A0A087X5K1_POEFO Loading...

FKBP prolyl isomerase like

AlphaFold DB , UniProt , Accession A0A087X5K1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 233 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	42.6	Very low	250 Å²	250	117.6 Å²	117.6	100%	1.232	72%	0.72	S	S	*	*				0	105.9	0	-76.9	-166.7	-174.3	0	0	108.9
2	A	25.9	Very low	44.5	Very low	86 Å²	86	112.9 Å²	112.9	71%	0.711	69%	0.692	S	S	*	*			trans	-154.5	96.1	156.9	0	0	0	0	0	104.7	T4	A2-T4 PolarHBondContact O-N 3.36Å
3	V	32.2	Very low	45.7	Very low	149 Å²	149	114.2 Å²	114.2	90%	0.903	70%	0.703	S	S	*	*			trans	-77.9	81	169.2	-176.9	0	0	0	0	104.9	A5	V3-A5 PolarHBondContact O-N 3.35Å
4	T	33	Very low	47.1	Very low	120 Å²	120	109.1 Å²	109.1	74%	0.736	67%	0.668	S	S	*	*			trans	-64	117.9	165.1	39.5	0	0	0	0	106.4	A2 A6	A2-T4 PolarHBondContact O-N 3.36Å; T4-A6 PolarHBondContact O-N 3.26Å; T4-A6 VanDerWaalsContact O-N 3.12Å
5	A	34	Very low	48.1	Very low	86 Å²	86	110.1 Å²	110.1	71%	0.711	67%	0.667	S	S	*	*			trans	-42.1	121.5	173.7	0	0	0	0	0	109.1	V3 T7	V3-A5 PolarHBondContact O-N 3.35Å; A5-T7 VanDerWaalsContact C-N 3.26Å; A5-T7 PolarHBondContact O-N 3.24Å
6	A	36.9	Very low	49.2	Very low	72 Å²	72	106.6 Å²	106.6	60%	0.595	64%	0.638	S	S	*	*			trans	-60.9	95.9	174.7	0	0	0	0	0	107	T4	T4-A6 PolarHBondContact O-N 3.26Å; T4-A6 VanDerWaalsContact O-N 3.12Å
7	T	41.1	Very low	50	Low	111 Å²	111	109.5 Å²	109.5	68%	0.681	64%	0.635	S	S	*	*			trans	-50.8	141.1	163.5	35.3	0	0	0	0	107.3	A5 L9	A5-T7 VanDerWaalsContact C-N 3.26Å; A5-T7 PolarHBondContact O-N 3.24Å; T7-L9 VanDerWaalsContact C-N 3.25Å; T7-L9 PolarHBondContact O-N 3.21Å
8	D	46.8	Very low	50.5	Low	150 Å²	150	115 Å²	115	80%	0.802	65%	0.654	S	S	*	*			trans	-54	91.6	176	-84.2	-46.9	0	0	0	109.4	V10	D8-V10 PolarHBondContact O-N 3.24Å
9	L	56.4	Low	51.3	Low	115 Å²	115	115.9 Å²	115.9	60%	0.602	66%	0.657	S	S	*	*			trans	-65.9	113.7	179.1	-73.2	169.4	0	0	0	106.3	T7 P11 T31	T7-L9 VanDerWaalsContact C-N 3.25Å; T7-L9 PolarHBondContact O-N 3.21Å; L9-P11 WeakPolarHBondContact O-CD 3.48Å; L9-T31 HydrophobicContact CB-CG2 3.74Å; L9-T31 HydrophobicContact CD1-CG2 4.49Å
10	V	58.3	Low	52.2	Low	127 Å²	127	111.8 Å²	111.8	77%	0.77	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-61	123.4	175.5	-180	0	0	0	0	107.2	D8 T12	D8-V10 PolarHBondContact O-N 3.24Å; V10-T12 PolarHBondContact O-N 3.28Å
11	P	64	Low	53.2	Low	28 Å²	28	110 Å²	110	18%	0.182	63%	0.629	C	S	.	*	P	Polyproline II helix	trans	-56.6	135.4	179.4	-23	31.7	0	0	0	110.3	L9 R33	L9-P11 WeakPolarHBondContact O-CD 3.48Å; P11-R33 HydrophobicContact CG-CB 4.31Å
12	T	65.7	Low	54.9	Low	61 Å²	61	98.8 Å²	98.8	37%	0.374	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-65.1	130.6	178.1	-52.5	0	0	0	0	108.4	V10 I14 T31	V10-T12 PolarHBondContact O-N 3.28Å; T12-I14 WeakPolarHBondContact O-CG1 3.4Å; T12-I14 PolarHBondContact O-N 2.96Å; T12-T31 PolarHBondContact N-O 3.46Å
13	P	59.7	Low	57.3	Low	129 Å²	129	96.2 Å²	96.2	84%	0.838	55%	0.547	S	S	*	.			trans	-68	109.3	176.6	24.8	-30.9	0	0	0	109.4
14	I	65.3	Low	59.5	Low	43 Å²	43	90.3 Å²	90.3	22%	0.221	51%	0.511	C	S	.	.			trans	-99.5	122.4	178.9	-58.3	168.8	0	0	0	109.5	T12 R16 Q23 V24 L32	T12-I14 WeakPolarHBondContact O-CG1 3.4Å; T12-I14 PolarHBondContact O-N 2.96Å; I14-R16 PolarHBondContact O-N 3.04Å; I14-Q23 WeakPolarHBondContact CG2-O 3.44Å; I14-V24 HydrophobicContact CD1-CB 4.49Å; I14-V24 HydrophobicContact CD1-CG1 4.08Å; I14-L32 HydrophobicContact CD1-CD2 3.29Å
15	L	62.8	Low	61.5	Low	124 Å²	124	87.1 Å²	87.1	65%	0.649	49%	0.493	S	S	*	.			trans	-81.2	113.6	172	-176.8	66.2	0	0	0	109.2
16	R	64.9	Low	63.8	Low	55 Å²	55	89.4 Å²	89.4	21%	0.208	49%	0.492	C	S	.	.			trans	-64.8	138.9	172.6	-75	-166.1	140.8	-166	-9.8	110.9	I14 Q23 G37 Q38 D40	I14-R16 PolarHBondContact O-N 3.04Å; R16-Q23 HydrophobicContact CG-CB 4.24Å; R16-Q23 HydrophobicContact CG-CG 4.4Å; R16-Q23 VanDerWaalsContact CG-OE1 3.32Å; R16-G37 VanDerWaalsContact CZ-O 3.22Å; R16-G37 PolarHBondContact NH2-O 3.02Å; R16-Q38 PolarHBondContact NE-O 3.41Å; R16-Q38 PolarHBondContact NH2-O 3.46Å; R16-D40 IonicContact CZ-OD2 3.38Å; R16-D40 IonicContact NH1-OD2 3.6Å; R16-D40 IonicContact NH2-OD2 3.1Å; R16-D40 PolarHBondContact NH2-OD2 2.99Å
17	R	63	Low	65.9	Low	155 Å²	155	90.2 Å²	90.2	59%	0.585	51%	0.507	S	S	*	.			trans	-125.5	139.9	176.6	-48.8	-174.3	174.5	174.4	-0.1	110.9	D19 A20 Q23	R17-D19 WeakPolarHBondContact CB-OD1 3.48Å; R17-D19 PolarHBondContact O-N 3.46Å; R17-A20 HydrophobicContact CB-CB 4.04Å; R17-A20 PolarHBondContact O-N 3.45Å; R17-Q23 PolarHBondContact O-NE2 3.38Å; R17-Q23 PolarHBondContact O-OE1 3.28Å
18	Q	59.7	Low	67.9	Low	209 Å²	209	90.8 Å²	90.8	98%	0.977	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.4	-177.5	-69.9	-178.1	-6.3	0	0	113.1
19	D	65.4	Low	69.7	Low	132 Å²	132	91.2 Å²	91.2	71%	0.706	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-5	179.2	61	-26.7	0	0	0	113.7	R17	R17-D19 WeakPolarHBondContact CB-OD1 3.48Å; R17-D19 PolarHBondContact O-N 3.46Å
20	A	69.9	Low	71	Confident	33 Å²	33	87.6 Å²	87.6	27%	0.273	48%	0.479	S	S	.	.			trans	-108.6	106.8	-175.4	0	0	0	0	0	112	R17 L22 Q23	R17-A20 HydrophobicContact CB-CB 4.04Å; R17-A20 PolarHBondContact O-N 3.45Å; A20-L22 PolarHBondContact O-N 3.34Å; A20-Q23 PolarHBondContact O-N 2.95Å; A20-Q23 PolarHBondContact O-NE2 3.33Å
21	V	72.1	Confident	72.3	Confident	74 Å²	74	83.8 Å²	83.8	45%	0.448	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-43.3	-178.4	173.6	0	0	0	0	112.7	I41	V21-I41 HydrophobicContact CG1-CD1 3.29Å
22	L	75.1	Confident	73	Confident	15 Å²	15	84.4 Å²	84.4	8%	0.079	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-15.1	-174.7	-68.2	-179.7	0	0	0	114.4	A20 V24 L26 C39 I41 T42 P57 L64 A66	A20-L22 PolarHBondContact O-N 3.34Å; L22-V24 HydrophobicContact CB-CG2 4.04Å; L22-V24 PolarHBondContact O-N 3.47Å; L22-L26 HydrophobicContact CD1-CD2 3.96Å; L22-C39 WeakPolarHBondContact O-CB 3.5Å; L22-I41 HydrophobicContact CD2-CB 4.02Å; L22-I41 HydrophobicContact CD2-CD1 4.5Å; L22-I41 HydrophobicContact CD2-CG2 3.71Å; L22-T42 HydrophobicContact CD2-CG2 4.04Å; L22-P57 HydrophobicContact CD2-CG 4.44Å; L22-L64 HydrophobicContact CD1-CD1 4.09Å; L22-L64 HydrophobicContact CD2-CD1 4.46Å; L22-L64 HydrophobicContact CD2-CD2 3.85Å; L22-L64 HydrophobicContact CG-CD1 4.12Å; L22-L64 HydrophobicContact CG-CD2 4.4Å; L22-A66 HydrophobicContact CD1-CB 3.69Å
23	Q	76.8	Confident	73.5	Confident	33 Å²	33	85.7 Å²	85.7	15%	0.154	46%	0.456	C	S	.	.			trans	52.2	23.9	178.4	-55.8	-66.1	-21	0	0	114.5	I14 R16 R17 A20 Q38 C39	I14-Q23 WeakPolarHBondContact CG2-O 3.44Å; R16-Q23 HydrophobicContact CG-CB 4.24Å; R16-Q23 HydrophobicContact CG-CG 4.4Å; R16-Q23 VanDerWaalsContact CG-OE1 3.32Å; R17-Q23 PolarHBondContact O-NE2 3.38Å; R17-Q23 PolarHBondContact O-OE1 3.28Å; A20-Q23 PolarHBondContact O-N 2.95Å; A20-Q23 PolarHBondContact O-NE2 3.33Å; Q23-Q38 WeakPolarHBondContact CB-O 3.46Å; Q23-C39 HydrophobicContact CB-CB 4.12Å
24	V	78.4	Confident	74.4	Confident	25 Å²	25	83.6 Å²	83.6	15%	0.152	44%	0.437	C	S	.	.	S	Bend	trans	-132.7	149.1	175.5	-62.7	0	0	0	0	109.8	I14 L22 L26 L32 C39 T42	I14-V24 HydrophobicContact CD1-CB 4.49Å; I14-V24 HydrophobicContact CD1-CG1 4.08Å; L22-V24 HydrophobicContact CB-CG2 4.04Å; L22-V24 PolarHBondContact O-N 3.47Å; V24-L26 PolarHBondContact O-N 2.99Å; V24-L32 HydrophobicContact CG1-CD1 4.11Å; V24-L32 HydrophobicContact CG1-CD2 4.1Å; V24-C39 HydrophobicContact CG1-CB 3.67Å; V24-T42 HydrophobicContact CG2-CG2 4.08Å
25	P	76.1	Confident	74.5	Confident	53 Å²	53	82.5 Å²	82.5	34%	0.344	44%	0.436	S	S	.	.			trans	-61.3	136.3	173.7	25.6	-32.6	0	0	0	110.4
26	L	81	Confident	74.8	Confident	134 Å²	134	76.9 Å²	76.9	70%	0.702	41%	0.407	S	S	*	.	S	Bend	trans	-93.4	136.8	178	-60.7	178.8	0	0	0	109.9	L22 V24 D28	L22-L26 HydrophobicContact CD1-CD2 3.96Å; V24-L26 PolarHBondContact O-N 2.99Å; L26-D28 VanDerWaalsContact C-N 3.34Å
27	G	81.6	Confident	74.6	Confident	88 Å²	88	74.4 Å²	74.4	91%	0.907	40%	0.399	S	S	*	.	S	Bend	trans	90.4	-13	175.5	0	0	0	0	0	115.3
28	D	83.1	Confident	74.6	Confident	123 Å²	123	68 Å²	68	66%	0.658	38%	0.375	S	S	*	.	S	Bend	trans	-111.2	145	177.9	-65.2	-41.9	0	0	0	111.5	L26 T30	L26-D28 VanDerWaalsContact C-N 3.34Å; D28-T30 PolarHBondContact O-N 3.05Å
29	W	85.4	Confident	75	Confident	160 Å²	160	58.1 Å²	58.1	61%	0.606	33%	0.329	S	S	*	.			trans	-67.2	129.6	169	-74.4	103.8	0	0	0	110.1	E69 Q71	W29-E69 HydrophobicContact CH2-CB 4.12Å; W29-E69 HydrophobicContact CH2-CG 3.88Å; W29-Q71 HydrophobicContact CE3-CB 4.29Å; W29-Q71 HydrophobicContact CH2-CB 3.94Å; W29-Q71 HydrophobicContact CZ3-CB 3.65Å
30	T	83.6	Confident	75.3	Confident	38 Å²	38	56.7 Å²	56.7	23%	0.233	32%	0.322	C	S	.	.			trans	-128.8	141.6	179.4	-171.2	0	0	0	0	111.4	D28 L32	D28-T30 PolarHBondContact O-N 3.05Å; T30-L32 HydrophobicContact CG2-CD1 4.25Å; T30-L32 HydrophobicContact CG2-CD2 4.21Å; T30-L32 HydrophobicContact CG2-CG 4.04Å
31	T	84.3	Confident	75.6	Confident	47 Å²	47	56.2 Å²	56.2	29%	0.288	31%	0.314	S	S	.	.			trans	-91.8	121.2	171.9	-57.5	0	0	0	0	108.9	L9 T12	L9-T31 HydrophobicContact CB-CG2 3.74Å; L9-T31 HydrophobicContact CD1-CG2 4.49Å; T12-T31 PolarHBondContact N-O 3.46Å
32	L	79.2	Confident	76	Confident	41 Å²	41	52.9 Å²	52.9	22%	0.215	29%	0.294	C	S	.	.			trans	-116.1	153.1	177.5	-58.9	170.2	0	0	0	109.7	I14 V24 T30 L46	I14-L32 HydrophobicContact CD1-CD2 3.29Å; V24-L32 HydrophobicContact CG1-CD1 4.11Å; V24-L32 HydrophobicContact CG1-CD2 4.1Å; T30-L32 HydrophobicContact CG2-CD1 4.25Å; T30-L32 HydrophobicContact CG2-CD2 4.21Å; T30-L32 HydrophobicContact CG2-CG 4.04Å; L32-L46 HydrophobicContact CD1-CD1 4.06Å
33	R	77.2	Confident	76.3	Confident	89 Å²	89	52.5 Å²	52.5	34%	0.336	29%	0.292	S	S	.	.			trans	-116.4	114.3	168.4	-169.9	179.3	-110.6	177.9	6.6	108.3	P11 E36	P11-R33 HydrophobicContact CG-CB 4.31Å; R33-E36 HydrophobicContact CB-CG 3.9Å; R33-E36 VanDerWaalsContact CD-CD 3.49Å; R33-E36 WeakPolarHBondContact CD-OE1 3.5Å; R33-E36 HydrophobicContact CG-CG 4.05Å; R33-E36 IonicContact NE-OE1 3.95Å; R33-E36 IonicContact NH1-OE1 3.54Å; R33-E36 WeakPolarHBondContact O-CB 3.38Å; R33-E36 WeakPolarHBondContact O-CG 3.33Å; R33-E36 PolarHBondContact O-N 3.21Å
34	L	77.1	Confident	76.5	Confident	84 Å²	84	53.9 Å²	53.9	44%	0.44	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	140.6	-178.9	-60	-175.3	0	0	0	110.3	E36 E43 L46 E47	L34-E36 VanDerWaalsContact C-N 3.31Å; L34-E43 HydrophobicContact CD2-CB 4.15Å; L34-E43 HydrophobicContact CD2-CG 3.85Å; L34-L46 HydrophobicContact CD1-CB 4.38Å; L34-L46 HydrophobicContact CD2-CB 3.84Å; L34-L46 HydrophobicContact CD2-CD1 3.95Å; L34-E47 HydrophobicContact CD1-CG 4.34Å
35	G	68.5	Low	76.8	Confident	20 Å²	20	53.8 Å²	53.8	21%	0.206	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	17.7	-177.3	0	0	0	0	0	113.9	E43 R116	G35-E43 PolarHBondContact N-OE2 2.87Å; G35-R116 VanDerWaalsContact C-CZ 3.46Å; G35-R116 VanDerWaalsContact C-NH1 3.33Å; G35-R116 VanDerWaalsContact CA-NH1 3.3Å; G35-R116 VanDerWaalsContact O-CD 3.25Å; G35-R116 WeakPolarHBondContact O-CD 3.35Å; G35-R116 PolarHBondContact O-NE 3.02Å; G35-R116 VanDerWaalsContact O-NE 3.09Å; G35-R116 PolarHBondContact O-NH1 2.78Å
36	E	67.6	Low	77.3	Confident	7 Å²	7	52.3 Å²	52.3	3%	0.033	30%	0.298	C	S	.	.	S	Bend	trans	-97.7	1.7	166.7	-65.3	-162	166.5	0	0	113.2	R33 L34 Q38 R97 R101	R33-E36 HydrophobicContact CB-CG 3.9Å; R33-E36 VanDerWaalsContact CD-CD 3.49Å; R33-E36 WeakPolarHBondContact CD-OE1 3.5Å; R33-E36 HydrophobicContact CG-CG 4.05Å; R33-E36 IonicContact NE-OE1 3.95Å; R33-E36 IonicContact NH1-OE1 3.54Å; R33-E36 WeakPolarHBondContact O-CB 3.38Å; R33-E36 WeakPolarHBondContact O-CG 3.33Å; R33-E36 PolarHBondContact O-N 3.21Å; L34-E36 VanDerWaalsContact C-N 3.31Å; E36-Q38 HydrophobicContact CB-CG 3.92Å; E36-Q38 PolarHBondContact O-N 3.19Å; E36-Q38 PolarHBondContact OE2-NE2 3.22Å; E36-R97 IonicContact OE1-CZ 2.94Å; E36-R97 IonicContact OE1-NH1 2.62Å; E36-R97 PolarHBondContact OE1-NH1 3.16Å; E36-R97 IonicContact OE1-NH2 2.78Å; E36-R97 PolarHBondContact OE1-NH2 2.99Å; E36-R97 IonicContact OE2-CZ 3.93Å; E36-R97 IonicContact OE2-NH1 2.69Å; E36-R97 IonicContact OE2-NH2 3.89Å; E36-R97 PolarHBondContact OE2-NH2 3.44Å; E36-R101 PolarHBondContact O-NH1 3.35Å; E36-R101 PolarHBondContact O-NH2 3.11Å
37	G	61.4	Low	77.4	Confident	3 Å²	3	52.7 Å²	52.7	3%	0.031	30%	0.296	C	S	.	.	S	Bend	trans	62.6	30.9	177.2	0	0	0	0	0	111.8	R16 E43	R16-G37 VanDerWaalsContact CZ-O 3.22Å; R16-G37 PolarHBondContact NH2-O 3.02Å; G37-E43 PolarHBondContact N-OE1 3.39Å
38	Q	62.9	Low	77.5	Confident	21 Å²	21	51.7 Å²	51.7	10%	0.098	29%	0.286	C	S	.	.	S	Bend	trans	-75.4	-34.3	179.4	-64.6	-178.9	-0.7	0	0	108.9	R16 Q23 E36 E43	R16-Q38 PolarHBondContact NE-O 3.41Å; R16-Q38 PolarHBondContact NH2-O 3.46Å; Q23-Q38 WeakPolarHBondContact CB-O 3.46Å; E36-Q38 HydrophobicContact CB-CG 3.92Å; E36-Q38 PolarHBondContact O-N 3.19Å; E36-Q38 PolarHBondContact OE2-NE2 3.22Å; Q38-E43 PolarHBondContact N-OE1 2.92Å
39	C	69.1	Low	77.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.			trans	-163.5	105.3	-174.7	48.4	0	0	0	0	112.4	L22 Q23 V24 I41 T42 E43	L22-C39 WeakPolarHBondContact O-CB 3.5Å; Q23-C39 HydrophobicContact CB-CB 4.12Å; V24-C39 HydrophobicContact CG1-CB 3.67Å; C39-I41 PolarHBondContact O-N 3.41Å; C39-T42 WeakPolarHBondContact CB-OG1 3.36Å; C39-T42 PolarHBondContact O-OG1 3.32Å; C39-T42 PolarHBondContact SG-OG1 3.48Å; C39-E43 PolarHBondContact N-OE1 2.99Å; C39-E43 WeakPolarHBondContact O-CB 3.44Å; C39-E43 WeakPolarHBondContact O-CG 3.08Å; C39-E43 PolarHBondContact O-N 2.96Å
40	D	70.5	Confident	78	Confident	103 Å²	103	48 Å²	48	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-69.1	-35.1	-169	-55.3	-73.2	0	0	0	113.3	R16 A44	R16-D40 IonicContact CZ-OD2 3.38Å; R16-D40 IonicContact NH1-OD2 3.6Å; R16-D40 IonicContact NH2-OD2 3.1Å; R16-D40 PolarHBondContact NH2-OD2 2.99Å; D40-A44 WeakPolarHBondContact O-CB 3.47Å; D40-A44 PolarHBondContact O-N 3.16Å
41	I	77.6	Confident	78.3	Confident	22 Å²	22	49 Å²	49	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-75.4	-48	-178.9	-65.3	166.9	0	0	0	111.2	V21 L22 C39 A44 C45 P57 Y59 L64	V21-I41 HydrophobicContact CG1-CD1 3.29Å; L22-I41 HydrophobicContact CD2-CB 4.02Å; L22-I41 HydrophobicContact CD2-CD1 4.5Å; L22-I41 HydrophobicContact CD2-CG2 3.71Å; C39-I41 PolarHBondContact O-N 3.41Å; I41-A44 PolarHBondContact O-N 2.89Å; I41-C45 PolarHBondContact O-N 3.1Å; I41-C45 VanDerWaalsContact O-N 3.11Å; I41-C45 PolarHBondContact O-SG 3.02Å; I41-C45 VanDerWaalsContact O-SG 3.35Å; I41-P57 HydrophobicContact CG2-CB 3.64Å; I41-Y59 HydrophobicContact CD1-CD1 4.41Å; I41-Y59 HydrophobicContact CD1-CD2 3.81Å; I41-Y59 HydrophobicContact CD1-CE2 4.42Å; I41-Y59 HydrophobicContact CD1-CG 3.79Å; I41-Y59 HydrophobicContact CG1-CD2 3.72Å; I41-Y59 HydrophobicContact CG1-CE2 4.21Å; I41-Y59 HydrophobicContact CG1-CG 4.22Å; I41-L64 HydrophobicContact CG2-CD2 4.49Å
42	T	80.6	Confident	78.5	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-72.2	-35.5	179.3	44.6	0	0	0	0	111.8	L22 V24 C39 A44 C45 L46 V68	L22-T42 HydrophobicContact CD2-CG2 4.04Å; V24-T42 HydrophobicContact CG2-CG2 4.08Å; C39-T42 WeakPolarHBondContact CB-OG1 3.36Å; C39-T42 PolarHBondContact O-OG1 3.32Å; C39-T42 PolarHBondContact SG-OG1 3.48Å; T42-A44 VanDerWaalsContact C-N 3.32Å; T42-A44 PolarHBondContact O-N 2.9Å; T42-C45 PolarHBondContact O-N 3.37Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 WeakPolarHBondContact O-CG 3.31Å; T42-L46 PolarHBondContact O-N 2.91Å; T42-V68 HydrophobicContact CG2-CG2 3.95Å
43	E	81.1	Confident	79.1	Confident	8 Å²	8	50.9 Å²	50.9	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-46	172.5	-76.4	178	-146.9	0	0	110.4	L34 G35 G37 Q38 C39 C45 L46 E47	L34-E43 HydrophobicContact CD2-CB 4.15Å; L34-E43 HydrophobicContact CD2-CG 3.85Å; G35-E43 PolarHBondContact N-OE2 2.87Å; G37-E43 PolarHBondContact N-OE1 3.39Å; Q38-E43 PolarHBondContact N-OE1 2.92Å; C39-E43 PolarHBondContact N-OE1 2.99Å; C39-E43 WeakPolarHBondContact O-CB 3.44Å; C39-E43 WeakPolarHBondContact O-CG 3.08Å; C39-E43 PolarHBondContact O-N 2.96Å; E43-C45 VanDerWaalsContact C-N 3.34Å; E43-C45 PolarHBondContact O-N 3.3Å; E43-L46 PolarHBondContact O-N 2.95Å; E43-L46 VanDerWaalsContact O-N 3.16Å; E43-E47 WeakPolarHBondContact O-CG 3.14Å; E43-E47 PolarHBondContact O-N 3.03Å
44	A	80.1	Confident	79.8	Confident	62 Å²	62	53.2 Å²	53.2	51%	0.512	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-37.5	177.2	0	0	0	0	0	113.3	D40 I41 T42	D40-A44 WeakPolarHBondContact O-CB 3.47Å; D40-A44 PolarHBondContact O-N 3.16Å; I41-A44 PolarHBondContact O-N 2.89Å; T42-A44 VanDerWaalsContact C-N 3.32Å; T42-A44 PolarHBondContact O-N 2.9Å
