A0A087YCG0_POEFO Loading...

E3 ubiquitin-protein ligase RNF166

AlphaFold DB , UniProt , Accession A0A087YCG0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 245 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	32.6	Very low	39.7	Very low	240 Å²	240	104.2 Å²	104.2	100%	1.182	54%	0.539	S	S	*	.				0	81.6	0	-162	161.8	-165.4	0	0	107.6	A3	M1-A3 PolarHBondContact O-N 3.42Å
2	M	30.7	Very low	39.5	Very low	161 Å²	161	105.5 Å²	105.5	79%	0.793	56%	0.564	S	S	*	*			trans	-81.7	100.7	178.5	-74.7	-160.8	157.6	0	0	107.4	M4	M2-M4 PolarHBondContact O-N 3.07Å
3	A	34.5	Very low	39.4	Very low	52 Å²	52	107.4 Å²	107.4	43%	0.43	58%	0.582	S	S	.	*			trans	-76.2	122	-179.3	0	0	0	0	0	109.2	M1 F5	M1-A3 PolarHBondContact O-N 3.42Å; A3-F5 HydrophobicContact CB-CD1 4.07Å; A3-F5 HydrophobicContact CB-CD2 3.87Å; A3-F5 HydrophobicContact CB-CE1 3.49Å; A3-F5 VanDerWaalsContact CB-CE1 3.49Å; A3-F5 HydrophobicContact CB-CE2 3.22Å; A3-F5 HydrophobicContact CB-CG 4.3Å; A3-F5 HydrophobicContact CB-CZ 3.04Å; A3-F5 VanDerWaalsContact O-CD2 3.26Å; A3-F5 WeakPolarHBondContact O-CD2 3.49Å; A3-F5 PolarHBondContact O-N 3.2Å
4	M	40.1	Very low	39.2	Very low	181 Å²	181	112.6 Å²	112.6	89%	0.892	60%	0.601	S	S	*	*			trans	-72.3	118.2	170.6	-57	-149.2	-157	0	0	107.3	M2	M2-M4 PolarHBondContact O-N 3.07Å
5	F	38.7	Very low	38.8	Very low	72 Å²	72	119.7 Å²	119.7	32%	0.316	63%	0.625	S	S	.	*			trans	-123.1	119.4	-174.2	-66.3	-52.2	0	0	0	110.4	A3 S7 F8	A3-F5 HydrophobicContact CB-CD1 4.07Å; A3-F5 HydrophobicContact CB-CD2 3.87Å; A3-F5 HydrophobicContact CB-CE1 3.49Å; A3-F5 VanDerWaalsContact CB-CE1 3.49Å; A3-F5 HydrophobicContact CB-CE2 3.22Å; A3-F5 HydrophobicContact CB-CG 4.3Å; A3-F5 HydrophobicContact CB-CZ 3.04Å; A3-F5 VanDerWaalsContact O-CD2 3.26Å; A3-F5 WeakPolarHBondContact O-CD2 3.49Å; A3-F5 PolarHBondContact O-N 3.2Å; F5-S7 PolarHBondContact O-N 3.02Å; F5-F8 HydrophobicContact CB-CD2 4.31Å; F5-F8 HydrophobicContact CB-CE2 3.71Å; F5-F8 HydrophobicContact CB-CZ 4.22Å; F5-F8 HydrophobicContact CD1-CD2 4.31Å; F5-F8 HydrophobicContact CD1-CE1 4.43Å; F5-F8 AromaticContact CD1-CE2 3.06Å; F5-F8 HydrophobicContact CD1-CE2 3.06Å; F5-F8 AromaticContact CD1-CZ 3.12Å; F5-F8 HydrophobicContact CD1-CZ 3.12Å; F5-F8 AromaticContact CD2-CE2 3.9Å; F5-F8 HydrophobicContact CD2-CE2 3.9Å; F5-F8 AromaticContact CE1-CE2 3.36Å; F5-F8 HydrophobicContact CE1-CE2 3.36Å; F5-F8 AromaticContact CE1-CZ 3.41Å; F5-F8 HydrophobicContact CE1-CZ 3.41Å; F5-F8 VanDerWaalsContact CE1-CZ 3.41Å; F5-F8 HydrophobicContact CE2-CE2 4.15Å; F5-F8 HydrophobicContact CG-CD2 4.25Å; F5-F8 AromaticContact CG-CE2 3.31Å; F5-F8 HydrophobicContact CG-CE2 3.31Å; F5-F8 AromaticContact CG-CZ 3.84Å; F5-F8 HydrophobicContact CG-CZ 3.84Å; F5-F8 AromaticContact CZ-CE2 3.88Å; F5-F8 HydrophobicContact CZ-CE2 3.88Å; F5-F8 HydrophobicContact CZ-CZ 4.32Å
6	R	46.7	Very low	38.4	Very low	225 Å²	225	126.1 Å²	126.1	85%	0.849	64%	0.638	S	S	*	*			trans	-51.5	133.3	145.7	-77.8	178.4	152.3	-130.8	-4.2	106.9	F8	R6-F8 PolarHBondContact O-N 3.46Å
7	S	43.3	Very low	38.3	Very low	37 Å²	37	129.8 Å²	129.8	26%	0.259	65%	0.652	S	S	.	*			trans	-46	114.9	176.9	-55.3	0	0	0	0	110.5	F5 V9 L45	F5-S7 PolarHBondContact O-N 3.02Å; S7-V9 CarbonylContact C-O 3.52Å; S7-V9 WeakPolarHBondContact CB-O 3.38Å; S7-V9 PolarHBondContact O-N 3.4Å; S7-L45 WeakPolarHBondContact CB-O 3.1Å; S7-L45 WeakPolarHBondContact OG-CB 3.26Å; S7-L45 PolarHBondContact OG-O 3.36Å
8	F	50.9	Low	38.2	Very low	36 Å²	36	132.9 Å²	132.9	16%	0.158	66%	0.664	C	S	.	*	S	Bend	trans	-73.1	12.2	171.7	-62.5	-64.7	0	0	0	113.1	F5 R6 E46 R107 I122 V128 I132	F5-F8 HydrophobicContact CB-CD2 4.31Å; F5-F8 HydrophobicContact CB-CE2 3.71Å; F5-F8 HydrophobicContact CB-CZ 4.22Å; F5-F8 HydrophobicContact CD1-CD2 4.31Å; F5-F8 HydrophobicContact CD1-CE1 4.43Å; F5-F8 AromaticContact CD1-CE2 3.06Å; F5-F8 HydrophobicContact CD1-CE2 3.06Å; F5-F8 AromaticContact CD1-CZ 3.12Å; F5-F8 HydrophobicContact CD1-CZ 3.12Å; F5-F8 AromaticContact CD2-CE2 3.9Å; F5-F8 HydrophobicContact CD2-CE2 3.9Å; F5-F8 AromaticContact CE1-CE2 3.36Å; F5-F8 HydrophobicContact CE1-CE2 3.36Å; F5-F8 AromaticContact CE1-CZ 3.41Å; F5-F8 HydrophobicContact CE1-CZ 3.41Å; F5-F8 VanDerWaalsContact CE1-CZ 3.41Å; F5-F8 HydrophobicContact CE2-CE2 4.15Å; F5-F8 HydrophobicContact CG-CD2 4.25Å; F5-F8 AromaticContact CG-CE2 3.31Å; F5-F8 HydrophobicContact CG-CE2 3.31Å; F5-F8 AromaticContact CG-CZ 3.84Å; F5-F8 HydrophobicContact CG-CZ 3.84Å; F5-F8 AromaticContact CZ-CE2 3.88Å; F5-F8 HydrophobicContact CZ-CE2 3.88Å; F5-F8 HydrophobicContact CZ-CZ 4.32Å; R6-F8 PolarHBondContact O-N 3.46Å; F8-E46 WeakPolarHBondContact CD2-OE1 3.44Å; F8-R107 VanDerWaalsContact O-CG 3.23Å; F8-R107 WeakPolarHBondContact O-CG 3.39Å; F8-I122 HydrophobicContact CB-CD1 4.35Å; F8-V128 HydrophobicContact CD1-CG1 4.26Å; F8-I132 HydrophobicContact CD1-CG1 4.33Å; F8-I132 HydrophobicContact CE1-CD1 3.91Å; F8-I132 HydrophobicContact CE1-CG1 3.37Å; F8-I132 HydrophobicContact CE2-CD1 4.14Å; F8-I132 HydrophobicContact CE2-CG1 4.4Å; F8-I132 HydrophobicContact CZ-CD1 3.62Å; F8-I132 HydrophobicContact CZ-CG1 3.41Å; F8-I132 VanDerWaalsContact CZ-CG1 3.41Å
9	V	46.2	Very low	38.3	Very low	18 Å²	18	135.5 Å²	135.5	11%	0.109	67%	0.674	C	S	.	*	S	Bend	trans	-134.1	130.5	177	172.4	0	0	0	0	104.5	S7 A11 E36 V47	S7-V9 CarbonylContact C-O 3.52Å; S7-V9 WeakPolarHBondContact CB-O 3.38Å; S7-V9 PolarHBondContact O-N 3.4Å; V9-A11 PolarHBondContact O-N 3.43Å; V9-E36 HydrophobicContact CG1-CB 3.71Å; V9-E36 HydrophobicContact CG1-CG 4.24Å; V9-E36 WeakPolarHBondContact CG1-OE1 3.45Å; V9-V47 HydrophobicContact CG2-CG2 4.18Å
10	S	38.4	Very low	38.1	Very low	67 Å²	67	137.9 Å²	137.9	47%	0.469	68%	0.683	S	S	.	*			trans	-57.9	117.3	-171.5	-58.7	0	0	0	0	110.5	R107	S10-R107 VanDerWaalsContact N-NH2 3.14Å; S10-R107 VanDerWaalsContact OG-CZ 3.32Å; S10-R107 PolarHBondContact OG-NE 2.91Å; S10-R107 PolarHBondContact OG-NH2 3.17Å; S10-R107 VanDerWaalsContact OG-NH2 3.08Å
11	A	34.7	Very low	37.6	Very low	57 Å²	57	137 Å²	137	47%	0.471	69%	0.69	S	S	.	*			trans	-121.8	104.6	148.1	0	0	0	0	0	105.1	V9 T13	V9-A11 PolarHBondContact O-N 3.43Å; A11-T13 PolarHBondContact O-N 2.94Å
12	S	37.4	Very low	37.5	Very low	120 Å²	120	131.6 Å²	131.6	84%	0.839	68%	0.676	S	S	*	*			trans	-63.4	106.3	163.3	-63.6	0	0	0	0	106.2	Q14	S12-Q14 PolarHBondContact O-N 3.33Å
13	T	37.5	Very low	37.5	Very low	130 Å²	130	130 Å²	130	80%	0.798	68%	0.681	S	S	*	*			trans	-59.2	122	171.6	44.6	0	0	0	0	109.8	A11	A11-T13 PolarHBondContact O-N 2.94Å
14	Q	37.8	Very low	37.2	Very low	181 Å²	181	131.1 Å²	131.1	85%	0.846	70%	0.698	S	S	*	*			trans	-129.7	85.7	145.4	-70.1	-169.2	7.3	0	0	108.5	S12 R16	S12-Q14 PolarHBondContact O-N 3.33Å; Q14-R16 VanDerWaalsContact C-N 3.33Å; Q14-R16 PolarHBondContact O-N 3.44Å
15	F	32.4	Very low	37.3	Very low	219 Å²	219	129.2 Å²	129.2	96%	0.961	70%	0.699	S	S	*	*			trans	-75.7	97.5	141.2	-113	-89.6	0	0	0	105.2
16	R	33.2	Very low	36.8	Very low	221 Å²	221	129 Å²	129	83%	0.834	72%	0.716	S	S	*	*			trans	-132.8	119.7	160.9	-170.4	162.5	179	170.2	-2.4	107.3	Q14	Q14-R16 VanDerWaalsContact C-N 3.33Å; Q14-R16 PolarHBondContact O-N 3.44Å
17	Q	36.6	Very low	36.6	Very low	189 Å²	189	124.7 Å²	124.7	88%	0.883	72%	0.718	S	S	*	*			trans	-44.7	136.7	171	-88.8	162.3	-11.2	0	0	110.9	Q19	Q17-Q19 PolarHBondContact O-N 2.9Å
18	Q	36.7	Very low	36.1	Very low	187 Å²	187	131.1 Å²	131.1	87%	0.874	75%	0.748	S	S	*	*			trans	-55.6	124.9	170.3	-70	168.7	-4.8	0	0	110.2
19	Q	39.4	Very low	35.4	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	78%	0.781	S	S	*	*			trans	-169.1	139.5	136.4	-107.6	174.2	30.9	0	0	110.9	Q17	Q17-Q19 PolarHBondContact O-N 2.9Å
20	Q	33.8	Very low	34.9	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	81%	0.807	S	S	*	*			trans	105.2	107.2	162.8	-61.4	174.2	13	0	0	118.3
21	S	29	Very low	34.9	Very low	119 Å²	119	139.1 Å²	139.1	83%	0.832	82%	0.818	S	S	*	*			trans	-75.9	131.1	158.2	39.1	0	0	0	0	111.2
22	S	29.8	Very low	35.4	Very low	127 Å²	127	142.4 Å²	142.4	89%	0.888	83%	0.834	S	S	*	*			trans	-177.6	153.4	136.8	43.8	0	0	0	0	111.2
23	S	30.7	Very low	35.8	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	84%	0.835	S	S	*	*			trans	-76.5	148.6	-157.3	43.6	0	0	0	0	118.2
24	G	28.4	Very low	36.7	Very low	76 Å²	76	140.7 Å²	140.7	78%	0.784	81%	0.812	S	S	*	*			trans	171.3	133.3	158.9	0	0	0	0	0	113.6
25	P	41.2	Very low	37.8	Very low	141 Å²	141	134.2 Å²	134.2	92%	0.916	79%	0.785	S	S	*	*			trans	-97.9	149.7	-163.4	37.3	-32.7	0	0	0	114.5
26	G	29.7	Very low	39.1	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	74%	0.744	S	S	*	*			trans	175.2	120.3	165.8	0	0	0	0	0	112	L28	G26-L28 PolarHBondContact O-N 3.16Å
27	P	41.8	Very low	40.8	Very low	136 Å²	136	117.5 Å²	117.5	88%	0.883	73%	0.727	S	S	*	*			trans	-85.6	101.7	-176.3	32.3	-28.1	0	0	0	109.6
28	L	32.3	Very low	43.1	Very low	171 Å²	171	115.5 Å²	115.5	90%	0.895	72%	0.718	S	S	*	*			trans	-103.1	108.2	162.9	-70.1	172	0	0	0	107.5	G26 A30	G26-L28 PolarHBondContact O-N 3.16Å; L28-A30 PolarHBondContact O-N 3.42Å; L28-A30 VanDerWaalsContact O-N 3.07Å
29	A	36	Very low	45.6	Very low	102 Å²	102	107.1 Å²	107.1	84%	0.843	68%	0.679	S	S	*	*			trans	-49	113.1	176.9	0	0	0	0	0	110.3
30	A	35.7	Very low	48.2	Very low	80 Å²	80	100.6 Å²	100.6	66%	0.661	65%	0.653	S	S	*	*			trans	-61.1	136.9	172.8	0	0	0	0	0	109.4	L28	L28-A30 PolarHBondContact O-N 3.42Å; L28-A30 VanDerWaalsContact O-N 3.07Å
31	P	39.8	Very low	51	Low	107 Å²	107	91.8 Å²	91.8	70%	0.695	61%	0.612	S	S	*	*			trans	-59.6	151.6	165.3	-6.7	20.2	0	0	0	108.7	E33	P31-E33 PolarHBondContact O-N 3.03Å
32	P	43.3	Very low	54.1	Low	126 Å²	126	88.3 Å²	88.3	82%	0.818	59%	0.586	S	S	*	*			trans	-54.7	115.7	-177	23.5	-33.4	0	0	0	109.4	G34	P32-G34 PolarHBondContact O-N 3.39Å; P32-G34 VanDerWaalsContact O-N 3.09Å
33	E	46.2	Very low	57.2	Low	183 Å²	183	85.7 Å²	85.7	86%	0.855	56%	0.562	S	S	*	*			trans	-51.2	120	177.1	-61.9	-150.7	107	0	0	108.7	P31 V35	P31-E33 PolarHBondContact O-N 3.03Å; E33-V35 PolarHBondContact O-N 3.38Å; E33-V35 VanDerWaalsContact O-N 3.1Å
34	G	57.8	Low	60	Low	31 Å²	31	81 Å²	81	32%	0.32	53%	0.528	S	S	.	.			trans	-63.4	116.1	-163.7	0	0	0	0	0	111.3	P32 E36 S37	P32-G34 PolarHBondContact O-N 3.39Å; P32-G34 VanDerWaalsContact O-N 3.09Å; G34-E36 PolarHBondContact O-N 2.88Å; G34-S37 PolarHBondContact O-N 3.2Å
35	V	59.6	Low	63	Low	45 Å²	45	81.7 Å²	81.7	27%	0.273	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-24.1	165.1	63.6	0	0	0	0	112.7	E33 S37 Q38 F39 Y102	E33-V35 PolarHBondContact O-N 3.38Å; E33-V35 VanDerWaalsContact O-N 3.1Å; V35-S37 PolarHBondContact O-N 3.25Å; V35-Q38 PolarHBondContact O-N 3.39Å; V35-F39 HydrophobicContact CG2-CD2 4.26Å; V35-F39 HydrophobicContact CG2-CE2 3.75Å; V35-F39 WeakPolarHBondContact O-CD2 3.46Å; V35-Y102 HydrophobicContact CG2-CD1 3.71Å; V35-Y102 HydrophobicContact CG2-CD2 4.33Å; V35-Y102 HydrophobicContact CG2-CE1 3.81Å; V35-Y102 HydrophobicContact CG2-CE2 4.43Å; V35-Y102 HydrophobicContact CG2-CG 4Å
36	E	61.2	Low	65.3	Low	19 Å²	19	75.6 Å²	75.6	9%	0.089	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-36.1	177.5	-51.1	-174.4	98.2	0	0	113.6	V9 G34 Q38 F39 A104 R107	V9-E36 HydrophobicContact CG1-CB 3.71Å; V9-E36 HydrophobicContact CG1-CG 4.24Å; V9-E36 WeakPolarHBondContact CG1-OE1 3.45Å; G34-E36 PolarHBondContact O-N 2.88Å; E36-Q38 VanDerWaalsContact C-N 3.27Å; E36-Q38 PolarHBondContact O-N 3.19Å; E36-F39 PolarHBondContact O-N 3.33Å; E36-A104 HydrophobicContact CG-CB 3.97Å; E36-A104 VanDerWaalsContact OE1-CB 3.25Å; E36-A104 WeakPolarHBondContact OE1-CB 3.23Å; E36-R107 IonicContact OE1-NH1 3.16Å; E36-R107 IonicContact OE2-CZ 3.96Å; E36-R107 IonicContact OE2-NH1 2.85Å; E36-R107 PolarHBondContact OE2-NH1 3.11Å; E36-R107 VanDerWaalsContact OE2-NH1 3.16Å; E36-R107 IonicContact OE2-NH2 3.48Å; E36-R107 PolarHBondContact OE2-NH2 3.21Å
37	S	68.8	Low	68.3	Low	70 Å²	70	73 Å²	73	49%	0.49	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-65.4	-32.7	-177.9	-58.7	0	0	0	0	112.1	G34 V35 F39 S40	G34-S37 PolarHBondContact O-N 3.2Å; V35-S37 PolarHBondContact O-N 3.25Å; S37-F39 PolarHBondContact O-N 2.96Å; S37-S40 PolarHBondContact O-N 3.49Å; S37-S40 PolarHBondContact O-OG 2.84Å
38	Q	83.5	Confident	70.8	Confident	147 Å²	147	68 Å²	68	69%	0.687	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-70.9	-20.5	-179.8	-60.3	177.3	69.5	0	0	112.7	V35 E36	V35-Q38 PolarHBondContact O-N 3.39Å; E36-Q38 VanDerWaalsContact C-N 3.27Å; E36-Q38 PolarHBondContact O-N 3.19Å
39	F	90.7	Very high	73.7	Confident	12 Å²	12	61.9 Å²	61.9	5%	0.053	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-109.3	23	-178	-62.2	-63.5	0	0	0	113.2	V35 E36 S37 V47 Y48 Q98 L99 Y102 L115	V35-F39 HydrophobicContact CG2-CD2 4.26Å; V35-F39 HydrophobicContact CG2-CE2 3.75Å; V35-F39 WeakPolarHBondContact O-CD2 3.46Å; E36-F39 PolarHBondContact O-N 3.33Å; S37-F39 PolarHBondContact O-N 2.96Å; F39-V47 WeakPolarHBondContact O-CA 3.41Å; F39-Y48 VanDerWaalsContact C-CD2 3.45Å; F39-Y48 WeakPolarHBondContact O-CD2 3.3Å; F39-Y48 PolarHBondContact O-N 3.19Å; F39-Q98 HydrophobicContact CE1-CB 3.54Å; F39-Q98 HydrophobicContact CE1-CG 4.45Å; F39-Q98 HydrophobicContact CZ-CB 3.81Å; F39-L99 HydrophobicContact CB-CD1 4.09Å; F39-L99 HydrophobicContact CB-CG 4.43Å; F39-L99 HydrophobicContact CD1-CD1 3.49Å; F39-L99 VanDerWaalsContact CD1-CD1 3.49Å; F39-L99 HydrophobicContact CD1-CG 4.4Å; F39-L99 HydrophobicContact CE1-CD1 4.25Å; F39-L99 HydrophobicContact CG-CD1 4.01Å; F39-Y102 HydrophobicContact CD2-CD2 4.47Å; F39-Y102 AromaticContact CE2-CD2 3.46Å; F39-Y102 HydrophobicContact CE2-CD2 3.46Å; F39-Y102 VanDerWaalsContact CE2-CD2 3.46Å; F39-Y102 AromaticContact CE2-CE2 3.79Å; F39-Y102 HydrophobicContact CE2-CE2 3.79Å; F39-Y102 HydrophobicContact CE2-CG 4.16Å; F39-Y102 AromaticContact CZ-CD2 3.68Å; F39-Y102 HydrophobicContact CZ-CD2 3.68Å; F39-Y102 AromaticContact CZ-CE2 3.72Å; F39-Y102 HydrophobicContact CZ-CE2 3.72Å; F39-L115 HydrophobicContact CB-CD1 4.01Å; F39-L115 HydrophobicContact CD2-CD1 3.53Å; F39-L115 HydrophobicContact CE2-CD1 4.32Å; F39-L115 HydrophobicContact CG-CD1 3.97Å
40	S	92.2	Very high	76.5	Confident	43 Å²	43	63 Å²	63	30%	0.301	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-95.4	138.7	178.2	67.5	0	0	0	0	111.9	S37 E46 Y48	S37-S40 PolarHBondContact O-N 3.49Å; S37-S40 PolarHBondContact O-OG 2.84Å; S40-E46 CarbonylContact C-O 3.46Å; S40-E46 WeakPolarHBondContact CA-O 3.32Å; S40-Y48 WeakPolarHBondContact O-CE2 3.24Å; S40-Y48 PolarHBondContact O-OH 3.03Å; S40-Y48 VanDerWaalsContact O-OH 3.06Å
41	C	94.1	Very high	79.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.329	C	S	.	.			trans	-76.7	129.2	174.3	175.5	0	0	0	0	109.8	I43 C44 L45 E46 Y48 C62	C41-I43 PolarHBondContact O-N 3.27Å; C41-I43 VanDerWaalsContact O-N 3.17Å; C41-C44 VanDerWaalsContact CB-SG 3.57Å; C41-L45 WeakPolarHBondContact O-CA 3.49Å; C41-L45 PolarHBondContact O-N 3.02Å; C41-E46 PolarHBondContact N-O 3.34Å; C41-Y48 VanDerWaalsContact CA-CE1 3.46Å; C41-Y48 HydrophobicContact CB-CD1 3.76Å; C41-Y48 HydrophobicContact CB-CE1 3.79Å; C41-C62 WeakPolarHBondContact CB-SG 3.18Å; C41-C62 PolarHBondContact SG-N 3.16Å; C41-C62 VanDerWaalsContact SG-N 3.39Å; C41-C62 VanDerWaalsContact SG-SG 3.62Å
