A0A096M313_POEFO Loading...

S100 calcium binding protein Z

AlphaFold DB , UniProt , Accession A0A096M313, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 178 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	41.7	Very low	38.3	Very low	238 Å²	238	152.4 Å²	152.4	100%	1.172	83%	0.825	S	S	*	*				0	96.8	0	-75.7	150.4	150	0	0	105.9
2	R	35.4	Very low	38.6	Very low	241 Å²	241	149.6 Å²	149.6	91%	0.909	82%	0.821	S	S	*	*				45	127.7	82.3	-75.4	-165.2	-155.8	-125.9	5.1	111.1
3	S	35.6	Very low	38.6	Very low	107 Å²	107	153.1 Å²	153.1	75%	0.748	82%	0.823	S	S	*	*			cis	-178.8	158.2	-4.1	24.8	0	0	0	0	106.2
4	S	38.7	Very low	38.6	Very low	110 Å²	110	151.6 Å²	151.6	77%	0.769	81%	0.812	S	S	*	*			trans	-39.3	169.3	174.2	-55.1	0	0	0	0	118.2
5	P	49.9	Very low	38.5	Very low	126 Å²	126	150.9 Å²	150.9	82%	0.818	80%	0.802	S	S	*	*			trans	-86.8	158.9	-163.4	37	-30.4	0	0	0	112.7
6	V	37.3	Very low	38.3	Very low	139 Å²	139	151.4 Å²	151.4	84%	0.842	81%	0.805	S	S	*	*			trans	-140	121.1	173.5	-171.7	0	0	0	0	110
7	E	40.3	Very low	38.1	Very low	157 Å²	157	153.3 Å²	153.3	73%	0.734	80%	0.798	S	S	*	*			trans	-55.3	156.6	164.4	-74.2	173.2	94.4	0	0	113
8	L	33.1	Very low	38.3	Very low	161 Å²	161	150.7 Å²	150.7	84%	0.843	79%	0.793	S	S	*	*				-161.4	98	124.9	-122.1	116.5	0	0	0	112.5
9	I	41.1	Very low	38.4	Very low	124 Å²	124	149.8 Å²	149.8	64%	0.636	80%	0.797	S	S	*	*				29.6	121.8	124.3	-52.9	166.7	0	0	0	117.6
10	I	34.3	Very low	38.3	Very low	165 Å²	165	145 Å²	145	85%	0.846	78%	0.784	S	S	*	*				-162.2	122.6	112.8	-61.9	-154.6	0	0	0	109.5
11	S	33.8	Very low	38	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	78%	0.784	S	S	*	*			trans	-89.6	174.4	162.6	-61.6	0	0	0	0	110.5
12	P	42	Very low	37.7	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	77%	0.769	S	S	*	*			cis	-123.6	164.2	-19.8	36.8	-20.5	0	0	0	112.1
13	K	38.1	Very low	37.7	Very low	195 Å²	195	134.9 Å²	134.9	85%	0.848	76%	0.76	S	S	*	*			trans	-134.6	91.1	161.7	-158	148.1	-175.2	172.8	0	108.9
14	I	39.3	Very low	37.7	Very low	132 Å²	132	137 Å²	137	68%	0.677	76%	0.757	S	S	*	*				63.7	103.2	113.1	-60.2	173.5	0	0	0	111.2	D16	I14-D16 PolarHBondContact O-N 3.19Å
15	E	36.8	Very low	37.4	Very low	142 Å²	142	136.3 Å²	136.3	66%	0.664	75%	0.752	S	S	*	*			trans	-43.6	100.5	162.9	-173.2	169.5	170.3	0	0	112.2	R17	E15-R17 HydrophobicContact CG-CB 4.15Å; E15-R17 PolarHBondContact O-N 3.06Å; E15-R17 IonicContact OE1-CZ 2.78Å; E15-R17 IonicContact OE1-NE 3.56Å; E15-R17 PolarHBondContact OE1-NE 2.92Å; E15-R17 IonicContact OE1-NH2 2.73Å; E15-R17 PolarHBondContact OE1-NH2 2.9Å
16	D	34.8	Very low	37.2	Very low	158 Å²	158	135.8 Å²	135.8	85%	0.845	75%	0.751	S	S	*	*			trans	-86.8	73.7	159.3	-81.9	-32.3	0	0	0	108.6	I14	I14-D16 PolarHBondContact O-N 3.19Å
17	R	36.3	Very low	37.2	Very low	184 Å²	184	136.3 Å²	136.3	69%	0.694	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.3	126.2	157.4	179.6	-168.1	-62.2	-139.9	0	107.2	E15	E15-R17 HydrophobicContact CG-CB 4.15Å; E15-R17 PolarHBondContact O-N 3.06Å; E15-R17 IonicContact OE1-CZ 2.78Å; E15-R17 IonicContact OE1-NE 3.56Å; E15-R17 PolarHBondContact OE1-NE 2.92Å; E15-R17 IonicContact OE1-NH2 2.73Å; E15-R17 PolarHBondContact OE1-NH2 2.9Å
18	P	40.6	Very low	37.2	Very low	107 Å²	107	133.4 Å²	133.4	70%	0.695	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.9	135.7	171.1	24.3	-31.7	0	0	0	109.8	G20	P18-G20 PolarHBondContact O-N 2.94Å; P18-G20 VanDerWaalsContact O-N 3.17Å
19	P	40.2	Very low	37.6	Very low	134 Å²	134	128.7 Å²	128.7	87%	0.87	72%	0.721	S	S	*	*	S	Bend	trans	-67	116.5	178.6	25	-30.9	0	0	0	110.5
20	G	36.6	Very low	37.7	Very low	53 Å²	53	125.1 Å²	125.1	55%	0.546	71%	0.71	S	S	.	*			trans	72.7	66.6	143.8	0	0	0	0	0	117.3	P18 F22	P18-G20 PolarHBondContact O-N 2.94Å; P18-G20 VanDerWaalsContact O-N 3.17Å; G20-F22 VanDerWaalsContact C-N 3.26Å; G20-F22 PolarHBondContact O-N 2.96Å
21	S	32.4	Very low	38.2	Very low	112 Å²	112	120.4 Å²	120.4	78%	0.783	70%	0.695	S	S	*	*			trans	-65.6	92.7	147.6	57.3	0	0	0	0	108.3	S23	S21-S23 PolarHBondContact O-N 3.35Å
22	F	35.6	Very low	38.5	Very low	196 Å²	196	122.6 Å²	122.6	86%	0.86	69%	0.687	S	S	*	*			trans	-70.4	94.6	172.8	-94.7	-90	0	0	0	109	G20 F24	G20-F22 VanDerWaalsContact C-N 3.26Å; G20-F22 PolarHBondContact O-N 2.96Å; F22-F24 PolarHBondContact O-N 3.41Å
23	S	34.3	Very low	38.7	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	68%	0.675	S	S	*	*			trans	-76.1	109.2	171.1	-61	0	0	0	0	108.7	S21 S25	S21-S23 PolarHBondContact O-N 3.35Å; S23-S25 VanDerWaalsContact C-N 3.34Å; S23-S25 PolarHBondContact O-N 2.92Å
24	F	35.3	Very low	38.9	Very low	153 Å²	153	116.6 Å²	116.6	67%	0.671	65%	0.653	S	S	*	*			trans	-68.3	92.8	172.5	-129.6	-95	0	0	0	109.1	F22 S26	F22-F24 PolarHBondContact O-N 3.41Å; F24-S26 PolarHBondContact O-N 3.47Å
25	S	33.8	Very low	38.9	Very low	95 Å²	95	113.6 Å²	113.6	66%	0.664	64%	0.644	S	S	*	*			trans	-67.4	106.7	174.8	-176	0	0	0	0	109.2	S23 K27	S23-S25 VanDerWaalsContact C-N 3.34Å; S23-S25 PolarHBondContact O-N 2.92Å; S25-K27 PolarHBondContact O-N 3.49Å
26	S	44.8	Very low	39.5	Very low	114 Å²	114	113.9 Å²	113.9	80%	0.797	64%	0.639	S	S	*	*			trans	-56.1	96.7	174.7	-121.9	0	0	0	0	110.9	F24	F24-S26 PolarHBondContact O-N 3.47Å
27	K	37.5	Very low	40.3	Very low	150 Å²	150	109.7 Å²	109.7	65%	0.652	62%	0.616	S	S	*	*			trans	-103.1	120.7	165.3	-75.1	-174.6	179.4	178.3	0	109.5	S25 A29 A30	S25-K27 PolarHBondContact O-N 3.49Å; K27-A29 PolarHBondContact O-N 3.06Å; K27-A30 WeakPolarHBondContact O-CB 3.5Å; K27-A30 PolarHBondContact O-N 2.81Å
28	P	41.3	Very low	40.8	Very low	97 Å²	97	105 Å²	105	63%	0.63	60%	0.604	S	S	*	*	H	α-helix	trans	-67.6	2.3	179.1	26.6	-33.4	0	0	0	114.2	R32	P28-R32 PolarHBondContact O-NE 3.06Å
29	A	40.5	Very low	41	Very low	61 Å²	61	103.2 Å²	103.2	50%	0.504	59%	0.591	S	S	.	*	H	α-helix	trans	-79.3	-33.9	167.6	0	0	0	0	0	112.2	K27 R32 H33	K27-A29 PolarHBondContact O-N 3.06Å; A29-R32 PolarHBondContact O-N 3.3Å; A29-H33 WeakPolarHBondContact O-CB 3.49Å; A29-H33 PolarHBondContact O-N 3.19Å
30	A	43.8	Very low	41.4	Very low	49 Å²	49	105.5 Å²	105.5	41%	0.405	58%	0.583	S	S	.	*	H	α-helix	trans	-70.5	-40.2	-179.5	0	0	0	0	0	111.8	K27 R32 H33 L34	K27-A30 WeakPolarHBondContact O-CB 3.5Å; K27-A30 PolarHBondContact O-N 2.81Å; A30-R32 VanDerWaalsContact C-N 3.34Å; A30-R32 PolarHBondContact O-N 2.83Å; A30-H33 CarbonylContact O-C 3.59Å; A30-H33 WeakPolarHBondContact O-CA 3.45Å; A30-H33 WeakPolarHBondContact O-CB 3.49Å; A30-H33 PolarHBondContact O-N 2.94Å; A30-L34 WeakPolarHBondContact O-CG 3.41Å; A30-L34 PolarHBondContact O-N 2.85Å
31	A	43.6	Very low	41.9	Very low	66 Å²	66	107.9 Å²	107.9	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-62.9	-38.4	175.6	0	0	0	0	0	112.7	H33 S35	A31-H33 VanDerWaalsContact C-N 3.3Å; A31-H33 PolarHBondContact O-N 3.36Å; A31-S35 WeakPolarHBondContact O-CB 3.19Å; A31-S35 PolarHBondContact O-N 2.96Å
32	R	41.4	Very low	42.5	Very low	154 Å²	154	105 Å²	105	58%	0.581	57%	0.566	S	S	*	*	H	α-helix	trans	-72.6	-23.2	173.6	-73.7	-174.5	-73.1	168.6	-3.5	113	P28 A29 A30 R36	P28-R32 PolarHBondContact O-NE 3.06Å; A29-R32 PolarHBondContact O-N 3.3Å; A30-R32 VanDerWaalsContact C-N 3.34Å; A30-R32 PolarHBondContact O-N 2.83Å; R32-R36 VanDerWaalsContact O-CG 3.32Å; R32-R36 WeakPolarHBondContact O-CG 3.32Å; R32-R36 PolarHBondContact O-N 2.85Å
33	H	45	Very low	42.7	Very low	115 Å²	115	102.3 Å²	102.3	53%	0.532	56%	0.556	S	S	.	*	H	α-helix	trans	-79.3	-42.2	174.1	-152.8	77.9	0	0	0	110.9	A29 A30 A31 R36 I37	A29-H33 WeakPolarHBondContact O-CB 3.49Å; A29-H33 PolarHBondContact O-N 3.19Å; A30-H33 CarbonylContact O-C 3.59Å; A30-H33 WeakPolarHBondContact O-CA 3.45Å; A30-H33 WeakPolarHBondContact O-CB 3.49Å; A30-H33 PolarHBondContact O-N 2.94Å; A31-H33 VanDerWaalsContact C-N 3.3Å; A31-H33 PolarHBondContact O-N 3.36Å; H33-R36 CarbonylContact O-C 3.11Å; H33-R36 PolarHBondContact O-N 3.16Å; H33-I37 VanDerWaalsContact CD2-CD1 3.44Å; H33-I37 WeakPolarHBondContact CD2-CD1 3.23Å; H33-I37 VanDerWaalsContact O-CG1 3.3Å; H33-I37 WeakPolarHBondContact O-CG1 3.43Å; H33-I37 PolarHBondContact O-N 2.78Å
34	L	43	Very low	43.1	Very low	73 Å²	73	106.5 Å²	106.5	38%	0.382	56%	0.556	S	S	.	*	H	α-helix	trans	-64.2	-40.6	173.7	-72.7	170.6	0	0	0	111.9	A30 R36 I37 L38	A30-L34 WeakPolarHBondContact O-CG 3.41Å; A30-L34 PolarHBondContact O-N 2.85Å; L34-R36 VanDerWaalsContact C-N 3.32Å; L34-R36 PolarHBondContact O-N 3.25Å; L34-I37 PolarHBondContact O-N 3.42Å; L34-L38 VanDerWaalsContact O-CB 3.29Å; L34-L38 WeakPolarHBondContact O-CB 3.44Å; L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 2.82Å
35	S	40.4	Very low	43.3	Very low	69 Å²	69	103.5 Å²	103.5	48%	0.483	55%	0.554	S	S	.	*	H	α-helix	trans	-61.1	-40.2	172.5	173.5	0	0	0	0	111.8	A31 L38 T39	A31-S35 WeakPolarHBondContact O-CB 3.19Å; A31-S35 PolarHBondContact O-N 2.96Å; S35-L38 PolarHBondContact O-N 3.47Å; S35-T39 WeakPolarHBondContact O-CB 3.29Å; S35-T39 PolarHBondContact O-N 2.88Å; S35-T39 PolarHBondContact O-OG1 3.17Å
36	R	47.9	Very low	43.7	Very low	149 Å²	149	106.2 Å²	106.2	56%	0.562	56%	0.56	S	S	*	*	H	α-helix	trans	-71.8	-32.5	175.3	-72.5	-178.9	-163.4	122.8	-4.9	113.5	R32 H33 L34 R40	R32-R36 VanDerWaalsContact O-CG 3.32Å; R32-R36 WeakPolarHBondContact O-CG 3.32Å; R32-R36 PolarHBondContact O-N 2.85Å; H33-R36 CarbonylContact O-C 3.11Å; H33-R36 PolarHBondContact O-N 3.16Å; L34-R36 VanDerWaalsContact C-N 3.32Å; L34-R36 PolarHBondContact O-N 3.25Å; R36-R40 VanDerWaalsContact O-CB 3.28Å; R36-R40 WeakPolarHBondContact O-CB 3.44Å; R36-R40 VanDerWaalsContact O-CG 3.23Å; R36-R40 WeakPolarHBondContact O-CG 3.3Å; R36-R40 PolarHBondContact O-N 3.19Å
37	I	52.4	Low	43.6	Very low	70 Å²	70	108.3 Å²	108.3	36%	0.359	56%	0.561	S	S	.	*	H	α-helix	trans	-69.1	-46.2	173.7	-71.8	168.2	0	0	0	109.3	H33 L34 T39 R40 L41	H33-I37 VanDerWaalsContact CD2-CD1 3.44Å; H33-I37 WeakPolarHBondContact CD2-CD1 3.23Å; H33-I37 VanDerWaalsContact O-CG1 3.3Å; H33-I37 WeakPolarHBondContact O-CG1 3.43Å; H33-I37 PolarHBondContact O-N 2.78Å; L34-I37 PolarHBondContact O-N 3.42Å; I37-T39 PolarHBondContact O-N 3.44Å; I37-R40 CarbonylContact O-C 3.6Å; I37-R40 PolarHBondContact O-N 2.9Å; I37-R40 VanDerWaalsContact O-N 3.16Å; I37-L41 HydrophobicContact CG2-CD1 3.71Å; I37-L41 HydrophobicContact CG2-CG 4.19Å; I37-L41 WeakPolarHBondContact O-CB 3.19Å; I37-L41 WeakPolarHBondContact O-CG 3.41Å; I37-L41 PolarHBondContact O-N 2.86Å
38	L	46.7	Very low	43.7	Very low	84 Å²	84	111.7 Å²	111.7	44%	0.44	57%	0.569	S	S	.	*	H	α-helix	trans	-64.4	-38.9	177.1	-68.9	170.9	0	0	0	111.9	L34 S35 L41 A42	L34-L38 VanDerWaalsContact O-CB 3.29Å; L34-L38 WeakPolarHBondContact O-CB 3.44Å; L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 2.82Å; S35-L38 PolarHBondContact O-N 3.47Å; L38-L41 PolarHBondContact O-N 3.49Å; L38-A42 VanDerWaalsContact O-CB 3.26Å; L38-A42 WeakPolarHBondContact O-CB 3.28Å; L38-A42 PolarHBondContact O-N 2.95Å
