A0A096M4M4_POEFO Loading...

Cyclin dependent kinase like 1 (CDC2 related kinase)

AlphaFold DB , UniProt , Accession A0A096M4M4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 283 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	33.4	Very low	32.4	Very low	250 Å²	250	147.6 Å²	147.6	100%	1.232	86%	0.864	S	S	*	*				0	129.3	0	-63.8	-174.8	-177.5	0	0	106.9
2	A	33.5	Very low	32.8	Very low	103 Å²	103	148.8 Å²	148.8	85%	0.851	86%	0.855	S	S	*	*			cis	-148.5	139.7	3.4	0	0	0	0	0	107.2
3	G	31.1	Very low	33.5	Very low	72 Å²	72	146.5 Å²	146.5	74%	0.742	85%	0.846	S	S	*	*			trans	-82	123.5	176.6	0	0	0	0	0	111	H5	G3-H5 PolarHBondContact O-N 3.36Å
4	A	32.2	Very low	34.1	Very low	102 Å²	102	149.6 Å²	149.6	84%	0.843	85%	0.845	S	S	*	*			trans	-77.8	103.7	174.3	0	0	0	0	0	110.2	K6	A4-K6 PolarHBondContact O-N 3.31Å
5	H	35.6	Very low	35.2	Very low	189 Å²	189	143.3 Å²	143.3	88%	0.875	81%	0.808	S	S	*	*			trans	-66.6	109.7	168.5	-90.1	-82	0	0	0	109.8	G3 A7	G3-H5 PolarHBondContact O-N 3.36Å; H5-A7 PolarHBondContact O-N 3.21Å
6	K	33.9	Very low	35.9	Very low	204 Å²	204	138.1 Å²	138.1	89%	0.887	78%	0.784	S	S	*	*			trans	-69.1	108.2	162.9	-83.5	-179.2	176.6	176.7	0	108.5	A4 Q8	A4-K6 PolarHBondContact O-N 3.31Å; K6-Q8 PolarHBondContact O-N 3.26Å
7	A	30.8	Very low	37	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	78%	0.784	S	S	*	*			trans	-63.3	116.2	166.8	0	0	0	0	0	109.2	H5 K9	H5-A7 PolarHBondContact O-N 3.21Å; A7-K9 PolarHBondContact O-N 3.21Å
8	Q	33.1	Very low	38	Very low	197 Å²	197	135.5 Å²	135.5	92%	0.921	78%	0.782	S	S	*	*			trans	-66.1	112.5	166.2	-88.5	171.2	-31.5	0	0	108.2	K6 A10	K6-Q8 PolarHBondContact O-N 3.26Å; Q8-A10 PolarHBondContact O-N 3.22Å
9	K	32.8	Very low	39.2	Very low	210 Å²	210	129.8 Å²	129.8	91%	0.913	75%	0.751	S	S	*	*			trans	-65.9	119.3	167.7	-118.6	177.1	179	-179.2	0	107.8	A7	A7-K9 PolarHBondContact O-N 3.21Å
10	A	29.5	Very low	40.4	Very low	81 Å²	81	125 Å²	125	67%	0.669	72%	0.721	S	S	*	*			trans	-58.5	145.1	168.6	0	0	0	0	0	109.8	Q8 Q12	Q8-A10 PolarHBondContact O-N 3.22Å; A10-Q12 PolarHBondContact O-N 3.25Å; A10-Q12 VanDerWaalsContact O-N 3.08Å
11	P	30.8	Very low	41.8	Very low	118 Å²	118	123.5 Å²	123.5	77%	0.766	71%	0.709	S	S	*	*			trans	-67.3	110.7	177.7	27.2	-31.2	0	0	0	109	T13	P11-T13 PolarHBondContact O-N 3.07Å; P11-T13 VanDerWaalsContact O-N 3.12Å
12	Q	37.4	Very low	43.4	Very low	161 Å²	161	113.5 Å²	113.5	75%	0.752	66%	0.663	S	S	*	*			trans	-70.2	102.8	162.7	-77.7	-178.7	-12.6	0	0	106.9	A10 F14	A10-Q12 PolarHBondContact O-N 3.25Å; A10-Q12 VanDerWaalsContact O-N 3.08Å; Q12-F14 HydrophobicContact CB-CE2 4.39Å; Q12-F14 WeakPolarHBondContact O-CD2 3.43Å; Q12-F14 PolarHBondContact O-N 3.35Å
13	T	41.1	Very low	45.1	Very low	120 Å²	120	108.7 Å²	108.7	74%	0.736	62%	0.624	S	S	*	*			trans	-65.8	104	169.5	40.5	0	0	0	0	108.2	P11 L15	P11-T13 PolarHBondContact O-N 3.07Å; P11-T13 VanDerWaalsContact O-N 3.12Å; T13-L15 PolarHBondContact O-N 2.86Å
14	F	42.4	Very low	46.4	Very low	190 Å²	190	106.1 Å²	106.1	83%	0.833	60%	0.597	S	S	*	*			trans	-70	100.8	171	-80.1	-93.5	0	0	0	108.3	Q12	Q12-F14 HydrophobicContact CB-CE2 4.39Å; Q12-F14 WeakPolarHBondContact O-CD2 3.43Å; Q12-F14 PolarHBondContact O-N 3.35Å
15	L	49.9	Very low	47.4	Very low	54 Å²	54	106.5 Å²	106.5	28%	0.283	59%	0.588	S	S	.	*			trans	-67.4	132.6	170.6	-69.9	170.6	0	0	0	109.2	T13 F20 T71 V75	T13-L15 PolarHBondContact O-N 2.86Å; L15-F20 HydrophobicContact CB-CE2 4.06Å; L15-F20 HydrophobicContact CB-CZ 4.43Å; L15-F20 HydrophobicContact CD1-CZ 4.42Å; L15-T71 HydrophobicContact CD1-CG2 4.12Å; L15-V75 HydrophobicContact CD1-CB 3.99Å; L15-V75 HydrophobicContact CD1-CG1 4.26Å; L15-V75 HydrophobicContact CD1-CG2 3.76Å
16	S	46.9	Very low	48.1	Very low	61 Å²	61	98.7 Å²	98.7	43%	0.427	56%	0.555	S	S	.	*			trans	-63.5	146.8	179.3	66.9	0	0	0	0	110.8	S18 S19	S16-S18 PolarHBondContact O-N 3.34Å; S16-S18 VanDerWaalsContact O-N 3.11Å; S16-S18 PolarHBondContact OG-OG 2.62Å; S16-S19 WeakPolarHBondContact O-CB 3.39Å; S16-S19 PolarHBondContact O-N 3.08Å; S16-S19 PolarHBondContact O-OG 3.38Å
17	P	54.3	Low	48.9	Very low	121 Å²	121	91.7 Å²	91.7	79%	0.786	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-54.5	-31.7	177.1	-26.5	34.5	0	0	0	113.6	S19 F20	P17-S19 PolarHBondContact O-N 3.05Å; P17-S19 VanDerWaalsContact O-N 3.16Å; P17-F20 PolarHBondContact O-N 3.12Å
18	S	55.4	Low	49.5	Very low	108 Å²	108	90.7 Å²	90.7	76%	0.755	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-67.5	-6.9	176.4	54.5	0	0	0	0	115.4	S16	S16-S18 PolarHBondContact O-N 3.34Å; S16-S18 VanDerWaalsContact O-N 3.11Å; S16-S18 PolarHBondContact OG-OG 2.62Å
19	S	61.7	Low	49.9	Very low	28 Å²	28	84.9 Å²	84.9	20%	0.196	51%	0.507	C	S	.	.	G	3₁₀ helix	trans	-91	-2.9	-179.3	65.9	0	0	0	0	114.1	S16 P17 T71	S16-S19 WeakPolarHBondContact O-CB 3.39Å; S16-S19 PolarHBondContact O-N 3.08Å; S16-S19 PolarHBondContact O-OG 3.38Å; P17-S19 PolarHBondContact O-N 3.05Å; P17-S19 VanDerWaalsContact O-N 3.16Å; S19-T71 WeakPolarHBondContact O-CA 3.34Å; S19-T71 WeakPolarHBondContact O-CB 3.49Å; S19-T71 WeakPolarHBondContact O-CG2 3.24Å
20	F	61.9	Low	50.8	Low	32 Å²	32	84.5 Å²	84.5	14%	0.14	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.8	-177.3	-75.5	-84.8	0	0	0	111	L15 P17 L69 T71 V75 K77	L15-F20 HydrophobicContact CB-CE2 4.06Å; L15-F20 HydrophobicContact CB-CZ 4.43Å; L15-F20 HydrophobicContact CD1-CZ 4.42Å; P17-F20 PolarHBondContact O-N 3.12Å; F20-L69 HydrophobicContact CB-CB 4Å; F20-L69 HydrophobicContact CB-CD1 4.11Å; F20-L69 HydrophobicContact CD1-CB 3.68Å; F20-L69 HydrophobicContact CG-CB 4.22Å; F20-L69 HydrophobicContact CG-CD1 4.45Å; F20-T71 HydrophobicContact CD1-CG2 3.35Å; F20-T71 HydrophobicContact CD2-CG2 3.94Å; F20-T71 HydrophobicContact CE1-CG2 3.2Å; F20-T71 HydrophobicContact CE2-CG2 3.79Å; F20-T71 HydrophobicContact CG-CG2 3.73Å; F20-T71 HydrophobicContact CZ-CG2 3.41Å; F20-T71 VanDerWaalsContact CZ-CG2 3.41Å; F20-V75 HydrophobicContact CE1-CG1 4.35Å; F20-V75 HydrophobicContact CZ-CG1 4.39Å; F20-K77 HydrophobicContact CE1-CB 4.19Å; F20-K77 HydrophobicContact CE1-CD 3.62Å; F20-K77 HydrophobicContact CE1-CG 3.77Å; F20-K77 HydrophobicContact CZ-CD 3.62Å; F20-K77 HydrophobicContact CZ-CG 4.23Å
21	I	70.2	Confident	52.1	Low	94 Å²	94	83 Å²	83	48%	0.482	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.8	177.3	-56	175.7	0	0	0	108	V25 I70	I21-V25 HydrophobicContact CG2-CB 4.01Å; I21-V25 HydrophobicContact CG2-CG1 4.05Å; I21-I70 PolarHBondContact N-O 2.95Å; I21-I70 PolarHBondContact O-N 3.11Å
22	P	67.1	Low	53.3	Low	40 Å²	40	84.8 Å²	84.8	26%	0.26	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	139.4	173.8	-23.2	33	0	0	0	112	G24 V25 S26 I68 L69	P22-G24 PolarHBondContact O-N 2.9Å; P22-V25 HydrophobicContact CB-CB 4.48Å; P22-V25 HydrophobicContact CB-CG2 4.02Å; P22-V25 HydrophobicContact CG-CG2 4.16Å; P22-V25 PolarHBondContact O-N 3.45Å; P22-S26 PolarHBondContact O-N 3.16Å; P22-I68 CarbonylContact C-O 3.49Å; P22-I68 WeakPolarHBondContact CA-O 3.31Å; P22-L69 HydrophobicContact CG-CD2 4.23Å
23	C	69.3	Low	54.2	Low	3 Å²	3	81.9 Å²	81.9	2%	0.02	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.2	-177.5	80.4	0	0	0	0	111.8	V25 S26 L27 P65 I68 I70	C23-V25 VanDerWaalsContact C-N 3.28Å; C23-V25 PolarHBondContact O-N 3.34Å; C23-S26 WeakPolarHBondContact O-CA 3.33Å; C23-S26 WeakPolarHBondContact O-CB 3.41Å; C23-S26 PolarHBondContact O-N 3Å; C23-L27 PolarHBondContact O-N 3.11Å; C23-P65 PolarHBondContact N-O 3.17Å; C23-P65 WeakPolarHBondContact SG-CA 3.42Å; C23-P65 PolarHBondContact SG-O 3.29Å; C23-I68 HydrophobicContact CB-CB 4.3Å; C23-I68 HydrophobicContact CB-CG2 4.16Å; C23-I68 WeakPolarHBondContact CB-O 3.32Å; C23-I68 PolarHBondContact N-O 3.21Å; C23-I70 HydrophobicContact CB-CD1 3.36Å; C23-I70 HydrophobicContact CB-CG1 3.89Å
24	G	57.3	Low	55.2	Low	18 Å²	18	78.8 Å²	78.8	19%	0.186	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-33.2	171.5	0	0	0	0	0	113.5	P22 S26 L27 P65	P22-G24 PolarHBondContact O-N 2.9Å; G24-S26 VanDerWaalsContact C-N 3.29Å; G24-S26 PolarHBondContact O-N 2.93Å; G24-L27 WeakPolarHBondContact O-CB 3.3Å; G24-L27 VanDerWaalsContact O-CD1 3.24Å; G24-L27 WeakPolarHBondContact O-CD1 3.42Å; G24-L27 WeakPolarHBondContact O-CG 3.35Å; G24-L27 PolarHBondContact O-N 3.33Å; G24-P65 PolarHBondContact N-O 3.47Å
25	V	54	Low	56.3	Low	109 Å²	109	71.2 Å²	71.2	66%	0.661	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-75.6	-22.8	176.1	179.1	0	0	0	0	111.2	I21 P22 C23 L27	I21-V25 HydrophobicContact CG2-CB 4.01Å; I21-V25 HydrophobicContact CG2-CG1 4.05Å; P22-V25 HydrophobicContact CB-CB 4.48Å; P22-V25 HydrophobicContact CB-CG2 4.02Å; P22-V25 HydrophobicContact CG-CG2 4.16Å; P22-V25 PolarHBondContact O-N 3.45Å; C23-V25 VanDerWaalsContact C-N 3.28Å; C23-V25 PolarHBondContact O-N 3.34Å; V25-L27 VanDerWaalsContact C-N 3.29Å; V25-L27 PolarHBondContact O-N 2.88Å
26	S	50.6	Low	57	Low	26 Å²	26	70.8 Å²	70.8	18%	0.182	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-83.3	3	174.9	-164.1	0	0	0	0	113.8	P22 C23 G24 G28 C29 Q34	P22-S26 PolarHBondContact O-N 3.16Å; C23-S26 WeakPolarHBondContact O-CA 3.33Å; C23-S26 WeakPolarHBondContact O-CB 3.41Å; C23-S26 PolarHBondContact O-N 3Å; G24-S26 VanDerWaalsContact C-N 3.29Å; G24-S26 PolarHBondContact O-N 2.93Å; S26-G28 PolarHBondContact O-N 3.13Å; S26-C29 PolarHBondContact O-N 3.35Å; S26-Q34 VanDerWaalsContact OG-CD 3.25Å; S26-Q34 PolarHBondContact OG-NE2 3.34Å; S26-Q34 PolarHBondContact OG-OE1 3.3Å
27	L	50.3	Low	57.9	Low	56 Å²	56	68.6 Å²	68.6	29%	0.293	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-60.5	-11.7	177.8	-72.8	170	0	0	0	113.7	C23 G24 V25 C29 L131	C23-L27 PolarHBondContact O-N 3.11Å; G24-L27 WeakPolarHBondContact O-CB 3.3Å; G24-L27 VanDerWaalsContact O-CD1 3.24Å; G24-L27 WeakPolarHBondContact O-CD1 3.42Å; G24-L27 WeakPolarHBondContact O-CG 3.35Å; G24-L27 PolarHBondContact O-N 3.33Å; V25-L27 VanDerWaalsContact C-N 3.29Å; V25-L27 PolarHBondContact O-N 2.88Å; L27-C29 VanDerWaalsContact C-N 3.33Å; L27-L131 HydrophobicContact CD2-CD2 4.02Å
28	G	43.8	Very low	58.4	Low	77 Å²	77	62.9 Å²	62.9	79%	0.794	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-74.5	-14.2	167.3	0	0	0	0	0	115.1	S26	S26-G28 PolarHBondContact O-N 3.13Å
29	C	42	Very low	58.9	Low	76 Å²	76	57.9 Å²	57.9	51%	0.514	33%	0.332	S	S	.	.			trans	-111.1	85	178.5	-79.8	0	0	0	0	110.5	S26 L27 S31 Q34	S26-C29 PolarHBondContact O-N 3.35Å; L27-C29 VanDerWaalsContact C-N 3.33Å; C29-S31 PolarHBondContact O-N 3.2Å; C29-Q34 PolarHBondContact O-OE1 3.12Å
30	K	49.8	Very low	59	Low	201 Å²	201	57.8 Å²	57.8	87%	0.874	33%	0.331	S	S	*	.			trans	-64.8	29.7	173.3	-59.7	-177.8	177.5	-177.2	0	114.6	E32	K30-E32 PolarHBondContact O-N 2.77Å
31	S	57.1	Low	59.4	Low	51 Å²	51	56.5 Å²	56.5	36%	0.357	33%	0.326	S	S	.	.			trans	-70.4	120	176.4	63.1	0	0	0	0	108.5	C29 L33 Q34	C29-S31 PolarHBondContact O-N 3.2Å; S31-L33 PolarHBondContact O-N 3.33Å; S31-Q34 PolarHBondContact O-N 2.86Å; S31-Q34 WeakPolarHBondContact OG-CG 3.46Å
32	E	57	Low	59.2	Low	155 Å²	155	52.4 Å²	52.4	72%	0.724	30%	0.304	S	S	*	.	H	α-helix	trans	-45.9	-31.6	174.3	-158.8	167.6	-166.8	0	0	112.3	K30 Q34 L35 E36	K30-E32 PolarHBondContact O-N 2.77Å; E32-Q34 PolarHBondContact O-N 2.88Å; E32-L35 WeakPolarHBondContact O-CB 2.98Å; E32-L35 PolarHBondContact O-N 3.1Å; E32-E36 WeakPolarHBondContact O-CG 3.21Å; E32-E36 PolarHBondContact O-N 2.76Å
33	L	56.3	Low	59	Low	99 Å²	99	50.6 Å²	50.6	52%	0.518	29%	0.292	S	S	.	.	H	α-helix	trans	-61.3	-32.8	174.6	-66.4	169.1	0	0	0	115.1	S31 A37	S31-L33 PolarHBondContact O-N 3.33Å; L33-A37 WeakPolarHBondContact O-CB 3.48Å; L33-A37 PolarHBondContact O-N 2.92Å
34	Q	62.2	Low	58.5	Low	56 Å²	56	54.7 Å²	54.7	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-74.9	-40.4	178.4	-78.8	-177.5	-10.4	0	0	111.5	S26 C29 S31 E32 A37 V38	S26-Q34 VanDerWaalsContact OG-CD 3.25Å; S26-Q34 PolarHBondContact OG-NE2 3.34Å; S26-Q34 PolarHBondContact OG-OE1 3.3Å; C29-Q34 PolarHBondContact O-OE1 3.12Å; S31-Q34 PolarHBondContact O-N 2.86Å; S31-Q34 WeakPolarHBondContact OG-CG 3.46Å; E32-Q34 PolarHBondContact O-N 2.88Å; Q34-A37 PolarHBondContact O-N 3.39Å; Q34-V38 VanDerWaalsContact O-CG2 3.31Å; Q34-V38 WeakPolarHBondContact O-CG2 3.47Å; Q34-V38 PolarHBondContact O-N 3.21Å
35	L	64.4	Low	58.2	Low	31 Å²	31	58.3 Å²	58.3	16%	0.162	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-50.7	171.1	-95	151.1	0	0	0	110.6	E32 A37 V38 L39 F128 L131 L132	E32-L35 WeakPolarHBondContact O-CB 2.98Å; E32-L35 PolarHBondContact O-N 3.1Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.04Å; L35-V38 PolarHBondContact O-N 2.84Å; L35-L39 WeakPolarHBondContact O-CB 3.5Å; L35-L39 WeakPolarHBondContact O-CD1 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.04Å; L35-L39 PolarHBondContact O-N 2.89Å; L35-F128 HydrophobicContact CD2-CD2 4.4Å; L35-F128 HydrophobicContact CD2-CE2 4.47Å; L35-L131 HydrophobicContact CD2-CB 3.39Å; L35-L131 HydrophobicContact CD2-CD1 4.44Å; L35-L131 HydrophobicContact CG-CB 4.05Å; L35-L132 HydrophobicContact CD1-CD2 4.29Å; L35-L132 HydrophobicContact CD2-CD2 3.88Å; L35-L132 HydrophobicContact CD2-CG 4.08Å
36	E	65.8	Low	57.8	Low	45 Å²	45	63.4 Å²	63.4	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-42.7	176.9	-75.6	-172.4	162.7	0	0	112.2	E32 C40 M226	E32-E36 WeakPolarHBondContact O-CG 3.21Å; E32-E36 PolarHBondContact O-N 2.76Å; E36-C40 VanDerWaalsContact O-CB 3.24Å; E36-C40 WeakPolarHBondContact O-CB 3.33Å; E36-C40 PolarHBondContact O-N 2.98Å; E36-C40 PolarHBondContact O-SG 2.83Å; E36-M226 HydrophobicContact CB-SD 3.98Å; E36-M226 HydrophobicContact CG-SD 3.87Å
37	A	64.4	Low	57.5	Low	14 Å²	14	66.2 Å²	66.2	12%	0.116	35%	0.348	C	S	.	.	H	α-helix	trans	-65.8	-45.1	178.8	0	0	0	0	0	112	L33 Q34 L35 L39 C40 F41 Q74 I76	L33-A37 WeakPolarHBondContact O-CB 3.48Å; L33-A37 PolarHBondContact O-N 2.92Å; Q34-A37 PolarHBondContact O-N 3.39Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.04Å; A37-L39 VanDerWaalsContact C-N 3.34Å; A37-L39 PolarHBondContact O-N 2.94Å; A37-C40 CarbonylContact O-C 3.37Å; A37-C40 PolarHBondContact O-N 2.83Å; A37-F41 WeakPolarHBondContact O-CB 3.43Å; A37-F41 PolarHBondContact O-N 2.79Å; A37-Q74 HydrophobicContact CB-CB 4.37Å; A37-I76 HydrophobicContact CB-CD1 3.88Å; A37-I76 VanDerWaalsContact O-CD1 3.26Å; A37-I76 WeakPolarHBondContact O-CD1 3.46Å
38	V	66.4	Low	57.4	Low	2 Å²	2	64.1 Å²	64.1	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-42.4	178.1	175.5	0	0	0	0	111.2	Q34 L35 F41 F42 I70 I76 L131	Q34-V38 VanDerWaalsContact O-CG2 3.31Å; Q34-V38 WeakPolarHBondContact O-CG2 3.47Å; Q34-V38 PolarHBondContact O-N 3.21Å; L35-V38 PolarHBondContact O-N 2.84Å; V38-F41 WeakPolarHBondContact O-CB 3.28Å; V38-F41 PolarHBondContact O-N 2.75Å; V38-F41 VanDerWaalsContact O-N 3.17Å; V38-F42 HydrophobicContact CG1-CD2 3.73Å; V38-F42 HydrophobicContact CG1-CE2 3.62Å; V38-F42 VanDerWaalsContact O-CD2 3.27Å; V38-F42 WeakPolarHBondContact O-CD2 2.91Å; V38-F42 PolarHBondContact O-N 2.76Å; V38-I70 HydrophobicContact CG2-CD1 3.4Å; V38-I70 VanDerWaalsContact CG2-CD1 3.4Å; V38-I70 HydrophobicContact CG2-CG1 4.39Å; V38-I76 HydrophobicContact CB-CD1 4.16Å; V38-I76 HydrophobicContact CG2-CD1 3.72Å; V38-I76 VanDerWaalsContact N-CD1 3.29Å; V38-L131 HydrophobicContact CB-CD1 4.02Å; V38-L131 HydrophobicContact CG1-CD1 3.67Å; V38-L131 HydrophobicContact CG2-CD1 4.3Å
39	L	65.5	Low	57.6	Low	2 Å²	2	61.8 Å²	61.8	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-68	-42	176.8	-63.3	164.7	0	0	0	111	L35 A37 F41 F42 F43 F128 Y222 F223	L35-L39 WeakPolarHBondContact O-CB 3.5Å; L35-L39 WeakPolarHBondContact O-CD1 3.31Å; L35-L39 WeakPolarHBondContact O-CG 3.04Å; L35-L39 PolarHBondContact O-N 2.89Å; A37-L39 VanDerWaalsContact C-N 3.34Å; A37-L39 PolarHBondContact O-N 2.94Å; L39-F41 PolarHBondContact O-N 3.02Å; L39-F42 PolarHBondContact O-N 2.89Å; L39-F43 HydrophobicContact CB-CD2 4.24Å; L39-F43 HydrophobicContact CD2-CD2 4.3Å; L39-F43 HydrophobicContact CD2-CE2 3.75Å; L39-F43 WeakPolarHBondContact O-CB 3.01Å; L39-F43 WeakPolarHBondContact O-CD2 3.28Å; L39-F43 PolarHBondContact O-N 3.47Å; L39-F128 HydrophobicContact CD1-CD2 3.8Å; L39-F128 HydrophobicContact CD1-CE2 3.33Å; L39-F128 HydrophobicContact CD1-CZ 4.15Å; L39-F128 HydrophobicContact CD2-CB 4.24Å; L39-F128 HydrophobicContact CD2-CD2 3.36Å; L39-F128 HydrophobicContact CD2-CE2 3.69Å; L39-F128 HydrophobicContact CD2-CG 3.84Å; L39-F128 HydrophobicContact CD2-CZ 4.4Å; L39-F128 HydrophobicContact CG-CD2 4.08Å; L39-F128 HydrophobicContact CG-CE2 4.09Å; L39-Y222 HydrophobicContact CD1-CE1 3.75Å; L39-Y222 VanDerWaalsContact CD1-OH 3.26Å; L39-Y222 WeakPolarHBondContact CD1-OH 3.48Å; L39-F223 HydrophobicContact CB-CE1 4.16Å; L39-F223 HydrophobicContact CB-CZ 4.39Å