42	P	93.6	Very high	82.1	Confident	46 Å²	46	55.2 Å²	55.2	30%	0.299	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.8	-177.7	30.7	-39.9	0	0	0	114.1	F61 L79	P42-F61 HydrophobicContact CB-CE1 4.49Å; P42-F61 HydrophobicContact CG-CD1 3.44Å; P42-F61 VanDerWaalsContact CG-CD1 3.44Å; P42-F61 HydrophobicContact CG-CE1 3.33Å; P42-F61 HydrophobicContact CG-CZ 4.39Å; P42-L79 HydrophobicContact CB-CD1 4.16Å; P42-L79 HydrophobicContact CB-CD2 3.69Å; P42-L79 HydrophobicContact CB-CG 4.16Å; P42-L79 HydrophobicContact CG-CD1 3.81Å; P42-L79 HydrophobicContact CG-CD2 4.14Å; P42-L79 HydrophobicContact CG-CG 4.03Å
43	I	93.9	Very high	84.7	Confident	71 Å²	71	50.7 Å²	50.7	36%	0.364	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-51.9	179.5	-63.5	168.1	0	0	0	111.1	C41 F61 C65 P78	C41-I43 PolarHBondContact O-N 3.27Å; C41-I43 VanDerWaalsContact O-N 3.17Å; I43-F61 HydrophobicContact CD1-CB 4.21Å; I43-F61 HydrophobicContact CD1-CD1 3.36Å; I43-F61 HydrophobicContact CD1-CE1 3.97Å; I43-F61 HydrophobicContact CD1-CG 4Å; I43-F61 HydrophobicContact CG1-CD1 3.69Å; I43-F61 HydrophobicContact CG1-CE1 4.07Å; I43-C65 HydrophobicContact CB-CB 3.78Å; I43-C65 HydrophobicContact CD1-CB 3.72Å; I43-C65 WeakPolarHBondContact CD1-O 3.42Å; I43-C65 HydrophobicContact CG1-CB 4.34Å; I43-C65 HydrophobicContact CG2-CB 3.75Å; I43-P78 HydrophobicContact CD1-CB 4.39Å; I43-P78 HydrophobicContact CD1-CG 4.12Å; I43-P78 HydrophobicContact CG1-CB 4.43Å
44	C	91.2	Very high	87.1	Confident	28 Å²	28	42 Å²	42	19%	0.189	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-7.5	-177.8	63.6	0	0	0	0	114.2	C41 E46 C65	C41-C44 VanDerWaalsContact CB-SG 3.57Å; C44-E46 PolarHBondContact O-N 2.94Å; C44-E46 VanDerWaalsContact O-N 3.11Å; C44-C65 VanDerWaalsContact SG-SG 3.65Å
45	L	90.4	Very high	88.8	Confident	91 Å²	91	43.6 Å²	43.6	48%	0.476	24%	0.243	S	C	.	.	S	Bend	trans	57.6	22.6	-179.5	-49.4	179.8	0	0	0	114.2	S7 C41	S7-L45 WeakPolarHBondContact CB-O 3.1Å; S7-L45 WeakPolarHBondContact OG-CB 3.26Å; S7-L45 PolarHBondContact OG-O 3.36Å; C41-L45 WeakPolarHBondContact O-CA 3.49Å; C41-L45 PolarHBondContact O-N 3.02Å
46	E	89.7	Confident	90.4	Very high	14 Å²	14	44.9 Å²	44.9	7%	0.065	25%	0.254	C	S	.	.	S	Bend	trans	-113.6	167.5	175.4	-66.4	-172.8	104.9	0	0	110.6	F8 S40 C41 C44 Y48 R119	F8-E46 WeakPolarHBondContact CD2-OE1 3.44Å; S40-E46 CarbonylContact C-O 3.46Å; S40-E46 WeakPolarHBondContact CA-O 3.32Å; C41-E46 PolarHBondContact N-O 3.34Å; C44-E46 PolarHBondContact O-N 2.94Å; C44-E46 VanDerWaalsContact O-N 3.11Å; E46-Y48 PolarHBondContact O-N 2.88Å; E46-R119 VanDerWaalsContact CB-NH2 3.35Å; E46-R119 IonicContact OE2-CZ 3.67Å; E46-R119 IonicContact OE2-NH1 2.73Å; E46-R119 PolarHBondContact OE2-NH1 3.46Å; E46-R119 IonicContact OE2-NH2 3.11Å; E46-R119 PolarHBondContact OE2-NH2 3.23Å
47	V	92.1	Very high	92.1	Very high	10 Å²	10	45.7 Å²	45.7	6%	0.061	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-53.2	136.5	173	179.4	0	0	0	0	110.6	V9 F39 H49 L99 L115 M118	V9-V47 HydrophobicContact CG2-CG2 4.18Å; F39-V47 WeakPolarHBondContact O-CA 3.41Å; V47-H49 PolarHBondContact O-N 3.13Å; V47-L99 HydrophobicContact CG1-CD2 3.7Å; V47-L99 HydrophobicContact CG1-CG 4.43Å; V47-L115 HydrophobicContact CG1-CB 4.01Å; V47-L115 HydrophobicContact CG2-CD2 4.34Å; V47-M118 HydrophobicContact CG2-CG 4.48Å
48	Y	94.6	Very high	93.3	Very high	33 Å²	33	44.8 Å²	44.8	13%	0.129	26%	0.264	C	S	.	.			trans	-51.1	134.4	180	-73.6	-68.3	0	0	0	112.6	F39 S40 C41 E46 P51 T60 V95 L99	F39-Y48 VanDerWaalsContact C-CD2 3.45Å; F39-Y48 WeakPolarHBondContact O-CD2 3.3Å; F39-Y48 PolarHBondContact O-N 3.19Å; S40-Y48 WeakPolarHBondContact O-CE2 3.24Å; S40-Y48 PolarHBondContact O-OH 3.03Å; S40-Y48 VanDerWaalsContact O-OH 3.06Å; C41-Y48 VanDerWaalsContact CA-CE1 3.46Å; C41-Y48 HydrophobicContact CB-CD1 3.76Å; C41-Y48 HydrophobicContact CB-CE1 3.79Å; E46-Y48 PolarHBondContact O-N 2.88Å; Y48-P51 HydrophobicContact CD1-CB 4.19Å; Y48-P51 HydrophobicContact CG-CB 4.18Å; Y48-T60 HydrophobicContact CD1-CG2 4.33Å; Y48-T60 HydrophobicContact CE1-CG2 3.91Å; Y48-T60 WeakPolarHBondContact CE1-O 3.25Å; Y48-T60 PolarHBondContact OH-O 2.81Å; Y48-V95 HydrophobicContact CD2-CG1 3.95Å; Y48-V95 HydrophobicContact CE2-CG1 4.41Å; Y48-V95 HydrophobicContact CG-CG1 4.44Å; Y48-L99 HydrophobicContact CD2-CD1 4.39Å; Y48-L99 VanDerWaalsContact O-CD2 3.29Å; Y48-L99 WeakPolarHBondContact O-CD2 3.32Å
49	H	93.8	Very high	93.9	Very high	42 Å²	42	40.8 Å²	40.8	19%	0.194	24%	0.244	C	C	.	.	S	Bend	trans	-123	117.8	172.1	-179.5	-119.1	0	0	0	109.4	V47 C62 G63 E64 R119	V47-H49 PolarHBondContact O-N 3.13Å; H49-C62 PolarHBondContact N-SG 2.96Å; H49-C62 WeakPolarHBondContact O-CA 3.28Å; H49-C62 WeakPolarHBondContact O-CB 3.28Å; H49-G63 PolarHBondContact O-N 3.32Å; H49-E64 IonicContact CE1-OE2 3.71Å; H49-E64 PolarHBondContact CE1-OE2 3.02Å; H49-E64 IonicContact ND1-OE2 3.67Å; H49-E64 PolarHBondContact ND1-OE2 3.18Å; H49-R119 VanDerWaalsContact CB-NE 3.28Å
50	K	94.1	Very high	94.2	Very high	124 Å²	124	41.1 Å²	41.1	54%	0.539	25%	0.248	S	C	.	.	S	Bend	trans	47.3	63.6	-173.2	-59.1	175.1	-176.6	172.9	0	110.6	G63	K50-G63 PolarHBondContact O-N 3.07Å
51	P	96.1	Very high	94.4	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.019	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	138.9	-173.4	25.9	-33.8	0	0	0	111.9	Y48 T60 F61 S92 V95 E96	Y48-P51 HydrophobicContact CD1-CB 4.19Å; Y48-P51 HydrophobicContact CG-CB 4.18Å; P51-T60 HydrophobicContact CB-CG2 3.74Å; P51-F61 CarbonylContact C-O 3.48Å; P51-F61 VanDerWaalsContact CA-O 3.24Å; P51-F61 WeakPolarHBondContact CA-O 3.45Å; P51-S92 PolarHBondContact O-N 3.22Å; P51-S92 PolarHBondContact O-OG 2.95Å; P51-V95 HydrophobicContact CB-CB 4.35Å; P51-V95 HydrophobicContact CB-CG1 4.01Å; P51-V95 HydrophobicContact CG-CB 4.11Å; P51-V95 HydrophobicContact CG-CG1 3.91Å; P51-E96 HydrophobicContact CG-CG 3.59Å
52	V	97.3	Very high	94.5	Very high	22 Å²	22	39.2 Å²	39.2	13%	0.133	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.2	174.2	-63.1	0	0	0	0	109.8	T60 F61 L66 V89 E90 S92	V52-T60 CarbonylContact O-C 3.49Å; V52-T60 VanDerWaalsContact O-CA 3.31Å; V52-T60 WeakPolarHBondContact O-CA 3.44Å; V52-F61 PolarHBondContact N-O 2.87Å; V52-F61 PolarHBondContact O-N 2.85Å; V52-L66 HydrophobicContact CG2-CB 4.27Å; V52-L66 HydrophobicContact CG2-CD2 3.79Å; V52-V89 HydrophobicContact CB-CG1 3.82Å; V52-V89 HydrophobicContact CG2-CG1 3.9Å; V52-E90 CarbonylContact C-O 3.6Å; V52-E90 VanDerWaalsContact CA-O 3.22Å; V52-E90 WeakPolarHBondContact CA-O 3.48Å; V52-S92 WeakPolarHBondContact CA-OG 3.23Å
53	S	97.3	Very high	94.6	Very high	31 Å²	31	37.9 Å²	37.9	22%	0.217	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141.3	178.7	-60.3	0	0	0	0	110.4	H59 T60 E90 S92	S53-H59 WeakPolarHBondContact CA-O 3.46Å; S53-T60 PolarHBondContact OG-OG1 3.37Å; S53-E90 PolarHBondContact N-O 2.99Å; S53-E90 PolarHBondContact O-N 3.32Å; S53-E90 VanDerWaalsContact O-N 3.08Å; S53-S92 WeakPolarHBondContact CB-OG 3.21Å; S53-S92 PolarHBondContact N-OG 3.1Å; S53-S92 WeakPolarHBondContact OG-CB 3.19Å; S53-S92 PolarHBondContact OG-OG 3.42Å
54	I	96.8	Very high	94.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.4	172.1	-58.4	173.8	0	0	0	108	S56 C57 G58 H59 F61 L66 C77 F84 V89	I54-S56 VanDerWaalsContact C-N 3.27Å; I54-S56 WeakPolarHBondContact CG2-OG 3.44Å; I54-S56 PolarHBondContact O-N 3.18Å; I54-C57 PolarHBondContact O-N 3.03Å; I54-G58 WeakPolarHBondContact O-CA 3.32Å; I54-G58 PolarHBondContact O-N 3.32Å; I54-H59 PolarHBondContact N-O 3.02Å; I54-F61 HydrophobicContact CD1-CD2 4.3Å; I54-F61 HydrophobicContact CD1-CE2 3.72Å; I54-F61 HydrophobicContact CG1-CE2 4.29Å; I54-L66 HydrophobicContact CD1-CD1 4.27Å; I54-L66 HydrophobicContact CD1-CD2 4.37Å; I54-L66 HydrophobicContact CG1-CD2 4.02Å; I54-C77 HydrophobicContact CD1-CB 3.92Å; I54-F84 HydrophobicContact CD1-CD1 3.94Å; I54-F84 HydrophobicContact CD1-CE1 3.83Å; I54-F84 HydrophobicContact CD1-CE2 4.43Å; I54-F84 HydrophobicContact CD1-CG 4.27Å; I54-F84 HydrophobicContact CD1-CZ 4.1Å; I54-F84 HydrophobicContact CG1-CD2 4.44Å; I54-F84 HydrophobicContact CG1-CE2 4.46Å; I54-F84 HydrophobicContact CG2-CB 3.44Å; I54-F84 VanDerWaalsContact CG2-CB 3.44Å; I54-F84 HydrophobicContact CG2-CD1 4.17Å; I54-F84 HydrophobicContact CG2-CD2 3.84Å; I54-F84 HydrophobicContact CG2-CG 3.56Å; I54-V89 HydrophobicContact CG1-CG2 4.41Å
55	A	94.5	Very high	94.9	Very high	64 Å²	64	40.1 Å²	40.1	53%	0.529	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-30.1	-173.4	0	0	0	0	0	114.1	C57 K88	A55-C57 PolarHBondContact O-N 2.89Å; A55-K88 HydrophobicContact CB-CB 4.19Å; A55-K88 VanDerWaalsContact CB-O 3.3Å; A55-K88 WeakPolarHBondContact CB-O 3.42Å; A55-K88 PolarHBondContact N-O 3.05Å; A55-K88 VanDerWaalsContact N-O 3.09Å
56	S	93.9	Very high	95.2	Very high	72 Å²	72	35.8 Å²	35.8	50%	0.503	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-25.4	-178.3	58.1	0	0	0	0	114.2	I54 F84	I54-S56 VanDerWaalsContact C-N 3.27Å; I54-S56 WeakPolarHBondContact CG2-OG 3.44Å; I54-S56 PolarHBondContact O-N 3.18Å; S56-F84 WeakPolarHBondContact OG-CB 3.14Å
57	C	95.6	Very high	95.4	Very high	36 Å²	36	39.7 Å²	39.7	24%	0.243	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-5.8	-175.8	66.9	0	0	0	0	115	I54 A55 H59 C77	I54-C57 PolarHBondContact O-N 3.03Å; A55-C57 PolarHBondContact O-N 2.89Å; C57-H59 PolarHBondContact O-N 2.86Å; C57-H59 PolarHBondContact SG-ND1 3.08Å; C57-H59 VanDerWaalsContact SG-ND1 3.37Å; C57-C77 VanDerWaalsContact SG-SG 3.69Å
58	G	94.4	Very high	95.4	Very high	51 Å²	51	42.4 Å²	42.4	53%	0.526	25%	0.251	S	S	.	.			trans	74.9	-2.8	176.5	0	0	0	0	0	115.8	I54	I54-G58 WeakPolarHBondContact O-CA 3.32Å; I54-G58 PolarHBondContact O-N 3.32Å
59	H	96.3	Very high	95.3	Very high	62 Å²	62	42.4 Å²	42.4	29%	0.287	26%	0.256	S	S	.	.			trans	-69.2	138.8	-179.9	-69.9	108.9	0	0	0	112.1	S53 I54 C57 F61 L79 C80	S53-H59 WeakPolarHBondContact CA-O 3.46Å; I54-H59 PolarHBondContact N-O 3.02Å; C57-H59 PolarHBondContact O-N 2.86Å; C57-H59 PolarHBondContact SG-ND1 3.08Å; C57-H59 VanDerWaalsContact SG-ND1 3.37Å; H59-F61 HydrophobicContact CB-CE2 3.65Å; H59-F61 HydrophobicContact CB-CZ 3.88Å; H59-L79 HydrophobicContact CB-CD1 4.05Å; H59-L79 WeakPolarHBondContact CD2-CD1 3.29Å; H59-C80 VanDerWaalsContact CE1-SG 3.52Å; H59-C80 PolarHBondContact ND1-SG 3.45Å; H59-C80 VanDerWaalsContact ND1-SG 3.37Å
60	T	96.9	Very high	95.2	Very high	20 Å²	20	42.6 Å²	42.6	12%	0.123	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.6	-173.6	-56.3	0	0	0	0	111.5	Y48 P51 V52 S53 V95	Y48-T60 HydrophobicContact CD1-CG2 4.33Å; Y48-T60 HydrophobicContact CE1-CG2 3.91Å; Y48-T60 WeakPolarHBondContact CE1-O 3.25Å; Y48-T60 PolarHBondContact OH-O 2.81Å; P51-T60 HydrophobicContact CB-CG2 3.74Å; V52-T60 CarbonylContact O-C 3.49Å; V52-T60 VanDerWaalsContact O-CA 3.31Å; V52-T60 WeakPolarHBondContact O-CA 3.44Å; S53-T60 PolarHBondContact OG-OG1 3.37Å; T60-V95 HydrophobicContact CG2-CG2 4.29Å
61	F	96.9	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	163.6	-176.7	-55.7	-83.8	0	0	0	110.1	P42 I43 P51 V52 I54 H59 L66 P78 L79	P42-F61 HydrophobicContact CB-CE1 4.49Å; P42-F61 HydrophobicContact CG-CD1 3.44Å; P42-F61 VanDerWaalsContact CG-CD1 3.44Å; P42-F61 HydrophobicContact CG-CE1 3.33Å; P42-F61 HydrophobicContact CG-CZ 4.39Å; I43-F61 HydrophobicContact CD1-CB 4.21Å; I43-F61 HydrophobicContact CD1-CD1 3.36Å; I43-F61 HydrophobicContact CD1-CE1 3.97Å; I43-F61 HydrophobicContact CD1-CG 4Å; I43-F61 HydrophobicContact CG1-CD1 3.69Å; I43-F61 HydrophobicContact CG1-CE1 4.07Å; P51-F61 CarbonylContact C-O 3.48Å; P51-F61 VanDerWaalsContact CA-O 3.24Å; P51-F61 WeakPolarHBondContact CA-O 3.45Å; V52-F61 PolarHBondContact N-O 2.87Å; V52-F61 PolarHBondContact O-N 2.85Å; I54-F61 HydrophobicContact CD1-CD2 4.3Å; I54-F61 HydrophobicContact CD1-CE2 3.72Å; I54-F61 HydrophobicContact CG1-CE2 4.29Å; H59-F61 HydrophobicContact CB-CE2 3.65Å; H59-F61 HydrophobicContact CB-CZ 3.88Å; F61-L66 HydrophobicContact CB-CB 4.12Å; F61-L66 HydrophobicContact CD2-CD1 4.12Å; F61-L66 HydrophobicContact CD2-CD2 4.21Å; F61-L66 HydrophobicContact CE2-CD1 4.5Å; F61-L66 HydrophobicContact CG-CD1 4.47Å; F61-P78 HydrophobicContact CE1-CB 3.99Å; F61-P78 HydrophobicContact CE1-CG 4.18Å; F61-P78 HydrophobicContact CZ-CB 4.19Å; F61-P78 HydrophobicContact CZ-CG 4.19Å; F61-L79 HydrophobicContact CE1-CD1 4.11Å; F61-L79 HydrophobicContact CE1-CG 3.86Å; F61-L79 HydrophobicContact CZ-CB 4.23Å; F61-L79 HydrophobicContact CZ-CD1 3.98Å; F61-L79 HydrophobicContact CZ-CG 3.8Å
62	C	96.4	Very high	94.5	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	141.2	162.9	-59.2	0	0	0	0	109.5	C41 H49 E64 C65 L66	C41-C62 WeakPolarHBondContact CB-SG 3.18Å; C41-C62 PolarHBondContact SG-N 3.16Å; C41-C62 VanDerWaalsContact SG-N 3.39Å; C41-C62 VanDerWaalsContact SG-SG 3.62Å; H49-C62 PolarHBondContact N-SG 2.96Å; H49-C62 WeakPolarHBondContact O-CA 3.28Å; H49-C62 WeakPolarHBondContact O-CB 3.28Å; C62-E64 PolarHBondContact O-N 3.21Å; C62-C65 HydrophobicContact CB-CB 3.93Å; C62-C65 WeakPolarHBondContact O-CB 3.26Å; C62-C65 PolarHBondContact O-N 2.77Å; C62-L66 PolarHBondContact O-N 2.72Å; C62-L66 VanDerWaalsContact O-N 3.1Å
63	G	95.3	Very high	93.9	Very high	19 Å²	19	52.2 Å²	52.2	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-54	-41.9	177.6	0	0	0	0	0	113	H49 K50 C65 Q67	H49-G63 PolarHBondContact O-N 3.32Å; K50-G63 PolarHBondContact O-N 3.07Å; G63-C65 VanDerWaalsContact C-N 3.34Å; G63-C65 PolarHBondContact O-N 3.07Å; G63-Q67 WeakPolarHBondContact O-CG 3.07Å; G63-Q67 PolarHBondContact O-N 3.12Å
64	E	95.1	Very high	93.5	Very high	119 Å²	119	55.2 Å²	55.2	56%	0.556	35%	0.349	S	S	*	.	H	α-helix	trans	-70	-28.6	178.1	-63.8	174.5	99.9	0	0	113.2	H49 C62	H49-E64 IonicContact CE1-OE2 3.71Å; H49-E64 PolarHBondContact CE1-OE2 3.02Å; H49-E64 IonicContact ND1-OE2 3.67Å; H49-E64 PolarHBondContact ND1-OE2 3.18Å; C62-E64 PolarHBondContact O-N 3.21Å
65	C	95.9	Very high	93.3	Very high	26 Å²	26	55.5 Å²	55.5	18%	0.176	35%	0.351	C	S	.	.	H	α-helix	trans	-77.4	-33.4	179.2	-68.4	0	0	0	0	112.3	I43 C44 C62 G63 P68	I43-C65 HydrophobicContact CB-CB 3.78Å; I43-C65 HydrophobicContact CD1-CB 3.72Å; I43-C65 WeakPolarHBondContact CD1-O 3.42Å; I43-C65 HydrophobicContact CG1-CB 4.34Å; I43-C65 HydrophobicContact CG2-CB 3.75Å; C44-C65 VanDerWaalsContact SG-SG 3.65Å; C62-C65 HydrophobicContact CB-CB 3.93Å; C62-C65 WeakPolarHBondContact O-CB 3.26Å; C62-C65 PolarHBondContact O-N 2.77Å; G63-C65 VanDerWaalsContact C-N 3.34Å; G63-C65 PolarHBondContact O-N 3.07Å; C65-P68 WeakPolarHBondContact O-CD 3.33Å