45	C	84.9	Confident	80.4	Confident	22 Å²	22	51.1 Å²	51.1	15%	0.149	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-48.3	172.5	-68.9	0	0	0	0	111.2	I41 T42 E43 E47 G48 M49	I41-C45 PolarHBondContact O-N 3.1Å; I41-C45 VanDerWaalsContact O-N 3.11Å; I41-C45 PolarHBondContact O-SG 3.02Å; I41-C45 VanDerWaalsContact O-SG 3.35Å; T42-C45 PolarHBondContact O-N 3.37Å; E43-C45 VanDerWaalsContact C-N 3.34Å; E43-C45 PolarHBondContact O-N 3.3Å; C45-E47 VanDerWaalsContact C-N 3.32Å; C45-E47 PolarHBondContact O-N 3.09Å; C45-G48 PolarHBondContact O-N 3.49Å; C45-M49 HydrophobicContact CB-SD 4.32Å; C45-M49 VanDerWaalsContact O-CG 3.22Å; C45-M49 WeakPolarHBondContact O-CG 3.48Å
46	L	86.7	Confident	81.3	Confident	22 Å²	22	57.6 Å²	57.6	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-67.2	-30	-174.2	-69.4	173.3	0	0	0	113.1	L32 L34 T42 E43 G48 M49 V68 L70	L32-L46 HydrophobicContact CD1-CD1 4.06Å; L34-L46 HydrophobicContact CD1-CB 4.38Å; L34-L46 HydrophobicContact CD2-CB 3.84Å; L34-L46 HydrophobicContact CD2-CD1 3.95Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 WeakPolarHBondContact O-CG 3.31Å; T42-L46 PolarHBondContact O-N 2.91Å; E43-L46 PolarHBondContact O-N 2.95Å; E43-L46 VanDerWaalsContact O-N 3.16Å; L46-G48 PolarHBondContact O-N 3.29Å; L46-M49 HydrophobicContact CD2-SD 3.95Å; L46-M49 PolarHBondContact O-N 3.34Å; L46-V68 HydrophobicContact CD2-CG1 3.94Å; L46-V68 HydrophobicContact CG-CG1 4.37Å; L46-L70 HydrophobicContact CD2-CB 3.91Å; L46-L70 HydrophobicContact CD2-CD1 4.05Å; L46-L70 HydrophobicContact CD2-CD2 4.4Å; L46-L70 HydrophobicContact CD2-CG 4.32Å
47	E	83.9	Confident	82	Confident	143 Å²	143	57.5 Å²	57.5	67%	0.668	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-28	177.7	-79.6	177	-177.9	0	0	113.6	L34 E43 C45	L34-E47 HydrophobicContact CD1-CG 4.34Å; E43-E47 WeakPolarHBondContact O-CG 3.14Å; E43-E47 PolarHBondContact O-N 3.03Å; C45-E47 VanDerWaalsContact C-N 3.32Å; C45-E47 PolarHBondContact O-N 3.09Å
48	G	83.3	Confident	82.9	Confident	67 Å²	67	62.6 Å²	62.6	69%	0.691	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.7	179.5	0	0	0	0	0	115.3	C45 L46	C45-G48 PolarHBondContact O-N 3.49Å; L46-G48 PolarHBondContact O-N 3.29Å
49	M	89.2	Confident	83.4	Confident	20 Å²	20	68.2 Å²	68.2	10%	0.099	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-90.8	150.6	-169.5	-73	169.8	76.1	0	0	113.1	C45 L46 E53 C55 V68 L70	C45-M49 HydrophobicContact CB-SD 4.32Å; C45-M49 VanDerWaalsContact O-CG 3.22Å; C45-M49 WeakPolarHBondContact O-CG 3.48Å; L46-M49 HydrophobicContact CD2-SD 3.95Å; L46-M49 PolarHBondContact O-N 3.34Å; M49-E53 WeakPolarHBondContact CA-OE2 3.26Å; M49-E53 HydrophobicContact CB-CB 4.45Å; M49-E53 VanDerWaalsContact CE-C 3.49Å; M49-E53 HydrophobicContact CE-CB 4.18Å; M49-E53 WeakPolarHBondContact CE-O 3.43Å; M49-C55 HydrophobicContact CE-CB 3.91Å; M49-C55 HydrophobicContact CG-CB 4.31Å; M49-C55 HydrophobicContact SD-CB 3.6Å; M49-V68 WeakPolarHBondContact CE-O 3.48Å; M49-V68 HydrophobicContact SD-CG1 4.44Å; M49-L70 HydrophobicContact CB-CB 4.28Å; M49-L70 HydrophobicContact CB-CD2 3.79Å; M49-L70 HydrophobicContact CE-CB 3.77Å
50	R	88.9	Confident	83.6	Confident	186 Å²	186	71.6 Å²	71.6	70%	0.702	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-96.5	158.1	165.7	-53.1	178.8	179.2	-127.6	-3.3	110.6	G52 E53	R50-G52 PolarHBondContact O-N 3.48Å; R50-E53 VanDerWaalsContact CB-CD 3.49Å; R50-E53 HydrophobicContact CB-CG 3.93Å; R50-E53 WeakPolarHBondContact CB-OE1 3.47Å; R50-E53 VanDerWaalsContact CD-OE1 3.3Å; R50-E53 WeakPolarHBondContact CD-OE1 3.47Å; R50-E53 WeakPolarHBondContact CG-OE1 3.46Å; R50-E53 VanDerWaalsContact N-CD 3.32Å; R50-E53 PolarHBondContact N-OE2 3.41Å; R50-E53 VanDerWaalsContact O-CB 3.29Å; R50-E53 WeakPolarHBondContact O-CB 3.29Å; R50-E53 PolarHBondContact O-N 3.41Å
51	A	89.8	Confident	83.8	Confident	59 Å²	59	74.9 Å²	74.9	49%	0.488	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	128.6	173.3	0	0	0	0	0	110.7
52	G	88.9	Confident	83.3	Confident	50 Å²	50	78.3 Å²	78.3	52%	0.515	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-6.2	-173.8	0	0	0	0	0	115.1	R50 L70	R50-G52 PolarHBondContact O-N 3.48Å; G52-L70 WeakPolarHBondContact CA-O 3.48Å; G52-L70 PolarHBondContact N-O 3.08Å
53	E	91.4	Very high	82.7	Confident	77 Å²	77	84 Å²	84	36%	0.36	49%	0.487	S	S	.	.			trans	-78.1	152.5	179.4	-70.2	-178.1	174.9	0	0	112.4	M49 R50 E69 L70	M49-E53 WeakPolarHBondContact CA-OE2 3.26Å; M49-E53 HydrophobicContact CB-CB 4.45Å; M49-E53 VanDerWaalsContact CE-C 3.49Å; M49-E53 HydrophobicContact CE-CB 4.18Å; M49-E53 WeakPolarHBondContact CE-O 3.43Å; R50-E53 VanDerWaalsContact CB-CD 3.49Å; R50-E53 HydrophobicContact CB-CG 3.93Å; R50-E53 WeakPolarHBondContact CB-OE1 3.47Å; R50-E53 VanDerWaalsContact CD-OE1 3.3Å; R50-E53 WeakPolarHBondContact CD-OE1 3.47Å; R50-E53 WeakPolarHBondContact CG-OE1 3.46Å; R50-E53 VanDerWaalsContact N-CD 3.32Å; R50-E53 PolarHBondContact N-OE2 3.41Å; R50-E53 VanDerWaalsContact O-CB 3.29Å; R50-E53 WeakPolarHBondContact O-CB 3.29Å; R50-E53 PolarHBondContact O-N 3.41Å; E53-E69 WeakPolarHBondContact O-CA 3.38Å; E53-L70 PolarHBondContact O-N 2.94Å
54	K	92.1	Very high	82.4	Confident	137 Å²	137	85.9 Å²	85.9	60%	0.596	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.7	174.5	-57.8	-172.8	-167	-133.8	0	109.1	T67 V68 E69	K54-T67 HydrophobicContact CB-CG2 4.09Å; K54-T67 HydrophobicContact CD-CG2 4.48Å; K54-V68 CarbonylContact C-O 3.55Å; K54-V68 VanDerWaalsContact CA-O 3.3Å; K54-V68 WeakPolarHBondContact CA-O 3.37Å; K54-E69 VanDerWaalsContact CE-OE2 3.24Å; K54-E69 WeakPolarHBondContact CE-OE2 3.35Å; K54-E69 HydrophobicContact CG-CB 4.17Å; K54-E69 HydrophobicContact CG-CG 3.95Å; K54-E69 IonicContact NZ-OE1 2.77Å; K54-E69 IonicContact NZ-OE2 2.86Å; K54-E69 PolarHBondContact NZ-OE2 3.28Å
55	C	89.6	Confident	82.4	Confident	41 Å²	41	90 Å²	90	28%	0.277	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	140.5	-179.4	-179.3	0	0	0	0	109.7	M49 P57 V68	M49-C55 HydrophobicContact CE-CB 3.91Å; M49-C55 HydrophobicContact CG-CB 4.31Å; M49-C55 HydrophobicContact SD-CB 3.6Å; C55-P57 WeakPolarHBondContact O-CD 3.39Å; C55-V68 PolarHBondContact N-O 3.07Å; C55-V68 PolarHBondContact O-N 2.94Å
56	E	87.8	Confident	82.3	Confident	155 Å²	155	90 Å²	90	72%	0.724	52%	0.517	S	S	*	.			trans	-103.7	103.8	173	-67	-177.7	173.1	0	0	108.3	S58	E56-S58 PolarHBondContact O-N 3.09Å
57	P	83.5	Confident	82.3	Confident	6 Å²	6	93 Å²	93	4%	0.039	54%	0.537	C	S	.	.			trans	-63.2	129.2	178.5	21.8	-33.3	0	0	0	111.6	L22 I41 C55 L64 A66 V68	L22-P57 HydrophobicContact CD2-CG 4.44Å; I41-P57 HydrophobicContact CG2-CB 3.64Å; C55-P57 WeakPolarHBondContact O-CD 3.39Å; P57-L64 HydrophobicContact CB-CD2 3.88Å; P57-L64 HydrophobicContact CG-CD2 3.82Å; P57-L64 WeakPolarHBondContact O-CD2 3.34Å; P57-A66 WeakPolarHBondContact CD-O 3.4Å; P57-A66 HydrophobicContact CG-CB 4.28Å; P57-V68 HydrophobicContact CG-CG2 4.04Å
58	S	79.1	Confident	82.5	Confident	109 Å²	109	87.1 Å²	87.1	76%	0.762	51%	0.51	S	S	*	.			trans	-111.5	129.4	165.6	63.9	0	0	0	0	109.8	E56	E56-S58 PolarHBondContact O-N 3.09Å
59	Y	72.9	Confident	82.9	Confident	140 Å²	140	87.7 Å²	87.7	55%	0.549	50%	0.495	S	S	.	.			trans	-129	98.6	177.1	-169.8	-92.2	0	0	0	111.2	I41 L62	I41-Y59 HydrophobicContact CD1-CD1 4.41Å; I41-Y59 HydrophobicContact CD1-CD2 3.81Å; I41-Y59 HydrophobicContact CD1-CE2 4.42Å; I41-Y59 HydrophobicContact CD1-CG 3.79Å; I41-Y59 HydrophobicContact CG1-CD2 3.72Å; I41-Y59 HydrophobicContact CG1-CE2 4.21Å; I41-Y59 HydrophobicContact CG1-CG 4.22Å; Y59-L62 HydrophobicContact CD1-CD1 4.07Å; Y59-L62 WeakPolarHBondContact O-CB 2.97Å; Y59-L62 PolarHBondContact O-N 3.19Å
60	G	74.8	Confident	82.9	Confident	70 Å²	70	87.7 Å²	87.7	72%	0.722	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-140	-175	0	0	0	0	0	111.9	L62	G60-L62 VanDerWaalsContact C-N 3.32Å
61	D	73.1	Confident	83.1	Confident	172 Å²	172	85.2 Å²	85.2	92%	0.92	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	11	179.2	-58.6	-39.2	0	0	0	113.4
62	L	68.1	Low	83	Confident	94 Å²	94	85.9 Å²	85.9	49%	0.492	50%	0.497	S	S	.	.			trans	-72.7	132	179	-70	174	0	0	0	110.1	Y59 G60 L64	Y59-L62 HydrophobicContact CD1-CD1 4.07Å; Y59-L62 WeakPolarHBondContact O-CB 2.97Å; Y59-L62 PolarHBondContact O-N 3.19Å; G60-L62 VanDerWaalsContact C-N 3.32Å; L62-L64 PolarHBondContact O-N 3.44Å
63	P	67.7	Low	83	Confident	124 Å²	124	89.4 Å²	89.4	81%	0.805	50%	0.498	S	S	*	.			trans	-74.5	74.8	174.2	31.8	-34.4	0	0	0	109.6
64	L	74	Confident	82.7	Confident	47 Å²	47	91 Å²	91	25%	0.246	51%	0.513	C	S	.	.			trans	-88.8	110.9	174.3	-176.8	64.8	0	0	0	108.8	L22 I41 P57 L62 A66	L22-L64 HydrophobicContact CD1-CD1 4.09Å; L22-L64 HydrophobicContact CD2-CD1 4.46Å; L22-L64 HydrophobicContact CD2-CD2 3.85Å; L22-L64 HydrophobicContact CG-CD1 4.12Å; L22-L64 HydrophobicContact CG-CD2 4.4Å; I41-L64 HydrophobicContact CG2-CD2 4.49Å; P57-L64 HydrophobicContact CB-CD2 3.88Å; P57-L64 HydrophobicContact CG-CD2 3.82Å; P57-L64 WeakPolarHBondContact O-CD2 3.34Å; L62-L64 PolarHBondContact O-N 3.44Å; L64-A66 HydrophobicContact CD1-CB 4.31Å; L64-A66 HydrophobicContact CG-CB 4.36Å
65	V	80.6	Confident	82.1	Confident	149 Å²	149	89.2 Å²	89.2	90%	0.903	52%	0.516	S	S	*	.			trans	-108.2	88.8	173	-173.8	0	0	0	0	107.6
66	A	83	Confident	81.3	Confident	22 Å²	22	90.4 Å²	90.4	18%	0.182	54%	0.535	C	S	.	.			trans	-140.4	150.5	176.4	0	0	0	0	0	109.6	L22 P57 L64	L22-A66 HydrophobicContact CD1-CB 3.69Å; P57-A66 WeakPolarHBondContact CD-O 3.4Å; P57-A66 HydrophobicContact CG-CB 4.28Å; L64-A66 HydrophobicContact CD1-CB 4.31Å; L64-A66 HydrophobicContact CG-CB 4.36Å
67	T	87	Confident	80.7	Confident	86 Å²	86	89 Å²	89	53%	0.528	53%	0.526	S	S	.	.			trans	-119.3	125.2	171.1	-49.5	0	0	0	0	107.8	K54	K54-T67 HydrophobicContact CB-CG2 4.09Å; K54-T67 HydrophobicContact CD-CG2 4.48Å
68	V	88.6	Confident	80.2	Confident	19 Å²	19	93.4 Å²	93.4	12%	0.115	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.8	174.7	179.9	0	0	0	0	107.6	T42 L46 M49 K54 C55 P57	T42-V68 HydrophobicContact CG2-CG2 3.95Å; L46-V68 HydrophobicContact CD2-CG1 3.94Å; L46-V68 HydrophobicContact CG-CG1 4.37Å; M49-V68 WeakPolarHBondContact CE-O 3.48Å; M49-V68 HydrophobicContact SD-CG1 4.44Å; K54-V68 CarbonylContact C-O 3.55Å; K54-V68 VanDerWaalsContact CA-O 3.3Å; K54-V68 WeakPolarHBondContact CA-O 3.37Å; C55-V68 PolarHBondContact N-O 3.07Å; C55-V68 PolarHBondContact O-N 2.94Å; P57-V68 HydrophobicContact CG-CG2 4.04Å
69	E	90.8	Very high	79.6	Confident	78 Å²	78	91.5 Å²	91.5	36%	0.364	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.4	176.7	-176.6	170.3	168.8	0	0	109.6	W29 E53 K54	W29-E69 HydrophobicContact CH2-CB 4.12Å; W29-E69 HydrophobicContact CH2-CG 3.88Å; E53-E69 WeakPolarHBondContact O-CA 3.38Å; K54-E69 VanDerWaalsContact CE-OE2 3.24Å; K54-E69 WeakPolarHBondContact CE-OE2 3.35Å; K54-E69 HydrophobicContact CG-CB 4.17Å; K54-E69 HydrophobicContact CG-CG 3.95Å; K54-E69 IonicContact NZ-OE1 2.77Å; K54-E69 IonicContact NZ-OE2 2.86Å; K54-E69 PolarHBondContact NZ-OE2 3.28Å
70	L	90.1	Very high	79.7	Confident	20 Å²	20	93.3 Å²	93.3	11%	0.105	54%	0.539	C	S	.	.			trans	-94.7	104.8	176.7	176.2	53	0	0	0	109.4	L46 M49 G52 E53 A72 F73	L46-L70 HydrophobicContact CD2-CB 3.91Å; L46-L70 HydrophobicContact CD2-CD1 4.05Å; L46-L70 HydrophobicContact CD2-CD2 4.4Å; L46-L70 HydrophobicContact CD2-CG 4.32Å; M49-L70 HydrophobicContact CB-CB 4.28Å; M49-L70 HydrophobicContact CB-CD2 3.79Å; M49-L70 HydrophobicContact CE-CB 3.77Å; G52-L70 WeakPolarHBondContact CA-O 3.48Å; G52-L70 PolarHBondContact N-O 3.08Å; E53-L70 PolarHBondContact O-N 2.94Å; L70-A72 WeakPolarHBondContact CD1-O 3.36Å; L70-F73 HydrophobicContact CD1-CB 4.39Å; L70-F73 HydrophobicContact CD2-CD1 4.14Å
71	Q	91.5	Very high	79.9	Confident	134 Å²	134	95.3 Å²	95.3	63%	0.626	53%	0.529	S	S	*	.			trans	-69.3	-55	179.3	-172.8	178.2	36.9	0	0	112.3	W29	W29-Q71 HydrophobicContact CE3-CB 4.29Å; W29-Q71 HydrophobicContact CH2-CB 3.94Å; W29-Q71 HydrophobicContact CZ3-CB 3.65Å
72	A	89	Confident	80.4	Confident	73 Å²	73	88.2 Å²	88.2	60%	0.603	49%	0.491	S	S	*	.			trans	-158	157.8	-179.4	0	0	0	0	0	109.2	L70	L70-A72 WeakPolarHBondContact CD1-O 3.36Å
73	F	88.4	Confident	81.3	Confident	125 Å²	125	86.5 Å²	86.5	55%	0.548	49%	0.485	S	S	.	.			trans	-141.9	153	170.4	74.3	-79.3	0	0	0	110.4	L70 P75	L70-F73 HydrophobicContact CD1-CB 4.39Å; L70-F73 HydrophobicContact CD2-CD1 4.14Å; F73-P75 HydrophobicContact CD2-CG 4.31Å; F73-P75 HydrophobicContact CE2-CB 4.42Å; F73-P75 HydrophobicContact CE2-CG 3.82Å
74	T	84.5	Confident	82.2	Confident	110 Å²	110	84.5 Å²	84.5	68%	0.675	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-103.6	121.5	166.8	-53	0	0	0	0	106.9	G76	T74-G76 PolarHBondContact O-N 3.46Å
75	P	79.4	Confident	82.8	Confident	100 Å²	100	86.8 Å²	86.8	65%	0.649	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-53.4	129.5	174.8	-24.3	32.1	0	0	0	110.6	F73	F73-P75 HydrophobicContact CD2-CG 4.31Å; F73-P75 HydrophobicContact CE2-CB 4.42Å; F73-P75 HydrophobicContact CE2-CG 3.82Å
76	G	74.2	Confident	83	Confident	65 Å²	65	81.8 Å²	81.8	67%	0.67	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-70.8	160.1	171.7	0	0	0	0	0	111	T74	T74-G76 PolarHBondContact O-N 3.46Å
77	K	74.3	Confident	83.2	Confident	127 Å²	127	82 Å²	82	55%	0.552	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-74.7	129.9	166.4	-70.8	-174.4	-177.9	-173.4	0	109.3	E81 M82 E86	K77-E81 WeakPolarHBondContact CA-OE2 3.4Å; K77-M82 HydrophobicContact CB-CG 4.42Å; K77-E86 IonicContact NZ-OE1 2.65Å; K77-E86 PolarHBondContact NZ-OE1 2.99Å
78	E	73.6	Confident	83.3	Confident	97 Å²	97	79.9 Å²	79.9	45%	0.453	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-72.1	157	176.3	-75.4	-68.4	170.8	0	0	111.8	W80 E81 M82	E78-W80 HydrophobicContact CB-CD2 3.72Å; E78-W80 HydrophobicContact CB-CE3 3.96Å; E78-W80 HydrophobicContact CB-CG 4.44Å; E78-W80 HydrophobicContact CB-CH2 3.61Å; E78-W80 HydrophobicContact CB-CZ2 3.36Å; E78-W80 HydrophobicContact CB-CZ3 3.9Å; E78-W80 HydrophobicContact CG-CH2 3.5Å; E78-W80 HydrophobicContact CG-CZ2 3.39Å; E78-W80 HydrophobicContact CG-CZ3 4.2Å; E78-W80 PolarHBondContact O-N 3.46Å; E78-E81 HydrophobicContact CB-CG 4.08Å; E78-E81 PolarHBondContact N-OE2 3.23Å; E78-E81 WeakPolarHBondContact O-CB 3.42Å; E78-E81 PolarHBondContact O-N 3.47Å; E78-M82 PolarHBondContact O-N 3.22Å
79	S	66.4	Low	83.2	Confident	69 Å²	69	84.9 Å²	84.9	48%	0.483	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.7	-173.8	65.4	0	0	0	0	113.9	R87	S79-R87 VanDerWaalsContact O-CZ 3.31Å; S79-R87 PolarHBondContact O-NE 3.19Å; S79-R87 VanDerWaalsContact O-NE 3.16Å; S79-R87 PolarHBondContact O-NH2 2.94Å
80	W	73.8	Confident	83.1	Confident	178 Å²	178	84.3 Å²	84.3	67%	0.674	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-24.8	176	56.3	84.9	0	0	0	113.8	E78 M82	E78-W80 HydrophobicContact CB-CD2 3.72Å; E78-W80 HydrophobicContact CB-CE3 3.96Å; E78-W80 HydrophobicContact CB-CG 4.44Å; E78-W80 HydrophobicContact CB-CH2 3.61Å; E78-W80 HydrophobicContact CB-CZ2 3.36Å; E78-W80 HydrophobicContact CB-CZ3 3.9Å; E78-W80 HydrophobicContact CG-CH2 3.5Å; E78-W80 HydrophobicContact CG-CZ2 3.39Å; E78-W80 HydrophobicContact CG-CZ3 4.2Å; E78-W80 PolarHBondContact O-N 3.46Å; W80-M82 VanDerWaalsContact C-N 3.28Å
81	E	80.5	Confident	83.1	Confident	112 Å²	112	83.6 Å²	83.6	52%	0.523	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.2	178.5	-57.7	179.5	143.8	0	0	112.3	K77 E78	K77-E81 WeakPolarHBondContact CA-OE2 3.4Å; E78-E81 HydrophobicContact CB-CG 4.08Å; E78-E81 PolarHBondContact N-OE2 3.23Å; E78-E81 WeakPolarHBondContact O-CB 3.42Å; E78-E81 PolarHBondContact O-N 3.47Å
82	M	82	Confident	83.1	Confident	23 Å²	23	82.3 Å²	82.3	11%	0.113	44%	0.438	C	S	.	.	S	Bend	trans	-70.9	138.6	179.5	-65.5	-176.2	144.2	0	0	112.1	K77 E78 W80 R87 W90	K77-M82 HydrophobicContact CB-CG 4.42Å; E78-M82 PolarHBondContact O-N 3.22Å; W80-M82 VanDerWaalsContact C-N 3.28Å; M82-R87 HydrophobicContact CB-CG 3.65Å; M82-R87 HydrophobicContact CG-CG 4.46Å; M82-R87 PolarHBondContact O-NH1 3.02Å; M82-R87 PolarHBondContact O-NH2 3.2Å; M82-R87 HydrophobicContact SD-CG 3.98Å; M82-W90 HydrophobicContact CE-CD2 4.15Å; M82-W90 HydrophobicContact CE-CG 3.96Å; M82-W90 HydrophobicContact CE-CZ2 4.38Å
