsContact O-N 3.13Å; L122-A124 PolarHBondContact O-N 3.35Å; L122-F125 PolarHBondContact O-N 3.46Å; L122-I126 HydrophobicContact CB-CD1 4.24Å; L122-I126 HydrophobicContact CD2-CD1 4.31Å; L122-I126 WeakPolarHBondContact O-CB 3.44Å; L122-I126 WeakPolarHBondContact O-CD1 3.41Å; L122-I126 WeakPolarHBondContact O-CG1 3.33Å; L122-I126 PolarHBondContact O-N 3.28Å
123	P	67.1	Low	57.7	Low	86 Å²	86	94.8 Å²	94.8	56%	0.558	56%	0.56	S	S	*	*	H	α-helix	trans	-61.2	-46.1	-179.6	-23	35.6	0	0	0	111.4	S120 F127	S120-P123 WeakPolarHBondContact O-CD 3.4Å; P123-F127 WeakPolarHBondContact O-CB 3.27Å; P123-F127 PolarHBondContact O-N 3.31Å
124	A	63.9	Low	58.7	Low	69 Å²	69	95.1 Å²	95.1	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-66.5	-42.7	180	0	0	0	0	0	112.1	L121 L122 K128	L121-A124 PolarHBondContact O-N 3.2Å; L122-A124 PolarHBondContact O-N 3.35Å; A124-K128 WeakPolarHBondContact O-CB 2.89Å; A124-K128 PolarHBondContact O-N 2.81Å
125	F	66.2	Low	59.4	Low	66 Å²	66	96.9 Å²	96.9	29%	0.289	55%	0.554	S	S	.	*	H	α-helix	trans	-70.2	-46.5	-179.4	-176.8	-88	0	0	0	112.2	L97 I99 L121 L122 F127 K128 L129	L97-F125 HydrophobicContact CD1-CD1 4.02Å; L97-F125 HydrophobicContact CD1-CE1 3.68Å; L97-F125 HydrophobicContact CD2-CE1 4.35Å; L97-F125 HydrophobicContact CG-CE1 4.47Å; I99-F125 HydrophobicContact CD1-CD1 3.74Å; I99-F125 HydrophobicContact CD1-CD2 4.08Å; I99-F125 HydrophobicContact CD1-CE1 3.31Å; I99-F125 HydrophobicContact CD1-CE2 3.66Å; I99-F125 HydrophobicContact CD1-CG 4.12Å; I99-F125 HydrophobicContact CD1-CZ 3.26Å; I99-F125 HydrophobicContact CG1-CZ 4.2Å; L121-F125 WeakPolarHBondContact O-CB 3.35Å; L121-F125 PolarHBondContact O-N 3.43Å; L122-F125 PolarHBondContact O-N 3.46Å; F125-F127 VanDerWaalsContact C-N 3.28Å; F125-F127 PolarHBondContact O-N 3.45Å; F125-K128 PolarHBondContact O-N 3.13Å; F125-K128 VanDerWaalsContact O-N 3.17Å; F125-L129 HydrophobicContact CE1-CB 4.21Å; F125-L129 HydrophobicContact CE1-CD1 3.58Å; F125-L129 HydrophobicContact CE1-CG 4.41Å; F125-L129 HydrophobicContact CZ-CD1 3.58Å; F125-L129 WeakPolarHBondContact O-CB 3.14Å; F125-L129 PolarHBondContact O-N 2.86Å
126	I	64.3	Low	59.7	Low	75 Å²	75	99.7 Å²	99.7	39%	0.385	56%	0.555	S	S	.	*	H	α-helix	trans	-58.9	-44.8	176.1	-68.1	168.9	0	0	0	109.3	L122 K128 L129 L130	L122-I126 HydrophobicContact CB-CD1 4.24Å; L122-I126 HydrophobicContact CD2-CD1 4.31Å; L122-I126 WeakPolarHBondContact O-CB 3.44Å; L122-I126 WeakPolarHBondContact O-CD1 3.41Å; L122-I126 WeakPolarHBondContact O-CG1 3.33Å; L122-I126 PolarHBondContact O-N 3.28Å; I126-K128 VanDerWaalsContact C-N 3.34Å; I126-K128 PolarHBondContact O-N 3.25Å; I126-L129 PolarHBondContact O-N 3.19Å; I126-L130 HydrophobicContact CG2-CD1 3.8Å; I126-L130 HydrophobicContact CG2-CG 4.26Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 VanDerWaalsContact O-CG 3.31Å; I126-L130 WeakPolarHBondContact O-CG 3.48Å; I126-L130 PolarHBondContact O-N 3.41Å