66	L	95.8	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-82	-21.1	178.5	-171.1	62.3	0	0	0	112.8	V52 I54 F61 C62 P68 C69 L70 P78 F84 V89	V52-L66 HydrophobicContact CG2-CB 4.27Å; V52-L66 HydrophobicContact CG2-CD2 3.79Å; I54-L66 HydrophobicContact CD1-CD1 4.27Å; I54-L66 HydrophobicContact CD1-CD2 4.37Å; I54-L66 HydrophobicContact CG1-CD2 4.02Å; F61-L66 HydrophobicContact CB-CB 4.12Å; F61-L66 HydrophobicContact CD2-CD1 4.12Å; F61-L66 HydrophobicContact CD2-CD2 4.21Å; F61-L66 HydrophobicContact CE2-CD1 4.5Å; F61-L66 HydrophobicContact CG-CD1 4.47Å; C62-L66 PolarHBondContact O-N 2.72Å; C62-L66 VanDerWaalsContact O-N 3.1Å; L66-P68 VanDerWaalsContact C-CD 3.48Å; L66-C69 HydrophobicContact CD1-CB 4.08Å; L66-C69 WeakPolarHBondContact O-CB 3.38Å; L66-C69 PolarHBondContact O-N 3.49Å; L66-L70 HydrophobicContact CG-CD2 4.36Å; L66-L70 HydrophobicContact CG-CG 4.48Å; L66-L70 PolarHBondContact O-N 3.23Å; L66-P78 HydrophobicContact CD1-CG 4.16Å; L66-F84 HydrophobicContact CD1-CZ 4.29Å; L66-V89 HydrophobicContact CD2-CG1 3.74Å; L66-V89 HydrophobicContact CD2-CG2 4.25Å
67	Q	94.7	Very high	93.4	Very high	97 Å²	97	53.4 Å²	53.4	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-47.8	-46.6	-177.2	-94.3	-71.9	-53.3	0	0	115.3	G63 C69 L70	G63-Q67 WeakPolarHBondContact O-CG 3.07Å; G63-Q67 PolarHBondContact O-N 3.12Å; Q67-C69 PolarHBondContact O-N 3.4Å; Q67-L70 WeakPolarHBondContact O-CB 3.33Å; Q67-L70 PolarHBondContact O-N 2.96Å
68	P	92.6	Very high	93.3	Very high	66 Å²	66	54.3 Å²	54.3	43%	0.429	33%	0.33	S	S	.	.	H	α-helix	trans	-58.8	-36	178.6	-25.2	35.4	0	0	0	113.2	C65 L66 L70 Q71	C65-P68 WeakPolarHBondContact O-CD 3.33Å; L66-P68 VanDerWaalsContact C-CD 3.48Å; P68-L70 VanDerWaalsContact C-N 3.26Å; P68-L70 PolarHBondContact O-N 2.98Å; P68-Q71 PolarHBondContact O-N 3.35Å
69	C	91.3	Very high	93.3	Very high	34 Å²	34	56.2 Å²	56.2	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-68.3	-26.3	176.3	-58.7	0	0	0	0	111.9	L66 Q67 Q71 V72 P75	L66-C69 HydrophobicContact CD1-CB 4.08Å; L66-C69 WeakPolarHBondContact O-CB 3.38Å; L66-C69 PolarHBondContact O-N 3.49Å; Q67-C69 PolarHBondContact O-N 3.4Å; C69-Q71 PolarHBondContact O-N 3.47Å; C69-V72 WeakPolarHBondContact O-CG2 3.47Å; C69-P75 WeakPolarHBondContact O-CB 3.4Å
70	L	91.5	Very high	93.3	Very high	45 Å²	45	55.5 Å²	55.5	24%	0.236	33%	0.33	C	S	.	.	H	α-helix	trans	-75.9	-11.7	179.3	-54.4	179.1	0	0	0	113.1	L66 Q67 P68 F84 P86 V89	L66-L70 HydrophobicContact CG-CD2 4.36Å; L66-L70 HydrophobicContact CG-CG 4.48Å; L66-L70 PolarHBondContact O-N 3.23Å; Q67-L70 WeakPolarHBondContact O-CB 3.33Å; Q67-L70 PolarHBondContact O-N 2.96Å; P68-L70 VanDerWaalsContact C-N 3.26Å; P68-L70 PolarHBondContact O-N 2.98Å; L70-F84 HydrophobicContact CD2-CE2 3.58Å; L70-F84 HydrophobicContact CD2-CZ 3.89Å; L70-P86 HydrophobicContact CD2-CB 4.21Å; L70-V89 HydrophobicContact CD2-CG2 3.92Å
71	Q	89.3	Confident	93.2	Very high	157 Å²	157	64.1 Å²	64.1	73%	0.734	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.4	-178.3	-62.8	177.5	9.4	0	0	113.3	P68 C69	P68-Q71 PolarHBondContact O-N 3.35Å; C69-Q71 PolarHBondContact O-N 3.47Å
72	V	87.7	Confident	93.1	Very high	79 Å²	79	67 Å²	67	48%	0.479	38%	0.377	S	S	.	.	S	Bend	trans	-90.9	147.8	177.6	-59.6	0	0	0	0	111.5	C69 S74 P75	C69-V72 WeakPolarHBondContact O-CG2 3.47Å; V72-S74 VanDerWaalsContact C-N 3.28Å; V72-S74 PolarHBondContact O-N 3.34Å; V72-P75 HydrophobicContact CG2-CB 3.83Å
73	A	84.1	Confident	92.9	Very high	115 Å²	115	71.4 Å²	71.4	95%	0.95	41%	0.406	S	S	*	.	S	Bend	trans	-61.1	-33.9	-176.1	0	0	0	0	0	113.6
74	S	88.9	Confident	92.9	Very high	95 Å²	95	71.4 Å²	71.4	66%	0.664	40%	0.4	S	S	*	.	S	Bend	trans	-131	85.3	178.9	59	0	0	0	0	110.2	V72	V72-S74 VanDerWaalsContact C-N 3.28Å; V72-S74 PolarHBondContact O-N 3.34Å
75	P	92.1	Very high	92.8	Very high	6 Å²	6	68.9 Å²	68.9	4%	0.039	39%	0.391	C	S	.	.			trans	-79.1	141.3	-172.8	36.9	-40.9	0	0	0	112	C69 V72 P83 F84 P86	C69-P75 WeakPolarHBondContact O-CB 3.4Å; V72-P75 HydrophobicContact CG2-CB 3.83Å; P75-P83 WeakPolarHBondContact O-CA 3.41Å; P75-F84 HydrophobicContact CB-CD1 4.34Å; P75-F84 HydrophobicContact CB-CE1 3.76Å; P75-F84 HydrophobicContact CB-CE2 4.31Å; P75-F84 HydrophobicContact CB-CZ 3.74Å; P75-F84 HydrophobicContact CG-CD1 4.36Å; P75-F84 HydrophobicContact CG-CD2 4.35Å; P75-F84 HydrophobicContact CG-CE1 4.17Å; P75-F84 HydrophobicContact CG-CE2 4.14Å; P75-F84 HydrophobicContact CG-CG 4.45Å; P75-F84 HydrophobicContact CG-CZ 4.06Å; P75-F84 WeakPolarHBondContact CG-O 3.35Å; P75-F84 PolarHBondContact O-N 3.42Å; P75-F84 VanDerWaalsContact O-N 3.14Å; P75-P86 HydrophobicContact CG-CG 3.92Å
76	L	94.4	Very high	92.7	Very high	90 Å²	90	70 Å²	70	47%	0.471	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-113.5	142.2	176.3	-56	-178.8	0	0	0	109.7	P78 P83	L76-P78 WeakPolarHBondContact O-CD 3.1Å; L76-P83 HydrophobicContact CD2-CB 3.96Å; L76-P83 HydrophobicContact CD2-CG 3.69Å
77	C	95.5	Very high	92.5	Very high	2 Å²	2	79.1 Å²	79.1	1%	0.014	44%	0.437	C	S	.	.			trans	-60	128.6	175	175.8	0	0	0	0	110.6	I54 C57 L79 C80 R81 V82 F84	I54-C77 HydrophobicContact CD1-CB 3.92Å; C57-C77 VanDerWaalsContact SG-SG 3.69Å; C77-L79 PolarHBondContact O-N 3.13Å; C77-L79 VanDerWaalsContact O-N 3.12Å; C77-L79 PolarHBondContact SG-N 2.88Å; C77-C80 VanDerWaalsContact CB-SG 3.57Å; C77-R81 WeakPolarHBondContact O-CA 3.25Å; C77-R81 PolarHBondContact O-N 3.05Å; C77-V82 PolarHBondContact N-O 3.43Å; C77-F84 HydrophobicContact CB-CD1 4.5Å
78	P	94.6	Very high	92.4	Very high	56 Å²	56	80.5 Å²	80.5	36%	0.364	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21	179.8	-27.5	36.7	0	0	0	115	I43 F61 L66 L76	I43-P78 HydrophobicContact CD1-CB 4.39Å; I43-P78 HydrophobicContact CD1-CG 4.12Å; I43-P78 HydrophobicContact CG1-CB 4.43Å; F61-P78 HydrophobicContact CE1-CB 3.99Å; F61-P78 HydrophobicContact CE1-CG 4.18Å; F61-P78 HydrophobicContact CZ-CB 4.19Å; F61-P78 HydrophobicContact CZ-CG 4.19Å; L66-P78 HydrophobicContact CD1-CG 4.16Å; L76-P78 WeakPolarHBondContact O-CD 3.1Å
79	L	94.5	Very high	92.6	Very high	90 Å²	90	78.8 Å²	78.8	47%	0.471	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-53	-179.8	-78.4	-178.8	0	0	0	113.2	P42 H59 F61 C77	P42-L79 HydrophobicContact CB-CD1 4.16Å; P42-L79 HydrophobicContact CB-CD2 3.69Å; P42-L79 HydrophobicContact CB-CG 4.16Å; P42-L79 HydrophobicContact CG-CD1 3.81Å; P42-L79 HydrophobicContact CG-CD2 4.14Å; P42-L79 HydrophobicContact CG-CG 4.03Å; H59-L79 HydrophobicContact CB-CD1 4.05Å; H59-L79 WeakPolarHBondContact CD2-CD1 3.29Å; F61-L79 HydrophobicContact CE1-CD1 4.11Å; F61-L79 HydrophobicContact CE1-CG 3.86Å; F61-L79 HydrophobicContact CZ-CB 4.23Å; F61-L79 HydrophobicContact CZ-CD1 3.98Å; F61-L79 HydrophobicContact CZ-CG 3.8Å; C77-L79 PolarHBondContact O-N 3.13Å; C77-L79 VanDerWaalsContact O-N 3.12Å; C77-L79 PolarHBondContact SG-N 2.88Å
80	C	95.5	Very high	92.8	Very high	48 Å²	48	83.5 Å²	83.5	32%	0.324	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-0.2	-172.7	62.9	0	0	0	0	114.2	H59 C77 V82	H59-C80 VanDerWaalsContact CE1-SG 3.52Å; H59-C80 PolarHBondContact ND1-SG 3.45Å; H59-C80 VanDerWaalsContact ND1-SG 3.37Å; C77-C80 VanDerWaalsContact CB-SG 3.57Å; C80-V82 HydrophobicContact CB-CG2 4.2Å; C80-V82 PolarHBondContact O-N 3.36Å; C80-V82 VanDerWaalsContact SG-CG2 3.54Å
81	R	94.7	Very high	93	Very high	200 Å²	200	89 Å²	89	76%	0.755	47%	0.466	S	S	*	.			trans	57.8	10.3	-177.5	-53.3	-175.3	-177.8	-162.9	1.2	115.4	C77	C77-R81 WeakPolarHBondContact O-CA 3.25Å; C77-R81 PolarHBondContact O-N 3.05Å
82	V	94.8	Very high	93.3	Very high	61 Å²	61	82 Å²	82	37%	0.37	44%	0.435	S	S	.	.			trans	-65.9	129	175.1	174.8	0	0	0	0	109.4	C77 C80	C77-V82 PolarHBondContact N-O 3.43Å; C80-V82 HydrophobicContact CB-CG2 4.2Å; C80-V82 PolarHBondContact O-N 3.36Å; C80-V82 VanDerWaalsContact SG-CG2 3.54Å
83	P	93.6	Very high	93.6	Very high	94 Å²	94	81.5 Å²	81.5	61%	0.61	44%	0.435	S	S	*	.	B	Isolated β-bridge	trans	-58.9	142.4	172.6	-20.9	30.9	0	0	0	111.5	P75 L76	P75-P83 WeakPolarHBondContact O-CA 3.41Å; L76-P83 HydrophobicContact CD2-CB 3.96Å; L76-P83 HydrophobicContact CD2-CG 3.69Å
84	F	94.6	Very high	94	Very high	19 Å²	19	81.1 Å²	81.1	8%	0.083	42%	0.417	C	S	.	.			trans	-140.6	162.2	178	71.3	-87.4	0	0	0	112.4	I54 S56 L66 L70 P75 C77 V89	I54-F84 HydrophobicContact CD1-CD1 3.94Å; I54-F84 HydrophobicContact CD1-CE1 3.83Å; I54-F84 HydrophobicContact CD1-CE2 4.43Å; I54-F84 HydrophobicContact CD1-CG 4.27Å; I54-F84 HydrophobicContact CD1-CZ 4.1Å; I54-F84 HydrophobicContact CG1-CD2 4.44Å; I54-F84 HydrophobicContact CG1-CE2 4.46Å; I54-F84 HydrophobicContact CG2-CB 3.44Å; I54-F84 VanDerWaalsContact CG2-CB 3.44Å; I54-F84 HydrophobicContact CG2-CD1 4.17Å; I54-F84 HydrophobicContact CG2-CD2 3.84Å; I54-F84 HydrophobicContact CG2-CG 3.56Å; S56-F84 WeakPolarHBondContact OG-CB 3.14Å; L66-F84 HydrophobicContact CD1-CZ 4.29Å; L70-F84 HydrophobicContact CD2-CE2 3.58Å; L70-F84 HydrophobicContact CD2-CZ 3.89Å; P75-F84 HydrophobicContact CB-CD1 4.34Å; P75-F84 HydrophobicContact CB-CE1 3.76Å; P75-F84 HydrophobicContact CB-CE2 4.31Å; P75-F84 HydrophobicContact CB-CZ 3.74Å; P75-F84 HydrophobicContact CG-CD1 4.36Å; P75-F84 HydrophobicContact CG-CD2 4.35Å; P75-F84 HydrophobicContact CG-CE1 4.17Å; P75-F84 HydrophobicContact CG-CE2 4.14Å; P75-F84 HydrophobicContact CG-CG 4.45Å; P75-F84 HydrophobicContact CG-CZ 4.06Å; P75-F84 WeakPolarHBondContact CG-O 3.35Å; P75-F84 PolarHBondContact O-N 3.42Å; P75-F84 VanDerWaalsContact O-N 3.14Å; C77-F84 HydrophobicContact CB-CD1 4.5Å; F84-V89 HydrophobicContact CD2-CG2 3.87Å; F84-V89 HydrophobicContact CE2-CG2 3.55Å
85	D	93.5	Very high	94.2	Very high	66 Å²	66	77.7 Å²	77.7	35%	0.353	39%	0.392	S	S	.	.			trans	-89.3	121.6	174.7	-180	-9.1	0	0	0	109	K87 K88	D85-K87 PolarHBondContact O-N 3.05Å; D85-K87 WeakPolarHBondContact OD1-CB 3.16Å; D85-K87 PolarHBondContact OD1-N 3.23Å; D85-K88 HydrophobicContact CB-CB 4.23Å; D85-K88 HydrophobicContact CB-CD 4.02Å; D85-K88 HydrophobicContact CB-CG 3.92Å; D85-K88 PolarHBondContact O-N 2.92Å
86	P	92.8	Very high	94.2	Very high	51 Å²	51	80 Å²	80	33%	0.331	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-51.3	-30.2	176.3	-22.6	26.9	0	0	0	114.2	L70 P75 K88	L70-P86 HydrophobicContact CD2-CB 4.21Å; P75-P86 HydrophobicContact CG-CG 3.92Å; P86-K88 VanDerWaalsContact C-N 3.28Å; P86-K88 PolarHBondContact O-N 2.98Å
87	K	92.1	Very high	94.2	Very high	190 Å²	190	82.7 Å²	82.7	83%	0.826	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-75.3	-17.1	180	-62.2	179.8	-179	177.7	0	113.1	D85 V89	D85-K87 PolarHBondContact O-N 3.05Å; D85-K87 WeakPolarHBondContact OD1-CB 3.16Å; D85-K87 PolarHBondContact OD1-N 3.23Å; K87-V89 VanDerWaalsContact C-N 3.32Å
88	K	93.4	Very high	94.1	Very high	126 Å²	126	86.3 Å²	86.3	55%	0.548	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-98.7	27.5	179.5	-60	-174.4	-175.9	-178.8	0	112.5	A55 D85 P86	A55-K88 HydrophobicContact CB-CB 4.19Å; A55-K88 VanDerWaalsContact CB-O 3.3Å; A55-K88 WeakPolarHBondContact CB-O 3.42Å; A55-K88 PolarHBondContact N-O 3.05Å; A55-K88 VanDerWaalsContact N-O 3.09Å; D85-K88 HydrophobicContact CB-CB 4.23Å; D85-K88 HydrophobicContact CB-CD 4.02Å; D85-K88 HydrophobicContact CB-CG 3.92Å; D85-K88 PolarHBondContact O-N 2.92Å; P86-K88 VanDerWaalsContact C-N 3.28Å; P86-K88 PolarHBondContact O-N 2.98Å
89	V	95.8	Very high	93.9	Very high	30 Å²	30	83.9 Å²	83.9	18%	0.182	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	115.9	171.2	176.7	0	0	0	0	107.8	V52 I54 L66 L70 F84 K87	V52-V89 HydrophobicContact CB-CG1 3.82Å; V52-V89 HydrophobicContact CG2-CG1 3.9Å; I54-V89 HydrophobicContact CG1-CG2 4.41Å; L66-V89 HydrophobicContact CD2-CG1 3.74Å; L66-V89 HydrophobicContact CD2-CG2 4.25Å; L70-V89 HydrophobicContact CD2-CG2 3.92Å; F84-V89 HydrophobicContact CD2-CG2 3.87Å; F84-V89 HydrophobicContact CE2-CG2 3.55Å; K87-V89 VanDerWaalsContact C-N 3.32Å
90	E	95.7	Very high	93.8	Very high	133 Å²	133	82 Å²	82	62%	0.621	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	156.8	-171.7	-63	-167.9	119.4	0	0	111.6	V52 S53 S92	V52-E90 CarbonylContact C-O 3.6Å; V52-E90 VanDerWaalsContact CA-O 3.22Å; V52-E90 WeakPolarHBondContact CA-O 3.48Å; S53-E90 PolarHBondContact N-O 2.99Å; S53-E90 PolarHBondContact O-N 3.32Å; S53-E90 VanDerWaalsContact O-N 3.08Å; E90-S92 PolarHBondContact O-N 3.49Å
91	R	96.1	Very high	93.6	Very high	160 Å²	160	84.2 Å²	84.2	60%	0.604	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.4	176.9	-65.9	-178.4	65.8	114	3.6	110.8	S93 E96	R91-S93 PolarHBondContact O-N 3.4Å; R91-E96 IonicContact CZ-OE1 2.73Å; R91-E96 IonicContact NE-OE1 3.49Å; R91-E96 IonicContact NH2-OE1 3.98Å; R91-E96 PolarHBondContact NH2-OE1 2.73Å; R91-E96 IonicContact NH2-OE2 2.74Å
92	S	95.2	Very high	93.4	Very high	10 Å²	10	79.8 Å²	79.8	7%	0.07	41%	0.409	C	S	.	.			trans	-85.6	74.8	-178.3	-41.9	0	0	0	0	111.3	P51 V52 S53 E90 N94 V95 E96	P51-S92 PolarHBondContact O-N 3.22Å; P51-S92 PolarHBondContact O-OG 2.95Å; V52-S92 WeakPolarHBondContact CA-OG 3.23Å; S53-S92 WeakPolarHBondContact CB-OG 3.21Å; S53-S92 PolarHBondContact N-OG 3.1Å; S53-S92 WeakPolarHBondContact OG-CB 3.19Å; S53-S92 PolarHBondContact OG-OG 3.42Å; E90-S92 PolarHBondContact O-N 3.49Å; S92-N94 PolarHBondContact O-N 2.9Å; S92-V95 PolarHBondContact O-N 3.09Å; S92-E96 PolarHBondContact O-N 2.96Å
93	S	93.6	Very high	93.2	Very high	70 Å²	70	84.3 Å²	84.3	49%	0.49	42%	0.423	S	S	.	.	H	α-helix	trans	-58.7	-31.5	-176.9	63.7	0	0	0	0	113.8	R91 K97	R91-S93 PolarHBondContact O-N 3.4Å; S93-K97 VanDerWaalsContact O-CG 3.28Å; S93-K97 WeakPolarHBondContact O-CG 3.49Å; S93-K97 PolarHBondContact O-N 3.23Å
94	N	93.1	Very high	93	Very high	107 Å²	107	80 Å²	80	57%	0.572	40%	0.396	S	S	*	.	H	α-helix	trans	-62.7	-50.3	173.4	-172.9	-7.8	0	0	0	111.1	S92 E96 K97 Q98	S92-N94 PolarHBondContact O-N 2.9Å; N94-E96 VanDerWaalsContact C-N 3.33Å; N94-E96 PolarHBondContact O-N 2.73Å; N94-K97 WeakPolarHBondContact O-CB 3.16Å; N94-K97 PolarHBondContact O-N 2.92Å; N94-K97 VanDerWaalsContact O-N 3.14Å; N94-Q98 WeakPolarHBondContact O-CG 3.47Å; N94-Q98 PolarHBondContact O-N 3.11Å
95	V	92.8	Very high	92.8	Very high	22 Å²	22	81.8 Å²	81.8	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-41.3	179.2	-178.9	0	0	0	0	110.6	Y48 P51 T60 S92 K97 Q98 L99	Y48-V95 HydrophobicContact CD2-CG1 3.95Å; Y48-V95 HydrophobicContact CE2-CG1 4.41Å; Y48-V95 HydrophobicContact CG-CG1 4.44Å; P51-V95 HydrophobicContact CB-CB 4.35Å; P51-V95 HydrophobicContact CB-CG1 4.01Å; P51-V95 HydrophobicContact CG-CB 4.11Å; P51-V95 HydrophobicContact CG-CG1 3.91Å; T60-V95 HydrophobicContact CG2-CG2 4.29Å; S92-V95 PolarHBondContact O-N 3.09Å; V95-K97 PolarHBondContact O-N 3.24Å; V95-Q98 PolarHBondContact O-N 2.93Å; V95-L99 HydrophobicContact CG1-CD1 3.57Å; V95-L99 WeakPolarHBondContact O-CD1 3.4Å; V95-L99 PolarHBondContact O-N 2.73Å
96	E	92.9	Very high	92.5	Very high	56 Å²	56	78.9 Å²	78.9	26%	0.262	39%	0.394	S	S	.	.	H	α-helix	trans	-58.5	-44	174.2	-69.1	-175	141.2	0	0	112.6	P51 R91 S92 N94 L99 A100	P51-E96 HydrophobicContact CG-CG 3.59Å; R91-E96 IonicContact CZ-OE1 2.73Å; R91-E96 IonicContact NE-OE1 3.49Å; R91-E96 IonicContact NH2-OE1 3.98Å; R91-E96 PolarHBondContact NH2-OE1 2.73Å; R91-E96 IonicContact NH2-OE2 2.74Å; S92-E96 PolarHBondContact O-N 2.96Å; N94-E96 VanDerWaalsContact C-N 3.33Å; N94-E96 PolarHBondContact O-N 2.73Å; E96-L99 PolarHBondContact O-N 2.79Å; E96-A100 PolarHBondContact O-N 3.42Å; E96-A100 VanDerWaalsContact O-N 3.11Å