83	T	87.1	Confident	83.1	Confident	59 Å²	59	81.4 Å²	81.4	36%	0.362	42%	0.423	S	S	.	.			trans	-74.5	158.3	165.6	60.5	0	0	0	0	110.8	T85 E86 R87	T83-T85 PolarHBondContact O-N 3.16Å; T83-T85 PolarHBondContact OG1-OG1 3.29Å; T83-E86 WeakPolarHBondContact CB-OE2 3.49Å; T83-E86 PolarHBondContact N-OE2 3.44Å; T83-E86 PolarHBondContact O-N 3.17Å; T83-E86 WeakPolarHBondContact OG1-CB 3.5Å; T83-E86 VanDerWaalsContact OG1-CD 3.26Å; T83-E86 WeakPolarHBondContact OG1-CG 3.5Å; T83-E86 PolarHBondContact OG1-N 3.14Å; T83-E86 PolarHBondContact OG1-OE2 2.84Å; T83-R87 WeakPolarHBondContact O-CG 3.06Å; T83-R87 PolarHBondContact O-N 3.09Å
84	P	86.7	Confident	83.2	Confident	81 Å²	81	76 Å²	76	53%	0.526	40%	0.4	S	S	.	.	H	α-helix	trans	-56.6	-35.5	174.8	-27.7	36.6	0	0	0	113.9	W88 L124	P84-W88 WeakPolarHBondContact O-CB 3.41Å; P84-W88 PolarHBondContact O-N 3.24Å; P84-L124 HydrophobicContact CB-CD2 3.68Å
85	T	86.4	Confident	83.6	Confident	95 Å²	95	73.1 Å²	73.1	58%	0.583	38%	0.378	S	S	*	.	H	α-helix	trans	-66.5	-46.8	177.6	43.9	0	0	0	0	111.7	T83 R87 W88 E89	T83-T85 PolarHBondContact O-N 3.16Å; T83-T85 PolarHBondContact OG1-OG1 3.29Å; T85-R87 PolarHBondContact O-N 2.96Å; T85-W88 WeakPolarHBondContact O-CB 3.14Å; T85-W88 PolarHBondContact O-N 2.78Å; T85-W88 VanDerWaalsContact O-N 3.17Å; T85-E89 PolarHBondContact O-N 3.32Å
86	E	86.3	Confident	84.2	Confident	44 Å²	44	74.8 Å²	74.8	21%	0.206	38%	0.377	C	S	.	.	H	α-helix	trans	-61.5	-46.8	175.6	-72.6	166.1	135.3	0	0	110.6	K77 T83 W88 E89 W90	K77-E86 IonicContact NZ-OE1 2.65Å; K77-E86 PolarHBondContact NZ-OE1 2.99Å; T83-E86 WeakPolarHBondContact CB-OE2 3.49Å; T83-E86 PolarHBondContact N-OE2 3.44Å; T83-E86 PolarHBondContact O-N 3.17Å; T83-E86 WeakPolarHBondContact OG1-CB 3.5Å; T83-E86 VanDerWaalsContact OG1-CD 3.26Å; T83-E86 WeakPolarHBondContact OG1-CG 3.5Å; T83-E86 PolarHBondContact OG1-N 3.14Å; T83-E86 PolarHBondContact OG1-OE2 2.84Å; E86-W88 PolarHBondContact O-N 3.35Å; E86-E89 WeakPolarHBondContact O-CB 3.45Å; E86-E89 PolarHBondContact O-N 3.34Å; E86-W90 PolarHBondContact O-N 3.2Å
87	R	86.8	Confident	84.8	Confident	28 Å²	28	74.3 Å²	74.3	11%	0.106	36%	0.355	C	S	.	.	H	α-helix	trans	-55.6	-39.6	176.4	-69.5	-170.1	-168.3	87.5	0.7	111.7	S79 M82 T83 T85 W90 V91 L124	S79-R87 VanDerWaalsContact O-CZ 3.31Å; S79-R87 PolarHBondContact O-NE 3.19Å; S79-R87 VanDerWaalsContact O-NE 3.16Å; S79-R87 PolarHBondContact O-NH2 2.94Å; M82-R87 HydrophobicContact CB-CG 3.65Å; M82-R87 HydrophobicContact CG-CG 4.46Å; M82-R87 PolarHBondContact O-NH1 3.02Å; M82-R87 PolarHBondContact O-NH2 3.2Å; M82-R87 HydrophobicContact SD-CG 3.98Å; T83-R87 WeakPolarHBondContact O-CG 3.06Å; T83-R87 PolarHBondContact O-N 3.09Å; T85-R87 PolarHBondContact O-N 2.96Å; R87-W90 PolarHBondContact O-N 3.28Å; R87-V91 WeakPolarHBondContact O-CG2 3.47Å; R87-V91 PolarHBondContact O-N 3.31Å; R87-L124 HydrophobicContact CB-CD1 4.17Å; R87-L124 HydrophobicContact CB-CD2 4.09Å; R87-L124 HydrophobicContact CB-CG 4.33Å
88	W	88.4	Confident	85.6	Confident	40 Å²	40	68.3 Å²	68.3	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-39.8	177.4	-172.7	-113.2	0	0	0	112.9	P84 T85 E86 V91 K92 L121 L124 E130 L131 K134	P84-W88 WeakPolarHBondContact O-CB 3.41Å; P84-W88 PolarHBondContact O-N 3.24Å; T85-W88 WeakPolarHBondContact O-CB 3.14Å; T85-W88 PolarHBondContact O-N 2.78Å; T85-W88 VanDerWaalsContact O-N 3.17Å; E86-W88 PolarHBondContact O-N 3.35Å; W88-V91 WeakPolarHBondContact O-CB 3.43Å; W88-V91 PolarHBondContact O-N 3.29Å; W88-K92 VanDerWaalsContact CD1-CE 3.47Å; W88-K92 WeakPolarHBondContact O-CG 3.08Å; W88-K92 PolarHBondContact O-N 2.84Å; W88-K92 VanDerWaalsContact O-N 3.09Å; W88-L121 HydrophobicContact CE3-CD2 3.96Å; W88-L121 HydrophobicContact CZ3-CD2 3.76Å; W88-L124 HydrophobicContact CE3-CD1 4.03Å; W88-E130 HydrophobicContact CH2-CB 4.46Å; W88-L131 HydrophobicContact CZ3-CD1 4.06Å; W88-K134 HydrophobicContact CH2-CB 4.24Å; W88-K134 HydrophobicContact CH2-CG 3.64Å; W88-K134 HydrophobicContact CZ2-CG 4.18Å; W88-K134 HydrophobicContact CZ3-CG 4.42Å
89	E	87.8	Confident	86.5	Confident	124 Å²	124	64.1 Å²	64.1	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-44.3	173.1	-68.9	174.1	167.4	0	0	111.4	T85 E86 V91 K92 L93	T85-E89 PolarHBondContact O-N 3.32Å; E86-E89 WeakPolarHBondContact O-CB 3.45Å; E86-E89 PolarHBondContact O-N 3.34Å; E89-V91 VanDerWaalsContact C-N 3.3Å; E89-V91 PolarHBondContact O-N 2.91Å; E89-K92 WeakPolarHBondContact O-CB 3.38Å; E89-K92 PolarHBondContact O-N 3.05Å; E89-L93 WeakPolarHBondContact O-CB 3.44Å; E89-L93 PolarHBondContact O-N 3.09Å
90	W	87.4	Confident	87.6	Confident	66 Å²	66	62.1 Å²	62.1	25%	0.25	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-38.1	175.2	-81.3	94.5	0	0	0	112.8	M82 E86 R87 L93 H94 L120	M82-W90 HydrophobicContact CE-CD2 4.15Å; M82-W90 HydrophobicContact CE-CG 3.96Å; M82-W90 HydrophobicContact CE-CZ2 4.38Å; E86-W90 PolarHBondContact O-N 3.2Å; R87-W90 PolarHBondContact O-N 3.28Å; W90-L93 HydrophobicContact CE3-CD2 4.25Å; W90-L93 HydrophobicContact CZ3-CD2 4.39Å; W90-L93 PolarHBondContact O-N 3.35Å; W90-H94 AromaticContact CE3-NE2 3.61Å; W90-H94 WeakPolarHBondContact O-CB 3.33Å; W90-H94 PolarHBondContact O-CD2 2.98Å; W90-H94 PolarHBondContact O-N 2.94Å; W90-L120 HydrophobicContact CB-CD1 3.7Å
91	V	90.9	Very high	88.1	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-45.6	174.5	169.3	0	0	0	0	111	R87 W88 E89 K95 A117 L120 L121 L138	R87-V91 WeakPolarHBondContact O-CG2 3.47Å; R87-V91 PolarHBondContact O-N 3.31Å; W88-V91 WeakPolarHBondContact O-CB 3.43Å; W88-V91 PolarHBondContact O-N 3.29Å; E89-V91 VanDerWaalsContact C-N 3.3Å; E89-V91 PolarHBondContact O-N 2.91Å; V91-K95 WeakPolarHBondContact O-CB 3.42Å; V91-K95 PolarHBondContact O-N 2.91Å; V91-A117 HydrophobicContact CG1-CB 4.46Å; V91-L120 HydrophobicContact CG2-CB 3.53Å; V91-L120 HydrophobicContact CG2-CD1 4.33Å; V91-L121 HydrophobicContact CB-CD2 4.27Å; V91-L121 HydrophobicContact CB-CG 4.48Å; V91-L121 HydrophobicContact CG1-CD1 4.01Å; V91-L121 HydrophobicContact CG1-CD2 3.79Å; V91-L121 HydrophobicContact CG1-CG 3.89Å; V91-L121 HydrophobicContact CG2-CD2 3.75Å; V91-L121 HydrophobicContact CG2-CG 3.78Å; V91-L138 HydrophobicContact CG1-CD1 4.32Å
92	K	90.9	Very high	88.7	Confident	106 Å²	106	52.6 Å²	52.6	46%	0.461	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-47.2	176.3	-68.3	176	-176	173.6	0	110.9	W88 E89 K95 E96	W88-K92 VanDerWaalsContact CD1-CE 3.47Å; W88-K92 WeakPolarHBondContact O-CG 3.08Å; W88-K92 PolarHBondContact O-N 2.84Å; W88-K92 VanDerWaalsContact O-N 3.09Å; E89-K92 WeakPolarHBondContact O-CB 3.38Å; E89-K92 PolarHBondContact O-N 3.05Å; K92-K95 WeakPolarHBondContact O-CB 3.29Å; K92-K95 PolarHBondContact O-N 3.11Å; K92-E96 WeakPolarHBondContact O-CG 3.42Å; K92-E96 PolarHBondContact O-N 2.86Å
93	L	89.4	Confident	89.1	Confident	55 Å²	55	60.9 Å²	60.9	29%	0.288	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-49.6	-179.9	-178.6	62.2	0	0	0	111.9	E89 W90 K95 E96 R97	E89-L93 WeakPolarHBondContact O-CB 3.44Å; E89-L93 PolarHBondContact O-N 3.09Å; W90-L93 HydrophobicContact CE3-CD2 4.25Å; W90-L93 HydrophobicContact CZ3-CD2 4.39Å; W90-L93 PolarHBondContact O-N 3.35Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.14Å; L93-E96 PolarHBondContact O-N 2.96Å; L93-R97 HydrophobicContact CD1-CG 4.47Å; L93-R97 WeakPolarHBondContact O-CB 3.13Å; L93-R97 VanDerWaalsContact O-CG 3.26Å; L93-R97 WeakPolarHBondContact O-CG 3.41Å; L93-R97 PolarHBondContact O-N 3.44Å
94	H	90.2	Very high	88.9	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-36	177.4	-81	-66.4	0	0	0	112.5	W90 G98 S113 A117	W90-H94 AromaticContact CE3-NE2 3.61Å; W90-H94 WeakPolarHBondContact O-CB 3.33Å; W90-H94 PolarHBondContact O-CD2 2.98Å; W90-H94 PolarHBondContact O-N 2.94Å; H94-G98 PolarHBondContact O-N 3.02Å; H94-S113 WeakPolarHBondContact O-CB 3.5Å; H94-A117 HydrophobicContact CB-CB 3.84Å
95	K	93.9	Very high	88.9	Confident	49 Å²	49	60.4 Å²	60.4	21%	0.213	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-49.1	174.2	-178.9	-162.7	160.9	-174.4	0	111.6	V91 K92 L93 R97 G98 G99 Y114 E137 L138	V91-K95 WeakPolarHBondContact O-CB 3.42Å; V91-K95 PolarHBondContact O-N 2.91Å; K92-K95 WeakPolarHBondContact O-CB 3.29Å; K92-K95 PolarHBondContact O-N 3.11Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.14Å; K95-R97 VanDerWaalsContact C-N 3.34Å; K95-G98 PolarHBondContact O-N 2.92Å; K95-G99 PolarHBondContact O-N 3.43Å; K95-Y114 HydrophobicContact CG-CE1 4.42Å; K95-Y114 WeakPolarHBondContact O-CE1 3.35Å; K95-E137 WeakPolarHBondContact CE-OE1 3.41Å; K95-E137 WeakPolarHBondContact CE-OE2 3.23Å; K95-E137 IonicContact NZ-OE1 3.6Å; K95-E137 PolarHBondContact NZ-OE1 3.43Å; K95-E137 IonicContact NZ-OE2 2.84Å; K95-E137 PolarHBondContact NZ-OE2 3.4Å; K95-L138 HydrophobicContact CB-CD2 4.02Å; K95-L138 HydrophobicContact CG-CD2 3.98Å
96	E	91.8	Very high	88.6	Confident	135 Å²	135	57.4 Å²	57.4	63%	0.631	28%	0.283	S	S	*	.	H	α-helix	trans	-61.5	-44.4	-179.7	-75.8	177.4	-177.8	0	0	111.4	K92 L93 G99 G100	K92-E96 WeakPolarHBondContact O-CG 3.42Å; K92-E96 PolarHBondContact O-N 2.86Å; L93-E96 PolarHBondContact O-N 2.96Å; E96-G99 CarbonylContact O-C 3.53Å; E96-G99 WeakPolarHBondContact O-CA 3.28Å; E96-G99 PolarHBondContact O-N 3.27Å; E96-G99 VanDerWaalsContact O-N 3.14Å; E96-G100 PolarHBondContact O-N 2.99Å
97	R	86.9	Confident	88.6	Confident	55 Å²	55	56.5 Å²	56.5	21%	0.208	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-45.9	174.6	-73.6	169.5	173.6	-179.2	-15	112.7	E36 L93 K95 G99 G100 R101	E36-R97 IonicContact OE1-CZ 2.94Å; E36-R97 IonicContact OE1-NH1 2.62Å; E36-R97 PolarHBondContact OE1-NH1 3.16Å; E36-R97 IonicContact OE1-NH2 2.78Å; E36-R97 PolarHBondContact OE1-NH2 2.99Å; E36-R97 IonicContact OE2-CZ 3.93Å; E36-R97 IonicContact OE2-NH1 2.69Å; E36-R97 IonicContact OE2-NH2 3.89Å; E36-R97 PolarHBondContact OE2-NH2 3.44Å; L93-R97 HydrophobicContact CD1-CG 4.47Å; L93-R97 WeakPolarHBondContact O-CB 3.13Å; L93-R97 VanDerWaalsContact O-CG 3.26Å; L93-R97 WeakPolarHBondContact O-CG 3.41Å; L93-R97 PolarHBondContact O-N 3.44Å; K95-R97 VanDerWaalsContact C-N 3.34Å; R97-G99 PolarHBondContact O-N 3.14Å; R97-G100 CarbonylContact O-C 3.37Å; R97-G100 WeakPolarHBondContact O-CA 3.43Å; R97-G100 PolarHBondContact O-N 3.48Å; R97-R101 PolarHBondContact O-N 3.12Å
98	G	90.9	Very high	88.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-39.9	174.1	0	0	0	0	0	111.3	H94 K95 F102 A110 Y114	H94-G98 PolarHBondContact O-N 3.02Å; K95-G98 PolarHBondContact O-N 2.92Å; G98-F102 VanDerWaalsContact O-CB 3.23Å; G98-F102 WeakPolarHBondContact O-CB 3.43Å; G98-F102 PolarHBondContact O-N 3.39Å; G98-A110 WeakPolarHBondContact O-CB 3.39Å; G98-Y114 VanDerWaalsContact C-CZ 3.46Å; G98-Y114 PolarHBondContact O-OH 2.95Å
99	G	92.6	Very high	88.3	Confident	10 Å²	10	60.7 Å²	60.7	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-40.8	173.5	0	0	0	0	0	113.4	K95 E96 R97 R103 Y114	K95-G99 PolarHBondContact O-N 3.43Å; E96-G99 CarbonylContact O-C 3.53Å; E96-G99 WeakPolarHBondContact O-CA 3.28Å; E96-G99 PolarHBondContact O-N 3.27Å; E96-G99 VanDerWaalsContact O-N 3.14Å; R97-G99 PolarHBondContact O-N 3.14Å; G99-R103 WeakPolarHBondContact O-CG 3.33Å; G99-R103 PolarHBondContact O-N 3.42Å; G99-R103 VanDerWaalsContact O-N 3.11Å; G99-R103 PolarHBondContact O-NH1 3.36Å; G99-Y114 VanDerWaalsContact CA-OH 3.29Å; G99-Y114 WeakPolarHBondContact CA-OH 3.3Å; G99-Y114 PolarHBondContact N-OH 3.27Å
100	G	89.1	Confident	88.4	Confident	27 Å²	27	54.8 Å²	54.8	28%	0.278	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-53.2	173.6	0	0	0	0	0	112.3	E96 R97 F102 R103 S104	E96-G100 PolarHBondContact O-N 2.99Å; R97-G100 CarbonylContact O-C 3.37Å; R97-G100 WeakPolarHBondContact O-CA 3.43Å; R97-G100 PolarHBondContact O-N 3.48Å; G100-F102 VanDerWaalsContact C-N 3.31Å; G100-F102 PolarHBondContact O-N 3.45Å; G100-R103 PolarHBondContact O-N 3.5Å; G100-R103 VanDerWaalsContact O-N 3.12Å; G100-S104 PolarHBondContact O-N 2.97Å
101	R	85.1	Confident	88.5	Confident	41 Å²	41	52.3 Å²	52.3	16%	0.155	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-40.1	177.7	-70.2	-176.7	179.7	175	-1.1	112.2	E36 R97 R103 S104 G105 D106 G109 A110 S113	E36-R101 PolarHBondContact O-NH1 3.35Å; E36-R101 PolarHBondContact O-NH2 3.11Å; R97-R101 PolarHBondContact O-N 3.12Å; R101-R103 VanDerWaalsContact C-N 3.35Å; R101-R103 PolarHBondContact O-N 3Å; R101-S104 WeakPolarHBondContact CA-OG 3.48Å; R101-S104 PolarHBondContact O-N 3.49Å; R101-S104 PolarHBondContact O-OG 2.86Å; R101-G105 PolarHBondContact O-N 3.32Å; R101-G105 VanDerWaalsContact O-N 3.14Å; R101-D106 HydrophobicContact CB-CB 4.24Å; R101-D106 PolarHBondContact O-N 3.1Å; R101-G109 WeakPolarHBondContact CD-O 3.43Å; R101-G109 PolarHBondContact NH1-O 3.43Å; R101-G109 VanDerWaalsContact NH1-O 3.1Å; R101-A110 HydrophobicContact CB-CB 4.01Å; R101-S113 PolarHBondContact NH1-OG 2.94Å
102	F	91.3	Very high	88.3	Confident	48 Å²	48	54.2 Å²	54.2	21%	0.211	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-42.6	175.9	-173.5	-88.9	0	0	0	112.1	G98 G100 S104 G105 I107 A110 L144 K148	G98-F102 VanDerWaalsContact O-CB 3.23Å; G98-F102 WeakPolarHBondContact O-CB 3.43Å; G98-F102 PolarHBondContact O-N 3.39Å; G100-F102 VanDerWaalsContact C-N 3.31Å; G100-F102 PolarHBondContact O-N 3.45Å; F102-S104 VanDerWaalsContact C-N 3.35Å; F102-G105 PolarHBondContact O-N 3.27Å; F102-I107 HydrophobicContact CD2-CD1 3.89Å; F102-I107 HydrophobicContact CE2-CD1 4.05Å; F102-I107 HydrophobicContact CG-CD1 4.5Å; F102-A110 HydrophobicContact CB-CB 4Å; F102-L144 HydrophobicContact CE1-CD2 4Å; F102-L144 HydrophobicContact CE2-CD2 3.92Å; F102-L144 HydrophobicContact CE2-CG 3.77Å; F102-L144 HydrophobicContact CZ-CD1 4.31Å; F102-L144 HydrophobicContact CZ-CD2 3.37Å; F102-L144 HydrophobicContact CZ-CG 3.57Å; F102-K148 HydrophobicContact CE2-CD 3.64Å; F102-K148 HydrophobicContact CZ-CD 3.65Å
103	R	91.3	Very high	88.3	Confident	197 Å²	197	49.2 Å²	49.2	74%	0.743	25%	0.248	S	C	*	.	H	α-helix	trans	-67.9	-33.4	176.9	-74.3	-172.7	-62.8	-88.1	3.4	112.6	G99 G100 R101 G105	G99-R103 WeakPolarHBondContact O-CG 3.33Å; G99-R103 PolarHBondContact O-N 3.42Å; G99-R103 VanDerWaalsContact O-N 3.11Å; G99-R103 PolarHBondContact O-NH1 3.36Å; G100-R103 PolarHBondContact O-N 3.5Å; G100-R103 VanDerWaalsContact O-N 3.12Å; R101-R103 VanDerWaalsContact C-N 3.35Å; R101-R103 PolarHBondContact O-N 3Å; R103-G105 PolarHBondContact O-N 3.48Å
104	S	83.6	Confident	88.5	Confident	78 Å²	78	47.1 Å²	47.1	55%	0.545	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-2.8	175.7	69.2	0	0	0	0	113.8	G100 R101 F102	G100-S104 PolarHBondContact O-N 2.97Å; R101-S104 WeakPolarHBondContact CA-OG 3.48Å; R101-S104 PolarHBondContact O-N 3.49Å; R101-S104 PolarHBondContact O-OG 2.86Å; F102-S104 VanDerWaalsContact C-N 3.35Å
105	G	85.4	Confident	88.6	Confident	53 Å²	53	48.3 Å²	48.3	55%	0.546	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	-1.2	179.1	0	0	0	0	0	115	R101 F102 R103 I107	R101-G105 PolarHBondContact O-N 3.32Å; R101-G105 VanDerWaalsContact O-N 3.14Å; F102-G105 PolarHBondContact O-N 3.27Å; R103-G105 PolarHBondContact O-N 3.48Å; G105-I107 VanDerWaalsContact C-N 3.31Å; G105-I107 PolarHBondContact O-N 3.34Å
106	D	80.3	Confident	88.4	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.171	25%	0.248	C	C	.	.			trans	-79.7	79.7	173.6	177.1	19.5	0	0	0	110.4	R101 W108 G109 A110	R101-D106 HydrophobicContact CB-CB 4.24Å; R101-D106 PolarHBondContact O-N 3.1Å; D106-W108 VanDerWaalsContact C-N 3.33Å; D106-W108 PolarHBondContact O-N 3.48Å; D106-G109 PolarHBondContact OD1-N 3.12Å; D106-G109 WeakPolarHBondContact OD2-CA 3.48Å; D106-A110 VanDerWaalsContact O-CB 3.3Å; D106-A110 WeakPolarHBondContact O-CB 3.49Å; D106-A110 PolarHBondContact O-N 2.77Å
107	I	87.5	Confident	88.5	Confident	25 Å²	25	42.7 Å²	42.7	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-69.5	-32.9	-176.5	-49.8	-52	0	0	0	111.6	F102 G105 T111 C145 K148 L149	F102-I107 HydrophobicContact CD2-CD1 3.89Å; F102-I107 HydrophobicContact CE2-CD1 4.05Å; F102-I107 HydrophobicContact CG-CD1 4.5Å; G105-I107 VanDerWaalsContact C-N 3.31Å; G105-I107 PolarHBondContact O-N 3.34Å; I107-T111 WeakPolarHBondContact O-CB 3.45Å; I107-T111 PolarHBondContact O-N 3.3Å; I107-T111 PolarHBondContact O-OG1 2.99Å; I107-C145 HydrophobicContact CG2-CB 3.85Å; I107-C145 WeakPolarHBondContact CG2-O 3.37Å; I107-K148 HydrophobicContact CD1-CD 3.67Å; I107-K148 HydrophobicContact CG1-CB 4.39Å; I107-K148 HydrophobicContact CG1-CD 4.18Å; I107-K148 HydrophobicContact CG2-CB 4Å; I107-L149 HydrophobicContact CB-CD2 3.96Å; I107-L149 HydrophobicContact CB-CG 4.32Å; I107-L149 HydrophobicContact CG2-CD1 4.12Å; I107-L149 HydrophobicContact CG2-CD2 3.84Å; I107-L149 HydrophobicContact CG2-CG 3.63Å