40	C	64.1	Low	57.6	Low	27 Å²	27	61.1 Å²	61.1	18%	0.182	30%	0.303	C	S	.	.	I	π-helix	trans	-61.1	-34.2	170.9	-76.7	0	0	0	0	111.9	E36 A37 K44 D45 M226	E36-C40 VanDerWaalsContact O-CB 3.24Å; E36-C40 WeakPolarHBondContact O-CB 3.33Å; E36-C40 PolarHBondContact O-N 2.98Å; E36-C40 PolarHBondContact O-SG 2.83Å; A37-C40 CarbonylContact O-C 3.37Å; A37-C40 PolarHBondContact O-N 2.83Å; C40-K44 HydrophobicContact CB-CB 4.04Å; C40-K44 HydrophobicContact CB-CD 4.44Å; C40-K44 CarbonylContact O-C 3.52Å; C40-K44 WeakPolarHBondContact O-CA 3.09Å; C40-K44 WeakPolarHBondContact O-CB 3.48Å; C40-K44 PolarHBondContact O-N 3.46Å; C40-D45 PolarHBondContact O-N 3.21Å; C40-M226 WeakPolarHBondContact SG-CE 3.38Å
41	F	68.9	Low	57.2	Low	5 Å²	5	56.9 Å²	56.9	2%	0.022	29%	0.289	C	S	.	.	I	π-helix	trans	-67.4	-47.8	176.6	171.1	-100.6	0	0	0	112.3	A37 V38 L39 V48 I76 L78	A37-F41 WeakPolarHBondContact O-CB 3.43Å; A37-F41 PolarHBondContact O-N 2.79Å; V38-F41 WeakPolarHBondContact O-CB 3.28Å; V38-F41 PolarHBondContact O-N 2.75Å; V38-F41 VanDerWaalsContact O-N 3.17Å; L39-F41 PolarHBondContact O-N 3.02Å; F41-V48 HydrophobicContact CE1-CG2 3.74Å; F41-V48 HydrophobicContact CE2-CG2 4.02Å; F41-V48 HydrophobicContact CZ-CG2 3.38Å; F41-I76 HydrophobicContact CB-CB 3.63Å; F41-I76 HydrophobicContact CB-CD1 3.84Å; F41-I76 HydrophobicContact CB-CG1 4.18Å; F41-I76 HydrophobicContact CB-CG2 3.73Å; F41-I76 HydrophobicContact CD1-CB 4.09Å; F41-I76 HydrophobicContact CD1-CG2 3.38Å; F41-I76 HydrophobicContact CD2-CB 3.55Å; F41-I76 HydrophobicContact CD2-CG2 3.76Å; F41-I76 VanDerWaalsContact CD2-O 3.31Å; F41-I76 WeakPolarHBondContact CD2-O 3.25Å; F41-I76 HydrophobicContact CE1-CG2 3.85Å; F41-I76 VanDerWaalsContact CE2-C 3.47Å; F41-I76 HydrophobicContact CE2-CB 4.2Å; F41-I76 HydrophobicContact CE2-CG2 4.2Å; F41-I76 WeakPolarHBondContact CE2-O 3.36Å; F41-I76 HydrophobicContact CG-CB 3.47Å; F41-I76 VanDerWaalsContact CG-CB 3.47Å; F41-I76 HydrophobicContact CG-CG2 3.31Å; F41-I76 HydrophobicContact CZ-CG2 4.23Å; F41-L78 HydrophobicContact CE1-CB 4.42Å; F41-L78 HydrophobicContact CZ-CB 4.36Å
42	F	66.1	Low	56.8	Low	7 Å²	7	54.9 Å²	54.9	3%	0.031	27%	0.274	C	S	.	.	I	π-helix	trans	-69.1	-38.8	-179.6	-79.4	-62.8	0	0	0	113.1	V38 L39 V63 I68 I124	V38-F42 HydrophobicContact CG1-CD2 3.73Å; V38-F42 HydrophobicContact CG1-CE2 3.62Å; V38-F42 VanDerWaalsContact O-CD2 3.27Å; V38-F42 WeakPolarHBondContact O-CD2 2.91Å; V38-F42 PolarHBondContact O-N 2.76Å; L39-F42 PolarHBondContact O-N 2.89Å; F42-V63 HydrophobicContact CE1-CG1 4.08Å; F42-V63 HydrophobicContact CZ-CG1 3.94Å; F42-I68 HydrophobicContact CE2-CD1 3.63Å; F42-I68 HydrophobicContact CE2-CG1 4.2Å; F42-I68 HydrophobicContact CZ-CD1 3.42Å; F42-I68 VanDerWaalsContact CZ-CD1 3.42Å; F42-I68 HydrophobicContact CZ-CG1 3.69Å; F42-I124 HydrophobicContact CB-CD1 4.26Å; F42-I124 HydrophobicContact CB-CG2 4.18Å; F42-I124 HydrophobicContact CD1-CD1 3.48Å; F42-I124 VanDerWaalsContact CD1-CD1 3.48Å; F42-I124 HydrophobicContact CD1-CG1 3.61Å; F42-I124 HydrophobicContact CD2-CG1 4.44Å; F42-I124 HydrophobicContact CD2-CG2 4.21Å; F42-I124 HydrophobicContact CE1-CD1 3.99Å; F42-I124 HydrophobicContact CE1-CG1 3.74Å; F42-I124 HydrophobicContact CG-CD1 4.01Å; F42-I124 HydrophobicContact CG-CG1 3.98Å; F42-I124 HydrophobicContact CG-CG2 4.07Å; F42-I124 HydrophobicContact CZ-CG1 4.2Å
43	F	64.2	Low	56.5	Low	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.249	C	C	.	.	I	π-helix	trans	-98.5	-55.8	-175.2	-55.4	-58.7	0	0	0	110.5	L39 I124 L199 L217 L218 F223	L39-F43 HydrophobicContact CB-CD2 4.24Å; L39-F43 HydrophobicContact CD2-CD2 4.3Å; L39-F43 HydrophobicContact CD2-CE2 3.75Å; L39-F43 WeakPolarHBondContact O-CB 3.01Å; L39-F43 WeakPolarHBondContact O-CD2 3.28Å; L39-F43 PolarHBondContact O-N 3.47Å; F43-I124 HydrophobicContact CE1-CG2 4.12Å; F43-I124 HydrophobicContact CE2-CG2 4.16Å; F43-I124 HydrophobicContact CZ-CG2 3.5Å; F43-L199 HydrophobicContact CE2-CD2 4.37Å; F43-L217 HydrophobicContact CD1-CB 3.53Å; F43-L217 HydrophobicContact CD1-CD1 4.07Å; F43-L217 HydrophobicContact CD1-CG 4.39Å; F43-L217 HydrophobicContact CE1-CB 3.66Å; F43-L217 HydrophobicContact CE1-CD1 3.38Å; F43-L217 HydrophobicContact CE1-CG 4.04Å; F43-L217 HydrophobicContact CG-CB 4.34Å; F43-L217 HydrophobicContact CZ-CB 4.5Å; F43-L217 HydrophobicContact CZ-CD1 4.15Å; F43-L218 HydrophobicContact CB-CD2 4.12Å; F43-L218 HydrophobicContact CB-CG 4.09Å; F43-L218 WeakPolarHBondContact O-CD1 3.32Å; F43-L218 WeakPolarHBondContact O-CD2 3.44Å; F43-L218 WeakPolarHBondContact O-CG 3.45Å; F43-F223 HydrophobicContact CB-CE2 4.2Å; F43-F223 HydrophobicContact CB-CZ 3.93Å; F43-F223 HydrophobicContact CD2-CE1 4.28Å; F43-F223 HydrophobicContact CD2-CE2 4.02Å; F43-F223 AromaticContact CD2-CZ 3.37Å; F43-F223 HydrophobicContact CD2-CZ 3.37Å; F43-F223 HydrophobicContact CE2-CZ 4.15Å; F43-F223 HydrophobicContact CG-CE2 4.19Å; F43-F223 AromaticContact CG-CZ 3.88Å; F43-F223 HydrophobicContact CG-CZ 3.88Å
44	K	58.4	Low	55.9	Low	89 Å²	89	48.9 Å²	48.9	39%	0.387	26%	0.258	S	S	.	.	I	π-helix	trans	-84	-37.8	-166	-159.2	176.1	-179.2	177.7	0	116.1	C40 L218	C40-K44 HydrophobicContact CB-CB 4.04Å; C40-K44 HydrophobicContact CB-CD 4.44Å; C40-K44 CarbonylContact O-C 3.52Å; C40-K44 WeakPolarHBondContact O-CA 3.09Å; C40-K44 WeakPolarHBondContact O-CB 3.48Å; C40-K44 PolarHBondContact O-N 3.46Å; K44-L218 HydrophobicContact CB-CD2 3.89Å; K44-L218 HydrophobicContact CG-CD2 4.19Å
45	D	51.3	Low	55.2	Low	95 Å²	95	50.5 Å²	50.5	51%	0.508	28%	0.276	S	S	.	.	S	Bend	trans	-84.5	124	-173.9	-121.7	1.1	0	0	0	110.4	C40 V47	C40-D45 PolarHBondContact O-N 3.21Å; D45-V47 HydrophobicContact CB-CG2 4.44Å; D45-V47 PolarHBondContact O-N 3.03Å
46	R	45.2	Very low	54.6	Low	215 Å²	215	53.1 Å²	53.1	81%	0.811	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	21.9	-175.2	-63.8	-175.3	172.6	-176.5	-2.7	114.1	P50	R46-P50 WeakPolarHBondContact O-CD 3.25Å; R46-P50 WeakPolarHBondContact O-CG 3.03Å
47	V	44.9	Very low	54.6	Low	85 Å²	85	56.5 Å²	56.5	52%	0.515	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-29.5	-171.2	-175.2	0	0	0	0	111.4	D45	D45-V47 HydrophobicContact CB-CG2 4.44Å; D45-V47 PolarHBondContact O-N 3.03Å
48	V	48.1	Very low	55	Low	13 Å²	13	56.7 Å²	56.7	8%	0.079	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-30.7	177.1	-173.8	0	0	0	0	111.9	F41 L52 F53	F41-V48 HydrophobicContact CE1-CG2 3.74Å; F41-V48 HydrophobicContact CE2-CG2 4.02Å; F41-V48 HydrophobicContact CZ-CG2 3.38Å; V48-L52 HydrophobicContact CG1-CB 4.13Å; V48-L52 HydrophobicContact CG1-CD1 4.06Å; V48-L52 HydrophobicContact CG1-CD2 4.05Å; V48-L52 HydrophobicContact CG1-CG 4.31Å; V48-L52 WeakPolarHBondContact O-CB 3.12Å; V48-L52 PolarHBondContact O-N 3.5Å; V48-F53 HydrophobicContact CG1-CD2 4.28Å; V48-F53 HydrophobicContact CG1-CE2 3.94Å
49	T	46.8	Very low	55.7	Low	28 Å²	28	56.6 Å²	56.6	17%	0.172	31%	0.305	C	S	.	.	I	π-helix	trans	-65.3	-39.1	-172.8	-2.4	0	0	0	0	114.9	F53 A54 C214	T49-F53 PolarHBondContact O-N 3.37Å; T49-A54 PolarHBondContact O-N 3.39Å; T49-C214 HydrophobicContact CG2-CB 3.8Å
50	P	42.1	Very low	56.6	Low	61 Å²	61	56.5 Å²	56.5	40%	0.396	30%	0.304	S	S	.	.	I	π-helix	trans	-83.6	-33	178.7	-14.7	31	0	0	0	114.4	R46 S55	R46-P50 WeakPolarHBondContact O-CD 3.25Å; R46-P50 WeakPolarHBondContact O-CG 3.03Å; P50-S55 PolarHBondContact O-OG 2.77Å
51	L	42.3	Very low	57.6	Low	113 Å²	113	57.3 Å²	57.3	59%	0.592	30%	0.303	S	S	*	.	I	π-helix	trans	-89.6	-30.6	-173.8	-76.5	167.7	0	0	0	113.6
52	L	48.2	Very low	58.4	Low	8 Å²	8	57.4 Å²	57.4	4%	0.042	30%	0.304	C	S	.	.	I	π-helix	trans	-89.2	-53	168.1	-96.5	77.6	0	0	0	111.9	V48 C58 H60 F81	V48-L52 HydrophobicContact CG1-CB 4.13Å; V48-L52 HydrophobicContact CG1-CD1 4.06Å; V48-L52 HydrophobicContact CG1-CD2 4.05Å; V48-L52 HydrophobicContact CG1-CG 4.31Å; V48-L52 WeakPolarHBondContact O-CB 3.12Å; V48-L52 PolarHBondContact O-N 3.5Å; L52-C58 CarbonylContact C-O 3.31Å; L52-C58 CarbonylContact O-C 3.59Å; L52-C58 WeakPolarHBondContact O-CA 3.42Å; L52-C58 PolarHBondContact O-N 3.17Å; L52-H60 HydrophobicContact CD2-CB 3.99Å; L52-F81 HydrophobicContact CD1-CE1 3.87Å
53	F	50.9	Low	59.4	Low	42 Å²	42	57.2 Å²	57.2	18%	0.184	30%	0.304	C	S	.	.	I	π-helix	trans	-103.8	-23.8	-153.3	-69.8	-80.7	0	0	0	117.5	V48 T49 P117 D120	V48-F53 HydrophobicContact CG1-CD2 4.28Å; V48-F53 HydrophobicContact CG1-CE2 3.94Å; T49-F53 PolarHBondContact O-N 3.37Å; F53-P117 HydrophobicContact CD1-CB 3.32Å; F53-P117 HydrophobicContact CD1-CG 4.43Å; F53-P117 HydrophobicContact CE1-CB 3.4Å; F53-P117 VanDerWaalsContact CE1-CB 3.4Å; F53-P117 WeakPolarHBondContact CE1-O 3.11Å; F53-D120 HydrophobicContact CE1-CB 4.08Å; F53-D120 HydrophobicContact CZ-CB 3.56Å; F53-D120 WeakPolarHBondContact CZ-OD2 3.35Å
54	A	44.2	Very low	60.5	Low	86 Å²	86	58.3 Å²	58.3	71%	0.711	31%	0.308	S	S	*	.	I	π-helix	trans	-113.3	-27.3	-168.7	0	0	0	0	0	116.4	T49	T49-A54 PolarHBondContact O-N 3.39Å
55	S	46.5	Very low	61.9	Low	91 Å²	91	54 Å²	54	64%	0.636	29%	0.29	S	S	*	.	S	Bend	trans	-119.7	-18.3	-172.1	66	0	0	0	0	115.7	P50	P50-S55 PolarHBondContact O-OG 2.77Å
56	L	51.3	Low	63.5	Low	86 Å²	86	53.5 Å²	53.5	45%	0.45	28%	0.284	S	S	.	.	S	Bend	trans	-125.8	0.7	-175	-65.8	172	0	0	0	114	C58 I86	L56-C58 HydrophobicContact CB-CB 4.44Å; L56-C58 PolarHBondContact O-N 2.69Å; L56-I86 VanDerWaalsContact O-CG2 3.28Å; L56-I86 WeakPolarHBondContact O-CG2 2.92Å
57	Q	67.4	Low	65.4	Low	116 Å²	116	43.8 Å²	43.8	54%	0.542	25%	0.248	S	C	.	.			trans	46.1	46.4	-173.4	-59.8	-174.3	-39.1	0	0	112.7	L87	Q57-L87 HydrophobicContact CB-CB 3.87Å; Q57-L87 HydrophobicContact CB-CD1 4.23Å; Q57-L87 HydrophobicContact CB-CG 4.35Å; Q57-L87 WeakPolarHBondContact O-CG 2.86Å; Q57-L87 PolarHBondContact O-N 2.86Å; Q57-L87 PolarHBondContact OE1-O 3.31Å
58	C	72.9	Confident	67.2	Low	18 Å²	18	39.7 Å²	39.7	12%	0.122	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.9	-176.4	178.6	0	0	0	0	110.9	L52 L56 R85 I86	L52-C58 CarbonylContact C-O 3.31Å; L52-C58 CarbonylContact O-C 3.59Å; L52-C58 WeakPolarHBondContact O-CA 3.42Å; L52-C58 PolarHBondContact O-N 3.17Å; L56-C58 HydrophobicContact CB-CB 4.44Å; L56-C58 PolarHBondContact O-N 2.69Å; C58-R85 CarbonylContact C-O 3.47Å; C58-R85 WeakPolarHBondContact CA-O 3.39Å; C58-I86 HydrophobicContact CB-CG1 4.4Å
59	I	80.8	Confident	68.8	Low	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.8	179.8	-47	176.6	0	0	0	108.4	R61 A84 R85 L87 Y115 P117 V119 D120	I59-R61 HydrophobicContact CB-CG 4.08Å; I59-R61 HydrophobicContact CG2-CG 3.5Å; I59-R61 VanDerWaalsContact CG2-CG 3.5Å; I59-A84 CarbonylContact O-C 3.48Å; I59-A84 WeakPolarHBondContact O-CA 3.49Å; I59-A84 WeakPolarHBondContact O-CB 3.4Å; I59-R85 PolarHBondContact N-O 2.81Å; I59-R85 PolarHBondContact O-N 3.39Å; I59-L87 HydrophobicContact CD1-CD1 3.8Å; I59-L87 HydrophobicContact CD1-CD2 3.59Å; I59-L87 HydrophobicContact CD1-CG 3.8Å; I59-L87 HydrophobicContact CG1-CD1 4.19Å; I59-L87 HydrophobicContact CG1-CD2 4.41Å; I59-L87 HydrophobicContact CG1-CG 4.15Å; I59-Y115 HydrophobicContact CD1-CD2 4.05Å; I59-Y115 HydrophobicContact CD1-CE2 4.28Å; I59-P117 HydrophobicContact CG1-CG 4.48Å; I59-V119 HydrophobicContact CG2-CG2 3.27Å; I59-D120 WeakPolarHBondContact CA-OD2 3.33Å; I59-D120 WeakPolarHBondContact CG2-OD2 3.47Å
60	H	83.9	Confident	70.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.			trans	-75.2	-46.6	176	-160.2	-91.6	0	0	0	112.8	L52 D62 V63 L78 C79 D80 F81 F83 A84 D120	L52-H60 HydrophobicContact CD2-CB 3.99Å; H60-D62 VanDerWaalsContact ND1-C 3.26Å; H60-D62 PolarHBondContact ND1-N 3.46Å; H60-D62 PolarHBondContact ND1-O 2.79Å; H60-D62 PolarHBondContact O-N 2.7Å; H60-V63 HydrophobicContact CB-CG2 3.75Å; H60-V63 PolarHBondContact ND1-N 2.81Å; H60-L78 HydrophobicContact CB-CD2 4.29Å; H60-L78 WeakPolarHBondContact CD2-CD2 3.43Å; H60-C79 PolarHBondContact CE1-O 3.05Å; H60-C79 PolarHBondContact NE2-O 3.38Å; H60-C79 VanDerWaalsContact NE2-O 3.11Å; H60-D80 PolarHBondContact CE1-O 2.81Å; H60-D80 PolarHBondContact NE2-O 2.98Å; H60-F81 AromaticContact CD2-CD1 3.78Å; H60-F81 AromaticContact CD2-CE1 3.83Å; H60-F83 CarbonylContact O-C 3.54Å; H60-F83 VanDerWaalsContact O-C 3.31Å; H60-A84 PolarHBondContact O-N 2.87Å; H60-D120 PolarHBondContact N-OD2 3.14Å
61	R	84.4	Confident	71.9	Confident	43 Å²	43	37.8 Å²	37.8	16%	0.162	21%	0.209	C	C	.	.	S	Bend	trans	65	-9.1	-177.3	-53.5	-172.2	-59.5	167.9	6.8	116.8	I59 F83 R85 Y94 Y115 D120	I59-R61 HydrophobicContact CB-CG 4.08Å; I59-R61 HydrophobicContact CG2-CG 3.5Å; I59-R61 VanDerWaalsContact CG2-CG 3.5Å; R61-F83 HydrophobicContact CB-CB 4.49Å; R61-F83 PolarHBondContact NE-O 2.93Å; R61-F83 PolarHBondContact NH2-O 3.04Å; R61-R85 VanDerWaalsContact NH2-CG 3.3Å; R61-Y94 VanDerWaalsContact NH1-CE1 3.34Å; R61-Y115 PolarHBondContact NH1-OH 3.43Å; R61-D120 PolarHBondContact N-OD1 2.97Å
62	D	86.6	Confident	73.3	Confident	7 Å²	7	40.9 Å²	40.9	4%	0.037	22%	0.217	C	C	.	.			trans	-128.7	41	176.6	-158	53.9	0	0	0	112.1	H60 K64 N67 F83 Y97	H60-D62 VanDerWaalsContact ND1-C 3.26Å; H60-D62 PolarHBondContact ND1-N 3.46Å; H60-D62 PolarHBondContact ND1-O 2.79Å; H60-D62 PolarHBondContact O-N 2.7Å; D62-K64 PolarHBondContact O-N 3.14Å; D62-K64 IonicContact OD1-NZ 3.46Å; D62-K64 PolarHBondContact OD1-NZ 2.77Å; D62-K64 WeakPolarHBondContact OD2-CE 3.44Å; D62-K64 IonicContact OD2-NZ 2.7Å; D62-K64 PolarHBondContact OD2-NZ 3.37Å; D62-N67 PolarHBondContact O-ND2 3.3Å; D62-N67 PolarHBondContact OD2-ND2 3.41Å; D62-F83 HydrophobicContact CB-CB 4.13Å; D62-F83 HydrophobicContact CB-CD2 3.71Å; D62-F83 HydrophobicContact CB-CG 4.23Å; D62-Y97 PolarHBondContact OD1-OH 3.02Å; D62-Y97 PolarHBondContact OD2-OH 3.39Å
63	V	87.3	Confident	74.5	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.024	24%	0.241	C	C	.	.			trans	-72.1	117.2	174.4	-179.3	0	0	0	0	108.9	F42 H60 I68 L78 Y103 D120 A123 I124	F42-V63 HydrophobicContact CE1-CG1 4.08Å; F42-V63 HydrophobicContact CZ-CG1 3.94Å; H60-V63 HydrophobicContact CB-CG2 3.75Å; H60-V63 PolarHBondContact ND1-N 2.81Å; V63-I68 HydrophobicContact CG1-CD1 4.49Å; V63-L78 HydrophobicContact CG2-CD2 4.42Å; V63-Y103 WeakPolarHBondContact O-CB 3.3Å; V63-D120 HydrophobicContact CG2-CB 4.24Å; V63-A123 HydrophobicContact CB-CB 3.75Å; V63-A123 HydrophobicContact CG1-CB 4.3Å; V63-I124 HydrophobicContact CG1-CG1 4.19Å
64	K	87.5	Confident	75.4	Confident	24 Å²	24	49.5 Å²	49.5	10%	0.104	26%	0.258	C	S	.	.			trans	-157.9	161.8	-179.7	62.1	-174	-171.1	-142.2	0	110.5	D62 E66 N67 I68 Y103	D62-K64 PolarHBondContact O-N 3.14Å; D62-K64 IonicContact OD1-NZ 3.46Å; D62-K64 PolarHBondContact OD1-NZ 2.77Å; D62-K64 WeakPolarHBondContact OD2-CE 3.44Å; D62-K64 IonicContact OD2-NZ 2.7Å; D62-K64 PolarHBondContact OD2-NZ 3.37Å; K64-E66 WeakPolarHBondContact CB-OE2 3.15Å; K64-E66 VanDerWaalsContact CD-OE2 3.3Å; K64-E66 WeakPolarHBondContact CD-OE2 3.47Å; K64-E66 HydrophobicContact CG-CB 4.37Å; K64-E66 WeakPolarHBondContact CG-OE2 3.26Å; K64-E66 PolarHBondContact O-N 3.31Å; K64-E66 VanDerWaalsContact O-N 3.14Å; K64-N67 WeakPolarHBondContact CE-ND2 3.24Å; K64-N67 HydrophobicContact CG-CB 4.1Å; K64-N67 PolarHBondContact O-N 3.45Å; K64-I68 WeakPolarHBondContact O-CD1 3.4Å; K64-I68 WeakPolarHBondContact O-CG1 3.44Å; K64-I68 PolarHBondContact O-N 3.41Å; K64-Y103 HydrophobicContact CB-CD2 3.52Å; K64-Y103 HydrophobicContact CB-CE2 3.51Å; K64-Y103 HydrophobicContact CB-CG 4.09Å
65	P	86.3	Confident	76.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-56.1	-31.6	-176.1	-26.6	37.4	0	0	0	114.4	C23 G24 N67 I68 Y103 V127	C23-P65 PolarHBondContact N-O 3.17Å; C23-P65 WeakPolarHBondContact SG-CA 3.42Å; C23-P65 PolarHBondContact SG-O 3.29Å; G24-P65 PolarHBondContact N-O 3.47Å; P65-N67 VanDerWaalsContact C-N 3.27Å; P65-N67 PolarHBondContact O-N 3.29Å; P65-I68 PolarHBondContact O-N 3.28Å; P65-Y103 WeakPolarHBondContact CD-OH 3.46Å; P65-Y103 HydrophobicContact CG-CE1 4.16Å; P65-Y103 WeakPolarHBondContact CG-OH 3.33Å; P65-V127 HydrophobicContact CG-CG2 4.23Å
66	E	85.3	Confident	78.3	Confident	83 Å²	83	44.2 Å²	44.2	39%	0.388	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-67.7	-29.6	178.4	-58.7	80.2	-174.9	0	0	112.5	K64	K64-E66 WeakPolarHBondContact CB-OE2 3.15Å; K64-E66 VanDerWaalsContact CD-OE2 3.3Å; K64-E66 WeakPolarHBondContact CD-OE2 3.47Å; K64-E66 HydrophobicContact CG-CB 4.37Å; K64-E66 WeakPolarHBondContact CG-OE2 3.26Å; K64-E66 PolarHBondContact O-N 3.31Å; K64-E66 VanDerWaalsContact O-N 3.14Å