97	K	93.8	Very high	92.1	Very high	145 Å²	145	80.7 Å²	80.7	63%	0.63	39%	0.394	S	S	*	.	H	α-helix	trans	-64.1	-43	176	-72.2	171.3	-175.8	178.3	0	111.5	S93 N94 V95 A100 S101	S93-K97 VanDerWaalsContact O-CG 3.28Å; S93-K97 WeakPolarHBondContact O-CG 3.49Å; S93-K97 PolarHBondContact O-N 3.23Å; N94-K97 WeakPolarHBondContact O-CB 3.16Å; N94-K97 PolarHBondContact O-N 2.92Å; N94-K97 VanDerWaalsContact O-N 3.14Å; V95-K97 PolarHBondContact O-N 3.24Å; K97-A100 WeakPolarHBondContact O-CB 3.4Å; K97-A100 PolarHBondContact O-N 3.17Å; K97-A100 VanDerWaalsContact O-N 3.13Å; K97-S101 PolarHBondContact O-N 3.38Å; K97-S101 PolarHBondContact O-OG 2.78Å
98	Q	92.4	Very high	91.8	Very high	79 Å²	79	72.4 Å²	72.4	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-45.2	177.5	-69.4	-174.5	-58.3	0	0	111.5	F39 N94 V95 A100 S101 Y102	F39-Q98 HydrophobicContact CE1-CB 3.54Å; F39-Q98 HydrophobicContact CE1-CG 4.45Å; F39-Q98 HydrophobicContact CZ-CB 3.81Å; N94-Q98 WeakPolarHBondContact O-CG 3.47Å; N94-Q98 PolarHBondContact O-N 3.11Å; V95-Q98 PolarHBondContact O-N 2.93Å; Q98-A100 PolarHBondContact O-N 3.05Å; Q98-S101 PolarHBondContact O-N 3.35Å; Q98-Y102 WeakPolarHBondContact O-CD2 3.42Å; Q98-Y102 PolarHBondContact O-N 3.43Å
99	L	92	Very high	91.6	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-32	174.6	-91.2	78.7	0	0	0	112.3	F39 V47 Y48 V95 E96 S114 L115 V116	F39-L99 HydrophobicContact CB-CD1 4.09Å; F39-L99 HydrophobicContact CB-CG 4.43Å; F39-L99 HydrophobicContact CD1-CD1 3.49Å; F39-L99 VanDerWaalsContact CD1-CD1 3.49Å; F39-L99 HydrophobicContact CD1-CG 4.4Å; F39-L99 HydrophobicContact CE1-CD1 4.25Å; F39-L99 HydrophobicContact CG-CD1 4.01Å; V47-L99 HydrophobicContact CG1-CD2 3.7Å; V47-L99 HydrophobicContact CG1-CG 4.43Å; Y48-L99 HydrophobicContact CD2-CD1 4.39Å; Y48-L99 VanDerWaalsContact O-CD2 3.29Å; Y48-L99 WeakPolarHBondContact O-CD2 3.32Å; V95-L99 HydrophobicContact CG1-CD1 3.57Å; V95-L99 WeakPolarHBondContact O-CD1 3.4Å; V95-L99 PolarHBondContact O-N 2.73Å; E96-L99 PolarHBondContact O-N 2.79Å; L99-S114 PolarHBondContact O-OG 3.32Å; L99-L115 HydrophobicContact CB-CB 4.08Å; L99-L115 HydrophobicContact CD2-CB 4.34Å; L99-L115 HydrophobicContact CG-CB 3.94Å; L99-L115 WeakPolarHBondContact O-CB 3.21Å; L99-L115 PolarHBondContact O-N 2.98Å; L99-V116 VanDerWaalsContact C-CG2 3.49Å; L99-V116 HydrophobicContact CB-CG2 3.5Å; L99-V116 PolarHBondContact O-N 3.39Å
100	A	92.1	Very high	91.3	Very high	52 Å²	52	71.8 Å²	71.8	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-71	-37.3	-178.8	0	0	0	0	0	111.5	E96 K97 Q98 S114 V116	E96-A100 PolarHBondContact O-N 3.42Å; E96-A100 VanDerWaalsContact O-N 3.11Å; K97-A100 WeakPolarHBondContact O-CB 3.4Å; K97-A100 PolarHBondContact O-N 3.17Å; K97-A100 VanDerWaalsContact O-N 3.13Å; Q98-A100 PolarHBondContact O-N 3.05Å; A100-S114 PolarHBondContact O-OG 3.27Å; A100-V116 HydrophobicContact CB-CG2 3.89Å; A100-V116 VanDerWaalsContact N-CG2 3.34Å
101	S	91.4	Very high	91	Very high	94 Å²	94	72.3 Å²	72.3	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-70.3	-36.4	-178.8	-60.7	0	0	0	0	113.2	K97 Q98	K97-S101 PolarHBondContact O-N 3.38Å; K97-S101 PolarHBondContact O-OG 2.78Å; Q98-S101 PolarHBondContact O-N 3.35Å
102	Y	89.9	Confident	90.8	Very high	107 Å²	107	72.9 Å²	72.9	42%	0.42	38%	0.382	S	S	.	.			trans	-88.4	141.5	-176.7	-69.1	-74	0	0	0	112.9	V35 F39 Q98 S114 L115	V35-Y102 HydrophobicContact CG2-CD1 3.71Å; V35-Y102 HydrophobicContact CG2-CD2 4.33Å; V35-Y102 HydrophobicContact CG2-CE1 3.81Å; V35-Y102 HydrophobicContact CG2-CE2 4.43Å; V35-Y102 HydrophobicContact CG2-CG 4Å; F39-Y102 HydrophobicContact CD2-CD2 4.47Å; F39-Y102 AromaticContact CE2-CD2 3.46Å; F39-Y102 HydrophobicContact CE2-CD2 3.46Å; F39-Y102 VanDerWaalsContact CE2-CD2 3.46Å; F39-Y102 AromaticContact CE2-CE2 3.79Å; F39-Y102 HydrophobicContact CE2-CE2 3.79Å; F39-Y102 HydrophobicContact CE2-CG 4.16Å; F39-Y102 AromaticContact CZ-CD2 3.68Å; F39-Y102 HydrophobicContact CZ-CD2 3.68Å; F39-Y102 AromaticContact CZ-CE2 3.72Å; F39-Y102 HydrophobicContact CZ-CE2 3.72Å; Q98-Y102 WeakPolarHBondContact O-CD2 3.42Å; Q98-Y102 PolarHBondContact O-N 3.43Å; Y102-S114 WeakPolarHBondContact O-CA 3.36Å; Y102-L115 PolarHBondContact O-N 3.25Å
103	K	91.3	Very high	90.6	Very high	155 Å²	155	73.3 Å²	73.3	67%	0.674	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.2	173.9	-62	179.5	-176.8	176.1	0	109.2	V113	K103-V113 WeakPolarHBondContact CA-O 3.48Å
104	A	88.3	Confident	90.6	Very high	4 Å²	4	71.1 Å²	71.1	3%	0.033	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.1	178.1	0	0	0	0	0	111	E36 K112 V113 L115 M118	E36-A104 HydrophobicContact CG-CB 3.97Å; E36-A104 VanDerWaalsContact OE1-CB 3.25Å; E36-A104 WeakPolarHBondContact OE1-CB 3.23Å; A104-K112 WeakPolarHBondContact O-CA 3.07Å; A104-V113 PolarHBondContact N-O 3.44Å; A104-V113 PolarHBondContact O-N 3.2Å; A104-L115 HydrophobicContact CB-CD2 3.75Å; A104-M118 HydrophobicContact CB-CE 4.14Å; A104-M118 VanDerWaalsContact O-CE 3.32Å; A104-M118 WeakPolarHBondContact O-CE 3.42Å
105	P	89.9	Confident	90.5	Very high	57 Å²	57	66.1 Å²	66.1	37%	0.37	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133	176.2	30.3	-32.8	0	0	0	111.5	K111	P105-K111 WeakPolarHBondContact CA-O 3.2Å
106	C	88.8	Confident	90.4	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.034	36%	0.356	C	S	.	.			trans	-61.2	134.5	169.7	174.4	0	0	0	0	111	G108 S110 K111 M118 H121 V128	C106-G108 VanDerWaalsContact C-N 3.29Å; C106-G108 PolarHBondContact O-N 2.83Å; C106-G108 PolarHBondContact SG-N 3.19Å; C106-G108 VanDerWaalsContact SG-N 3.37Å; C106-S110 WeakPolarHBondContact O-CA 3.43Å; C106-S110 PolarHBondContact O-N 3.2Å; C106-K111 PolarHBondContact N-O 3.47Å; C106-M118 HydrophobicContact CB-SD 4.49Å; C106-H121 WeakPolarHBondContact CB-NE2 3.5Å; C106-H121 PolarHBondContact SG-NE2 3.13Å; C106-V128 WeakPolarHBondContact SG-CG2 3.31Å
107	R	83.4	Confident	90.3	Very high	89 Å²	89	72.5 Å²	72.5	34%	0.336	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.6	178.8	-69	-67.1	-172.7	-88.9	-1.2	114.8	F8 S10 E36	F8-R107 VanDerWaalsContact O-CG 3.23Å; F8-R107 WeakPolarHBondContact O-CG 3.39Å; S10-R107 VanDerWaalsContact N-NH2 3.14Å; S10-R107 VanDerWaalsContact OG-CZ 3.32Å; S10-R107 PolarHBondContact OG-NE 2.91Å; S10-R107 PolarHBondContact OG-NH2 3.17Å; S10-R107 VanDerWaalsContact OG-NH2 3.08Å; E36-R107 IonicContact OE1-NH1 3.16Å; E36-R107 IonicContact OE2-CZ 3.96Å; E36-R107 IonicContact OE2-NH1 2.85Å; E36-R107 PolarHBondContact OE2-NH1 3.11Å; E36-R107 VanDerWaalsContact OE2-NH1 3.16Å; E36-R107 IonicContact OE2-NH2 3.48Å; E36-R107 PolarHBondContact OE2-NH2 3.21Å
108	G	86.1	Confident	90.2	Very high	15 Å²	15	65.6 Å²	65.6	16%	0.155	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-51.8	178.2	0	0	0	0	0	113.4	C106 K127	C106-G108 VanDerWaalsContact C-N 3.29Å; C106-G108 PolarHBondContact O-N 2.83Å; C106-G108 PolarHBondContact SG-N 3.19Å; C106-G108 VanDerWaalsContact SG-N 3.37Å; G108-K127 VanDerWaalsContact O-CB 3.26Å; G108-K127 WeakPolarHBondContact O-CB 3.24Å
109	C	89.9	Confident	90	Very high	51 Å²	51	64.9 Å²	64.9	35%	0.345	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-0.6	-173.8	74.5	0	0	0	0	114.9	K111 H121 C125 K127	C109-K111 PolarHBondContact O-N 3.31Å; C109-K111 VanDerWaalsContact SG-CB 3.5Å; C109-H121 PolarHBondContact SG-CE1 3.48Å; C109-H121 PolarHBondContact SG-NE2 3.36Å; C109-C125 VanDerWaalsContact SG-SG 3.69Å; C109-K127 HydrophobicContact CB-CB 4.37Å; C109-K127 HydrophobicContact CB-CG 4.35Å
110	S	88.6	Confident	90	Very high	93 Å²	93	68.1 Å²	68.1	65%	0.65	36%	0.36	S	S	*	.			trans	59.9	6	-178.4	-57.4	0	0	0	0	116.1	C106 K112	C106-S110 WeakPolarHBondContact O-CA 3.43Å; C106-S110 PolarHBondContact O-N 3.2Å; S110-K112 PolarHBondContact O-N 3.35Å
111	K	89.8	Confident	89.9	Confident	143 Å²	143	67.2 Å²	67.2	62%	0.622	35%	0.346	S	S	*	.			trans	-67.4	132.6	177	-166	171.5	-169.8	172.8	0	110.4	P105 C106 C109 V113	P105-K111 WeakPolarHBondContact CA-O 3.2Å; C106-K111 PolarHBondContact N-O 3.47Å; C109-K111 PolarHBondContact O-N 3.31Å; C109-K111 VanDerWaalsContact SG-CB 3.5Å; K111-V113 HydrophobicContact CB-CG2 4.42Å; K111-V113 HydrophobicContact CG-CG2 4.39Å; K111-V113 PolarHBondContact O-N 3.23Å
112	K	92	Very high	89.9	Confident	173 Å²	173	63.6 Å²	63.6	75%	0.752	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	114.5	173.3	-67.9	-174.9	180	179.4	0	109.8	A104 S110	A104-K112 WeakPolarHBondContact O-CA 3.07Å; S110-K112 PolarHBondContact O-N 3.35Å
113	V	91	Very high	89.8	Confident	19 Å²	19	63 Å²	63	12%	0.115	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.8	-178.5	-174.6	0	0	0	0	109.2	K103 A104 K111 K117 M118 H121	K103-V113 WeakPolarHBondContact CA-O 3.48Å; A104-V113 PolarHBondContact N-O 3.44Å; A104-V113 PolarHBondContact O-N 3.2Å; K111-V113 HydrophobicContact CB-CG2 4.42Å; K111-V113 HydrophobicContact CG-CG2 4.39Å; K111-V113 PolarHBondContact O-N 3.23Å; V113-K117 HydrophobicContact CG1-CB 4.01Å; V113-M118 HydrophobicContact CB-CE 3.93Å; V113-M118 HydrophobicContact CB-SD 4.17Å; V113-H121 HydrophobicContact CG1-CB 4.04Å; V113-H121 HydrophobicContact CG2-CB 4.34Å
114	S	92.4	Very high	89.8	Confident	24 Å²	24	59.5 Å²	59.5	17%	0.168	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	140.1	171.5	165.9	0	0	0	0	110.1	L99 A100 Y102 V116 K117 M118	L99-S114 PolarHBondContact O-OG 3.32Å; A100-S114 PolarHBondContact O-OG 3.27Å; Y102-S114 WeakPolarHBondContact O-CA 3.36Å; S114-V116 PolarHBondContact O-N 2.93Å; S114-K117 CarbonylContact O-C 3.58Å; S114-K117 PolarHBondContact O-N 3.48Å; S114-M118 PolarHBondContact O-N 3Å
115	L	91.4	Very high	90	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-59.1	-35.5	-176.1	-63.8	-177.5	0	0	0	112.4	F39 V47 L99 Y102 A104 K117 M118	F39-L115 HydrophobicContact CB-CD1 4.01Å; F39-L115 HydrophobicContact CD2-CD1 3.53Å; F39-L115 HydrophobicContact CE2-CD1 4.32Å; F39-L115 HydrophobicContact CG-CD1 3.97Å; V47-L115 HydrophobicContact CG1-CB 4.01Å; V47-L115 HydrophobicContact CG2-CD2 4.34Å; L99-L115 HydrophobicContact CB-CB 4.08Å; L99-L115 HydrophobicContact CD2-CB 4.34Å; L99-L115 HydrophobicContact CG-CB 3.94Å; L99-L115 WeakPolarHBondContact O-CB 3.21Å; L99-L115 PolarHBondContact O-N 2.98Å; Y102-L115 PolarHBondContact O-N 3.25Å; A104-L115 HydrophobicContact CB-CD2 3.75Å; L115-K117 PolarHBondContact O-N 3.4Å; L115-M118 HydrophobicContact CD2-CE 4.45Å; L115-M118 WeakPolarHBondContact O-CB 3.43Å; L115-M118 PolarHBondContact O-N 3.4Å; L115-M118 VanDerWaalsContact O-N 3.13Å
116	V	91.3	Very high	90	Very high	69 Å²	69	61.5 Å²	61.5	42%	0.418	34%	0.341	S	S	.	.	H	α-helix	trans	-56.8	-37	173.9	176.2	0	0	0	0	112.3	L99 A100 S114	L99-V116 VanDerWaalsContact C-CG2 3.49Å; L99-V116 HydrophobicContact CB-CG2 3.5Å; L99-V116 PolarHBondContact O-N 3.39Å; A100-V116 HydrophobicContact CB-CG2 3.89Å; A100-V116 VanDerWaalsContact N-CG2 3.34Å; S114-V116 PolarHBondContact O-N 2.93Å
117	K	90.9	Very high	90	Very high	142 Å²	142	66.7 Å²	66.7	62%	0.617	36%	0.363	S	S	*	.	H	α-helix	trans	-94.7	-3	-177.2	-64.6	-176.4	179.8	175.4	0	112.9	V113 S114 L115 R119 S120 H121	V113-K117 HydrophobicContact CG1-CB 4.01Å; S114-K117 CarbonylContact O-C 3.58Å; S114-K117 PolarHBondContact O-N 3.48Å; L115-K117 PolarHBondContact O-N 3.4Å; K117-R119 PolarHBondContact O-N 3.23Å; K117-S120 PolarHBondContact O-N 3.07Å; K117-H121 WeakPolarHBondContact O-CB 3.42Å; K117-H121 PolarHBondContact O-N 3.06Å
118	M	90.4	Very high	90.2	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-62.4	-43.3	-172.9	-172.8	62.3	78.5	0	0	111.9	V47 A104 C106 V113 S114 L115 S120 H121 I122	V47-M118 HydrophobicContact CG2-CG 4.48Å; A104-M118 HydrophobicContact CB-CE 4.14Å; A104-M118 VanDerWaalsContact O-CE 3.32Å; A104-M118 WeakPolarHBondContact O-CE 3.42Å; C106-M118 HydrophobicContact CB-SD 4.49Å; V113-M118 HydrophobicContact CB-CE 3.93Å; V113-M118 HydrophobicContact CB-SD 4.17Å; S114-M118 PolarHBondContact O-N 3Å; L115-M118 HydrophobicContact CD2-CE 4.45Å; L115-M118 WeakPolarHBondContact O-CB 3.43Å; L115-M118 PolarHBondContact O-N 3.4Å; L115-M118 VanDerWaalsContact O-N 3.13Å; M118-S120 PolarHBondContact O-N 3.14Å; M118-H121 WeakPolarHBondContact O-CB 3.36Å; M118-H121 PolarHBondContact O-N 2.91Å; M118-I122 HydrophobicContact CG-CD1 3.87Å; M118-I122 HydrophobicContact CG-CG1 4.44Å; M118-I122 VanDerWaalsContact O-CG1 3.32Å; M118-I122 WeakPolarHBondContact O-CG1 3.22Å; M118-I122 PolarHBondContact O-N 2.91Å; M118-I122 HydrophobicContact SD-CD1 4.42Å; M118-I122 HydrophobicContact SD-CG1 4.49Å
119	R	89.8	Confident	90.2	Very high	63 Å²	63	67.8 Å²	67.8	24%	0.238	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-43	178.6	-172.2	177.8	-78.9	-85.5	-0.3	112.6	E46 H49 K117 H121 I122 S123	E46-R119 VanDerWaalsContact CB-NH2 3.35Å; E46-R119 IonicContact OE2-CZ 3.67Å; E46-R119 IonicContact OE2-NH1 2.73Å; E46-R119 PolarHBondContact OE2-NH1 3.46Å; E46-R119 IonicContact OE2-NH2 3.11Å; E46-R119 PolarHBondContact OE2-NH2 3.23Å; H49-R119 VanDerWaalsContact CB-NE 3.28Å; K117-R119 PolarHBondContact O-N 3.23Å; R119-H121 VanDerWaalsContact C-N 3.32Å; R119-H121 PolarHBondContact O-N 2.9Å; R119-I122 PolarHBondContact O-N 3.42Å; R119-S123 PolarHBondContact O-N 3.03Å; R119-S123 VanDerWaalsContact O-N 3.13Å
120	S	90.8	Very high	90	Very high	72 Å²	72	70.3 Å²	70.3	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-68.6	-31.4	176.4	-52.1	0	0	0	0	112.8	K117 M118 S123 S124	K117-S120 PolarHBondContact O-N 3.07Å; M118-S120 PolarHBondContact O-N 3.14Å; S120-S123 PolarHBondContact O-OG 3.14Å; S120-S124 PolarHBondContact O-OG 2.9Å
121	H	91.6	Very high	89.7	Confident	33 Å²	33	70.2 Å²	70.2	15%	0.153	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-47.9	171.7	170.1	65.5	0	0	0	111.2	C106 C109 V113 K117 M118 R119 S123 S124 C125	C106-H121 WeakPolarHBondContact CB-NE2 3.5Å; C106-H121 PolarHBondContact SG-NE2 3.13Å; C109-H121 PolarHBondContact SG-CE1 3.48Å; C109-H121 PolarHBondContact SG-NE2 3.36Å; V113-H121 HydrophobicContact CG1-CB 4.04Å; V113-H121 HydrophobicContact CG2-CB 4.34Å; K117-H121 WeakPolarHBondContact O-CB 3.42Å; K117-H121 PolarHBondContact O-N 3.06Å; M118-H121 WeakPolarHBondContact O-CB 3.36Å; M118-H121 PolarHBondContact O-N 2.91Å; R119-H121 VanDerWaalsContact C-N 3.32Å; R119-H121 PolarHBondContact O-N 2.9Å; H121-S123 VanDerWaalsContact C-N 3.28Å; H121-S123 PolarHBondContact O-N 3.26Å; H121-S124 CarbonylContact O-C 3.57Å; H121-S124 PolarHBondContact O-N 3.23Å; H121-S124 PolarHBondContact O-OG 3.09Å; H121-C125 VanDerWaalsContact O-CB 3.23Å; H121-C125 WeakPolarHBondContact O-CB 3.37Å; H121-C125 PolarHBondContact O-N 3.25Å
122	I	89.8	Confident	89.3	Confident	19 Å²	19	66.1 Å²	66.1	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-56.4	-42.8	179.7	-74.5	165.8	0	0	0	111.1	F8 M118 R119 S124 C125 V128	F8-I122 HydrophobicContact CB-CD1 4.35Å; M118-I122 HydrophobicContact CG-CD1 3.87Å; M118-I122 HydrophobicContact CG-CG1 4.44Å; M118-I122 VanDerWaalsContact O-CG1 3.32Å; M118-I122 WeakPolarHBondContact O-CG1 3.22Å; M118-I122 PolarHBondContact O-N 2.91Å; M118-I122 HydrophobicContact SD-CD1 4.42Å; M118-I122 HydrophobicContact SD-CG1 4.49Å; R119-I122 PolarHBondContact O-N 3.42Å; I122-S124 PolarHBondContact O-N 3.47Å; I122-C125 PolarHBondContact O-N 2.67Å; I122-V128 HydrophobicContact CG2-CG1 3.85Å