127	F	67.9	Low	59.5	Low	131 Å²	131	96.6 Å²	96.6	58%	0.575	55%	0.547	S	S	*	.	H	α-helix	trans	-60.7	-43.8	177.2	-162.2	-88.6	0	0	0	111.6	P123 F125 S131	P123-F127 WeakPolarHBondContact O-CB 3.27Å; P123-F127 PolarHBondContact O-N 3.31Å; F125-F127 VanDerWaalsContact C-N 3.28Å; F125-F127 PolarHBondContact O-N 3.45Å; F127-S131 VanDerWaalsContact O-CB 3.26Å; F127-S131 WeakPolarHBondContact O-CB 3.27Å; F127-S131 PolarHBondContact O-N 3.25Å; F127-S131 PolarHBondContact O-OG 2.97Å
128	K	73	Confident	59.3	Low	147 Å²	147	100.7 Å²	100.7	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-41.5	175.8	-172.2	175	-178.3	178.6	0	112.5	A124 F125 I126 S131 S132	A124-K128 WeakPolarHBondContact O-CB 2.89Å; A124-K128 PolarHBondContact O-N 2.81Å; F125-K128 PolarHBondContact O-N 3.13Å; F125-K128 VanDerWaalsContact O-N 3.17Å; I126-K128 VanDerWaalsContact C-N 3.34Å; I126-K128 PolarHBondContact O-N 3.25Å; K128-S131 PolarHBondContact O-N 3.22Å; K128-S132 WeakPolarHBondContact O-CB 3.42Å; K128-S132 PolarHBondContact O-N 3.38Å; K128-S132 PolarHBondContact O-OG 3.24Å
129	L	65.6	Low	59	Low	81 Å²	81	100.7 Å²	100.7	42%	0.424	56%	0.557	S	S	.	*	H	α-helix	trans	-65.4	-47.2	179.6	-159	104.4	0	0	0	111	L97 F125 I126 S131 S132 Q133	L97-L129 HydrophobicContact CD2-CD2 4.44Å; F125-L129 HydrophobicContact CE1-CB 4.21Å; F125-L129 HydrophobicContact CE1-CD1 3.58Å; F125-L129 HydrophobicContact CE1-CG 4.41Å; F125-L129 HydrophobicContact CZ-CD1 3.58Å; F125-L129 WeakPolarHBondContact O-CB 3.14Å; F125-L129 PolarHBondContact O-N 2.86Å; I126-L129 PolarHBondContact O-N 3.19Å; L129-S131 VanDerWaalsContact C-N 3.35Å; L129-S131 PolarHBondContact O-N 2.69Å; L129-S132 PolarHBondContact O-N 3.27Å; L129-Q133 PolarHBondContact O-N 3.17Å; L129-Q133 VanDerWaalsContact O-N 3.16Å
130	L	68	Low	58.1	Low	98 Å²	98	103.8 Å²	103.8	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-64	-39.5	176.3	-67.6	174.7	0	0	0	112	I126 S132 Q133 N134	I126-L130 HydrophobicContact CG2-CD1 3.8Å; I126-L130 HydrophobicContact CG2-CG 4.26Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 VanDerWaalsContact O-CG 3.31Å; I126-L130 WeakPolarHBondContact O-CG 3.48Å; I126-L130 PolarHBondContact O-N 3.41Å; L130-S132 VanDerWaalsContact C-N 3.32Å; L130-S132 PolarHBondContact O-N 3.14Å; L130-Q133 PolarHBondContact O-N 3.11Å; L130-N134 PolarHBondContact O-N 2.83Å
131	S	70.2	Confident	57.2	Low	49 Å²	49	104.4 Å²	104.4	34%	0.343	57%	0.57	S	S	.	*	H	α-helix	trans	-65.5	-36.8	176.3	-59.3	0	0	0	0	112	F127 K128 L129 Q133	F127-S131 VanDerWaalsContact O-CB 3.26Å; F127-S131 WeakPolarHBondContact O-CB 3.27Å; F127-S131 PolarHBondContact O-N 3.25Å; F127-S131 PolarHBondContact O-OG 2.97Å; K128-S131 PolarHBondContact O-N 3.22Å; L129-S131 VanDerWaalsContact C-N 3.35Å; L129-S131 PolarHBondContact O-N 2.69Å; S131-Q133 VanDerWaalsContact C-N 3.34Å