108	W	84.5	Confident	88.7	Confident	155 Å²	155	41.2 Å²	41.2	59%	0.587	21%	0.213	S	C	*	.	H	α-helix	trans	-68.9	-50.1	178.1	-76.4	105.2	0	0	0	111.5	D106 A110 T111 D112 L149	D106-W108 VanDerWaalsContact C-N 3.33Å; D106-W108 PolarHBondContact O-N 3.48Å; W108-A110 VanDerWaalsContact C-N 3.25Å; W108-A110 PolarHBondContact O-N 3Å; W108-T111 WeakPolarHBondContact O-CB 3.5Å; W108-T111 PolarHBondContact O-N 3.01Å; W108-T111 VanDerWaalsContact O-N 3.1Å; W108-D112 PolarHBondContact O-N 3.4Å; W108-L149 HydrophobicContact CD2-CD1 3.93Å; W108-L149 HydrophobicContact CD2-CD2 4.09Å; W108-L149 HydrophobicContact CE3-CD1 4.01Å; W108-L149 HydrophobicContact CG-CD1 4.46Å; W108-L149 HydrophobicContact CG-CD2 4.18Å; W108-L149 HydrophobicContact CH2-CD1 4.44Å; W108-L149 HydrophobicContact CZ2-CD1 4.35Å; W108-L149 HydrophobicContact CZ2-CD2 4.21Å; W108-L149 HydrophobicContact CZ3-CD1 4.28Å
109	G	83.2	Confident	88.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-29.3	176.5	0	0	0	0	0	112.9	R101 D106 S113	R101-G109 WeakPolarHBondContact CD-O 3.43Å; R101-G109 PolarHBondContact NH1-O 3.43Å; R101-G109 VanDerWaalsContact NH1-O 3.1Å; D106-G109 PolarHBondContact OD1-N 3.12Å; D106-G109 WeakPolarHBondContact OD2-CA 3.48Å; G109-S113 WeakPolarHBondContact O-CB 3.14Å; G109-S113 PolarHBondContact O-N 3.32Å; G109-S113 PolarHBondContact O-OG 3.3Å
110	A	89.4	Confident	88.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-45.5	169.6	0	0	0	0	0	112.2	G98 R101 F102 D106 W108 D112 S113 Y114	G98-A110 WeakPolarHBondContact O-CB 3.39Å; R101-A110 HydrophobicContact CB-CB 4.01Å; F102-A110 HydrophobicContact CB-CB 4Å; D106-A110 VanDerWaalsContact O-CB 3.3Å; D106-A110 WeakPolarHBondContact O-CB 3.49Å; D106-A110 PolarHBondContact O-N 2.77Å; W108-A110 VanDerWaalsContact C-N 3.25Å; W108-A110 PolarHBondContact O-N 3Å; A110-D112 VanDerWaalsContact C-N 3.33Å; A110-D112 PolarHBondContact O-N 3.34Å; A110-S113 PolarHBondContact O-N 3.5Å; A110-Y114 HydrophobicContact CB-CE2 4.3Å; A110-Y114 WeakPolarHBondContact O-CD2 3.34Å; A110-Y114 PolarHBondContact O-N 2.98Å
111	T	90.6	Very high	88.5	Confident	15 Å²	15	47.6 Å²	47.6	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-57.8	-45.5	176.3	-58.9	0	0	0	0	111.3	I107 W108 S115 L142 C145	I107-T111 WeakPolarHBondContact O-CB 3.45Å; I107-T111 PolarHBondContact O-N 3.3Å; I107-T111 PolarHBondContact O-OG1 2.99Å; W108-T111 WeakPolarHBondContact O-CB 3.5Å; W108-T111 PolarHBondContact O-N 3.01Å; W108-T111 VanDerWaalsContact O-N 3.1Å; T111-S115 WeakPolarHBondContact O-CB 3.47Å; T111-S115 PolarHBondContact O-N 3.31Å; T111-S115 PolarHBondContact O-OG 3.38Å; T111-L142 HydrophobicContact CG2-CD1 3.52Å; T111-L142 WeakPolarHBondContact O-CD1 3.49Å; T111-C145 WeakPolarHBondContact OG1-CB 3.16Å
112	D	87	Confident	88.5	Confident	45 Å²	45	51.5 Å²	51.5	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-48.2	176.5	179.2	64.6	0	0	0	111.7	W108 A110 Y114 S115 R116	W108-D112 PolarHBondContact O-N 3.4Å; A110-D112 VanDerWaalsContact C-N 3.33Å; A110-D112 PolarHBondContact O-N 3.34Å; D112-Y114 PolarHBondContact O-N 3Å; D112-S115 WeakPolarHBondContact O-CA 3.39Å; D112-S115 WeakPolarHBondContact O-CB 3.17Å; D112-S115 PolarHBondContact O-N 3.33Å; D112-R116 WeakPolarHBondContact O-CG 3.38Å; D112-R116 PolarHBondContact O-N 3.33Å; D112-R116 IonicContact OD1-CZ 3.19Å; D112-R116 IonicContact OD1-NE 2.63Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.7Å; D112-R116 IonicContact OD2-CZ 3.91Å; D112-R116 IonicContact OD2-NE 2.79Å; D112-R116 PolarHBondContact OD2-NE 3.34Å; D112-R116 IonicContact OD2-NH2 2.72Å
113	S	89.6	Confident	88.1	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-56.9	-46.5	179.4	-61.4	0	0	0	0	112.4	H94 R101 G109 A110 S115 R116 A117	H94-S113 WeakPolarHBondContact O-CB 3.5Å; R101-S113 PolarHBondContact NH1-OG 2.94Å; G109-S113 WeakPolarHBondContact O-CB 3.14Å; G109-S113 PolarHBondContact O-N 3.32Å; G109-S113 PolarHBondContact O-OG 3.3Å; A110-S113 PolarHBondContact O-N 3.5Å; S113-S115 VanDerWaalsContact C-N 3.33Å; S113-S115 PolarHBondContact O-N 3.18Å; S113-R116 PolarHBondContact O-N 2.89Å; S113-A117 PolarHBondContact O-N 2.86Å
114	Y	95.1	Very high	87.6	Confident	12 Å²	12	43.8 Å²	43.8	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-35.3	176.8	-64.7	-45.7	0	0	0	112.5	K95 G98 G99 A110 D112 A117 L118 L138 N141	K95-Y114 HydrophobicContact CG-CE1 4.42Å; K95-Y114 WeakPolarHBondContact O-CE1 3.35Å; G98-Y114 VanDerWaalsContact C-CZ 3.46Å; G98-Y114 PolarHBondContact O-OH 2.95Å; G99-Y114 VanDerWaalsContact CA-OH 3.29Å; G99-Y114 WeakPolarHBondContact CA-OH 3.3Å; G99-Y114 PolarHBondContact N-OH 3.27Å; A110-Y114 HydrophobicContact CB-CE2 4.3Å; A110-Y114 WeakPolarHBondContact O-CD2 3.34Å; A110-Y114 PolarHBondContact O-N 2.98Å; D112-Y114 PolarHBondContact O-N 3Å; Y114-A117 PolarHBondContact O-N 2.79Å; Y114-L118 PolarHBondContact O-N 2.9Å; Y114-L138 HydrophobicContact CD1-CD2 3.71Å; Y114-L138 HydrophobicContact CE1-CD2 4.46Å; Y114-N141 HydrophobicContact CD1-CB 4.31Å; Y114-N141 HydrophobicContact CD2-CB 4Å; Y114-N141 HydrophobicContact CE1-CB 4.02Å; Y114-N141 HydrophobicContact CE2-CB 3.68Å; Y114-N141 HydrophobicContact CG-CB 4.31Å
115	S	92.2	Very high	86.5	Confident	37 Å²	37	46.1 Å²	46.1	26%	0.259	25%	0.25	S	C	.	.	H	α-helix	trans	-66.2	-40.4	176.9	-58.7	0	0	0	0	111.6	T111 D112 S113 L118 K119	T111-S115 WeakPolarHBondContact O-CB 3.47Å; T111-S115 PolarHBondContact O-N 3.31Å; T111-S115 PolarHBondContact O-OG 3.38Å; D112-S115 WeakPolarHBondContact O-CA 3.39Å; D112-S115 WeakPolarHBondContact O-CB 3.17Å; D112-S115 PolarHBondContact O-N 3.33Å; S113-S115 VanDerWaalsContact C-N 3.33Å; S113-S115 PolarHBondContact O-N 3.18Å; S115-L118 PolarHBondContact O-N 3.3Å; S115-K119 WeakPolarHBondContact O-CG 3.44Å; S115-K119 PolarHBondContact O-N 3.41Å
116	R	89.6	Confident	85.4	Confident	66 Å²	66	46.7 Å²	46.7	25%	0.249	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-44.6	173.8	-69.2	-180	-172.1	-94.2	-0.6	111.7	G35 D112 S113 L118 K119 L120	G35-R116 VanDerWaalsContact C-CZ 3.46Å; G35-R116 VanDerWaalsContact C-NH1 3.33Å; G35-R116 VanDerWaalsContact CA-NH1 3.3Å; G35-R116 VanDerWaalsContact O-CD 3.25Å; G35-R116 WeakPolarHBondContact O-CD 3.35Å; G35-R116 PolarHBondContact O-NE 3.02Å; G35-R116 VanDerWaalsContact O-NE 3.09Å; G35-R116 PolarHBondContact O-NH1 2.78Å; D112-R116 WeakPolarHBondContact O-CG 3.38Å; D112-R116 PolarHBondContact O-N 3.33Å; D112-R116 IonicContact OD1-CZ 3.19Å; D112-R116 IonicContact OD1-NE 2.63Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.7Å; D112-R116 IonicContact OD2-CZ 3.91Å; D112-R116 IonicContact OD2-NE 2.79Å; D112-R116 PolarHBondContact OD2-NE 3.34Å; D112-R116 IonicContact OD2-NH2 2.72Å; S113-R116 PolarHBondContact O-N 2.89Å; R116-L118 VanDerWaalsContact C-N 3.28Å; R116-L118 PolarHBondContact O-N 3.5Å; R116-K119 WeakPolarHBondContact O-CB 3.25Å; R116-K119 PolarHBondContact O-N 3.49Å; R116-K119 VanDerWaalsContact O-N 3.11Å; R116-L120 WeakPolarHBondContact O-CG 3.29Å; R116-L120 PolarHBondContact O-N 3.41Å
117	A	92.2	Very high	84.3	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.1	-42.8	174.1	0	0	0	0	0	111.7	V91 H94 S113 Y114 L120 L121 L138	V91-A117 HydrophobicContact CG1-CB 4.46Å; H94-A117 HydrophobicContact CB-CB 3.84Å; S113-A117 PolarHBondContact O-N 2.86Å; Y114-A117 PolarHBondContact O-N 2.79Å; A117-L120 PolarHBondContact O-N 3.37Å; A117-L121 WeakPolarHBondContact O-CG 3.18Å; A117-L121 PolarHBondContact O-N 3.31Å; A117-L138 HydrophobicContact CB-CD1 3.69Å; A117-L138 HydrophobicContact CB-CD2 3.8Å; A117-L138 HydrophobicContact CB-CG 4.41Å
118	L	92.6	Very high	83.3	Confident	23 Å²	23	55 Å²	55	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-40.9	175.9	-77.8	169.9	0	0	0	112.8	Y114 S115 R116 L120 L121 I122 K135 L138 L142	Y114-L118 PolarHBondContact O-N 2.9Å; S115-L118 PolarHBondContact O-N 3.3Å; R116-L118 VanDerWaalsContact C-N 3.28Å; R116-L118 PolarHBondContact O-N 3.5Å; L118-L120 VanDerWaalsContact C-N 3.35Å; L118-L120 PolarHBondContact O-N 2.69Å; L118-L121 WeakPolarHBondContact O-CB 3.22Å; L118-L121 PolarHBondContact O-N 2.88Å; L118-L121 VanDerWaalsContact O-N 3.17Å; L118-I122 PolarHBondContact O-N 3.1Å; L118-K135 HydrophobicContact CD2-CG 4.48Å; L118-L138 HydrophobicContact CD1-CB 4.42Å; L118-L138 HydrophobicContact CD2-CB 3.73Å; L118-L138 HydrophobicContact CD2-CD1 4.06Å; L118-L138 HydrophobicContact CG-CB 3.86Å; L118-L138 HydrophobicContact CG-CD1 4.17Å; L118-L142 HydrophobicContact CD1-CD2 4.07Å
119	K	89.7	Confident	82.7	Confident	141 Å²	141	49.1 Å²	49.1	61%	0.613	29%	0.291	S	S	*	.	H	α-helix	trans	-61	-43	176.7	-72.8	175	-179.4	179.8	0	111.8	S115 R116 L121 I122 P123	S115-K119 WeakPolarHBondContact O-CG 3.44Å; S115-K119 PolarHBondContact O-N 3.41Å; R116-K119 WeakPolarHBondContact O-CB 3.25Å; R116-K119 PolarHBondContact O-N 3.49Å; R116-K119 VanDerWaalsContact O-N 3.11Å; K119-L121 PolarHBondContact O-N 3.45Å; K119-I122 WeakPolarHBondContact O-CB 3.5Å; K119-I122 WeakPolarHBondContact O-CG1 3.44Å; K119-I122 PolarHBondContact O-N 3.34Å; K119-I122 VanDerWaalsContact O-N 3.08Å; K119-P123 WeakPolarHBondContact O-CD 3.31Å
120	L	88.8	Confident	82.5	Confident	30 Å²	30	55.7 Å²	55.7	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-22.3	177.6	-69	169.3	0	0	0	113.3	W90 V91 R116 A117 L118 P123	W90-L120 HydrophobicContact CB-CD1 3.7Å; V91-L120 HydrophobicContact CG2-CB 3.53Å; V91-L120 HydrophobicContact CG2-CD1 4.33Å; R116-L120 WeakPolarHBondContact O-CG 3.29Å; R116-L120 PolarHBondContact O-N 3.41Å; A117-L120 PolarHBondContact O-N 3.37Å; L118-L120 VanDerWaalsContact C-N 3.35Å; L118-L120 PolarHBondContact O-N 2.69Å; L120-P123 WeakPolarHBondContact O-CD 3.44Å
121	L	88.9	Confident	82.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.5	174.6	-69	173.1	0	0	0	114.3	W88 V91 A117 L118 K119 L124 L131 K135 L138	W88-L121 HydrophobicContact CE3-CD2 3.96Å; W88-L121 HydrophobicContact CZ3-CD2 3.76Å; V91-L121 HydrophobicContact CB-CD2 4.27Å; V91-L121 HydrophobicContact CB-CG 4.48Å; V91-L121 HydrophobicContact CG1-CD1 4.01Å; V91-L121 HydrophobicContact CG1-CD2 3.79Å; V91-L121 HydrophobicContact CG1-CG 3.89Å; V91-L121 HydrophobicContact CG2-CD2 3.75Å; V91-L121 HydrophobicContact CG2-CG 3.78Å; A117-L121 WeakPolarHBondContact O-CG 3.18Å; A117-L121 PolarHBondContact O-N 3.31Å; L118-L121 WeakPolarHBondContact O-CB 3.22Å; L118-L121 PolarHBondContact O-N 2.88Å; L118-L121 VanDerWaalsContact O-N 3.17Å; K119-L121 PolarHBondContact O-N 3.45Å; L121-L124 HydrophobicContact CD2-CD1 3.85Å; L121-L131 HydrophobicContact CB-CD1 4.04Å; L121-L131 HydrophobicContact CD1-CD1 4.35Å; L121-L131 HydrophobicContact CD2-CD1 3.23Å; L121-L131 HydrophobicContact CG-CD1 4.06Å; L121-K135 HydrophobicContact CB-CG 4.29Å; L121-K135 HydrophobicContact CD1-CG 3.71Å; L121-K135 VanDerWaalsContact O-CE 3.3Å; L121-K135 WeakPolarHBondContact O-CE 3.25Å; L121-K135 PolarHBondContact O-NZ 2.97Å; L121-K135 VanDerWaalsContact O-NZ 3.07Å; L121-L138 HydrophobicContact CD1-CD1 3.46Å; L121-L138 VanDerWaalsContact CD1-CD1 3.46Å
122	I	85.5	Confident	82.3	Confident	123 Å²	123	61.2 Å²	61.2	63%	0.631	35%	0.345	S	S	*	.	S	Bend	trans	-66.5	-53	176.4	-60.9	172.6	0	0	0	111.6	L118 K119 L124	L118-I122 PolarHBondContact O-N 3.1Å; K119-I122 WeakPolarHBondContact O-CB 3.5Å; K119-I122 WeakPolarHBondContact O-CG1 3.44Å; K119-I122 PolarHBondContact O-N 3.34Å; K119-I122 VanDerWaalsContact O-N 3.08Å; I122-L124 PolarHBondContact O-N 3.49Å
123	P	83.8	Confident	82.4	Confident	74 Å²	74	63.1 Å²	63.1	48%	0.481	35%	0.354	S	S	.	.	S	Bend	trans	-72.2	-13.6	-178.1	29.7	-37.7	0	0	0	113.6	K119 L120 C125	K119-P123 WeakPolarHBondContact O-CD 3.31Å; L120-P123 WeakPolarHBondContact O-CD 3.44Å; P123-C125 PolarHBondContact O-N 3.31Å
124	L	80.6	Confident	82.6	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.052	37%	0.368	C	S	.	.			trans	-77	66.8	175.3	-63.1	179.5	0	0	0	110.1	P84 R87 W88 L121 I122 L131	P84-L124 HydrophobicContact CB-CD2 3.68Å; R87-L124 HydrophobicContact CB-CD1 4.17Å; R87-L124 HydrophobicContact CB-CD2 4.09Å; R87-L124 HydrophobicContact CB-CG 4.33Å; W88-L124 HydrophobicContact CE3-CD1 4.03Å; L121-L124 HydrophobicContact CD2-CD1 3.85Å; I122-L124 PolarHBondContact O-N 3.49Å; L124-L131 HydrophobicContact CB-CD1 4.49Å; L124-L131 WeakPolarHBondContact O-CD2 3.45Å
125	C	61	Low	82.5	Confident	127 Å²	127	68.2 Å²	68.2	86%	0.858	38%	0.377	S	S	*	.			trans	-93.8	102.3	175.8	-151.2	0	0	0	0	108.8	P123	P123-C125 PolarHBondContact O-N 3.31Å
126	G	60.9	Low	82.7	Confident	64 Å²	64	66.5 Å²	66.5	66%	0.66	37%	0.365	S	S	*	.	S	Bend	trans	157.8	-24.1	174.9	0	0	0	0	0	116.7	V128	G126-V128 PolarHBondContact O-N 3.09Å
127	L	57.8	Low	83	Confident	102 Å²	102	66.3 Å²	66.3	53%	0.534	37%	0.367	S	S	.	.			trans	-88.6	86.2	178.6	-71.1	157.8	0	0	0	110	G129 L131	L127-G129 PolarHBondContact O-N 3.28Å; L127-L131 WeakPolarHBondContact O-CB 3.45Å
128	V	65.8	Low	83.2	Confident	130 Å²	130	66.4 Å²	66.4	79%	0.788	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	108.7	-171.8	-170.2	0	0	0	0	110.3	G126	G126-V128 PolarHBondContact O-N 3.09Å
129	G	71.6	Confident	83.5	Confident	31 Å²	31	66.6 Å²	66.6	32%	0.32	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	135.1	-79.9	175.5	0	0	0	0	0	112	L127 L131 K132 I133	L127-G129 PolarHBondContact O-N 3.28Å; G129-L131 PolarHBondContact O-N 3.4Å; G129-K132 WeakPolarHBondContact O-CB 3.25Å; G129-K132 PolarHBondContact O-N 3.33Å; G129-I133 PolarHBondContact O-N 2.7Å
130	E	80.2	Confident	83.9	Confident	138 Å²	138	60.2 Å²	60.2	65%	0.645	34%	0.341	S	S	*	.	H	α-helix	trans	-55.6	-36.5	179.7	-66.5	-173.7	-173.9	0	0	112.8	W88 K132 I133 K134	W88-E130 HydrophobicContact CH2-CB 4.46Å; E130-K132 VanDerWaalsContact C-N 3.34Å; E130-K132 PolarHBondContact O-N 3.14Å; E130-I133 PolarHBondContact O-N 3.27Å; E130-K134 WeakPolarHBondContact O-CG 3.48Å; E130-K134 PolarHBondContact O-N 3.05Å
131	L	86	Confident	84.3	Confident	16 Å²	16	60 Å²	60	8%	0.084	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-39	176.3	-177.4	64.7	0	0	0	112.6	W88 L121 L124 L127 G129 K134 K135	W88-L131 HydrophobicContact CZ3-CD1 4.06Å; L121-L131 HydrophobicContact CB-CD1 4.04Å; L121-L131 HydrophobicContact CD1-CD1 4.35Å; L121-L131 HydrophobicContact CD2-CD1 3.23Å; L121-L131 HydrophobicContact CG-CD1 4.06Å; L124-L131 HydrophobicContact CB-CD1 4.49Å; L124-L131 WeakPolarHBondContact O-CD2 3.45Å; L127-L131 WeakPolarHBondContact O-CB 3.45Å; G129-L131 PolarHBondContact O-N 3.4Å; L131-K134 PolarHBondContact O-N 2.89Å; L131-K135 HydrophobicContact CD1-CG 4.42Å; L131-K135 HydrophobicContact CG-CD 4.28Å; L131-K135 WeakPolarHBondContact O-CB 3.35Å; L131-K135 VanDerWaalsContact O-CG 3.31Å; L131-K135 WeakPolarHBondContact O-CG 3.49Å; L131-K135 PolarHBondContact O-N 3.04Å
132	K	88.5	Confident	84.7	Confident	116 Å²	116	60.4 Å²	60.4	50%	0.504	34%	0.342	S	S	.	.	H	α-helix	trans	-66.2	-45.5	179.8	-69.7	-174.8	177.9	-179.2	0	110.4	G129 E130 K134 K135 A136	G129-K132 WeakPolarHBondContact O-CB 3.25Å; G129-K132 PolarHBondContact O-N 3.33Å; E130-K132 VanDerWaalsContact C-N 3.34Å; E130-K132 PolarHBondContact O-N 3.14Å; K132-K134 PolarHBondContact O-N 3.19Å; K132-K135 PolarHBondContact O-N 2.87Å; K132-A136 WeakPolarHBondContact O-CB 3.17Å; K132-A136 PolarHBondContact O-N 3.22Å
133	I	90.9	Very high	85.4	Confident	84 Å²	84	54.6 Å²	54.6	43%	0.431	31%	0.312	S	S	.	.	H	α-helix	trans	-60.2	-46.1	176.4	-62.3	170.3	0	0	0	110.1	G129 E130 A136 E137	G129-I133 PolarHBondContact O-N 2.7Å; E130-I133 PolarHBondContact O-N 3.27Å; I133-A136 WeakPolarHBondContact O-CB 3.26Å; I133-A136 PolarHBondContact O-N 2.74Å; I133-E137 WeakPolarHBondContact O-CB 3.39Å; I133-E137 PolarHBondContact O-N 2.95Å
134	K	92.4	Very high	86.1	Confident	68 Å²	68	53 Å²	53	30%	0.296	30%	0.299	S	S	.	.	H	α-helix	trans	-65.5	-40.5	177.2	-69	-61.5	174.7	-164.8	0	113.3	W88 E130 L131 K132 A136 E137 L138	W88-K134 HydrophobicContact CH2-CB 4.24Å; W88-K134 HydrophobicContact CH2-CG 3.64Å; W88-K134 HydrophobicContact CZ2-CG 4.18Å; W88-K134 HydrophobicContact CZ3-CG 4.42Å; E130-K134 WeakPolarHBondContact O-CG 3.48Å; E130-K134 PolarHBondContact O-N 3.05Å; L131-K134 PolarHBondContact O-N 2.89Å; K132-K134 PolarHBondContact O-N 3.19Å; K134-A136 VanDerWaalsContact C-N 3.34Å; K134-E137 IonicContact NZ-OE2 3.56Å; K134-E137 PolarHBondContact O-N 2.96Å; K134-L138 WeakPolarHBondContact O-CG 3.38Å; K134-L138 PolarHBondContact O-N 3.3Å