123	S	89.2	Confident	88.8	Confident	93 Å²	93	60.8 Å²	60.8	65%	0.65	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.5	179.4	65.3	0	0	0	0	114.5	R119 S120 H121	R119-S123 PolarHBondContact O-N 3.03Å; R119-S123 VanDerWaalsContact O-N 3.13Å; S120-S123 PolarHBondContact O-OG 3.14Å; H121-S123 VanDerWaalsContact C-N 3.28Å; H121-S123 PolarHBondContact O-N 3.26Å
124	S	90.5	Very high	88.2	Confident	83 Å²	83	65.8 Å²	65.8	58%	0.58	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	3.2	180	54.9	0	0	0	0	113.6	S120 H121 I122 S126	S120-S124 PolarHBondContact O-OG 2.9Å; H121-S124 CarbonylContact O-C 3.57Å; H121-S124 PolarHBondContact O-N 3.23Å; H121-S124 PolarHBondContact O-OG 3.09Å; I122-S124 PolarHBondContact O-N 3.47Å; S124-S126 PolarHBondContact O-N 3.1Å
125	C	92.1	Very high	87.3	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.054	38%	0.375	C	S	.	.			trans	-86.8	108.8	-177.1	-177.8	0	0	0	0	110.2	C109 H121 I122 K127 V128 Q129	C109-C125 VanDerWaalsContact SG-SG 3.69Å; H121-C125 VanDerWaalsContact O-CB 3.23Å; H121-C125 WeakPolarHBondContact O-CB 3.37Å; H121-C125 PolarHBondContact O-N 3.25Å; I122-C125 PolarHBondContact O-N 2.67Å; C125-K127 PolarHBondContact O-N 3Å; C125-K127 VanDerWaalsContact O-N 3.16Å; C125-V128 HydrophobicContact CB-CB 4.08Å; C125-V128 HydrophobicContact CB-CG2 3.98Å; C125-V128 PolarHBondContact O-N 3.23Å; C125-Q129 PolarHBondContact O-N 3.1Å
126	S	90.3	Very high	86.5	Confident	94 Å²	94	72.9 Å²	72.9	66%	0.657	41%	0.409	S	S	*	.	H	α-helix	trans	-54.2	-38.8	-178	-43	0	0	0	0	112.9	S124 Q129 E130	S124-S126 PolarHBondContact O-N 3.1Å; S126-Q129 PolarHBondContact O-N 3Å; S126-E130 WeakPolarHBondContact O-CB 3.48Å; S126-E130 PolarHBondContact O-N 3.46Å
127	K	89.3	Confident	85.4	Confident	115 Å²	115	77.9 Å²	77.9	50%	0.5	43%	0.425	S	S	.	.	H	α-helix	trans	-67.9	-38.5	178.1	-71.2	-69.3	-179.6	-170.9	0	113.3	G108 C109 C125 E130 Q131	G108-K127 VanDerWaalsContact O-CB 3.26Å; G108-K127 WeakPolarHBondContact O-CB 3.24Å; C109-K127 HydrophobicContact CB-CB 4.37Å; C109-K127 HydrophobicContact CB-CG 4.35Å; C125-K127 PolarHBondContact O-N 3Å; C125-K127 VanDerWaalsContact O-N 3.16Å; K127-E130 IonicContact NZ-OE2 2.93Å; K127-Q131 VanDerWaalsContact O-CG 3.3Å; K127-Q131 WeakPolarHBondContact O-CG 3.47Å; K127-Q131 PolarHBondContact O-N 3.03Å
128	V	86.1	Confident	83.8	Confident	3 Å²	3	80 Å²	80	2%	0.018	44%	0.435	C	S	.	.	H	α-helix	trans	-73.1	-39.2	176.1	-179.4	0	0	0	0	110.2	F8 C106 I122 C125 E130 Q131 I132	F8-V128 HydrophobicContact CD1-CG1 4.26Å; C106-V128 WeakPolarHBondContact SG-CG2 3.31Å; I122-V128 HydrophobicContact CG2-CG1 3.85Å; C125-V128 HydrophobicContact CB-CB 4.08Å; C125-V128 HydrophobicContact CB-CG2 3.98Å; C125-V128 PolarHBondContact O-N 3.23Å; V128-E130 VanDerWaalsContact C-N 3.32Å; V128-E130 PolarHBondContact O-N 2.99Å; V128-Q131 WeakPolarHBondContact O-CB 3.28Å; V128-Q131 PolarHBondContact O-N 3.03Å; V128-I132 HydrophobicContact CG1-CD1 3.87Å; V128-I132 HydrophobicContact CG1-CG1 4.3Å; V128-I132 VanDerWaalsContact O-CG1 3.24Å; V128-I132 WeakPolarHBondContact O-CG1 3.47Å; V128-I132 PolarHBondContact O-N 3.06Å
129	Q	86.9	Confident	82.4	Confident	123 Å²	123	85.1 Å²	85.1	58%	0.575	47%	0.466	S	S	*	.	H	α-helix	trans	-62.2	-39.4	176.7	-168.3	173.2	18.4	0	0	112.3	C125 S126 I132 A133	C125-Q129 PolarHBondContact O-N 3.1Å; S126-Q129 PolarHBondContact O-N 3Å; Q129-I132 PolarHBondContact O-N 2.83Å; Q129-A133 WeakPolarHBondContact O-CB 3.25Å; Q129-A133 PolarHBondContact O-N 3.48Å
130	E	86.2	Confident	80.9	Confident	104 Å²	104	87.3 Å²	87.3	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-61.5	-45.2	172.6	-173	-178.2	179.1	0	0	111.5	S126 K127 V128 I132 A133 N134	S126-E130 WeakPolarHBondContact O-CB 3.48Å; S126-E130 PolarHBondContact O-N 3.46Å; K127-E130 IonicContact NZ-OE2 2.93Å; V128-E130 VanDerWaalsContact C-N 3.32Å; V128-E130 PolarHBondContact O-N 2.99Å; E130-I132 VanDerWaalsContact C-N 3.33Å; E130-I132 PolarHBondContact O-N 2.74Å; E130-A133 WeakPolarHBondContact O-CB 3.46Å; E130-A133 PolarHBondContact O-N 2.9Å; E130-N134 PolarHBondContact O-N 3.22Å; E130-N134 VanDerWaalsContact O-N 3.07Å; E130-N134 PolarHBondContact O-ND2 2.6Å
131	Q	82.1	Confident	79.2	Confident	91 Å²	91	90.1 Å²	90.1	43%	0.425	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-38.6	175.1	-71.7	171.8	-29.1	0	0	112.7	K127 V128 N134 C135	K127-Q131 VanDerWaalsContact O-CG 3.3Å; K127-Q131 WeakPolarHBondContact O-CG 3.47Å; K127-Q131 PolarHBondContact O-N 3.03Å; V128-Q131 WeakPolarHBondContact O-CB 3.28Å; V128-Q131 PolarHBondContact O-N 3.03Å; Q131-N134 PolarHBondContact O-N 3.22Å; Q131-C135 PolarHBondContact O-N 3.06Å; Q131-C135 PolarHBondContact O-SG 3.01Å; Q131-C135 VanDerWaalsContact O-SG 3.39Å
132	I	81.5	Confident	77.6	Confident	58 Å²	58	93.6 Å²	93.6	30%	0.297	53%	0.525	S	S	.	.	H	α-helix	trans	-65.7	-41.3	174.9	-67.2	166.9	0	0	0	110.6	F8 V128 Q129 E130 N134 C135	F8-I132 HydrophobicContact CD1-CG1 4.33Å; F8-I132 HydrophobicContact CE1-CD1 3.91Å; F8-I132 HydrophobicContact CE1-CG1 3.37Å; F8-I132 HydrophobicContact CE2-CD1 4.14Å; F8-I132 HydrophobicContact CE2-CG1 4.4Å; F8-I132 HydrophobicContact CZ-CD1 3.62Å; F8-I132 HydrophobicContact CZ-CG1 3.41Å; F8-I132 VanDerWaalsContact CZ-CG1 3.41Å; V128-I132 HydrophobicContact CG1-CD1 3.87Å; V128-I132 HydrophobicContact CG1-CG1 4.3Å; V128-I132 VanDerWaalsContact O-CG1 3.24Å; V128-I132 WeakPolarHBondContact O-CG1 3.47Å; V128-I132 PolarHBondContact O-N 3.06Å; Q129-I132 PolarHBondContact O-N 2.83Å; E130-I132 VanDerWaalsContact C-N 3.33Å; E130-I132 PolarHBondContact O-N 2.74Å; I132-N134 PolarHBondContact O-N 2.55Å; I132-C135 WeakPolarHBondContact O-CB 3.29Å; I132-C135 PolarHBondContact O-N 3.19Å; I132-C135 VanDerWaalsContact O-N 3.17Å
133	A	80.9	Confident	75.8	Confident	60 Å²	60	98.4 Å²	98.4	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-31.2	178.7	0	0	0	0	0	112.6	Q129 E130 C135	Q129-A133 WeakPolarHBondContact O-CB 3.25Å; Q129-A133 PolarHBondContact O-N 3.48Å; E130-A133 WeakPolarHBondContact O-CB 3.46Å; E130-A133 PolarHBondContact O-N 2.9Å; A133-C135 VanDerWaalsContact C-N 3.33Å
134	N	79.3	Confident	74	Confident	125 Å²	125	97.4 Å²	97.4	67%	0.668	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.8	177.4	-69.1	-18.3	0	0	0	113.6	E130 Q131 I132	E130-N134 PolarHBondContact O-N 3.22Å; E130-N134 VanDerWaalsContact O-N 3.07Å; E130-N134 PolarHBondContact O-ND2 2.6Å; Q131-N134 PolarHBondContact O-N 3.22Å; I132-N134 PolarHBondContact O-N 2.55Å
135	C	72.9	Confident	72.3	Confident	63 Å²	63	99.1 Å²	99.1	43%	0.426	56%	0.56	S	S	.	*	S	Bend	trans	-75.7	143.7	175.8	-74.7	0	0	0	0	110.8	Q131 I132 A133 K137	Q131-C135 PolarHBondContact O-N 3.06Å; Q131-C135 PolarHBondContact O-SG 3.01Å; Q131-C135 VanDerWaalsContact O-SG 3.39Å; I132-C135 WeakPolarHBondContact O-CB 3.29Å; I132-C135 PolarHBondContact O-N 3.19Å; I132-C135 VanDerWaalsContact O-N 3.17Å; A133-C135 VanDerWaalsContact C-N 3.33Å; C135-K137 PolarHBondContact O-N 3.25Å
136	P	75.5	Confident	70.6	Confident	111 Å²	111	105.7 Å²	105.7	72%	0.721	59%	0.59	S	S	*	*			trans	-54.5	116.4	173.7	-21.7	31	0	0	0	109.7	F138	P136-F138 PolarHBondContact O-N 3.13Å
137	K	68	Low	68.8	Low	174 Å²	174	106.7 Å²	106.7	76%	0.757	59%	0.594	S	S	*	*			trans	-69.6	104.3	174.8	-67.9	177.3	-175.3	170.8	0	107.2	C135 V139	C135-K137 PolarHBondContact O-N 3.25Å; K137-V139 VanDerWaalsContact C-N 3.33Å; K137-V139 PolarHBondContact O-N 3Å
138	F	56.7	Low	67.2	Low	188 Å²	188	108 Å²	108	83%	0.825	61%	0.605	S	S	*	*			trans	-65.5	99.8	165.9	-87.1	-91.4	0	0	0	107.7	P136	P136-F138 PolarHBondContact O-N 3.13Å
139	V	60.8	Low	65.6	Low	107 Å²	107	111.3 Å²	111.3	65%	0.648	63%	0.627	S	S	*	*			trans	-68.3	137.6	164.2	-164	0	0	0	0	105.6	K137 V141	K137-V139 VanDerWaalsContact C-N 3.33Å; K137-V139 PolarHBondContact O-N 3Å; V139-V141 PolarHBondContact O-N 3.28Å; V139-V141 VanDerWaalsContact O-N 3.12Å
140	P	59.5	Low	64.1	Low	110 Å²	110	111.7 Å²	111.7	71%	0.714	64%	0.643	S	S	*	*			trans	-44.4	129.8	165.5	-24.9	32.7	0	0	0	107.1	V142	P140-V142 VanDerWaalsContact C-N 3.26Å; P140-V142 PolarHBondContact O-N 3.4Å
141	V	55.3	Low	62.9	Low	131 Å²	131	113.7 Å²	113.7	79%	0.794	66%	0.657	S	S	*	*			trans	-53.4	106.2	171.4	-178.1	0	0	0	0	104.1	V139	V139-V141 PolarHBondContact O-N 3.28Å; V139-V141 VanDerWaalsContact O-N 3.12Å
142	V	56.1	Low	61.9	Low	106 Å²	106	115.1 Å²	115.1	64%	0.642	67%	0.666	S	S	*	*			trans	-45.5	136.1	170.4	-138.3	0	0	0	0	104.4	P140 T144	P140-V142 VanDerWaalsContact C-N 3.26Å; P140-V142 PolarHBondContact O-N 3.4Å; V142-T144 VanDerWaalsContact O-CA 3.28Å; V142-T144 WeakPolarHBondContact O-CA 3.49Å; V142-T144 PolarHBondContact O-N 2.69Å
143	P	52.9	Low	61.1	Low	120 Å²	120	114.7 Å²	114.7	78%	0.779	67%	0.667	S	S	*	*	S	Bend	trans	-42.3	113.6	176.6	-25.6	31.3	0	0	0	106.8	S145	P143-S145 PolarHBondContact O-N 2.81Å
144	T	51.7	Low	60.5	Low	71 Å²	71	116 Å²	116	44%	0.436	67%	0.666	S	S	.	*			trans	-54.4	125.3	-160.7	178.1	0	0	0	0	107.4	V142 Q146	V142-T144 VanDerWaalsContact O-CA 3.28Å; V142-T144 WeakPolarHBondContact O-CA 3.49Å; V142-T144 PolarHBondContact O-N 2.69Å; T144-Q146 HydrophobicContact CG2-CB 4.37Å; T144-Q146 WeakPolarHBondContact CG2-O 3.5Å; T144-Q146 PolarHBondContact O-N 3.21Å; T144-Q146 WeakPolarHBondContact OG1-CB 3.42Å; T144-Q146 VanDerWaalsContact OG1-CG 3.32Å; T144-Q146 WeakPolarHBondContact OG1-CG 3.43Å; T144-Q146 PolarHBondContact OG1-N 3.43Å
145	S	54.4	Low	60.2	Low	120 Å²	120	118 Å²	118	84%	0.839	66%	0.664	S	S	*	*	S	Bend	trans	-66.7	-11.6	173	-34	0	0	0	0	110.1	P143	P143-S145 PolarHBondContact O-N 2.81Å
146	Q	55.9	Low	60.6	Low	145 Å²	145	119.2 Å²	119.2	68%	0.678	67%	0.673	S	S	*	*	S	Bend	trans	-64	124.8	165.5	-55.9	-173	-48.8	0	0	107.5	T144 I148	T144-Q146 HydrophobicContact CG2-CB 4.37Å; T144-Q146 WeakPolarHBondContact CG2-O 3.5Å; T144-Q146 PolarHBondContact O-N 3.21Å; T144-Q146 WeakPolarHBondContact OG1-CB 3.42Å; T144-Q146 VanDerWaalsContact OG1-CG 3.32Å; T144-Q146 WeakPolarHBondContact OG1-CG 3.43Å; T144-Q146 PolarHBondContact OG1-N 3.43Å; Q146-I148 PolarHBondContact O-N 3.44Å; Q146-I148 VanDerWaalsContact O-N 3.07Å
147	P	53.7	Low	61.2	Low	115 Å²	115	116.4 Å²	116.4	75%	0.747	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-52.6	125.9	169.5	22.4	-30.6	0	0	0	107	P149	P147-P149 VanDerWaalsContact O-CD 3.28Å; P147-P149 WeakPolarHBondContact O-CD 3.29Å
148	I	55.1	Low	62.3	Low	143 Å²	143	108.9 Å²	108.9	73%	0.733	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-46.1	119.9	164	-59.9	163.7	0	0	0	104	Q146 S150	Q146-I148 PolarHBondContact O-N 3.44Å; Q146-I148 VanDerWaalsContact O-N 3.07Å; I148-S150 VanDerWaalsContact C-N 3.33Å; I148-S150 PolarHBondContact O-N 3.08Å
149	P	53.4	Low	64	Low	73 Å²	73	103.1 Å²	103.1	47%	0.474	60%	0.601	S	S	.	*			trans	-56.5	107.2	-179.4	-24.7	34	0	0	0	106.5	P147 N151 I152	P147-P149 VanDerWaalsContact O-CD 3.28Å; P147-P149 WeakPolarHBondContact O-CD 3.29Å; P149-N151 PolarHBondContact O-N 3.42Å; P149-I152 HydrophobicContact CB-CD1 3.61Å; P149-I152 HydrophobicContact CB-CG1 3.8Å; P149-I152 HydrophobicContact CG-CD1 3.59Å; P149-I152 HydrophobicContact CG-CG1 4.36Å; P149-I152 PolarHBondContact O-N 2.9Å
150	S	55.2	Low	65.5	Low	130 Å²	130	98 Å²	98	91%	0.909	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-9.9	-178.6	44.7	0	0	0	0	111.5	I148	I148-S150 VanDerWaalsContact C-N 3.33Å; I148-S150 PolarHBondContact O-N 3.08Å
151	N	59.5	Low	67.1	Low	147 Å²	147	95 Å²	95	79%	0.786	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	6	179.5	-148.3	-17.5	0	0	0	113.8	P149 P153	P149-N151 PolarHBondContact O-N 3.42Å; N151-P153 WeakPolarHBondContact O-CD 3.43Å
152	I	61.1	Low	68.8	Low	120 Å²	120	90.7 Å²	90.7	62%	0.615	52%	0.521	S	S	*	.	S	Bend	trans	-94.9	99.9	167.2	-62	166.5	0	0	0	107.4	P149 N154	P149-I152 HydrophobicContact CB-CD1 3.61Å; P149-I152 HydrophobicContact CB-CG1 3.8Å; P149-I152 HydrophobicContact CG-CD1 3.59Å; P149-I152 HydrophobicContact CG-CG1 4.36Å; P149-I152 PolarHBondContact O-N 2.9Å; I152-N154 PolarHBondContact O-N 2.79Å
153	P	64.5	Low	70.6	Confident	50 Å²	50	89 Å²	89	33%	0.325	51%	0.513	S	S	.	.			trans	-58.9	131.1	176.4	18.5	-27.6	0	0	0	110.1	N151 R155 A195	N151-P153 WeakPolarHBondContact O-CD 3.43Å; P153-R155 PolarHBondContact O-N 3.42Å; P153-A195 WeakPolarHBondContact CB-O 3.47Å
154	N	69.5	Low	72.4	Confident	86 Å²	86	85.1 Å²	85.1	46%	0.46	50%	0.496	S	S	.	.			trans	-69.4	115.6	176.5	177.2	1.6	0	0	0	110	I152 S156 T157 A195	I152-N154 PolarHBondContact O-N 2.79Å; N154-S156 PolarHBondContact OD1-N 3.31Å; N154-S156 VanDerWaalsContact OD1-N 3.1Å; N154-T157 VanDerWaalsContact CG-O 3.24Å; N154-T157 PolarHBondContact ND2-O 3.35Å; N154-T157 PolarHBondContact OD1-N 3.4Å; N154-T157 PolarHBondContact OD1-O 2.97Å; N154-A195 WeakPolarHBondContact O-CB 3.21Å
155	R	73.4	Confident	74.2	Confident	168 Å²	168	83.3 Å²	83.3	63%	0.634	49%	0.488	S	S	*	.			trans	-108.1	-0.1	-178	-62.8	-177.2	-176	-161.3	0.7	114.1	P153	P153-R155 PolarHBondContact O-N 3.42Å
156	S	79.5	Confident	75.9	Confident	88 Å²	88	86.7 Å²	86.7	62%	0.615	48%	0.482	S	S	*	.	S	Bend	trans	-117.7	-35.7	-164	-53	0	0	0	0	113.9	N154	N154-S156 PolarHBondContact OD1-N 3.31Å; N154-S156 VanDerWaalsContact OD1-N 3.1Å
157	T	88.9	Confident	77.5	Confident	53 Å²	53	85.9 Å²	85.9	33%	0.325	48%	0.483	S	S	.	.			trans	-140.3	144.2	-179.5	60	0	0	0	0	111.5	N154 L168	N154-T157 VanDerWaalsContact CG-O 3.24Å; N154-T157 PolarHBondContact ND2-O 3.35Å; N154-T157 PolarHBondContact OD1-N 3.4Å; N154-T157 PolarHBondContact OD1-O 2.97Å; T157-L168 CarbonylContact C-O 3.31Å; T157-L168 WeakPolarHBondContact CA-O 3.4Å
158	F	90.9	Very high	79.2	Confident	15 Å²	15	81.6 Å²	81.6	7%	0.066	45%	0.453	C	S	.	.	B	Isolated β-bridge	trans	-126.9	160.7	-171.7	-55.3	-74.3	0	0	0	110.1	N167 L168 Q170 L173 P191 V192 A195	F158-N167 PolarHBondContact O-N 3.27Å; F158-L168 PolarHBondContact N-O 3.41Å; F158-L168 PolarHBondContact O-N 3.15Å; F158-L168 VanDerWaalsContact O-N 3.08Å; F158-Q170 HydrophobicContact CE2-CB 4.2Å; F158-L173 HydrophobicContact CB-CD2 3.95Å; F158-L173 HydrophobicContact CG-CD2 4.39Å; F158-P191 HydrophobicContact CB-CB 4.17Å; F158-P191 HydrophobicContact CB-CG 4.08Å; F158-P191 HydrophobicContact CD1-CB 4.11Å; F158-V192 HydrophobicContact CD1-CG2 4.13Å; F158-V192 HydrophobicContact CD2-CG2 3.93Å; F158-V192 HydrophobicContact CE1-CB 4.26Å; F158-V192 HydrophobicContact CE1-CG1 4.44Å; F158-V192 HydrophobicContact CE1-CG2 4.1Å; F158-V192 HydrophobicContact CE2-CG1 4.46Å; F158-V192 HydrophobicContact CE2-CG2 3.89Å; F158-V192 HydrophobicContact CG-CG2 4.04Å; F158-V192 HydrophobicContact CZ-CB 4.25Å; F158-V192 HydrophobicContact CZ-CG1 4.03Å; F158-V192 HydrophobicContact CZ-CG2 3.98Å; F158-A195 HydrophobicContact CE1-CB 4.14Å
159	V	91.7	Very high	80.7	Confident	67 Å²	67	78.3 Å²	78.3	41%	0.406	44%	0.437	S	S	.	.			trans	-105.1	131.4	174.1	-178.8	0	0	0	0	107.9	P161 A165 R166	V159-P161 WeakPolarHBondContact O-CD 3.47Å; V159-A165 CarbonylContact C-O 3.49Å; V159-A165 VanDerWaalsContact CA-O 3.25Å; V159-A165 WeakPolarHBondContact CA-O 3.4Å; V159-R166 HydrophobicContact CG1-CG 4.39Å; V159-R166 HydrophobicContact CG2-CB 4.42Å; V159-R166 HydrophobicContact CG2-CG 4.21Å