67	N	85.4	Confident	79.5	Confident	11 Å²	11	45 Å²	45	6%	0.059	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-94.2	0.1	-177.3	-69.7	-5.7	0	0	0	112.9	D62 K64 P65 C79	D62-N67 PolarHBondContact O-ND2 3.3Å; D62-N67 PolarHBondContact OD2-ND2 3.41Å; K64-N67 WeakPolarHBondContact CE-ND2 3.24Å; K64-N67 HydrophobicContact CG-CB 4.1Å; K64-N67 PolarHBondContact O-N 3.45Å; P65-N67 VanDerWaalsContact C-N 3.27Å; P65-N67 PolarHBondContact O-N 3.29Å; N67-C79 PolarHBondContact O-N 3.48Å; N67-C79 PolarHBondContact O-SG 2.96Å; N67-C79 VanDerWaalsContact O-SG 3.33Å
68	I	84	Confident	80.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	105.6	178.1	-59.8	157.5	0	0	0	107.8	P22 C23 F42 V63 K64 P65 I76 L78 V127	P22-I68 CarbonylContact C-O 3.49Å; P22-I68 WeakPolarHBondContact CA-O 3.31Å; C23-I68 HydrophobicContact CB-CB 4.3Å; C23-I68 HydrophobicContact CB-CG2 4.16Å; C23-I68 WeakPolarHBondContact CB-O 3.32Å; C23-I68 PolarHBondContact N-O 3.21Å; F42-I68 HydrophobicContact CE2-CD1 3.63Å; F42-I68 HydrophobicContact CE2-CG1 4.2Å; F42-I68 HydrophobicContact CZ-CD1 3.42Å; F42-I68 VanDerWaalsContact CZ-CD1 3.42Å; F42-I68 HydrophobicContact CZ-CG1 3.69Å; V63-I68 HydrophobicContact CG1-CD1 4.49Å; K64-I68 WeakPolarHBondContact O-CD1 3.4Å; K64-I68 WeakPolarHBondContact O-CG1 3.44Å; K64-I68 PolarHBondContact O-N 3.41Å; P65-I68 PolarHBondContact O-N 3.28Å; I68-I76 HydrophobicContact CG2-CG2 3.75Å; I68-L78 HydrophobicContact CG1-CD1 4.02Å; I68-V127 HydrophobicContact CD1-CG1 3.75Å; I68-V127 HydrophobicContact CD1-CG2 4.14Å
69	L	80.5	Confident	80.7	Confident	38 Å²	38	41.2 Å²	41.2	20%	0.199	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	132.7	-177.1	-58.8	-176.8	0	0	0	110.9	F20 P22 I76 K77 C79	F20-L69 HydrophobicContact CB-CB 4Å; F20-L69 HydrophobicContact CB-CD1 4.11Å; F20-L69 HydrophobicContact CD1-CB 3.68Å; F20-L69 HydrophobicContact CG-CB 4.22Å; F20-L69 HydrophobicContact CG-CD1 4.45Å; P22-L69 HydrophobicContact CG-CD2 4.23Å; L69-I76 CarbonylContact O-C 3.53Å; L69-I76 WeakPolarHBondContact O-CA 3.35Å; L69-K77 PolarHBondContact N-O 3.48Å; L69-K77 PolarHBondContact O-N 3.46Å; L69-C79 HydrophobicContact CD1-CB 3.79Å; L69-C79 HydrophobicContact CG-CB 4.16Å
70	I	78.1	Confident	80.8	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.087	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.8	178.3	-53.6	179.6	0	0	0	109.4	I21 C23 V38 V75 I76	I21-I70 PolarHBondContact N-O 2.95Å; I21-I70 PolarHBondContact O-N 3.11Å; C23-I70 HydrophobicContact CB-CD1 3.36Å; C23-I70 HydrophobicContact CB-CG1 3.89Å; V38-I70 HydrophobicContact CG2-CD1 3.4Å; V38-I70 VanDerWaalsContact CG2-CD1 3.4Å; V38-I70 HydrophobicContact CG2-CG1 4.39Å; I70-V75 WeakPolarHBondContact CA-O 3.44Å; I70-I76 HydrophobicContact CD1-CD1 4.24Å; I70-I76 HydrophobicContact CG1-CD1 4.14Å; I70-I76 HydrophobicContact CG1-CG1 4.03Å; I70-I76 HydrophobicContact CG1-CG2 4.29Å; I70-I76 HydrophobicContact CG2-CG1 4.26Å
71	T	76.1	Confident	80.6	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.043	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	162.1	170.9	69.4	0	0	0	0	112	L15 S19 F20 H73 Q74 V75	L15-T71 HydrophobicContact CD1-CG2 4.12Å; S19-T71 WeakPolarHBondContact O-CA 3.34Å; S19-T71 WeakPolarHBondContact O-CB 3.49Å; S19-T71 WeakPolarHBondContact O-CG2 3.24Å; F20-T71 HydrophobicContact CD1-CG2 3.35Å; F20-T71 HydrophobicContact CD2-CG2 3.94Å; F20-T71 HydrophobicContact CE1-CG2 3.2Å; F20-T71 HydrophobicContact CE2-CG2 3.79Å; F20-T71 HydrophobicContact CG-CG2 3.73Å; F20-T71 HydrophobicContact CZ-CG2 3.41Å; F20-T71 VanDerWaalsContact CZ-CG2 3.41Å; T71-H73 PolarHBondContact O-N 3.3Å; T71-H73 PolarHBondContact OG1-N 2.96Å; T71-Q74 PolarHBondContact O-N 3.3Å; T71-V75 HydrophobicContact CG2-CB 4.19Å; T71-V75 PolarHBondContact N-O 3.37Å; T71-V75 WeakPolarHBondContact OG1-CB 3.2Å; T71-V75 PolarHBondContact OG1-N 3.35Å; T71-V75 VanDerWaalsContact OG1-N 3.12Å; T71-V75 PolarHBondContact OG1-O 3.37Å
72	K	72.8	Confident	80.4	Confident	178 Å²	178	50 Å²	50	77%	0.774	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-19.3	170.8	71.1	-176.8	-175.2	-178.4	0	114.4	Q74	K72-Q74 VanDerWaalsContact C-N 3.35Å
73	H	72.5	Confident	79.9	Confident	117 Å²	117	52.7 Å²	52.7	54%	0.542	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	18	177.9	-60.8	-64.2	0	0	0	112.6	T71 V75	T71-H73 PolarHBondContact O-N 3.3Å; T71-H73 PolarHBondContact OG1-N 2.96Å; H73-V75 PolarHBondContact O-N 3.02Å; H73-V75 VanDerWaalsContact O-N 3.1Å
74	Q	70.4	Confident	79.6	Confident	113 Å²	113	53.2 Å²	53.2	53%	0.528	27%	0.27	S	S	.	.			trans	58.9	20.2	-179.7	-56.5	-179	5.4	0	0	114.3	A37 T71 K72	A37-Q74 HydrophobicContact CB-CB 4.37Å; T71-Q74 PolarHBondContact O-N 3.3Å; K72-Q74 VanDerWaalsContact C-N 3.35Å
75	V	74.8	Confident	79.1	Confident	55 Å²	55	57.1 Å²	57.1	33%	0.333	28%	0.284	S	S	.	.			trans	-77.4	126.3	166.9	-179.6	0	0	0	0	108.1	L15 F20 I70 T71 H73	L15-V75 HydrophobicContact CD1-CB 3.99Å; L15-V75 HydrophobicContact CD1-CG1 4.26Å; L15-V75 HydrophobicContact CD1-CG2 3.76Å; F20-V75 HydrophobicContact CE1-CG1 4.35Å; F20-V75 HydrophobicContact CZ-CG1 4.39Å; I70-V75 WeakPolarHBondContact CA-O 3.44Å; T71-V75 HydrophobicContact CG2-CB 4.19Å; T71-V75 PolarHBondContact N-O 3.37Å; T71-V75 WeakPolarHBondContact OG1-CB 3.2Å; T71-V75 PolarHBondContact OG1-N 3.35Å; T71-V75 VanDerWaalsContact OG1-N 3.12Å; T71-V75 PolarHBondContact OG1-O 3.37Å; H73-V75 PolarHBondContact O-N 3.02Å; H73-V75 VanDerWaalsContact O-N 3.1Å
76	I	76.5	Confident	78.6	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.056	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.5	-179.5	-52.5	-170.6	0	0	0	109.4	A37 V38 F41 I68 L69 I70	A37-I76 HydrophobicContact CB-CD1 3.88Å; A37-I76 VanDerWaalsContact O-CD1 3.26Å; A37-I76 WeakPolarHBondContact O-CD1 3.46Å; V38-I76 HydrophobicContact CB-CD1 4.16Å; V38-I76 HydrophobicContact CG2-CD1 3.72Å; V38-I76 VanDerWaalsContact N-CD1 3.29Å; F41-I76 HydrophobicContact CB-CB 3.63Å; F41-I76 HydrophobicContact CB-CD1 3.84Å; F41-I76 HydrophobicContact CB-CG1 4.18Å; F41-I76 HydrophobicContact CB-CG2 3.73Å; F41-I76 HydrophobicContact CD1-CB 4.09Å; F41-I76 HydrophobicContact CD1-CG2 3.38Å; F41-I76 HydrophobicContact CD2-CB 3.55Å; F41-I76 HydrophobicContact CD2-CG2 3.76Å; F41-I76 VanDerWaalsContact CD2-O 3.31Å; F41-I76 WeakPolarHBondContact CD2-O 3.25Å; F41-I76 HydrophobicContact CE1-CG2 3.85Å; F41-I76 VanDerWaalsContact CE2-C 3.47Å; F41-I76 HydrophobicContact CE2-CB 4.2Å; F41-I76 HydrophobicContact CE2-CG2 4.2Å; F41-I76 WeakPolarHBondContact CE2-O 3.36Å; F41-I76 HydrophobicContact CG-CB 3.47Å; F41-I76 VanDerWaalsContact CG-CB 3.47Å; F41-I76 HydrophobicContact CG-CG2 3.31Å; F41-I76 HydrophobicContact CZ-CG2 4.23Å; I68-I76 HydrophobicContact CG2-CG2 3.75Å; L69-I76 CarbonylContact O-C 3.53Å; L69-I76 WeakPolarHBondContact O-CA 3.35Å; I70-I76 HydrophobicContact CD1-CD1 4.24Å; I70-I76 HydrophobicContact CG1-CD1 4.14Å; I70-I76 HydrophobicContact CG1-CG1 4.03Å; I70-I76 HydrophobicContact CG1-CG2 4.29Å; I70-I76 HydrophobicContact CG2-CG1 4.26Å
77	K	77.2	Confident	77.9	Confident	102 Å²	102	59.7 Å²	59.7	44%	0.443	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	143.2	177	-66.5	-173.8	-179.4	178.1	0	110.3	F20 L69	F20-K77 HydrophobicContact CE1-CB 4.19Å; F20-K77 HydrophobicContact CE1-CD 3.62Å; F20-K77 HydrophobicContact CE1-CG 3.77Å; F20-K77 HydrophobicContact CZ-CD 3.62Å; F20-K77 HydrophobicContact CZ-CG 4.23Å; L69-K77 PolarHBondContact N-O 3.48Å; L69-K77 PolarHBondContact O-N 3.46Å
78	L	81.9	Confident	76.7	Confident	19 Å²	19	65 Å²	65	10%	0.099	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	138.3	167	-166.5	65.3	0	0	0	108.5	F41 H60 V63 I68 F81	F41-L78 HydrophobicContact CE1-CB 4.42Å; F41-L78 HydrophobicContact CZ-CB 4.36Å; H60-L78 HydrophobicContact CB-CD2 4.29Å; H60-L78 WeakPolarHBondContact CD2-CD2 3.43Å; V63-L78 HydrophobicContact CG2-CD2 4.42Å; I68-L78 HydrophobicContact CG1-CD1 4.02Å; L78-F81 WeakPolarHBondContact O-CE2 3.47Å
79	C	82.6	Confident	75.4	Confident	36 Å²	36	67.9 Å²	67.9	24%	0.243	36%	0.362	C	S	.	.			trans	-127.6	177.6	174.7	70.2	0	0	0	0	111.1	H60 N67 L69	H60-C79 PolarHBondContact CE1-O 3.05Å; H60-C79 PolarHBondContact NE2-O 3.38Å; H60-C79 VanDerWaalsContact NE2-O 3.11Å; N67-C79 PolarHBondContact O-N 3.48Å; N67-C79 PolarHBondContact O-SG 2.96Å; N67-C79 VanDerWaalsContact O-SG 3.33Å; L69-C79 HydrophobicContact CD1-CB 3.79Å; L69-C79 HydrophobicContact CG-CB 4.16Å
80	D	82.4	Confident	73.9	Confident	75 Å²	75	72.4 Å²	72.4	40%	0.401	39%	0.393	S	S	.	.			trans	61.5	69.1	179.6	-162.9	2	0	0	0	114.8	H60 G82	H60-D80 PolarHBondContact CE1-O 2.81Å; H60-D80 PolarHBondContact NE2-O 2.98Å; D80-G82 PolarHBondContact O-N 2.97Å; D80-G82 PolarHBondContact OD1-N 2.78Å
81	F	80.6	Confident	72.5	Confident	103 Å²	103	76.2 Å²	76.2	45%	0.452	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-83.3	16	175.4	-66.4	-102.5	0	0	0	112.7	L52 H60 L78 F83 A84	L52-F81 HydrophobicContact CD1-CE1 3.87Å; H60-F81 AromaticContact CD2-CD1 3.78Å; H60-F81 AromaticContact CD2-CE1 3.83Å; L78-F81 WeakPolarHBondContact O-CE2 3.47Å; F81-F83 PolarHBondContact O-N 2.85Å; F81-F83 VanDerWaalsContact O-N 3.13Å; F81-A84 HydrophobicContact CB-CB 3.86Å; F81-A84 HydrophobicContact CD1-CB 3.89Å; F81-A84 HydrophobicContact CG-CB 4.37Å; F81-A84 VanDerWaalsContact O-CB 3.3Å; F81-A84 WeakPolarHBondContact O-CB 3.21Å; F81-A84 PolarHBondContact O-N 3.41Å
82	G	79.6	Confident	71.2	Confident	51 Å²	51	80.1 Å²	80.1	53%	0.526	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-58.1	-28.3	-179.9	0	0	0	0	0	112.8	D80	D80-G82 PolarHBondContact O-N 2.97Å; D80-G82 PolarHBondContact OD1-N 2.78Å
83	F	76.9	Confident	70	Confident	63 Å²	63	81.7 Å²	81.7	28%	0.276	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-98.4	-0.9	177.2	-53.6	-68.4	0	0	0	113.5	H60 R61 D62 F81 Y97	H60-F83 CarbonylContact O-C 3.54Å; H60-F83 VanDerWaalsContact O-C 3.31Å; R61-F83 HydrophobicContact CB-CB 4.49Å; R61-F83 PolarHBondContact NE-O 2.93Å; R61-F83 PolarHBondContact NH2-O 3.04Å; D62-F83 HydrophobicContact CB-CB 4.13Å; D62-F83 HydrophobicContact CB-CD2 3.71Å; D62-F83 HydrophobicContact CB-CG 4.23Å; F81-F83 PolarHBondContact O-N 2.85Å; F81-F83 VanDerWaalsContact O-N 3.13Å; F83-Y97 AromaticContact CD1-CD2 3.92Å; F83-Y97 HydrophobicContact CD1-CD2 3.92Å; F83-Y97 HydrophobicContact CD1-CE1 4.31Å; F83-Y97 AromaticContact CD1-CE2 3.3Å; F83-Y97 HydrophobicContact CD1-CE2 3.3Å; F83-Y97 AromaticContact CD1-CZ 3.5Å; F83-Y97 VanDerWaalsContact CD1-CZ 3.5Å; F83-Y97 HydrophobicContact CD2-CE2 4.13Å; F83-Y97 AromaticContact CD2-CZ 3.67Å; F83-Y97 WeakPolarHBondContact CD2-OH 3.27Å; F83-Y97 AromaticContact CE1-CD2 3.66Å; F83-Y97 HydrophobicContact CE1-CD2 3.66Å; F83-Y97 AromaticContact CE1-CE2 2.93Å; F83-Y97 HydrophobicContact CE1-CE2 2.93Å; F83-Y97 AromaticContact CE1-CZ 3.52Å; F83-Y97 AromaticContact CE2-CE2 3.81Å; F83-Y97 HydrophobicContact CE2-CE2 3.81Å; F83-Y97 AromaticContact CE2-CZ 3.65Å; F83-Y97 WeakPolarHBondContact CE2-OH 3.18Å; F83-Y97 HydrophobicContact CG-CE1 4.31Å; F83-Y97 AromaticContact CG-CE2 3.91Å; F83-Y97 HydrophobicContact CG-CE2 3.91Å; F83-Y97 AromaticContact CG-CZ 3.59Å; F83-Y97 WeakPolarHBondContact CG-OH 3.4Å; F83-Y97 HydrophobicContact CZ-CD2 4.3Å; F83-Y97 AromaticContact CZ-CE2 3.2Å; F83-Y97 HydrophobicContact CZ-CE2 3.2Å; F83-Y97 AromaticContact CZ-CZ 3.58Å; F83-Y97 VanDerWaalsContact CZ-OH 3.28Å; F83-Y97 WeakPolarHBondContact CZ-OH 3.35Å
84	A	80.7	Confident	69.1	Low	15 Å²	15	80.2 Å²	80.2	12%	0.124	43%	0.434	C	S	.	.			trans	-69.5	148.9	-177.8	0	0	0	0	0	111.9	I59 H60 F81	I59-A84 CarbonylContact O-C 3.48Å; I59-A84 WeakPolarHBondContact O-CA 3.49Å; I59-A84 WeakPolarHBondContact O-CB 3.4Å; H60-A84 PolarHBondContact O-N 2.87Å; F81-A84 HydrophobicContact CB-CB 3.86Å; F81-A84 HydrophobicContact CD1-CB 3.89Å; F81-A84 HydrophobicContact CG-CB 4.37Å; F81-A84 VanDerWaalsContact O-CB 3.3Å; F81-A84 WeakPolarHBondContact O-CB 3.21Å; F81-A84 PolarHBondContact O-N 3.41Å
85	R	75.8	Confident	68	Low	106 Å²	106	81 Å²	81	40%	0.4	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.8	179.9	-68.8	-66.3	-179.2	-96.3	5.4	111	C58 I59 R61	C58-R85 CarbonylContact C-O 3.47Å; C58-R85 WeakPolarHBondContact CA-O 3.39Å; I59-R85 PolarHBondContact N-O 2.81Å; I59-R85 PolarHBondContact O-N 3.39Å; R61-R85 VanDerWaalsContact NH2-CG 3.3Å
86	I	77.1	Confident	66.8	Low	96 Å²	96	84 Å²	84	49%	0.492	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124	166.2	-62.6	177	0	0	0	105.8	L56 C58 T88	L56-I86 VanDerWaalsContact O-CG2 3.28Å; L56-I86 WeakPolarHBondContact O-CG2 2.92Å; C58-I86 HydrophobicContact CB-CG1 4.4Å; I86-T88 HydrophobicContact CG2-CG2 3.73Å; I86-T88 PolarHBondContact O-N 3.27Å
87	L	69.8	Low	65.9	Low	41 Å²	41	86.4 Å²	86.4	22%	0.215	47%	0.469	C	S	.	.			trans	-70.6	93.7	177.7	-63.1	172	0	0	0	109.5	Q57 I59 P117	Q57-L87 HydrophobicContact CB-CB 3.87Å; Q57-L87 HydrophobicContact CB-CD1 4.23Å; Q57-L87 HydrophobicContact CB-CG 4.35Å; Q57-L87 WeakPolarHBondContact O-CG 2.86Å; Q57-L87 PolarHBondContact O-N 2.86Å; Q57-L87 PolarHBondContact OE1-O 3.31Å; I59-L87 HydrophobicContact CD1-CD1 3.8Å; I59-L87 HydrophobicContact CD1-CD2 3.59Å; I59-L87 HydrophobicContact CD1-CG 3.8Å; I59-L87 HydrophobicContact CG1-CD1 4.19Å; I59-L87 HydrophobicContact CG1-CD2 4.41Å; I59-L87 HydrophobicContact CG1-CG 4.15Å; L87-P117 HydrophobicContact CD1-CG 4.36Å
88	T	60.6	Low	64.8	Low	123 Å²	123	88.5 Å²	88.5	76%	0.755	49%	0.49	S	S	*	.			trans	-108.9	69.6	173.2	56	0	0	0	0	110	I86	I86-T88 HydrophobicContact CG2-CG2 3.73Å; I86-T88 PolarHBondContact O-N 3.27Å
89	G	57.5	Low	64.1	Low	59 Å²	59	88.7 Å²	88.7	61%	0.608	50%	0.495	S	S	*	.	S	Bend	trans	88.4	172.4	170.6	0	0	0	0	0	116.5	C91	G89-C91 PolarHBondContact O-N 3.12Å
90	P	47.7	Very low	63.9	Low	133 Å²	133	89.4 Å²	89.4	86%	0.864	50%	0.498	S	S	*	.	S	Bend	trans	-95.4	75.4	-165.9	36.2	-31.9	0	0	0	111.9
91	C	48.7	Very low	64.4	Low	97 Å²	97	88.9 Å²	88.9	66%	0.655	49%	0.491	S	S	*	.			trans	-176.7	93.7	161.3	-110.1	0	0	0	0	109.8	G89	G89-C91 PolarHBondContact O-N 3.12Å
92	D	49.1	Very low	65.1	Low	89 Å²	89	88 Å²	88	48%	0.476	48%	0.484	S	S	.	.			trans	-136.1	114.9	154.6	-85.6	-33.5	0	0	0	105.6	Y94	D92-Y94 HydrophobicContact CB-CD1 4.17Å; D92-Y94 HydrophobicContact CB-CE1 3.41Å; D92-Y94 VanDerWaalsContact CB-CE1 3.41Å; D92-Y94 HydrophobicContact CB-CE2 3.89Å; D92-Y94 WeakPolarHBondContact CB-OH 3.47Å; D92-Y94 WeakPolarHBondContact O-CD2 3.22Å; D92-Y94 WeakPolarHBondContact O-CE2 3.38Å; D92-Y94 PolarHBondContact O-N 2.87Å
93	Y	47.9	Very low	65.8	Low	211 Å²	211	86.2 Å²	86.2	83%	0.827	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-77.1	117.2	169.3	-78.7	-91.3	0	0	0	106.9
94	Y	53.6	Low	66.6	Low	87 Å²	87	84.5 Å²	84.5	34%	0.341	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-96.8	130.4	-173.8	-56.6	-75.2	0	0	0	110.6	R61 D92 Y115	R61-Y94 VanDerWaalsContact NH1-CE1 3.34Å; D92-Y94 HydrophobicContact CB-CD1 4.17Å; D92-Y94 HydrophobicContact CB-CE1 3.41Å; D92-Y94 VanDerWaalsContact CB-CE1 3.41Å; D92-Y94 HydrophobicContact CB-CE2 3.89Å; D92-Y94 WeakPolarHBondContact CB-OH 3.47Å; D92-Y94 WeakPolarHBondContact O-CD2 3.22Å; D92-Y94 WeakPolarHBondContact O-CE2 3.38Å; D92-Y94 PolarHBondContact O-N 2.87Å; Y94-Y115 AromaticContact CD2-CE1 3.62Å; Y94-Y115 HydrophobicContact CD2-CE1 3.62Å; Y94-Y115 AromaticContact CD2-CZ 3.77Å; Y94-Y115 WeakPolarHBondContact CD2-OH 3.17Å; Y94-Y115 VanDerWaalsContact CE1-OH 3.25Å; Y94-Y115 WeakPolarHBondContact CE1-OH 3.33Å; Y94-Y115 AromaticContact CE2-CE1 3.34Å; Y94-Y115 HydrophobicContact CE2-CE1 3.34Å; Y94-Y115 HydrophobicContact CE2-CE2 4.5Å; Y94-Y115 AromaticContact CE2-CZ 3.32Å; Y94-Y115 WeakPolarHBondContact CE2-OH 3.42Å; Y94-Y115 AromaticContact CZ-CZ 3.64Å; Y94-Y115 PolarHBondContact OH-OH 2.78Å
95	T	46.9	Very low	67.4	Low	129 Å²	129	83.8 Å²	83.8	79%	0.791	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-71.5	147.8	173.9	49.9	0	0	0	0	111.3	Y97	T95-Y97 PolarHBondContact O-N 2.9Å; T95-Y97 VanDerWaalsContact O-N 3.12Å
96	D	50.1	Low	68.3	Low	117 Å²	117	78.8 Å²	78.8	63%	0.626	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-49.1	117.4	172.2	-79.1	-32.6	0	0	0	111.4