132	S	63.1	Low	56.7	Low	71 Å²	71	107.6 Å²	107.6	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-34.4	178.4	-58.1	0	0	0	0	112	K128 L129 L130 N135	K128-S132 WeakPolarHBondContact O-CB 3.42Å; K128-S132 PolarHBondContact O-N 3.38Å; K128-S132 PolarHBondContact O-OG 3.24Å; L129-S132 PolarHBondContact O-N 3.27Å; L130-S132 VanDerWaalsContact C-N 3.32Å; L130-S132 PolarHBondContact O-N 3.14Å; S132-N135 PolarHBondContact O-N 3.11Å
133	Q	57.6	Low	55.9	Low	133 Å²	133	114.8 Å²	114.8	62%	0.621	62%	0.615	S	S	*	*	H	α-helix	trans	-72.4	-33.4	-178.4	-154.7	169.3	42.7	0	0	112.8	L129 L130 S131 N135 Q136	L129-Q133 PolarHBondContact O-N 3.17Å; L129-Q133 VanDerWaalsContact O-N 3.16Å; L130-Q133 PolarHBondContact O-N 3.11Å; S131-Q133 VanDerWaalsContact C-N 3.34Å; Q133-N135 PolarHBondContact O-N 3.5Å; Q133-Q136 PolarHBondContact O-N 3.44Å; Q133-Q136 VanDerWaalsContact O-N 3.17Å
134	N	55.8	Low	54.5	Low	118 Å²	118	116.9 Å²	116.9	63%	0.631	62%	0.621	S	S	*	*	H	α-helix	trans	-64.9	-28	176.4	-80.4	-19	0	0	0	113	L130 Q136 S137	L130-N134 PolarHBondContact O-N 2.83Å; N134-Q136 PolarHBondContact O-N 3.49Å; N134-S137 PolarHBondContact O-N 3.41Å; N134-S137 PolarHBondContact O-OG 3.5Å
135	N	52.7	Low	53.5	Low	137 Å²	137	120 Å²	120	73%	0.733	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-8.7	177.9	-66	-24.9	0	0	0	113.8	S132 Q133	S132-N135 PolarHBondContact O-N 3.11Å; Q133-N135 PolarHBondContact O-N 3.5Å
136	Q	48.2	Very low	52.3	Low	167 Å²	167	123.5 Å²	123.5	78%	0.78	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-1.4	177.6	-114	177.4	9.1	0	0	114	Q133 N134 Q138	Q133-Q136 PolarHBondContact O-N 3.44Å; Q133-Q136 VanDerWaalsContact O-N 3.17Å; N134-Q136 PolarHBondContact O-N 3.49Å; Q136-Q138 PolarHBondContact O-N 3.02Å
137	S	43.2	Very low	50.9	Low	96 Å²	96	128.1 Å²	128.1	67%	0.671	67%	0.666	S	S	*	*			trans	-83.4	53.2	171.8	53.4	0	0	0	0	112.1	N134	N134-S137 PolarHBondContact O-N 3.41Å; N134-S137 PolarHBondContact O-OG 3.5Å
138	Q	40	Very low	49.3	Very low	168 Å²	168	130.5 Å²	130.5	79%	0.785	68%	0.678	S	S	*	*	S	Bend	trans	-133.5	127.7	161.4	-74.8	-174.9	-8.1	0	0	108.1	Q136	Q136-Q138 PolarHBondContact O-N 3.02Å
139	S	41	Very low	47.4	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	68%	0.679	S	S	*	*			trans	79.8	66	179.4	75.4	0	0	0	0	117.5
140	I	33.7	Very low	45.7	Very low	149 Å²	149	132 Å²	132	76%	0.764	70%	0.698	S	S	*	*			trans	-82.5	112.2	144.6	-59.8	171.7	0	0	0	105.2
141	S	40.7	Very low	44	Very low	78 Å²	78	135.8 Å²	135.8	55%	0.545	72%	0.719	S	S	.	*			trans	-63.8	135.2	171.5	51.3	0	0	0	0	109.4	E143 N144	S141-E143 PolarHBondContact O-N 2.59Å; S141-N144 PolarHBondContact O-N 3.4Å
142	E	46.7	Very low	42.2	Very low	192 Å²	192	137 Å²	137	90%	0.897	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-60.4	-4.6	-173.7	-70.6	-173.3	147.8	0	0	114.8