160	C	93.3	Very high	82.3	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.007	42%	0.423	C	S	.	.			trans	-62.6	121.5	174.1	179	0	0	0	0	109.2	F162 G164 A165 L168 L173 H176	C160-F162 PolarHBondContact O-N 3.38Å; C160-G164 VanDerWaalsContact O-CA 3.25Å; C160-G164 WeakPolarHBondContact O-CA 3.45Å; C160-G164 PolarHBondContact O-N 3.29Å; C160-A165 HydrophobicContact CB-CB 3.96Å; C160-A165 PolarHBondContact N-O 2.69Å; C160-L168 HydrophobicContact CB-CD1 3.89Å; C160-L173 HydrophobicContact CB-CD1 4.21Å; C160-H176 VanDerWaalsContact SG-CD2 3.58Å; C160-H176 PolarHBondContact SG-NE2 3.18Å; C160-H176 VanDerWaalsContact SG-NE2 3.39Å
161	P	92.3	Very high	83.8	Confident	46 Å²	46	75.2 Å²	75.2	30%	0.299	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11	-175.6	32.6	-38.1	0	0	0	113.7	V159 V188 F208	V159-P161 WeakPolarHBondContact O-CD 3.47Å; P161-V188 HydrophobicContact CB-CB 3.74Å; P161-V188 HydrophobicContact CB-CG1 4.01Å; P161-V188 HydrophobicContact CB-CG2 4.17Å; P161-V188 HydrophobicContact CG-CB 3.84Å; P161-V188 HydrophobicContact CG-CG1 4.31Å; P161-V188 HydrophobicContact CG-CG2 3.67Å; P161-F208 HydrophobicContact CG-CD1 4.36Å; P161-F208 HydrophobicContact CG-CE1 3.77Å; P161-F208 HydrophobicContact CG-CZ 3.89Å
162	F	92.3	Very high	85.3	Confident	40 Å²	40	72.2 Å²	72.2	18%	0.175	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-45.4	176	-63.3	-63	0	0	0	112.9	C160 H181 D184 N186 V188 F208	C160-F162 PolarHBondContact O-N 3.38Å; F162-H181 VanDerWaalsContact CB-CE1 3.47Å; F162-H181 WeakPolarHBondContact CB-CE1 3.4Å; F162-H181 WeakPolarHBondContact CB-ND1 3.41Å; F162-H181 HydrophobicContact CD2-CB 3.59Å; F162-H181 AromaticContact CD2-CD2 3.92Å; F162-H181 AromaticContact CD2-CG 3.57Å; F162-H181 HydrophobicContact CE2-CB 3.86Å; F162-H181 HydrophobicContact CG-CB 4.21Å; F162-H181 AromaticContact CG-CG 3.89Å; F162-H181 AromaticContact CG-ND1 3.89Å; F162-D184 HydrophobicContact CD1-CB 4.06Å; F162-D184 VanDerWaalsContact CD1-CG 3.45Å; F162-D184 HydrophobicContact CE1-CB 3.89Å; F162-D184 HydrophobicContact CZ-CB 4.19Å; F162-N186 HydrophobicContact CD1-CB 4.23Å; F162-N186 HydrophobicContact CE1-CB 4.11Å; F162-N186 WeakPolarHBondContact CE1-O 3.25Å; F162-V188 HydrophobicContact CD1-CG1 3.81Å; F162-V188 HydrophobicContact CD1-CG2 4.45Å; F162-V188 HydrophobicContact CE1-CB 4.47Å; F162-V188 HydrophobicContact CE1-CG1 3.76Å; F162-V188 HydrophobicContact CE1-CG2 3.83Å; F162-V188 HydrophobicContact CE2-CG2 4.4Å; F162-V188 HydrophobicContact CZ-CG2 3.81Å; F162-F208 HydrophobicContact CD2-CD1 4.37Å; F162-F208 HydrophobicContact CD2-CE1 4.44Å; F162-F208 AromaticContact CE2-CD1 3.42Å; F162-F208 HydrophobicContact CE2-CD1 3.42Å; F162-F208 VanDerWaalsContact CE2-CD1 3.42Å; F162-F208 AromaticContact CE2-CE1 3.86Å; F162-F208 HydrophobicContact CE2-CE1 3.86Å; F162-F208 HydrophobicContact CZ-CB 4.34Å; F162-F208 AromaticContact CZ-CD1 3.65Å; F162-F208 HydrophobicContact CZ-CD1 3.65Å; F162-F208 HydrophobicContact CZ-CE1 4.48Å; F162-F208 HydrophobicContact CZ-CG 4.44Å
163	C	93.1	Very high	86.7	Confident	70 Å²	70	66.5 Å²	66.5	47%	0.473	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-5.5	-171.2	66.6	0	0	0	0	114.6	A165 H176 H181	C163-A165 VanDerWaalsContact C-N 3.31Å; C163-A165 PolarHBondContact O-N 3.48Å; C163-H176 PolarHBondContact SG-NE2 2.93Å; C163-H181 PolarHBondContact SG-NE2 2.95Å
164	G	90.8	Very high	88	Confident	40 Å²	40	64.5 Å²	64.5	41%	0.412	34%	0.341	S	S	.	.			trans	77.3	9.6	-180	0	0	0	0	0	115.1	C160 R166	C160-G164 VanDerWaalsContact O-CA 3.25Å; C160-G164 WeakPolarHBondContact O-CA 3.45Å; C160-G164 PolarHBondContact O-N 3.29Å; G164-R166 VanDerWaalsContact O-CG 3.29Å; G164-R166 WeakPolarHBondContact O-CG 3.24Å; G164-R166 PolarHBondContact O-N 3.28Å
165	A	90.3	Very high	89	Confident	32 Å²	32	64.8 Å²	64.8	26%	0.264	34%	0.338	S	S	.	.			trans	-55.3	126.4	173.9	0	0	0	0	0	110.6	V159 C160 C163 L168	V159-A165 CarbonylContact C-O 3.49Å; V159-A165 VanDerWaalsContact CA-O 3.25Å; V159-A165 WeakPolarHBondContact CA-O 3.4Å; C160-A165 HydrophobicContact CB-CB 3.96Å; C160-A165 PolarHBondContact N-O 2.69Å; C163-A165 VanDerWaalsContact C-N 3.31Å; C163-A165 PolarHBondContact O-N 3.48Å; A165-L168 HydrophobicContact CB-CD1 4.03Å
166	R	90.2	Very high	90	Very high	191 Å²	191	58.4 Å²	58.4	72%	0.721	32%	0.315	S	S	*	.			trans	-103.3	165.7	-171.8	-51.8	178.7	78.4	-178.5	4.4	111.2	V159 G164 L168	V159-R166 HydrophobicContact CG1-CG 4.39Å; V159-R166 HydrophobicContact CG2-CB 4.42Å; V159-R166 HydrophobicContact CG2-CG 4.21Å; G164-R166 VanDerWaalsContact O-CG 3.29Å; G164-R166 WeakPolarHBondContact O-CG 3.24Å; G164-R166 PolarHBondContact O-N 3.28Å; R166-L168 VanDerWaalsContact C-N 3.29Å; R166-L168 PolarHBondContact O-N 2.83Å
167	N	88.1	Confident	90.6	Very high	129 Å²	129	54.2 Å²	54.2	69%	0.69	29%	0.286	S	S	*	.	S	Bend	trans	63	30.7	174.3	-49.1	-58.9	0	0	0	114.2	F158	F158-N167 PolarHBondContact O-N 3.27Å
168	L	89.4	Confident	90.6	Very high	25 Å²	25	55.7 Å²	55.7	13%	0.131	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-87.7	119.4	175.8	-59.7	173.4	0	0	0	108.4	T157 F158 C160 A165 R166 E172 L173 H176	T157-L168 CarbonylContact C-O 3.31Å; T157-L168 WeakPolarHBondContact CA-O 3.4Å; F158-L168 PolarHBondContact N-O 3.41Å; F158-L168 PolarHBondContact O-N 3.15Å; F158-L168 VanDerWaalsContact O-N 3.08Å; C160-L168 HydrophobicContact CB-CD1 3.89Å; A165-L168 HydrophobicContact CB-CD1 4.03Å; R166-L168 VanDerWaalsContact C-N 3.29Å; R166-L168 PolarHBondContact O-N 2.83Å; L168-E172 HydrophobicContact CD2-CB 4.36Å; L168-L173 HydrophobicContact CB-CB 4.06Å; L168-L173 HydrophobicContact CB-CD1 4.44Å; L168-L173 HydrophobicContact CD1-CD1 3.77Å; L168-H176 HydrophobicContact CD1-CB 4.24Å
169	D	87.8	Confident	90.7	Very high	73 Å²	73	61.2 Å²	61.2	39%	0.39	32%	0.316	S	S	.	.			trans	-64.9	174.8	166	67.3	45.8	0	0	0	110.6	Q171 E172 L173	D169-Q171 VanDerWaalsContact C-N 3.27Å; D169-Q171 PolarHBondContact O-N 3.47Å; D169-Q171 WeakPolarHBondContact OD1-CA 3.37Å; D169-Q171 WeakPolarHBondContact OD1-CB 3.22Å; D169-Q171 PolarHBondContact OD1-N 3.47Å; D169-E172 PolarHBondContact O-N 3.3Å; D169-E172 PolarHBondContact OD1-N 3.08Å; D169-L173 WeakPolarHBondContact O-CB 3.44Å; D169-L173 PolarHBondContact O-N 2.83Å
170	Q	87	Confident	90.7	Very high	37 Å²	37	62.7 Å²	62.7	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-56.5	-41.3	-178.6	-176.7	-179.4	55.8	0	0	112.5	F158 V174 H216	F158-Q170 HydrophobicContact CE2-CB 4.2Å; Q170-V174 VanDerWaalsContact O-CG2 3.23Å; Q170-V174 WeakPolarHBondContact O-CG2 3.22Å; Q170-V174 PolarHBondContact O-N 2.93Å; Q170-V174 VanDerWaalsContact O-N 3.15Å; Q170-H216 HydrophobicContact CG-CB 4.04Å; Q170-H216 PolarHBondContact NE2-ND1 3.22Å
171	Q	87.4	Confident	90.6	Very high	101 Å²	101	64 Å²	64	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-73.5	-44.7	-175.7	-161.9	71.5	14.9	0	0	111.2	D169 L173 V174 K175 K217	D169-Q171 VanDerWaalsContact C-N 3.27Å; D169-Q171 PolarHBondContact O-N 3.47Å; D169-Q171 WeakPolarHBondContact OD1-CA 3.37Å; D169-Q171 WeakPolarHBondContact OD1-CB 3.22Å; D169-Q171 PolarHBondContact OD1-N 3.47Å; Q171-L173 VanDerWaalsContact C-N 3.3Å; Q171-L173 PolarHBondContact O-N 3.12Å; Q171-V174 WeakPolarHBondContact O-CB 3.14Å; Q171-V174 PolarHBondContact O-N 3.01Å; Q171-K175 PolarHBondContact O-N 2.78Å; Q171-K217 PolarHBondContact OE1-O 2.89Å
172	E	89.7	Confident	90.4	Very high	85 Å²	85	71.2 Å²	71.2	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-32.5	176.2	-69.5	-59.6	126.4	0	0	111.2	L168 D169 H176	L168-E172 HydrophobicContact CD2-CB 4.36Å; D169-E172 PolarHBondContact O-N 3.3Å; D169-E172 PolarHBondContact OD1-N 3.08Å; E172-H176 WeakPolarHBondContact O-CB 3.43Å; E172-H176 PolarHBondContact O-N 2.84Å
173	L	91.3	Very high	90.1	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.6	-45.5	172	-178.5	66.7	0	0	0	111.3	F158 C160 L168 D169 Q171 C177 P191 V192 L212	F158-L173 HydrophobicContact CB-CD2 3.95Å; F158-L173 HydrophobicContact CG-CD2 4.39Å; C160-L173 HydrophobicContact CB-CD1 4.21Å; L168-L173 HydrophobicContact CB-CB 4.06Å; L168-L173 HydrophobicContact CB-CD1 4.44Å; L168-L173 HydrophobicContact CD1-CD1 3.77Å; D169-L173 WeakPolarHBondContact O-CB 3.44Å; D169-L173 PolarHBondContact O-N 2.83Å; Q171-L173 VanDerWaalsContact C-N 3.3Å; Q171-L173 PolarHBondContact O-N 3.12Å; L173-C177 WeakPolarHBondContact O-CB 3.32Å; L173-C177 PolarHBondContact O-N 3.21Å; L173-C177 PolarHBondContact O-SG 3.13Å; L173-P191 HydrophobicContact CD2-CG 3.76Å; L173-V192 HydrophobicContact CD2-CG2 3.89Å; L173-L212 HydrophobicContact CD2-CD1 4.15Å; L173-L212 HydrophobicContact CG-CD2 4.19Å
174	V	90.7	Very high	89.7	Confident	7 Å²	7	75.5 Å²	75.5	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-58.3	-52.4	175.7	175.1	0	0	0	0	110.5	Q170 Q171 C177 M178 L212 L213 H216	Q170-V174 VanDerWaalsContact O-CG2 3.23Å; Q170-V174 WeakPolarHBondContact O-CG2 3.22Å; Q170-V174 PolarHBondContact O-N 2.93Å; Q170-V174 VanDerWaalsContact O-N 3.15Å; Q171-V174 WeakPolarHBondContact O-CB 3.14Å; Q171-V174 PolarHBondContact O-N 3.01Å; V174-C177 PolarHBondContact O-N 3.19Å; V174-M178 HydrophobicContact CG1-CE 4.47Å; V174-M178 WeakPolarHBondContact O-CG 3.45Å; V174-M178 PolarHBondContact O-N 2.79Å; V174-L212 HydrophobicContact CB-CD2 4.36Å; V174-L212 HydrophobicContact CB-CG 4.46Å; V174-L212 HydrophobicContact CG2-CD1 4.28Å; V174-L212 HydrophobicContact CG2-CD2 4.08Å; V174-L212 HydrophobicContact CG2-CG 3.72Å; V174-L213 HydrophobicContact CG1-CD2 3.63Å; V174-H216 WeakPolarHBondContact CG2-O 3.35Å
175	K	91.6	Very high	89.4	Confident	93 Å²	93	79.1 Å²	79.1	40%	0.404	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-50.1	-179.2	-177.4	-175.9	171.4	-165.8	0	111.7	Q171 C177 M178 E179	Q171-K175 PolarHBondContact O-N 2.78Å; K175-C177 VanDerWaalsContact C-N 3.34Å; K175-C177 PolarHBondContact O-N 3.18Å; K175-M178 PolarHBondContact O-N 3.5Å; K175-E179 WeakPolarHBondContact CE-OE1 3.41Å; K175-E179 WeakPolarHBondContact CG-OE1 3.42Å; K175-E179 WeakPolarHBondContact O-CG 3.16Å; K175-E179 PolarHBondContact O-N 2.98Å
176	H	93.5	Very high	89.3	Confident	33 Å²	33	82.3 Å²	82.3	15%	0.153	40%	0.398	C	S	.	.	H	α-helix	trans	-55.7	-47.3	178	170.7	78.8	0	0	0	111.8	C160 C163 L168 E172 M178 E179 N180 H181	C160-H176 VanDerWaalsContact SG-CD2 3.58Å; C160-H176 PolarHBondContact SG-NE2 3.18Å; C160-H176 VanDerWaalsContact SG-NE2 3.39Å; C163-H176 PolarHBondContact SG-NE2 2.93Å; L168-H176 HydrophobicContact CD1-CB 4.24Å; E172-H176 WeakPolarHBondContact O-CB 3.43Å; E172-H176 PolarHBondContact O-N 2.84Å; H176-M178 PolarHBondContact O-N 3.37Å; H176-E179 PolarHBondContact O-N 3.37Å; H176-N180 PolarHBondContact ND1-ND2 3.28Å; H176-N180 WeakPolarHBondContact O-CB 3.35Å; H176-N180 PolarHBondContact O-N 3.2Å; H176-N180 PolarHBondContact O-ND2 2.78Å; H176-H181 AromaticContact NE2-CD2 3.78Å; H176-H181 AromaticContact NE2-NE2 3.64Å
177	C	91.9	Very high	89.4	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-66.6	-36.8	-179.7	-65.7	0	0	0	0	112.2	L173 V174 K175 H181 L209 L212	L173-C177 WeakPolarHBondContact O-CB 3.32Å; L173-C177 PolarHBondContact O-N 3.21Å; L173-C177 PolarHBondContact O-SG 3.13Å; V174-C177 PolarHBondContact O-N 3.19Å; K175-C177 VanDerWaalsContact C-N 3.34Å; K175-C177 PolarHBondContact O-N 3.18Å; C177-H181 CarbonylContact O-C 3.38Å; C177-H181 WeakPolarHBondContact O-CA 3.49Å; C177-H181 WeakPolarHBondContact O-CB 3.39Å; C177-H181 PolarHBondContact O-N 3.29Å; C177-L209 HydrophobicContact CB-CD1 3.82Å; C177-L212 HydrophobicContact CB-CD2 4.07Å
178	M	90.3	Very high	89.7	Confident	85 Å²	85	74.3 Å²	74.3	42%	0.419	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-42	175.8	-79.2	-152	-65.8	0	0	113	V174 K175 H176 L209 L213	V174-M178 HydrophobicContact CG1-CE 4.47Å; V174-M178 WeakPolarHBondContact O-CG 3.45Å; V174-M178 PolarHBondContact O-N 2.79Å; K175-M178 PolarHBondContact O-N 3.5Å; H176-M178 PolarHBondContact O-N 3.37Å; M178-L209 HydrophobicContact CG-CD1 3.96Å; M178-L213 HydrophobicContact CE-CD2 4.16Å; M178-L213 HydrophobicContact CG-CD1 4.33Å; M178-L213 HydrophobicContact CG-CD2 4.03Å; M178-L213 HydrophobicContact SD-CD1 4.05Å; M178-L213 HydrophobicContact SD-CD2 3.53Å; M178-L213 VanDerWaalsContact SD-CD2 3.53Å; M178-L213 HydrophobicContact SD-CG 4.35Å
179	E	92.1	Very high	89.8	Confident	131 Å²	131	74.8 Å²	74.8	61%	0.612	37%	0.367	S	S	*	.	H	α-helix	trans	-77.9	-34.9	-175.4	-69.7	173.1	176.8	0	0	112.1	K175 H176	K175-E179 WeakPolarHBondContact CE-OE1 3.41Å; K175-E179 WeakPolarHBondContact CG-OE1 3.42Å; K175-E179 WeakPolarHBondContact O-CG 3.16Å; K175-E179 PolarHBondContact O-N 2.98Å; H176-E179 PolarHBondContact O-N 3.37Å
180	N	91.8	Very high	90	Very high	98 Å²	98	71.5 Å²	71.5	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-110.9	-19.1	-168.6	-58.9	-84.9	0	0	0	114.4	H176	H176-N180 PolarHBondContact ND1-ND2 3.28Å; H176-N180 WeakPolarHBondContact O-CB 3.35Å; H176-N180 PolarHBondContact O-N 3.2Å; H176-N180 PolarHBondContact O-ND2 2.78Å
181	H	91.8	Very high	90.2	Very high	27 Å²	27	70.8 Å²	70.8	13%	0.125	35%	0.348	C	S	.	.			trans	-133	29.9	-171.4	-62	-71.8	0	0	0	113.6	F162 C163 H176 C177 N183 D184	F162-H181 VanDerWaalsContact CB-CE1 3.47Å; F162-H181 WeakPolarHBondContact CB-CE1 3.4Å; F162-H181 WeakPolarHBondContact CB-ND1 3.41Å; F162-H181 HydrophobicContact CD2-CB 3.59Å; F162-H181 AromaticContact CD2-CD2 3.92Å; F162-H181 AromaticContact CD2-CG 3.57Å; F162-H181 HydrophobicContact CE2-CB 3.86Å; F162-H181 HydrophobicContact CG-CB 4.21Å; F162-H181 AromaticContact CG-CG 3.89Å; F162-H181 AromaticContact CG-ND1 3.89Å; C163-H181 PolarHBondContact SG-NE2 2.95Å; H176-H181 AromaticContact NE2-CD2 3.78Å; H176-H181 AromaticContact NE2-NE2 3.64Å; C177-H181 CarbonylContact O-C 3.38Å; C177-H181 WeakPolarHBondContact O-CA 3.49Å; C177-H181 WeakPolarHBondContact O-CB 3.39Å; C177-H181 PolarHBondContact O-N 3.29Å; H181-N183 VanDerWaalsContact C-N 3.25Å; H181-N183 PolarHBondContact O-N 3.03Å; H181-N183 VanDerWaalsContact O-N 3.16Å; H181-D184 HydrophobicContact CB-CB 4.1Å; H181-D184 IonicContact ND1-OD2 3.44Å; H181-D184 PolarHBondContact ND1-OD2 2.96Å; H181-D184 PolarHBondContact O-N 2.99Å
182	R	87.3	Confident	90.3	Very high	199 Å²	199	66.4 Å²	66.4	75%	0.751	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.3	-174.7	-167.8	172	-176.9	169.6	1.7	114.7
183	N	87.1	Confident	90.3	Very high	151 Å²	151	64.2 Å²	64.2	81%	0.807	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	23.6	-175.9	-67.4	-14.1	0	0	0	112.5	H181 P185	H181-N183 VanDerWaalsContact C-N 3.25Å; H181-N183 PolarHBondContact O-N 3.03Å; H181-N183 VanDerWaalsContact O-N 3.16Å; N183-P185 WeakPolarHBondContact O-CD 3.45Å
184	D	84.6	Confident	90.2	Very high	49 Å²	49	66.2 Å²	66.2	26%	0.262	34%	0.336	S	S	.	.			trans	-72	121.3	179.1	-162.9	-49.8	0	0	0	110.4	F162 H181 N186	F162-D184 HydrophobicContact CD1-CB 4.06Å; F162-D184 VanDerWaalsContact CD1-CG 3.45Å; F162-D184 HydrophobicContact CE1-CB 3.89Å; F162-D184 HydrophobicContact CZ-CB 4.19Å; H181-D184 HydrophobicContact CB-CB 4.1Å; H181-D184 IonicContact ND1-OD2 3.44Å; H181-D184 PolarHBondContact ND1-OD2 2.96Å; H181-D184 PolarHBondContact O-N 2.99Å; D184-N186 VanDerWaalsContact C-N 3.27Å; D184-N186 PolarHBondContact O-N 3.24Å; D184-N186 VanDerWaalsContact OD1-CB 3.22Å; D184-N186 WeakPolarHBondContact OD1-CB 3.25Å; D184-N186 VanDerWaalsContact OD1-CG 3.29Å; D184-N186 PolarHBondContact OD1-N 3.38Å; D184-N186 PolarHBondContact OD1-ND2 3.4Å