39	T	44.8	Very low	43.6	Very low	70 Å²	70	111.9 Å²	111.9	43%	0.429	56%	0.562	S	S	.	*	H	α-helix	trans	-67.8	-35.9	172.5	-57	0	0	0	0	112	S35 I37 A42 E43	S35-T39 WeakPolarHBondContact O-CB 3.29Å; S35-T39 PolarHBondContact O-N 2.88Å; S35-T39 PolarHBondContact O-OG1 3.17Å; I37-T39 PolarHBondContact O-N 3.44Å; T39-A42 PolarHBondContact O-N 3.17Å; T39-E43 WeakPolarHBondContact O-CB 3.37Å; T39-E43 PolarHBondContact O-N 3.21Å
40	R	47.7	Very low	43.8	Very low	182 Å²	182	121.1 Å²	121.1	69%	0.687	58%	0.584	S	S	*	*	H	α-helix	trans	-74	-28.3	173.9	-76.8	-177.5	175.7	-163.6	-0.8	113.5	R36 I37 R44	R36-R40 VanDerWaalsContact O-CB 3.28Å; R36-R40 WeakPolarHBondContact O-CB 3.44Å; R36-R40 VanDerWaalsContact O-CG 3.23Å; R36-R40 WeakPolarHBondContact O-CG 3.3Å; R36-R40 PolarHBondContact O-N 3.19Å; I37-R40 CarbonylContact O-C 3.6Å; I37-R40 PolarHBondContact O-N 2.9Å; I37-R40 VanDerWaalsContact O-N 3.16Å; R40-R44 VanDerWaalsContact O-CB 3.25Å; R40-R44 WeakPolarHBondContact O-CB 3.44Å; R40-R44 WeakPolarHBondContact O-CG 3.39Å; R40-R44 PolarHBondContact O-N 2.96Å
41	L	48	Very low	43.4	Very low	103 Å²	103	123.4 Å²	123.4	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-75.2	-34.4	172	-70.8	172.6	0	0	0	110.9	I37 L38 S45	I37-L41 HydrophobicContact CG2-CD1 3.71Å; I37-L41 HydrophobicContact CG2-CG 4.19Å; I37-L41 WeakPolarHBondContact O-CB 3.19Å; I37-L41 WeakPolarHBondContact O-CG 3.41Å; I37-L41 PolarHBondContact O-N 2.86Å; L38-L41 PolarHBondContact O-N 3.49Å; L41-S45 WeakPolarHBondContact O-CB 3.34Å; L41-S45 PolarHBondContact O-N 2.85Å; L41-S45 VanDerWaalsContact O-N 3.16Å; L41-S45 PolarHBondContact O-OG 3.09Å
42	A	45.4	Very low	43.3	Very low	53 Å²	53	123 Å²	123	44%	0.438	59%	0.59	S	S	.	*	H	α-helix	trans	-71.4	-38.4	172.4	0	0	0	0	0	113.1	L38 T39 S45	L38-A42 VanDerWaalsContact O-CB 3.26Å; L38-A42 WeakPolarHBondContact O-CB 3.28Å; L38-A42 PolarHBondContact O-N 2.95Å; T39-A42 PolarHBondContact O-N 3.17Å; A42-S45 VanDerWaalsContact CA-OG 3.26Å; A42-S45 WeakPolarHBondContact CA-OG 3.28Å; A42-S45 PolarHBondContact O-OG 3.15Å
43	E	40.1	Very low	43.4	Very low	138 Å²	138	124 Å²	124	65%	0.645	60%	0.595	S	S	*	*	H	α-helix	trans	-76.6	-28.7	175.2	-78.8	-179.6	159	0	0	112.9	T39	T39-E43 WeakPolarHBondContact O-CB 3.37Å; T39-E43 PolarHBondContact O-N 3.21Å
44	R	41.3	Very low	43.3	Very low	191 Å²	191	124.6 Å²	124.6	72%	0.721	60%	0.602	S	S	*	*	H	α-helix	trans	-73.9	-23.4	171.2	-83.5	-174.9	173.2	-176	-2.6	113.6	R40	R40-R44 VanDerWaalsContact O-CB 3.25Å; R40-R44 WeakPolarHBondContact O-CB 3.44Å; R40-R44 WeakPolarHBondContact O-CG 3.39Å; R40-R44 PolarHBondContact O-N 2.96Å
45	S	39.3	Very low	43.1	Very low	90 Å²	90	124.2 Å²	124.2	63%	0.629	61%	0.605	S	S	*	*	H	α-helix	trans	-80.7	-18.3	178	32.3	0	0	0	0	113.7	L41 A42	L41-S45 WeakPolarHBondContact O-CB 3.34Å; L41-S45 PolarHBondContact O-N 2.85Å; L41-S45 VanDerWaalsContact O-N 3.16Å; L41-S45 PolarHBondContact O-OG 3.09Å; A42-S45 VanDerWaalsContact CA-OG 3.26Å; A42-S45 WeakPolarHBondContact CA-OG 3.28Å; A42-S45 PolarHBondContact O-OG 3.15Å
46	L	43.6	Very low	43.3	Very low	153 Å²	153	129.6 Å²	129.6	80%	0.801	62%	0.616	S	S	*	*	H	α-helix	trans	-98.7	-17.7	-177.1	-84.2	174.3	0	0	0	117.1
47	I	41.6	Very low	43.1	Very low	158 Å²	158	129.4 Å²	129.4	81%	0.81	62%	0.619	S	S	*	*	H	α-helix	trans	-128.9	-16.1	-172.3	-60.3	179.3	0	0	0	116.2
48	R	40	Very low	42.6	Very low	220 Å²	220	131.3 Å²	131.3	83%	0.83	63%	0.631	S	S	*	*	S	Bend	trans	-136	-0.7	-168.1	-169.1	156.7	-107.2	-170.2	-4.2	120.5
49	E	39.3	Very low	42.5	Very low	102 Å²	102	137.4 Å²	137.4	48%	0.477	65%	0.648	S	S	.	*			trans	-148.9	45.1	-175.3	-120.3	165.6	168.7	0	0	117.1	S51	E49-S51 PolarHBondContact O-N 3.32Å
50	R	44.2	Very low	42.3	Very low	254 Å²	254	139.4 Å²	139.4	96%	0.958	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	5.4	168.1	-148.8	-179.5	-179.1	177.2	0.9	114.3
51	S	36	Very low	42.4	Very low	98 Å²	98	134 Å²	134	69%	0.685	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	-18.7	-168.9	-159	0	0	0	0	116.3	E49	E49-S51 PolarHBondContact O-N 3.32Å
52	S	40.9	Very low	42.1	Very low	58 Å²	58	134.7 Å²	134.7	41%	0.406	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.2	-24.3	-174.2	-65.8	0	0	0	0	114.7	S55	S52-S55 PolarHBondContact O-OG 3.43Å
53	Y	44.6	Very low	42.1	Very low	173 Å²	173	139 Å²	139	68%	0.678	66%	0.658	S	S	*	*	H	α-helix	trans	-80.9	-26.1	178.6	-73.4	-84.4	0	0	0	113.4	S55 F57	Y53-S55 VanDerWaalsContact C-N 3.29Å; Y53-S55 PolarHBondContact O-N 2.8Å; Y53-F57 PolarHBondContact O-N 3.2Å
54	L	43.1	Very low	42.3	Very low	129 Å²	129	137.5 Å²	137.5	68%	0.675	65%	0.654	S	S	*	*	H	α-helix	trans	-67.6	-28.8	175.8	-126.5	80.5	0	0	0	112.4	D58	L54-D58 PolarHBondContact O-N 3.01Å; L54-D58 VanDerWaalsContact O-N 3.13Å
55	S	39	Very low	42.3	Very low	65 Å²	65	134.3 Å²	134.3	46%	0.455	65%	0.646	S	S	.	*	H	α-helix	trans	-82.9	-20.7	-177.5	64	0	0	0	0	114.2	S52 Y53 R59	S52-S55 PolarHBondContact O-OG 3.43Å; Y53-S55 VanDerWaalsContact C-N 3.29Å; Y53-S55 PolarHBondContact O-N 2.8Å; S55-R59 PolarHBondContact O-N 3.43Å
56	Y	44.3	Very low	42.4	Very low	182 Å²	182	133.9 Å²	133.9	71%	0.714	64%	0.639	S	S	*	*	H	α-helix	trans	-82.2	-38.1	170.1	-107.5	-88.5	0	0	0	111.8	D58 R59 L60	Y56-D58 VanDerWaalsContact C-N 3.3Å; Y56-D58 PolarHBondContact O-N 3Å; Y56-R59 PolarHBondContact O-N 3.03Å; Y56-L60 WeakPolarHBondContact O-CB 3.49Å; Y56-L60 PolarHBondContact O-N 3.25Å
57	F	42.3	Very low	42.4	Very low	144 Å²	144	129.6 Å²	129.6	63%	0.632	62%	0.621	S	S	*	*	H	α-helix	trans	-62.5	-37.3	172.4	-107	-93.6	0	0	0	111.5	Y53 S61	Y53-F57 PolarHBondContact O-N 3.2Å; F57-S61 WeakPolarHBondContact O-CA 3.31Å; F57-S61 WeakPolarHBondContact O-CB 3.06Å; F57-S61 PolarHBondContact O-N 2.88Å
58	D	42.4	Very low	42.3	Very low	111 Å²	111	130.2 Å²	130.2	59%	0.594	62%	0.618	S	S	*	*	H	α-helix	trans	-67.8	-40.7	175.3	-95.2	-41	0	0	0	113.8	L54 Y56 L62	L54-D58 PolarHBondContact O-N 3.01Å; L54-D58 VanDerWaalsContact O-N 3.13Å; Y56-D58 VanDerWaalsContact C-N 3.3Å; Y56-D58 PolarHBondContact O-N 3Å; D58-L62 VanDerWaalsContact O-CB 3.25Å; D58-L62 WeakPolarHBondContact O-CB 3.21Å; D58-L62 PolarHBondContact O-N 2.97Å
59	R	44	Very low	42.3	Very low	212 Å²	212	124.3 Å²	124.3	80%	0.8	61%	0.606	S	S	*	*	H	α-helix	trans	-78.6	-32.6	-178.7	-76.2	-171.4	-174.4	-122.8	1.7	113.8	S55 Y56 F63	S55-R59 PolarHBondContact O-N 3.43Å; Y56-R59 PolarHBondContact O-N 3.03Å; R59-F63 WeakPolarHBondContact O-CB 3.36Å; R59-F63 PolarHBondContact O-N 3.49Å
60	L	42.3	Very low	42	Very low	112 Å²	112	124 Å²	124	59%	0.586	62%	0.616	S	S	*	*	H	α-helix	trans	-77.3	-35.4	175.2	-154.7	71.4	0	0	0	110.9	Y56 L64	Y56-L60 WeakPolarHBondContact O-CB 3.49Å; Y56-L60 PolarHBondContact O-N 3.25Å; L60-L64 HydrophobicContact CG-CD1 4.43Å; L60-L64 WeakPolarHBondContact O-CB 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.26Å; L60-L64 PolarHBondContact O-N 3.42Å
61	S	49	Very low	41.7	Very low	69 Å²	69	121.6 Å²	121.6	48%	0.483	61%	0.607	S	S	.	*	H	α-helix	trans	-65.2	-45.6	171.5	-176.8	0	0	0	0	111.7	F57 F63 L64 F65	F57-S61 WeakPolarHBondContact O-CA 3.31Å; F57-S61 WeakPolarHBondContact O-CB 3.06Å; F57-S61 PolarHBondContact O-N 2.88Å; S61-F63 VanDerWaalsContact C-N 3.34Å; S61-F63 PolarHBondContact O-N 3.06Å; S61-L64 PolarHBondContact O-N 3.49Å; S61-F65 WeakPolarHBondContact O-CB 3.31Å; S61-F65 PolarHBondContact O-N 3.13Å
62	L	42.3	Very low	41.6	Very low	116 Å²	116	119.6 Å²	119.6	61%	0.607	60%	0.601	S	S	*	*	H	α-helix	trans	-67.2	-34.1	179.2	-157.5	75.2	0	0	0	112.5	D58 V66	D58-L62 VanDerWaalsContact O-CB 3.25Å; D58-L62 WeakPolarHBondContact O-CB 3.21Å; D58-L62 PolarHBondContact O-N 2.97Å; L62-V66 VanDerWaalsContact O-CB 3.27Å; L62-V66 WeakPolarHBondContact O-CB 3.25Å; L62-V66 WeakPolarHBondContact O-CG2 3.34Å; L62-V66 PolarHBondContact O-N 3.29Å
63	F	45.3	Very low	41.6	Very low	143 Å²	143	123.5 Å²	123.5	63%	0.627	63%	0.625	S	S	*	*	H	α-helix	trans	-72.4	-42.1	177.9	-165.2	-101.3	0	0	0	112.1	R59 S61 C67	R59-F63 WeakPolarHBondContact O-CB 3.36Å; R59-F63 PolarHBondContact O-N 3.49Å; S61-F63 VanDerWaalsContact C-N 3.34Å; S61-F63 PolarHBondContact O-N 3.06Å; F63-C67 PolarHBondContact O-N 3.28Å; F63-C67 VanDerWaalsContact O-N 3.17Å; F63-C67 PolarHBondContact O-SG 3.16Å
64	L	44.2	Very low	41.3	Very low	107 Å²	107	123.1 Å²	123.1	56%	0.56	63%	0.629	S	S	*	*	H	α-helix	trans	-69.4	-37.5	174	-69.8	172.3	0	0	0	111.9	L60 S61 C67 F68	L60-L64 HydrophobicContact CG-CD1 4.43Å; L60-L64 WeakPolarHBondContact O-CB 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.26Å; L60-L64 PolarHBondContact O-N 3.42Å; S61-L64 PolarHBondContact O-N 3.49Å; L64-C67 PolarHBondContact O-N 3.35Å; L64-F68 WeakPolarHBondContact O-CB 3.35Å; L64-F68 PolarHBondContact O-N 3.26Å
65	F	40.5	Very low	41.2	Very low	125 Å²	125	126.1 Å²	126.1	55%	0.548	64%	0.64	S	S	.	*	H	α-helix	trans	-67.4	-40.4	176.5	-169.1	-100.5	0	0	0	112.4	S61 F68 V69	S61-F65 WeakPolarHBondContact O-CB 3.31Å; S61-F65 PolarHBondContact O-N 3.13Å; F65-F68 PolarHBondContact O-N 3.08Å; F65-V69 HydrophobicContact CD1-CG2 4.11Å; F65-V69 HydrophobicContact CD2-CG2 4.17Å; F65-V69 HydrophobicContact CE1-CG2 3.86Å; F65-V69 HydrophobicContact CE2-CG2 3.93Å; F65-V69 HydrophobicContact CG-CG2 4.26Å; F65-V69 HydrophobicContact CZ-CG2 3.77Å; F65-V69 VanDerWaalsContact O-CB 3.29Å; F65-V69 WeakPolarHBondContact O-CB 3.46Å; F65-V69 WeakPolarHBondContact O-CG2 3.34Å; F65-V69 PolarHBondContact O-N 2.86Å
66	V	41.9	Very low	41.4	Very low	81 Å²	81	131.1 Å²	131.1	49%	0.491	66%	0.661	S	S	.	*	H	α-helix	trans	-65.4	-38.7	174.9	166.3	0	0	0	0	111.6	L62 S70	L62-V66 VanDerWaalsContact O-CB 3.27Å; L62-V66 WeakPolarHBondContact O-CB 3.25Å; L62-V66 WeakPolarHBondContact O-CG2 3.34Å; L62-V66 PolarHBondContact O-N 3.29Å; V66-S70 WeakPolarHBondContact O-CB 3.1Å; V66-S70 PolarHBondContact O-N 3.4Å; V66-S70 PolarHBondContact O-OG 2.75Å
67	C	43.3	Very low	41.4	Very low	63 Å²	63	128 Å²	128	43%	0.426	67%	0.666	S	S	.	*	H	α-helix	trans	-74.2	-33.5	176.3	-72.3	0	0	0	0	113.3	F63 L64	F63-C67 PolarHBondContact O-N 3.28Å; F63-C67 VanDerWaalsContact O-N 3.17Å; F63-C67 PolarHBondContact O-SG 3.16Å; L64-C67 PolarHBondContact O-N 3.35Å
68	F	39.8	Very low	41.4	Very low	171 Å²	171	125.6 Å²	125.6	75%	0.75	66%	0.659	S	S	*	*	H	α-helix	trans	-80.5	-39.3	-178.9	-168.9	-100.2	0	0	0	112.8	L64 F65 S70	L64-F68 WeakPolarHBondContact O-CB 3.35Å; L64-F68 PolarHBondContact O-N 3.26Å; F65-F68 PolarHBondContact O-N 3.08Å; F68-S70 VanDerWaalsContact C-N 3.29Å; F68-S70 PolarHBondContact O-N 2.97Å