143	E	45	Very low	40.9	Very low	177 Å²	177	143.2 Å²	143.2	83%	0.827	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-82.4	-13.6	-177.6	-69.2	-171.1	153.4	0	0	115.1	S141	S141-E143 PolarHBondContact O-N 2.59Å
144	N	38.4	Very low	39.7	Very low	129 Å²	129	144 Å²	144	69%	0.69	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-98.2	6.1	179.4	-84.9	-40.6	0	0	0	115.2	S141 L146	S141-N144 PolarHBondContact O-N 3.4Å; N144-L146 VanDerWaalsContact C-N 3.27Å; N144-L146 PolarHBondContact O-N 3.45Å
145	L	42.7	Very low	38.5	Very low	135 Å²	135	145.9 Å²	145.9	71%	0.707	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	1.8	178.6	-144.8	88.3	0	0	0	114.2
146	L	39.8	Very low	37.8	Very low	139 Å²	139	147.4 Å²	147.4	73%	0.728	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-8.8	-174.4	-151	69.6	0	0	0	115.1	N144	N144-L146 VanDerWaalsContact C-N 3.27Å; N144-L146 PolarHBondContact O-N 3.45Å
147	F	36.7	Very low	37.1	Very low	172 Å²	172	143.5 Å²	143.5	75%	0.754	75%	0.752	S	S	*	*	S	Bend	trans	-116.7	12.3	-173.7	-74.4	-71.4	0	0	0	117.1
148	H	34.2	Very low	36.7	Very low	181 Å²	181	147.9 Å²	147.9	84%	0.838	76%	0.762	S	S	*	*			trans	-138.8	55.4	173.6	-69.2	-57.7	0	0	0	113.7
149	T	31.8	Very low	36.6	Very low	105 Å²	105	146.2 Å²	146.2	64%	0.644	76%	0.758	S	S	*	*			trans	-123.7	66	167.7	47.9	0	0	0	0	110.9
150	N	30.6	Very low	36.1	Very low	156 Å²	156	147.5 Å²	147.5	83%	0.834	76%	0.755	S	S	*	*			trans	-149.6	73.6	162.6	-86	-35.8	0	0	0	109.9
151	N	33	Very low	36.3	Very low	176 Å²	176	144.4 Å²	144.4	94%	0.941	74%	0.743	S	S	*	*			trans	-160.3	67.3	150	-88.3	-24.9	0	0	0	107.5
152	S	31.9	Very low	35.9	Very low	75 Å²	75	148.1 Å²	148.1	52%	0.524	76%	0.757	S	S	.	*			trans	-89.8	131.6	166.7	-176.2	0	0	0	0	108.2
153	Y	34.5	Very low	35.5	Very low	202 Å²	202	147.8 Å²	147.8	79%	0.792	75%	0.749	S	S	*	*				173.4	106.4	104	-85.7	-80.2	0	0	0	110.9
154	H	32.4	Very low	35.1	Very low	148 Å²	148	145.8 Å²	145.8	69%	0.685	74%	0.742	S	S	*	*			trans	53.5	110.2	134.8	-69.1	-94.2	0	0	0	121.5
155	N	31.8	Very low	35.4	Very low	158 Å²	158	144.8 Å²	144.8	85%	0.845	74%	0.741	S	S	*	*				-168.4	67.2	115.1	-98.9	-36.7	0	0	0	110.1	S157	N155-S157 PolarHBondContact O-N 3.04Å; N155-S157 VanDerWaalsContact O-N 3.07Å
156	I	36.6	Very low	35.4	Very low	169 Å²	169	143.3 Å²	143.3	87%	0.867	73%	0.734	S	S	*	*			trans	-80.7	81.9	159.7	-59.3	173.7	0	0	0	105.1	Q158	I156-Q158 PolarHBondContact O-N 3.15Å; I156-Q158 VanDerWaalsContact O-N 3.15Å
157	S	35.2	Very low	35.8	Very low	85 Å²	85	144.5 Å²	144.5	59%	0.594	74%	0.735	S	S	*	*			trans	-51.5	118.3	159.7	44.7	0	0	0	0	106.9	N155 L159	N155-S157 PolarHBondContact O-N 3.04Å; N155-S157 VanDerWaalsContact O-N 3.07Å; S157-L159 PolarHBondContact O-N 3.39Å
158	Q	34.5	Very low	36.4	Very low	188 Å²	188	141.5 Å²	141.5	88%	0.879	73%	0.727	S	S	*	*			trans	-44.3	90.6	169.3	-77.3	167.2	-25.4	0	0	109	I156 D160	I156-Q158 PolarHBondContact O-N 3.15Å; I156-Q158 VanDerWaalsContact O-N 3.15Å; Q158-D160 PolarHBondContact O-N 3.01Å