185	P	83.7	Confident	90	Very high	115 Å²	115	66.7 Å²	66.7	75%	0.747	34%	0.341	S	S	*	.			trans	-80.1	-5.7	-176	33.2	-36.1	0	0	0	113.4	N183	N183-P185 WeakPolarHBondContact O-CD 3.45Å
186	N	88.8	Confident	89.6	Confident	99 Å²	99	65.3 Å²	65.3	53%	0.529	34%	0.337	S	S	.	.			trans	-72.6	134.5	-171.9	-67.6	-56.5	0	0	0	112.4	F162 D184 V188	F162-N186 HydrophobicContact CD1-CB 4.23Å; F162-N186 HydrophobicContact CE1-CB 4.11Å; F162-N186 WeakPolarHBondContact CE1-O 3.25Å; D184-N186 VanDerWaalsContact C-N 3.27Å; D184-N186 PolarHBondContact O-N 3.24Å; D184-N186 VanDerWaalsContact OD1-CB 3.22Å; D184-N186 WeakPolarHBondContact OD1-CB 3.25Å; D184-N186 VanDerWaalsContact OD1-CG 3.29Å; D184-N186 PolarHBondContact OD1-N 3.38Å; D184-N186 PolarHBondContact OD1-ND2 3.4Å; N186-V188 HydrophobicContact CB-CG1 4.42Å
187	K	91.5	Very high	88.8	Confident	137 Å²	137	68.1 Å²	68.1	60%	0.596	36%	0.358	S	S	*	.			trans	-84.3	116.8	171.8	-61.9	-175	-178.1	-176.7	0	109.5	K204	K187-K204 HydrophobicContact CB-CB 4.04Å
188	V	93.7	Very high	88.2	Confident	15 Å²	15	78.2 Å²	78.2	9%	0.091	40%	0.396	C	S	.	.			trans	-123.4	154.5	-174.5	-67	0	0	0	0	111.8	P161 F162 N186 K204 S205 F208	P161-V188 HydrophobicContact CB-CB 3.74Å; P161-V188 HydrophobicContact CB-CG1 4.01Å; P161-V188 HydrophobicContact CB-CG2 4.17Å; P161-V188 HydrophobicContact CG-CB 3.84Å; P161-V188 HydrophobicContact CG-CG1 4.31Å; P161-V188 HydrophobicContact CG-CG2 3.67Å; F162-V188 HydrophobicContact CD1-CG1 3.81Å; F162-V188 HydrophobicContact CD1-CG2 4.45Å; F162-V188 HydrophobicContact CE1-CB 4.47Å; F162-V188 HydrophobicContact CE1-CG1 3.76Å; F162-V188 HydrophobicContact CE1-CG2 3.83Å; F162-V188 HydrophobicContact CE2-CG2 4.4Å; F162-V188 HydrophobicContact CZ-CG2 3.81Å; N186-V188 HydrophobicContact CB-CG1 4.42Å; V188-K204 WeakPolarHBondContact O-CA 3.3Å; V188-S205 PolarHBondContact O-N 3.43Å; V188-F208 HydrophobicContact CG2-CB 3.45Å; V188-F208 VanDerWaalsContact CG2-CB 3.45Å; V188-F208 HydrophobicContact CG2-CD1 3.48Å; V188-F208 VanDerWaalsContact CG2-CD1 3.48Å; V188-F208 HydrophobicContact CG2-CD2 3.93Å; V188-F208 HydrophobicContact CG2-CE1 4.17Å; V188-F208 HydrophobicContact CG2-CG 3.31Å
189	V	93.3	Very high	87.9	Confident	36 Å²	36	75.1 Å²	75.1	22%	0.218	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-77.3	135.7	172.5	-179.8	0	0	0	0	108.4	P191 P201 Y203 K204	V189-P191 VanDerWaalsContact O-CD 3.25Å; V189-P191 WeakPolarHBondContact O-CD 3.43Å; V189-P201 WeakPolarHBondContact CG1-O 3.38Å; V189-P201 WeakPolarHBondContact CG2-O 3.48Å; V189-Y203 WeakPolarHBondContact CA-O 3.38Å; V189-K204 HydrophobicContact CG2-CG 3.94Å
190	C	91.9	Very high	87.6	Confident	4 Å²	4	72.8 Å²	72.8	3%	0.027	38%	0.378	C	S	.	.			trans	-73.8	114.1	174.1	179.2	0	0	0	0	110	V192 C193 S194 F208 H211	C190-V192 PolarHBondContact O-N 3.09Å; C190-C193 HydrophobicContact CB-CB 4Å; C190-C193 PolarHBondContact O-N 3.46Å; C190-C193 PolarHBondContact SG-N 2.86Å; C190-S194 WeakPolarHBondContact O-CB 3.5Å; C190-S194 PolarHBondContact O-N 3.45Å; C190-S194 PolarHBondContact O-OG 3.23Å; C190-F208 HydrophobicContact CB-CD2 4.08Å; C190-F208 HydrophobicContact CB-CE2 3.75Å; C190-H211 WeakPolarHBondContact CB-NE2 3.25Å; C190-H211 PolarHBondContact SG-NE2 3.13Å
191	P	90.9	Very high	87.4	Confident	21 Å²	21	72.4 Å²	72.4	14%	0.136	38%	0.381	C	S	.	.	H	α-helix	trans	-64.2	-31.7	-177.6	27.2	-35.6	0	0	0	111.6	F158 L173 V189 S194 A195	F158-P191 HydrophobicContact CB-CB 4.17Å; F158-P191 HydrophobicContact CB-CG 4.08Å; F158-P191 HydrophobicContact CD1-CB 4.11Å; L173-P191 HydrophobicContact CD2-CG 3.76Å; V189-P191 VanDerWaalsContact O-CD 3.25Å; V189-P191 WeakPolarHBondContact O-CD 3.43Å; P191-S194 WeakPolarHBondContact CA-OG 3.04Å; P191-S194 PolarHBondContact O-OG 3.24Å; P191-A195 WeakPolarHBondContact O-CB 3.34Å; P191-A195 PolarHBondContact O-N 3.34Å
192	V	89.2	Confident	87.3	Confident	9 Å²	9	76.3 Å²	76.3	6%	0.055	41%	0.407	C	S	.	.	H	α-helix	trans	-67.1	-48.5	177.3	-170.7	0	0	0	0	111.2	F158 L173 C190 A195 L212	F158-V192 HydrophobicContact CD1-CG2 4.13Å; F158-V192 HydrophobicContact CD2-CG2 3.93Å; F158-V192 HydrophobicContact CE1-CB 4.26Å; F158-V192 HydrophobicContact CE1-CG1 4.44Å; F158-V192 HydrophobicContact CE1-CG2 4.1Å; F158-V192 HydrophobicContact CE2-CG1 4.46Å; F158-V192 HydrophobicContact CE2-CG2 3.89Å; F158-V192 HydrophobicContact CG-CG2 4.04Å; F158-V192 HydrophobicContact CZ-CB 4.25Å; F158-V192 HydrophobicContact CZ-CG1 4.03Å; F158-V192 HydrophobicContact CZ-CG2 3.98Å; L173-V192 HydrophobicContact CD2-CG2 3.89Å; C190-V192 PolarHBondContact O-N 3.09Å; V192-A195 PolarHBondContact O-N 3.39Å; V192-L212 HydrophobicContact CG2-CD1 4.48Å
193	C	89.1	Confident	87.5	Confident	39 Å²	39	73.2 Å²	73.2	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-43.4	175.8	-66.6	0	0	0	0	111.9	C190 A195 M196 G199 H211 H216	C190-C193 HydrophobicContact CB-CB 4Å; C190-C193 PolarHBondContact O-N 3.46Å; C190-C193 PolarHBondContact SG-N 2.86Å; C193-A195 PolarHBondContact O-N 3.29Å; C193-A195 VanDerWaalsContact O-N 3.15Å; C193-M196 WeakPolarHBondContact O-CB 3.41Å; C193-M196 PolarHBondContact O-N 3.32Å; C193-G199 VanDerWaalsContact O-CA 3.24Å; C193-G199 WeakPolarHBondContact O-CA 3.29Å; C193-H211 PolarHBondContact SG-CE1 3.04Å; C193-H211 PolarHBondContact SG-NE2 3Å; C193-H216 PolarHBondContact SG-NE2 3.44Å
194	S	89.4	Confident	87.8	Confident	43 Å²	43	72.3 Å²	72.3	30%	0.301	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-22.9	-179.2	74.5	0	0	0	0	113.4	C190 P191 M196	C190-S194 WeakPolarHBondContact O-CB 3.5Å; C190-S194 PolarHBondContact O-N 3.45Å; C190-S194 PolarHBondContact O-OG 3.23Å; P191-S194 WeakPolarHBondContact CA-OG 3.04Å; P191-S194 PolarHBondContact O-OG 3.24Å; S194-M196 VanDerWaalsContact C-N 3.33Å
195	A	86.4	Confident	87.9	Confident	17 Å²	17	70.1 Å²	70.1	14%	0.14	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.8	176.1	0	0	0	0	0	113.6	P153 N154 F158 P191 V192 C193	P153-A195 WeakPolarHBondContact CB-O 3.47Å; N154-A195 WeakPolarHBondContact O-CB 3.21Å; F158-A195 HydrophobicContact CE1-CB 4.14Å; P191-A195 WeakPolarHBondContact O-CB 3.34Å; P191-A195 PolarHBondContact O-N 3.34Å; V192-A195 PolarHBondContact O-N 3.39Å; C193-A195 PolarHBondContact O-N 3.29Å; C193-A195 VanDerWaalsContact O-N 3.15Å
196	M	82.4	Confident	88	Confident	64 Å²	64	69.3 Å²	69.3	32%	0.315	37%	0.371	S	S	.	.	S	Bend	trans	-81.8	148.1	176.6	-60.3	-57.9	-70.5	0	0	110.7	C193 S194 W198 G199	C193-M196 WeakPolarHBondContact O-CB 3.41Å; C193-M196 PolarHBondContact O-N 3.32Å; S194-M196 VanDerWaalsContact C-N 3.33Å; M196-W198 HydrophobicContact CB-CD2 4.32Å; M196-W198 HydrophobicContact CB-CG 4.46Å; M196-W198 HydrophobicContact CE-CH2 3.54Å; M196-W198 HydrophobicContact CE-CZ2 3.16Å; M196-W198 HydrophobicContact CE-CZ3 4.46Å; M196-W198 PolarHBondContact O-N 3.29Å; M196-W198 VanDerWaalsContact O-N 3.09Å; M196-G199 PolarHBondContact O-N 3.27Å
197	P	78.6	Confident	88	Confident	92 Å²	92	69 Å²	69	60%	0.597	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.7	178.4	-24.4	33.7	0	0	0	114.3
198	W	79.1	Confident	87.9	Confident	211 Å²	211	62.7 Å²	62.7	80%	0.799	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	10.6	177.3	52.8	82.9	0	0	0	113.1	M196	M196-W198 HydrophobicContact CB-CD2 4.32Å; M196-W198 HydrophobicContact CB-CG 4.46Å; M196-W198 HydrophobicContact CE-CH2 3.54Å; M196-W198 HydrophobicContact CE-CZ2 3.16Å; M196-W198 HydrophobicContact CE-CZ3 4.46Å; M196-W198 PolarHBondContact O-N 3.29Å; M196-W198 VanDerWaalsContact O-N 3.09Å
199	G	82.7	Confident	87.7	Confident	21 Å²	21	63.1 Å²	63.1	22%	0.216	34%	0.343	C	S	.	.			trans	-78.8	144.4	177.1	0	0	0	0	0	112.5	C193 M196 P201	C193-G199 VanDerWaalsContact O-CA 3.24Å; C193-G199 WeakPolarHBondContact O-CA 3.29Å; M196-G199 PolarHBondContact O-N 3.27Å; G199-P201 WeakPolarHBondContact O-CD 3.23Å
200	D	85.4	Confident	87.5	Confident	82 Å²	82	65.9 Å²	65.9	44%	0.439	35%	0.354	S	S	.	.			trans	-96.7	111.3	170.9	-179.4	-6.8	0	0	0	110	T202 Y203	D200-T202 PolarHBondContact O-N 3.48Å; D200-T202 WeakPolarHBondContact OD1-CA 3.49Å; D200-T202 WeakPolarHBondContact OD1-CB 3.44Å; D200-T202 PolarHBondContact OD1-N 2.81Å; D200-T202 PolarHBondContact OD1-OG1 3.47Å; D200-T202 PolarHBondContact OD2-OG1 2.91Å; D200-Y203 PolarHBondContact O-N 3.06Å; D200-Y203 PolarHBondContact OD1-N 3.15Å
201	P	88.3	Confident	87.5	Confident	89 Å²	89	67.4 Å²	67.4	58%	0.578	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.5	178.9	-20.2	34.1	0	0	0	114.5	V189 G199	V189-P201 WeakPolarHBondContact CG1-O 3.38Å; V189-P201 WeakPolarHBondContact CG2-O 3.48Å; G199-P201 WeakPolarHBondContact O-CD 3.23Å
202	T	91	Very high	87.4	Confident	110 Å²	110	66.4 Å²	66.4	68%	0.675	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-15.9	-179.4	72.2	0	0	0	0	112.6	D200 K204	D200-T202 PolarHBondContact O-N 3.48Å; D200-T202 WeakPolarHBondContact OD1-CA 3.49Å; D200-T202 WeakPolarHBondContact OD1-CB 3.44Å; D200-T202 PolarHBondContact OD1-N 2.81Å; D200-T202 PolarHBondContact OD1-OG1 3.47Å; D200-T202 PolarHBondContact OD2-OG1 2.91Å; T202-K204 PolarHBondContact O-N 2.93Å
203	Y	91.4	Very high	87.3	Confident	133 Å²	133	68 Å²	68	52%	0.522	36%	0.362	S	S	.	.			trans	-70.4	115.7	-177.5	178.7	-98.6	0	0	0	111.7	V189 D200	V189-Y203 WeakPolarHBondContact CA-O 3.38Å; D200-Y203 PolarHBondContact O-N 3.06Å; D200-Y203 PolarHBondContact OD1-N 3.15Å
204	K	91.8	Very high	87.2	Confident	132 Å²	132	72.5 Å²	72.5	57%	0.574	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-97.5	117	175.7	-64	178.6	179.6	-176.9	0	110.1	K187 V188 V189 T202 S206	K187-K204 HydrophobicContact CB-CB 4.04Å; V188-K204 WeakPolarHBondContact O-CA 3.3Å; V189-K204 HydrophobicContact CG2-CG 3.94Å; T202-K204 PolarHBondContact O-N 2.93Å; K204-S206 PolarHBondContact O-N 3.34Å
205	S	87.1	Confident	87	Confident	4 Å²	4	79.3 Å²	79.3	3%	0.028	40%	0.398	C	S	.	.			trans	-64.4	134.8	178.1	-70.5	0	0	0	0	110.9	V188 N207	V188-S205 PolarHBondContact O-N 3.43Å; S205-N207 VanDerWaalsContact C-N 3.31Å
206	S	85.9	Confident	86.9	Confident	98 Å²	98	79.5 Å²	79.5	69%	0.685	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.8	175.3	52.9	0	0	0	0	112.6	K204	K204-S206 PolarHBondContact O-N 3.34Å
207	N	88.3	Confident	86.8	Confident	91 Å²	91	81.3 Å²	81.3	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.6	89	170	-172.9	-27.4	0	0	0	108.8	S205 L209 Q210 H211	S205-N207 VanDerWaalsContact C-N 3.31Å; N207-L209 PolarHBondContact OD1-N 3.09Å; N207-Q210 HydrophobicContact CB-CB 4.13Å; N207-Q210 VanDerWaalsContact CG-CB 3.41Å; N207-Q210 VanDerWaalsContact OD1-CB 3.27Å; N207-Q210 WeakPolarHBondContact OD1-CB 3.42Å; N207-Q210 PolarHBondContact OD1-N 3.43Å; N207-H211 WeakPolarHBondContact O-CB 3.44Å; N207-H211 PolarHBondContact O-N 3.26Å
208	F	90.5	Very high	86.4	Confident	5 Å²	5	82.9 Å²	82.9	2%	0.022	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-41.3	-176.6	171.4	-111.6	0	0	0	112.6	P161 F162 V188 C190 Q210 H211 L212	P161-F208 HydrophobicContact CG-CD1 4.36Å; P161-F208 HydrophobicContact CG-CE1 3.77Å; P161-F208 HydrophobicContact CG-CZ 3.89Å; F162-F208 HydrophobicContact CD2-CD1 4.37Å; F162-F208 HydrophobicContact CD2-CE1 4.44Å; F162-F208 AromaticContact CE2-CD1 3.42Å; F162-F208 HydrophobicContact CE2-CD1 3.42Å; F162-F208 VanDerWaalsContact CE2-CD1 3.42Å; F162-F208 AromaticContact CE2-CE1 3.86Å; F162-F208 HydrophobicContact CE2-CE1 3.86Å; F162-F208 HydrophobicContact CZ-CB 4.34Å; F162-F208 AromaticContact CZ-CD1 3.65Å; F162-F208 HydrophobicContact CZ-CD1 3.65Å; F162-F208 HydrophobicContact CZ-CE1 4.48Å; F162-F208 HydrophobicContact CZ-CG 4.44Å; V188-F208 HydrophobicContact CG2-CB 3.45Å; V188-F208 VanDerWaalsContact CG2-CB 3.45Å; V188-F208 HydrophobicContact CG2-CD1 3.48Å; V188-F208 VanDerWaalsContact CG2-CD1 3.48Å; V188-F208 HydrophobicContact CG2-CD2 3.93Å; V188-F208 HydrophobicContact CG2-CE1 4.17Å; V188-F208 HydrophobicContact CG2-CG 3.31Å; C190-F208 HydrophobicContact CB-CD2 4.08Å; C190-F208 HydrophobicContact CB-CE2 3.75Å; F208-Q210 PolarHBondContact O-N 3.38Å; F208-H211 WeakPolarHBondContact O-CB 3.27Å; F208-H211 PolarHBondContact O-N 2.98Å; F208-L212 HydrophobicContact CE1-CD2 4.23Å; F208-L212 HydrophobicContact CE2-CD1 4.35Å; F208-L212 HydrophobicContact CZ-CD1 4.23Å; F208-L212 HydrophobicContact CZ-CD2 4.03Å; F208-L212 WeakPolarHBondContact O-CB 3.45Å; F208-L212 PolarHBondContact O-N 3.14Å
209	L	89.6	Confident	85.6	Confident	25 Å²	25	74.6 Å²	74.6	13%	0.131	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-46.2	-178.8	-174.8	62.5	0	0	0	111.6	C177 M178 N207 L212 L213	C177-L209 HydrophobicContact CB-CD1 3.82Å; M178-L209 HydrophobicContact CG-CD1 3.96Å; N207-L209 PolarHBondContact OD1-N 3.09Å; L209-L212 PolarHBondContact O-N 3.34Å; L209-L213 HydrophobicContact CG-CD1 4.3Å; L209-L213 WeakPolarHBondContact O-CG 3.42Å; L209-L213 PolarHBondContact O-N 3.49Å
210	Q	89.3	Confident	84.3	Confident	94 Å²	94	81.6 Å²	81.6	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.3	-170.8	70.6	-20.1	0	0	110.9	N207 F208 L212 L213 H214	N207-Q210 HydrophobicContact CB-CB 4.13Å; N207-Q210 VanDerWaalsContact CG-CB 3.41Å; N207-Q210 VanDerWaalsContact OD1-CB 3.27Å; N207-Q210 WeakPolarHBondContact OD1-CB 3.42Å; N207-Q210 PolarHBondContact OD1-N 3.43Å; F208-Q210 PolarHBondContact O-N 3.38Å; Q210-L212 VanDerWaalsContact C-N 3.3Å; Q210-L212 PolarHBondContact O-N 3Å; Q210-L213 PolarHBondContact O-N 3.49Å; Q210-H214 VanDerWaalsContact CD-NE2 3.29Å; Q210-H214 PolarHBondContact NE2-NE2 3.48Å; Q210-H214 PolarHBondContact O-CD2 3.49Å; Q210-H214 PolarHBondContact O-N 3.44Å
211	H	91.3	Very high	83	Confident	36 Å²	36	83.3 Å²	83.3	17%	0.167	40%	0.404	C	S	.	.	H	α-helix	trans	-54.9	-46.8	174.8	162	80.9	0	0	0	112	C190 C193 N207 F208 L213 H214 R215 H216	C190-H211 WeakPolarHBondContact CB-NE2 3.25Å; C190-H211 PolarHBondContact SG-NE2 3.13Å; C193-H211 PolarHBondContact SG-CE1 3.04Å; C193-H211 PolarHBondContact SG-NE2 3Å; N207-H211 WeakPolarHBondContact O-CB 3.44Å; N207-H211 PolarHBondContact O-N 3.26Å; F208-H211 WeakPolarHBondContact O-CB 3.27Å; F208-H211 PolarHBondContact O-N 2.98Å; H211-L213 VanDerWaalsContact C-N 3.35Å; H211-L213 PolarHBondContact O-N 2.99Å; H211-H214 PolarHBondContact O-N 2.99Å; H211-R215 WeakPolarHBondContact O-CB 3.49Å; H211-R215 PolarHBondContact O-N 2.77Å; H211-H216 AromaticContact NE2-CD2 3.7Å; H211-H216 AromaticContact NE2-NE2 3.55Å