135	K	93.8	Very high	86.8	Confident	52 Å²	52	52.5 Å²	52.5	23%	0.226	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-43.9	173.4	-76	-177	178.1	178.8	0	110.9	L118 L121 L131 K132 L138 H139 L165	L118-K135 HydrophobicContact CD2-CG 4.48Å; L121-K135 HydrophobicContact CB-CG 4.29Å; L121-K135 HydrophobicContact CD1-CG 3.71Å; L121-K135 VanDerWaalsContact O-CE 3.3Å; L121-K135 WeakPolarHBondContact O-CE 3.25Å; L121-K135 PolarHBondContact O-NZ 2.97Å; L121-K135 VanDerWaalsContact O-NZ 3.07Å; L131-K135 HydrophobicContact CD1-CG 4.42Å; L131-K135 HydrophobicContact CG-CD 4.28Å; L131-K135 WeakPolarHBondContact O-CB 3.35Å; L131-K135 VanDerWaalsContact O-CG 3.31Å; L131-K135 WeakPolarHBondContact O-CG 3.49Å; L131-K135 PolarHBondContact O-N 3.04Å; K132-K135 PolarHBondContact O-N 2.87Å; K135-L138 PolarHBondContact O-N 3.21Å; K135-H139 WeakPolarHBondContact O-CB 3.47Å; K135-H139 PolarHBondContact O-CD2 2.84Å; K135-H139 PolarHBondContact O-N 3.45Å; K135-L165 HydrophobicContact CB-CD1 3.71Å
136	A	95.6	Very high	88.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-46.9	177	0	0	0	0	0	111.6	K132 I133 K134 L138 H139 S140 A162 L165 E166	K132-A136 WeakPolarHBondContact O-CB 3.17Å; K132-A136 PolarHBondContact O-N 3.22Å; I133-A136 WeakPolarHBondContact O-CB 3.26Å; I133-A136 PolarHBondContact O-N 2.74Å; K134-A136 VanDerWaalsContact C-N 3.34Å; A136-L138 PolarHBondContact O-N 3.11Å; A136-H139 PolarHBondContact O-N 3.4Å; A136-S140 VanDerWaalsContact O-CB 3.25Å; A136-S140 WeakPolarHBondContact O-CB 3.01Å; A136-S140 PolarHBondContact O-N 2.89Å; A136-A162 VanDerWaalsContact O-CB 3.29Å; A136-A162 WeakPolarHBondContact O-CB 3.29Å; A136-L165 HydrophobicContact CB-CB 3.75Å; A136-L165 HydrophobicContact CB-CD1 4.49Å; A136-E166 HydrophobicContact CB-CB 3.52Å
137	E	96	Very high	90.4	Very high	63 Å²	63	44.4 Å²	44.4	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-59	-45.8	177.6	-171.9	-179.8	-173.8	0	0	112	K95 I133 K134 S140 N141	K95-E137 WeakPolarHBondContact CE-OE1 3.41Å; K95-E137 WeakPolarHBondContact CE-OE2 3.23Å; K95-E137 IonicContact NZ-OE1 3.6Å; K95-E137 PolarHBondContact NZ-OE1 3.43Å; K95-E137 IonicContact NZ-OE2 2.84Å; K95-E137 PolarHBondContact NZ-OE2 3.4Å; I133-E137 WeakPolarHBondContact O-CB 3.39Å; I133-E137 PolarHBondContact O-N 2.95Å; K134-E137 IonicContact NZ-OE2 3.56Å; K134-E137 PolarHBondContact O-N 2.96Å; E137-S140 WeakPolarHBondContact O-CB 3.21Å; E137-S140 PolarHBondContact O-N 2.89Å; E137-N141 VanDerWaalsContact O-CG 3.31Å; E137-N141 PolarHBondContact O-N 2.83Å; E137-N141 PolarHBondContact O-ND2 2.9Å
138	L	97.1	Very high	92.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-45.9	178.5	-73.6	171.6	0	0	0	112.3	V91 K95 Y114 A117 L118 L121 K134 K135 A136 S140 N141 L142	V91-L138 HydrophobicContact CG1-CD1 4.32Å; K95-L138 HydrophobicContact CB-CD2 4.02Å; K95-L138 HydrophobicContact CG-CD2 3.98Å; Y114-L138 HydrophobicContact CD1-CD2 3.71Å; Y114-L138 HydrophobicContact CE1-CD2 4.46Å; A117-L138 HydrophobicContact CB-CD1 3.69Å; A117-L138 HydrophobicContact CB-CD2 3.8Å; A117-L138 HydrophobicContact CB-CG 4.41Å; L118-L138 HydrophobicContact CD1-CB 4.42Å; L118-L138 HydrophobicContact CD2-CB 3.73Å; L118-L138 HydrophobicContact CD2-CD1 4.06Å; L118-L138 HydrophobicContact CG-CB 3.86Å; L118-L138 HydrophobicContact CG-CD1 4.17Å; L121-L138 HydrophobicContact CD1-CD1 3.46Å; L121-L138 VanDerWaalsContact CD1-CD1 3.46Å; K134-L138 WeakPolarHBondContact O-CG 3.38Å; K134-L138 PolarHBondContact O-N 3.3Å; K135-L138 PolarHBondContact O-N 3.21Å; A136-L138 PolarHBondContact O-N 3.11Å; L138-S140 VanDerWaalsContact C-N 3.26Å; L138-S140 PolarHBondContact O-N 3.5Å; L138-N141 PolarHBondContact O-N 3.23Å; L138-L142 WeakPolarHBondContact O-CB 3.16Å; L138-L142 PolarHBondContact O-N 2.81Å
139	H	98	Very high	93.5	Very high	27 Å²	27	41 Å²	41	13%	0.125	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-40.6	174	-84.7	-60	0	0	0	111.6	K135 A136 L142 S143 N158 A162	K135-H139 WeakPolarHBondContact O-CB 3.47Å; K135-H139 PolarHBondContact O-CD2 2.84Å; K135-H139 PolarHBondContact O-N 3.45Å; A136-H139 PolarHBondContact O-N 3.4Å; H139-L142 PolarHBondContact O-N 3.28Å; H139-S143 PolarHBondContact O-N 3.01Å; H139-N158 WeakPolarHBondContact CB-O 3.44Å; H139-N158 PolarHBondContact ND1-OD1 3.1Å; H139-A162 HydrophobicContact CB-CB 3.88Å
140	S	98.2	Very high	94.6	Very high	7 Å²	7	44.9 Å²	44.9	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-43.3	176	-163	0	0	0	0	111.4	A136 E137 L138 S143 L144 A172 R175	A136-S140 VanDerWaalsContact O-CB 3.25Å; A136-S140 WeakPolarHBondContact O-CB 3.01Å; A136-S140 PolarHBondContact O-N 2.89Å; E137-S140 WeakPolarHBondContact O-CB 3.21Å; E137-S140 PolarHBondContact O-N 2.89Å; L138-S140 VanDerWaalsContact C-N 3.26Å; L138-S140 PolarHBondContact O-N 3.5Å; S140-S143 PolarHBondContact O-N 3.06Å; S140-S143 PolarHBondContact O-OG 3.45Å; S140-L144 PolarHBondContact O-N 3.01Å; S140-A172 WeakPolarHBondContact OG-CA 3.15Å; S140-A172 PolarHBondContact OG-N 3.39Å; S140-R175 VanDerWaalsContact CB-NH1 3.32Å; S140-R175 WeakPolarHBondContact O-CD 3.15Å; S140-R175 PolarHBondContact O-NH1 3.36Å; S140-R175 PolarHBondContact OG-NH1 3.34Å
141	N	98.2	Very high	95.4	Very high	26 Å²	26	40 Å²	40	14%	0.139	19%	0.192	C	C	.	.	H	α-helix	trans	-69.3	-35.7	178.1	-68.5	-21.3	0	0	0	112.4	Y114 E137 L138 L144 C145 R175	Y114-N141 HydrophobicContact CD1-CB 4.31Å; Y114-N141 HydrophobicContact CD2-CB 4Å; Y114-N141 HydrophobicContact CE1-CB 4.02Å; Y114-N141 HydrophobicContact CE2-CB 3.68Å; Y114-N141 HydrophobicContact CG-CB 4.31Å; E137-N141 VanDerWaalsContact O-CG 3.31Å; E137-N141 PolarHBondContact O-N 2.83Å; E137-N141 PolarHBondContact O-ND2 2.9Å; L138-N141 PolarHBondContact O-N 3.23Å; N141-L144 PolarHBondContact O-N 3.33Å; N141-C145 PolarHBondContact O-N 2.87Å; N141-C145 VanDerWaalsContact O-N 3.11Å; N141-C145 PolarHBondContact O-SG 2.82Å; N141-R175 PolarHBondContact OD1-NH1 2.94Å
142	L	97.8	Very high	95.9	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-41	174.6	-169.5	63.2	0	0	0	111.6	T111 L118 L138 H139 L144 C145 Q146	T111-L142 HydrophobicContact CG2-CD1 3.52Å; T111-L142 WeakPolarHBondContact O-CD1 3.49Å; L118-L142 HydrophobicContact CD1-CD2 4.07Å; L138-L142 WeakPolarHBondContact O-CB 3.16Å; L138-L142 PolarHBondContact O-N 2.81Å; H139-L142 PolarHBondContact O-N 3.28Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-L144 PolarHBondContact O-N 3.14Å; L142-C145 PolarHBondContact O-N 3.39Å; L142-Q146 WeakPolarHBondContact O-CG 3.44Å; L142-Q146 PolarHBondContact O-N 3.42Å
143	S	98.4	Very high	96.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-37.6	176.3	70.6	0	0	0	0	112.3	H139 S140 C145 Q146 L147 A155	H139-S143 PolarHBondContact O-N 3.01Å; S140-S143 PolarHBondContact O-N 3.06Å; S140-S143 PolarHBondContact O-OG 3.45Å; S143-C145 PolarHBondContact O-N 3.19Å; S143-Q146 PolarHBondContact O-N 2.95Å; S143-L147 WeakPolarHBondContact O-CG 3.38Å; S143-L147 PolarHBondContact O-N 3.18Å; S143-A155 WeakPolarHBondContact CB-O 3.46Å; S143-A155 WeakPolarHBondContact O-CB 3.4Å
144	L	98.5	Very high	96.7	Very high	40 Å²	40	41.7 Å²	41.7	21%	0.209	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-43	173	178.3	59.1	0	0	0	112.4	F102 S140 N141 L142 Q146 L147 K148 R175	F102-L144 HydrophobicContact CE1-CD2 4Å; F102-L144 HydrophobicContact CE2-CD2 3.92Å; F102-L144 HydrophobicContact CE2-CG 3.77Å; F102-L144 HydrophobicContact CZ-CD1 4.31Å; F102-L144 HydrophobicContact CZ-CD2 3.37Å; F102-L144 HydrophobicContact CZ-CG 3.57Å; S140-L144 PolarHBondContact O-N 3.01Å; N141-L144 PolarHBondContact O-N 3.33Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-L144 PolarHBondContact O-N 3.14Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; L144-L147 PolarHBondContact O-N 3.21Å; L144-K148 PolarHBondContact O-N 2.74Å; L144-K148 VanDerWaalsContact O-N 3.14Å; L144-R175 VanDerWaalsContact CD2-NH2 3.32Å
145	C	97.1	Very high	97	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.5	-45.4	176	-60	0	0	0	0	110.7	I107 T111 N141 L142 S143 L147 K148 L149	I107-C145 HydrophobicContact CG2-CB 3.85Å; I107-C145 WeakPolarHBondContact CG2-O 3.37Å; T111-C145 WeakPolarHBondContact OG1-CB 3.16Å; N141-C145 PolarHBondContact O-N 2.87Å; N141-C145 VanDerWaalsContact O-N 3.11Å; N141-C145 PolarHBondContact O-SG 2.82Å; L142-C145 PolarHBondContact O-N 3.39Å; S143-C145 PolarHBondContact O-N 3.19Å; C145-L147 PolarHBondContact O-N 2.92Å; C145-K148 WeakPolarHBondContact O-CB 3.44Å; C145-K148 PolarHBondContact O-N 3.42Å; C145-K148 VanDerWaalsContact O-N 3.11Å; C145-L149 WeakPolarHBondContact O-CG 3.1Å; C145-L149 PolarHBondContact O-N 3.49Å
146	Q	97.8	Very high	97.2	Very high	7 Å²	7	39 Å²	39	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-65.3	-35.3	179	-72	163.4	-13.5	0	0	113.1	L142 S143 L144 K148 L149 N150 Q151 R154 A155 N158	L142-Q146 WeakPolarHBondContact O-CG 3.44Å; L142-Q146 PolarHBondContact O-N 3.42Å; S143-Q146 PolarHBondContact O-N 2.95Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; Q146-K148 VanDerWaalsContact C-N 3.33Å; Q146-L149 CarbonylContact O-C 3.57Å; Q146-L149 PolarHBondContact O-N 2.91Å; Q146-N150 PolarHBondContact O-N 3.2Å; Q146-Q151 HydrophobicContact CB-CB 4.25Å; Q146-Q151 PolarHBondContact O-N 2.82Å; Q146-R154 HydrophobicContact CG-CB 4.19Å; Q146-R154 PolarHBondContact OE1-O 3.32Å; Q146-A155 HydrophobicContact CB-CB 3.78Å; Q146-A155 VanDerWaalsContact OE1-CA 3.29Å; Q146-A155 VanDerWaalsContact OE1-N 3.15Å; Q146-N158 PolarHBondContact NE2-ND2 3.46Å; Q146-N158 VanDerWaalsContact NE2-ND2 3.15Å; Q146-N158 PolarHBondContact OE1-ND2 2.88Å
147	L	98.1	Very high	97.4	Very high	14 Å²	14	42.1 Å²	42.1	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-41.8	171.1	-75.3	170.9	0	0	0	111.7	S143 L144 C145 N150 A155 R175 Q178 A179 K182	S143-L147 WeakPolarHBondContact O-CG 3.38Å; S143-L147 PolarHBondContact O-N 3.18Å; L144-L147 PolarHBondContact O-N 3.21Å; C145-L147 PolarHBondContact O-N 2.92Å; L147-N150 PolarHBondContact O-N 2.8Å; L147-A155 HydrophobicContact CD2-CB 3.88Å; L147-A155 HydrophobicContact CG-CB 3.75Å; L147-R175 HydrophobicContact CD1-CB 4.17Å; L147-R175 HydrophobicContact CD1-CG 4.36Å; L147-Q178 HydrophobicContact CD1-CB 4.05Å; L147-Q178 HydrophobicContact CD2-CB 4.41Å; L147-A179 HydrophobicContact CD2-CB 3.97Å; L147-K182 HydrophobicContact CD2-CD 3.95Å
148	K	96.5	Very high	97.5	Very high	126 Å²	126	40 Å²	40	55%	0.548	19%	0.189	S	C	.	.	H	α-helix	trans	-68.3	-33.8	175.6	-78.2	-172.8	174.7	-78.2	0	112.9	F102 I107 L144 C145 Q146 N150	F102-K148 HydrophobicContact CE2-CD 3.64Å; F102-K148 HydrophobicContact CZ-CD 3.65Å; I107-K148 HydrophobicContact CD1-CD 3.67Å; I107-K148 HydrophobicContact CG1-CB 4.39Å; I107-K148 HydrophobicContact CG1-CD 4.18Å; I107-K148 HydrophobicContact CG2-CB 4Å; L144-K148 PolarHBondContact O-N 2.74Å; L144-K148 VanDerWaalsContact O-N 3.14Å; C145-K148 WeakPolarHBondContact O-CB 3.44Å; C145-K148 PolarHBondContact O-N 3.42Å; C145-K148 VanDerWaalsContact O-N 3.11Å; Q146-K148 VanDerWaalsContact C-N 3.33Å; K148-N150 PolarHBondContact O-N 2.94Å
149	L	93.3	Very high	97.5	Very high	34 Å²	34	40 Å²	40	18%	0.178	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	6.7	174.9	-64.6	176	0	0	0	113.6	I107 W108 C145 Q146 Q151	I107-L149 HydrophobicContact CB-CD2 3.96Å; I107-L149 HydrophobicContact CB-CG 4.32Å; I107-L149 HydrophobicContact CG2-CD1 4.12Å; I107-L149 HydrophobicContact CG2-CD2 3.84Å; I107-L149 HydrophobicContact CG2-CG 3.63Å; W108-L149 HydrophobicContact CD2-CD1 3.93Å; W108-L149 HydrophobicContact CD2-CD2 4.09Å; W108-L149 HydrophobicContact CE3-CD1 4.01Å; W108-L149 HydrophobicContact CG-CD1 4.46Å; W108-L149 HydrophobicContact CG-CD2 4.18Å; W108-L149 HydrophobicContact CH2-CD1 4.44Å; W108-L149 HydrophobicContact CZ2-CD1 4.35Å; W108-L149 HydrophobicContact CZ2-CD2 4.21Å; W108-L149 HydrophobicContact CZ3-CD1 4.28Å; C145-L149 WeakPolarHBondContact O-CG 3.1Å; C145-L149 PolarHBondContact O-N 3.49Å; Q146-L149 CarbonylContact O-C 3.57Å; Q146-L149 PolarHBondContact O-N 2.91Å; L149-Q151 VanDerWaalsContact C-N 3.26Å; L149-Q151 HydrophobicContact CB-CG 4.23Å; L149-Q151 PolarHBondContact O-N 3.21Å
150	N	95.4	Very high	97.5	Very high	113 Å²	113	39.9 Å²	39.9	60%	0.604	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	39.1	-176.2	-158	46.5	0	0	0	113.8	Q146 L147 K148 P152	Q146-N150 PolarHBondContact O-N 3.2Å; L147-N150 PolarHBondContact O-N 2.8Å; K148-N150 PolarHBondContact O-N 2.94Å; N150-P152 WeakPolarHBondContact O-CD 3.37Å
151	Q	96.1	Very high	97.5	Very high	37 Å²	37	44.5 Å²	44.5	17%	0.173	21%	0.212	C	C	.	.			trans	-109.7	66.3	175.3	-63.8	174.2	26	0	0	110.2	Q146 L149 Q153 R154 A155	Q146-Q151 HydrophobicContact CB-CB 4.25Å; Q146-Q151 PolarHBondContact O-N 2.82Å; L149-Q151 VanDerWaalsContact C-N 3.26Å; L149-Q151 HydrophobicContact CB-CG 4.23Å; L149-Q151 PolarHBondContact O-N 3.21Å; Q151-Q153 VanDerWaalsContact C-N 3.3Å; Q151-Q153 PolarHBondContact O-N 3.01Å; Q151-R154 HydrophobicContact CB-CB 4.5Å; Q151-R154 PolarHBondContact O-N 2.94Å; Q151-R154 VanDerWaalsContact OE1-CD 3.24Å; Q151-A155 PolarHBondContact O-N 2.72Å; Q151-A155 VanDerWaalsContact O-N 3.09Å
152	P	97.1	Very high	97.5	Very high	26 Å²	26	43.3 Å²	43.3	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-31.5	-167.5	28.8	-37.6	0	0	0	113.2	N150 A155 R156 K182 L183	N150-P152 WeakPolarHBondContact O-CD 3.37Å; P152-A155 WeakPolarHBondContact O-CB 3.35Å; P152-A155 PolarHBondContact O-N 2.84Å; P152-R156 WeakPolarHBondContact O-CB 3.26Å; P152-R156 PolarHBondContact O-N 3.46Å; P152-K182 HydrophobicContact CB-CB 3.7Å; P152-K182 HydrophobicContact CB-CD 4.27Å; P152-K182 HydrophobicContact CG-CB 4.4Å; P152-L183 HydrophobicContact CB-CD2 3.95Å; P152-L183 HydrophobicContact CB-CG 3.98Å; P152-L183 HydrophobicContact CG-CD2 3.74Å; P152-L183 HydrophobicContact CG-CG 4.32Å
153	Q	98.1	Very high	97.5	Very high	82 Å²	82	43.4 Å²	43.4	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-60.7	-51.8	176.6	-168.7	62.4	28	0	0	112.1	Q151 A155 R156 D157 L183	Q151-Q153 VanDerWaalsContact C-N 3.3Å; Q151-Q153 PolarHBondContact O-N 3.01Å; Q153-A155 VanDerWaalsContact C-N 3.28Å; Q153-A155 PolarHBondContact O-N 2.97Å; Q153-R156 WeakPolarHBondContact O-CB 3.5Å; Q153-R156 PolarHBondContact O-N 3.42Å; Q153-D157 PolarHBondContact O-N 2.91Å; Q153-D157 VanDerWaalsContact O-N 3.14Å; Q153-L183 HydrophobicContact CB-CD2 4.45Å
154	R	97.4	Very high	97.4	Very high	143 Å²	143	50.6 Å²	50.6	54%	0.54	24%	0.24	S	C	.	.	H	α-helix	trans	-64.7	-37.5	178.5	-57.7	-179.5	103.2	176.7	7.2	111	Q146 Q151 D157 N158	Q146-R154 HydrophobicContact CG-CB 4.19Å; Q146-R154 PolarHBondContact OE1-O 3.32Å; Q151-R154 HydrophobicContact CB-CB 4.5Å; Q151-R154 PolarHBondContact O-N 2.94Å; Q151-R154 VanDerWaalsContact OE1-CD 3.24Å; R154-D157 PolarHBondContact O-N 3.45Å; R154-N158 PolarHBondContact O-N 3.25Å; R154-N158 PolarHBondContact O-ND2 2.78Å
155	A	98.5	Very high	97.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-45.3	176.8	0	0	0	0	0	111.7	S143 Q146 L147 Q151 P152 Q153 N158 A159 A179	S143-A155 WeakPolarHBondContact CB-O 3.46Å; S143-A155 WeakPolarHBondContact O-CB 3.4Å; Q146-A155 HydrophobicContact CB-CB 3.78Å; Q146-A155 VanDerWaalsContact OE1-CA 3.29Å; Q146-A155 VanDerWaalsContact OE1-N 3.15Å; L147-A155 HydrophobicContact CD2-CB 3.88Å; L147-A155 HydrophobicContact CG-CB 3.75Å; Q151-A155 PolarHBondContact O-N 2.72Å; Q151-A155 VanDerWaalsContact O-N 3.09Å; P152-A155 WeakPolarHBondContact O-CB 3.35Å; P152-A155 PolarHBondContact O-N 2.84Å; Q153-A155 VanDerWaalsContact C-N 3.28Å; Q153-A155 PolarHBondContact O-N 2.97Å; A155-N158 PolarHBondContact O-N 3.2Å; A155-A159 VanDerWaalsContact O-CB 3.25Å; A155-A159 WeakPolarHBondContact O-CB 3.47Å; A155-A159 PolarHBondContact O-N 2.84Å; A155-A179 HydrophobicContact CB-CB 4.06Å
156	R	98.6	Very high	97.1	Very high	63 Å²	63	54.2 Å²	54.2	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-50.9	176.1	-174.1	-164.1	68.7	174.9	12.1	110.7	P152 Q153 N158 A159 A160 L176 A179 L183 E185	P152-R156 WeakPolarHBondContact O-CB 3.26Å; P152-R156 PolarHBondContact O-N 3.46Å; Q153-R156 WeakPolarHBondContact O-CB 3.5Å; Q153-R156 PolarHBondContact O-N 3.42Å; R156-N158 VanDerWaalsContact C-N 3.32Å; R156-N158 PolarHBondContact O-N 3.31Å; R156-A159 PolarHBondContact O-N 3.37Å; R156-A160 VanDerWaalsContact O-CB 3.31Å; R156-A160 WeakPolarHBondContact O-CB 3.43Å; R156-A160 PolarHBondContact O-N 2.92Å; R156-L176 HydrophobicContact CG-CD1 3.76Å; R156-A179 HydrophobicContact CB-CB 3.84Å; R156-L183 HydrophobicContact CB-CD1 4.04Å; R156-L183 HydrophobicContact CG-CD1 4.39Å; R156-E185 WeakPolarHBondContact CD-OE2 2.85Å; R156-E185 IonicContact CZ-OE1 3.69Å; R156-E185 VanDerWaalsContact NH1-CD 3.34Å; R156-E185 IonicContact NH1-OE1 3.69Å; R156-E185 PolarHBondContact NH1-OE1 2.93Å; R156-E185 IonicContact NH1-OE2 3.68Å; R156-E185 PolarHBondContact NH1-OE2 3.46Å