97	Y	56.4	Low	69.2	Low	62 Å²	62	74.3 Å²	74.3	24%	0.243	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-89.3	125.8	-172.3	175	-139	0	0	0	110.3	D62 F83 T95 A99 R104	D62-Y97 PolarHBondContact OD1-OH 3.02Å; D62-Y97 PolarHBondContact OD2-OH 3.39Å; F83-Y97 AromaticContact CD1-CD2 3.92Å; F83-Y97 HydrophobicContact CD1-CD2 3.92Å; F83-Y97 HydrophobicContact CD1-CE1 4.31Å; F83-Y97 AromaticContact CD1-CE2 3.3Å; F83-Y97 HydrophobicContact CD1-CE2 3.3Å; F83-Y97 AromaticContact CD1-CZ 3.5Å; F83-Y97 VanDerWaalsContact CD1-CZ 3.5Å; F83-Y97 HydrophobicContact CD2-CE2 4.13Å; F83-Y97 AromaticContact CD2-CZ 3.67Å; F83-Y97 WeakPolarHBondContact CD2-OH 3.27Å; F83-Y97 AromaticContact CE1-CD2 3.66Å; F83-Y97 HydrophobicContact CE1-CD2 3.66Å; F83-Y97 AromaticContact CE1-CE2 2.93Å; F83-Y97 HydrophobicContact CE1-CE2 2.93Å; F83-Y97 AromaticContact CE1-CZ 3.52Å; F83-Y97 AromaticContact CE2-CE2 3.81Å; F83-Y97 HydrophobicContact CE2-CE2 3.81Å; F83-Y97 AromaticContact CE2-CZ 3.65Å; F83-Y97 WeakPolarHBondContact CE2-OH 3.18Å; F83-Y97 HydrophobicContact CG-CE1 4.31Å; F83-Y97 AromaticContact CG-CE2 3.91Å; F83-Y97 HydrophobicContact CG-CE2 3.91Å; F83-Y97 AromaticContact CG-CZ 3.59Å; F83-Y97 WeakPolarHBondContact CG-OH 3.4Å; F83-Y97 HydrophobicContact CZ-CD2 4.3Å; F83-Y97 AromaticContact CZ-CE2 3.2Å; F83-Y97 HydrophobicContact CZ-CE2 3.2Å; F83-Y97 AromaticContact CZ-CZ 3.58Å; F83-Y97 VanDerWaalsContact CZ-OH 3.28Å; F83-Y97 WeakPolarHBondContact CZ-OH 3.35Å; T95-Y97 PolarHBondContact O-N 2.9Å; T95-Y97 VanDerWaalsContact O-N 3.12Å; Y97-A99 HydrophobicContact CD1-CB 3.99Å; Y97-A99 HydrophobicContact CD2-CB 4.27Å; Y97-A99 HydrophobicContact CE1-CB 3.3Å; Y97-A99 HydrophobicContact CE2-CB 3.55Å; Y97-A99 HydrophobicContact CG-CB 4.42Å; Y97-A99 PolarHBondContact O-N 2.89Å; Y97-A99 WeakPolarHBondContact OH-CB 3.12Å; Y97-R104 PolarHBondContact O-NH2 2.99Å
98	V	55.1	Low	70.2	Confident	146 Å²	146	74.3 Å²	74.3	89%	0.885	41%	0.406	S	S	*	.			trans	-87.8	79.1	175.6	-172.5	0	0	0	0	109.6
99	A	66.2	Low	71.8	Confident	24 Å²	24	68.6 Å²	68.6	20%	0.198	37%	0.371	C	S	.	.	S	Bend	trans	-151.1	176.6	168.5	0	0	0	0	0	112.3	Y97 R101	Y97-A99 HydrophobicContact CD1-CB 3.99Å; Y97-A99 HydrophobicContact CD2-CB 4.27Å; Y97-A99 HydrophobicContact CE1-CB 3.3Å; Y97-A99 HydrophobicContact CE2-CB 3.55Å; Y97-A99 HydrophobicContact CG-CB 4.42Å; Y97-A99 PolarHBondContact O-N 2.89Å; Y97-A99 WeakPolarHBondContact OH-CB 3.12Å; A99-R101 PolarHBondContact O-N 3.02Å
100	T	79.9	Confident	73.4	Confident	50 Å²	50	65.8 Å²	65.8	31%	0.307	34%	0.342	S	S	.	.			trans	-59	105.9	-179.5	-48.2	0	0	0	0	111.2	W102 Y103	T100-W102 HydrophobicContact CG2-CB 4.07Å; T100-W102 HydrophobicContact CG2-CD2 3.55Å; T100-W102 HydrophobicContact CG2-CE3 3.71Å; T100-W102 HydrophobicContact CG2-CG 3.71Å; T100-W102 HydrophobicContact CG2-CZ3 4.4Å; T100-W102 PolarHBondContact O-N 2.74Å; T100-Y103 HydrophobicContact CG2-CD2 4.32Å; T100-Y103 HydrophobicContact CG2-CE2 3.93Å
101	R	91.5	Very high	75.4	Confident	65 Å²	65	61.2 Å²	61.2	25%	0.245	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-72.4	-10.5	-177.3	67.3	-177.4	60.3	73.7	4.3	115	A99 Y103 R104 K141 S142 D143 Q146	A99-R101 PolarHBondContact O-N 3.02Å; R101-Y103 PolarHBondContact O-N 3.23Å; R101-Y103 VanDerWaalsContact O-N 3.07Å; R101-R104 WeakPolarHBondContact O-CB 3.28Å; R101-R104 PolarHBondContact O-N 3.3Å; R101-K141 PolarHBondContact NH1-O 2.98Å; R101-S142 VanDerWaalsContact CD-C 3.44Å; R101-S142 WeakPolarHBondContact CD-O 3.46Å; R101-D143 WeakPolarHBondContact CD-OD1 3.45Å; R101-D143 IonicContact CZ-OD1 2.77Å; R101-D143 IonicContact NE-OD1 3.59Å; R101-D143 PolarHBondContact NE-OD1 3.11Å; R101-Q146 HydrophobicContact CG-CB 4.46Å; R101-Q146 HydrophobicContact CG-CG 4.46Å
102	W	95.3	Very high	77.3	Confident	84 Å²	84	57 Å²	57	32%	0.318	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-60.2	-24.6	-170.1	-55.4	-16.8	0	0	0	114.2	T100 P136 P139 G140 Q146	T100-W102 HydrophobicContact CG2-CB 4.07Å; T100-W102 HydrophobicContact CG2-CD2 3.55Å; T100-W102 HydrophobicContact CG2-CE3 3.71Å; T100-W102 HydrophobicContact CG2-CG 3.71Å; T100-W102 HydrophobicContact CG2-CZ3 4.4Å; T100-W102 PolarHBondContact O-N 2.74Å; W102-P136 HydrophobicContact CD2-CB 4.3Å; W102-P136 HydrophobicContact CD2-CG 4.48Å; W102-P136 HydrophobicContact CE3-CB 3.67Å; W102-P136 HydrophobicContact CE3-CG 3.51Å; W102-P136 HydrophobicContact CH2-CG 4.32Å; W102-P136 HydrophobicContact CZ3-CB 4.11Å; W102-P136 HydrophobicContact CZ3-CG 3.42Å; W102-P136 VanDerWaalsContact CZ3-CG 3.42Å; W102-P139 HydrophobicContact CD2-CB 4.26Å; W102-P139 HydrophobicContact CZ2-CB 4.07Å; W102-G140 PolarHBondContact NE1-O 3.36Å; W102-Q146 PolarHBondContact O-NE2 3.03Å
103	Y	95	Very high	79	Confident	13 Å²	13	56.8 Å²	56.8	5%	0.051	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-105.9	2.5	-178.6	-45.6	-83.9	0	0	0	113.2	V63 K64 P65 T100 R101 A123 C126 V127 E130	V63-Y103 WeakPolarHBondContact O-CB 3.3Å; K64-Y103 HydrophobicContact CB-CD2 3.52Å; K64-Y103 HydrophobicContact CB-CE2 3.51Å; K64-Y103 HydrophobicContact CB-CG 4.09Å; P65-Y103 WeakPolarHBondContact CD-OH 3.46Å; P65-Y103 HydrophobicContact CG-CE1 4.16Å; P65-Y103 WeakPolarHBondContact CG-OH 3.33Å; T100-Y103 HydrophobicContact CG2-CD2 4.32Å; T100-Y103 HydrophobicContact CG2-CE2 3.93Å; R101-Y103 PolarHBondContact O-N 3.23Å; R101-Y103 VanDerWaalsContact O-N 3.07Å; Y103-A123 WeakPolarHBondContact O-CB 3.39Å; Y103-C126 HydrophobicContact CD1-CB 3.69Å; Y103-C126 HydrophobicContact CE1-CB 4.46Å; Y103-V127 HydrophobicContact CD1-CG2 3.97Å; Y103-V127 HydrophobicContact CE1-CG2 4.05Å; Y103-E130 WeakPolarHBondContact CE1-OE2 3.23Å; Y103-E130 PolarHBondContact OH-OE2 2.91Å
104	R	94.7	Very high	80.8	Confident	28 Å²	28	53.1 Å²	53.1	11%	0.106	28%	0.282	C	S	.	.			trans	-73.5	136.8	179.9	-69.2	-177	-173.7	172.1	5.3	110.6	Y97 R101 L108 L109 W122	Y97-R104 PolarHBondContact O-NH2 2.99Å; R101-R104 WeakPolarHBondContact O-CB 3.28Å; R101-R104 PolarHBondContact O-N 3.3Å; R104-L108 HydrophobicContact CB-CB 4.48Å; R104-L109 HydrophobicContact CB-CD2 3.93Å; R104-L109 HydrophobicContact CB-CG 3.97Å; R104-W122 PolarHBondContact O-NE1 2.82Å
105	A	95.6	Very high	82.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.			trans	-70.9	154.5	174.5	0	0	0	0	0	111.8	E107 L108 L109 V119 W122	A105-E107 VanDerWaalsContact C-N 3.26Å; A105-E107 VanDerWaalsContact CB-CD 3.4Å; A105-E107 HydrophobicContact CB-CG 4.26Å; A105-E107 WeakPolarHBondContact CB-OE1 3.4Å; A105-E107 VanDerWaalsContact CB-OE2 3.25Å; A105-E107 WeakPolarHBondContact CB-OE2 3.5Å; A105-E107 PolarHBondContact O-N 3.23Å; A105-L108 WeakPolarHBondContact O-CB 3.36Å; A105-L108 PolarHBondContact O-N 3.39Å; A105-L109 PolarHBondContact O-N 3.01Å; A105-V119 HydrophobicContact CB-CB 4.18Å; A105-V119 HydrophobicContact CB-CG1 4.22Å; A105-W122 VanDerWaalsContact CA-CD1 3.43Å; A105-W122 HydrophobicContact CB-CB 3.79Å; A105-W122 HydrophobicContact CB-CD2 4.2Å; A105-W122 HydrophobicContact CB-CG 3.67Å
106	P	96.6	Very high	84.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-54.2	-40.2	-178.5	-26	34.5	0	0	0	113.4	L108 L109 V110 W122 I150 L157 M206	P106-L108 VanDerWaalsContact C-N 3.28Å; P106-L108 PolarHBondContact O-N 2.81Å; P106-L109 PolarHBondContact O-N 3.39Å; P106-L109 VanDerWaalsContact O-N 3.13Å; P106-V110 WeakPolarHBondContact O-CG2 3.46Å; P106-V110 PolarHBondContact O-N 3.21Å; P106-W122 HydrophobicContact CG-CE3 4.37Å; P106-W122 HydrophobicContact CG-CH2 3.51Å; P106-W122 HydrophobicContact CG-CZ2 3.86Å; P106-W122 HydrophobicContact CG-CZ3 3.81Å; P106-I150 HydrophobicContact CG-CG2 4.37Å; P106-L157 HydrophobicContact CB-CD2 4.25Å; P106-M206 HydrophobicContact CB-SD 4.04Å; P106-M206 HydrophobicContact CG-SD 3.7Å
107	E	94.8	Very high	85.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-34.7	177.8	60.4	-88.8	-148.4	0	0	112.8	A105 V110 G111 D112 V119 P208 R211	A105-E107 VanDerWaalsContact C-N 3.26Å; A105-E107 VanDerWaalsContact CB-CD 3.4Å; A105-E107 HydrophobicContact CB-CG 4.26Å; A105-E107 WeakPolarHBondContact CB-OE1 3.4Å; A105-E107 VanDerWaalsContact CB-OE2 3.25Å; A105-E107 WeakPolarHBondContact CB-OE2 3.5Å; A105-E107 PolarHBondContact O-N 3.23Å; E107-V110 WeakPolarHBondContact O-CG2 3.04Å; E107-G111 PolarHBondContact O-N 3.3Å; E107-D112 HydrophobicContact CB-CB 4.18Å; E107-D112 VanDerWaalsContact O-CB 3.31Å; E107-D112 WeakPolarHBondContact O-CB 3.45Å; E107-D112 PolarHBondContact O-N 2.71Å; E107-V119 HydrophobicContact CG-CG1 3.89Å; E107-V119 WeakPolarHBondContact OE1-CG1 3.1Å; E107-P208 HydrophobicContact CB-CG 4.45Å; E107-P208 HydrophobicContact CG-CG 4.25Å; E107-P208 WeakPolarHBondContact OE1-CG 3.25Å; E107-R211 IonicContact OE1-CZ 2.76Å; E107-R211 IonicContact OE1-NH1 3.17Å; E107-R211 PolarHBondContact OE1-NH1 3.11Å; E107-R211 IonicContact OE1-NH2 2.79Å; E107-R211 PolarHBondContact OE1-NH2 3.13Å; E107-R211 IonicContact OE2-CZ 3.97Å; E107-R211 IonicContact OE2-NH1 3.93Å; E107-R211 IonicContact OE2-NH2 2.9Å; E107-R211 PolarHBondContact OE2-NH2 3.16Å
108	L	92	Very high	87.4	Confident	41 Å²	41	39.6 Å²	39.6	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-75	-36.5	175.8	-64.2	177.6	0	0	0	111.3	R104 A105 P106 G111 Y115 V119	R104-L108 HydrophobicContact CB-CB 4.48Å; A105-L108 WeakPolarHBondContact O-CB 3.36Å; A105-L108 PolarHBondContact O-N 3.39Å; P106-L108 VanDerWaalsContact C-N 3.28Å; P106-L108 PolarHBondContact O-N 2.81Å; L108-G111 PolarHBondContact O-N 3.47Å; L108-Y115 HydrophobicContact CD2-CD1 3.72Å; L108-Y115 HydrophobicContact CD2-CD2 3.93Å; L108-Y115 HydrophobicContact CD2-CE1 3.87Å; L108-Y115 HydrophobicContact CD2-CE2 4.09Å; L108-Y115 HydrophobicContact CD2-CG 3.71Å; L108-V119 HydrophobicContact CD1-CB 4Å; L108-V119 HydrophobicContact CD1-CG1 4.03Å; L108-V119 HydrophobicContact CD1-CG2 4.44Å; L108-V119 HydrophobicContact CD2-CG1 4.23Å; L108-V119 HydrophobicContact CG-CB 4.46Å; L108-V119 HydrophobicContact CG-CG1 3.94Å
109	L	93	Very high	89.2	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-71.5	-34.6	-178.3	-68.4	168	0	0	0	112.8	R104 A105 P106 G111 D143 Q146 L147 I150	R104-L109 HydrophobicContact CB-CD2 3.93Å; R104-L109 HydrophobicContact CB-CG 3.97Å; A105-L109 PolarHBondContact O-N 3.01Å; P106-L109 PolarHBondContact O-N 3.39Å; P106-L109 VanDerWaalsContact O-N 3.13Å; L109-G111 VanDerWaalsContact C-N 3.27Å; L109-D143 HydrophobicContact CD2-CB 4.26Å; L109-Q146 HydrophobicContact CD1-CB 4.19Å; L109-Q146 HydrophobicContact CD1-CG 3.52Å; L109-Q146 HydrophobicContact CD2-CB 4.25Å; L109-Q146 HydrophobicContact CD2-CG 3.99Å; L109-Q146 HydrophobicContact CG-CG 4.43Å; L109-L147 HydrophobicContact CB-CD1 4.28Å; L109-L147 HydrophobicContact CB-CD2 3.72Å; L109-L147 HydrophobicContact CB-CG 3.91Å; L109-L147 HydrophobicContact CD1-CD2 4.05Å; L109-L147 HydrophobicContact CD1-CG 4.29Å; L109-I150 HydrophobicContact CD1-CD1 3.55Å
110	V	92.3	Very high	90.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-12.6	175.2	-58.8	0	0	0	0	113	P106 E107 D112 L147 L157 H161 V164 F165 N168	P106-V110 WeakPolarHBondContact O-CG2 3.46Å; P106-V110 PolarHBondContact O-N 3.21Å; E107-V110 WeakPolarHBondContact O-CG2 3.04Å; V110-D112 HydrophobicContact CG2-CB 4.26Å; V110-L147 HydrophobicContact CG1-CD1 4.19Å; V110-L147 HydrophobicContact CG1-CD2 4.02Å; V110-L157 HydrophobicContact CG1-CD1 3.81Å; V110-H161 HydrophobicContact CG1-CB 4.27Å; V110-H161 HydrophobicContact CG2-CB 4.23Å; V110-V164 HydrophobicContact CB-CG1 4.36Å; V110-V164 HydrophobicContact CG2-CB 4.24Å; V110-V164 HydrophobicContact CG2-CG1 3.9Å; V110-F165 HydrophobicContact CB-CB 4.02Å; V110-F165 HydrophobicContact CB-CD2 4.38Å; V110-F165 HydrophobicContact CG1-CB 3.96Å; V110-F165 HydrophobicContact CG1-CD2 4.07Å; V110-F165 HydrophobicContact CG1-CG 4.44Å; V110-N168 PolarHBondContact O-ND2 3.33Å
111	G	88.8	Confident	90.7	Very high	37 Å²	37	29.6 Å²	29.6	38%	0.381	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	31.2	-177.3	0	0	0	0	0	113.8	E107 L108 L109	E107-G111 PolarHBondContact O-N 3.3Å; L108-G111 PolarHBondContact O-N 3.47Å; L109-G111 VanDerWaalsContact C-N 3.27Å
112	D	89.6	Confident	90.9	Very high	9 Å²	9	26.5 Å²	26.5	5%	0.048	15%	0.146	C	C	.	.			trans	-65.6	136.9	171.9	-159.9	-20.1	0	0	0	109.1	E107 V110 Q114 Y115 R160 V164	E107-D112 HydrophobicContact CB-CB 4.18Å; E107-D112 VanDerWaalsContact O-CB 3.31Å; E107-D112 WeakPolarHBondContact O-CB 3.45Å; E107-D112 PolarHBondContact O-N 2.71Å; V110-D112 HydrophobicContact CG2-CB 4.26Å; D112-Q114 PolarHBondContact OD1-N 3.09Å; D112-Y115 VanDerWaalsContact O-CD1 3.25Å; D112-Y115 WeakPolarHBondContact O-CD1 2.91Å; D112-R160 VanDerWaalsContact CG-NH2 3.34Å; D112-R160 IonicContact OD1-CZ 3.29Å; D112-R160 IonicContact OD1-NH2 2.96Å; D112-R160 PolarHBondContact OD1-NH2 2.98Å; D112-R160 IonicContact OD2-CZ 2.89Å; D112-R160 VanDerWaalsContact OD2-CZ 3.29Å; D112-R160 IonicContact OD2-NE 3.32Å; D112-R160 PolarHBondContact OD2-NE 3.01Å; D112-R160 IonicContact OD2-NH2 3.42Å; D112-R160 PolarHBondContact OD2-NH2 3.23Å; D112-V164 HydrophobicContact CB-CG1 4.08Å; D112-V164 HydrophobicContact CB-CG2 4.4Å
113	T	84.5	Confident	90.8	Very high	84 Å²	84	22.7 Å²	22.7	52%	0.515	13%	0.132	S	C	.	.	S	Bend	trans	-91.2	-16.1	176.8	52.4	0	0	0	0	111.7	Y115	T113-Y115 PolarHBondContact O-N 3.15Å
114	Q	84.4	Confident	90.6	Very high	134 Å²	134	22.4 Å²	22.4	63%	0.626	13%	0.132	S	C	*	.			trans	-96.8	81.4	175.8	-55.6	176.8	15.9	0	0	109.1	D112	D112-Q114 PolarHBondContact OD1-N 3.09Å
115	Y	86	Confident	90.5	Very high	25 Å²	25	21 Å²	21	10%	0.098	13%	0.126	C	C	.	.			trans	-124	161.8	171.7	60.3	-96.7	0	0	0	110.7	I59 R61 Y94 L108 D112 T113 V119	I59-Y115 HydrophobicContact CD1-CD2 4.05Å; I59-Y115 HydrophobicContact CD1-CE2 4.28Å; R61-Y115 PolarHBondContact NH1-OH 3.43Å; Y94-Y115 AromaticContact CD2-CE1 3.62Å; Y94-Y115 HydrophobicContact CD2-CE1 3.62Å; Y94-Y115 AromaticContact CD2-CZ 3.77Å; Y94-Y115 WeakPolarHBondContact CD2-OH 3.17Å; Y94-Y115 VanDerWaalsContact CE1-OH 3.25Å; Y94-Y115 WeakPolarHBondContact CE1-OH 3.33Å; Y94-Y115 AromaticContact CE2-CE1 3.34Å; Y94-Y115 HydrophobicContact CE2-CE1 3.34Å; Y94-Y115 HydrophobicContact CE2-CE2 4.5Å; Y94-Y115 AromaticContact CE2-CZ 3.32Å; Y94-Y115 WeakPolarHBondContact CE2-OH 3.42Å; Y94-Y115 AromaticContact CZ-CZ 3.64Å; Y94-Y115 PolarHBondContact OH-OH 2.78Å; L108-Y115 HydrophobicContact CD2-CD1 3.72Å; L108-Y115 HydrophobicContact CD2-CD2 3.93Å; L108-Y115 HydrophobicContact CD2-CE1 3.87Å; L108-Y115 HydrophobicContact CD2-CE2 4.09Å; L108-Y115 HydrophobicContact CD2-CG 3.71Å; D112-Y115 VanDerWaalsContact O-CD1 3.25Å; D112-Y115 WeakPolarHBondContact O-CD1 2.91Å; T113-Y115 PolarHBondContact O-N 3.15Å; Y115-V119 HydrophobicContact CD2-CG1 4.37Å; Y115-V119 HydrophobicContact CG-CG1 4.48Å
116	G	85.9	Confident	90.4	Very high	16 Å²	16	21.1 Å²	21.1	17%	0.165	13%	0.127	C	C	.	.			trans	-145.8	-167.6	-171.6	0	0	0	0	0	112.1	P118 V119	G116-P118 WeakPolarHBondContact O-CD 2.82Å; G116-P118 VanDerWaalsContact O-N 3.08Å; G116-V119 WeakPolarHBondContact O-CG2 3.25Å; G116-V119 PolarHBondContact O-N 3.1Å; G116-V119 VanDerWaalsContact O-N 3.15Å
117	P	85.1	Confident	90.1	Very high	32 Å²	32	21.1 Å²	21.1	21%	0.208	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-27	179.3	-17.9	30.1	0	0	0	115.6	F53 I59 L87 V119 D120	F53-P117 HydrophobicContact CD1-CB 3.32Å; F53-P117 HydrophobicContact CD1-CG 4.43Å; F53-P117 HydrophobicContact CE1-CB 3.4Å; F53-P117 VanDerWaalsContact CE1-CB 3.4Å; F53-P117 WeakPolarHBondContact CE1-O 3.11Å; I59-P117 HydrophobicContact CG1-CG 4.48Å; L87-P117 HydrophobicContact CD1-CG 4.36Å; P117-V119 PolarHBondContact O-N 3.43Å; P117-D120 PolarHBondContact O-N 3.01Å; P117-D120 VanDerWaalsContact O-N 3.1Å
118	P	90.1	Very high	89.8	Confident	38 Å²	38	21.2 Å²	21.2	25%	0.247	13%	0.127	C	C	.	.	H	α-helix	trans	-55.8	-17.4	174	-30.1	37.2	0	0	0	116.6	G116 D120 V121 W122 P208 R211	G116-P118 WeakPolarHBondContact O-CD 2.82Å; G116-P118 VanDerWaalsContact O-N 3.08Å; P118-D120 VanDerWaalsContact C-N 3.27Å; P118-D120 PolarHBondContact O-N 3.14Å; P118-V121 PolarHBondContact O-N 3.28Å; P118-W122 PolarHBondContact O-N 2.85Å; P118-W122 VanDerWaalsContact O-N 3.14Å; P118-P208 HydrophobicContact CB-CB 3.98Å; P118-P208 WeakPolarHBondContact CB-O 3.37Å; P118-P208 HydrophobicContact CG-CB 4.47Å; P118-R211 PolarHBondContact O-NH1 3.44Å
119	V	91.3	Very high	89.8	Confident	3 Å²	3	19.2 Å²	19.2	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-34.8	175.1	-58.1	0	0	0	0	112	I59 A105 E107 L108 Y115 G116 P117 W122 A123	I59-V119 HydrophobicContact CG2-CG2 3.27Å; A105-V119 HydrophobicContact CB-CB 4.18Å; A105-V119 HydrophobicContact CB-CG1 4.22Å; E107-V119 HydrophobicContact CG-CG1 3.89Å; E107-V119 WeakPolarHBondContact OE1-CG1 3.1Å; L108-V119 HydrophobicContact CD1-CB 4Å; L108-V119 HydrophobicContact CD1-CG1 4.03Å; L108-V119 HydrophobicContact CD1-CG2 4.44Å; L108-V119 HydrophobicContact CD2-CG1 4.23Å; L108-V119 HydrophobicContact CG-CB 4.46Å; L108-V119 HydrophobicContact CG-CG1 3.94Å; Y115-V119 HydrophobicContact CD2-CG1 4.37Å; Y115-V119 HydrophobicContact CG-CG1 4.48Å; G116-V119 WeakPolarHBondContact O-CG2 3.25Å; G116-V119 PolarHBondContact O-N 3.1Å; G116-V119 VanDerWaalsContact O-N 3.15Å; P117-V119 PolarHBondContact O-N 3.43Å; V119-W122 WeakPolarHBondContact O-CB 3.05Å; V119-W122 PolarHBondContact O-N 2.85Å; V119-A123 PolarHBondContact O-N 2.93Å