69	V	39	Very low	41.6	Very low	95 Å²	95	126.4 Å²	126.4	58%	0.576	67%	0.674	S	S	*	*	H	α-helix	trans	-72.1	-21.7	176.1	170.1	0	0	0	0	112.5	F65	F65-V69 HydrophobicContact CD1-CG2 4.11Å; F65-V69 HydrophobicContact CD2-CG2 4.17Å; F65-V69 HydrophobicContact CE1-CG2 3.86Å; F65-V69 HydrophobicContact CE2-CG2 3.93Å; F65-V69 HydrophobicContact CG-CG2 4.26Å; F65-V69 HydrophobicContact CZ-CG2 3.77Å; F65-V69 VanDerWaalsContact O-CB 3.29Å; F65-V69 WeakPolarHBondContact O-CB 3.46Å; F65-V69 WeakPolarHBondContact O-CG2 3.34Å; F65-V69 PolarHBondContact O-N 2.86Å
70	S	32.7	Very low	42.2	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-9.9	179.6	-56.9	0	0	0	0	114.5	V66 F68	V66-S70 WeakPolarHBondContact O-CB 3.1Å; V66-S70 PolarHBondContact O-N 3.4Å; V66-S70 PolarHBondContact O-OG 2.75Å; F68-S70 VanDerWaalsContact C-N 3.29Å; F68-S70 PolarHBondContact O-N 2.97Å
71	R	39.5	Very low	42.8	Very low	203 Å²	203	129 Å²	129	77%	0.766	69%	0.686	S	S	*	*	S	Bend	trans	-112.9	99.7	175.4	-93	-173.7	170.4	103.7	-4.2	109.5
72	G	33.8	Very low	43.6	Very low	56 Å²	56	129.6 Å²	129.6	58%	0.577	69%	0.688	S	S	*	*			trans	-59.3	172.3	170.6	0	0	0	0	0	113.1	Q74	G72-Q74 PolarHBondContact O-N 3.16Å; G72-Q74 VanDerWaalsContact O-N 3.11Å
73	P	40.2	Very low	45.4	Very low	139 Å²	139	126.8 Å²	126.8	90%	0.903	68%	0.678	S	S	*	*			trans	-67.3	112.6	-171.3	27.8	-32.2	0	0	0	109.8
74	Q	37.8	Very low	46.9	Very low	165 Å²	165	129.1 Å²	129.1	77%	0.771	69%	0.691	S	S	*	*			trans	-97.5	113.3	162.8	-81.6	-168	-64.4	0	0	108.6	G72 L76	G72-Q74 PolarHBondContact O-N 3.16Å; G72-Q74 VanDerWaalsContact O-N 3.11Å; Q74-L76 PolarHBondContact O-N 2.98Å
75	E	42.4	Very low	48.3	Very low	193 Å²	193	129.6 Å²	129.6	90%	0.902	69%	0.693	S	S	*	*			trans	-54.6	125.2	159.9	-69.1	-151.4	148.4	0	0	109.5	S77	E75-S77 PolarHBondContact O-N 3.16Å
76	L	42.1	Very low	49.9	Very low	170 Å²	170	129.2 Å²	129.2	89%	0.89	69%	0.694	S	S	*	*			trans	-95.4	89.9	-168.9	-130	110.8	0	0	0	110.4	Q74	Q74-L76 PolarHBondContact O-N 2.98Å
77	S	45	Very low	51.7	Low	116 Å²	116	126.7 Å²	126.7	81%	0.811	68%	0.684	S	S	*	*			trans	-128.7	86.5	154.5	67.9	0	0	0	0	108.5	E75	E75-S77 PolarHBondContact O-N 3.16Å
78	D	40.8	Very low	53.4	Low	93 Å²	93	126 Å²	126	50%	0.497	68%	0.683	S	S	.	*			trans	-141.2	117.1	166.5	-162.8	-0.5	0	0	0	110.1	R80	D78-R80 PolarHBondContact O-N 2.62Å; D78-R80 IonicContact OD2-CZ 3.24Å; D78-R80 VanDerWaalsContact OD2-CZ 3.24Å; D78-R80 IonicContact OD2-NE 2.79Å; D78-R80 PolarHBondContact OD2-NE 3.01Å; D78-R80 IonicContact OD2-NH2 2.85Å; D78-R80 PolarHBondContact OD2-NH2 3.25Å
79	S	48.3	Very low	55.3	Low	128 Å²	128	122.6 Å²	122.6	90%	0.895	67%	0.67	S	S	*	*			trans	-72.4	62.4	172.1	52.4	0	0	0	0	110.5
80	R	55.1	Low	57.2	Low	193 Å²	193	119.5 Å²	119.5	73%	0.728	66%	0.658	S	S	*	*			trans	-107.5	132.1	162.4	-80.9	-170.8	-114.5	178.1	-0.5	108	D78 P82	D78-R80 PolarHBondContact O-N 2.62Å; D78-R80 IonicContact OD2-CZ 3.24Å; D78-R80 VanDerWaalsContact OD2-CZ 3.24Å; D78-R80 IonicContact OD2-NE 2.79Å; D78-R80 PolarHBondContact OD2-NE 3.01Å; D78-R80 IonicContact OD2-NH2 2.85Å; D78-R80 PolarHBondContact OD2-NH2 3.25Å; R80-P82 VanDerWaalsContact O-CD 3.26Å; R80-P82 WeakPolarHBondContact O-CD 3.49Å
81	M	56.5	Low	59.6	Low	186 Å²	186	117.3 Å²	117.3	92%	0.916	65%	0.645	S	S	*	*			trans	-55	115.1	167.3	-72	-100.4	-76.3	0	0	106.8
82	P	64.7	Low	61.8	Low	81 Å²	81	110.8 Å²	110.8	53%	0.526	63%	0.625	S	S	.	*			trans	-60.1	144.9	-176.3	23.6	-32.3	0	0	0	108.9	R80 E86	R80-P82 VanDerWaalsContact O-CD 3.26Å; R80-P82 WeakPolarHBondContact O-CD 3.49Å; P82-E86 HydrophobicContact CB-CB 3.98Å
83	S	80.4	Confident	64.3	Low	58 Å²	58	111.7 Å²	111.7	41%	0.406	62%	0.616	S	S	.	*			trans	-57.4	154.9	170.5	64.4	0	0	0	0	109.6	L85 E86 G87	S83-L85 PolarHBondContact O-N 3.32Å; S83-E86 WeakPolarHBondContact CB-OE2 3.28Å; S83-E86 PolarHBondContact N-OE2 2.96Å; S83-E86 PolarHBondContact O-N 2.72Å; S83-E86 WeakPolarHBondContact OG-CB 3.4Å; S83-E86 WeakPolarHBondContact OG-CG 3.32Å; S83-E86 PolarHBondContact OG-N 3.31Å; S83-E86 PolarHBondContact OG-OE2 2.85Å; S83-G87 PolarHBondContact O-N 3.14Å
84	Q	76.6	Confident	66.5	Low	191 Å²	191	108.6 Å²	108.6	89%	0.893	60%	0.595	S	S	*	*	H	α-helix	trans	-53	-34.9	-175.6	-69.5	177.8	65.7	0	0	112.7	A88	Q84-A88 WeakPolarHBondContact O-CB 3.36Å; Q84-A88 PolarHBondContact O-N 2.86Å
85	L	74.6	Confident	68.9	Low	117 Å²	117	102.2 Å²	102.2	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-74.6	-43.9	176.6	-175.1	61.8	0	0	0	112.7	S83 G87 A88 M89	S83-L85 PolarHBondContact O-N 3.32Å; L85-G87 VanDerWaalsContact C-N 3.27Å; L85-G87 PolarHBondContact O-N 3.05Å; L85-A88 PolarHBondContact O-N 3.5Å; L85-M89 HydrophobicContact CD1-CE 4.34Å; L85-M89 HydrophobicContact CD2-CE 4.34Å; L85-M89 HydrophobicContact CG-CE 4.12Å; L85-M89 WeakPolarHBondContact O-CG 3.12Å; L85-M89 PolarHBondContact O-N 3.49Å
86	E	72.9	Confident	71	Confident	118 Å²	118	93 Å²	93	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-62.7	-37.3	174.6	-72.8	164.9	157.5	0	0	111.4	P82 S83 M89 G90	P82-E86 HydrophobicContact CB-CB 3.98Å; S83-E86 WeakPolarHBondContact CB-OE2 3.28Å; S83-E86 PolarHBondContact N-OE2 2.96Å; S83-E86 PolarHBondContact O-N 2.72Å; S83-E86 WeakPolarHBondContact OG-CB 3.4Å; S83-E86 WeakPolarHBondContact OG-CG 3.32Å; S83-E86 PolarHBondContact OG-N 3.31Å; S83-E86 PolarHBondContact OG-OE2 2.85Å; E86-M89 PolarHBondContact O-N 3.4Å; E86-G90 PolarHBondContact O-N 3.42Å
87	G	79.6	Confident	73.1	Confident	28 Å²	28	89.8 Å²	89.8	29%	0.289	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-41.6	173.6	0	0	0	0	0	111.9	S83 L85 G90 A91	S83-G87 PolarHBondContact O-N 3.14Å; L85-G87 VanDerWaalsContact C-N 3.27Å; L85-G87 PolarHBondContact O-N 3.05Å; G87-G90 PolarHBondContact O-N 2.74Å; G87-A91 VanDerWaalsContact O-CB 3.3Å; G87-A91 WeakPolarHBondContact O-CB 3.36Å; G87-A91 PolarHBondContact O-N 2.81Å
88	A	80.1	Confident	75.1	Confident	48 Å²	48	89.7 Å²	89.7	40%	0.397	49%	0.491	S	S	.	.	H	α-helix	trans	-65.3	-42.2	174.8	0	0	0	0	0	112.2	Q84 L85 A91 L92	Q84-A88 WeakPolarHBondContact O-CB 3.36Å; Q84-A88 PolarHBondContact O-N 2.86Å; L85-A88 PolarHBondContact O-N 3.5Å; A88-A91 PolarHBondContact O-N 3.18Å; A88-L92 WeakPolarHBondContact O-CG 3.5Å; A88-L92 PolarHBondContact O-N 3.44Å
89	M	78.9	Confident	77.4	Confident	100 Å²	100	87.4 Å²	87.4	49%	0.493	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-45.8	173.7	-71	177.7	173.6	0	0	111.3	L85 E86 A91 L92 I93	L85-M89 HydrophobicContact CD1-CE 4.34Å; L85-M89 HydrophobicContact CD2-CE 4.34Å; L85-M89 HydrophobicContact CG-CE 4.12Å; L85-M89 WeakPolarHBondContact O-CG 3.12Å; L85-M89 PolarHBondContact O-N 3.49Å; E86-M89 PolarHBondContact O-N 3.4Å; M89-A91 VanDerWaalsContact C-N 3.33Å; M89-A91 PolarHBondContact O-N 3.12Å; M89-L92 PolarHBondContact O-N 3.37Å; M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 2.93Å; M89-I93 VanDerWaalsContact O-N 3.09Å
90	G	78.9	Confident	79.1	Confident	30 Å²	30	81.9 Å²	81.9	31%	0.309	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-39.8	175.1	0	0	0	0	0	112.6	E86 G87 I93 T94	E86-G90 PolarHBondContact O-N 3.42Å; G87-G90 PolarHBondContact O-N 2.74Å; G90-I93 PolarHBondContact O-N 3.42Å; G90-T94 VanDerWaalsContact O-CB 3.29Å; G90-T94 WeakPolarHBondContact O-CB 3.35Å; G90-T94 PolarHBondContact O-N 3.46Å; G90-T94 PolarHBondContact O-OG1 3.2Å
91	A	83.8	Confident	80	Confident	51 Å²	51	74 Å²	74	42%	0.421	42%	0.416	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.2	0	0	0	0	0	111.7	G87 A88 M89 I93 T94 V95	G87-A91 VanDerWaalsContact O-CB 3.3Å; G87-A91 WeakPolarHBondContact O-CB 3.36Å; G87-A91 PolarHBondContact O-N 2.81Å; A88-A91 PolarHBondContact O-N 3.18Å; M89-A91 VanDerWaalsContact C-N 3.33Å; M89-A91 PolarHBondContact O-N 3.12Å; A91-I93 PolarHBondContact O-N 2.84Å; A91-T94 PolarHBondContact O-N 3.43Å; A91-V95 WeakPolarHBondContact O-CB 3.43Å; A91-V95 VanDerWaalsContact O-CG2 3.3Å; A91-V95 WeakPolarHBondContact O-CG2 3.37Å; A91-V95 PolarHBondContact O-N 3.11Å
92	L	84.9	Confident	80.6	Confident	65 Å²	65	71.2 Å²	71.2	34%	0.34	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-45.3	176.2	-73.5	172.2	0	0	0	112.3	A88 M89 T94 V95 F96 V159	A88-L92 WeakPolarHBondContact O-CG 3.5Å; A88-L92 PolarHBondContact O-N 3.44Å; M89-L92 PolarHBondContact O-N 3.37Å; L92-T94 VanDerWaalsContact C-N 3.32Å; L92-V95 PolarHBondContact O-N 3.39Å; L92-F96 PolarHBondContact O-N 3.23Å; L92-V159 HydrophobicContact CD1-CG1 4.42Å; L92-V159 HydrophobicContact CD2-CG1 3.71Å; L92-V159 HydrophobicContact CD2-CG2 4.29Å
93	I	86.1	Confident	80.4	Confident	76 Å²	76	73.6 Å²	73.6	39%	0.39	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-44.7	176.1	-67.3	166	0	0	0	110.1	M89 G90 A91 F96 Y97 F152	M89-I93 WeakPolarHBondContact O-CG1 3.45Å; M89-I93 PolarHBondContact O-N 2.93Å; M89-I93 VanDerWaalsContact O-N 3.09Å; G90-I93 PolarHBondContact O-N 3.42Å; A91-I93 PolarHBondContact O-N 2.84Å; I93-F96 PolarHBondContact O-N 3.17Å; I93-Y97 HydrophobicContact CG2-CD2 3.6Å; I93-Y97 HydrophobicContact CG2-CE2 3.69Å; I93-Y97 VanDerWaalsContact O-CD2 3.24Å; I93-Y97 WeakPolarHBondContact O-CD2 3.3Å; I93-Y97 PolarHBondContact O-N 2.85Å; I93-F152 HydrophobicContact CG1-CE2 3.99Å; I93-F152 HydrophobicContact CG1-CZ 3.66Å
94	T	86	Confident	79.8	Confident	74 Å²	74	73.9 Å²	73.9	45%	0.454	43%	0.425	S	S	.	.	H	α-helix	trans	-64.2	-43.9	-179.6	-59	0	0	0	0	111.4	G90 A91 L92 Y97 N98	G90-T94 VanDerWaalsContact O-CB 3.29Å; G90-T94 WeakPolarHBondContact O-CB 3.35Å; G90-T94 PolarHBondContact O-N 3.46Å; G90-T94 PolarHBondContact O-OG1 3.2Å; A91-T94 PolarHBondContact O-N 3.43Å; L92-T94 VanDerWaalsContact C-N 3.32Å; T94-Y97 PolarHBondContact O-N 3.25Å; T94-N98 VanDerWaalsContact O-CB 3.26Å; T94-N98 WeakPolarHBondContact O-CB 3.42Å; T94-N98 PolarHBondContact O-N 2.99Å; T94-N98 PolarHBondContact O-ND2 2.68Å; T94-N98 PolarHBondContact O-OD1 3.17Å
95	V	88.4	Confident	79.7	Confident	30 Å²	30	68.2 Å²	68.2	18%	0.182	40%	0.401	C	S	.	.	H	α-helix	trans	-57.8	-51.1	175	164.1	0	0	0	0	109.6	A91 L92 Y97 N98 Y99 L117 E121 F155	A91-V95 WeakPolarHBondContact O-CB 3.43Å; A91-V95 VanDerWaalsContact O-CG2 3.3Å; A91-V95 WeakPolarHBondContact O-CG2 3.37Å; A91-V95 PolarHBondContact O-N 3.11Å; L92-V95 PolarHBondContact O-N 3.39Å; V95-Y97 PolarHBondContact O-N 3.48Å; V95-N98 PolarHBondContact O-N 3.01Å; V95-N98 VanDerWaalsContact O-N 3.15Å; V95-Y99 HydrophobicContact CG1-CD2 4.09Å; V95-Y99 HydrophobicContact CG1-CE2 3.98Å; V95-Y99 WeakPolarHBondContact O-CD2 3.29Å; V95-Y99 PolarHBondContact O-N 2.99Å; V95-L117 HydrophobicContact CG1-CD1 4.16Å; V95-L117 HydrophobicContact CG1-CG 4.32Å; V95-E121 HydrophobicContact CG1-CG 3.99Å; V95-F155 HydrophobicContact CG1-CZ 4.36Å