157	D	98.3	Very high	97	Very high	67 Å²	67	58 Å²	58	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-63.3	-38.6	-176.5	-60.4	-20.4	0	0	0	112	Q153 R154 K161	Q153-D157 PolarHBondContact O-N 2.91Å; Q153-D157 VanDerWaalsContact O-N 3.14Å; R154-D157 PolarHBondContact O-N 3.45Å; D157-K161 WeakPolarHBondContact O-CG 3.27Å; D157-K161 PolarHBondContact O-N 2.81Å; D157-K161 VanDerWaalsContact O-N 3.15Å
158	N	98.3	Very high	96.8	Very high	19 Å²	19	59.7 Å²	59.7	10%	0.102	30%	0.304	C	S	.	.	H	α-helix	trans	-71.8	-41.9	175	-79.3	-64.2	0	0	0	112.5	H139 Q146 R154 A155 R156 A160 K161 A162	H139-N158 WeakPolarHBondContact CB-O 3.44Å; H139-N158 PolarHBondContact ND1-OD1 3.1Å; Q146-N158 PolarHBondContact NE2-ND2 3.46Å; Q146-N158 VanDerWaalsContact NE2-ND2 3.15Å; Q146-N158 PolarHBondContact OE1-ND2 2.88Å; R154-N158 PolarHBondContact O-N 3.25Å; R154-N158 PolarHBondContact O-ND2 2.78Å; A155-N158 PolarHBondContact O-N 3.2Å; R156-N158 VanDerWaalsContact C-N 3.32Å; R156-N158 PolarHBondContact O-N 3.31Å; N158-A160 VanDerWaalsContact C-N 3.34Å; N158-A160 PolarHBondContact O-N 2.98Å; N158-K161 PolarHBondContact O-N 2.8Å; N158-A162 PolarHBondContact O-N 3.17Å
159	A	98.4	Very high	96.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-40.4	177.2	0	0	0	0	0	111.5	A155 R156 A162 T163 R175 L176	A155-A159 VanDerWaalsContact O-CB 3.25Å; A155-A159 WeakPolarHBondContact O-CB 3.47Å; A155-A159 PolarHBondContact O-N 2.84Å; R156-A159 PolarHBondContact O-N 3.37Å; A159-A162 WeakPolarHBondContact O-CB 3.43Å; A159-A162 PolarHBondContact O-N 3.15Å; A159-T163 WeakPolarHBondContact O-CG2 3.38Å; A159-T163 PolarHBondContact O-N 3.05Å; A159-R175 HydrophobicContact CB-CB 4.3Å; A159-L176 HydrophobicContact CB-CB 3.73Å; A159-L176 HydrophobicContact CB-CD1 4.18Å
160	A	98.4	Very high	96.8	Very high	26 Å²	26	54 Å²	54	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-41.9	175.2	0	0	0	0	0	112.3	R156 N158 A162 T163 Q164 L176	R156-A160 VanDerWaalsContact O-CB 3.31Å; R156-A160 WeakPolarHBondContact O-CB 3.43Å; R156-A160 PolarHBondContact O-N 2.92Å; N158-A160 VanDerWaalsContact C-N 3.34Å; N158-A160 PolarHBondContact O-N 2.98Å; A160-A162 VanDerWaalsContact C-N 3.3Å; A160-A162 PolarHBondContact O-N 2.85Å; A160-T163 PolarHBondContact O-N 3.28Å; A160-T163 PolarHBondContact O-OG1 3.45Å; A160-Q164 VanDerWaalsContact O-CG 3.27Å; A160-Q164 WeakPolarHBondContact O-CG 3.04Å; A160-Q164 PolarHBondContact O-N 3.04Å; A160-L176 HydrophobicContact CB-CD1 4.12Å
161	K	97.6	Very high	96.9	Very high	104 Å²	104	55.4 Å²	55.4	45%	0.452	28%	0.284	S	S	.	.	H	α-helix	trans	-61	-41.1	172.4	-74.9	173.4	-175.9	177.2	0	111.7	D157 N158 Q164 L165	D157-K161 WeakPolarHBondContact O-CG 3.27Å; D157-K161 PolarHBondContact O-N 2.81Å; D157-K161 VanDerWaalsContact O-N 3.15Å; N158-K161 PolarHBondContact O-N 2.8Å; K161-Q164 PolarHBondContact O-N 2.72Å; K161-L165 WeakPolarHBondContact O-CB 3.33Å; K161-L165 WeakPolarHBondContact O-CD1 3.44Å; K161-L165 WeakPolarHBondContact O-CG 3.43Å; K161-L165 PolarHBondContact O-N 3.02Å
162	A	97.8	Very high	97	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-42.3	177.8	0	0	0	0	0	112.3	A136 H139 N158 A159 A160 L165 E166 A172	A136-A162 VanDerWaalsContact O-CB 3.29Å; A136-A162 WeakPolarHBondContact O-CB 3.29Å; H139-A162 HydrophobicContact CB-CB 3.88Å; N158-A162 PolarHBondContact O-N 3.17Å; A159-A162 WeakPolarHBondContact O-CB 3.43Å; A159-A162 PolarHBondContact O-N 3.15Å; A160-A162 VanDerWaalsContact C-N 3.3Å; A160-A162 PolarHBondContact O-N 2.85Å; A162-L165 PolarHBondContact O-N 3.01Å; A162-E166 PolarHBondContact O-N 3.04Å; A162-A172 HydrophobicContact CB-CB 3.63Å
163	T	97.6	Very high	97.1	Very high	11 Å²	11	54.5 Å²	54.5	7%	0.067	28%	0.276	C	S	.	.	H	α-helix	trans	-70.5	-31.6	177.9	60.3	0	0	0	0	113	A159 A160 E166 P167 A172 W173 L176	A159-T163 WeakPolarHBondContact O-CG2 3.38Å; A159-T163 PolarHBondContact O-N 3.05Å; A160-T163 PolarHBondContact O-N 3.28Å; A160-T163 PolarHBondContact O-OG1 3.45Å; T163-E166 CarbonylContact O-C 3.36Å; T163-P167 VanDerWaalsContact O-CA 3.27Å; T163-P167 WeakPolarHBondContact O-CA 3.39Å; T163-A172 HydrophobicContact CG2-CB 3.73Å; T163-W173 HydrophobicContact CG2-CB 4.47Å; T163-W173 HydrophobicContact CG2-CD2 3.42Å; T163-W173 VanDerWaalsContact CG2-CD2 3.42Å; T163-W173 HydrophobicContact CG2-CE3 3.7Å; T163-W173 HydrophobicContact CG2-CG 3.78Å; T163-W173 HydrophobicContact CG2-CH2 4.28Å; T163-W173 HydrophobicContact CG2-CZ2 4.05Å; T163-W173 HydrophobicContact CG2-CZ3 4.12Å; T163-L176 HydrophobicContact CG2-CD2 4.31Å
164	Q	96.4	Very high	97.1	Very high	151 Å²	151	53.9 Å²	53.9	71%	0.706	27%	0.271	S	S	*	.	H	α-helix	trans	-68.6	-39.7	172.7	-72.2	171	8.7	0	0	112.4	A160 K161	A160-Q164 VanDerWaalsContact O-CG 3.27Å; A160-Q164 WeakPolarHBondContact O-CG 3.04Å; A160-Q164 PolarHBondContact O-N 3.04Å; K161-Q164 PolarHBondContact O-N 2.72Å
165	L	94.6	Very high	97.1	Very high	57 Å²	57	48.4 Å²	48.4	30%	0.298	25%	0.25	S	C	.	.	H	α-helix	trans	-74.1	-36.6	179.5	-71.3	169.3	0	0	0	112.3	K135 A136 K161 A162	K135-L165 HydrophobicContact CB-CD1 3.71Å; A136-L165 HydrophobicContact CB-CB 3.75Å; A136-L165 HydrophobicContact CB-CD1 4.49Å; K161-L165 WeakPolarHBondContact O-CB 3.33Å; K161-L165 WeakPolarHBondContact O-CD1 3.44Å; K161-L165 WeakPolarHBondContact O-CG 3.43Å; K161-L165 PolarHBondContact O-N 3.02Å; A162-L165 PolarHBondContact O-N 3.01Å
166	E	94.8	Very high	97.1	Very high	59 Å²	59	49.3 Å²	49.3	28%	0.276	26%	0.255	S	S	.	.			trans	-139.8	89.4	-179.9	-169.2	179.4	166.6	0	0	110.4	A136 A162 T163 G168 A169	A136-E166 HydrophobicContact CB-CB 3.52Å; A162-E166 PolarHBondContact O-N 3.04Å; T163-E166 CarbonylContact O-C 3.36Å; E166-G168 PolarHBondContact O-N 3.4Å; E166-G168 VanDerWaalsContact O-N 3.12Å; E166-A169 HydrophobicContact CB-CB 4.07Å; E166-A169 HydrophobicContact CG-CB 4Å; E166-A169 VanDerWaalsContact O-CB 3.26Å; E166-A169 WeakPolarHBondContact O-CB 3.49Å; E166-A169 PolarHBondContact O-N 3.15Å
167	P	95.3	Very high	97.1	Very high	87 Å²	87	46.3 Å²	46.3	57%	0.565	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.6	-178.1	-27.5	36.2	0	0	0	114.6	T163 A169 W173 I199	T163-P167 VanDerWaalsContact O-CA 3.27Å; T163-P167 WeakPolarHBondContact O-CA 3.39Å; P167-A169 VanDerWaalsContact C-N 3.33Å; P167-W173 PolarHBondContact O-NE1 2.87Å; P167-I199 WeakPolarHBondContact O-CD1 3.22Å
168	G	94.5	Very high	97.1	Very high	49 Å²	49	45.8 Å²	45.8	51%	0.505	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.2	176	0	0	0	0	0	114.9	E166 S170	E166-G168 PolarHBondContact O-N 3.4Å; E166-G168 VanDerWaalsContact O-N 3.12Å; G168-S170 PolarHBondContact O-N 2.89Å
169	A	94.1	Very high	97.1	Very high	16 Å²	16	44.9 Å²	44.9	13%	0.132	23%	0.234	C	C	.	.			trans	-76	87.9	-174.9	0	0	0	0	0	112	E166 P167 K171 A172 W173	E166-A169 HydrophobicContact CB-CB 4.07Å; E166-A169 HydrophobicContact CG-CB 4Å; E166-A169 VanDerWaalsContact O-CB 3.26Å; E166-A169 WeakPolarHBondContact O-CB 3.49Å; E166-A169 PolarHBondContact O-N 3.15Å; P167-A169 VanDerWaalsContact C-N 3.33Å; A169-K171 VanDerWaalsContact C-N 3.29Å; A169-K171 PolarHBondContact O-N 3.37Å; A169-A172 HydrophobicContact CB-CB 3.86Å; A169-A172 WeakPolarHBondContact O-CA 3.47Å; A169-A172 WeakPolarHBondContact O-CB 3.3Å; A169-A172 PolarHBondContact O-N 2.99Å; A169-W173 PolarHBondContact O-N 3.48Å
170	S	96.2	Very high	97.1	Very high	24 Å²	24	45 Å²	45	17%	0.168	24%	0.235	C	C	.	.	H	α-helix	trans	-52.3	-42.6	-179.4	62.2	0	0	0	0	113.4	G168 A172 W173 Y174 L196 Q200	G168-S170 PolarHBondContact O-N 2.89Å; S170-A172 VanDerWaalsContact C-N 3.28Å; S170-A172 PolarHBondContact O-N 3.34Å; S170-W173 PolarHBondContact O-N 2.93Å; S170-Y174 PolarHBondContact O-N 3.35Å; S170-L196 VanDerWaalsContact O-CD1 3.28Å; S170-L196 WeakPolarHBondContact O-CD1 3.27Å; S170-Q200 PolarHBondContact OG-NE2 3.4Å
171	K	97	Very high	97	Very high	143 Å²	143	45.5 Å²	45.5	62%	0.622	23%	0.232	S	C	*	.	H	α-helix	trans	-60.1	-36.2	176	-67.9	178	-177.6	171.3	0	112.7	A169 R175	A169-K171 VanDerWaalsContact C-N 3.29Å; A169-K171 PolarHBondContact O-N 3.37Å; K171-R175 WeakPolarHBondContact O-CB 3.4Å; K171-R175 VanDerWaalsContact O-CD 3.25Å; K171-R175 WeakPolarHBondContact O-CD 3.4Å; K171-R175 WeakPolarHBondContact O-CG 3.37Å; K171-R175 PolarHBondContact O-N 3.44Å; K171-R175 VanDerWaalsContact O-N 3.1Å
172	A	97.9	Very high	96.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69.6	-44.9	178.9	0	0	0	0	0	111.3	S140 A162 T163 A169 S170 Y174 R175 L176	S140-A172 WeakPolarHBondContact OG-CA 3.15Å; S140-A172 PolarHBondContact OG-N 3.39Å; A162-A172 HydrophobicContact CB-CB 3.63Å; T163-A172 HydrophobicContact CG2-CB 3.73Å; A169-A172 HydrophobicContact CB-CB 3.86Å; A169-A172 WeakPolarHBondContact O-CA 3.47Å; A169-A172 WeakPolarHBondContact O-CB 3.3Å; A169-A172 PolarHBondContact O-N 2.99Å; S170-A172 VanDerWaalsContact C-N 3.28Å; S170-A172 PolarHBondContact O-N 3.34Å; A172-Y174 VanDerWaalsContact C-N 3.35Å; A172-Y174 PolarHBondContact O-N 3.33Å; A172-R175 PolarHBondContact O-N 3.17Å; A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 PolarHBondContact O-N 2.98Å
173	W	98.4	Very high	96.9	Very high	44 Å²	44	48.3 Å²	48.3	17%	0.167	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-42.6	174.9	-73	112.1	0	0	0	112.7	T163 P167 A169 S170 R175 L176 G177 A192 K195 L196 I199	T163-W173 HydrophobicContact CG2-CB 4.47Å; T163-W173 HydrophobicContact CG2-CD2 3.42Å; T163-W173 VanDerWaalsContact CG2-CD2 3.42Å; T163-W173 HydrophobicContact CG2-CE3 3.7Å; T163-W173 HydrophobicContact CG2-CG 3.78Å; T163-W173 HydrophobicContact CG2-CH2 4.28Å; T163-W173 HydrophobicContact CG2-CZ2 4.05Å; T163-W173 HydrophobicContact CG2-CZ3 4.12Å; P167-W173 PolarHBondContact O-NE1 2.87Å; A169-W173 PolarHBondContact O-N 3.48Å; S170-W173 PolarHBondContact O-N 2.93Å; W173-R175 PolarHBondContact O-N 3.01Å; W173-L176 HydrophobicContact CE3-CD2 3.99Å; W173-L176 HydrophobicContact CZ3-CD2 3.89Å; W173-L176 PolarHBondContact O-N 2.96Å; W173-G177 PolarHBondContact O-N 2.92Å; W173-A192 HydrophobicContact CE3-CB 4.13Å; W173-K195 HydrophobicContact CD2-CB 3.77Å; W173-K195 HydrophobicContact CE3-CB 3.8Å; W173-K195 HydrophobicContact CE3-CG 4.34Å; W173-K195 HydrophobicContact CG-CB 4.35Å; W173-K195 HydrophobicContact CH2-CB 4.21Å; W173-K195 HydrophobicContact CH2-CG 3.98Å; W173-K195 HydrophobicContact CZ2-CB 4.17Å; W173-K195 HydrophobicContact CZ2-CG 4.23Å; W173-K195 HydrophobicContact CZ3-CB 4.03Å; W173-K195 HydrophobicContact CZ3-CG 4.04Å; W173-L196 HydrophobicContact CB-CB 3.97Å; W173-L196 HydrophobicContact CB-CD1 4.43Å; W173-I199 HydrophobicContact CG-CD1 4.35Å
174	Y	98.3	Very high	96.7	Very high	69 Å²	69	51.8 Å²	51.8	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-60.5	-46.4	175.6	-172	-109.2	0	0	0	112.1	S170 A172 L176 G177 Q178 F193 L196 A205	S170-Y174 PolarHBondContact O-N 3.35Å; A172-Y174 VanDerWaalsContact C-N 3.35Å; A172-Y174 PolarHBondContact O-N 3.33Å; Y174-L176 VanDerWaalsContact C-N 3.34Å; Y174-L176 PolarHBondContact O-N 3.32Å; Y174-G177 PolarHBondContact O-N 3.41Å; Y174-Q178 HydrophobicContact CD1-CG 4.45Å; Y174-Q178 VanDerWaalsContact CE1-CD 3.44Å; Y174-Q178 HydrophobicContact CE1-CG 4.14Å; Y174-Q178 VanDerWaalsContact CZ-NE2 3.28Å; Y174-Q178 WeakPolarHBondContact O-CG 3.38Å; Y174-Q178 PolarHBondContact O-N 3.22Å; Y174-Q178 PolarHBondContact OH-NE2 3.38Å; Y174-Q178 VanDerWaalsContact OH-NE2 3.09Å; Y174-F193 HydrophobicContact CD2-CD1 4.26Å; Y174-F193 AromaticContact CD2-CE1 3.66Å; Y174-F193 HydrophobicContact CD2-CE1 3.66Å; Y174-F193 AromaticContact CE2-CE1 3.87Å; Y174-F193 HydrophobicContact CE2-CE1 3.87Å; Y174-L196 HydrophobicContact CD2-CD2 3.48Å; Y174-L196 VanDerWaalsContact CD2-CD2 3.48Å; Y174-L196 HydrophobicContact CG-CD2 3.97Å; Y174-A205 HydrophobicContact CE2-CB 3.88Å
175	R	98.3	Very high	96.7	Very high	27 Å²	27	46.8 Å²	46.8	10%	0.102	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-35.7	178.9	-68.7	163.8	-174.8	174.7	-11.2	111.8	S140 N141 L144 L147 A159 K171 A172 W173 Q178 A179	S140-R175 VanDerWaalsContact CB-NH1 3.32Å; S140-R175 WeakPolarHBondContact O-CD 3.15Å; S140-R175 PolarHBondContact O-NH1 3.36Å; S140-R175 PolarHBondContact OG-NH1 3.34Å; N141-R175 PolarHBondContact OD1-NH1 2.94Å; L144-R175 VanDerWaalsContact CD2-NH2 3.32Å; L147-R175 HydrophobicContact CD1-CB 4.17Å; L147-R175 HydrophobicContact CD1-CG 4.36Å; A159-R175 HydrophobicContact CB-CB 4.3Å; K171-R175 WeakPolarHBondContact O-CB 3.4Å; K171-R175 VanDerWaalsContact O-CD 3.25Å; K171-R175 WeakPolarHBondContact O-CD 3.4Å; K171-R175 WeakPolarHBondContact O-CG 3.37Å; K171-R175 PolarHBondContact O-N 3.44Å; K171-R175 VanDerWaalsContact O-N 3.1Å; A172-R175 PolarHBondContact O-N 3.17Å; W173-R175 PolarHBondContact O-N 3.01Å; R175-Q178 PolarHBondContact O-N 3Å; R175-A179 WeakPolarHBondContact O-CB 3.25Å; R175-A179 PolarHBondContact O-N 3.44Å
176	L	98.6	Very high	96.8	Very high	20 Å²	20	44.1 Å²	44.1	11%	0.105	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-48.8	174.1	-179	58.9	0	0	0	110.8	R156 A159 A160 T163 A172 W173 Y174 Q178 A179 C180 A192	R156-L176 HydrophobicContact CG-CD1 3.76Å; A159-L176 HydrophobicContact CB-CB 3.73Å; A159-L176 HydrophobicContact CB-CD1 4.18Å; A160-L176 HydrophobicContact CB-CD1 4.12Å; T163-L176 HydrophobicContact CG2-CD2 4.31Å; A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 PolarHBondContact O-N 2.98Å; W173-L176 HydrophobicContact CE3-CD2 3.99Å; W173-L176 HydrophobicContact CZ3-CD2 3.89Å; W173-L176 PolarHBondContact O-N 2.96Å; Y174-L176 VanDerWaalsContact C-N 3.34Å; Y174-L176 PolarHBondContact O-N 3.32Å; L176-Q178 VanDerWaalsContact C-N 3.35Å; L176-Q178 PolarHBondContact O-N 3.01Å; L176-A179 PolarHBondContact O-N 2.89Å; L176-A179 VanDerWaalsContact O-N 3.16Å; L176-C180 PolarHBondContact O-N 3.39Å; L176-A192 HydrophobicContact CB-CB 4.22Å; L176-A192 HydrophobicContact CD2-CB 4.12Å; L176-A192 HydrophobicContact CG-CB 3.99Å
177	G	98.1	Very high	96.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-44.9	176.4	0	0	0	0	0	112.6	W173 Y174 A179 C180 Q181 F193	W173-G177 PolarHBondContact O-N 2.92Å; Y174-G177 PolarHBondContact O-N 3.41Å; G177-A179 VanDerWaalsContact C-N 3.35Å; G177-A179 PolarHBondContact O-N 3.41Å; G177-C180 PolarHBondContact O-N 2.69Å; G177-Q181 WeakPolarHBondContact O-CB 3.47Å; G177-Q181 WeakPolarHBondContact O-CG 3.44Å; G177-Q181 PolarHBondContact O-N 2.62Å; G177-F193 VanDerWaalsContact C-CZ 3.41Å
178	Q	98.3	Very high	96.9	Very high	56 Å²	56	46 Å²	46	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-39.8	175.3	-73.9	-170.9	-27.7	0	0	113.1	L147 Y174 R175 L176 K182 F193	L147-Q178 HydrophobicContact CD1-CB 4.05Å; L147-Q178 HydrophobicContact CD2-CB 4.41Å; Y174-Q178 HydrophobicContact CD1-CG 4.45Å; Y174-Q178 VanDerWaalsContact CE1-CD 3.44Å; Y174-Q178 HydrophobicContact CE1-CG 4.14Å; Y174-Q178 VanDerWaalsContact CZ-NE2 3.28Å; Y174-Q178 WeakPolarHBondContact O-CG 3.38Å; Y174-Q178 PolarHBondContact O-N 3.22Å; Y174-Q178 PolarHBondContact OH-NE2 3.38Å; Y174-Q178 VanDerWaalsContact OH-NE2 3.09Å; R175-Q178 PolarHBondContact O-N 3Å; L176-Q178 VanDerWaalsContact C-N 3.35Å; L176-Q178 PolarHBondContact O-N 3.01Å; Q178-K182 PolarHBondContact O-N 3.12Å; Q178-K182 VanDerWaalsContact O-N 3.14Å; Q178-F193 HydrophobicContact CG-CZ 4.37Å
179	A	98.4	Very high	97	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.1	-47.6	178.3	0	0	0	0	0	111.4	L147 A155 R156 R175 L176 G177 Q181 K182 L183	L147-A179 HydrophobicContact CD2-CB 3.97Å; A155-A179 HydrophobicContact CB-CB 4.06Å; R156-A179 HydrophobicContact CB-CB 3.84Å; R175-A179 WeakPolarHBondContact O-CB 3.25Å; R175-A179 PolarHBondContact O-N 3.44Å; L176-A179 PolarHBondContact O-N 2.89Å; L176-A179 VanDerWaalsContact O-N 3.16Å; G177-A179 VanDerWaalsContact C-N 3.35Å; G177-A179 PolarHBondContact O-N 3.41Å; A179-Q181 PolarHBondContact O-N 2.92Å; A179-K182 WeakPolarHBondContact O-CB 3.42Å; A179-K182 PolarHBondContact O-N 3.38Å; A179-L183 WeakPolarHBondContact O-CG 3.5Å; A179-L183 PolarHBondContact O-N 2.82Å