120	D	88.4	Confident	89.7	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.011	12%	0.119	C	C	.	.	H	α-helix	trans	-76.1	-31.1	178.2	-70.1	-24.5	0	0	0	110.9	F53 I59 H60 R61 V63 P117 P118 W122 A123 I124	F53-D120 HydrophobicContact CE1-CB 4.08Å; F53-D120 HydrophobicContact CZ-CB 3.56Å; F53-D120 WeakPolarHBondContact CZ-OD2 3.35Å; I59-D120 WeakPolarHBondContact CA-OD2 3.33Å; I59-D120 WeakPolarHBondContact CG2-OD2 3.47Å; H60-D120 PolarHBondContact N-OD2 3.14Å; R61-D120 PolarHBondContact N-OD1 2.97Å; V63-D120 HydrophobicContact CG2-CB 4.24Å; P117-D120 PolarHBondContact O-N 3.01Å; P117-D120 VanDerWaalsContact O-N 3.1Å; P118-D120 VanDerWaalsContact C-N 3.27Å; P118-D120 PolarHBondContact O-N 3.14Å; D120-W122 VanDerWaalsContact C-N 3.31Å; D120-W122 PolarHBondContact O-N 3.46Å; D120-A123 PolarHBondContact O-N 3.28Å; D120-I124 WeakPolarHBondContact O-CD1 3.46Å; D120-I124 WeakPolarHBondContact O-CG1 3.49Å; D120-I124 PolarHBondContact O-N 3.2Å
121	V	90.9	Very high	89.2	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.03	13%	0.126	C	C	.	.	H	α-helix	trans	-62	-41.9	172.7	176	0	0	0	0	110.7	P118 I124 G125 C203 R211 L217	P118-V121 PolarHBondContact O-N 3.28Å; V121-I124 PolarHBondContact O-N 2.97Å; V121-G125 PolarHBondContact O-N 3.17Å; V121-C203 HydrophobicContact CG1-CB 4.15Å; V121-R211 HydrophobicContact CG1-CB 4.16Å; V121-L217 HydrophobicContact CG1-CD1 3.86Å
122	W	95.3	Very high	89	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-49.9	173.2	174.6	-82.4	0	0	0	111.6	R104 A105 P106 P118 V119 D120 I124 G125 C126 W138 I150 L154 L204 R205	R104-W122 PolarHBondContact O-NE1 2.82Å; A105-W122 VanDerWaalsContact CA-CD1 3.43Å; A105-W122 HydrophobicContact CB-CB 3.79Å; A105-W122 HydrophobicContact CB-CD2 4.2Å; A105-W122 HydrophobicContact CB-CG 3.67Å; P106-W122 HydrophobicContact CG-CE3 4.37Å; P106-W122 HydrophobicContact CG-CH2 3.51Å; P106-W122 HydrophobicContact CG-CZ2 3.86Å; P106-W122 HydrophobicContact CG-CZ3 3.81Å; P118-W122 PolarHBondContact O-N 2.85Å; P118-W122 VanDerWaalsContact O-N 3.14Å; V119-W122 WeakPolarHBondContact O-CB 3.05Å; V119-W122 PolarHBondContact O-N 2.85Å; D120-W122 VanDerWaalsContact C-N 3.31Å; D120-W122 PolarHBondContact O-N 3.46Å; W122-I124 VanDerWaalsContact C-N 3.29Å; W122-I124 PolarHBondContact O-N 3.06Å; W122-G125 WeakPolarHBondContact O-CA 3.49Å; W122-G125 PolarHBondContact O-N 2.99Å; W122-C126 PolarHBondContact NE1-SG 2.9Å; W122-C126 PolarHBondContact O-N 2.95Å; W122-W138 AromaticContact CE2-CZ3 3.85Å; W122-W138 AromaticContact CH2-CH2 3.87Å; W122-W138 HydrophobicContact CH2-CH2 3.87Å; W122-W138 AromaticContact CH2-CZ3 3.89Å; W122-W138 HydrophobicContact CH2-CZ3 3.89Å; W122-W138 HydrophobicContact CZ2-CE3 4.09Å; W122-W138 AromaticContact CZ2-CH2 3.73Å; W122-W138 HydrophobicContact CZ2-CH2 3.73Å; W122-W138 AromaticContact CZ2-CZ3 3.24Å; W122-W138 HydrophobicContact CZ2-CZ3 3.24Å; W122-I150 HydrophobicContact CH2-CG2 3.93Å; W122-I150 HydrophobicContact CZ2-CD1 3.81Å; W122-I150 HydrophobicContact CZ2-CG1 4.05Å; W122-I150 HydrophobicContact CZ2-CG2 4.26Å; W122-L154 HydrophobicContact CH2-CD1 3.56Å; W122-L154 HydrophobicContact CZ3-CD1 3.88Å; W122-L204 HydrophobicContact CD2-CD2 3.96Å; W122-L204 HydrophobicContact CE3-CD2 4.09Å; W122-L204 HydrophobicContact CG-CD2 4.42Å; W122-L204 HydrophobicContact CZ3-CB 4.42Å; W122-L204 HydrophobicContact CZ3-CD2 4.43Å; W122-R205 WeakPolarHBondContact CZ3-O 3.29Å
123	A	92.7	Very high	88.8	Confident	4 Å²	4	23.5 Å²	23.5	3%	0.033	13%	0.134	C	C	.	.	H	α-helix	trans	-59.6	-39.3	179.9	0	0	0	0	0	112.2	V63 Y103 V119 D120 G125 C126 V127	V63-A123 HydrophobicContact CB-CB 3.75Å; V63-A123 HydrophobicContact CG1-CB 4.3Å; Y103-A123 WeakPolarHBondContact O-CB 3.39Å; V119-A123 PolarHBondContact O-N 2.93Å; D120-A123 PolarHBondContact O-N 3.28Å; A123-G125 VanDerWaalsContact C-N 3.32Å; A123-G125 PolarHBondContact O-N 3.25Å; A123-C126 WeakPolarHBondContact O-CB 3.42Å; A123-C126 PolarHBondContact O-N 3.48Å; A123-V127 WeakPolarHBondContact O-CG2 3.46Å; A123-V127 PolarHBondContact O-N 3.49Å
124	I	89.7	Confident	88.9	Confident	7 Å²	7	21.4 Å²	21.4	4%	0.036	13%	0.13	C	C	.	.	H	α-helix	trans	-60.7	-40.7	172	-68	162.7	0	0	0	111.1	F42 F43 V63 D120 V121 W122 C126 V127 F128	F42-I124 HydrophobicContact CB-CD1 4.26Å; F42-I124 HydrophobicContact CB-CG2 4.18Å; F42-I124 HydrophobicContact CD1-CD1 3.48Å; F42-I124 VanDerWaalsContact CD1-CD1 3.48Å; F42-I124 HydrophobicContact CD1-CG1 3.61Å; F42-I124 HydrophobicContact CD2-CG1 4.44Å; F42-I124 HydrophobicContact CD2-CG2 4.21Å; F42-I124 HydrophobicContact CE1-CD1 3.99Å; F42-I124 HydrophobicContact CE1-CG1 3.74Å; F42-I124 HydrophobicContact CG-CD1 4.01Å; F42-I124 HydrophobicContact CG-CG1 3.98Å; F42-I124 HydrophobicContact CG-CG2 4.07Å; F42-I124 HydrophobicContact CZ-CG1 4.2Å; F43-I124 HydrophobicContact CE1-CG2 4.12Å; F43-I124 HydrophobicContact CE2-CG2 4.16Å; F43-I124 HydrophobicContact CZ-CG2 3.5Å; V63-I124 HydrophobicContact CG1-CG1 4.19Å; D120-I124 WeakPolarHBondContact O-CD1 3.46Å; D120-I124 WeakPolarHBondContact O-CG1 3.49Å; D120-I124 PolarHBondContact O-N 3.2Å; V121-I124 PolarHBondContact O-N 2.97Å; W122-I124 VanDerWaalsContact C-N 3.29Å; W122-I124 PolarHBondContact O-N 3.06Å; I124-C126 VanDerWaalsContact C-N 3.35Å; I124-C126 PolarHBondContact O-N 2.78Å; I124-V127 PolarHBondContact O-N 3.41Å; I124-F128 VanDerWaalsContact O-CB 3.31Å; I124-F128 WeakPolarHBondContact O-CB 3.43Å; I124-F128 PolarHBondContact O-N 2.91Å
125	G	93	Very high	89.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.8	-42.4	173.9	0	0	0	0	0	112.9	V121 W122 A123 F128 A129	V121-G125 PolarHBondContact O-N 3.17Å; W122-G125 WeakPolarHBondContact O-CA 3.49Å; W122-G125 PolarHBondContact O-N 2.99Å; A123-G125 VanDerWaalsContact C-N 3.32Å; A123-G125 PolarHBondContact O-N 3.25Å; G125-F128 PolarHBondContact O-N 2.88Å; G125-A129 PolarHBondContact O-N 2.63Å
126	C	95.1	Very high	89.4	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-46.9	175	-65.3	0	0	0	0	111.9	Y103 W122 A123 I124 F128 A129 E130	Y103-C126 HydrophobicContact CD1-CB 3.69Å; Y103-C126 HydrophobicContact CE1-CB 4.46Å; W122-C126 PolarHBondContact NE1-SG 2.9Å; W122-C126 PolarHBondContact O-N 2.95Å; A123-C126 WeakPolarHBondContact O-CB 3.42Å; A123-C126 PolarHBondContact O-N 3.48Å; I124-C126 VanDerWaalsContact C-N 3.35Å; I124-C126 PolarHBondContact O-N 2.78Å; C126-F128 VanDerWaalsContact C-N 3.29Å; C126-F128 PolarHBondContact O-N 3.07Å; C126-A129 PolarHBondContact O-N 3.21Å; C126-E130 PolarHBondContact O-N 3.4Å
127	V	89.4	Confident	89.9	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-59.3	-42.1	175	170.2	0	0	0	0	110.8	P65 I68 Y103 A123 I124 E130 L131	P65-V127 HydrophobicContact CG-CG2 4.23Å; I68-V127 HydrophobicContact CD1-CG1 3.75Å; I68-V127 HydrophobicContact CD1-CG2 4.14Å; Y103-V127 HydrophobicContact CD1-CG2 3.97Å; Y103-V127 HydrophobicContact CE1-CG2 4.05Å; A123-V127 WeakPolarHBondContact O-CG2 3.46Å; A123-V127 PolarHBondContact O-N 3.49Å; I124-V127 PolarHBondContact O-N 3.41Å; V127-E130 PolarHBondContact O-N 3.45Å; V127-L131 HydrophobicContact CG1-CD1 3.79Å; V127-L131 HydrophobicContact CG1-CG 4.14Å; V127-L131 WeakPolarHBondContact O-CB 3.44Å; V127-L131 VanDerWaalsContact O-CG 3.25Å; V127-L131 WeakPolarHBondContact O-CG 3.46Å; V127-L131 PolarHBondContact O-N 3.02Å
128	F	88.6	Confident	90.5	Very high	3 Å²	3	18.7 Å²	18.7	1%	0.013	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-46.1	178.6	177.1	-138	0	0	0	111.9	L35 L39 I124 G125 C126 E130 L131 L132 T196 L199 M200 Y222	L35-F128 HydrophobicContact CD2-CD2 4.4Å; L35-F128 HydrophobicContact CD2-CE2 4.47Å; L39-F128 HydrophobicContact CD1-CD2 3.8Å; L39-F128 HydrophobicContact CD1-CE2 3.33Å; L39-F128 HydrophobicContact CD1-CZ 4.15Å; L39-F128 HydrophobicContact CD2-CB 4.24Å; L39-F128 HydrophobicContact CD2-CD2 3.36Å; L39-F128 HydrophobicContact CD2-CE2 3.69Å; L39-F128 HydrophobicContact CD2-CG 3.84Å; L39-F128 HydrophobicContact CD2-CZ 4.4Å; L39-F128 HydrophobicContact CG-CD2 4.08Å; L39-F128 HydrophobicContact CG-CE2 4.09Å; I124-F128 VanDerWaalsContact O-CB 3.31Å; I124-F128 WeakPolarHBondContact O-CB 3.43Å; I124-F128 PolarHBondContact O-N 2.91Å; G125-F128 PolarHBondContact O-N 2.88Å; C126-F128 VanDerWaalsContact C-N 3.29Å; C126-F128 PolarHBondContact O-N 3.07Å; F128-E130 VanDerWaalsContact C-N 3.3Å; F128-E130 PolarHBondContact O-N 2.95Å; F128-L131 PolarHBondContact O-N 3.47Å; F128-L132 HydrophobicContact CD1-CD1 4.36Å; F128-L132 HydrophobicContact CD2-CD1 3.94Å; F128-L132 HydrophobicContact CD2-CG 4.09Å; F128-L132 HydrophobicContact CE1-CD1 4.09Å; F128-L132 HydrophobicContact CE2-CD1 3.65Å; F128-L132 HydrophobicContact CE2-CD2 4.12Å; F128-L132 HydrophobicContact CE2-CG 3.91Å; F128-L132 HydrophobicContact CG-CD1 4.33Å; F128-L132 HydrophobicContact CZ-CD1 3.78Å; F128-L132 VanDerWaalsContact O-CG 3.28Å; F128-L132 WeakPolarHBondContact O-CG 3.19Å; F128-L132 PolarHBondContact O-N 3.49Å; F128-L132 VanDerWaalsContact O-N 3.11Å; F128-T196 HydrophobicContact CE1-CG2 4.16Å; F128-T196 HydrophobicContact CE2-CG2 4.43Å; F128-T196 HydrophobicContact CZ-CG2 3.61Å; F128-L199 HydrophobicContact CE1-CB 4.33Å; F128-L199 HydrophobicContact CE1-CD2 4.03Å; F128-L199 HydrophobicContact CE1-CG 4.31Å; F128-L199 HydrophobicContact CZ-CD2 4.12Å; F128-M200 HydrophobicContact CD1-CB 3.9Å; F128-M200 HydrophobicContact CD1-CE 4.34Å; F128-M200 HydrophobicContact CD1-CG 4.3Å; F128-M200 HydrophobicContact CE1-CB 3.93Å; F128-Y222 HydrophobicContact CZ-CE2 4.31Å
129	A	91.4	Very high	90.8	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.2	-38.9	175.5	0	0	0	0	0	112.5	G125 C126 L132 S133 L137 Y189 M200	G125-A129 PolarHBondContact O-N 2.63Å; C126-A129 PolarHBondContact O-N 3.21Å; A129-L132 PolarHBondContact O-N 3.01Å; A129-S133 PolarHBondContact O-N 3.05Å; A129-S133 PolarHBondContact O-OG 3.09Å; A129-L137 HydrophobicContact CB-CB 3.99Å; A129-L137 HydrophobicContact CB-CD1 4.22Å; A129-L137 HydrophobicContact CB-CD2 3.91Å; A129-L137 HydrophobicContact CB-CG 4.26Å; A129-Y189 HydrophobicContact CB-CE2 4.4Å; A129-M200 HydrophobicContact CB-CE 3.74Å; A129-M200 HydrophobicContact CB-SD 3.97Å
130	E	90.3	Very high	91	Very high	10 Å²	10	19.9 Å²	19.9	5%	0.047	12%	0.124	C	C	.	.	H	α-helix	trans	-68.3	-43.5	176.4	179.4	165.4	159.8	0	0	112.7	Y103 C126 V127 F128 L132 S133 G134 I135 P136	Y103-E130 WeakPolarHBondContact CE1-OE2 3.23Å; Y103-E130 PolarHBondContact OH-OE2 2.91Å; C126-E130 PolarHBondContact O-N 3.4Å; V127-E130 PolarHBondContact O-N 3.45Å; F128-E130 VanDerWaalsContact C-N 3.3Å; F128-E130 PolarHBondContact O-N 2.95Å; E130-L132 PolarHBondContact O-N 2.82Å; E130-S133 PolarHBondContact O-N 3.38Å; E130-G134 VanDerWaalsContact O-CA 3.3Å; E130-G134 WeakPolarHBondContact O-CA 3.02Å; E130-G134 PolarHBondContact O-N 3.33Å; E130-I135 VanDerWaalsContact CA-O 3.32Å; E130-I135 WeakPolarHBondContact CA-O 3.31Å; E130-P136 VanDerWaalsContact OE2-CA 3.28Å; E130-P136 WeakPolarHBondContact OE2-CA 3.39Å
131	L	83.5	Confident	91.2	Very high	28 Å²	28	28.6 Å²	28.6	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-32.1	176.4	-69.1	170.8	0	0	0	112.2	L27 L35 V38 V127 F128	L27-L131 HydrophobicContact CD2-CD2 4.02Å; L35-L131 HydrophobicContact CD2-CB 3.39Å; L35-L131 HydrophobicContact CD2-CD1 4.44Å; L35-L131 HydrophobicContact CG-CB 4.05Å; V38-L131 HydrophobicContact CB-CD1 4.02Å; V38-L131 HydrophobicContact CG1-CD1 3.67Å; V38-L131 HydrophobicContact CG2-CD1 4.3Å; V127-L131 HydrophobicContact CG1-CD1 3.79Å; V127-L131 HydrophobicContact CG1-CG 4.14Å; V127-L131 WeakPolarHBondContact O-CB 3.44Å; V127-L131 VanDerWaalsContact O-CG 3.25Å; V127-L131 WeakPolarHBondContact O-CG 3.46Å; V127-L131 PolarHBondContact O-N 3.02Å; F128-L131 PolarHBondContact O-N 3.47Å
132	L	84.2	Confident	91.2	Very high	51 Å²	51	30.8 Å²	30.8	27%	0.267	18%	0.177	S	C	.	.	H	α-helix	trans	-73.2	-30.8	177.7	-71.4	169.9	0	0	0	113.1	L35 F128 A129 E130 L192 T196 M200	L35-L132 HydrophobicContact CD1-CD2 4.29Å; L35-L132 HydrophobicContact CD2-CD2 3.88Å; L35-L132 HydrophobicContact CD2-CG 4.08Å; F128-L132 HydrophobicContact CD1-CD1 4.36Å; F128-L132 HydrophobicContact CD2-CD1 3.94Å; F128-L132 HydrophobicContact CD2-CG 4.09Å; F128-L132 HydrophobicContact CE1-CD1 4.09Å; F128-L132 HydrophobicContact CE2-CD1 3.65Å; F128-L132 HydrophobicContact CE2-CD2 4.12Å; F128-L132 HydrophobicContact CE2-CG 3.91Å; F128-L132 HydrophobicContact CG-CD1 4.33Å; F128-L132 HydrophobicContact CZ-CD1 3.78Å; F128-L132 VanDerWaalsContact O-CG 3.28Å; F128-L132 WeakPolarHBondContact O-CG 3.19Å; F128-L132 PolarHBondContact O-N 3.49Å; F128-L132 VanDerWaalsContact O-N 3.11Å; A129-L132 PolarHBondContact O-N 3.01Å; E130-L132 PolarHBondContact O-N 2.82Å; L132-L192 HydrophobicContact CD1-CD1 3.83Å; L132-L192 HydrophobicContact CD1-CD2 4.26Å; L132-L192 HydrophobicContact CD2-CD2 4.32Å; L132-T196 HydrophobicContact CD1-CG2 3.74Å; L132-T196 HydrophobicContact CD2-CG2 4.29Å; L132-M200 HydrophobicContact CD1-CE 3.59Å
133	S	85.8	Confident	91	Very high	50 Å²	50	32.4 Å²	32.4	35%	0.35	19%	0.186	S	C	.	.	H	α-helix	trans	-112.9	-16.8	-171.6	59.4	0	0	0	0	114.8	A129 E130 I135	A129-S133 PolarHBondContact O-N 3.05Å; A129-S133 PolarHBondContact O-OG 3.09Å; E130-S133 PolarHBondContact O-N 3.38Å; S133-I135 PolarHBondContact O-N 3.47Å; S133-I135 WeakPolarHBondContact OG-CG1 3.35Å; S133-I135 PolarHBondContact OG-N 3.14Å; S133-I135 PolarHBondContact OG-O 3.09Å; S133-I135 VanDerWaalsContact OG-O 3.13Å
134	G	85.8	Confident	91	Very high	40 Å²	40	34.1 Å²	34.1	41%	0.412	19%	0.194	S	C	.	.	S	Bend	trans	74.6	4.6	-171.4	0	0	0	0	0	114.3	E130	E130-G134 VanDerWaalsContact O-CA 3.3Å; E130-G134 WeakPolarHBondContact O-CA 3.02Å; E130-G134 PolarHBondContact O-N 3.33Å
135	I	88.8	Confident	91.3	Very high	110 Å²	110	36.1 Å²	36.1	56%	0.564	20%	0.204	S	C	*	.	S	Bend	trans	-131.8	143.9	-178.5	57.9	170.8	0	0	0	111.1	E130 S133 L137	E130-I135 VanDerWaalsContact CA-O 3.32Å; E130-I135 WeakPolarHBondContact CA-O 3.31Å; S133-I135 PolarHBondContact O-N 3.47Å; S133-I135 WeakPolarHBondContact OG-CG1 3.35Å; S133-I135 PolarHBondContact OG-N 3.14Å; S133-I135 PolarHBondContact OG-O 3.09Å; S133-I135 VanDerWaalsContact OG-O 3.13Å; I135-L137 PolarHBondContact O-N 3.46Å
136	P	92.8	Very high	91.5	Very high	30 Å²	30	36.1 Å²	36.1	20%	0.195	20%	0.204	C	C	.	.			trans	-58.3	137.4	176	-22.3	30.9	0	0	0	112	W102 E130 W138 P139	W102-P136 HydrophobicContact CD2-CB 4.3Å; W102-P136 HydrophobicContact CD2-CG 4.48Å; W102-P136 HydrophobicContact CE3-CB 3.67Å; W102-P136 HydrophobicContact CE3-CG 3.51Å; W102-P136 HydrophobicContact CH2-CG 4.32Å; W102-P136 HydrophobicContact CZ3-CB 4.11Å; W102-P136 HydrophobicContact CZ3-CG 3.42Å; W102-P136 VanDerWaalsContact CZ3-CG 3.42Å; E130-P136 VanDerWaalsContact OE2-CA 3.28Å; E130-P136 WeakPolarHBondContact OE2-CA 3.39Å; P136-W138 VanDerWaalsContact C-N 3.34Å; P136-W138 PolarHBondContact O-N 3.18Å; P136-P139 HydrophobicContact CB-CB 4.29Å
137	L	95.9	Very high	91.6	Very high	8 Å²	8	36 Å²	36	4%	0.042	20%	0.204	C	C	.	.	S	Bend	trans	-61.4	-41.2	-176.4	175.9	60.3	0	0	0	112.9	A129 I135 L185 K188 Y189 L204	A129-L137 HydrophobicContact CB-CB 3.99Å; A129-L137 HydrophobicContact CB-CD1 4.22Å; A129-L137 HydrophobicContact CB-CD2 3.91Å; A129-L137 HydrophobicContact CB-CG 4.26Å; I135-L137 PolarHBondContact O-N 3.46Å; L137-L185 HydrophobicContact CD1-CD2 4Å; L137-L185 HydrophobicContact CD2-CD2 4.44Å; L137-K188 HydrophobicContact CD1-CD 4.25Å; L137-K188 PolarHBondContact O-NZ 2.98Å; L137-Y189 HydrophobicContact CD1-CE2 3.8Å; L137-Y189 VanDerWaalsContact CD1-OH 3.23Å; L137-Y189 WeakPolarHBondContact CD1-OH 3.33Å; L137-L204 HydrophobicContact CD2-CD1 3.51Å