212	L	89.5	Confident	81.7	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-41.5	180	-166.4	69.6	0	0	0	111.2	L173 V174 C177 V192 F208 L209 Q210 H216 K217	L173-L212 HydrophobicContact CD2-CD1 4.15Å; L173-L212 HydrophobicContact CG-CD2 4.19Å; V174-L212 HydrophobicContact CB-CD2 4.36Å; V174-L212 HydrophobicContact CB-CG 4.46Å; V174-L212 HydrophobicContact CG2-CD1 4.28Å; V174-L212 HydrophobicContact CG2-CD2 4.08Å; V174-L212 HydrophobicContact CG2-CG 3.72Å; C177-L212 HydrophobicContact CB-CD2 4.07Å; V192-L212 HydrophobicContact CG2-CD1 4.48Å; F208-L212 HydrophobicContact CE1-CD2 4.23Å; F208-L212 HydrophobicContact CE2-CD1 4.35Å; F208-L212 HydrophobicContact CZ-CD1 4.23Å; F208-L212 HydrophobicContact CZ-CD2 4.03Å; F208-L212 WeakPolarHBondContact O-CB 3.45Å; F208-L212 PolarHBondContact O-N 3.14Å; L209-L212 PolarHBondContact O-N 3.34Å; Q210-L212 VanDerWaalsContact C-N 3.3Å; Q210-L212 PolarHBondContact O-N 3Å; L212-H216 HydrophobicContact CD1-CB 3.91Å; L212-H216 CarbonylContact O-C 3.55Å; L212-H216 VanDerWaalsContact O-C 3.31Å; L212-H216 VanDerWaalsContact O-CA 3.29Å; L212-H216 WeakPolarHBondContact O-CA 3.45Å; L212-H216 WeakPolarHBondContact O-CB 3.36Å; L212-H216 PolarHBondContact O-N 3.48Å; L212-K217 PolarHBondContact O-N 2.98Å
213	L	86.9	Confident	80.1	Confident	42 Å²	42	85.6 Å²	85.6	22%	0.22	41%	0.405	C	S	.	.	H	α-helix	trans	-69.9	-31	177.1	-71.4	170	0	0	0	114.4	V174 M178 L209 Q210 H211 K217	V174-L213 HydrophobicContact CG1-CD2 3.63Å; M178-L213 HydrophobicContact CE-CD2 4.16Å; M178-L213 HydrophobicContact CG-CD1 4.33Å; M178-L213 HydrophobicContact CG-CD2 4.03Å; M178-L213 HydrophobicContact SD-CD1 4.05Å; M178-L213 HydrophobicContact SD-CD2 3.53Å; M178-L213 VanDerWaalsContact SD-CD2 3.53Å; M178-L213 HydrophobicContact SD-CG 4.35Å; L209-L213 HydrophobicContact CG-CD1 4.3Å; L209-L213 WeakPolarHBondContact O-CG 3.42Å; L209-L213 PolarHBondContact O-N 3.49Å; Q210-L213 PolarHBondContact O-N 3.49Å; H211-L213 VanDerWaalsContact C-N 3.35Å; H211-L213 PolarHBondContact O-N 2.99Å; L213-K217 WeakPolarHBondContact O-CB 3.47Å
214	H	85.4	Confident	78.4	Confident	133 Å²	133	81.4 Å²	81.4	62%	0.616	39%	0.393	S	S	*	.	H	α-helix	trans	-85.4	-37.9	179.8	-81.8	-91.3	0	0	0	112.5	Q210 H211	Q210-H214 VanDerWaalsContact CD-NE2 3.29Å; Q210-H214 PolarHBondContact NE2-NE2 3.48Å; Q210-H214 PolarHBondContact O-CD2 3.49Å; Q210-H214 PolarHBondContact O-N 3.44Å; H211-H214 PolarHBondContact O-N 2.99Å
215	R	85.2	Confident	77	Confident	187 Å²	187	79.4 Å²	79.4	71%	0.706	39%	0.389	S	S	*	.	H	α-helix	trans	-103.3	-20.6	-171.4	-66.4	-77.1	170	84.6	-2.3	114.3	H211	H211-R215 WeakPolarHBondContact O-CB 3.49Å; H211-R215 PolarHBondContact O-N 2.77Å
216	H	85.7	Confident	75.9	Confident	20 Å²	20	86.9 Å²	86.9	9%	0.093	42%	0.417	C	S	.	.	S	Bend	trans	-133.2	10.8	-170.4	-59.8	-52.1	0	0	0	113.5	Q170 V174 C193 H211 L212 F218	Q170-H216 HydrophobicContact CG-CB 4.04Å; Q170-H216 PolarHBondContact NE2-ND1 3.22Å; V174-H216 WeakPolarHBondContact CG2-O 3.35Å; C193-H216 PolarHBondContact SG-NE2 3.44Å; H211-H216 AromaticContact NE2-CD2 3.7Å; H211-H216 AromaticContact NE2-NE2 3.55Å; L212-H216 HydrophobicContact CD1-CB 3.91Å; L212-H216 CarbonylContact O-C 3.55Å; L212-H216 VanDerWaalsContact O-C 3.31Å; L212-H216 VanDerWaalsContact O-CA 3.29Å; L212-H216 WeakPolarHBondContact O-CA 3.45Å; L212-H216 WeakPolarHBondContact O-CB 3.36Å; L212-H216 PolarHBondContact O-N 3.48Å; H216-F218 PolarHBondContact O-N 3.4Å
217	K	80.5	Confident	75.1	Confident	103 Å²	103	87 Å²	87	45%	0.448	42%	0.418	S	S	.	.	S	Bend	trans	-65.2	-24.1	171.6	173.4	-179.1	177.6	-169.2	0	112.9	Q171 L212 L213	Q171-K217 PolarHBondContact OE1-O 2.89Å; L212-K217 PolarHBondContact O-N 2.98Å; L213-K217 WeakPolarHBondContact O-CB 3.47Å
218	F	68.8	Low	74.2	Confident	125 Å²	125	86.9 Å²	86.9	55%	0.548	42%	0.417	S	S	.	.	S	Bend	trans	-123.7	131.6	-179.5	-57.8	-73.6	0	0	0	109.6	H216 F223	H216-F218 PolarHBondContact O-N 3.4Å; F218-F223 HydrophobicContact CB-CE2 4.02Å; F218-F223 AromaticContact CD1-CE2 3.84Å; F218-F223 HydrophobicContact CD1-CE2 3.84Å; F218-F223 HydrophobicContact CD1-CZ 4.01Å; F218-F223 HydrophobicContact CG-CE2 4.34Å
219	S	63.8	Low	73.6	Confident	37 Å²	37	92 Å²	92	26%	0.259	44%	0.444	S	S	.	.			trans	-84	126.5	168.3	175.9	0	0	0	0	109.2	D221 T222 F223	S219-D221 PolarHBondContact O-N 3.5Å; S219-D221 PolarHBondContact OG-N 3.49Å; S219-T222 WeakPolarHBondContact O-CB 3.46Å; S219-T222 PolarHBondContact O-N 2.87Å; S219-T222 VanDerWaalsContact O-N 3.13Å; S219-F223 WeakPolarHBondContact O-CD2 3.39Å
220	Y	55.8	Low	72.9	Confident	167 Å²	167	99.3 Å²	99.3	66%	0.655	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-60.8	-31.7	178.8	-156.2	-104.9	0	0	0	112	T222 F223 V224	Y220-T222 PolarHBondContact O-N 3.29Å; Y220-F223 PolarHBondContact O-N 3.13Å; Y220-V224 HydrophobicContact CD1-CB 4.09Å; Y220-V224 HydrophobicContact CD1-CG2 3.7Å; Y220-V224 HydrophobicContact CD2-CG2 4.32Å; Y220-V224 HydrophobicContact CE1-CB 3.97Å; Y220-V224 HydrophobicContact CE1-CG1 4.22Å; Y220-V224 HydrophobicContact CE1-CG2 3.37Å; Y220-V224 HydrophobicContact CE2-CG2 4.01Å; Y220-V224 HydrophobicContact CG-CG2 4.17Å; Y220-V224 PolarHBondContact O-N 2.91Å
221	D	57.8	Low	72.5	Confident	119 Å²	119	101 Å²	101	64%	0.636	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20.1	178.3	-151.5	-106.8	0	0	0	113.3	S219	S219-D221 PolarHBondContact O-N 3.5Å; S219-D221 PolarHBondContact OG-N 3.49Å
222	T	59.9	Low	72	Confident	105 Å²	105	101.7 Å²	101.7	64%	0.644	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-86.4	-20.4	179.9	-49.7	0	0	0	0	113	S219 Y220	S219-T222 WeakPolarHBondContact O-CB 3.46Å; S219-T222 PolarHBondContact O-N 2.87Å; S219-T222 VanDerWaalsContact O-N 3.13Å; Y220-T222 PolarHBondContact O-N 3.29Å
223	F	57.4	Low	71.6	Confident	142 Å²	142	104.1 Å²	104.1	62%	0.623	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-14.9	-172.9	-61.8	-78.8	0	0	0	113.6	F218 S219 Y220	F218-F223 HydrophobicContact CB-CE2 4.02Å; F218-F223 AromaticContact CD1-CE2 3.84Å; F218-F223 HydrophobicContact CD1-CE2 3.84Å; F218-F223 HydrophobicContact CD1-CZ 4.01Å; F218-F223 HydrophobicContact CG-CE2 4.34Å; S219-F223 WeakPolarHBondContact O-CD2 3.39Å; Y220-F223 PolarHBondContact O-N 3.13Å
224	V	57	Low	71.4	Confident	44 Å²	44	106.9 Å²	106.9	27%	0.267	53%	0.532	S	S	.	.			trans	-108	102.5	175.3	-178.8	0	0	0	0	108.5	Y220 Y226	Y220-V224 HydrophobicContact CD1-CB 4.09Å; Y220-V224 HydrophobicContact CD1-CG2 3.7Å; Y220-V224 HydrophobicContact CD2-CG2 4.32Å; Y220-V224 HydrophobicContact CE1-CB 3.97Å; Y220-V224 HydrophobicContact CE1-CG1 4.22Å; Y220-V224 HydrophobicContact CE1-CG2 3.37Å; Y220-V224 HydrophobicContact CE2-CG2 4.01Å; Y220-V224 HydrophobicContact CG-CG2 4.17Å; Y220-V224 PolarHBondContact O-N 2.91Å; V224-Y226 HydrophobicContact CG1-CD1 3.93Å; V224-Y226 HydrophobicContact CG1-CE1 3.8Å; V224-Y226 HydrophobicContact CG1-CG 4.41Å; V224-Y226 PolarHBondContact O-N 2.99Å
225	D	60.9	Low	71.4	Confident	91 Å²	91	106.4 Å²	106.4	49%	0.487	53%	0.53	S	S	.	.			trans	-78.1	99.5	167.3	-174.3	-9.2	0	0	0	108.3	S227 I228	D225-S227 PolarHBondContact O-N 3.01Å; D225-S227 VanDerWaalsContact OD1-CB 3.25Å; D225-S227 WeakPolarHBondContact OD1-CB 3.45Å; D225-S227 PolarHBondContact OD1-N 3.19Å; D225-S227 PolarHBondContact OD1-OG 3.4Å; D225-S227 PolarHBondContact OD2-OG 3.04Å; D225-I228 HydrophobicContact CB-CD1 3.58Å; D225-I228 HydrophobicContact CB-CG1 3.72Å; D225-I228 PolarHBondContact O-N 3.37Å; D225-I228 WeakPolarHBondContact OD2-CD1 3.42Å; D225-I228 WeakPolarHBondContact OD2-CG1 3.5Å
226	Y	65.1	Low	71.3	Confident	160 Å²	160	100 Å²	100	63%	0.627	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-4.9	177.8	-59.2	-77.9	0	0	0	113.8	V224	V224-Y226 HydrophobicContact CG1-CD1 3.93Å; V224-Y226 HydrophobicContact CG1-CE1 3.8Å; V224-Y226 HydrophobicContact CG1-CG 4.41Å; V224-Y226 PolarHBondContact O-N 2.99Å
227	S	69.4	Low	71.2	Confident	101 Å²	101	101.4 Å²	101.4	71%	0.706	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-9.6	174.1	76.4	0	0	0	0	113.7	D225	D225-S227 PolarHBondContact O-N 3.01Å; D225-S227 VanDerWaalsContact OD1-CB 3.25Å; D225-S227 WeakPolarHBondContact OD1-CB 3.45Å; D225-S227 PolarHBondContact OD1-N 3.19Å; D225-S227 PolarHBondContact OD1-OG 3.4Å; D225-S227 PolarHBondContact OD2-OG 3.04Å
228	I	67.6	Low	71.5	Confident	89 Å²	89	100.9 Å²	100.9	46%	0.456	53%	0.534	S	S	.	.	S	Bend	trans	-94.7	131.9	178.6	-48.7	178.1	0	0	0	109.1	D225 A232 A233	D225-I228 HydrophobicContact CB-CD1 3.58Å; D225-I228 HydrophobicContact CB-CG1 3.72Å; D225-I228 PolarHBondContact O-N 3.37Å; D225-I228 WeakPolarHBondContact OD2-CD1 3.42Å; D225-I228 WeakPolarHBondContact OD2-CG1 3.5Å; I228-A232 HydrophobicContact CG2-CB 4.08Å; I228-A233 HydrophobicContact CG2-CB 4.29Å
229	D	79.8	Confident	72.4	Confident	111 Å²	111	97.6 Å²	97.6	59%	0.594	53%	0.53	S	S	*	.			trans	-62.7	139.3	173.6	-175.9	-95.2	0	0	0	111.1	E231 A232 A233	D229-E231 PolarHBondContact O-N 3.22Å; D229-E231 WeakPolarHBondContact OD1-CB 3.44Å; D229-E231 PolarHBondContact OD1-N 2.94Å; D229-E231 VanDerWaalsContact OD1-N 3.14Å; D229-A232 HydrophobicContact CB-CB 4.24Å; D229-A232 WeakPolarHBondContact O-CB 3.03Å; D229-A232 PolarHBondContact O-N 3.02Å; D229-A233 PolarHBondContact O-N 3.3Å
230	E	74.4	Confident	73.4	Confident	180 Å²	180	101.3 Å²	101.3	84%	0.841	55%	0.546	S	S	*	.	H	α-helix	trans	-61.1	-34.1	-172.2	-146.7	175.8	110	0	0	112	L234	E230-L234 WeakPolarHBondContact O-CB 3.22Å; E230-L234 PolarHBondContact O-N 3.46Å; E230-L234 VanDerWaalsContact O-N 3.13Å
231	E	80.8	Confident	74.7	Confident	129 Å²	129	97.2 Å²	97.2	60%	0.603	54%	0.542	S	S	*	.	H	α-helix	trans	-67.9	-40.7	175.3	-166.5	80.8	-130.3	0	0	110.9	D229 L234 Q235	D229-E231 PolarHBondContact O-N 3.22Å; D229-E231 WeakPolarHBondContact OD1-CB 3.44Å; D229-E231 PolarHBondContact OD1-N 2.94Å; D229-E231 VanDerWaalsContact OD1-N 3.14Å; E231-L234 PolarHBondContact O-N 3.35Å; E231-Q235 WeakPolarHBondContact O-CB 3.43Å; E231-Q235 PolarHBondContact O-N 3.09Å
232	A	81.1	Confident	76	Confident	51 Å²	51	98 Å²	98	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-68.4	-38.2	179.2	0	0	0	0	0	112.2	I228 D229 A236	I228-A232 HydrophobicContact CG2-CB 4.08Å; D229-A232 HydrophobicContact CB-CB 4.24Å; D229-A232 WeakPolarHBondContact O-CB 3.03Å; D229-A232 PolarHBondContact O-N 3.02Å; A232-A236 WeakPolarHBondContact O-CB 3.35Å; A232-A236 PolarHBondContact O-N 3.31Å; A232-A236 VanDerWaalsContact O-N 3.13Å
233	A	79.8	Confident	77	Confident	50 Å²	50	96.8 Å²	96.8	41%	0.413	55%	0.546	S	S	.	.	H	α-helix	trans	-65.4	-41.3	175.1	0	0	0	0	0	111.8	I228 D229 A236 A237	I228-A233 HydrophobicContact CG2-CB 4.29Å; D229-A233 PolarHBondContact O-N 3.3Å; A233-A236 PolarHBondContact O-N 2.92Å; A233-A237 PolarHBondContact O-N 3.21Å; A233-A237 VanDerWaalsContact O-N 3.09Å
234	L	83.6	Confident	77.6	Confident	101 Å²	101	98.5 Å²	98.5	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-66.3	-44.3	177.3	-175.6	61.9	0	0	0	112	E230 E231 A236 A237 L238	E230-L234 WeakPolarHBondContact O-CB 3.22Å; E230-L234 PolarHBondContact O-N 3.46Å; E230-L234 VanDerWaalsContact O-N 3.13Å; E231-L234 PolarHBondContact O-N 3.35Å; L234-A236 VanDerWaalsContact C-N 3.29Å; L234-A236 PolarHBondContact O-N 3.32Å; L234-A237 PolarHBondContact O-N 2.9Å; L234-L238 HydrophobicContact CG-CD1 4.31Å; L234-L238 WeakPolarHBondContact O-CG 3.49Å; L234-L238 PolarHBondContact O-N 3.31Å
235	Q	85.2	Confident	77.4	Confident	122 Å²	122	106.1 Å²	106.1	57%	0.57	60%	0.595	S	S	*	*	H	α-helix	trans	-60.6	-39.7	177.8	-155.1	84.3	-17.3	0	0	111.7	E231 L238 A239	E231-Q235 WeakPolarHBondContact O-CB 3.43Å; E231-Q235 PolarHBondContact O-N 3.09Å; Q235-L238 PolarHBondContact O-N 3.41Å; Q235-A239 WeakPolarHBondContact O-CB 3.37Å; Q235-A239 PolarHBondContact O-N 3.1Å
236	A	83.3	Confident	78.2	Confident	52 Å²	52	106.9 Å²	106.9	43%	0.43	60%	0.6	S	S	.	*	H	α-helix	trans	-67.2	-41.4	177.1	0	0	0	0	0	112.3	A232 A233 L234 A239 L240	A232-A236 WeakPolarHBondContact O-CB 3.35Å; A232-A236 PolarHBondContact O-N 3.31Å; A232-A236 VanDerWaalsContact O-N 3.13Å; A233-A236 PolarHBondContact O-N 2.92Å; L234-A236 VanDerWaalsContact C-N 3.29Å; L234-A236 PolarHBondContact O-N 3.32Å; A236-A239 PolarHBondContact O-N 3.4Å; A236-L240 WeakPolarHBondContact O-CG 3.37Å; A236-L240 PolarHBondContact O-N 3.23Å
237	A	83.4	Confident	78.9	Confident	50 Å²	50	104.1 Å²	104.1	41%	0.413	60%	0.599	S	S	.	*	H	α-helix	trans	-64.3	-40	176.3	0	0	0	0	0	112.1	A233 L234 S241	A233-A237 PolarHBondContact O-N 3.21Å; A233-A237 VanDerWaalsContact O-N 3.09Å; L234-A237 PolarHBondContact O-N 2.9Å; A237-S241 WeakPolarHBondContact O-CB 3.27Å; A237-S241 PolarHBondContact O-N 2.75Å; A237-S241 PolarHBondContact O-OG 2.98Å
238	L	87.1	Confident	79.4	Confident	92 Å²	92	104.2 Å²	104.2	48%	0.482	59%	0.593	S	S	.	*	H	α-helix	trans	-64.9	-43.3	174.7	-71.3	171.4	0	0	0	111.5	L234 Q235 L240 S241 L242	L234-L238 HydrophobicContact CG-CD1 4.31Å; L234-L238 WeakPolarHBondContact O-CG 3.49Å; L234-L238 PolarHBondContact O-N 3.31Å; Q235-L238 PolarHBondContact O-N 3.41Å; L238-L240 PolarHBondContact O-N 3.3Å; L238-S241 PolarHBondContact O-N 3Å; L238-L242 VanDerWaalsContact O-CG 3.27Å; L238-L242 WeakPolarHBondContact O-CG 3.16Å; L238-L242 PolarHBondContact O-N 3.16Å
239	A	86.9	Confident	80.1	Confident	57 Å²	57	105.1 Å²	105.1	47%	0.471	60%	0.601	S	S	.	*	H	α-helix	trans	-63.1	-40.9	178.2	0	0	0	0	0	112.7	Q235 A236 L242 A243	Q235-A239 WeakPolarHBondContact O-CB 3.37Å; Q235-A239 PolarHBondContact O-N 3.1Å; A236-A239 PolarHBondContact O-N 3.4Å; A239-L242 PolarHBondContact O-N 2.96Å; A239-A243 WeakPolarHBondContact O-CB 3.44Å; A239-A243 PolarHBondContact O-N 3.16Å; A239-A243 VanDerWaalsContact O-N 3.1Å
240	L	84.5	Confident	80.1	Confident	115 Å²	115	104.8 Å²	104.8	60%	0.602	60%	0.601	S	S	*	*	H	α-helix	trans	-64.6	-43.8	175.1	-75.2	165.8	0	0	0	111.6	A236 L238 L242 A243 E244	A236-L240 WeakPolarHBondContact O-CG 3.37Å; A236-L240 PolarHBondContact O-N 3.23Å; L238-L240 PolarHBondContact O-N 3.3Å; L240-L242 PolarHBondContact O-N 3.48Å; L240-A243 PolarHBondContact O-N 2.94Å; L240-A243 VanDerWaalsContact O-N 3.09Å; L240-E244 PolarHBondContact O-N 2.97Å
241	S	84.6	Confident	80.5	Confident	80 Å²	80	99.7 Å²	99.7	56%	0.559	59%	0.585	S	S	*	*	H	α-helix	trans	-63.3	-32	178.4	-56.5	0	0	0	0	112.5	A237 L238	A237-S241 WeakPolarHBondContact O-CB 3.27Å; A237-S241 PolarHBondContact O-N 2.75Å; A237-S241 PolarHBondContact O-OG 2.98Å; L238-S241 PolarHBondContact O-N 3Å
242	L	84.9	Confident	80.5	Confident	137 Å²	137	97.6 Å²	97.6	72%	0.717	58%	0.584	S	S	*	*	H	α-helix	trans	-79.6	-21.9	176.1	-70.8	168.9	0	0	0	113.2	L238 A239 L240	L238-L242 VanDerWaalsContact O-CG 3.27Å; L238-L242 WeakPolarHBondContact O-CG 3.16Å; L238-L242 PolarHBondContact O-N 3.16Å; A239-L242 PolarHBondContact O-N 2.96Å; L240-L242 PolarHBondContact O-N 3.48Å
243	A	81.1	Confident	80.4	Confident	78 Å²	78	101.2 Å²	101.2	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-86.4	-18.2	179.7	0	0	0	0	0	113.4	A239 L240 N245	A239-A243 WeakPolarHBondContact O-CB 3.44Å; A239-A243 PolarHBondContact O-N 3.16Å; A239-A243 VanDerWaalsContact O-N 3.1Å; L240-A243 PolarHBondContact O-N 2.94Å; L240-A243 VanDerWaalsContact O-N 3.09Å; A243-N245 VanDerWaalsContact C-N 3.34Å
244	E	69.3	Low	80.5	Confident	178 Å²	178	105.5 Å²	105.5	83%	0.832	61%	0.612	S	S	*	*			trans	-90.4	9.7	177.2	-72.3	-175.6	129.1	0	0	113.9	L240	L240-E244 PolarHBondContact O-N 2.97Å
245	N	51.5	Low	80.2	Confident	204 Å²	204	105.9 Å²	105.9	100%	1.091	62%	0.619	S	S	*	*			trans	-123.9	0	177	-164	61.5	0	0	0	111.4	A243	A243-N245 VanDerWaalsContact C-N 3.34Å

Retrieved 245 of 245 residues in 76.2 ms (Link to these results)

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