96	F	86.8	Confident	79.8	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-54.6	-52	178.7	-177	-93.9	0	0	0	112.1	L92 I93 N98 Y99 S100 H107 L109 F152 F155	L92-F96 PolarHBondContact O-N 3.23Å; I93-F96 PolarHBondContact O-N 3.17Å; F96-N98 VanDerWaalsContact C-N 3.29Å; F96-N98 PolarHBondContact O-N 2.69Å; F96-Y99 PolarHBondContact O-N 3.37Å; F96-S100 WeakPolarHBondContact O-CB 3.46Å; F96-S100 PolarHBondContact O-N 3.02Å; F96-S100 PolarHBondContact O-OG 2.95Å; F96-H107 WeakPolarHBondContact CE1-O 3.3Å; F96-H107 WeakPolarHBondContact CZ-O 3.34Å; F96-L109 HydrophobicContact CD2-CD1 3.63Å; F96-L109 HydrophobicContact CD2-CG 4.18Å; F96-L109 HydrophobicContact CE2-CD1 3.5Å; F96-L109 HydrophobicContact CE2-CG 3.77Å; F96-L109 HydrophobicContact CZ-CD1 4.44Å; F96-L109 HydrophobicContact CZ-CG 4.23Å; F96-F152 HydrophobicContact CB-CD2 4.01Å; F96-F152 HydrophobicContact CB-CE2 4.18Å; F96-F152 HydrophobicContact CD1-CB 4.41Å; F96-F152 AromaticContact CD1-CD2 3.76Å; F96-F152 HydrophobicContact CD1-CD2 3.76Å; F96-F152 HydrophobicContact CD2-CD2 4.06Å; F96-F152 HydrophobicContact CE1-CB 4Å; F96-F152 HydrophobicContact CE1-CD2 4.21Å; F96-F152 HydrophobicContact CE2-CB 4.36Å; F96-F152 HydrophobicContact CE2-CD2 4.47Å; F96-F152 AromaticContact CG-CD2 3.67Å; F96-F152 HydrophobicContact CG-CD2 3.67Å; F96-F152 HydrophobicContact CG-CE2 4.34Å; F96-F152 HydrophobicContact CZ-CB 3.97Å; F96-F155 HydrophobicContact CB-CD1 4.11Å; F96-F155 HydrophobicContact CB-CE1 4.06Å; F96-F155 HydrophobicContact CD2-CB 3.7Å; F96-F155 AromaticContact CD2-CD1 3.6Å; F96-F155 HydrophobicContact CD2-CD1 3.6Å; F96-F155 HydrophobicContact CD2-CD2 4.19Å; F96-F155 HydrophobicContact CD2-CE1 4.26Å; F96-F155 AromaticContact CD2-CG 3.55Å; F96-F155 HydrophobicContact CD2-CG 3.55Å; F96-F155 HydrophobicContact CE2-CB 3.72Å; F96-F155 HydrophobicContact CE2-CD1 4.47Å; F96-F155 HydrophobicContact CE2-CG 4.09Å; F96-F155 HydrophobicContact CG-CD1 4.25Å
97	Y	86.6	Confident	80.2	Confident	102 Å²	102	69.2 Å²	69.2	40%	0.4	40%	0.4	S	S	.	.	H	α-helix	trans	-72.5	-16.4	-179.1	-74.4	-63.8	0	0	0	115.1	I93 T94 V95 S100 K106 H107	I93-Y97 HydrophobicContact CG2-CD2 3.6Å; I93-Y97 HydrophobicContact CG2-CE2 3.69Å; I93-Y97 VanDerWaalsContact O-CD2 3.24Å; I93-Y97 WeakPolarHBondContact O-CD2 3.3Å; I93-Y97 PolarHBondContact O-N 2.85Å; T94-Y97 PolarHBondContact O-N 3.25Å; V95-Y97 PolarHBondContact O-N 3.48Å; Y97-S100 WeakPolarHBondContact CA-OG 3.49Å; Y97-K106 WeakPolarHBondContact CD1-O 3.38Å; Y97-K106 WeakPolarHBondContact CE1-O 3.17Å; Y97-H107 AromaticContact CE1-ND1 3.61Å; Y97-H107 AromaticContact CZ-ND1 3.98Å; Y97-H107 PolarHBondContact OH-ND1 2.84Å
98	N	88.1	Confident	80.6	Confident	114 Å²	114	70.2 Å²	70.2	61%	0.61	40%	0.396	S	S	*	.	H	α-helix	trans	-75.9	-30.6	173.7	-79.8	-7.4	0	0	0	112	T94 V95 F96	T94-N98 VanDerWaalsContact O-CB 3.26Å; T94-N98 WeakPolarHBondContact O-CB 3.42Å; T94-N98 PolarHBondContact O-N 2.99Å; T94-N98 PolarHBondContact O-ND2 2.68Å; T94-N98 PolarHBondContact O-OD1 3.17Å; V95-N98 PolarHBondContact O-N 3.01Å; V95-N98 VanDerWaalsContact O-N 3.15Å; F96-N98 VanDerWaalsContact C-N 3.29Å; F96-N98 PolarHBondContact O-N 2.69Å
99	Y	87.4	Confident	80.9	Confident	46 Å²	46	67.9 Å²	67.9	18%	0.18	38%	0.377	C	S	.	.	H	α-helix	trans	-97.9	-23.7	178.4	-64.2	-79.1	0	0	0	112.4	V95 F96 L109 E113 L117 S120 E121	V95-Y99 HydrophobicContact CG1-CD2 4.09Å; V95-Y99 HydrophobicContact CG1-CE2 3.98Å; V95-Y99 WeakPolarHBondContact O-CD2 3.29Å; V95-Y99 PolarHBondContact O-N 2.99Å; F96-Y99 PolarHBondContact O-N 3.37Å; Y99-L109 VanDerWaalsContact C-CD2 3.48Å; Y99-E113 WeakPolarHBondContact O-CB 3.41Å; Y99-E113 VanDerWaalsContact O-CD 3.3Å; Y99-E113 VanDerWaalsContact O-CG 3.29Å; Y99-E113 WeakPolarHBondContact O-CG 3.44Å; Y99-L117 HydrophobicContact CD1-CB 4.11Å; Y99-L117 HydrophobicContact CD2-CB 3.84Å; Y99-L117 HydrophobicContact CD2-CD1 3.69Å; Y99-L117 HydrophobicContact CD2-CG 3.6Å; Y99-L117 HydrophobicContact CE2-CB 4.36Å; Y99-L117 HydrophobicContact CE2-CG 4.04Å; Y99-L117 HydrophobicContact CG-CB 3.75Å; Y99-L117 HydrophobicContact CG-CD1 4.1Å; Y99-L117 HydrophobicContact CG-CG 4.04Å; Y99-S120 WeakPolarHBondContact CE1-OG 3.45Å; Y99-S120 VanDerWaalsContact OH-CB 3.3Å; Y99-S120 WeakPolarHBondContact OH-CB 3.5Å; Y99-S120 PolarHBondContact OH-OG 2.92Å; Y99-E121 HydrophobicContact CE2-CG 3.95Å; Y99-E121 WeakPolarHBondContact CE2-OE1 3.13Å; Y99-E121 PolarHBondContact OH-OE1 3.44Å
100	S	84	Confident	81.3	Confident	11 Å²	11	64.9 Å²	64.9	8%	0.077	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	150.4	176.4	73.8	0	0	0	0	112.7	F96 Y97 N102 K106 K108	F96-S100 WeakPolarHBondContact O-CB 3.46Å; F96-S100 PolarHBondContact O-N 3.02Å; F96-S100 PolarHBondContact O-OG 2.95Å; Y97-S100 WeakPolarHBondContact CA-OG 3.49Å; S100-N102 VanDerWaalsContact C-N 3.29Å; S100-N102 PolarHBondContact O-N 3.21Å; S100-K106 PolarHBondContact OG-O 2.83Å; S100-K108 WeakPolarHBondContact CB-O 3.4Å
101	G	74.6	Confident	81.5	Confident	28 Å²	28	68.1 Å²	68.1	29%	0.289	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	14.3	176.4	0	0	0	0	0	114.9	D105 E113	G101-D105 PolarHBondContact N-O 3.43Å; G101-E113 PolarHBondContact N-OE1 2.99Å
102	N	69.4	Low	81.6	Confident	128 Å²	128	67.5 Å²	67.5	68%	0.684	37%	0.368	S	S	*	.	S	Bend	trans	-75.8	-34.3	170.5	-137.5	22.9	0	0	0	109.8	S100 E113	S100-N102 VanDerWaalsContact C-N 3.29Å; S100-N102 PolarHBondContact O-N 3.21Å; N102-E113 WeakPolarHBondContact CA-OE1 3.38Å; N102-E113 HydrophobicContact CB-CG 4.39Å; N102-E113 WeakPolarHBondContact CB-OE1 3.21Å; N102-E113 PolarHBondContact N-OE1 3.14Å
103	D	61.1	Low	81.7	Confident	130 Å²	130	64.9 Å²	64.9	70%	0.695	35%	0.353	S	S	*	.	S	Bend	trans	-147.3	85.1	175.6	-149	5.2	0	0	0	110.9	N110 E113	D103-N110 PolarHBondContact O-ND2 2.92Å; D103-E113 PolarHBondContact N-OE1 2.91Å
104	G	67	Low	81.7	Confident	64 Å²	64	61.2 Å²	61.2	66%	0.66	34%	0.335	S	S	*	.	S	Bend	trans	128.1	-132.5	176.1	0	0	0	0	0	115.1
105	D	73.8	Confident	81.7	Confident	73 Å²	73	62.8 Å²	62.8	39%	0.39	34%	0.335	S	S	.	.			trans	-74.5	131.1	-179.5	-167.9	-19.1	0	0	0	110.6	G101 H107 K108	G101-D105 PolarHBondContact N-O 3.43Å; D105-H107 PolarHBondContact O-N 3.06Å; D105-H107 IonicContact OD1-CD2 3.36Å; D105-H107 IonicContact OD1-CG 2.74Å; D105-H107 PolarHBondContact OD1-N 3.22Å; D105-K108 HydrophobicContact CB-CB 4.3Å; D105-K108 HydrophobicContact CB-CG 4.42Å; D105-K108 PolarHBondContact O-N 3.15Å; D105-K108 VanDerWaalsContact O-O 3.05Å
106	K	77.9	Confident	81.6	Confident	145 Å²	145	66.7 Å²	66.7	63%	0.63	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17	178.7	-69.1	-172.4	176	-171.1	0	113.3	Y97 S100	Y97-K106 WeakPolarHBondContact CD1-O 3.38Å; Y97-K106 WeakPolarHBondContact CE1-O 3.17Å; S100-K106 PolarHBondContact OG-O 2.83Å
107	H	81.8	Confident	81.7	Confident	110 Å²	110	66.9 Å²	66.9	51%	0.509	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	3.2	-175.5	-59.6	-68.7	0	0	0	113.9	F96 Y97 D105	F96-H107 WeakPolarHBondContact CE1-O 3.3Å; F96-H107 WeakPolarHBondContact CZ-O 3.34Å; Y97-H107 AromaticContact CE1-ND1 3.61Å; Y97-H107 AromaticContact CZ-ND1 3.98Å; Y97-H107 PolarHBondContact OH-ND1 2.84Å; D105-H107 PolarHBondContact O-N 3.06Å; D105-H107 IonicContact OD1-CD2 3.36Å; D105-H107 IonicContact OD1-CG 2.74Å; D105-H107 PolarHBondContact OD1-N 3.22Å
108	K	86.4	Confident	81.5	Confident	49 Å²	49	62.1 Å²	62.1	21%	0.213	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.8	-178.7	-58.8	-175.1	177.6	-167.7	0	111	S100 D105 D147 E149 V150	S100-K108 WeakPolarHBondContact CB-O 3.4Å; D105-K108 HydrophobicContact CB-CB 4.3Å; D105-K108 HydrophobicContact CB-CG 4.42Å; D105-K108 PolarHBondContact O-N 3.15Å; D105-K108 VanDerWaalsContact O-O 3.05Å; K108-D147 IonicContact NZ-OD2 2.85Å; K108-D147 PolarHBondContact NZ-OD2 3.26Å; K108-E149 HydrophobicContact CB-CB 4.15Å; K108-E149 HydrophobicContact CD-CB 3.86Å; K108-E149 HydrophobicContact CD-CG 4.4Å; K108-E149 WeakPolarHBondContact CD-OE2 3.28Å; K108-E149 IonicContact NZ-OE2 3.98Å; K108-E149 PolarHBondContact NZ-OE2 3.25Å; K108-V150 CarbonylContact C-O 3.6Å; K108-V150 WeakPolarHBondContact CA-O 3.06Å
109	L	87.1	Confident	81.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.5	172.9	-68	165.7	0	0	0	109	F96 Y99 E113 L114 L117 E149 V150 F155	F96-L109 HydrophobicContact CD2-CD1 3.63Å; F96-L109 HydrophobicContact CD2-CG 4.18Å; F96-L109 HydrophobicContact CE2-CD1 3.5Å; F96-L109 HydrophobicContact CE2-CG 3.77Å; F96-L109 HydrophobicContact CZ-CD1 4.44Å; F96-L109 HydrophobicContact CZ-CG 4.23Å; Y99-L109 VanDerWaalsContact C-CD2 3.48Å; L109-E113 WeakPolarHBondContact CA-OE2 3.12Å; L109-E113 HydrophobicContact CB-CB 4.45Å; L109-E113 HydrophobicContact CD2-CB 3.81Å; L109-L114 HydrophobicContact CB-CB 4.42Å; L109-L114 HydrophobicContact CD1-CD1 4.37Å; L109-L117 HydrophobicContact CD1-CD1 3.85Å; L109-E149 CarbonylContact O-C 3.53Å; L109-E149 WeakPolarHBondContact O-CA 3.49Å; L109-V150 HydrophobicContact CB-CB 4.34Å; L109-V150 PolarHBondContact N-O 2.88Å; L109-V150 PolarHBondContact O-N 2.86Å; L109-F155 HydrophobicContact CD1-CD2 4.35Å
110	N	87.3	Confident	80.9	Confident	37 Å²	37	61.6 Å²	61.6	20%	0.198	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	170.3	168.6	72.4	45.5	0	0	0	110.8	D103 G112 E113 L114	D103-N110 PolarHBondContact O-ND2 2.92Å; N110-G112 PolarHBondContact O-N 3.4Å; N110-G112 VanDerWaalsContact O-N 3.15Å; N110-G112 VanDerWaalsContact OD1-CA 3.29Å; N110-G112 WeakPolarHBondContact OD1-CA 3.46Å; N110-G112 PolarHBondContact OD1-N 3.14Å; N110-E113 PolarHBondContact N-OE2 2.86Å; N110-E113 VanDerWaalsContact ND2-CD 3.3Å; N110-E113 PolarHBondContact ND2-OE2 2.9Å; N110-E113 PolarHBondContact O-N 3.25Å; N110-E113 WeakPolarHBondContact OD1-CG 3.45Å; N110-E113 PolarHBondContact OD1-N 3.44Å; N110-L114 WeakPolarHBondContact O-CB 3.31Å; N110-L114 PolarHBondContact O-N 3.41Å
111	K	84.1	Confident	80.9	Confident	98 Å²	98	65.7 Å²	65.7	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-56.5	-32.3	180	-172.3	176.3	-175.7	172.5	0	113.6	K115 E136 M139	K111-K115 WeakPolarHBondContact O-CB 3.45Å; K111-K115 PolarHBondContact O-N 3.4Å; K111-E136 IonicContact NZ-OE1 3.55Å; K111-E136 PolarHBondContact NZ-OE1 3.47Å; K111-M139 HydrophobicContact CB-SD 4.34Å
112	G	85	Confident	80.9	Confident	38 Å²	38	65.9 Å²	65.9	39%	0.392	35%	0.347	S	S	.	.	H	α-helix	trans	-73.3	-49	177.4	0	0	0	0	0	112.1	N110 K115 E116	N110-G112 PolarHBondContact O-N 3.4Å; N110-G112 VanDerWaalsContact O-N 3.15Å; N110-G112 VanDerWaalsContact OD1-CA 3.29Å; N110-G112 WeakPolarHBondContact OD1-CA 3.46Å; N110-G112 PolarHBondContact OD1-N 3.14Å; G112-K115 WeakPolarHBondContact O-CB 3.48Å; G112-K115 PolarHBondContact O-N 3.26Å; G112-E116 PolarHBondContact O-N 2.87Å