138	W	97.4	Very high	91.9	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	21%	0.214	C	C	.	.			trans	-141	90.4	178.9	-61	-57.4	0	0	0	110.3	W122 P136 G140 Q146 L149 I150 T153 L154 L204	W122-W138 AromaticContact CE2-CZ3 3.85Å; W122-W138 AromaticContact CH2-CH2 3.87Å; W122-W138 HydrophobicContact CH2-CH2 3.87Å; W122-W138 AromaticContact CH2-CZ3 3.89Å; W122-W138 HydrophobicContact CH2-CZ3 3.89Å; W122-W138 HydrophobicContact CZ2-CE3 4.09Å; W122-W138 AromaticContact CZ2-CH2 3.73Å; W122-W138 HydrophobicContact CZ2-CH2 3.73Å; W122-W138 AromaticContact CZ2-CZ3 3.24Å; W122-W138 HydrophobicContact CZ2-CZ3 3.24Å; P136-W138 VanDerWaalsContact C-N 3.34Å; P136-W138 PolarHBondContact O-N 3.18Å; W138-G140 VanDerWaalsContact C-N 3.29Å; W138-G140 PolarHBondContact O-N 3.29Å; W138-G140 VanDerWaalsContact O-N 3.08Å; W138-Q146 VanDerWaalsContact CB-NE2 3.27Å; W138-Q146 PolarHBondContact O-NE2 3.5Å; W138-Q146 PolarHBondContact O-OE1 3.47Å; W138-L149 HydrophobicContact CB-CB 4.07Å; W138-L149 HydrophobicContact CB-CD1 4.27Å; W138-L149 HydrophobicContact CG-CB 4.1Å; W138-L149 PolarHBondContact NE1-O 2.92Å; W138-I150 HydrophobicContact CD2-CG1 3.79Å; W138-I150 HydrophobicContact CE3-CG1 3.76Å; W138-I150 HydrophobicContact CG-CG1 4.29Å; W138-I150 HydrophobicContact CH2-CG1 4.43Å; W138-I150 HydrophobicContact CZ2-CG1 4.45Å; W138-I150 HydrophobicContact CZ3-CG1 4.11Å; W138-T153 HydrophobicContact CZ2-CG2 3.88Å; W138-T153 PolarHBondContact NE1-OG1 3.21Å; W138-T153 VanDerWaalsContact NE1-OG1 3.16Å; W138-L154 HydrophobicContact CH2-CD1 3.88Å; W138-L154 HydrophobicContact CH2-CG 4.28Å; W138-L154 HydrophobicContact CZ2-CD1 4.16Å; W138-L154 HydrophobicContact CZ2-CG 4.05Å; W138-L204 HydrophobicContact CH2-CD1 4.08Å; W138-L204 HydrophobicContact CH2-CD2 4.18Å; W138-L204 HydrophobicContact CZ3-CD2 4.09Å
139	P	95.8	Very high	92.4	Very high	66 Å²	66	40.3 Å²	40.3	43%	0.429	22%	0.223	S	C	.	.			trans	-85.1	61.4	-179.3	34.1	-35	0	0	0	112.3	W102 P136	W102-P139 HydrophobicContact CD2-CB 4.26Å; W102-P139 HydrophobicContact CZ2-CB 4.07Å; P136-P139 HydrophobicContact CB-CB 4.29Å
140	G	95.5	Very high	92.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.01	22%	0.223	C	C	.	.			trans	-67.7	140.4	-176.6	0	0	0	0	0	113.9	W102 W138 D145	W102-G140 PolarHBondContact NE1-O 3.36Å; W138-G140 VanDerWaalsContact C-N 3.29Å; W138-G140 PolarHBondContact O-N 3.29Å; W138-G140 VanDerWaalsContact O-N 3.08Å; G140-D145 WeakPolarHBondContact CA-OD2 3.28Å
141	K	92.4	Very high	93.1	Very high	184 Å²	184	41.4 Å²	41.4	80%	0.8	23%	0.226	S	C	*	.	S	Bend	trans	-82.3	-26.6	-178.5	-62.5	175.3	-175.8	174.2	0	113.2	R101 D145	R101-K141 PolarHBondContact NH1-O 2.98Å; K141-D145 WeakPolarHBondContact CB-OD2 3.31Å; K141-D145 PolarHBondContact N-OD2 3.25Å
142	S	91.6	Very high	93.8	Very high	52 Å²	52	42.7 Å²	42.7	36%	0.364	23%	0.231	S	C	.	.	S	Bend	trans	-141.3	171.8	175.5	67.5	0	0	0	0	109.6	R101 M144 D145 Q146	R101-S142 VanDerWaalsContact CD-C 3.44Å; R101-S142 WeakPolarHBondContact CD-O 3.46Å; S142-M144 VanDerWaalsContact C-N 3.26Å; S142-M144 PolarHBondContact O-N 3.37Å; S142-D145 PolarHBondContact O-N 3.43Å; S142-D145 WeakPolarHBondContact OG-CB 3.26Å; S142-D145 PolarHBondContact OG-N 3.3Å; S142-D145 VanDerWaalsContact OG-N 3.12Å; S142-Q146 WeakPolarHBondContact O-CB 3.48Å; S142-Q146 PolarHBondContact O-N 3.13Å
143	D	91.6	Very high	94.4	Very high	33 Å²	33	40.5 Å²	40.5	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-34	178.2	-65.2	-1.6	0	0	0	111.1	R101 L109 Q146 L147 F171	R101-D143 WeakPolarHBondContact CD-OD1 3.45Å; R101-D143 IonicContact CZ-OD1 2.77Å; R101-D143 IonicContact NE-OD1 3.59Å; R101-D143 PolarHBondContact NE-OD1 3.11Å; L109-D143 HydrophobicContact CD2-CB 4.26Å; D143-Q146 PolarHBondContact O-N 3.41Å; D143-L147 WeakPolarHBondContact O-CB 3.3Å; D143-L147 VanDerWaalsContact O-CG 3.27Å; D143-L147 WeakPolarHBondContact O-CG 3.32Å; D143-L147 PolarHBondContact O-N 2.85Å; D143-F171 HydrophobicContact CB-CZ 4.28Å
144	M	92.9	Very high	95	Very high	41 Å²	41	40.6 Å²	40.6	20%	0.202	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-47.2	170.4	-75	-62.1	-65.3	0	0	112.8	S142 Q146 L147 Y148 F165 F171 V174 S175 I176	S142-M144 VanDerWaalsContact C-N 3.26Å; S142-M144 PolarHBondContact O-N 3.37Å; M144-Q146 VanDerWaalsContact C-N 3.33Å; M144-L147 PolarHBondContact O-N 2.82Å; M144-Y148 WeakPolarHBondContact O-CB 3.47Å; M144-Y148 PolarHBondContact O-N 3.18Å; M144-F165 HydrophobicContact CE-CZ 4.05Å; M144-F165 HydrophobicContact SD-CE2 3.66Å; M144-F165 HydrophobicContact SD-CZ 3.44Å; M144-F165 WeakPolarHBondContact SD-CZ 3.29Å; M144-F171 HydrophobicContact CG-CD1 4.26Å; M144-F171 HydrophobicContact CG-CE1 4.02Å; M144-F171 HydrophobicContact SD-CD1 3.77Å; M144-F171 HydrophobicContact SD-CE1 3.94Å; M144-V174 HydrophobicContact CE-CG1 3.61Å; M144-V174 HydrophobicContact SD-CG1 4.4Å; M144-S175 WeakPolarHBondContact CE-O 3.3Å; M144-I176 HydrophobicContact CE-CG1 4.25Å
145	D	95.3	Very high	95.5	Very high	48 Å²	48	39.5 Å²	39.5	26%	0.257	20%	0.204	S	C	.	.	H	α-helix	trans	-66	-39.1	178.3	-173	40.1	0	0	0	110.8	G140 K141 S142 Y148 L149	G140-D145 WeakPolarHBondContact CA-OD2 3.28Å; K141-D145 WeakPolarHBondContact CB-OD2 3.31Å; K141-D145 PolarHBondContact N-OD2 3.25Å; S142-D145 PolarHBondContact O-N 3.43Å; S142-D145 WeakPolarHBondContact OG-CB 3.26Å; S142-D145 PolarHBondContact OG-N 3.3Å; S142-D145 VanDerWaalsContact OG-N 3.12Å; D145-Y148 WeakPolarHBondContact O-CB 3.41Å; D145-Y148 PolarHBondContact O-N 3.27Å; D145-L149 VanDerWaalsContact O-CG 3.29Å; D145-L149 WeakPolarHBondContact O-CG 3.26Å; D145-L149 PolarHBondContact O-N 3.46Å
146	Q	96.9	Very high	95.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-48	174.3	-169.5	69.2	30.4	0	0	111.5	R101 W102 L109 W138 S142 D143 M144 Y148 L149 I150	R101-Q146 HydrophobicContact CG-CB 4.46Å; R101-Q146 HydrophobicContact CG-CG 4.46Å; W102-Q146 PolarHBondContact O-NE2 3.03Å; L109-Q146 HydrophobicContact CD1-CB 4.19Å; L109-Q146 HydrophobicContact CD1-CG 3.52Å; L109-Q146 HydrophobicContact CD2-CB 4.25Å; L109-Q146 HydrophobicContact CD2-CG 3.99Å; L109-Q146 HydrophobicContact CG-CG 4.43Å; W138-Q146 VanDerWaalsContact CB-NE2 3.27Å; W138-Q146 PolarHBondContact O-NE2 3.5Å; W138-Q146 PolarHBondContact O-OE1 3.47Å; S142-Q146 WeakPolarHBondContact O-CB 3.48Å; S142-Q146 PolarHBondContact O-N 3.13Å; D143-Q146 PolarHBondContact O-N 3.41Å; M144-Q146 VanDerWaalsContact C-N 3.33Å; Q146-Y148 VanDerWaalsContact C-N 3.33Å; Q146-Y148 PolarHBondContact O-N 3.23Å; Q146-L149 PolarHBondContact O-N 3.4Å; Q146-I150 HydrophobicContact CG-CD1 4.21Å; Q146-I150 VanDerWaalsContact O-CG1 3.31Å; Q146-I150 WeakPolarHBondContact O-CG1 3.28Å; Q146-I150 PolarHBondContact O-N 3.02Å
147	L	96.8	Very high	96	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-39.2	176.1	-75	169.2	0	0	0	111.9	L109 V110 D143 M144 I150 R151 L157 F165 I176	L109-L147 HydrophobicContact CB-CD1 4.28Å; L109-L147 HydrophobicContact CB-CD2 3.72Å; L109-L147 HydrophobicContact CB-CG 3.91Å; L109-L147 HydrophobicContact CD1-CD2 4.05Å; L109-L147 HydrophobicContact CD1-CG 4.29Å; V110-L147 HydrophobicContact CG1-CD1 4.19Å; V110-L147 HydrophobicContact CG1-CD2 4.02Å; D143-L147 WeakPolarHBondContact O-CB 3.3Å; D143-L147 VanDerWaalsContact O-CG 3.27Å; D143-L147 WeakPolarHBondContact O-CG 3.32Å; D143-L147 PolarHBondContact O-N 2.85Å; M144-L147 PolarHBondContact O-N 2.82Å; L147-I150 PolarHBondContact O-N 2.71Å; L147-R151 VanDerWaalsContact O-CB 3.29Å; L147-R151 WeakPolarHBondContact O-CB 3.45Å; L147-R151 PolarHBondContact O-N 3.32Å; L147-L157 HydrophobicContact CD2-CD1 4.35Å; L147-L157 HydrophobicContact CD2-CD2 4.13Å; L147-F165 HydrophobicContact CD1-CD2 3.96Å; L147-F165 HydrophobicContact CD1-CE2 3.76Å; L147-I176 HydrophobicContact CB-CD1 3.9Å; L147-I176 HydrophobicContact CB-CG1 4.24Å; L147-I176 HydrophobicContact CD1-CD1 4.14Å; L147-I176 HydrophobicContact CG-CD1 4.46Å
148	Y	97.5	Very high	96.1	Very high	56 Å²	56	39.1 Å²	39.1	22%	0.22	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-46.1	174.3	172.2	-100.9	0	0	0	112.2	M144 D145 Q146 I150 R151 K152 P177 P179	M144-Y148 WeakPolarHBondContact O-CB 3.47Å; M144-Y148 PolarHBondContact O-N 3.18Å; D145-Y148 WeakPolarHBondContact O-CB 3.41Å; D145-Y148 PolarHBondContact O-N 3.27Å; Q146-Y148 VanDerWaalsContact C-N 3.33Å; Q146-Y148 PolarHBondContact O-N 3.23Å; Y148-I150 VanDerWaalsContact C-N 3.34Å; Y148-I150 PolarHBondContact O-N 3.06Å; Y148-R151 PolarHBondContact O-N 2.69Å; Y148-K152 WeakPolarHBondContact O-CB 3.39Å; Y148-K152 PolarHBondContact O-N 3.43Å; Y148-P177 HydrophobicContact CD2-CB 4.04Å; Y148-P177 HydrophobicContact CD2-CG 4.47Å; Y148-P177 WeakPolarHBondContact CD2-O 3.35Å; Y148-P177 HydrophobicContact CE2-CB 4.17Å; Y148-P179 HydrophobicContact CE2-CB 3.99Å
149	L	98.1	Very high	96	Very high	37 Å²	37	43.9 Å²	43.9	19%	0.194	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-40.6	177.5	-71.5	175.8	0	0	0	112.2	W138 D145 Q146 T153	W138-L149 HydrophobicContact CB-CB 4.07Å; W138-L149 HydrophobicContact CB-CD1 4.27Å; W138-L149 HydrophobicContact CG-CB 4.1Å; W138-L149 PolarHBondContact NE1-O 2.92Å; D145-L149 VanDerWaalsContact O-CG 3.29Å; D145-L149 WeakPolarHBondContact O-CG 3.26Å; D145-L149 PolarHBondContact O-N 3.46Å; Q146-L149 PolarHBondContact O-N 3.4Å; L149-T153 PolarHBondContact O-N 2.89Å; L149-T153 PolarHBondContact O-OG1 2.86Å
150	I	98.3	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-48.4	173.3	-69.2	165.2	0	0	0	110	P106 L109 W122 W138 Q146 L147 Y148 K152 T153 L154 M206	P106-I150 HydrophobicContact CG-CG2 4.37Å; L109-I150 HydrophobicContact CD1-CD1 3.55Å; W122-I150 HydrophobicContact CH2-CG2 3.93Å; W122-I150 HydrophobicContact CZ2-CD1 3.81Å; W122-I150 HydrophobicContact CZ2-CG1 4.05Å; W122-I150 HydrophobicContact CZ2-CG2 4.26Å; W138-I150 HydrophobicContact CD2-CG1 3.79Å; W138-I150 HydrophobicContact CE3-CG1 3.76Å; W138-I150 HydrophobicContact CG-CG1 4.29Å; W138-I150 HydrophobicContact CH2-CG1 4.43Å; W138-I150 HydrophobicContact CZ2-CG1 4.45Å; W138-I150 HydrophobicContact CZ3-CG1 4.11Å; Q146-I150 HydrophobicContact CG-CD1 4.21Å; Q146-I150 VanDerWaalsContact O-CG1 3.31Å; Q146-I150 WeakPolarHBondContact O-CG1 3.28Å; Q146-I150 PolarHBondContact O-N 3.02Å; L147-I150 PolarHBondContact O-N 2.71Å; Y148-I150 VanDerWaalsContact C-N 3.34Å; Y148-I150 PolarHBondContact O-N 3.06Å; I150-K152 VanDerWaalsContact C-N 3.34Å; I150-K152 PolarHBondContact O-N 2.89Å; I150-T153 PolarHBondContact O-N 3.34Å; I150-L154 HydrophobicContact CG2-CD1 4.23Å; I150-L154 PolarHBondContact O-N 3.49Å; I150-M206 HydrophobicContact CG2-CE 3.99Å; I150-M206 HydrophobicContact CG2-SD 4.06Å
151	R	97.7	Very high	95.9	Very high	33 Å²	33	45.4 Å²	45.4	13%	0.125	23%	0.23	C	C	.	.	H	α-helix	trans	-58	-44.8	179.2	-176.1	-177.8	-176.5	-166.8	1.3	112	L147 Y148 T153 G155 D156 I176 P177 E178 M182	L147-R151 VanDerWaalsContact O-CB 3.29Å; L147-R151 WeakPolarHBondContact O-CB 3.45Å; L147-R151 PolarHBondContact O-N 3.32Å; Y148-R151 PolarHBondContact O-N 2.69Å; R151-T153 PolarHBondContact O-N 3.42Å; R151-G155 VanDerWaalsContact CA-O 3.32Å; R151-G155 WeakPolarHBondContact CA-O 3.5Å; R151-G155 VanDerWaalsContact O-CA 3.29Å; R151-G155 WeakPolarHBondContact O-CA 3.41Å; R151-G155 PolarHBondContact O-N 2.96Å; R151-D156 IonicContact CZ-OD1 3.12Å; R151-D156 IonicContact NE-OD1 2.7Å; R151-D156 PolarHBondContact NE-OD1 2.99Å; R151-D156 IonicContact NH2-OD1 2.77Å; R151-D156 PolarHBondContact NH2-OD1 3.13Å; R151-I176 HydrophobicContact CB-CG2 4.48Å; R151-I176 PolarHBondContact NH1-O 3.22Å; R151-P177 PolarHBondContact NH1-O 3.45Å; R151-E178 VanDerWaalsContact NH1-CA 3.31Å; R151-M182 WeakPolarHBondContact O-CE 3.31Å
152	K	98	Very high	96	Very high	55 Å²	55	41 Å²	41	24%	0.239	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-32.2	176.3	-169.7	-173.4	-179.4	-146.4	0	112.7	Y148 I150 P179 E181 M182 E183	Y148-K152 WeakPolarHBondContact O-CB 3.39Å; Y148-K152 PolarHBondContact O-N 3.43Å; I150-K152 VanDerWaalsContact C-N 3.34Å; I150-K152 PolarHBondContact O-N 2.89Å; K152-P179 HydrophobicContact CB-CB 4.02Å; K152-P179 HydrophobicContact CB-CG 4.39Å; K152-P179 HydrophobicContact CG-CB 3.88Å; K152-E181 WeakPolarHBondContact CE-O 3.25Å; K152-M182 VanDerWaalsContact O-CE 3.31Å; K152-M182 WeakPolarHBondContact O-CE 3.49Å; K152-E183 HydrophobicContact CD-CB 4.43Å; K152-E183 HydrophobicContact CG-CB 4.31Å; K152-E183 IonicContact NZ-OE2 2.68Å; K152-E183 PolarHBondContact NZ-OE2 2.83Å; K152-E183 PolarHBondContact O-N 3.46Å
153	T	98.1	Very high	96.1	Very high	5 Å²	5	45 Å²	45	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-94.8	-38.3	-177.4	-62.7	0	0	0	0	113.8	W138 L149 I150 R151 E183 P184 L185 K188	W138-T153 HydrophobicContact CZ2-CG2 3.88Å; W138-T153 PolarHBondContact NE1-OG1 3.21Å; W138-T153 VanDerWaalsContact NE1-OG1 3.16Å; L149-T153 PolarHBondContact O-N 2.89Å; L149-T153 PolarHBondContact O-OG1 2.86Å; I150-T153 PolarHBondContact O-N 3.34Å; R151-T153 PolarHBondContact O-N 3.42Å; T153-E183 VanDerWaalsContact CA-O 3.32Å; T153-E183 WeakPolarHBondContact CA-O 3.31Å; T153-E183 WeakPolarHBondContact CG2-O 3.49Å; T153-E183 PolarHBondContact OG1-O 3.28Å; T153-P184 WeakPolarHBondContact O-CA 3.4Å; T153-L185 HydrophobicContact CG2-CD2 3.63Å; T153-L185 HydrophobicContact CG2-CG 3.79Å; T153-K188 PolarHBondContact OG1-NZ 3.34Å
154	L	97.8	Very high	96.1	Very high	53 Å²	53	44.8 Å²	44.8	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-112.4	-9	-170.8	-59.7	-175.3	0	0	0	114.6	W122 W138 I150 L185 L204 M206	W122-L154 HydrophobicContact CH2-CD1 3.56Å; W122-L154 HydrophobicContact CZ3-CD1 3.88Å; W138-L154 HydrophobicContact CH2-CD1 3.88Å; W138-L154 HydrophobicContact CH2-CG 4.28Å; W138-L154 HydrophobicContact CZ2-CD1 4.16Å; W138-L154 HydrophobicContact CZ2-CG 4.05Å; I150-L154 HydrophobicContact CG2-CD1 4.23Å; I150-L154 PolarHBondContact O-N 3.49Å; L154-L185 HydrophobicContact CD2-CD1 4.02Å; L154-L185 HydrophobicContact CD2-CG 4.24Å; L154-L204 HydrophobicContact CD1-CB 4.5Å; L154-L204 WeakPolarHBondContact CD1-O 3.44Å; L154-M206 HydrophobicContact CB-CE 3.79Å
155	G	96.4	Very high	96.1	Very high	16 Å²	16	43.3 Å²	43.3	17%	0.165	22%	0.217	C	C	.	.			trans	93.5	-169.9	-175.7	0	0	0	0	0	112.4	R151 M206	R151-G155 VanDerWaalsContact CA-O 3.32Å; R151-G155 WeakPolarHBondContact CA-O 3.5Å; R151-G155 VanDerWaalsContact O-CA 3.29Å; R151-G155 WeakPolarHBondContact O-CA 3.41Å; R151-G155 PolarHBondContact O-N 2.96Å; G155-M206 WeakPolarHBondContact O-CE 3.48Å
156	D	96.1	Very high	95.8	Very high	97 Å²	97	44.8 Å²	44.8	52%	0.519	23%	0.231	S	C	.	.	S	Bend	trans	-61.7	150.1	-174.5	-65.6	-36.6	0	0	0	113.3	R151	R151-D156 IonicContact CZ-OD1 3.12Å; R151-D156 IonicContact NE-OD1 2.7Å; R151-D156 PolarHBondContact NE-OD1 2.99Å; R151-D156 IonicContact NH2-OD1 2.77Å; R151-D156 PolarHBondContact NH2-OD1 3.13Å
157	L	96.3	Very high	95.4	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.052	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-57.5	146.9	169.3	-66.2	-175.5	0	0	0	110.4	P106 V110 L147 H161 Q162 I176 M206	P106-L157 HydrophobicContact CB-CD2 4.25Å; V110-L157 HydrophobicContact CG1-CD1 3.81Å; L147-L157 HydrophobicContact CD2-CD1 4.35Å; L147-L157 HydrophobicContact CD2-CD2 4.13Å; L157-H161 HydrophobicContact CB-CB 4.08Å; L157-H161 HydrophobicContact CD1-CB 4.27Å; L157-Q162 HydrophobicContact CB-CG 3.82Å; L157-Q162 PolarHBondContact O-NE2 3.18Å; L157-I176 HydrophobicContact CD1-CD1 3.39Å; L157-I176 HydrophobicContact CG-CD1 4.03Å; L157-M206 HydrophobicContact CD2-CE 4.38Å; L157-M206 HydrophobicContact CD2-SD 3.77Å
158	I	96.8	Very high	94.9	Very high	34 Å²	34	50.7 Å²	50.7	17%	0.174	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-63.4	155.6	173.4	62.7	167.3	0	0	0	111.2	R160 H161 Q162 M206 D207	I158-R160 HydrophobicContact CD1-CB 4.12Å; I158-R160 HydrophobicContact CG1-CB 4.39Å; I158-R160 PolarHBondContact O-N 3.34Å; I158-R160 VanDerWaalsContact O-N 3.11Å; I158-H161 HydrophobicContact CG1-CB 3.95Å; I158-H161 PolarHBondContact O-N 2.77Å; I158-Q162 WeakPolarHBondContact O-CG 3.46Å; I158-Q162 PolarHBondContact O-N 2.88Å; I158-M206 HydrophobicContact CG2-CB 4.11Å; I158-M206 HydrophobicContact CG2-CG 3.91Å; I158-D207 HydrophobicContact CD1-CB 4.35Å; I158-D207 HydrophobicContact CG2-CB 4.34Å
159	P	96.4	Very high	94.3	Very high	101 Å²	101	56.6 Å²	56.6	66%	0.656	30%	0.3	S	S	*	.	H	α-helix	trans	-52.3	-39.3	-177	-30	35.9	0	0	0	114.1	Q162 Q163	P159-Q162 PolarHBondContact O-N 3.33Å; P159-Q163 WeakPolarHBondContact O-CB 3.41Å; P159-Q163 PolarHBondContact O-N 3.36Å
160	R	94.7	Very high	93.5	Very high	97 Å²	97	61.9 Å²	61.9	37%	0.366	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-50.1	175.6	179.9	-178.6	172.7	91	20.3	112	D112 I158 Q162 Q163 V164	D112-R160 VanDerWaalsContact CG-NH2 3.34Å; D112-R160 IonicContact OD1-CZ 3.29Å; D112-R160 IonicContact OD1-NH2 2.96Å; D112-R160 PolarHBondContact OD1-NH2 2.98Å; D112-R160 IonicContact OD2-CZ 2.89Å; D112-R160 VanDerWaalsContact OD2-CZ 3.29Å; D112-R160 IonicContact OD2-NE 3.32Å; D112-R160 PolarHBondContact OD2-NE 3.01Å; D112-R160 IonicContact OD2-NH2 3.42Å; D112-R160 PolarHBondContact OD2-NH2 3.23Å; I158-R160 HydrophobicContact CD1-CB 4.12Å; I158-R160 HydrophobicContact CG1-CB 4.39Å; I158-R160 PolarHBondContact O-N 3.34Å; I158-R160 VanDerWaalsContact O-N 3.11Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 3.33Å; R160-Q163 PolarHBondContact O-N 3.07Å; R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 3.34Å