159	L	37.9	Very low	37.3	Very low	134 Å²	134	140.8 Å²	140.8	70%	0.702	72%	0.722	S	S	*	*			trans	-79.9	106	165	-109.6	151.6	0	0	0	102.7	S157 T161	S157-L159 PolarHBondContact O-N 3.39Å; L159-T161 HydrophobicContact CB-CG2 4.33Å; L159-T161 HydrophobicContact CD2-CG2 4.34Å; L159-T161 PolarHBondContact O-N 2.82Å
160	D	30.4	Very low	38.2	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	72%	0.723	S	S	*	*			trans	-58.9	68.4	161.9	-73.9	-34.8	0	0	0	108.4	Q158 N162	Q158-D160 PolarHBondContact O-N 3.01Å; D160-N162 VanDerWaalsContact C-N 3.35Å; D160-N162 PolarHBondContact O-N 3.22Å
161	T	36.7	Very low	39.2	Very low	84 Å²	84	137.9 Å²	137.9	52%	0.515	71%	0.708	S	S	.	*			trans	-83.4	95.7	160.6	52.7	0	0	0	0	104.9	L159 Y163	L159-T161 HydrophobicContact CB-CG2 4.33Å; L159-T161 HydrophobicContact CD2-CG2 4.34Å; L159-T161 PolarHBondContact O-N 2.82Å; T161-Y163 HydrophobicContact CG2-CD2 4.21Å; T161-Y163 HydrophobicContact CG2-CE2 4.19Å; T161-Y163 PolarHBondContact O-N 3.06Å
162	N	32.3	Very low	39.9	Very low	155 Å²	155	136.1 Å²	136.1	83%	0.829	69%	0.692	S	S	*	*			trans	-60.6	62.1	152.5	-70.6	-25.6	0	0	0	108.5	D160 I164	D160-N162 VanDerWaalsContact C-N 3.35Å; D160-N162 PolarHBondContact O-N 3.22Å; N162-I164 PolarHBondContact O-N 3.44Å
163	Y	38.3	Very low	40.7	Very low	185 Å²	185	135 Å²	135	73%	0.725	68%	0.684	S	S	*	*			trans	-72.2	107.4	151.7	-86.1	-74.4	0	0	0	103.7	T161 T165	T161-Y163 HydrophobicContact CG2-CD2 4.21Å; T161-Y163 HydrophobicContact CG2-CE2 4.19Å; T161-Y163 PolarHBondContact O-N 3.06Å; Y163-T165 PolarHBondContact O-N 3.19Å; Y163-T165 PolarHBondContact O-OG1 3.5Å
164	I	37.7	Very low	41.4	Very low	135 Å²	135	132.9 Å²	132.9	69%	0.692	68%	0.675	S	S	*	*			trans	-52.7	96.5	158.7	-71.3	167.2	0	0	0	105	N162 D166	N162-I164 PolarHBondContact O-N 3.44Å; I164-D166 HydrophobicContact CG2-CB 3.68Å; I164-D166 VanDerWaalsContact CG2-OD2 3.29Å; I164-D166 WeakPolarHBondContact CG2-OD2 3.41Å; I164-D166 PolarHBondContact O-N 3.2Å
165	T	44	Very low	42.1	Very low	108 Å²	108	132.7 Å²	132.7	66%	0.663	68%	0.675	S	S	*	*			trans	-74.3	54.3	169.6	-36	0	0	0	0	107.5	Y163 H167	Y163-T165 PolarHBondContact O-N 3.19Å; Y163-T165 PolarHBondContact O-OG1 3.5Å; T165-H167 PolarHBondContact O-N 3.03Å
166	D	42	Very low	43.1	Very low	104 Å²	104	134.4 Å²	134.4	56%	0.556	67%	0.671	S	S	*	*			trans	-72.9	94.8	167.3	-81.9	-7.3	0	0	0	105.1	I164 N168 F169	I164-D166 HydrophobicContact CG2-CB 3.68Å; I164-D166 VanDerWaalsContact CG2-OD2 3.29Å; I164-D166 WeakPolarHBondContact CG2-OD2 3.41Å; I164-D166 PolarHBondContact O-N 3.2Å; D166-N168 PolarHBondContact O-N 2.84Å; D166-F169 PolarHBondContact O-N 2.98Å
167	H	49.4	Very low	43.7	Very low	164 Å²	164	133.4 Å²	133.4	76%	0.759	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.8	-10.4	164.9	-83.3	-80.7	0	0	0	112.7	T165	T165-H167 PolarHBondContact O-N 3.03Å