113	E	87.6	Confident	80.9	Confident	9 Å²	9	62.8 Å²	62.8	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-43.5	178.4	-68.4	170.7	153.1	0	0	111.5	Y99 G101 N102 D103 L109 N110 K115 E116 L117	Y99-E113 WeakPolarHBondContact O-CB 3.41Å; Y99-E113 VanDerWaalsContact O-CD 3.3Å; Y99-E113 VanDerWaalsContact O-CG 3.29Å; Y99-E113 WeakPolarHBondContact O-CG 3.44Å; G101-E113 PolarHBondContact N-OE1 2.99Å; N102-E113 WeakPolarHBondContact CA-OE1 3.38Å; N102-E113 HydrophobicContact CB-CG 4.39Å; N102-E113 WeakPolarHBondContact CB-OE1 3.21Å; N102-E113 PolarHBondContact N-OE1 3.14Å; D103-E113 PolarHBondContact N-OE1 2.91Å; L109-E113 WeakPolarHBondContact CA-OE2 3.12Å; L109-E113 HydrophobicContact CB-CB 4.45Å; L109-E113 HydrophobicContact CD2-CB 3.81Å; N110-E113 PolarHBondContact N-OE2 2.86Å; N110-E113 VanDerWaalsContact ND2-CD 3.3Å; N110-E113 PolarHBondContact ND2-OE2 2.9Å; N110-E113 PolarHBondContact O-N 3.25Å; N110-E113 WeakPolarHBondContact OD1-CG 3.45Å; N110-E113 PolarHBondContact OD1-N 3.44Å; E113-K115 VanDerWaalsContact C-N 3.3Å; E113-K115 PolarHBondContact O-N 3.22Å; E113-E116 PolarHBondContact O-N 3.36Å; E113-L117 WeakPolarHBondContact O-CB 3.37Å; E113-L117 PolarHBondContact O-N 2.95Å
114	L	86.3	Confident	81	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-42.8	174.4	-179.5	66.7	0	0	0	110.9	L109 N110 E116 L117 L118 M139 L142 V150	L109-L114 HydrophobicContact CB-CB 4.42Å; L109-L114 HydrophobicContact CD1-CD1 4.37Å; N110-L114 WeakPolarHBondContact O-CB 3.31Å; N110-L114 PolarHBondContact O-N 3.41Å; L114-E116 VanDerWaalsContact C-N 3.31Å; L114-E116 PolarHBondContact O-N 3.2Å; L114-L117 PolarHBondContact O-N 3.38Å; L114-L118 HydrophobicContact CD1-CD1 4.26Å; L114-L118 HydrophobicContact CD1-CG 4.11Å; L114-L118 HydrophobicContact CD2-CD1 4.42Å; L114-L118 HydrophobicContact CG-CD1 3.93Å; L114-L118 HydrophobicContact CG-CG 4.19Å; L114-L118 WeakPolarHBondContact O-CB 3.39Å; L114-L118 WeakPolarHBondContact O-CG 3.21Å; L114-L118 PolarHBondContact O-N 2.83Å; L114-M139 HydrophobicContact CD2-CB 4.3Å; L114-M139 HydrophobicContact CD2-SD 3.4Å; L114-M139 WeakPolarHBondContact CD2-SD 3.4Å; L114-L142 HydrophobicContact CD2-CD1 4.36Å; L114-V150 HydrophobicContact CD2-CG2 4Å
115	K	84.3	Confident	80.8	Confident	107 Å²	107	64.6 Å²	64.6	47%	0.465	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-44.6	177.3	-179.3	177.7	176.6	-172.4	0	111	K111 G112 E113 H119 V135	K111-K115 WeakPolarHBondContact O-CB 3.45Å; K111-K115 PolarHBondContact O-N 3.4Å; G112-K115 WeakPolarHBondContact O-CB 3.48Å; G112-K115 PolarHBondContact O-N 3.26Å; E113-K115 VanDerWaalsContact C-N 3.3Å; E113-K115 PolarHBondContact O-N 3.22Å; K115-H119 WeakPolarHBondContact O-CB 3.47Å; K115-H119 PolarHBondContact O-CD2 2.97Å; K115-H119 VanDerWaalsContact O-CD2 3.25Å; K115-H119 PolarHBondContact O-N 2.96Å; K115-V135 HydrophobicContact CB-CG1 3.81Å; K115-V135 HydrophobicContact CD-CG1 4.49Å; K115-V135 HydrophobicContact CG-CG1 4Å; K115-V135 HydrophobicContact CG-CG2 4.32Å
116	E	86.9	Confident	80.2	Confident	112 Å²	112	62 Å²	62	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-47.8	178	-72.2	-177.6	-178.1	0	0	111.6	G112 E113 L114 L118 H119 S120	G112-E116 PolarHBondContact O-N 2.87Å; E113-E116 PolarHBondContact O-N 3.36Å; L114-E116 VanDerWaalsContact C-N 3.31Å; L114-E116 PolarHBondContact O-N 3.2Å; E116-L118 PolarHBondContact O-N 3.42Å; E116-H119 CarbonylContact O-C 3.58Å; E116-H119 PolarHBondContact O-N 3.01Å; E116-H119 VanDerWaalsContact O-N 3.14Å; E116-S120 WeakPolarHBondContact O-CB 3.48Å; E116-S120 PolarHBondContact O-N 2.89Å; E116-S120 PolarHBondContact O-OG 2.99Å
117	L	88.4	Confident	79.1	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-56.4	-49.9	176.6	-174.4	162	0	0	0	111.6	V95 Y99 L109 E113 L114 H119 S120 E121 F155	V95-L117 HydrophobicContact CG1-CD1 4.16Å; V95-L117 HydrophobicContact CG1-CG 4.32Å; Y99-L117 HydrophobicContact CD1-CB 4.11Å; Y99-L117 HydrophobicContact CD2-CB 3.84Å; Y99-L117 HydrophobicContact CD2-CD1 3.69Å; Y99-L117 HydrophobicContact CD2-CG 3.6Å; Y99-L117 HydrophobicContact CE2-CB 4.36Å; Y99-L117 HydrophobicContact CE2-CG 4.04Å; Y99-L117 HydrophobicContact CG-CB 3.75Å; Y99-L117 HydrophobicContact CG-CD1 4.1Å; Y99-L117 HydrophobicContact CG-CG 4.04Å; L109-L117 HydrophobicContact CD1-CD1 3.85Å; E113-L117 WeakPolarHBondContact O-CB 3.37Å; E113-L117 PolarHBondContact O-N 2.95Å; L114-L117 PolarHBondContact O-N 3.38Å; L117-H119 VanDerWaalsContact C-N 3.28Å; L117-H119 PolarHBondContact O-N 2.94Å; L117-S120 PolarHBondContact O-N 2.86Å; L117-S120 PolarHBondContact O-OG 3.34Å; L117-S120 VanDerWaalsContact O-OG 3.06Å; L117-E121 HydrophobicContact CD2-CG 4.4Å; L117-E121 HydrophobicContact CG-CG 4.4Å; L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.91Å; L117-F155 HydrophobicContact CD1-CD2 4.37Å; L117-F155 HydrophobicContact CD1-CE2 3.69Å; L117-F155 HydrophobicContact CD1-CZ 4.17Å; L117-F155 HydrophobicContact CD2-CE2 3.8Å; L117-F155 HydrophobicContact CD2-CZ 4.45Å; L117-F155 HydrophobicContact CG-CE2 4.45Å
118	L	82.3	Confident	77.6	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-41.9	179.2	-69.8	179.1	0	0	0	110.3	L114 E116 L122 L126 V135 I138 L158	L114-L118 HydrophobicContact CD1-CD1 4.26Å; L114-L118 HydrophobicContact CD1-CG 4.11Å; L114-L118 HydrophobicContact CD2-CD1 4.42Å; L114-L118 HydrophobicContact CG-CD1 3.93Å; L114-L118 HydrophobicContact CG-CG 4.19Å; L114-L118 WeakPolarHBondContact O-CB 3.39Å; L114-L118 WeakPolarHBondContact O-CG 3.21Å; L114-L118 PolarHBondContact O-N 2.83Å; E116-L118 PolarHBondContact O-N 3.42Å; L118-L122 HydrophobicContact CD2-CD1 3.66Å; L118-L122 CarbonylContact O-C 3.38Å; L118-L122 VanDerWaalsContact O-CA 3.32Å; L118-L122 WeakPolarHBondContact O-CA 3.43Å; L118-L122 VanDerWaalsContact O-CB 3.28Å; L118-L122 WeakPolarHBondContact O-CB 3.29Å; L118-L122 PolarHBondContact O-N 3.28Å; L118-L126 HydrophobicContact CB-CD1 3.82Å; L118-L126 WeakPolarHBondContact O-CD1 3.32Å; L118-V135 HydrophobicContact CD1-CG1 4.47Å; L118-I138 HydrophobicContact CD1-CB 4.38Å; L118-I138 HydrophobicContact CD1-CD1 4.09Å; L118-I138 HydrophobicContact CD1-CG2 3.93Å; L118-L158 HydrophobicContact CD2-CD2 3.81Å
119	H	80.8	Confident	76	Confident	96 Å²	96	57.2 Å²	57.2	44%	0.444	30%	0.3	S	S	.	.	H	α-helix	trans	-70.8	-30.8	178.8	-91.5	-74.8	0	0	0	114.4	K115 E116 L117 T123	K115-H119 WeakPolarHBondContact O-CB 3.47Å; K115-H119 PolarHBondContact O-CD2 2.97Å; K115-H119 VanDerWaalsContact O-CD2 3.25Å; K115-H119 PolarHBondContact O-N 2.96Å; E116-H119 CarbonylContact O-C 3.58Å; E116-H119 PolarHBondContact O-N 3.01Å; E116-H119 VanDerWaalsContact O-N 3.14Å; L117-H119 VanDerWaalsContact C-N 3.28Å; L117-H119 PolarHBondContact O-N 2.94Å; H119-T123 PolarHBondContact O-OG1 2.93Å
120	S	83.7	Confident	74.5	Confident	53 Å²	53	66.4 Å²	66.4	37%	0.371	34%	0.34	S	S	.	.	H	α-helix	trans	-84.7	-51.5	-179.6	55.5	0	0	0	0	111.8	Y99 E116 L117 T123	Y99-S120 WeakPolarHBondContact CE1-OG 3.45Å; Y99-S120 VanDerWaalsContact OH-CB 3.3Å; Y99-S120 WeakPolarHBondContact OH-CB 3.5Å; Y99-S120 PolarHBondContact OH-OG 2.92Å; E116-S120 WeakPolarHBondContact O-CB 3.48Å; E116-S120 PolarHBondContact O-N 2.89Å; E116-S120 PolarHBondContact O-OG 2.99Å; L117-S120 PolarHBondContact O-N 2.86Å; L117-S120 PolarHBondContact O-OG 3.34Å; L117-S120 VanDerWaalsContact O-OG 3.06Å; S120-T123 PolarHBondContact O-OG1 3.33Å
121	E	83.9	Confident	73.3	Confident	97 Å²	97	68.9 Å²	68.9	45%	0.453	35%	0.354	S	S	.	.	H	α-helix	trans	-83.2	-29.9	-173.1	-57.5	-59.1	151.9	0	0	112.3	V95 Y99 L117	V95-E121 HydrophobicContact CG1-CG 3.99Å; Y99-E121 HydrophobicContact CE2-CG 3.95Å; Y99-E121 WeakPolarHBondContact CE2-OE1 3.13Å; Y99-E121 PolarHBondContact OH-OE1 3.44Å; L117-E121 HydrophobicContact CD2-CG 4.4Å; L117-E121 HydrophobicContact CG-CG 4.4Å; L117-E121 WeakPolarHBondContact O-CB 3.42Å; L117-E121 PolarHBondContact O-N 2.91Å
122	L	74	Confident	72.4	Confident	33 Å²	33	69.9 Å²	69.9	17%	0.173	37%	0.37	C	S	.	.	S	Bend	trans	-117.2	28	-173.8	-56.7	174.9	0	0	0	113.1	L118 D124 F125 L126 L162	L118-L122 HydrophobicContact CD2-CD1 3.66Å; L118-L122 CarbonylContact O-C 3.38Å; L118-L122 VanDerWaalsContact O-CA 3.32Å; L118-L122 WeakPolarHBondContact O-CA 3.43Å; L118-L122 VanDerWaalsContact O-CB 3.28Å; L118-L122 WeakPolarHBondContact O-CB 3.29Å; L118-L122 PolarHBondContact O-N 3.28Å; L122-D124 VanDerWaalsContact C-N 3.25Å; L122-D124 PolarHBondContact O-N 2.87Å; L122-D124 VanDerWaalsContact O-N 3.15Å; L122-F125 HydrophobicContact CB-CB 4.33Å; L122-F125 HydrophobicContact CB-CD2 4.2Å; L122-F125 HydrophobicContact CD2-CD2 3.77Å; L122-F125 HydrophobicContact CD2-CE2 4.12Å; L122-F125 PolarHBondContact O-N 2.85Å; L122-L126 WeakPolarHBondContact O-CG 3.43Å; L122-L126 PolarHBondContact O-N 2.84Å; L122-L162 HydrophobicContact CD1-CD1 3.48Å; L122-L162 VanDerWaalsContact CD1-CD1 3.48Å; L122-L162 HydrophobicContact CD2-CD1 4.21Å
123	T	68.3	Low	71.8	Confident	63 Å²	63	73.4 Å²	73.4	39%	0.387	38%	0.378	S	S	.	.	H	α-helix	trans	-47.2	-46.5	-179.9	-55.3	0	0	0	0	112.5	H119 S120 F125 L126 T127	H119-T123 PolarHBondContact O-OG1 2.93Å; S120-T123 PolarHBondContact O-OG1 3.33Å; T123-F125 VanDerWaalsContact C-N 3.34Å; T123-F125 PolarHBondContact O-N 3.31Å; T123-L126 PolarHBondContact O-N 3.15Å; T123-T127 HydrophobicContact CG2-CG2 3.91Å; T123-T127 WeakPolarHBondContact O-CB 3.38Å; T123-T127 WeakPolarHBondContact O-CG2 3.31Å; T123-T127 PolarHBondContact O-N 3.37Å; T123-T127 PolarHBondContact O-OG1 2.82Å
124	D	64.8	Low	71.1	Confident	125 Å²	125	74.1 Å²	74.1	67%	0.668	38%	0.382	S	S	*	.	H	α-helix	trans	-70	-31	-176.1	-67.5	-22.7	0	0	0	112.8	L122 T127 S128	L122-D124 VanDerWaalsContact C-N 3.25Å; L122-D124 PolarHBondContact O-N 2.87Å; L122-D124 VanDerWaalsContact O-N 3.15Å; D124-T127 WeakPolarHBondContact CA-OG1 3.49Å; D124-T127 PolarHBondContact O-OG1 3.44Å; D124-T127 VanDerWaalsContact O-OG1 3.09Å; D124-S128 PolarHBondContact O-OG 3.27Å
125	F	62.1	Low	70.7	Confident	106 Å²	106	74.9 Å²	74.9	47%	0.465	39%	0.386	S	S	.	.	H	α-helix	trans	-73.1	-39	174.7	-67.5	-81.7	0	0	0	111.5	L122 T123 S128 C166	L122-F125 HydrophobicContact CB-CB 4.33Å; L122-F125 HydrophobicContact CB-CD2 4.2Å; L122-F125 HydrophobicContact CD2-CD2 3.77Å; L122-F125 HydrophobicContact CD2-CE2 4.12Å; L122-F125 PolarHBondContact O-N 2.85Å; T123-F125 VanDerWaalsContact C-N 3.34Å; T123-F125 PolarHBondContact O-N 3.31Å; F125-S128 WeakPolarHBondContact O-CB 3.45Å; F125-C166 VanDerWaalsContact CE1-SG 3.57Å; F125-C166 WeakPolarHBondContact CZ-SG 3.43Å