161	H	95.1	Very high	92.8	Very high	2 Å²	2	63 Å²	63	1%	0.009	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-36.6	-179.5	-67.1	169.9	0	0	0	111.5	V110 L157 I158 V164 F165 M206	V110-H161 HydrophobicContact CG1-CB 4.27Å; V110-H161 HydrophobicContact CG2-CB 4.23Å; L157-H161 HydrophobicContact CB-CB 4.08Å; L157-H161 HydrophobicContact CD1-CB 4.27Å; I158-H161 HydrophobicContact CG1-CB 3.95Å; I158-H161 PolarHBondContact O-N 2.77Å; H161-V164 PolarHBondContact O-N 3.1Å; H161-F165 WeakPolarHBondContact O-CB 3.27Å; H161-F165 PolarHBondContact O-N 2.91Å; H161-M206 PolarHBondContact CE1-O 3.3Å
162	Q	94.4	Very high	92.1	Very high	91 Å²	91	65.8 Å²	65.8	43%	0.425	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-42.9	173.5	-65	176.4	-8	0	0	111.9	L157 I158 P159 R160 S166	L157-Q162 HydrophobicContact CB-CG 3.82Å; L157-Q162 PolarHBondContact O-NE2 3.18Å; I158-Q162 WeakPolarHBondContact O-CG 3.46Å; I158-Q162 PolarHBondContact O-N 2.88Å; P159-Q162 PolarHBondContact O-N 3.33Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 3.33Å; Q162-S166 WeakPolarHBondContact O-CB 3.32Å; Q162-S166 PolarHBondContact O-N 3.43Å; Q162-S166 PolarHBondContact O-OG 3.36Å
163	Q	93.1	Very high	91.3	Very high	135 Å²	135	67.3 Å²	67.3	63%	0.631	38%	0.381	S	S	*	.	H	α-helix	trans	-64.4	-47.5	177.6	-178.9	-177.3	-7.2	0	0	111.5	P159 R160 S166 S167	P159-Q163 WeakPolarHBondContact O-CB 3.41Å; P159-Q163 PolarHBondContact O-N 3.36Å; R160-Q163 PolarHBondContact O-N 3.07Å; Q163-S166 PolarHBondContact O-N 3.05Å; Q163-S167 WeakPolarHBondContact O-CB 3.36Å; Q163-S167 PolarHBondContact O-N 3.01Å; Q163-S167 PolarHBondContact O-OG 3.28Å
164	V	91.8	Very high	90.7	Very high	30 Å²	30	70.9 Å²	70.9	18%	0.182	40%	0.403	C	S	.	.	H	α-helix	trans	-61.1	-48.9	177.6	171.4	0	0	0	0	110.3	V110 D112 R160 H161 S166 S167 N168	V110-V164 HydrophobicContact CB-CG1 4.36Å; V110-V164 HydrophobicContact CG2-CB 4.24Å; V110-V164 HydrophobicContact CG2-CG1 3.9Å; D112-V164 HydrophobicContact CB-CG1 4.08Å; D112-V164 HydrophobicContact CB-CG2 4.4Å; R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 3.34Å; H161-V164 PolarHBondContact O-N 3.1Å; V164-S166 PolarHBondContact O-N 3.02Å; V164-S167 PolarHBondContact O-N 3.43Å; V164-S167 VanDerWaalsContact O-N 3.17Å; V164-N168 WeakPolarHBondContact O-CB 3.48Å; V164-N168 PolarHBondContact O-N 3.08Å
165	F	91.6	Very high	90.3	Very high	9 Å²	9	72.7 Å²	72.7	4%	0.039	42%	0.42	C	S	.	.	H	α-helix	trans	-56	-48	177.9	180	-94.6	0	0	0	111.9	V110 M144 L147 H161 S167 N168 F171 V174 I176	V110-F165 HydrophobicContact CB-CB 4.02Å; V110-F165 HydrophobicContact CB-CD2 4.38Å; V110-F165 HydrophobicContact CG1-CB 3.96Å; V110-F165 HydrophobicContact CG1-CD2 4.07Å; V110-F165 HydrophobicContact CG1-CG 4.44Å; M144-F165 HydrophobicContact CE-CZ 4.05Å; M144-F165 HydrophobicContact SD-CE2 3.66Å; M144-F165 HydrophobicContact SD-CZ 3.44Å; M144-F165 WeakPolarHBondContact SD-CZ 3.29Å; L147-F165 HydrophobicContact CD1-CD2 3.96Å; L147-F165 HydrophobicContact CD1-CE2 3.76Å; H161-F165 WeakPolarHBondContact O-CB 3.27Å; H161-F165 PolarHBondContact O-N 2.91Å; F165-S167 VanDerWaalsContact C-N 3.28Å; F165-S167 PolarHBondContact O-N 3.35Å; F165-N168 WeakPolarHBondContact O-CB 3.34Å; F165-N168 PolarHBondContact O-N 3.21Å; F165-F171 HydrophobicContact CD1-CB 4.4Å; F165-F171 HydrophobicContact CD2-CB 4.05Å; F165-F171 HydrophobicContact CD2-CD1 4.44Å; F165-F171 AromaticContact CD2-CD2 3.54Å; F165-F171 HydrophobicContact CD2-CD2 3.54Å; F165-F171 HydrophobicContact CD2-CE2 4.07Å; F165-F171 AromaticContact CD2-CG 3.76Å; F165-F171 HydrophobicContact CD2-CG 3.76Å; F165-F171 HydrophobicContact CE1-CB 4.07Å; F165-F171 HydrophobicContact CE2-CB 3.7Å; F165-F171 AromaticContact CE2-CD1 3.62Å; F165-F171 HydrophobicContact CE2-CD1 3.62Å; F165-F171 AromaticContact CE2-CD2 3.57Å; F165-F171 HydrophobicContact CE2-CD2 3.57Å; F165-F171 HydrophobicContact CE2-CE1 4.1Å; F165-F171 HydrophobicContact CE2-CE2 4.06Å; F165-F171 AromaticContact CE2-CG 3.33Å; F165-F171 HydrophobicContact CE2-CG 3.33Å; F165-F171 HydrophobicContact CE2-CZ 4.31Å; F165-F171 HydrophobicContact CG-CB 4.39Å; F165-F171 HydrophobicContact CG-CD2 4.4Å; F165-F171 HydrophobicContact CZ-CB 3.7Å; F165-F171 HydrophobicContact CZ-CD1 4.02Å; F165-F171 HydrophobicContact CZ-CD2 4.44Å; F165-F171 AromaticContact CZ-CG 3.81Å; F165-F171 HydrophobicContact CZ-CG 3.81Å; F165-F171 WeakPolarHBondContact O-CB 3.23Å; F165-V174 WeakPolarHBondContact CE1-O 3.5Å; F165-I176 HydrophobicContact CE1-CG1 4.21Å; F165-I176 HydrophobicContact CE2-CD1 4.42Å; F165-I176 HydrophobicContact CE2-CG1 4.22Å; F165-I176 HydrophobicContact CZ-CD1 4.42Å; F165-I176 HydrophobicContact CZ-CG1 3.87Å
166	S	89.8	Confident	90.1	Very high	79 Å²	79	72.8 Å²	72.8	55%	0.552	42%	0.417	S	S	*	.	H	α-helix	trans	-68.4	-27.1	-179.3	-53.6	0	0	0	0	113.4	Q162 Q163 V164	Q162-S166 WeakPolarHBondContact O-CB 3.32Å; Q162-S166 PolarHBondContact O-N 3.43Å; Q162-S166 PolarHBondContact O-OG 3.36Å; Q163-S166 PolarHBondContact O-N 3.05Å; V164-S166 PolarHBondContact O-N 3.02Å
167	S	88.6	Confident	89.9	Confident	93 Å²	93	71.6 Å²	71.6	65%	0.65	41%	0.414	S	S	*	.	H	α-helix	trans	-86.8	-11.6	179.3	-52.2	0	0	0	0	112.7	Q163 V164 F165	Q163-S167 WeakPolarHBondContact O-CB 3.36Å; Q163-S167 PolarHBondContact O-N 3.01Å; Q163-S167 PolarHBondContact O-OG 3.28Å; V164-S167 PolarHBondContact O-N 3.43Å; V164-S167 VanDerWaalsContact O-N 3.17Å; F165-S167 VanDerWaalsContact C-N 3.28Å; F165-S167 PolarHBondContact O-N 3.35Å
168	N	86.2	Confident	89.8	Confident	32 Å²	32	78.7 Å²	78.7	17%	0.171	45%	0.447	C	S	.	.			trans	-76	126.8	-178.9	-172.6	-27.4	0	0	0	110.2	V110 V164 F165 F170 F171 C172	V110-N168 PolarHBondContact O-ND2 3.33Å; V164-N168 WeakPolarHBondContact O-CB 3.48Å; V164-N168 PolarHBondContact O-N 3.08Å; F165-N168 WeakPolarHBondContact O-CB 3.34Å; F165-N168 PolarHBondContact O-N 3.21Å; N168-F170 PolarHBondContact O-N 3.48Å; N168-F170 VanDerWaalsContact O-N 3.17Å; N168-F170 VanDerWaalsContact OD1-CD2 3.26Å; N168-F170 WeakPolarHBondContact OD1-CD2 3.48Å; N168-F170 PolarHBondContact OD1-N 3.05Å; N168-F171 HydrophobicContact CB-CD2 3.9Å; N168-F171 CarbonylContact O-C 3.35Å; N168-F171 PolarHBondContact O-N 2.98Å; N168-C172 PolarHBondContact O-N 3.34Å
169	Q	85.4	Confident	89.6	Confident	180 Å²	180	77.8 Å²	77.8	84%	0.841	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.1	-178.5	-66.8	-179.7	-10.7	0	0	113.1	F171	Q169-F171 VanDerWaalsContact C-N 3.33Å
170	F	81.7	Confident	89.5	Confident	147 Å²	147	79 Å²	79	65%	0.645	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-22.6	178.8	-62.6	-70.4	0	0	0	113.6	N168	N168-F170 PolarHBondContact O-N 3.48Å; N168-F170 VanDerWaalsContact O-N 3.17Å; N168-F170 VanDerWaalsContact OD1-CD2 3.26Å; N168-F170 WeakPolarHBondContact OD1-CD2 3.48Å; N168-F170 PolarHBondContact OD1-N 3.05Å
171	F	83.7	Confident	89.6	Confident	23 Å²	23	80.6 Å²	80.6	10%	0.101	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	0	-177.4	-58.2	-55	0	0	0	113.2	D143 M144 F165 N168 Q169 G173 V174	D143-F171 HydrophobicContact CB-CZ 4.28Å; M144-F171 HydrophobicContact CG-CD1 4.26Å; M144-F171 HydrophobicContact CG-CE1 4.02Å; M144-F171 HydrophobicContact SD-CD1 3.77Å; M144-F171 HydrophobicContact SD-CE1 3.94Å; F165-F171 HydrophobicContact CD1-CB 4.4Å; F165-F171 HydrophobicContact CD2-CB 4.05Å; F165-F171 HydrophobicContact CD2-CD1 4.44Å; F165-F171 AromaticContact CD2-CD2 3.54Å; F165-F171 HydrophobicContact CD2-CD2 3.54Å; F165-F171 HydrophobicContact CD2-CE2 4.07Å; F165-F171 AromaticContact CD2-CG 3.76Å; F165-F171 HydrophobicContact CD2-CG 3.76Å; F165-F171 HydrophobicContact CE1-CB 4.07Å; F165-F171 HydrophobicContact CE2-CB 3.7Å; F165-F171 AromaticContact CE2-CD1 3.62Å; F165-F171 HydrophobicContact CE2-CD1 3.62Å; F165-F171 AromaticContact CE2-CD2 3.57Å; F165-F171 HydrophobicContact CE2-CD2 3.57Å; F165-F171 HydrophobicContact CE2-CE1 4.1Å; F165-F171 HydrophobicContact CE2-CE2 4.06Å; F165-F171 AromaticContact CE2-CG 3.33Å; F165-F171 HydrophobicContact CE2-CG 3.33Å; F165-F171 HydrophobicContact CE2-CZ 4.31Å; F165-F171 HydrophobicContact CG-CB 4.39Å; F165-F171 HydrophobicContact CG-CD2 4.4Å; F165-F171 HydrophobicContact CZ-CB 3.7Å; F165-F171 HydrophobicContact CZ-CD1 4.02Å; F165-F171 HydrophobicContact CZ-CD2 4.44Å; F165-F171 AromaticContact CZ-CG 3.81Å; F165-F171 HydrophobicContact CZ-CG 3.81Å; F165-F171 WeakPolarHBondContact O-CB 3.23Å; N168-F171 HydrophobicContact CB-CD2 3.9Å; N168-F171 CarbonylContact O-C 3.35Å; N168-F171 PolarHBondContact O-N 2.98Å; Q169-F171 VanDerWaalsContact C-N 3.33Å; F171-G173 PolarHBondContact O-N 3.46Å; F171-V174 PolarHBondContact O-N 3.3Å
172	C	81.6	Confident	89.7	Confident	92 Å²	92	84.3 Å²	84.3	62%	0.622	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	122.9	-179	-179.3	0	0	0	0	111.2	N168 V174	N168-C172 PolarHBondContact O-N 3.34Å; C172-V174 VanDerWaalsContact C-N 3.31Å
173	G	81.1	Confident	89.8	Confident	87 Å²	87	82.8 Å²	82.8	90%	0.897	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	3.9	-179.7	0	0	0	0	0	115.1	F171	F171-G173 PolarHBondContact O-N 3.46Å
174	V	86.4	Confident	90	Very high	80 Å²	80	78.4 Å²	78.4	49%	0.485	46%	0.457	S	S	.	.			trans	-110.5	144	175.1	-168.4	0	0	0	0	109.2	M144 F165 F171 C172	M144-V174 HydrophobicContact CE-CG1 3.61Å; M144-V174 HydrophobicContact SD-CG1 4.4Å; F165-V174 WeakPolarHBondContact CE1-O 3.5Å; F171-V174 PolarHBondContact O-N 3.3Å; C172-V174 VanDerWaalsContact C-N 3.31Å
175	S	88.8	Confident	90.3	Very high	91 Å²	91	77.1 Å²	77.1	64%	0.636	45%	0.45	S	S	*	.			trans	-116.9	149	171.2	60.3	0	0	0	0	110.5	M144 P177	M144-S175 WeakPolarHBondContact CE-O 3.3Å; S175-P177 WeakPolarHBondContact O-CD 3.37Å
176	I	91.9	Very high	90.5	Very high	19 Å²	19	81 Å²	81	10%	0.097	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-67.7	126.1	169	-58.2	161.6	0	0	0	106.5	M144 L147 R151 L157 F165	M144-I176 HydrophobicContact CE-CG1 4.25Å; L147-I176 HydrophobicContact CB-CD1 3.9Å; L147-I176 HydrophobicContact CB-CG1 4.24Å; L147-I176 HydrophobicContact CD1-CD1 4.14Å; L147-I176 HydrophobicContact CG-CD1 4.46Å; R151-I176 HydrophobicContact CB-CG2 4.48Å; R151-I176 PolarHBondContact NH1-O 3.22Å; L157-I176 HydrophobicContact CD1-CD1 3.39Å; L157-I176 HydrophobicContact CG-CD1 4.03Å; F165-I176 HydrophobicContact CE1-CG1 4.21Å; F165-I176 HydrophobicContact CE2-CD1 4.42Å; F165-I176 HydrophobicContact CE2-CG1 4.22Å; F165-I176 HydrophobicContact CZ-CD1 4.42Å; F165-I176 HydrophobicContact CZ-CG1 3.87Å
177	P	92.8	Very high	90.8	Very high	71 Å²	71	82.2 Å²	82.2	46%	0.461	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-58.4	147.1	179.3	-25.1	34.6	0	0	0	112.1	Y148 R151 S175	Y148-P177 HydrophobicContact CD2-CB 4.04Å; Y148-P177 HydrophobicContact CD2-CG 4.47Å; Y148-P177 WeakPolarHBondContact CD2-O 3.35Å; Y148-P177 HydrophobicContact CE2-CB 4.17Å; R151-P177 PolarHBondContact NH1-O 3.45Å; S175-P177 WeakPolarHBondContact O-CD 3.37Å
178	E	93.4	Very high	91.1	Very high	159 Å²	159	80.3 Å²	80.3	74%	0.743	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-77.9	124.1	172.4	-170.3	170.1	-174.5	0	0	109.4	R151	R151-E178 VanDerWaalsContact NH1-CA 3.31Å
179	P	94	Very high	91.4	Very high	15 Å²	15	80.1 Å²	80.1	10%	0.097	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-67.6	133.9	177.4	27.3	-32.4	0	0	0	109.6	Y148 K152 E181 M182	Y148-P179 HydrophobicContact CE2-CB 3.99Å; K152-P179 HydrophobicContact CB-CB 4.02Å; K152-P179 HydrophobicContact CB-CG 4.39Å; K152-P179 HydrophobicContact CG-CB 3.88Å; P179-E181 PolarHBondContact O-N 3.12Å; P179-M182 HydrophobicContact CG-SD 3.94Å
180	P	94.4	Very high	91.8	Very high	126 Å²	126	76 Å²	76	82%	0.818	43%	0.431	S	S	*	.	S	Bend	trans	-66.4	-29	179.5	27	-34.7	0	0	0	112.3
181	E	95.4	Very high	92.1	Very high	131 Å²	131	76.6 Å²	76.6	61%	0.612	44%	0.44	S	S	*	.	S	Bend	trans	-141.6	136.1	175.9	-169.2	-178.7	179.4	0	0	109.3	K152 P179	K152-E181 WeakPolarHBondContact CE-O 3.25Å; P179-E181 PolarHBondContact O-N 3.12Å
182	M	97.4	Very high	92.4	Very high	81 Å²	81	77.7 Å²	77.7	40%	0.399	45%	0.447	S	S	.	.			trans	-75.9	143.8	173.9	-70.4	-64.2	-65.8	0	0	110.5	R151 K152 P179	R151-M182 WeakPolarHBondContact O-CE 3.31Å; K152-M182 VanDerWaalsContact O-CE 3.31Å; K152-M182 WeakPolarHBondContact O-CE 3.49Å; P179-M182 HydrophobicContact CG-SD 3.94Å
183	E	97.1	Very high	92.8	Very high	58 Å²	58	76 Å²	76	27%	0.271	44%	0.436	S	S	.	.			trans	-129.5	75.6	177	-168.3	-171.5	-178	0	0	109.1	K152 T153 K188	K152-E183 HydrophobicContact CD-CB 4.43Å; K152-E183 HydrophobicContact CG-CB 4.31Å; K152-E183 IonicContact NZ-OE2 2.68Å; K152-E183 PolarHBondContact NZ-OE2 2.83Å; K152-E183 PolarHBondContact O-N 3.46Å; T153-E183 VanDerWaalsContact CA-O 3.32Å; T153-E183 WeakPolarHBondContact CA-O 3.31Å; T153-E183 WeakPolarHBondContact CG2-O 3.49Å; T153-E183 PolarHBondContact OG1-O 3.28Å; E183-K188 HydrophobicContact CG-CG 3.84Å
184	P	97.6	Very high	93.4	Very high	44 Å²	44	78.7 Å²	78.7	29%	0.286	43%	0.425	S	S	.	.			trans	-64.7	163.1	-175.9	27.7	-35.2	0	0	0	112.2	T153 E186 Q187 K188	T153-P184 WeakPolarHBondContact O-CA 3.4Å; P184-E186 PolarHBondContact O-N 3.25Å; P184-Q187 HydrophobicContact CG-CB 4.08Å; P184-Q187 WeakPolarHBondContact O-CB 3.49Å; P184-Q187 PolarHBondContact O-N 2.8Å; P184-K188 PolarHBondContact O-N 2.96Å
185	L	97	Very high	93.6	Very high	3 Å²	3	79.2 Å²	79.2	2%	0.016	42%	0.423	C	S	.	.	H	α-helix	trans	-57.4	-36.1	-178.5	-66.8	172.5	0	0	0	112.5	L137 T153 L154 Q187 K188 Y189 L197 M200 K201 L204	L137-L185 HydrophobicContact CD1-CD2 4Å; L137-L185 HydrophobicContact CD2-CD2 4.44Å; T153-L185 HydrophobicContact CG2-CD2 3.63Å; T153-L185 HydrophobicContact CG2-CG 3.79Å; L154-L185 HydrophobicContact CD2-CD1 4.02Å; L154-L185 HydrophobicContact CD2-CG 4.24Å; L185-Q187 VanDerWaalsContact C-N 3.28Å; L185-Q187 PolarHBondContact O-N 2.97Å; L185-K188 PolarHBondContact O-N 3.08Å; L185-Y189 HydrophobicContact CD2-CD2 4.31Å; L185-Y189 HydrophobicContact CD2-CE2 4.02Å; L185-Y189 WeakPolarHBondContact O-CB 3.5Å; L185-Y189 WeakPolarHBondContact O-CD2 3.48Å; L185-Y189 PolarHBondContact O-N 3.39Å; L185-L197 HydrophobicContact CB-CD1 3.84Å; L185-M200 HydrophobicContact CD1-SD 4.27Å; L185-M200 HydrophobicContact CD2-SD 4.07Å; L185-K201 HydrophobicContact CD1-CG 3.83Å; L185-L204 HydrophobicContact CD1-CD1 4.08Å; L185-L204 HydrophobicContact CD2-CD1 4.38Å
186	E	96.1	Very high	93.7	Very high	90 Å²	90	75.6 Å²	75.6	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-54	-43.7	172.2	-77	82	166.3	0	0	113	P184 Y189 P190 L197 K201	P184-E186 PolarHBondContact O-N 3.25Å; E186-Y189 CarbonylContact O-C 3.34Å; E186-P190 WeakPolarHBondContact O-CA 3.44Å; E186-L197 HydrophobicContact CB-CD2 4.41Å; E186-L197 HydrophobicContact CG-CD2 3.65Å; E186-K201 WeakPolarHBondContact OE1-CE 3.36Å; E186-K201 IonicContact OE1-NZ 3.64Å; E186-K201 PolarHBondContact OE1-NZ 3.25Å; E186-K201 VanDerWaalsContact OE2-CE 3.25Å; E186-K201 WeakPolarHBondContact OE2-CE 3.45Å; E186-K201 IonicContact OE2-NZ 2.69Å; E186-K201 PolarHBondContact OE2-NZ 2.78Å
187	Q	95.9	Very high	93.8	Very high	105 Å²	105	75.5 Å²	75.5	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-77	-36.5	-177.1	-177.8	174.4	-15.6	0	0	111.2	P184 L185 Y189 P190	P184-Q187 HydrophobicContact CG-CB 4.08Å; P184-Q187 WeakPolarHBondContact O-CB 3.49Å; P184-Q187 PolarHBondContact O-N 2.8Å; L185-Q187 VanDerWaalsContact C-N 3.28Å; L185-Q187 PolarHBondContact O-N 2.97Å; Q187-Y189 VanDerWaalsContact C-N 3.27Å; Q187-Y189 PolarHBondContact O-N 3.01Å; Q187-P190 WeakPolarHBondContact O-CD 3.49Å
188	K	94.4	Very high	93.9	Very high	53 Å²	53	74 Å²	74	23%	0.23	39%	0.387	C	S	.	.	H	α-helix	trans	-65.2	-32.7	172.4	-74.1	-168.1	164.6	-175	0	112.5	L137 T153 E183 P184 L185 P190	L137-K188 HydrophobicContact CD1-CD 4.25Å; L137-K188 PolarHBondContact O-NZ 2.98Å; T153-K188 PolarHBondContact OG1-NZ 3.34Å; E183-K188 HydrophobicContact CG-CG 3.84Å; P184-K188 PolarHBondContact O-N 2.96Å; L185-K188 PolarHBondContact O-N 3.08Å; K188-P190 VanDerWaalsContact C-CD 3.46Å; K188-P190 WeakPolarHBondContact O-CD 3.44Å