180	C	98.2	Very high	97.2	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.02	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-40.4	176.3	-70	0	0	0	0	112.1	L176 G177 K182 L183 N184 E185 E188 A189	L176-C180 PolarHBondContact O-N 3.39Å; G177-C180 PolarHBondContact O-N 2.69Å; C180-K182 VanDerWaalsContact C-N 3.3Å; C180-K182 PolarHBondContact O-N 2.69Å; C180-L183 CarbonylContact O-C 3.59Å; C180-L183 PolarHBondContact O-N 2.78Å; C180-L183 VanDerWaalsContact O-N 3.09Å; C180-N184 PolarHBondContact O-N 3.35Å; C180-E185 HydrophobicContact CB-CB 4Å; C180-E185 PolarHBondContact O-N 3.27Å; C180-E188 HydrophobicContact CB-CB 4.29Å; C180-A189 HydrophobicContact CB-CB 3.65Å
181	Q	96.3	Very high	97.2	Very high	35 Å²	35	48.6 Å²	48.6	16%	0.164	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-41.5	173.2	-79.1	-175.9	-54.1	0	0	112.6	G177 A179 L183 N184 A189 F193 I213	G177-Q181 WeakPolarHBondContact O-CB 3.47Å; G177-Q181 WeakPolarHBondContact O-CG 3.44Å; G177-Q181 PolarHBondContact O-N 2.62Å; A179-Q181 PolarHBondContact O-N 2.92Å; Q181-L183 VanDerWaalsContact C-N 3.32Å; Q181-N184 PolarHBondContact O-N 3.11Å; Q181-A189 HydrophobicContact CG-CB 3.8Å; Q181-F193 HydrophobicContact CG-CE2 3.95Å; Q181-I213 HydrophobicContact CG-CD1 3.86Å; Q181-I213 HydrophobicContact CG-CG1 3.98Å
182	K	96.4	Very high	97.3	Very high	116 Å²	116	41.9 Å²	41.9	50%	0.504	20%	0.195	S	C	.	.	H	α-helix	trans	-67.8	-30.5	176.4	-80.8	-179	169	-76.5	0	112.8	L147 P152 Q178 A179 C180 N184	L147-K182 HydrophobicContact CD2-CD 3.95Å; P152-K182 HydrophobicContact CB-CB 3.7Å; P152-K182 HydrophobicContact CB-CD 4.27Å; P152-K182 HydrophobicContact CG-CB 4.4Å; Q178-K182 PolarHBondContact O-N 3.12Å; Q178-K182 VanDerWaalsContact O-N 3.14Å; A179-K182 WeakPolarHBondContact O-CB 3.42Å; A179-K182 PolarHBondContact O-N 3.38Å; C180-K182 VanDerWaalsContact C-N 3.3Å; C180-K182 PolarHBondContact O-N 2.69Å; K182-N184 VanDerWaalsContact C-N 3.28Å
183	L	96.9	Very high	97.3	Very high	47 Å²	47	41.9 Å²	41.9	25%	0.246	20%	0.195	C	C	.	.	H	α-helix	trans	-82.5	-4.1	174.4	-65.5	168.4	0	0	0	113.3	P152 Q153 R156 A179 C180 Q181 E185	P152-L183 HydrophobicContact CB-CD2 3.95Å; P152-L183 HydrophobicContact CB-CG 3.98Å; P152-L183 HydrophobicContact CG-CD2 3.74Å; P152-L183 HydrophobicContact CG-CG 4.32Å; Q153-L183 HydrophobicContact CB-CD2 4.45Å; R156-L183 HydrophobicContact CB-CD1 4.04Å; R156-L183 HydrophobicContact CG-CD1 4.39Å; A179-L183 WeakPolarHBondContact O-CG 3.5Å; A179-L183 PolarHBondContact O-N 2.82Å; C180-L183 CarbonylContact O-C 3.59Å; C180-L183 PolarHBondContact O-N 2.78Å; C180-L183 VanDerWaalsContact O-N 3.09Å; Q181-L183 VanDerWaalsContact C-N 3.32Å; L183-E185 HydrophobicContact CB-CB 4.44Å; L183-E185 HydrophobicContact CB-CG 3.89Å; L183-E185 PolarHBondContact O-N 3.44Å
184	N	94.9	Very high	97.2	Very high	84 Å²	84	43.7 Å²	43.7	45%	0.449	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	24	-172.6	-158.4	55.1	0	0	0	113.8	C180 Q181 K182 L186	C180-N184 PolarHBondContact O-N 3.35Å; Q181-N184 PolarHBondContact O-N 3.11Å; K182-N184 VanDerWaalsContact C-N 3.28Å; N184-L186 VanDerWaalsContact C-N 3.32Å; N184-L186 PolarHBondContact O-N 3.39Å; N184-L186 VanDerWaalsContact O-N 3.16Å
185	E	96.2	Very high	97.2	Very high	46 Å²	46	44 Å²	44	22%	0.215	21%	0.207	C	C	.	.			trans	-84	74.5	171.3	-68.6	174.7	178.7	0	0	108.3	R156 C180 L183 E188 A189	R156-E185 WeakPolarHBondContact CD-OE2 2.85Å; R156-E185 IonicContact CZ-OE1 3.69Å; R156-E185 VanDerWaalsContact NH1-CD 3.34Å; R156-E185 IonicContact NH1-OE1 3.69Å; R156-E185 PolarHBondContact NH1-OE1 2.93Å; R156-E185 IonicContact NH1-OE2 3.68Å; R156-E185 PolarHBondContact NH1-OE2 3.46Å; C180-E185 HydrophobicContact CB-CB 4Å; C180-E185 PolarHBondContact O-N 3.27Å; L183-E185 HydrophobicContact CB-CB 4.44Å; L183-E185 HydrophobicContact CB-CG 3.89Å; L183-E185 PolarHBondContact O-N 3.44Å; E185-E188 HydrophobicContact CB-CB 4.36Å; E185-E188 WeakPolarHBondContact CB-OE2 3.4Å; E185-A189 VanDerWaalsContact O-CB 3.29Å; E185-A189 WeakPolarHBondContact O-CB 3.21Å; E185-A189 PolarHBondContact O-N 3.21Å
186	L	95.4	Very high	97.2	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-39.4	-168.7	-63	-175	0	0	0	112.8	N184 A189 K190 I213 R216 E217	N184-L186 VanDerWaalsContact C-N 3.32Å; N184-L186 PolarHBondContact O-N 3.39Å; N184-L186 VanDerWaalsContact O-N 3.16Å; L186-A189 PolarHBondContact O-N 3.25Å; L186-K190 WeakPolarHBondContact O-CB 3.46Å; L186-K190 PolarHBondContact O-N 3Å; L186-I213 HydrophobicContact CB-CG2 4.1Å; L186-I213 HydrophobicContact CD2-CG2 4.45Å; L186-R216 HydrophobicContact CD1-CB 3.88Å; L186-R216 HydrophobicContact CD2-CB 4.48Å; L186-E217 HydrophobicContact CB-CG 4.13Å; L186-E217 HydrophobicContact CD1-CG 3.93Å
187	D	95.8	Very high	97.1	Very high	82 Å²	82	43.4 Å²	43.4	44%	0.439	21%	0.206	S	C	.	.	H	α-helix	trans	-67	-45.7	-177.5	-64.4	-68.9	0	0	0	110.6	K190 E191 R220	D187-K190 WeakPolarHBondContact O-CB 3.41Å; D187-K190 PolarHBondContact O-N 3.32Å; D187-E191 PolarHBondContact O-N 2.75Å; D187-E191 VanDerWaalsContact O-N 3.12Å; D187-R220 IonicContact OD2-NH2 3.29Å; D187-R220 PolarHBondContact OD2-NH2 2.79Å
188	E	96.9	Very high	97	Very high	104 Å²	104	49.4 Å²	49.4	49%	0.486	23%	0.234	S	C	.	.	H	α-helix	trans	-66.5	-40.1	175.8	-65	81.1	176.8	0	0	112.1	C180 E185 K190 E191 A192	C180-E188 HydrophobicContact CB-CB 4.29Å; E185-E188 HydrophobicContact CB-CB 4.36Å; E185-E188 WeakPolarHBondContact CB-OE2 3.4Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 3.23Å; E188-E191 PolarHBondContact O-N 3.09Å; E188-A192 PolarHBondContact O-N 3.41Å
189	A	97.6	Very high	96.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-42.3	175.6	0	0	0	0	0	111.5	C180 Q181 E185 L186 A192 F193 I213	C180-A189 HydrophobicContact CB-CB 3.65Å; Q181-A189 HydrophobicContact CG-CB 3.8Å; E185-A189 VanDerWaalsContact O-CB 3.29Å; E185-A189 WeakPolarHBondContact O-CB 3.21Å; E185-A189 PolarHBondContact O-N 3.21Å; L186-A189 PolarHBondContact O-N 3.25Å; A189-A192 PolarHBondContact O-N 3.06Å; A189-F193 HydrophobicContact CB-CE2 4.5Å; A189-F193 WeakPolarHBondContact O-CD2 3.46Å; A189-F193 PolarHBondContact O-N 3.3Å; A189-I213 HydrophobicContact CB-CD1 3.67Å; A189-I213 HydrophobicContact CB-CG1 4.49Å
190	K	97.1	Very high	96.8	Very high	49 Å²	49	53.6 Å²	53.6	21%	0.213	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-46.9	178.8	-170	-179.1	-168.9	165.7	0	111.5	L186 D187 E188 A192 F193 K194 L210 I213 E217	L186-K190 WeakPolarHBondContact O-CB 3.46Å; L186-K190 PolarHBondContact O-N 3Å; D187-K190 WeakPolarHBondContact O-CB 3.41Å; D187-K190 PolarHBondContact O-N 3.32Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 3.23Å; K190-A192 VanDerWaalsContact C-N 3.34Å; K190-A192 PolarHBondContact O-N 3.34Å; K190-F193 PolarHBondContact O-N 3.49Å; K190-K194 WeakPolarHBondContact O-CG 3.36Å; K190-K194 PolarHBondContact O-N 3.38Å; K190-L210 HydrophobicContact CB-CD2 4.3Å; K190-L210 HydrophobicContact CG-CD2 3.75Å; K190-I213 HydrophobicContact CB-CG2 4.23Å; K190-E217 IonicContact NZ-OE1 3.69Å; K190-E217 IonicContact NZ-OE2 3.51Å; K190-E217 PolarHBondContact NZ-OE2 3.35Å
191	E	97.4	Very high	96.5	Very high	93 Å²	93	58.4 Å²	58.4	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-42.8	176	-72.3	-55.9	128.2	0	0	111.8	D187 E188 F193 K194 K195	D187-E191 PolarHBondContact O-N 2.75Å; D187-E191 VanDerWaalsContact O-N 3.12Å; E188-E191 PolarHBondContact O-N 3.09Å; E191-F193 PolarHBondContact O-N 3.34Å; E191-K194 PolarHBondContact O-N 2.79Å; E191-K194 IonicContact OE1-NZ 2.69Å; E191-K194 PolarHBondContact OE1-NZ 2.88Å; E191-K195 WeakPolarHBondContact O-CG 3.5Å; E191-K195 PolarHBondContact O-N 2.63Å
192	A	97.9	Very high	96.2	Very high	2 Å²	2	63.8 Å²	63.8	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-42.7	177	0	0	0	0	0	112.8	W173 L176 E188 A189 K190 K195 L196	W173-A192 HydrophobicContact CE3-CB 4.13Å; L176-A192 HydrophobicContact CB-CB 4.22Å; L176-A192 HydrophobicContact CD2-CB 4.12Å; L176-A192 HydrophobicContact CG-CB 3.99Å; E188-A192 PolarHBondContact O-N 3.41Å; A189-A192 PolarHBondContact O-N 3.06Å; K190-A192 VanDerWaalsContact C-N 3.34Å; K190-A192 PolarHBondContact O-N 3.34Å; A192-K195 PolarHBondContact O-N 3.04Å; A192-L196 PolarHBondContact O-N 3.19Å
193	F	98.1	Very high	96.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-73.5	-31	177	-70.2	-58	0	0	0	113.5	Y174 G177 Q178 Q181 A189 K190 E191 L196 L197 A206 A209 L210 I213	Y174-F193 HydrophobicContact CD2-CD1 4.26Å; Y174-F193 AromaticContact CD2-CE1 3.66Å; Y174-F193 HydrophobicContact CD2-CE1 3.66Å; Y174-F193 AromaticContact CE2-CE1 3.87Å; Y174-F193 HydrophobicContact CE2-CE1 3.87Å; G177-F193 VanDerWaalsContact C-CZ 3.41Å; Q178-F193 HydrophobicContact CG-CZ 4.37Å; Q181-F193 HydrophobicContact CG-CE2 3.95Å; A189-F193 HydrophobicContact CB-CE2 4.5Å; A189-F193 WeakPolarHBondContact O-CD2 3.46Å; A189-F193 PolarHBondContact O-N 3.3Å; K190-F193 PolarHBondContact O-N 3.49Å; E191-F193 PolarHBondContact O-N 3.34Å; F193-L196 HydrophobicContact CD1-CD2 4.15Å; F193-L196 WeakPolarHBondContact O-CB 2.98Å; F193-L196 PolarHBondContact O-N 3.41Å; F193-L197 WeakPolarHBondContact O-CG 3.47Å; F193-L197 PolarHBondContact O-N 3.06Å; F193-A206 HydrophobicContact CD1-CB 4.2Å; F193-A209 HydrophobicContact CD1-CB 4.26Å; F193-A209 HydrophobicContact CD2-CB 3.9Å; F193-A209 HydrophobicContact CE1-CB 3.96Å; F193-A209 HydrophobicContact CE2-CB 3.58Å; F193-A209 HydrophobicContact CG-CB 4.24Å; F193-A209 HydrophobicContact CZ-CB 3.6Å; F193-L210 HydrophobicContact CB-CD1 4.25Å; F193-L210 HydrophobicContact CB-CD2 3.76Å; F193-L210 HydrophobicContact CB-CG 3.73Å; F193-I213 HydrophobicContact CD2-CD1 3.61Å; F193-I213 HydrophobicContact CE2-CD1 3.8Å
194	K	97	Very high	96	Very high	83 Å²	83	62.5 Å²	62.5	36%	0.361	32%	0.32	S	S	.	.	H	α-helix	trans	-62.7	-48.3	170	-75.5	174.8	-177.2	170.3	0	111	K190 E191 L196 L197 E198	K190-K194 WeakPolarHBondContact O-CG 3.36Å; K190-K194 PolarHBondContact O-N 3.38Å; E191-K194 PolarHBondContact O-N 2.79Å; E191-K194 IonicContact OE1-NZ 2.69Å; E191-K194 PolarHBondContact OE1-NZ 2.88Å; K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 3.02Å; K194-L197 CarbonylContact O-C 3.58Å; K194-L197 PolarHBondContact O-N 3.32Å; K194-E198 PolarHBondContact O-N 2.99Å
195	K	97.6	Very high	96	Very high	75 Å²	75	60.3 Å²	60.3	33%	0.326	31%	0.313	S	S	.	.	H	α-helix	trans	-58.6	-38.5	174.5	-72	-49	-171.6	-168.7	0	112.5	W173 E191 A192 L197 E198 I199	W173-K195 HydrophobicContact CD2-CB 3.77Å; W173-K195 HydrophobicContact CE3-CB 3.8Å; W173-K195 HydrophobicContact CE3-CG 4.34Å; W173-K195 HydrophobicContact CG-CB 4.35Å; W173-K195 HydrophobicContact CH2-CB 4.21Å; W173-K195 HydrophobicContact CH2-CG 3.98Å; W173-K195 HydrophobicContact CZ2-CB 4.17Å; W173-K195 HydrophobicContact CZ2-CG 4.23Å; W173-K195 HydrophobicContact CZ3-CB 4.03Å; W173-K195 HydrophobicContact CZ3-CG 4.04Å; E191-K195 WeakPolarHBondContact O-CG 3.5Å; E191-K195 PolarHBondContact O-N 2.63Å; A192-K195 PolarHBondContact O-N 3.04Å; K195-L197 VanDerWaalsContact C-N 3.35Å; K195-L197 PolarHBondContact O-N 3.2Å; K195-E198 WeakPolarHBondContact CD-OE2 3.5Å; K195-E198 IonicContact NZ-OE1 3.87Å; K195-E198 PolarHBondContact NZ-OE1 2.88Å; K195-E198 IonicContact NZ-OE2 3.3Å; K195-E198 PolarHBondContact NZ-OE2 3.35Å; K195-E198 WeakPolarHBondContact O-CB 3.39Å; K195-E198 PolarHBondContact O-N 3.39Å; K195-I199 WeakPolarHBondContact O-CD1 3.24Å; K195-I199 WeakPolarHBondContact O-CG1 3.39Å; K195-I199 PolarHBondContact O-N 2.92Å
196	L	97.6	Very high	95.9	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-43.1	172.3	178.4	56	0	0	0	112.6	S170 W173 Y174 A192 F193 K194 I199 Q200 L203 A206	S170-L196 VanDerWaalsContact O-CD1 3.28Å; S170-L196 WeakPolarHBondContact O-CD1 3.27Å; W173-L196 HydrophobicContact CB-CB 3.97Å; W173-L196 HydrophobicContact CB-CD1 4.43Å; Y174-L196 HydrophobicContact CD2-CD2 3.48Å; Y174-L196 VanDerWaalsContact CD2-CD2 3.48Å; Y174-L196 HydrophobicContact CG-CD2 3.97Å; A192-L196 PolarHBondContact O-N 3.19Å; F193-L196 HydrophobicContact CD1-CD2 4.15Å; F193-L196 WeakPolarHBondContact O-CB 2.98Å; F193-L196 PolarHBondContact O-N 3.41Å; K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 3.02Å; L196-I199 PolarHBondContact O-N 3.17Å; L196-Q200 PolarHBondContact O-N 3.01Å; L196-L203 HydrophobicContact CD1-CD2 4.05Å; L196-L203 HydrophobicContact CD2-CD2 3.57Å; L196-L203 HydrophobicContact CG-CD2 3.83Å; L196-A206 HydrophobicContact CD2-CB 3.87Å; L196-A206 HydrophobicContact CG-CB 4.29Å
197	L	97.1	Very high	95.9	Very high	33 Å²	33	61.8 Å²	61.8	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-71.6	-27.1	177.8	-71	175.7	0	0	0	113.1	F193 K194 K195 I199 Q200 P201 L203 A206 V207 L210	F193-L197 WeakPolarHBondContact O-CG 3.47Å; F193-L197 PolarHBondContact O-N 3.06Å; K194-L197 CarbonylContact O-C 3.58Å; K194-L197 PolarHBondContact O-N 3.32Å; K195-L197 VanDerWaalsContact C-N 3.35Å; K195-L197 PolarHBondContact O-N 3.2Å; L197-I199 PolarHBondContact O-N 3.09Å; L197-Q200 WeakPolarHBondContact CA-O 3.47Å; L197-Q200 WeakPolarHBondContact CD2-O 3.4Å; L197-Q200 CarbonylContact O-C 3.49Å; L197-P201 WeakPolarHBondContact O-CA 3.45Å; L197-P201 WeakPolarHBondContact O-CG 3.49Å; L197-P201 VanDerWaalsContact O-N 3.13Å; L197-L203 HydrophobicContact CD2-CB 4.31Å; L197-A206 HydrophobicContact CD1-CB 4.49Å; L197-A206 HydrophobicContact CD2-CB 3.78Å; L197-A206 HydrophobicContact CG-CB 3.94Å; L197-V207 HydrophobicContact CD1-CG2 4.22Å; L197-V207 HydrophobicContact CD2-CG2 4.05Å; L197-L210 HydrophobicContact CD1-CD1 3.47Å; L197-L210 VanDerWaalsContact CD1-CD1 3.47Å
198	E	96.8	Very high	95.9	Very high	127 Å²	127	64.2 Å²	64.2	59%	0.593	33%	0.332	S	S	*	.	H	α-helix	trans	-61.3	-34.7	168.6	-69.6	174.3	-164.8	0	0	111.3	K194 K195	K194-E198 PolarHBondContact O-N 2.99Å; K195-E198 WeakPolarHBondContact CD-OE2 3.5Å; K195-E198 IonicContact NZ-OE1 3.87Å; K195-E198 PolarHBondContact NZ-OE1 2.88Å; K195-E198 IonicContact NZ-OE2 3.3Å; K195-E198 PolarHBondContact NZ-OE2 3.35Å; K195-E198 WeakPolarHBondContact O-CB 3.39Å; K195-E198 PolarHBondContact O-N 3.39Å
199	I	96	Very high	95.9	Very high	64 Å²	64	59.5 Å²	59.5	33%	0.328	31%	0.311	S	S	.	.	H	α-helix	trans	-86.5	-39.6	-180	-57.2	161.7	0	0	0	111.5	P167 W173 K195 L196 L197	P167-I199 WeakPolarHBondContact O-CD1 3.22Å; W173-I199 HydrophobicContact CG-CD1 4.35Å; K195-I199 WeakPolarHBondContact O-CD1 3.24Å; K195-I199 WeakPolarHBondContact O-CG1 3.39Å; K195-I199 PolarHBondContact O-N 2.92Å; L196-I199 PolarHBondContact O-N 3.17Å; L197-I199 PolarHBondContact O-N 3.09Å
200	Q	95.1	Very high	95.8	Very high	80 Å²	80	60.7 Å²	60.7	37%	0.374	32%	0.317	S	S	.	.			trans	-132.1	84.6	-178.8	-66.9	-171.6	-27.2	0	0	109.6	S170 L196 L197 D202 L203	S170-Q200 PolarHBondContact OG-NE2 3.4Å; L196-Q200 PolarHBondContact O-N 3.01Å; L197-Q200 WeakPolarHBondContact CA-O 3.47Å; L197-Q200 WeakPolarHBondContact CD2-O 3.4Å; L197-Q200 CarbonylContact O-C 3.49Å; Q200-D202 PolarHBondContact O-N 2.87Å; Q200-L203 HydrophobicContact CB-CB 4.37Å
201	P	93.2	Very high	95.7	Very high	103 Å²	103	65.8 Å²	65.8	67%	0.669	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.1	-173.3	-27	35.6	0	0	0	114.9	L197	L197-P201 WeakPolarHBondContact O-CA 3.45Å; L197-P201 WeakPolarHBondContact O-CG 3.49Å; L197-P201 VanDerWaalsContact O-N 3.13Å
202	D	90	Very high	95.6	Very high	149 Å²	149	65.8 Å²	65.8	80%	0.797	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	59.1	-177.7	-168	17.1	0	0	0	111.6	Q200 P204	Q200-D202 PolarHBondContact O-N 2.87Å; D202-P204 WeakPolarHBondContact O-CD 3.43Å
203	L	94.1	Very high	95.5	Very high	43 Å²	43	65.7 Å²	65.7	23%	0.225	34%	0.338	C	S	.	.			trans	-109.8	97.9	173.8	-171.8	63.7	0	0	0	110.6	L196 L197 Q200 A205 A206 V207	L196-L203 HydrophobicContact CD1-CD2 4.05Å; L196-L203 HydrophobicContact CD2-CD2 3.57Å; L196-L203 HydrophobicContact CG-CD2 3.83Å; L197-L203 HydrophobicContact CD2-CB 4.31Å; Q200-L203 HydrophobicContact CB-CB 4.37Å; L203-A205 HydrophobicContact CG-CB 4.43Å; L203-A205 PolarHBondContact O-N 3.49Å; L203-A205 VanDerWaalsContact O-N 3.08Å; L203-A206 HydrophobicContact CB-CB 4.24Å; L203-A206 HydrophobicContact CD2-CB 4.09Å; L203-A206 HydrophobicContact CG-CB 4.25Å; L203-A206 PolarHBondContact O-N 2.96Å; L203-V207 PolarHBondContact O-N 3.46Å