126	L	61.3	Low	70.5	Confident	20 Å²	20	73.1 Å²	73.1	11%	0.105	38%	0.38	C	S	.	.	H	α-helix	trans	-84.1	-28.7	-177.4	-61.4	177	0	0	0	113.7	L118 L122 T123 S128 Q129 L134 I138	L118-L126 HydrophobicContact CB-CD1 3.82Å; L118-L126 WeakPolarHBondContact O-CD1 3.32Å; L122-L126 WeakPolarHBondContact O-CG 3.43Å; L122-L126 PolarHBondContact O-N 2.84Å; T123-L126 PolarHBondContact O-N 3.15Å; L126-S128 PolarHBondContact O-N 3Å; L126-Q129 CarbonylContact O-C 3.53Å; L126-Q129 WeakPolarHBondContact O-CA 3.3Å; L126-Q129 PolarHBondContact O-N 3.13Å; L126-L134 HydrophobicContact CD2-CD2 3.49Å; L126-L134 VanDerWaalsContact CD2-CD2 3.49Å; L126-L134 HydrophobicContact CD2-CG 4.4Å; L126-I138 HydrophobicContact CD2-CD1 4.47Å
127	T	53.8	Low	70.2	Confident	74 Å²	74	73 Å²	73	45%	0.454	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-27	174.5	44	0	0	0	0	112.2	T123 D124 Q129	T123-T127 HydrophobicContact CG2-CG2 3.91Å; T123-T127 WeakPolarHBondContact O-CB 3.38Å; T123-T127 WeakPolarHBondContact O-CG2 3.31Å; T123-T127 PolarHBondContact O-N 3.37Å; T123-T127 PolarHBondContact O-OG1 2.82Å; D124-T127 WeakPolarHBondContact CA-OG1 3.49Å; D124-T127 PolarHBondContact O-OG1 3.44Å; D124-T127 VanDerWaalsContact O-OG1 3.09Å; T127-Q129 VanDerWaalsContact C-N 3.28Å
128	S	51.5	Low	69.8	Low	48 Å²	48	74 Å²	74	34%	0.336	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.8	171	-54.6	0	0	0	0	112.9	D124 F125 L126	D124-S128 PolarHBondContact O-OG 3.27Å; F125-S128 WeakPolarHBondContact O-CB 3.45Å; L126-S128 PolarHBondContact O-N 3Å
129	Q	51.8	Low	69.8	Low	80 Å²	80	74.2 Å²	74.2	37%	0.374	38%	0.384	S	S	.	.			trans	-121.6	83.5	-176	-61.6	-168.7	18.9	0	0	110	L126 T127 D131 L134	L126-Q129 CarbonylContact O-C 3.53Å; L126-Q129 WeakPolarHBondContact O-CA 3.3Å; L126-Q129 PolarHBondContact O-N 3.13Å; T127-Q129 VanDerWaalsContact C-N 3.28Å; Q129-D131 PolarHBondContact O-N 3.33Å; Q129-L134 HydrophobicContact CB-CD2 3.54Å; Q129-L134 HydrophobicContact CG-CD2 4.24Å
130	K	55.8	Low	69.9	Low	193 Å²	193	74.6 Å²	74.6	84%	0.839	39%	0.389	S	S	*	.			trans	-72.6	43.2	172.4	-67	-176.5	177.1	-178.9	0	112.5
131	D	62.6	Low	69.7	Low	90 Å²	90	77.4 Å²	77.4	48%	0.481	40%	0.4	S	S	.	.			trans	-103.6	111.6	177.2	-165.2	-18.7	0	0	0	109.1	Q129 M133 L134	Q129-D131 PolarHBondContact O-N 3.33Å; D131-M133 PolarHBondContact O-N 3.48Å; D131-M133 VanDerWaalsContact O-N 3.13Å; D131-M133 WeakPolarHBondContact OD1-CB 3.36Å; D131-M133 PolarHBondContact OD1-N 3.17Å; D131-L134 HydrophobicContact CB-CB 4.28Å; D131-L134 VanDerWaalsContact O-CB 3.28Å; D131-L134 WeakPolarHBondContact O-CB 3.35Å; D131-L134 PolarHBondContact O-N 3.43Å
132	P	65.3	Low	69.6	Low	119 Å²	119	73.4 Å²	73.4	77%	0.773	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.2	176.5	26.4	-34.2	0	0	0	112.7
133	M	71.7	Confident	70.1	Confident	112 Å²	112	72.3 Å²	72.3	55%	0.552	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.1	176	-59.5	-142.5	72.7	0	0	113.7	D131 V135 E136 K137	D131-M133 PolarHBondContact O-N 3.48Å; D131-M133 VanDerWaalsContact O-N 3.13Å; D131-M133 WeakPolarHBondContact OD1-CB 3.36Å; D131-M133 PolarHBondContact OD1-N 3.17Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.88Å; M133-E136 WeakPolarHBondContact CE-OE2 3.37Å; M133-E136 PolarHBondContact O-N 2.95Å; M133-K137 WeakPolarHBondContact O-CB 3.35Å; M133-K137 PolarHBondContact O-N 2.91Å
134	L	74.4	Confident	70.5	Confident	24 Å²	24	73.9 Å²	73.9	13%	0.126	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-43.5	-179	177.2	62.5	0	0	0	111.9	L126 Q129 D131 E136 K137 I138	L126-L134 HydrophobicContact CD2-CD2 3.49Å; L126-L134 VanDerWaalsContact CD2-CD2 3.49Å; L126-L134 HydrophobicContact CD2-CG 4.4Å; Q129-L134 HydrophobicContact CB-CD2 3.54Å; Q129-L134 HydrophobicContact CG-CD2 4.24Å; D131-L134 HydrophobicContact CB-CB 4.28Å; D131-L134 VanDerWaalsContact O-CB 3.28Å; D131-L134 WeakPolarHBondContact O-CB 3.35Å; D131-L134 PolarHBondContact O-N 3.43Å; L134-E136 VanDerWaalsContact C-N 3.28Å; L134-E136 PolarHBondContact O-N 2.98Å; L134-K137 WeakPolarHBondContact O-CB 3.03Å; L134-K137 PolarHBondContact O-N 2.74Å; L134-I138 HydrophobicContact CD1-CD1 3.99Å; L134-I138 HydrophobicContact CD1-CG1 4.14Å; L134-I138 HydrophobicContact CD2-CD1 4.4Å; L134-I138 HydrophobicContact CG-CD1 3.79Å; L134-I138 HydrophobicContact CG-CG1 4.35Å; L134-I138 VanDerWaalsContact O-CG1 3.3Å; L134-I138 WeakPolarHBondContact O-CG1 3.37Å; L134-I138 PolarHBondContact O-N 3.34Å
135	V	76.8	Confident	71.3	Confident	15 Å²	15	72 Å²	72	9%	0.091	38%	0.379	C	S	.	.	H	α-helix	trans	-62.3	-40.4	179	177.3	0	0	0	0	110.6	K115 L118 M133 K137 I138 M139	K115-V135 HydrophobicContact CB-CG1 3.81Å; K115-V135 HydrophobicContact CD-CG1 4.49Å; K115-V135 HydrophobicContact CG-CG1 4Å; K115-V135 HydrophobicContact CG-CG2 4.32Å; L118-V135 HydrophobicContact CD1-CG1 4.47Å; M133-V135 VanDerWaalsContact C-N 3.34Å; M133-V135 PolarHBondContact O-N 2.88Å; V135-K137 VanDerWaalsContact C-N 3.35Å; V135-I138 PolarHBondContact O-N 3.01Å; V135-M139 WeakPolarHBondContact O-CB 3.45Å; V135-M139 PolarHBondContact O-N 3Å
136	E	81.3	Confident	72.3	Confident	71 Å²	71	75 Å²	75	33%	0.332	39%	0.392	S	S	.	.	H	α-helix	trans	-68.2	-36	176.4	-177.4	159.5	-118	0	0	112.1	K111 M133 L134 M139 N140	K111-E136 IonicContact NZ-OE1 3.55Å; K111-E136 PolarHBondContact NZ-OE1 3.47Å; M133-E136 WeakPolarHBondContact CE-OE2 3.37Å; M133-E136 PolarHBondContact O-N 2.95Å; L134-E136 VanDerWaalsContact C-N 3.28Å; L134-E136 PolarHBondContact O-N 2.98Å; E136-M139 PolarHBondContact O-N 3.33Å; E136-N140 WeakPolarHBondContact O-CB 3.29Å; E136-N140 PolarHBondContact O-N 2.82Å; E136-N140 PolarHBondContact O-ND2 3.32Å
137	K	79.6	Confident	73.4	Confident	108 Å²	108	76.4 Å²	76.4	47%	0.47	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-44.9	173.7	-168.4	-178.5	177.6	-170.7	0	111.8	M133 L134 V135 M139 N140 D141	M133-K137 WeakPolarHBondContact O-CB 3.35Å; M133-K137 PolarHBondContact O-N 2.91Å; L134-K137 WeakPolarHBondContact O-CB 3.03Å; L134-K137 PolarHBondContact O-N 2.74Å; V135-K137 VanDerWaalsContact C-N 3.35Å; K137-M139 VanDerWaalsContact C-N 3.32Å; K137-M139 PolarHBondContact O-N 2.84Å; K137-N140 PolarHBondContact O-N 3.5Å; K137-D141 WeakPolarHBondContact O-CB 3.26Å; K137-D141 VanDerWaalsContact O-CG 3.25Å; K137-D141 PolarHBondContact O-N 2.73Å
138	I	79.8	Confident	74.8	Confident	27 Å²	27	78.4 Å²	78.4	14%	0.138	41%	0.407	C	S	.	.	H	α-helix	trans	-61	-45.3	175.5	-68.5	167.7	0	0	0	109.6	L118 L126 L134 V135 N140 D141 L142 L158	L118-I138 HydrophobicContact CD1-CB 4.38Å; L118-I138 HydrophobicContact CD1-CD1 4.09Å; L118-I138 HydrophobicContact CD1-CG2 3.93Å; L126-I138 HydrophobicContact CD2-CD1 4.47Å; L134-I138 HydrophobicContact CD1-CD1 3.99Å; L134-I138 HydrophobicContact CD1-CG1 4.14Å; L134-I138 HydrophobicContact CD2-CD1 4.4Å; L134-I138 HydrophobicContact CG-CD1 3.79Å; L134-I138 HydrophobicContact CG-CG1 4.35Å; L134-I138 VanDerWaalsContact O-CG1 3.3Å; L134-I138 WeakPolarHBondContact O-CG1 3.37Å; L134-I138 PolarHBondContact O-N 3.34Å; V135-I138 PolarHBondContact O-N 3.01Å; I138-N140 VanDerWaalsContact C-N 3.34Å; I138-N140 PolarHBondContact O-N 3.24Å; I138-D141 PolarHBondContact O-N 3.1Å; I138-L142 HydrophobicContact CG2-CD1 3.6Å; I138-L142 HydrophobicContact CG2-CG 4.18Å; I138-L142 WeakPolarHBondContact O-CB 3.24Å; I138-L142 WeakPolarHBondContact O-CG 3.3Å; I138-L142 PolarHBondContact O-N 3.43Å; I138-L158 HydrophobicContact CG2-CD1 4.12Å; I138-L158 HydrophobicContact CG2-CD2 4.43Å
139	M	83.1	Confident	76.5	Confident	5 Å²	5	78.9 Å²	78.9	3%	0.025	41%	0.405	C	S	.	.	H	α-helix	trans	-54.7	-51.4	174.6	-171.2	77.7	-168.9	0	0	110.9	K111 L114 V135 E136 K137 D141 L142 D143 N148 V150	K111-M139 HydrophobicContact CB-SD 4.34Å; L114-M139 HydrophobicContact CD2-CB 4.3Å; L114-M139 HydrophobicContact CD2-SD 3.4Å; L114-M139 WeakPolarHBondContact CD2-SD 3.4Å; V135-M139 WeakPolarHBondContact O-CB 3.45Å; V135-M139 PolarHBondContact O-N 3Å; E136-M139 PolarHBondContact O-N 3.33Å; K137-M139 VanDerWaalsContact C-N 3.32Å; K137-M139 PolarHBondContact O-N 2.84Å; M139-D141 VanDerWaalsContact C-N 3.3Å; M139-D141 PolarHBondContact O-N 3.25Å; M139-L142 PolarHBondContact O-N 3.03Å; M139-D143 WeakPolarHBondContact O-CB 3.41Å; M139-D143 PolarHBondContact O-N 3.45Å; M139-N148 WeakPolarHBondContact CE-O 3.39Å; M139-V150 HydrophobicContact CE-CG2 3.82Å; M139-V150 HydrophobicContact SD-CG2 3.81Å
140	N	82.3	Confident	78.2	Confident	103 Å²	103	75.1 Å²	75.1	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-65.7	-30.4	-179.9	-70.8	-27.3	0	0	0	113.8	E136 K137 I138	E136-N140 WeakPolarHBondContact O-CB 3.29Å; E136-N140 PolarHBondContact O-N 2.82Å; E136-N140 PolarHBondContact O-ND2 3.32Å; K137-N140 PolarHBondContact O-N 3.5Å; I138-N140 VanDerWaalsContact C-N 3.34Å; I138-N140 PolarHBondContact O-N 3.24Å
141	D	80.3	Confident	79.7	Confident	113 Å²	113	68 Å²	68	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-77.6	-25.6	178.3	-73.7	-18.6	0	0	0	111.5	K137 I138 M139	K137-D141 WeakPolarHBondContact O-CB 3.26Å; K137-D141 VanDerWaalsContact O-CG 3.25Å; K137-D141 PolarHBondContact O-N 2.73Å; I138-D141 PolarHBondContact O-N 3.1Å; M139-D141 VanDerWaalsContact C-N 3.3Å; M139-D141 PolarHBondContact O-N 3.25Å
142	L	81.4	Confident	80.7	Confident	13 Å²	13	66.5 Å²	66.5	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-90.3	-43.2	178.1	-64.5	175.3	0	0	0	113	L114 I138 M139 S144 V150 E154 L158	L114-L142 HydrophobicContact CD2-CD1 4.36Å; I138-L142 HydrophobicContact CG2-CD1 3.6Å; I138-L142 HydrophobicContact CG2-CG 4.18Å; I138-L142 WeakPolarHBondContact O-CB 3.24Å; I138-L142 WeakPolarHBondContact O-CG 3.3Å; I138-L142 PolarHBondContact O-N 3.43Å; M139-L142 PolarHBondContact O-N 3.03Å; L142-S144 VanDerWaalsContact C-N 3.26Å; L142-S144 PolarHBondContact O-N 3.32Å; L142-S144 PolarHBondContact O-OG 3.48Å; L142-V150 HydrophobicContact CB-CG2 4.12Å; L142-E154 VanDerWaalsContact O-CD 3.26Å; L142-E154 WeakPolarHBondContact O-CG 3.46Å; L142-L158 HydrophobicContact CD1-CB 4.06Å; L142-L158 HydrophobicContact CD1-CD1 4.13Å; L142-L158 HydrophobicContact CD1-CD2 3.89Å; L142-L158 HydrophobicContact CD1-CG 4.21Å; L142-L158 HydrophobicContact CD2-CB 3.58Å; L142-L158 HydrophobicContact CD2-CD1 3.97Å; L142-L158 HydrophobicContact CD2-CG 4.26Å; L142-L158 HydrophobicContact CG-CB 4.44Å; L142-L158 HydrophobicContact CG-CD1 4.41Å
143	D	83.5	Confident	81.5	Confident	9 Å²	9	66.1 Å²	66.1	5%	0.048	34%	0.339	C	S	.	.			trans	-69	80.1	179.9	-179.5	10.5	0	0	0	110.5	M139 N145 K146 D147 N148	M139-D143 WeakPolarHBondContact O-CB 3.41Å; M139-D143 PolarHBondContact O-N 3.45Å; D143-N145 PolarHBondContact OD1-OD1 2.85Å; D143-K146 WeakPolarHBondContact OD1-CA 3.39Å; D143-K146 PolarHBondContact OD1-N 3.47Å; D143-K146 WeakPolarHBondContact OD2-CA 3.38Å; D143-D147 PolarHBondContact OD1-N 3.02Å; D143-N148 WeakPolarHBondContact OD2-CA 3.48Å; D143-N148 PolarHBondContact OD2-N 3.35Å