168	N	48.7	Very low	44.2	Very low	109 Å²	109	134.1 Å²	134.1	58%	0.583	66%	0.664	S	S	*	*	H	α-helix	trans	-86.2	-9	174.5	-70	-20.2	0	0	0	115.8	D166 L170 S171 K172	D166-N168 PolarHBondContact O-N 2.84Å; N168-L170 VanDerWaalsContact C-N 3.32Å; N168-L170 PolarHBondContact O-N 3.21Å; N168-S171 PolarHBondContact O-N 3.4Å; N168-K172 PolarHBondContact O-N 3.49Å; N168-K172 VanDerWaalsContact O-N 3.09Å
169	F	53	Low	44.6	Very low	166 Å²	166	128.8 Å²	128.8	73%	0.728	65%	0.647	S	S	*	*	H	α-helix	trans	-66.6	-36.5	-179.9	-161.3	-91.5	0	0	0	112	D166 S173	D166-F169 PolarHBondContact O-N 2.98Å; F169-S173 PolarHBondContact O-N 3.32Å; F169-S173 PolarHBondContact O-OG 3.47Å; F169-S173 VanDerWaalsContact O-OG 3.06Å
170	L	51.9	Low	44.8	Very low	128 Å²	128	130.2 Å²	130.2	67%	0.67	66%	0.656	S	S	*	*	H	α-helix	trans	-71.6	-38.4	175.6	-68.4	173.5	0	0	0	112.2	N168 K172 S173 Y174	N168-L170 VanDerWaalsContact C-N 3.32Å; N168-L170 PolarHBondContact O-N 3.21Å; L170-K172 VanDerWaalsContact C-N 3.34Å; L170-K172 PolarHBondContact O-N 3.1Å; L170-S173 WeakPolarHBondContact CA-OG 3.36Å; L170-S173 PolarHBondContact O-N 3.04Å; L170-S173 PolarHBondContact O-OG 3.47Å; L170-Y174 PolarHBondContact O-N 3.08Å
171	S	50.7	Low	45.4	Very low	73 Å²	73	125.9 Å²	125.9	51%	0.51	65%	0.646	S	S	.	*	H	α-helix	trans	-64.7	-37.5	175.9	-60.2	0	0	0	0	112.4	N168 S173 Y174 E175	N168-S171 PolarHBondContact O-N 3.4Å; S171-S173 PolarHBondContact O-N 3.1Å; S171-Y174 VanDerWaalsContact O-CB 3.31Å; S171-Y174 WeakPolarHBondContact O-CB 3.36Å; S171-Y174 PolarHBondContact O-N 3.45Å; S171-E175 PolarHBondContact O-N 3.21Å
172	K	47.2	Very low	45.6	Very low	138 Å²	138	127.1 Å²	127.1	60%	0.6	66%	0.658	S	S	*	*	H	α-helix	trans	-66.9	-34.3	177.2	-83.4	-174.6	176.7	-178.8	0	113.6	N168 L170 Y174 E175 Y176	N168-K172 PolarHBondContact O-N 3.49Å; N168-K172 VanDerWaalsContact O-N 3.09Å; L170-K172 VanDerWaalsContact C-N 3.34Å; L170-K172 PolarHBondContact O-N 3.1Å; K172-Y174 VanDerWaalsContact C-N 3.25Å; K172-Y174 PolarHBondContact O-N 3.06Å; K172-E175 PolarHBondContact O-N 3.49Å; K172-Y176 WeakPolarHBondContact O-CD2 3.39Å; K172-Y176 PolarHBondContact O-N 3.02Å
173	S	49.1	Very low	46.2	Very low	52 Å²	52	124.6 Å²	124.6	36%	0.364	65%	0.649	S	S	.	*	H	α-helix	trans	-69.1	-28.9	176.5	28.2	0	0	0	0	111.7	F169 L170 S171 Y176 L177	F169-S173 PolarHBondContact O-N 3.32Å; F169-S173 PolarHBondContact O-OG 3.47Å; F169-S173 VanDerWaalsContact O-OG 3.06Å; L170-S173 WeakPolarHBondContact CA-OG 3.36Å; L170-S173 PolarHBondContact O-N 3.04Å; L170-S173 PolarHBondContact O-OG 3.47Å; S171-S173 PolarHBondContact O-N 3.1Å; S173-Y176 PolarHBondContact O-N 3.01Å; S173-L177 PolarHBondContact O-N 3.05Å