204	P	94.8	Very high	95.3	Very high	93 Å²	93	70.3 Å²	70.3	60%	0.604	36%	0.361	S	S	*	.	H	α-helix	trans	-55	-34.4	-176.7	-28.8	34.6	0	0	0	113.9	D202 A206 V207 K208	D202-P204 WeakPolarHBondContact O-CD 3.43Å; P204-A206 VanDerWaalsContact C-N 3.34Å; P204-A206 PolarHBondContact O-N 3.3Å; P204-V207 PolarHBondContact O-N 2.84Å; P204-K208 WeakPolarHBondContact O-CB 3.39Å; P204-K208 PolarHBondContact O-N 3.28Å
205	A	94.2	Very high	95.2	Very high	37 Å²	37	69.2 Å²	69.2	31%	0.306	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-37.7	178.3	0	0	0	0	0	112.7	Y174 L203 A209	Y174-A205 HydrophobicContact CE2-CB 3.88Å; L203-A205 HydrophobicContact CG-CB 4.43Å; L203-A205 PolarHBondContact O-N 3.49Å; L203-A205 VanDerWaalsContact O-N 3.08Å; A205-A209 WeakPolarHBondContact O-CB 3.3Å; A205-A209 PolarHBondContact O-N 3.02Å; A205-A209 VanDerWaalsContact O-N 3.09Å
206	A	94.4	Very high	95	Very high	0 Å²	0	71 Å²	71	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-75	-41	178.7	0	0	0	0	0	111.5	F193 L196 L197 L203 P204 K208 A209 L210	F193-A206 HydrophobicContact CD1-CB 4.2Å; L196-A206 HydrophobicContact CD2-CB 3.87Å; L196-A206 HydrophobicContact CG-CB 4.29Å; L197-A206 HydrophobicContact CD1-CB 4.49Å; L197-A206 HydrophobicContact CD2-CB 3.78Å; L197-A206 HydrophobicContact CG-CB 3.94Å; L203-A206 HydrophobicContact CB-CB 4.24Å; L203-A206 HydrophobicContact CD2-CB 4.09Å; L203-A206 HydrophobicContact CG-CB 4.25Å; L203-A206 PolarHBondContact O-N 2.96Å; P204-A206 VanDerWaalsContact C-N 3.34Å; P204-A206 PolarHBondContact O-N 3.3Å; A206-K208 VanDerWaalsContact C-N 3.34Å; A206-K208 PolarHBondContact O-N 3.44Å; A206-A209 PolarHBondContact O-N 3.36Å; A206-L210 WeakPolarHBondContact O-CG 3.46Å; A206-L210 PolarHBondContact O-N 3.39Å
207	V	95.4	Very high	94.7	Very high	79 Å²	79	71.9 Å²	71.9	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-44.9	174.8	179.1	0	0	0	0	110.9	L197 L203 P204 L210 K211	L197-V207 HydrophobicContact CD1-CG2 4.22Å; L197-V207 HydrophobicContact CD2-CG2 4.05Å; L203-V207 PolarHBondContact O-N 3.46Å; P204-V207 PolarHBondContact O-N 2.84Å; V207-L210 PolarHBondContact O-N 2.73Å; V207-K211 PolarHBondContact O-N 2.99Å
208	K	96.4	Very high	94.6	Very high	133 Å²	133	77.7 Å²	77.7	58%	0.578	40%	0.396	S	S	*	.	H	α-helix	trans	-59.9	-48.5	175.3	-176.8	-179.6	174.4	-176.8	0	111.5	P204 A206 L210 K211 E212	P204-K208 WeakPolarHBondContact O-CB 3.39Å; P204-K208 PolarHBondContact O-N 3.28Å; A206-K208 VanDerWaalsContact C-N 3.34Å; A206-K208 PolarHBondContact O-N 3.44Å; K208-L210 VanDerWaalsContact C-N 3.34Å; K208-L210 PolarHBondContact O-N 2.99Å; K208-K211 PolarHBondContact O-N 3.29Å; K208-E212 WeakPolarHBondContact CE-OE1 3.47Å; K208-E212 WeakPolarHBondContact O-CG 3.34Å; K208-E212 PolarHBondContact O-N 3.2Å
209	A	95.2	Very high	94.4	Very high	6 Å²	6	76.8 Å²	76.8	5%	0.05	39%	0.392	C	S	.	.	H	α-helix	trans	-60.3	-41.4	179.4	0	0	0	0	0	112.4	F193 A205 A206 E212 I213	F193-A209 HydrophobicContact CD1-CB 4.26Å; F193-A209 HydrophobicContact CD2-CB 3.9Å; F193-A209 HydrophobicContact CE1-CB 3.96Å; F193-A209 HydrophobicContact CE2-CB 3.58Å; F193-A209 HydrophobicContact CG-CB 4.24Å; F193-A209 HydrophobicContact CZ-CB 3.6Å; A205-A209 WeakPolarHBondContact O-CB 3.3Å; A205-A209 PolarHBondContact O-N 3.02Å; A205-A209 VanDerWaalsContact O-N 3.09Å; A206-A209 PolarHBondContact O-N 3.36Å; A209-E212 PolarHBondContact O-N 3.2Å; A209-I213 WeakPolarHBondContact O-CD1 3.39Å; A209-I213 VanDerWaalsContact O-CG1 3.26Å; A209-I213 WeakPolarHBondContact O-CG1 3.47Å; A209-I213 PolarHBondContact O-N 2.78Å
210	L	95.6	Very high	94.1	Very high	25 Å²	25	78.1 Å²	78.1	13%	0.131	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-42.1	175.1	-77.6	174.3	0	0	0	112.5	K190 F193 L197 A206 V207 K208 E212 I213 M214	K190-L210 HydrophobicContact CB-CD2 4.3Å; K190-L210 HydrophobicContact CG-CD2 3.75Å; F193-L210 HydrophobicContact CB-CD1 4.25Å; F193-L210 HydrophobicContact CB-CD2 3.76Å; F193-L210 HydrophobicContact CB-CG 3.73Å; L197-L210 HydrophobicContact CD1-CD1 3.47Å; L197-L210 VanDerWaalsContact CD1-CD1 3.47Å; A206-L210 WeakPolarHBondContact O-CG 3.46Å; A206-L210 PolarHBondContact O-N 3.39Å; V207-L210 PolarHBondContact O-N 2.73Å; K208-L210 VanDerWaalsContact C-N 3.34Å; K208-L210 PolarHBondContact O-N 2.99Å; L210-E212 VanDerWaalsContact C-N 3.33Å; L210-E212 PolarHBondContact O-N 3.16Å; L210-I213 PolarHBondContact O-N 3.42Å; L210-M214 WeakPolarHBondContact O-CG 3.15Å; L210-M214 PolarHBondContact O-N 3.02Å
211	K	95.8	Very high	94	Very high	155 Å²	155	78.9 Å²	78.9	67%	0.674	40%	0.4	S	S	*	.	H	α-helix	trans	-61.4	-43	176.5	-171.7	177.8	-179.6	179.4	0	111.6	V207 K208 M214 S215	V207-K211 PolarHBondContact O-N 2.99Å; K208-K211 PolarHBondContact O-N 3.29Å; K211-M214 PolarHBondContact O-N 3.49Å; K211-S215 PolarHBondContact O-N 3.29Å; K211-S215 VanDerWaalsContact O-N 3.09Å
212	E	95.4	Very high	94.1	Very high	93 Å²	93	78 Å²	78	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-44.9	175.3	-70.9	171.4	-176.9	0	0	111.5	K208 A209 L210 M214 S215 R216	K208-E212 WeakPolarHBondContact CE-OE1 3.47Å; K208-E212 WeakPolarHBondContact O-CG 3.34Å; K208-E212 PolarHBondContact O-N 3.2Å; A209-E212 PolarHBondContact O-N 3.2Å; L210-E212 VanDerWaalsContact C-N 3.33Å; L210-E212 PolarHBondContact O-N 3.16Å; E212-M214 PolarHBondContact O-N 2.68Å; E212-S215 PolarHBondContact O-N 3.11Å; E212-R216 WeakPolarHBondContact O-CG 3.31Å; E212-R216 PolarHBondContact O-N 3.26Å; E212-R216 VanDerWaalsContact O-N 3.1Å
213	I	95.5	Very high	94.2	Very high	0 Å²	0	76 Å²	76	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-60	-47.5	177.1	-69.8	162.2	0	0	0	111.1	Q181 L186 A189 K190 F193 A209 L210 S215 R216 E217	Q181-I213 HydrophobicContact CG-CD1 3.86Å; Q181-I213 HydrophobicContact CG-CG1 3.98Å; L186-I213 HydrophobicContact CB-CG2 4.1Å; L186-I213 HydrophobicContact CD2-CG2 4.45Å; A189-I213 HydrophobicContact CB-CD1 3.67Å; A189-I213 HydrophobicContact CB-CG1 4.49Å; K190-I213 HydrophobicContact CB-CG2 4.23Å; F193-I213 HydrophobicContact CD2-CD1 3.61Å; F193-I213 HydrophobicContact CE2-CD1 3.8Å; A209-I213 WeakPolarHBondContact O-CD1 3.39Å; A209-I213 VanDerWaalsContact O-CG1 3.26Å; A209-I213 WeakPolarHBondContact O-CG1 3.47Å; A209-I213 PolarHBondContact O-N 2.78Å; L210-I213 PolarHBondContact O-N 3.42Å; I213-S215 VanDerWaalsContact C-N 3.31Å; I213-S215 PolarHBondContact O-N 3.08Å; I213-R216 PolarHBondContact O-N 3.17Å; I213-R216 VanDerWaalsContact O-N 3.16Å; I213-E217 HydrophobicContact CG2-CG 4.32Å; I213-E217 WeakPolarHBondContact O-CG 3.42Å; I213-E217 PolarHBondContact O-N 3.31Å
214	M	94.1	Very high	94.1	Very high	98 Å²	98	78 Å²	78	48%	0.483	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-36.3	179.3	-70.7	-170.7	-60.2	0	0	112.8	L210 K211 E212 K218	L210-M214 WeakPolarHBondContact O-CG 3.15Å; L210-M214 PolarHBondContact O-N 3.02Å; K211-M214 PolarHBondContact O-N 3.49Å; E212-M214 PolarHBondContact O-N 2.68Å; M214-K218 WeakPolarHBondContact O-CB 3.37Å; M214-K218 PolarHBondContact O-N 3.05Å
215	S	94.5	Very high	94	Very high	59 Å²	59	75.4 Å²	75.4	41%	0.413	38%	0.379	S	S	.	.	H	α-helix	trans	-62.4	-47.7	173.8	-164.1	0	0	0	0	110.9	K211 E212 I213 E217 K218 E219	K211-S215 PolarHBondContact O-N 3.29Å; K211-S215 VanDerWaalsContact O-N 3.09Å; E212-S215 PolarHBondContact O-N 3.11Å; I213-S215 VanDerWaalsContact C-N 3.31Å; I213-S215 PolarHBondContact O-N 3.08Å; S215-E217 PolarHBondContact O-N 3.5Å; S215-K218 WeakPolarHBondContact O-CB 3.48Å; S215-K218 PolarHBondContact O-N 3.07Å; S215-E219 WeakPolarHBondContact O-CG 3.16Å; S215-E219 PolarHBondContact O-N 3.05Å; S215-E219 PolarHBondContact OG-OE1 3.18Å; S215-E219 VanDerWaalsContact OG-OE1 3.05Å
216	R	93.4	Very high	94	Very high	114 Å²	114	78.8 Å²	78.8	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-38.7	179.7	-65.5	178.1	96	-165.7	3.7	112.2	L186 E212 I213 E219 R220	L186-R216 HydrophobicContact CD1-CB 3.88Å; L186-R216 HydrophobicContact CD2-CB 4.48Å; E212-R216 WeakPolarHBondContact O-CG 3.31Å; E212-R216 PolarHBondContact O-N 3.26Å; E212-R216 VanDerWaalsContact O-N 3.1Å; I213-R216 PolarHBondContact O-N 3.17Å; I213-R216 VanDerWaalsContact O-N 3.16Å; R216-E219 PolarHBondContact O-N 3.17Å; R216-R220 VanDerWaalsContact O-CB 3.29Å; R216-R220 WeakPolarHBondContact O-CB 3.48Å; R216-R220 PolarHBondContact O-N 3.38Å
217	E	92.6	Very high	94	Very high	19 Å²	19	86.3 Å²	86.3	9%	0.089	42%	0.42	C	S	.	.	H	α-helix	trans	-60.6	-46.6	173	-77	177.3	170	0	0	111.3	L186 K190 I213 S215 R220 N221	L186-E217 HydrophobicContact CB-CG 4.13Å; L186-E217 HydrophobicContact CD1-CG 3.93Å; K190-E217 IonicContact NZ-OE1 3.69Å; K190-E217 IonicContact NZ-OE2 3.51Å; K190-E217 PolarHBondContact NZ-OE2 3.35Å; I213-E217 HydrophobicContact CG2-CG 4.32Å; I213-E217 WeakPolarHBondContact O-CG 3.42Å; I213-E217 PolarHBondContact O-N 3.31Å; S215-E217 PolarHBondContact O-N 3.5Å; E217-R220 PolarHBondContact O-N 3.3Å; E217-N221 WeakPolarHBondContact O-CB 2.99Å; E217-N221 PolarHBondContact O-N 3.29Å; E217-N221 PolarHBondContact O-ND2 2.94Å; E217-N221 PolarHBondContact O-OD1 2.95Å
218	K	93.1	Very high	93.9	Very high	154 Å²	154	86.9 Å²	86.9	67%	0.67	42%	0.419	S	S	*	.	H	α-helix	trans	-61.1	-46.6	178.3	-176.2	177.8	178.7	-178.7	0	111.4	M214 S215 N221 V222	M214-K218 WeakPolarHBondContact O-CB 3.37Å; M214-K218 PolarHBondContact O-N 3.05Å; S215-K218 WeakPolarHBondContact O-CB 3.48Å; S215-K218 PolarHBondContact O-N 3.07Å; K218-N221 PolarHBondContact O-N 3.05Å; K218-V222 WeakPolarHBondContact O-CG2 3.46Å; K218-V222 PolarHBondContact O-N 3.19Å
219	E	92.7	Very high	93.8	Very high	109 Å²	109	84.3 Å²	84.3	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-60.5	-45.4	176.3	-72	162.1	-148.1	0	0	111.8	S215 R216 N221 V222 Q223	S215-E219 WeakPolarHBondContact O-CG 3.16Å; S215-E219 PolarHBondContact O-N 3.05Å; S215-E219 PolarHBondContact OG-OE1 3.18Å; S215-E219 VanDerWaalsContact OG-OE1 3.05Å; R216-E219 PolarHBondContact O-N 3.17Å; E219-N221 VanDerWaalsContact C-N 3.35Å; E219-N221 PolarHBondContact O-N 3.44Å; E219-V222 PolarHBondContact O-N 2.95Å; E219-Q223 WeakPolarHBondContact O-CG 3.29Å; E219-Q223 PolarHBondContact O-N 3.25Å
220	R	90.8	Very high	93.7	Very high	92 Å²	92	92 Å²	92	35%	0.347	45%	0.451	S	S	.	.	H	α-helix	trans	-57.7	-46.8	175.7	-179.2	177.9	70.7	163	-4.7	111.3	D187 R216 E217 Q223 L224	D187-R220 IonicContact OD2-NH2 3.29Å; D187-R220 PolarHBondContact OD2-NH2 2.79Å; R216-R220 VanDerWaalsContact O-CB 3.29Å; R216-R220 WeakPolarHBondContact O-CB 3.48Å; R216-R220 PolarHBondContact O-N 3.38Å; E217-R220 PolarHBondContact O-N 3.3Å; R220-Q223 PolarHBondContact O-N 3.12Å; R220-L224 HydrophobicContact CG-CD1 3.78Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 WeakPolarHBondContact O-CD1 3.43Å; R220-L224 WeakPolarHBondContact O-CG 3.32Å; R220-L224 PolarHBondContact O-N 3.16Å
221	N	92.2	Very high	93.4	Very high	95 Å²	95	97.5 Å²	97.5	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-40	-179	-68.8	-8.3	0	0	0	112.1	E217 K218 E219 L224 G225	E217-N221 WeakPolarHBondContact O-CB 2.99Å; E217-N221 PolarHBondContact O-N 3.29Å; E217-N221 PolarHBondContact O-ND2 2.94Å; E217-N221 PolarHBondContact O-OD1 2.95Å; K218-N221 PolarHBondContact O-N 3.05Å; E219-N221 VanDerWaalsContact C-N 3.35Å; E219-N221 PolarHBondContact O-N 3.44Å; N221-L224 PolarHBondContact O-N 3.27Å; N221-G225 PolarHBondContact O-N 2.65Å
222	V	94.7	Very high	93.1	Very high	85 Å²	85	98.4 Å²	98.4	52%	0.515	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-46.5	173.4	170.8	0	0	0	0	110.7	K218 E219 L224 G225 L226	K218-V222 WeakPolarHBondContact O-CG2 3.46Å; K218-V222 PolarHBondContact O-N 3.19Å; E219-V222 PolarHBondContact O-N 2.95Å; V222-L224 PolarHBondContact O-N 3.01Å; V222-G225 PolarHBondContact O-N 3.27Å; V222-L226 HydrophobicContact CG1-CD1 4.31Å; V222-L226 WeakPolarHBondContact O-CG 3.4Å; V222-L226 PolarHBondContact O-N 3.02Å
223	Q	92.6	Very high	92	Very high	108 Å²	108	100.7 Å²	100.7	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-40.4	177.7	-73.5	-165.6	6.2	0	0	112.8	E219 R220 L226 R227	E219-Q223 WeakPolarHBondContact O-CG 3.29Å; E219-Q223 PolarHBondContact O-N 3.25Å; R220-Q223 PolarHBondContact O-N 3.12Å; Q223-L226 PolarHBondContact O-N 3.49Å; Q223-R227 WeakPolarHBondContact O-CG 3.2Å; Q223-R227 PolarHBondContact O-N 3.29Å
224	L	92	Very high	91.9	Very high	83 Å²	83	105.8 Å²	105.8	44%	0.435	53%	0.534	S	S	.	.	H	α-helix	trans	-59.8	-47.1	174.4	-83	151.5	0	0	0	111.2	R220 N221 V222 L226 R227 L228	R220-L224 HydrophobicContact CG-CD1 3.78Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 WeakPolarHBondContact O-CD1 3.43Å; R220-L224 WeakPolarHBondContact O-CG 3.32Å; R220-L224 PolarHBondContact O-N 3.16Å; N221-L224 PolarHBondContact O-N 3.27Å; V222-L224 PolarHBondContact O-N 3.01Å; L224-L226 VanDerWaalsContact C-N 3.34Å; L224-L226 PolarHBondContact O-N 3.31Å; L224-R227 PolarHBondContact O-N 2.88Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.3Å; L224-L228 PolarHBondContact O-N 3.22Å
225	G	93.5	Very high	91.8	Very high	39 Å²	39	106.2 Å²	106.2	40%	0.402	54%	0.536	S	S	.	.	H	α-helix	trans	-58.5	-43.4	176.5	0	0	0	0	0	113	N221 V222 L228 S229	N221-G225 PolarHBondContact O-N 2.65Å; V222-G225 PolarHBondContact O-N 3.27Å; G225-L228 PolarHBondContact O-N 2.89Å; G225-S229 WeakPolarHBondContact O-CB 3.46Å; G225-S229 PolarHBondContact O-N 3.04Å
226	L	94.6	Very high	91.6	Very high	108 Å²	108	108.8 Å²	108.8	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-63.9	-41.3	176.1	-69.9	172.5	0	0	0	112.6	V222 Q223 L224 K230	V222-L226 HydrophobicContact CG1-CD1 4.31Å; V222-L226 WeakPolarHBondContact O-CG 3.4Å; V222-L226 PolarHBondContact O-N 3.02Å; Q223-L226 PolarHBondContact O-N 3.49Å; L224-L226 VanDerWaalsContact C-N 3.34Å; L224-L226 PolarHBondContact O-N 3.31Å; L226-K230 WeakPolarHBondContact O-CG 3.49Å; L226-K230 PolarHBondContact O-N 3.27Å
227	R	94	Very high	91.5	Very high	159 Å²	159	108.5 Å²	108.5	60%	0.6	55%	0.55	S	S	*	.	H	α-helix	trans	-66.2	-44	177.9	-73	177.6	-172.7	176.6	4.6	111.5	Q223 L224 K230 M231	Q223-R227 WeakPolarHBondContact O-CG 3.2Å; Q223-R227 PolarHBondContact O-N 3.29Å; L224-R227 PolarHBondContact O-N 2.88Å; R227-K230 PolarHBondContact O-N 3.36Å; R227-M231 WeakPolarHBondContact O-CG 3.47Å; R227-M231 PolarHBondContact O-N 2.69Å
228	L	93.9	Very high	91.4	Very high	90 Å²	90	114.1 Å²	114.1	47%	0.471	58%	0.579	S	S	.	*	H	α-helix	trans	-61	-45.8	176.4	-70.3	169.8	0	0	0	110.8	L224 G225 K230 M231 F232	L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.3Å; L224-L228 PolarHBondContact O-N 3.22Å; G225-L228 PolarHBondContact O-N 2.89Å; L228-K230 PolarHBondContact O-N 2.93Å; L228-M231 PolarHBondContact O-N 2.85Å; L228-F232 HydrophobicContact CD2-CE2 4.26Å; L228-F232 WeakPolarHBondContact O-CD2 3.45Å; L228-F232 PolarHBondContact O-N 2.75Å
229	S	93.4	Very high	91.3	Very high	80 Å²	80	111.4 Å²	111.4	56%	0.559	57%	0.573	S	S	*	*	H	α-helix	trans	-56.9	-35.8	177.1	-175.5	0	0	0	0	113.2	G225 S233	G225-S229 WeakPolarHBondContact O-CB 3.46Å; G225-S229 PolarHBondContact O-N 3.04Å; S229-S233 WeakPolarHBondContact O-CB 3.5Å; S229-S233 PolarHBondContact O-N 2.81Å; S229-S233 PolarHBondContact O-OG 3.01Å
230	K	93	Very high	91.2	Very high	166 Å²	166	111.6 Å²	111.6	72%	0.722	58%	0.577	S	S	*	*	H	α-helix	trans	-75.9	-22.4	177.3	-72.2	-179.3	178.3	-174.1	0	114.1	L226 R227 L228 S233	L226-K230 WeakPolarHBondContact O-CG 3.49Å; L226-K230 PolarHBondContact O-N 3.27Å; R227-K230 PolarHBondContact O-N 3.36Å; L228-K230 PolarHBondContact O-N 2.93Å; K230-S233 WeakPolarHBondContact CA-OG 3.46Å; K230-S233 PolarHBondContact O-OG 2.74Å
231	M	89.6	Confident	91.2	Very high	141 Å²	141	113.1 Å²	113.1	70%	0.695	60%	0.595	S	S	*	*	H	α-helix	trans	-79.8	-24	178.4	-72.3	177.3	66.3	0	0	112.6	R227 L228	R227-M231 WeakPolarHBondContact O-CG 3.47Å; R227-M231 PolarHBondContact O-N 2.69Å; L228-M231 PolarHBondContact O-N 2.85Å
232	F	88.6	Confident	91.2	Very high	174 Å²	174	114.6 Å²	114.6	76%	0.763	60%	0.602	S	S	*	*			trans	-109.5	4.7	-177.7	-60.9	-70.2	0	0	0	113.7	L228	L228-F232 HydrophobicContact CD2-CE2 4.26Å; L228-F232 WeakPolarHBondContact O-CD2 3.45Å; L228-F232 PolarHBondContact O-N 2.75Å
233	S	74.2	Confident	90.8	Very high	142 Å²	142	117.3 Å²	117.3	99%	0.993	61%	0.61	S	S	*	*			trans	-101.2	0	170.8	64.8	0	0	0	0	110.4	S229 K230	S229-S233 WeakPolarHBondContact O-CB 3.5Å; S229-S233 PolarHBondContact O-N 2.81Å; S229-S233 PolarHBondContact O-OG 3.01Å; K230-S233 WeakPolarHBondContact CA-OG 3.46Å; K230-S233 PolarHBondContact O-OG 2.74Å

Retrieved 233 of 233 residues in 527.9 ms (Link to these results)

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