144	S	76.7	Confident	82.1	Confident	97 Å²	97	61.8 Å²	61.8	68%	0.678	32%	0.317	S	S	*	.	S	Bend	trans	-78.2	-29.7	-176.2	-66.5	0	0	0	0	111.2	L142 E154	L142-S144 VanDerWaalsContact C-N 3.26Å; L142-S144 PolarHBondContact O-N 3.32Å; L142-S144 PolarHBondContact O-OG 3.48Å; S144-E154 PolarHBondContact N-OE1 3.29Å
145	N	81.9	Confident	82.5	Confident	84 Å²	84	60.9 Å²	60.9	45%	0.449	31%	0.312	S	S	.	.	S	Bend	trans	-84.8	-12.7	180	71.7	13.3	0	0	0	112.6	D143 D147	D143-N145 PolarHBondContact OD1-OD1 2.85Å; N145-D147 VanDerWaalsContact C-N 3.32Å; N145-D147 VanDerWaalsContact CG-CG 3.49Å; N145-D147 VanDerWaalsContact ND2-CG 3.27Å; N145-D147 PolarHBondContact ND2-OD2 3.04Å; N145-D147 WeakPolarHBondContact OD1-CB 3.41Å; N145-D147 PolarHBondContact OD1-N 3.24Å; N145-D147 PolarHBondContact OD1-OD1 3.33Å; N145-D147 PolarHBondContact OD1-OD2 3.39Å
146	K	83.1	Confident	82.8	Confident	170 Å²	170	62.9 Å²	62.9	74%	0.739	32%	0.324	S	S	*	.			trans	63.2	32.8	-178.9	-56.2	-176.4	-179	-177.4	0	113.6	D143 N148	D143-K146 WeakPolarHBondContact OD1-CA 3.39Å; D143-K146 PolarHBondContact OD1-N 3.47Å; D143-K146 WeakPolarHBondContact OD2-CA 3.38Å; K146-N148 VanDerWaalsContact C-N 3.29Å
147	D	84.1	Confident	82.8	Confident	50 Å²	50	63.1 Å²	63.1	27%	0.267	33%	0.33	S	S	.	.	S	Bend	trans	-85.7	-3.5	176.2	73.6	3.6	0	0	0	112.8	K108 D143 N145 E149	K108-D147 IonicContact NZ-OD2 2.85Å; K108-D147 PolarHBondContact NZ-OD2 3.26Å; D143-D147 PolarHBondContact OD1-N 3.02Å; N145-D147 VanDerWaalsContact C-N 3.32Å; N145-D147 VanDerWaalsContact CG-CG 3.49Å; N145-D147 VanDerWaalsContact ND2-CG 3.27Å; N145-D147 PolarHBondContact ND2-OD2 3.04Å; N145-D147 WeakPolarHBondContact OD1-CB 3.41Å; N145-D147 PolarHBondContact OD1-N 3.24Å; N145-D147 PolarHBondContact OD1-OD1 3.33Å; N145-D147 PolarHBondContact OD1-OD2 3.39Å; D147-E149 PolarHBondContact O-N 3.47Å; D147-E149 VanDerWaalsContact OD1-CA 3.31Å; D147-E149 WeakPolarHBondContact OD1-CA 3.36Å; D147-E149 WeakPolarHBondContact OD1-CB 3.02Å; D147-E149 PolarHBondContact OD1-N 2.81Å
148	N	84	Confident	82.8	Confident	115 Å²	115	59 Å²	59	62%	0.615	31%	0.314	S	S	*	.	S	Bend	trans	62.4	23.3	-174.2	-49.6	-92.4	0	0	0	113.2	M139 D143 K146	M139-N148 WeakPolarHBondContact CE-O 3.39Å; D143-N148 WeakPolarHBondContact OD2-CA 3.48Å; D143-N148 PolarHBondContact OD2-N 3.35Å; K146-N148 VanDerWaalsContact C-N 3.29Å
149	E	87.3	Confident	82.8	Confident	59 Å²	59	59.2 Å²	59.2	28%	0.276	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	163.1	172.2	-53.8	-179.2	130.5	0	0	108.2	K108 L109 D147	K108-E149 HydrophobicContact CB-CB 4.15Å; K108-E149 HydrophobicContact CD-CB 3.86Å; K108-E149 HydrophobicContact CD-CG 4.4Å; K108-E149 WeakPolarHBondContact CD-OE2 3.28Å; K108-E149 IonicContact NZ-OE2 3.98Å; K108-E149 PolarHBondContact NZ-OE2 3.25Å; L109-E149 CarbonylContact O-C 3.53Å; L109-E149 WeakPolarHBondContact O-CA 3.49Å; D147-E149 PolarHBondContact O-N 3.47Å; D147-E149 VanDerWaalsContact OD1-CA 3.31Å; D147-E149 WeakPolarHBondContact OD1-CA 3.36Å; D147-E149 WeakPolarHBondContact OD1-CB 3.02Å; D147-E149 PolarHBondContact OD1-N 2.81Å
150	V	87.5	Confident	82.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.5	175.8	174.2	0	0	0	0	108.5	K108 L109 L114 M139 L142 E154 F155	K108-V150 CarbonylContact C-O 3.6Å; K108-V150 WeakPolarHBondContact CA-O 3.06Å; L109-V150 HydrophobicContact CB-CB 4.34Å; L109-V150 PolarHBondContact N-O 2.88Å; L109-V150 PolarHBondContact O-N 2.86Å; L114-V150 HydrophobicContact CD2-CG2 4Å; M139-V150 HydrophobicContact CE-CG2 3.82Å; M139-V150 HydrophobicContact SD-CG2 3.81Å; L142-V150 HydrophobicContact CB-CG2 4.12Å; V150-E154 WeakPolarHBondContact CA-OE2 3.29Å; V150-E154 HydrophobicContact CG1-CB 3.82Å; V150-F155 HydrophobicContact CG1-CB 4.22Å
151	D	86.7	Confident	82.2	Confident	43 Å²	43	59.5 Å²	59.5	23%	0.23	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	171.1	175.7	83	15.1	0	0	0	112.1	N153 E154 F155	D151-N153 VanDerWaalsContact C-N 3.25Å; D151-N153 PolarHBondContact O-N 3.32Å; D151-N153 WeakPolarHBondContact OD1-CA 3.33Å; D151-N153 VanDerWaalsContact OD1-CB 3.29Å; D151-N153 WeakPolarHBondContact OD1-CB 3.33Å; D151-N153 PolarHBondContact OD1-N 3.46Å; D151-E154 PolarHBondContact N-OE2 2.7Å; D151-E154 PolarHBondContact O-N 2.93Å; D151-E154 WeakPolarHBondContact OD1-CG 3.41Å; D151-E154 PolarHBondContact OD1-N 3.49Å; D151-F155 WeakPolarHBondContact O-CB 3.2Å; D151-F155 PolarHBondContact O-N 2.82Å
152	F	84.6	Confident	81.9	Confident	60 Å²	60	56.3 Å²	56.3	26%	0.263	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-33.8	179.5	-178.2	-103.3	0	0	0	113	I93 F96 V156	I93-F152 HydrophobicContact CG1-CE2 3.99Å; I93-F152 HydrophobicContact CG1-CZ 3.66Å; F96-F152 HydrophobicContact CB-CD2 4.01Å; F96-F152 HydrophobicContact CB-CE2 4.18Å; F96-F152 HydrophobicContact CD1-CB 4.41Å; F96-F152 AromaticContact CD1-CD2 3.76Å; F96-F152 HydrophobicContact CD1-CD2 3.76Å; F96-F152 HydrophobicContact CD2-CD2 4.06Å; F96-F152 HydrophobicContact CE1-CB 4Å; F96-F152 HydrophobicContact CE1-CD2 4.21Å; F96-F152 HydrophobicContact CE2-CB 4.36Å; F96-F152 HydrophobicContact CE2-CD2 4.47Å; F96-F152 AromaticContact CG-CD2 3.67Å; F96-F152 HydrophobicContact CG-CD2 3.67Å; F96-F152 HydrophobicContact CG-CE2 4.34Å; F96-F152 HydrophobicContact CZ-CB 3.97Å; F152-V156 HydrophobicContact CD1-CG2 4.14Å; F152-V156 HydrophobicContact CD2-CG2 4.46Å; F152-V156 HydrophobicContact CE1-CG2 3.66Å; F152-V156 HydrophobicContact CE2-CG2 4Å; F152-V156 HydrophobicContact CZ-CG2 3.57Å; F152-V156 VanDerWaalsContact O-CG2 3.28Å; F152-V156 WeakPolarHBondContact O-CG2 3.26Å; F152-V156 PolarHBondContact O-N 3.39Å
153	N	81.3	Confident	81.7	Confident	111 Å²	111	59.9 Å²	59.9	59%	0.594	34%	0.339	S	S	*	.	H	α-helix	trans	-69.3	-45.6	-179.8	-57.8	-64.6	0	0	0	110.5	D151 F155 V156 V157	D151-N153 VanDerWaalsContact C-N 3.25Å; D151-N153 PolarHBondContact O-N 3.32Å; D151-N153 WeakPolarHBondContact OD1-CA 3.33Å; D151-N153 VanDerWaalsContact OD1-CB 3.29Å; D151-N153 WeakPolarHBondContact OD1-CB 3.33Å; D151-N153 PolarHBondContact OD1-N 3.46Å; N153-F155 VanDerWaalsContact C-N 3.32Å; N153-F155 PolarHBondContact O-N 3.43Å; N153-V156 PolarHBondContact O-N 2.76Å; N153-V157 WeakPolarHBondContact O-CG2 3.33Å; N153-V157 PolarHBondContact O-N 3.18Å; N153-V157 VanDerWaalsContact O-N 3.1Å
154	E	84.2	Confident	81.2	Confident	20 Å²	20	63.6 Å²	63.6	9%	0.093	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-41.4	176	-69.1	172.8	147.5	0	0	110.8	L142 S144 V150 D151 V157 L158	L142-E154 VanDerWaalsContact O-CD 3.26Å; L142-E154 WeakPolarHBondContact O-CG 3.46Å; S144-E154 PolarHBondContact N-OE1 3.29Å; V150-E154 WeakPolarHBondContact CA-OE2 3.29Å; V150-E154 HydrophobicContact CG1-CB 3.82Å; D151-E154 PolarHBondContact N-OE2 2.7Å; D151-E154 PolarHBondContact O-N 2.93Å; D151-E154 WeakPolarHBondContact OD1-CG 3.41Å; D151-E154 PolarHBondContact OD1-N 3.49Å; E154-V157 PolarHBondContact O-N 3.09Å; E154-L158 PolarHBondContact O-N 2.89Å
155	F	83.9	Confident	80.7	Confident	5 Å²	5	61.6 Å²	61.6	2%	0.022	35%	0.351	C	S	.	.	H	α-helix	trans	-60.5	-46.5	173.3	174.1	-105.4	0	0	0	113.1	V95 F96 L109 L117 V150 D151 N153 V157 L158 V159	V95-F155 HydrophobicContact CG1-CZ 4.36Å; F96-F155 HydrophobicContact CB-CD1 4.11Å; F96-F155 HydrophobicContact CB-CE1 4.06Å; F96-F155 HydrophobicContact CD2-CB 3.7Å; F96-F155 AromaticContact CD2-CD1 3.6Å; F96-F155 HydrophobicContact CD2-CD1 3.6Å; F96-F155 HydrophobicContact CD2-CD2 4.19Å; F96-F155 HydrophobicContact CD2-CE1 4.26Å; F96-F155 AromaticContact CD2-CG 3.55Å; F96-F155 HydrophobicContact CD2-CG 3.55Å; F96-F155 HydrophobicContact CE2-CB 3.72Å; F96-F155 HydrophobicContact CE2-CD1 4.47Å; F96-F155 HydrophobicContact CE2-CG 4.09Å; F96-F155 HydrophobicContact CG-CD1 4.25Å; L109-F155 HydrophobicContact CD1-CD2 4.35Å; L117-F155 HydrophobicContact CD1-CD2 4.37Å; L117-F155 HydrophobicContact CD1-CE2 3.69Å; L117-F155 HydrophobicContact CD1-CZ 4.17Å; L117-F155 HydrophobicContact CD2-CE2 3.8Å; L117-F155 HydrophobicContact CD2-CZ 4.45Å; L117-F155 HydrophobicContact CG-CE2 4.45Å; V150-F155 HydrophobicContact CG1-CB 4.22Å; D151-F155 WeakPolarHBondContact O-CB 3.2Å; D151-F155 PolarHBondContact O-N 2.82Å; N153-F155 VanDerWaalsContact C-N 3.32Å; N153-F155 PolarHBondContact O-N 3.43Å; F155-V157 VanDerWaalsContact C-N 3.25Å; F155-V157 PolarHBondContact O-N 3.21Å; F155-L158 VanDerWaalsContact O-CB 3.31Å; F155-L158 WeakPolarHBondContact O-CB 3.38Å; F155-L158 PolarHBondContact O-N 3.02Å; F155-L158 VanDerWaalsContact O-N 3.13Å; F155-V159 HydrophobicContact CD1-CG2 4.44Å; F155-V159 HydrophobicContact CE1-CG2 3.93Å; F155-V159 HydrophobicContact CE2-CG2 4Å; F155-V159 HydrophobicContact CZ-CG2 3.69Å; F155-V159 PolarHBondContact O-N 3.39Å
156	V	83.1	Confident	80	Confident	58 Å²	58	59.1 Å²	59.1	35%	0.352	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-34.5	179.6	170.3	0	0	0	0	111.4	F152 N153 V159 A160	F152-V156 HydrophobicContact CD1-CG2 4.14Å; F152-V156 HydrophobicContact CD2-CG2 4.46Å; F152-V156 HydrophobicContact CE1-CG2 3.66Å; F152-V156 HydrophobicContact CE2-CG2 4Å; F152-V156 HydrophobicContact CZ-CG2 3.57Å; F152-V156 VanDerWaalsContact O-CG2 3.28Å; F152-V156 WeakPolarHBondContact O-CG2 3.26Å; F152-V156 PolarHBondContact O-N 3.39Å; N153-V156 PolarHBondContact O-N 2.76Å; V156-V159 PolarHBondContact O-N 3.37Å; V156-A160 WeakPolarHBondContact O-CB 3.37Å; V156-A160 PolarHBondContact O-N 2.99Å
157	V	79.9	Confident	79.3	Confident	75 Å²	75	55.1 Å²	55.1	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-42.4	174.8	172.8	0	0	0	0	111.2	N153 E154 F155 A160 A161	N153-V157 WeakPolarHBondContact O-CG2 3.33Å; N153-V157 PolarHBondContact O-N 3.18Å; N153-V157 VanDerWaalsContact O-N 3.1Å; E154-V157 PolarHBondContact O-N 3.09Å; F155-V157 VanDerWaalsContact C-N 3.25Å; F155-V157 PolarHBondContact O-N 3.21Å; V157-A160 PolarHBondContact O-N 2.81Å; V157-A161 WeakPolarHBondContact O-CB 2.89Å; V157-A161 PolarHBondContact O-N 2.94Å
158	L	79.6	Confident	78.5	Confident	23 Å²	23	56.7 Å²	56.7	12%	0.12	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-52.8	174.1	-176.4	68.2	0	0	0	111.3	L118 I138 L142 E154 F155 A160 A161 L162	L118-L158 HydrophobicContact CD2-CD2 3.81Å; I138-L158 HydrophobicContact CG2-CD1 4.12Å; I138-L158 HydrophobicContact CG2-CD2 4.43Å; L142-L158 HydrophobicContact CD1-CB 4.06Å; L142-L158 HydrophobicContact CD1-CD1 4.13Å; L142-L158 HydrophobicContact CD1-CD2 3.89Å; L142-L158 HydrophobicContact CD1-CG 4.21Å; L142-L158 HydrophobicContact CD2-CB 3.58Å; L142-L158 HydrophobicContact CD2-CD1 3.97Å; L142-L158 HydrophobicContact CD2-CG 4.26Å; L142-L158 HydrophobicContact CG-CB 4.44Å; L142-L158 HydrophobicContact CG-CD1 4.41Å; E154-L158 PolarHBondContact O-N 2.89Å; F155-L158 VanDerWaalsContact O-CB 3.31Å; F155-L158 WeakPolarHBondContact O-CB 3.38Å; F155-L158 PolarHBondContact O-N 3.02Å; F155-L158 VanDerWaalsContact O-N 3.13Å; L158-A160 VanDerWaalsContact C-N 3.29Å; L158-A160 PolarHBondContact O-N 2.78Å; L158-A161 WeakPolarHBondContact O-CB 3.34Å; L158-A161 PolarHBondContact O-N 2.73Å; L158-A161 VanDerWaalsContact O-N 3.14Å; L158-L162 HydrophobicContact CD1-CD1 4.45Å; L158-L162 HydrophobicContact CD2-CD1 4.37Å; L158-L162 HydrophobicContact CG-CD1 4.02Å; L158-L162 HydrophobicContact CG-CG 4.49Å; L158-L162 WeakPolarHBondContact O-CG 3.03Å; L158-L162 PolarHBondContact O-N 2.78Å