174	Y	48.4	Very low	46.5	Very low	157 Å²	157	121.6 Å²	121.6	62%	0.616	65%	0.652	S	S	*	*	H	α-helix	trans	-64.2	-41.9	171.6	-128	-92.2	0	0	0	112.6	L170 S171 K172 L177 N178	L170-Y174 PolarHBondContact O-N 3.08Å; S171-Y174 VanDerWaalsContact O-CB 3.31Å; S171-Y174 WeakPolarHBondContact O-CB 3.36Å; S171-Y174 PolarHBondContact O-N 3.45Å; K172-Y174 VanDerWaalsContact C-N 3.25Å; K172-Y174 PolarHBondContact O-N 3.06Å; Y174-L177 PolarHBondContact O-N 3.36Å; Y174-N178 WeakPolarHBondContact CD1-ND2 3.47Å; Y174-N178 VanDerWaalsContact CE1-ND2 3.31Å; Y174-N178 WeakPolarHBondContact CE1-ND2 3.43Å; Y174-N178 WeakPolarHBondContact O-CB 3.4Å; Y174-N178 PolarHBondContact O-N 3.43Å
175	E	48.4	Very low	46.8	Very low	145 Å²	145	124.7 Å²	124.7	68%	0.678	66%	0.656	S	S	*	*	H	α-helix	trans	-66.5	-37.6	175.6	-80.9	-174.5	164.2	0	0	112.5	S171 K172 L177 S179	S171-E175 PolarHBondContact O-N 3.21Å; K172-E175 PolarHBondContact O-N 3.49Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 3.41Å; E175-S179 VanDerWaalsContact O-CB 3.27Å; E175-S179 WeakPolarHBondContact O-CB 3.4Å; E175-S179 PolarHBondContact O-N 3.02Å
176	Y	51.8	Low	46.5	Very low	193 Å²	193	127.8 Å²	127.8	76%	0.757	66%	0.663	S	S	*	*	H	α-helix	trans	-67.2	-31.6	178.8	-94.4	-82.9	0	0	0	113.5	K172 S173	K172-Y176 WeakPolarHBondContact O-CD2 3.39Å; K172-Y176 PolarHBondContact O-N 3.02Å; S173-Y176 PolarHBondContact O-N 3.01Å
177	L	49.6	Very low	46.7	Very low	148 Å²	148	128 Å²	128	78%	0.775	67%	0.668	S	S	*	*	H	α-helix	trans	-88.5	-24.3	179.8	-66.2	175.2	0	0	0	113.3	S173 Y174 E175	S173-L177 PolarHBondContact O-N 3.05Å; Y174-L177 PolarHBondContact O-N 3.36Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 3.41Å
178	N	46.1	Very low	46.5	Very low	101 Å²	101	126.7 Å²	126.7	54%	0.54	67%	0.667	S	S	.	*	H	α-helix	trans	-104.1	-5.2	178.5	-69	-20.7	0	0	0	114.1	Y174 N180	Y174-N178 WeakPolarHBondContact CD1-ND2 3.47Å; Y174-N178 VanDerWaalsContact CE1-ND2 3.31Å; Y174-N178 WeakPolarHBondContact CE1-ND2 3.43Å; Y174-N178 WeakPolarHBondContact O-CB 3.4Å; Y174-N178 PolarHBondContact O-N 3.43Å; N178-N180 PolarHBondContact O-N 3.5Å
179	S	42	Very low	46.6	Very low	75 Å²	75	128.1 Å²	128.1	52%	0.524	68%	0.675	S	S	.	*	S	Bend	trans	-63.8	114.4	164.7	81.2	0	0	0	0	106.2	E175 G181	E175-S179 VanDerWaalsContact O-CB 3.27Å; E175-S179 WeakPolarHBondContact O-CB 3.4Å; E175-S179 PolarHBondContact O-N 3.02Å; S179-G181 PolarHBondContact O-N 3.36Å
180	N	44	Very low	46.3	Very low	165 Å²	165	127.8 Å²	127.8	88%	0.882	68%	0.681	S	S	*	*			trans	-66.5	55.3	171.8	-67.1	-35.1	0	0	0	109.8	N178 S182	N178-N180 PolarHBondContact O-N 3.5Å; N180-S182 PolarHBondContact O-N 3.43Å
181	G	41.6	Very low	46	Very low	59 Å²	59	128 Å²	128	61%	0.608	68%	0.681	S	S	*	*			trans	-71.2	80.8	176	0	0	0	0	0	108.2	S179 T183	S179-G181 PolarHBondContact O-N 3.36Å; G181-T183 PolarHBondContact O-N 3.38Å; G181-T183 VanDerWaalsContact O-N 3.11Å
182	S	41.3	Very low	45.8	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	70%	0.695	S	S	*	*			trans	-4.2	101.7	156.3	-163.4	0	0	0	0	112.2	N180 P184	N180-S182 PolarHBondContact O-N 3.43Å; S182-P184 WeakPolarHBondContact O-CD 3.43Å
183	T	45.2	Very low	45.7	Very low	102 Å²	102	134.4 Å²	134.4	63%	0.626	71%	0.71	S	S	*	*			trans	-55.7	120.7	169.5	46.9	0	0	0	0	108.9	G181 Y185	G181-T183 PolarHBondContact O-N 3.38Å; G181-T183 VanDerWaalsContact O-N 3.11Å; T183-Y185 HydrophobicContact CG2-CD2 4.37Å; T183-Y185 PolarHBondContact O-N 3.47Å
184	P	44.7	Very low	45.1	Very low	123 Å²	123	140.4 Å²	140.4	80%	0.799	74%	0.737	S	S	*	*			trans	-85.1	57.5	167.7	36.8	-30.1	0	0	0	107.6	S182 Q186	S182-P184 WeakPolarHBondContact O-CD 3.43Å; P184-Q186 PolarHBondContact O-N 3.13Å
185	Y	43.8	Very low	44.7	Very low	199 Å²	199	140.1 Å²	140.1	78%	0.78	78%	0.782	S	S	*	*			trans	-91.4	80.9	155	-68.8	-69.9	0	0	0	104.5	T183 T187	T183-Y185 HydrophobicContact CG2-CD2 4.37Å; T183-Y185 PolarHBondContact O-N 3.47Å; Y185-T187 VanDerWaalsContact C-N 3.31Å; Y185-T187 PolarHBondContact O-N 3.01Å
186	Q	38.5	Very low	44.6	Very low	173 Å²	173	139.9 Å²	139.9	81%	0.808	79%	0.787	S	S	*	*			trans	-54.9	106.4	158.7	-157.9	153.4	-22.7	0	0	104.6	P184 D188	P184-Q186 PolarHBondContact O-N 3.13Å; Q186-D188 PolarHBondContact O-N 3.48Å; Q186-D188 VanDerWaalsContact O-N 3.15Å
187	T	45	Very low	44.2	Very low	108 Å²	108	137.1 Å²	137.1	66%	0.663	79%	0.789	S	S	*	*			trans	-59.6	113.6	171.4	32	0	0	0	0	106.5	Y185 D189	Y185-T187 VanDerWaalsContact C-N 3.31Å; Y185-T187 PolarHBondContact O-N 3.01Å; T187-D189 PolarHBondContact O-N 3.43Å
188	D	46	Very low	43.9	Very low	137 Å²	137	136.5 Å²	136.5	73%	0.733	79%	0.789	S	S	*	*			trans	-68.1	38.4	175.6	-71.2	-41.2	0	0	0	112.1	Q186	Q186-D188 PolarHBondContact O-N 3.48Å; Q186-D188 VanDerWaalsContact O-N 3.15Å
189	D	49.3	Very low	43.7	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	8.6	-177.2	-77.7	-31.3	0	0	0	113.7	T187	T187-D189 PolarHBondContact O-N 3.43Å
190	D	48	Very low	43.9	Very low	160 Å²	160	142.6 Å²	142.6	86%	0.856	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	23.8	177.8	-74.4	-26.9	0	0	0	114.2
191	I	44.8	Very low	43.8	Very low	131 Å²	131	141.1 Å²	141.1	67%	0.672	82%	0.817	S	S	*	*	S	Bend	trans	-115.9	87.5	168.4	-49.2	-175.2	0	0	0	108.2
192	D	47.3	Very low	44	Very low	150 Å²	150	146.9 Å²	146.9	80%	0.802	83%	0.832	S	S	*	*			trans	164.6	42.7	142.6	-78	-17.6	0	0	0	112.8
193	Q	45.8	Very low	44.2	Very low	197 Å²	197	149.8 Å²	149.8	92%	0.921	84%	0.838	S	S	*	*			trans	-112.7	54.2	156.7	-80.8	-168.3	43.1	0	0	111.3
194	L	36.4	Very low	44.1	Very low	178 Å²	178	153.8 Å²	153.8	93%	0.932	86%	0.855	S	S	*	*			trans	-136.2	95.2	159.5	-73.5	176	0	0	0	108.3
195	G	40.2	Very low	44.1	Very low	151 Å²	151	156.6 Å²	156.6	100%	1.557	86%	0.861	S	S	*	*			trans	174	0	177.9	0	0	0	0	0	110.8

Retrieved 195 of 195 residues in 29.4 ms (Link to these results)

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