159	V	80.8	Confident	77.6	Confident	31 Å²	31	56.8 Å²	56.8	19%	0.188	33%	0.33	C	S	.	.	H	α-helix	trans	-63.3	-39.8	-175.4	176.5	0	0	0	0	110.6	L92 F155 V156 L162 T163	L92-V159 HydrophobicContact CD1-CG1 4.42Å; L92-V159 HydrophobicContact CD2-CG1 3.71Å; L92-V159 HydrophobicContact CD2-CG2 4.29Å; F155-V159 HydrophobicContact CD1-CG2 4.44Å; F155-V159 HydrophobicContact CE1-CG2 3.93Å; F155-V159 HydrophobicContact CE2-CG2 4Å; F155-V159 HydrophobicContact CZ-CG2 3.69Å; F155-V159 PolarHBondContact O-N 3.39Å; V156-V159 PolarHBondContact O-N 3.37Å; V159-L162 PolarHBondContact O-N 2.98Å; V159-T163 WeakPolarHBondContact O-CB 3.4Å; V159-T163 PolarHBondContact O-N 3.13Å; V159-T163 PolarHBondContact O-OG1 3.31Å
160	A	79.2	Confident	76.4	Confident	53 Å²	53	60.8 Å²	60.8	44%	0.438	35%	0.346	S	S	.	.	H	α-helix	trans	-60.9	-46.2	174.4	0	0	0	0	0	111.2	V156 V157 L158 L162 T163 V164	V156-A160 WeakPolarHBondContact O-CB 3.37Å; V156-A160 PolarHBondContact O-N 2.99Å; V157-A160 PolarHBondContact O-N 2.81Å; L158-A160 VanDerWaalsContact C-N 3.29Å; L158-A160 PolarHBondContact O-N 2.78Å; A160-L162 PolarHBondContact O-N 3.39Å; A160-T163 PolarHBondContact O-N 2.88Å; A160-V164 WeakPolarHBondContact O-CG2 3.49Å; A160-V164 PolarHBondContact O-N 3.44Å
161	A	73.5	Confident	75.4	Confident	60 Å²	60	65 Å²	65	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-43.4	177.6	0	0	0	0	0	112.3	V157 L158 V164 A165	V157-A161 WeakPolarHBondContact O-CB 2.89Å; V157-A161 PolarHBondContact O-N 2.94Å; L158-A161 WeakPolarHBondContact O-CB 3.34Å; L158-A161 PolarHBondContact O-N 2.73Å; L158-A161 VanDerWaalsContact O-N 3.14Å; A161-V164 PolarHBondContact O-N 2.79Å; A161-A165 WeakPolarHBondContact O-CB 3.39Å; A161-A165 PolarHBondContact O-N 3.42Å
162	L	73.1	Confident	74.1	Confident	47 Å²	47	68.7 Å²	68.7	25%	0.246	38%	0.382	C	S	.	.	H	α-helix	trans	-63.1	-42.3	175.3	-72	171.8	0	0	0	111.8	L122 L158 V159 A160 V164 A165 C166	L122-L162 HydrophobicContact CD1-CD1 3.48Å; L122-L162 VanDerWaalsContact CD1-CD1 3.48Å; L122-L162 HydrophobicContact CD2-CD1 4.21Å; L158-L162 HydrophobicContact CD1-CD1 4.45Å; L158-L162 HydrophobicContact CD2-CD1 4.37Å; L158-L162 HydrophobicContact CG-CD1 4.02Å; L158-L162 HydrophobicContact CG-CG 4.49Å; L158-L162 WeakPolarHBondContact O-CG 3.03Å; L158-L162 PolarHBondContact O-N 2.78Å; V159-L162 PolarHBondContact O-N 2.98Å; A160-L162 PolarHBondContact O-N 3.39Å; L162-V164 VanDerWaalsContact C-N 3.32Å; L162-V164 PolarHBondContact O-N 3.48Å; L162-A165 PolarHBondContact O-N 3.47Å; L162-C166 WeakPolarHBondContact O-CB 3.25Å; L162-C166 PolarHBondContact O-N 3.38Å; L162-C166 PolarHBondContact O-SG 2.99Å
163	T	76.9	Confident	72.9	Confident	88 Å²	88	70.8 Å²	70.8	54%	0.54	39%	0.393	S	S	.	.	H	α-helix	trans	-60.7	-43.3	178.1	-58.3	0	0	0	0	111.1	V159 A160 C166 N167	V159-T163 WeakPolarHBondContact O-CB 3.4Å; V159-T163 PolarHBondContact O-N 3.13Å; V159-T163 PolarHBondContact O-OG1 3.31Å; A160-T163 PolarHBondContact O-N 2.88Å; T163-C166 PolarHBondContact O-N 2.98Å; T163-N167 WeakPolarHBondContact O-CB 3.14Å; T163-N167 PolarHBondContact O-N 3.41Å
164	V	73.3	Confident	71.8	Confident	86 Å²	86	71.7 Å²	71.7	52%	0.521	40%	0.397	S	S	.	.	H	α-helix	trans	-64.3	-46.7	175.4	174.6	0	0	0	0	110.9	A160 A161 L162 C166 N167 D168	A160-V164 WeakPolarHBondContact O-CG2 3.49Å; A160-V164 PolarHBondContact O-N 3.44Å; A161-V164 PolarHBondContact O-N 2.79Å; L162-V164 VanDerWaalsContact C-N 3.32Å; L162-V164 PolarHBondContact O-N 3.48Å; V164-C166 VanDerWaalsContact C-N 3.31Å; V164-C166 PolarHBondContact O-N 3.02Å; V164-N167 WeakPolarHBondContact O-CB 3.12Å; V164-N167 PolarHBondContact O-N 3.44Å; V164-N167 VanDerWaalsContact O-N 3.14Å; V164-D168 PolarHBondContact O-N 3.4Å
165	A	67.3	Low	70.5	Confident	56 Å²	56	77.4 Å²	77.4	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-39.6	177.9	0	0	0	0	0	112.5	A161 L162 D168 F169	A161-A165 WeakPolarHBondContact O-CB 3.39Å; A161-A165 PolarHBondContact O-N 3.42Å; L162-A165 PolarHBondContact O-N 3.47Å; A165-D168 PolarHBondContact O-N 2.73Å; A165-F169 PolarHBondContact O-N 3.2Å; A165-F169 VanDerWaalsContact O-N 3.11Å
166	C	66.1	Low	69	Low	32 Å²	32	83.5 Å²	83.5	22%	0.216	46%	0.455	C	S	.	.	H	α-helix	trans	-63.3	-46.2	174.2	-67.7	0	0	0	0	111.2	F125 L162 T163 V164 D168 F169 F170	F125-C166 VanDerWaalsContact CE1-SG 3.57Å; F125-C166 WeakPolarHBondContact CZ-SG 3.43Å; L162-C166 WeakPolarHBondContact O-CB 3.25Å; L162-C166 PolarHBondContact O-N 3.38Å; L162-C166 PolarHBondContact O-SG 2.99Å; T163-C166 PolarHBondContact O-N 2.98Å; V164-C166 VanDerWaalsContact C-N 3.31Å; V164-C166 PolarHBondContact O-N 3.02Å; C166-D168 VanDerWaalsContact C-N 3.31Å; C166-D168 PolarHBondContact O-N 3.01Å; C166-F169 PolarHBondContact O-N 2.94Å; C166-F170 WeakPolarHBondContact O-CD2 3.36Å; C166-F170 PolarHBondContact O-N 2.86Å
167	N	68.7	Low	67.5	Low	85 Å²	85	84.8 Å²	84.8	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-59.3	-41.2	178.8	177.1	64.1	0	0	0	112.2	T163 V164 F170 Q171	T163-N167 WeakPolarHBondContact O-CB 3.14Å; T163-N167 PolarHBondContact O-N 3.41Å; V164-N167 WeakPolarHBondContact O-CB 3.12Å; V164-N167 PolarHBondContact O-N 3.44Å; V164-N167 VanDerWaalsContact O-N 3.14Å; N167-F170 PolarHBondContact O-N 3.42Å; N167-Q171 PolarHBondContact ND2-NE2 3.04Å; N167-Q171 WeakPolarHBondContact O-CG 3.27Å; N167-Q171 PolarHBondContact O-N 3.17Å
168	D	67.8	Low	65.7	Low	84 Å²	84	93 Å²	93	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-43.5	175.9	-71.5	-13.9	0	0	0	111.7	V164 A165 C166 F170 Q171 E172	V164-D168 PolarHBondContact O-N 3.4Å; A165-D168 PolarHBondContact O-N 2.73Å; C166-D168 VanDerWaalsContact C-N 3.31Å; C166-D168 PolarHBondContact O-N 3.01Å; D168-F170 PolarHBondContact O-N 3.41Å; D168-Q171 PolarHBondContact O-N 3.47Å; D168-E172 PolarHBondContact O-N 2.92Å
169	F	64	Low	65	Low	116 Å²	116	96.6 Å²	96.6	51%	0.509	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176	-176.6	-98.9	0	0	0	112.5	A165 C166 Q171 E172 Q173	A165-F169 PolarHBondContact O-N 3.2Å; A165-F169 VanDerWaalsContact O-N 3.11Å; C166-F169 PolarHBondContact O-N 2.94Å; F169-Q171 VanDerWaalsContact C-N 3.34Å; F169-Q171 PolarHBondContact O-N 2.78Å; F169-E172 PolarHBondContact O-N 2.94Å; F169-Q173 HydrophobicContact CD1-CG 4.09Å; F169-Q173 HydrophobicContact CE1-CG 3.8Å; F169-Q173 HydrophobicContact CZ-CG 4.12Å; F169-Q173 VanDerWaalsContact O-CG 3.31Å; F169-Q173 WeakPolarHBondContact O-CG 3.29Å; F169-Q173 PolarHBondContact O-N 2.79Å
170	F	63.1	Low	64.2	Low	143 Å²	143	100 Å²	100	63%	0.627	54%	0.538	S	S	*	.	H	α-helix	trans	-63.3	-40.1	175.7	-83.3	-68.4	0	0	0	112	C166 N167 D168 E172 Q173 N174	C166-F170 WeakPolarHBondContact O-CD2 3.36Å; C166-F170 PolarHBondContact O-N 2.86Å; N167-F170 PolarHBondContact O-N 3.42Å; D168-F170 PolarHBondContact O-N 3.41Å; F170-E172 VanDerWaalsContact C-N 3.34Å; F170-Q173 PolarHBondContact O-N 3.36Å; F170-N174 PolarHBondContact O-N 3.11Å; F170-N174 VanDerWaalsContact O-N 3.08Å
171	Q	65.6	Low	63.3	Low	88 Å²	88	102.6 Å²	102.6	41%	0.411	54%	0.543	S	S	.	.	H	α-helix	trans	-65.4	-36.2	175.8	-75.4	-176.6	59.2	0	0	112.6	N167 D168 F169 K175	N167-Q171 PolarHBondContact ND2-NE2 3.04Å; N167-Q171 WeakPolarHBondContact O-CG 3.27Å; N167-Q171 PolarHBondContact O-N 3.17Å; D168-Q171 PolarHBondContact O-N 3.47Å; F169-Q171 VanDerWaalsContact C-N 3.34Å; F169-Q171 PolarHBondContact O-N 2.78Å; Q171-K175 VanDerWaalsContact O-CG 3.31Å; Q171-K175 WeakPolarHBondContact O-CG 3.32Å; Q171-K175 PolarHBondContact O-N 2.88Å
172	E	60.8	Low	62.7	Low	121 Å²	121	105.1 Å²	105.1	57%	0.565	55%	0.546	S	S	*	.	H	α-helix	trans	-70.3	-42.4	176	-74.6	-174.4	169.2	0	0	112.6	D168 F169 F170 N174 K175 N176	D168-E172 PolarHBondContact O-N 2.92Å; F169-E172 PolarHBondContact O-N 2.94Å; F170-E172 VanDerWaalsContact C-N 3.34Å; E172-N174 VanDerWaalsContact C-N 3.32Å; E172-N174 PolarHBondContact O-N 3.35Å; E172-K175 PolarHBondContact O-N 2.89Å; E172-K175 VanDerWaalsContact O-N 3.16Å; E172-N176 PolarHBondContact O-N 2.85Å
173	Q	58.2	Low	62.1	Low	104 Å²	104	108.8 Å²	108.8	49%	0.486	57%	0.565	S	S	.	*	H	α-helix	trans	-58.5	-43.5	174.2	-72.5	-85.1	10.7	0	0	111.6	F169 F170 K175 N176 A177	F169-Q173 HydrophobicContact CD1-CG 4.09Å; F169-Q173 HydrophobicContact CE1-CG 3.8Å; F169-Q173 HydrophobicContact CZ-CG 4.12Å; F169-Q173 VanDerWaalsContact O-CG 3.31Å; F169-Q173 WeakPolarHBondContact O-CG 3.29Å; F169-Q173 PolarHBondContact O-N 2.79Å; F170-Q173 PolarHBondContact O-N 3.36Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.42Å; Q173-N176 PolarHBondContact O-N 2.77Å; Q173-A177 PolarHBondContact O-N 3.45Å; Q173-A177 VanDerWaalsContact O-N 3.16Å
174	N	58.5	Low	61.1	Low	130 Å²	130	110.1 Å²	110.1	70%	0.695	57%	0.567	S	S	*	*	H	α-helix	trans	-68	-24.8	178.9	-118.6	-9.2	0	0	0	113.4	F170 E172	F170-N174 PolarHBondContact O-N 3.11Å; F170-N174 VanDerWaalsContact O-N 3.08Å; E172-N174 VanDerWaalsContact C-N 3.32Å; E172-N174 PolarHBondContact O-N 3.35Å
175	K	56.4	Low	60.2	Low	141 Å²	141	111.9 Å²	111.9	61%	0.613	57%	0.57	S	S	*	*	H	α-helix	trans	-79.7	-34.2	174.7	-73.8	170.2	-173.5	169.8	0	112.3	Q171 E172 Q173 A177	Q171-K175 VanDerWaalsContact O-CG 3.31Å; Q171-K175 WeakPolarHBondContact O-CG 3.32Å; Q171-K175 PolarHBondContact O-N 2.88Å; E172-K175 PolarHBondContact O-N 2.89Å; E172-K175 VanDerWaalsContact O-N 3.16Å; Q173-K175 VanDerWaalsContact C-N 3.26Å; Q173-K175 PolarHBondContact O-N 3.42Å; K175-A177 VanDerWaalsContact C-N 3.34Å
176	N	52.7	Low	59.7	Low	133 Å²	133	116.2 Å²	116.2	71%	0.711	58%	0.578	S	S	*	*	H	α-helix	trans	-83.1	-8.7	179.9	-68.4	-21.2	0	0	0	113.8	E172 Q173	E172-N176 PolarHBondContact O-N 2.85Å; Q173-N176 PolarHBondContact O-N 2.77Å
177	A	52.3	Low	59.1	Low	84 Å²	84	123.2 Å²	123.2	69%	0.694	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	6.3	175.1	0	0	0	0	0	113.9	Q173 K175	Q173-A177 PolarHBondContact O-N 3.45Å; Q173-A177 VanDerWaalsContact O-N 3.16Å; K175-A177 VanDerWaalsContact C-N 3.34Å
178	K	41.8	Very low	58.3	Low	249 Å²	249	126.6 Å²	126.6	100%	1.083	62%	0.622	S	S	*	*			trans	-109.6	0	170.7	-91	-175.1	174.9	179.6	0	110.5

Retrieved 178 of 178 residues in 37.5 ms (Link to these results)

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