189	Y	93.3	Very high	93.8	Very high	28 Å²	28	66.4 Å²	66.4	11%	0.11	35%	0.352	C	S	.	.			trans	-129.6	59.9	-170.9	-59.1	-64.2	0	0	0	112.9	A129 L137 L185 E186 Q187 N191 L192 M200	A129-Y189 HydrophobicContact CB-CE2 4.4Å; L137-Y189 HydrophobicContact CD1-CE2 3.8Å; L137-Y189 VanDerWaalsContact CD1-OH 3.23Å; L137-Y189 WeakPolarHBondContact CD1-OH 3.33Å; L185-Y189 HydrophobicContact CD2-CD2 4.31Å; L185-Y189 HydrophobicContact CD2-CE2 4.02Å; L185-Y189 WeakPolarHBondContact O-CB 3.5Å; L185-Y189 WeakPolarHBondContact O-CD2 3.48Å; L185-Y189 PolarHBondContact O-N 3.39Å; E186-Y189 CarbonylContact O-C 3.34Å; Q187-Y189 VanDerWaalsContact C-N 3.27Å; Q187-Y189 PolarHBondContact O-N 3.01Å; Y189-N191 PolarHBondContact O-N 2.88Å; Y189-N191 VanDerWaalsContact O-N 3.15Å; Y189-L192 VanDerWaalsContact CB-CD1 3.46Å; Y189-L192 HydrophobicContact CD1-CD1 4.17Å; Y189-L192 HydrophobicContact CD2-CD1 4.45Å; Y189-L192 HydrophobicContact CG-CD1 3.79Å; Y189-L192 HydrophobicContact CG-CG 4.45Å; Y189-L192 PolarHBondContact O-N 3.09Å; Y189-M200 HydrophobicContact CD2-CE 4.22Å; Y189-M200 HydrophobicContact CD2-SD 4.05Å; Y189-M200 HydrophobicContact CE2-CE 4.17Å; Y189-M200 HydrophobicContact CE2-SD 3.93Å
190	P	93	Very high	93.8	Very high	94 Å²	94	65.7 Å²	65.7	61%	0.61	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.6	-171.5	28.4	-36	0	0	0	113.5	E186 Q187 K188	E186-P190 WeakPolarHBondContact O-CA 3.44Å; Q187-P190 WeakPolarHBondContact O-CD 3.49Å; K188-P190 VanDerWaalsContact C-CD 3.46Å; K188-P190 WeakPolarHBondContact O-CD 3.44Å
191	N	90.1	Very high	93.9	Very high	158 Å²	158	63.1 Å²	63.1	85%	0.845	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-1.9	-177.1	-60.5	-38.8	0	0	0	113.4	Y189	Y189-N191 PolarHBondContact O-N 2.88Å; Y189-N191 VanDerWaalsContact O-N 3.15Å
192	L	88.6	Confident	93.9	Very high	47 Å²	47	57.9 Å²	57.9	25%	0.246	30%	0.301	C	S	.	.	S	Bend	trans	-78.5	142.4	179	-65.6	-174.6	0	0	0	110.9	L132 Y189 T196 M200	L132-L192 HydrophobicContact CD1-CD1 3.83Å; L132-L192 HydrophobicContact CD1-CD2 4.26Å; L132-L192 HydrophobicContact CD2-CD2 4.32Å; Y189-L192 VanDerWaalsContact CB-CD1 3.46Å; Y189-L192 HydrophobicContact CD1-CD1 4.17Å; Y189-L192 HydrophobicContact CD2-CD1 4.45Å; Y189-L192 HydrophobicContact CG-CD1 3.79Å; Y189-L192 HydrophobicContact CG-CG 4.45Å; Y189-L192 PolarHBondContact O-N 3.09Å; L192-T196 HydrophobicContact CB-CG2 4.44Å; L192-T196 HydrophobicContact CD1-CG2 4.09Å; L192-T196 HydrophobicContact CD2-CG2 4.18Å; L192-T196 HydrophobicContact CG-CG2 4.47Å; L192-M200 HydrophobicContact CD1-CE 3.93Å
193	S	91	Very high	93.7	Very high	56 Å²	56	54 Å²	54	39%	0.392	28%	0.282	S	S	.	.			trans	-63.1	153.3	171.1	74.9	0	0	0	0	110.8	Q195 T196 L197	S193-Q195 PolarHBondContact O-N 3.31Å; S193-T196 PolarHBondContact O-N 3.31Å; S193-T196 VanDerWaalsContact O-N 3.09Å; S193-T196 PolarHBondContact OG-N 2.96Å; S193-T196 PolarHBondContact OG-OG1 2.76Å; S193-L197 PolarHBondContact O-N 2.65Å
194	H	93.4	Very high	93.8	Very high	144 Å²	144	51.5 Å²	51.5	67%	0.667	27%	0.27	S	S	*	.	H	α-helix	trans	-54.7	-37.7	177.6	-179.2	-87.7	0	0	0	112.1	S198	H194-S198 WeakPolarHBondContact O-CB 3.31Å; H194-S198 PolarHBondContact O-N 3.45Å
195	Q	90.6	Very high	93.8	Very high	91 Å²	91	54.6 Å²	54.6	43%	0.425	28%	0.276	S	S	.	.	H	α-helix	trans	-68.7	-40.1	179.4	-62.3	76.1	15	0	0	112	S193 L199 H220 Y222	S193-Q195 PolarHBondContact O-N 3.31Å; Q195-L199 PolarHBondContact O-N 3.03Å; Q195-H220 PolarHBondContact O-CE1 3.47Å; Q195-Y222 HydrophobicContact CB-CD2 4.49Å
196	T	90	Very high	93.8	Very high	14 Å²	14	55.4 Å²	55.4	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-48.6	176.7	-55.3	0	0	0	0	110.5	F128 L132 L192 S193 S198 L199 M200 Y222	F128-T196 HydrophobicContact CE1-CG2 4.16Å; F128-T196 HydrophobicContact CE2-CG2 4.43Å; F128-T196 HydrophobicContact CZ-CG2 3.61Å; L132-T196 HydrophobicContact CD1-CG2 3.74Å; L132-T196 HydrophobicContact CD2-CG2 4.29Å; L192-T196 HydrophobicContact CB-CG2 4.44Å; L192-T196 HydrophobicContact CD1-CG2 4.09Å; L192-T196 HydrophobicContact CD2-CG2 4.18Å; L192-T196 HydrophobicContact CG-CG2 4.47Å; S193-T196 PolarHBondContact O-N 3.31Å; S193-T196 VanDerWaalsContact O-N 3.09Å; S193-T196 PolarHBondContact OG-N 2.96Å; S193-T196 PolarHBondContact OG-OG1 2.76Å; T196-S198 PolarHBondContact O-N 2.95Å; T196-L199 PolarHBondContact O-N 3.17Å; T196-M200 PolarHBondContact O-N 3.41Å; T196-M200 VanDerWaalsContact O-N 3.08Å; T196-Y222 HydrophobicContact CG2-CE2 4.05Å; T196-Y222 VanDerWaalsContact OG1-CE2 3.3Å; T196-Y222 WeakPolarHBondContact OG1-CE2 3.39Å
197	L	94.1	Very high	93.8	Very high	18 Å²	18	53.3 Å²	53.3	9%	0.094	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-40.7	179	-171.4	67	0	0	0	111.8	L185 E186 S193 L199 M200 K201	L185-L197 HydrophobicContact CB-CD1 3.84Å; E186-L197 HydrophobicContact CB-CD2 4.41Å; E186-L197 HydrophobicContact CG-CD2 3.65Å; S193-L197 PolarHBondContact O-N 2.65Å; L197-L199 PolarHBondContact O-N 3.05Å; L197-M200 WeakPolarHBondContact O-CB 3.4Å; L197-M200 PolarHBondContact O-N 2.86Å; L197-K201 HydrophobicContact CG-CD 4.33Å; L197-K201 WeakPolarHBondContact O-CB 3.29Å; L197-K201 WeakPolarHBondContact O-CG 3.35Å; L197-K201 PolarHBondContact O-N 3.2Å
198	S	95	Very high	93.7	Very high	39 Å²	39	49.6 Å²	49.6	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-41.8	175.7	179.4	0	0	0	0	112.3	H194 T196 K201 S202 H220	H194-S198 WeakPolarHBondContact O-CB 3.31Å; H194-S198 PolarHBondContact O-N 3.45Å; T196-S198 PolarHBondContact O-N 2.95Å; S198-K201 PolarHBondContact O-N 2.81Å; S198-S202 WeakPolarHBondContact O-CB 3.49Å; S198-S202 PolarHBondContact O-N 3.39Å; S198-S202 PolarHBondContact O-OG 2.85Å; S198-H220 PolarHBondContact OG-NE2 3.27Å
199	L	91.4	Very high	93.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-45.8	176.2	-178.2	69.4	0	0	0	111	F43 F128 Q195 T196 L197 K201 S202 C203 L217 H220 Y222 F223	F43-L199 HydrophobicContact CE2-CD2 4.37Å; F128-L199 HydrophobicContact CE1-CB 4.33Å; F128-L199 HydrophobicContact CE1-CD2 4.03Å; F128-L199 HydrophobicContact CE1-CG 4.31Å; F128-L199 HydrophobicContact CZ-CD2 4.12Å; Q195-L199 PolarHBondContact O-N 3.03Å; T196-L199 PolarHBondContact O-N 3.17Å; L197-L199 PolarHBondContact O-N 3.05Å; L199-K201 PolarHBondContact O-N 3.25Å; L199-S202 WeakPolarHBondContact O-CB 3.14Å; L199-S202 PolarHBondContact O-N 3.17Å; L199-C203 PolarHBondContact O-N 3.21Å; L199-C203 PolarHBondContact O-SG 3.45Å; L199-C203 VanDerWaalsContact O-SG 3.33Å; L199-L217 HydrophobicContact CD1-CB 4.44Å; L199-L217 HydrophobicContact CD1-CD2 3.66Å; L199-H220 HydrophobicContact CD1-CB 3.82Å; L199-H220 PolarHBondContact N-CE1 2.98Å; L199-H220 VanDerWaalsContact N-CE1 3.34Å; L199-Y222 HydrophobicContact CB-CG 4.33Å; L199-Y222 HydrophobicContact CD2-CD1 3.45Å; L199-Y222 VanDerWaalsContact CD2-CD1 3.45Å; L199-Y222 HydrophobicContact CD2-CD2 4.39Å; L199-Y222 HydrophobicContact CD2-CE1 3.92Å; L199-Y222 HydrophobicContact CD2-CG 3.71Å; L199-F223 HydrophobicContact CD1-CE2 3.9Å; L199-F223 HydrophobicContact CD2-CE2 3.9Å; L199-F223 HydrophobicContact CD2-CZ 3.82Å
200	M	93.6	Very high	93.8	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-48	177.5	-175.5	-171.7	-64.5	0	0	111.1	F128 A129 L132 L185 Y189 L192 T196 L197 S202 C203 L204	F128-M200 HydrophobicContact CD1-CB 3.9Å; F128-M200 HydrophobicContact CD1-CE 4.34Å; F128-M200 HydrophobicContact CD1-CG 4.3Å; F128-M200 HydrophobicContact CE1-CB 3.93Å; A129-M200 HydrophobicContact CB-CE 3.74Å; A129-M200 HydrophobicContact CB-SD 3.97Å; L132-M200 HydrophobicContact CD1-CE 3.59Å; L185-M200 HydrophobicContact CD1-SD 4.27Å; L185-M200 HydrophobicContact CD2-SD 4.07Å; Y189-M200 HydrophobicContact CD2-CE 4.22Å; Y189-M200 HydrophobicContact CD2-SD 4.05Å; Y189-M200 HydrophobicContact CE2-CE 4.17Å; Y189-M200 HydrophobicContact CE2-SD 3.93Å; L192-M200 HydrophobicContact CD1-CE 3.93Å; T196-M200 PolarHBondContact O-N 3.41Å; T196-M200 VanDerWaalsContact O-N 3.08Å; L197-M200 WeakPolarHBondContact O-CB 3.4Å; L197-M200 PolarHBondContact O-N 2.86Å; M200-S202 VanDerWaalsContact C-N 3.28Å; M200-S202 PolarHBondContact O-N 3.36Å; M200-C203 WeakPolarHBondContact O-CB 3.49Å; M200-C203 PolarHBondContact O-N 3.44Å; M200-C203 VanDerWaalsContact O-N 3.07Å; M200-L204 HydrophobicContact CG-CD1 3.72Å; M200-L204 HydrophobicContact CG-CG 4.46Å; M200-L204 WeakPolarHBondContact O-CG 3.43Å; M200-L204 PolarHBondContact O-N 2.88Å; M200-L204 HydrophobicContact SD-CD1 4.33Å
201	K	96.6	Very high	93.8	Very high	72 Å²	72	51.1 Å²	51.1	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-33.2	177.1	-76.5	-178.6	168.9	-149.4	0	113.7	L185 E186 L197 S198 L199 C203 L204 R205	L185-K201 HydrophobicContact CD1-CG 3.83Å; E186-K201 WeakPolarHBondContact OE1-CE 3.36Å; E186-K201 IonicContact OE1-NZ 3.64Å; E186-K201 PolarHBondContact OE1-NZ 3.25Å; E186-K201 VanDerWaalsContact OE2-CE 3.25Å; E186-K201 WeakPolarHBondContact OE2-CE 3.45Å; E186-K201 IonicContact OE2-NZ 2.69Å; E186-K201 PolarHBondContact OE2-NZ 2.78Å; L197-K201 HydrophobicContact CG-CD 4.33Å; L197-K201 WeakPolarHBondContact O-CB 3.29Å; L197-K201 WeakPolarHBondContact O-CG 3.35Å; L197-K201 PolarHBondContact O-N 3.2Å; S198-K201 PolarHBondContact O-N 2.81Å; L199-K201 PolarHBondContact O-N 3.25Å; K201-C203 PolarHBondContact O-N 2.98Å; K201-L204 PolarHBondContact O-N 3.47Å; K201-R205 WeakPolarHBondContact O-CD 3.43Å
202	S	95.2	Very high	93.9	Very high	21 Å²	21	46 Å²	46	15%	0.147	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-24.3	175.9	-60.4	0	0	0	0	112.7	S198 L199 M200 L212	S198-S202 WeakPolarHBondContact O-CB 3.49Å; S198-S202 PolarHBondContact O-N 3.39Å; S198-S202 PolarHBondContact O-OG 2.85Å; L199-S202 WeakPolarHBondContact O-CB 3.14Å; L199-S202 PolarHBondContact O-N 3.17Å; M200-S202 VanDerWaalsContact C-N 3.28Å; M200-S202 PolarHBondContact O-N 3.36Å; S202-L212 PolarHBondContact O-N 3.23Å
203	C	94.6	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-87.6	-38.4	174.1	-55.2	0	0	0	0	112	V121 L199 M200 K201 R205 R211	V121-C203 HydrophobicContact CG1-CB 4.15Å; L199-C203 PolarHBondContact O-N 3.21Å; L199-C203 PolarHBondContact O-SG 3.45Å; L199-C203 VanDerWaalsContact O-SG 3.33Å; M200-C203 WeakPolarHBondContact O-CB 3.49Å; M200-C203 PolarHBondContact O-N 3.44Å; M200-C203 VanDerWaalsContact O-N 3.07Å; K201-C203 PolarHBondContact O-N 2.98Å; C203-R205 PolarHBondContact O-N 2.9Å; C203-R211 VanDerWaalsContact O-CD 3.31Å; C203-R211 WeakPolarHBondContact O-CD 3.4Å; C203-R211 WeakPolarHBondContact O-CG 3.38Å
204	L	97.4	Very high	93.1	Very high	4 Å²	4	45 Å²	45	2%	0.021	23%	0.234	C	C	.	.			trans	-95.1	44	-172.5	-60.7	177.9	0	0	0	113.2	W122 L137 W138 L154 L185 M200 K201	W122-L204 HydrophobicContact CD2-CD2 3.96Å; W122-L204 HydrophobicContact CE3-CD2 4.09Å; W122-L204 HydrophobicContact CG-CD2 4.42Å; W122-L204 HydrophobicContact CZ3-CB 4.42Å; W122-L204 HydrophobicContact CZ3-CD2 4.43Å; L137-L204 HydrophobicContact CD2-CD1 3.51Å; W138-L204 HydrophobicContact CH2-CD1 4.08Å; W138-L204 HydrophobicContact CH2-CD2 4.18Å; W138-L204 HydrophobicContact CZ3-CD2 4.09Å; L154-L204 HydrophobicContact CD1-CB 4.5Å; L154-L204 WeakPolarHBondContact CD1-O 3.44Å; L185-L204 HydrophobicContact CD1-CD1 4.08Å; L185-L204 HydrophobicContact CD2-CD1 4.38Å; M200-L204 HydrophobicContact CG-CD1 3.72Å; M200-L204 HydrophobicContact CG-CG 4.46Å; M200-L204 WeakPolarHBondContact O-CG 3.43Å; M200-L204 PolarHBondContact O-N 2.88Å; M200-L204 HydrophobicContact SD-CD1 4.33Å; K201-L204 PolarHBondContact O-N 3.47Å
205	R	97.8	Very high	92.4	Very high	110 Å²	110	43.2 Å²	43.2	42%	0.415	23%	0.226	S	C	.	.			trans	-80.3	137.7	170.5	-60	-67	-69.2	-168.3	-5.2	110.2	W122 K201 C203 D207 E210 R211	W122-R205 WeakPolarHBondContact CZ3-O 3.29Å; K201-R205 WeakPolarHBondContact O-CD 3.43Å; C203-R205 PolarHBondContact O-N 2.9Å; R205-D207 VanDerWaalsContact C-N 3.34Å; R205-E210 HydrophobicContact CB-CB 3.97Å; R205-E210 HydrophobicContact CG-CB 4.05Å; R205-E210 IonicContact CZ-OE2 2.87Å; R205-E210 IonicContact NE-OE2 2.87Å; R205-E210 PolarHBondContact NE-OE2 3.31Å; R205-E210 IonicContact NH2-OE1 2.49Å; R205-E210 IonicContact NH2-OE2 3.5Å; R205-E210 PolarHBondContact NH2-OE2 2.84Å; R205-R211 HydrophobicContact CB-CG 3.83Å; R205-R211 HydrophobicContact CG-CG 4.49Å; R205-R211 PolarHBondContact O-NE 3.43Å; R205-R211 PolarHBondContact O-NH2 3.29Å
206	M	97.1	Very high	92.1	Very high	20 Å²	20	43.3 Å²	43.3	10%	0.099	23%	0.227	C	C	.	.	S	Bend	trans	-63	-42.9	178.4	-163.7	73.6	78.5	0	0	111	P106 I150 L154 G155 L157 I158 H161 P208	P106-M206 HydrophobicContact CB-SD 4.04Å; P106-M206 HydrophobicContact CG-SD 3.7Å; I150-M206 HydrophobicContact CG2-CE 3.99Å; I150-M206 HydrophobicContact CG2-SD 4.06Å; L154-M206 HydrophobicContact CB-CE 3.79Å; G155-M206 WeakPolarHBondContact O-CE 3.48Å; L157-M206 HydrophobicContact CD2-CE 4.38Å; L157-M206 HydrophobicContact CD2-SD 3.77Å; I158-M206 HydrophobicContact CG2-CB 4.11Å; I158-M206 HydrophobicContact CG2-CG 3.91Å; H161-M206 PolarHBondContact CE1-O 3.3Å; M206-P208 WeakPolarHBondContact O-CD 3.49Å
207	D	96.4	Very high	91.9	Very high	45 Å²	45	42.7 Å²	42.7	24%	0.241	22%	0.223	C	C	.	.	S	Bend	trans	-77.8	121.5	172.5	-168.7	-36.7	0	0	0	110.3	I158 R205 S209 E210	I158-D207 HydrophobicContact CD1-CB 4.35Å; I158-D207 HydrophobicContact CG2-CB 4.34Å; R205-D207 VanDerWaalsContact C-N 3.34Å; D207-S209 VanDerWaalsContact CG-OG 3.23Å; D207-S209 PolarHBondContact O-N 2.91Å; D207-S209 VanDerWaalsContact OD1-CB 3.31Å; D207-S209 WeakPolarHBondContact OD1-CB 3.49Å; D207-S209 PolarHBondContact OD1-N 3.48Å; D207-S209 PolarHBondContact OD1-OG 2.9Å; D207-S209 PolarHBondContact OD2-OG 3.45Å; D207-E210 HydrophobicContact CB-CB 4.25Å; D207-E210 HydrophobicContact CB-CG 3.86Å; D207-E210 PolarHBondContact O-N 2.99Å
208	P	94	Very high	91.2	Very high	28 Å²	28	44 Å²	44	18%	0.182	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-59.2	-29.4	177.7	-22.6	33.9	0	0	0	113.9	E107 P118 M206 E210 R211	E107-P208 HydrophobicContact CB-CG 4.45Å; E107-P208 HydrophobicContact CG-CG 4.25Å; E107-P208 WeakPolarHBondContact OE1-CG 3.25Å; P118-P208 HydrophobicContact CB-CB 3.98Å; P118-P208 WeakPolarHBondContact CB-O 3.37Å; P118-P208 HydrophobicContact CG-CB 4.47Å; M206-P208 WeakPolarHBondContact O-CD 3.49Å; P208-E210 VanDerWaalsContact C-N 3.33Å; P208-R211 PolarHBondContact O-N 3.28Å
209	S	93.4	Very high	90.6	Very high	99 Å²	99	49.4 Å²	49.4	69%	0.692	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-75.1	-21.7	-179.3	71.7	0	0	0	0	113.5	D207	D207-S209 VanDerWaalsContact CG-OG 3.23Å; D207-S209 PolarHBondContact O-N 2.91Å; D207-S209 VanDerWaalsContact OD1-CB 3.31Å; D207-S209 WeakPolarHBondContact OD1-CB 3.49Å; D207-S209 PolarHBondContact OD1-N 3.48Å; D207-S209 PolarHBondContact OD1-OG 2.9Å; D207-S209 PolarHBondContact OD2-OG 3.45Å
210	E	95.6	Very high	90.4	Very high	95 Å²	95	50.1 Å²	50.1	44%	0.444	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-87	-11.4	176.5	-65.2	-172.9	151.5	0	0	113	R205 D207 P208 L212	R205-E210 HydrophobicContact CB-CB 3.97Å; R205-E210 HydrophobicContact CG-CB 4.05Å; R205-E210 IonicContact CZ-OE2 2.87Å; R205-E210 IonicContact NE-OE2 2.87Å; R205-E210 PolarHBondContact NE-OE2 3.31Å; R205-E210 IonicContact NH2-OE1 2.49Å; R205-E210 IonicContact NH2-OE2 3.5Å; R205-E210 PolarHBondContact NH2-OE2 2.84Å; D207-E210 HydrophobicContact CB-CB 4.25Å; D207-E210 HydrophobicContact CB-CG 3.86Å; D207-E210 PolarHBondContact O-N 2.99Å; P208-E210 VanDerWaalsContact C-N 3.33Å; E210-L212 PolarHBondContact O-N 2.83Å
211	R	94.7	Very high	90.2	Very high	12 Å²	12	53.5 Å²	53.5	5%	0.045	27%	0.269	C	S	.	.	S	Bend	trans	-68.8	129.6	175.7	-62.7	-178.9	-162.1	143.3	13.1	109	E107 P118 V121 C203 R205 P208 T213	E107-R211 IonicContact OE1-CZ 2.76Å; E107-R211 IonicContact OE1-NH1 3.17Å; E107-R211 PolarHBondContact OE1-NH1 3.11Å; E107-R211 IonicContact OE1-NH2 2.79Å; E107-R211 PolarHBondContact OE1-NH2 3.13Å; E107-R211 IonicContact OE2-CZ 3.97Å; E107-R211 IonicContact OE2-NH1 3.93Å; E107-R211 IonicContact OE2-NH2 2.9Å; E107-R211 PolarHBondContact OE2-NH2 3.16Å; P118-R211 PolarHBondContact O-NH1 3.44Å; V121-R211 HydrophobicContact CG1-CB 4.16Å; C203-R211 VanDerWaalsContact O-CD 3.31Å; C203-R211 WeakPolarHBondContact O-CD 3.4Å; C203-R211 WeakPolarHBondContact O-CG 3.38Å; R205-R211 HydrophobicContact CB-CG 3.83Å; R205-R211 HydrophobicContact CG-CG 4.49Å; R205-R211 PolarHBondContact O-NE 3.43Å; R205-R211 PolarHBondContact O-NH2 3.29Å; P208-R211 PolarHBondContact O-N 3.28Å; R211-T213 PolarHBondContact O-N 3.06Å
212	L	90.4	Very high	89.6	Confident	50 Å²	50	51.9 Å²	51.9	26%	0.262	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-62.9	139	176.4	-68.3	-171	0	0	0	110.1	S202 E210 Q216 L217	S202-L212 PolarHBondContact O-N 3.23Å; E210-L212 PolarHBondContact O-N 2.83Å; L212-Q216 HydrophobicContact CB-CB 4Å; L212-Q216 HydrophobicContact CD1-CB 4.37Å; L212-Q216 HydrophobicContact CD2-CB 4.19Å; L212-Q216 HydrophobicContact CG-CB 4.42Å; L212-L217 HydrophobicContact CB-CD1 4.36Å; L212-L217 HydrophobicContact CB-CD2 3.75Å; L212-L217 HydrophobicContact CB-CG 3.65Å; L212-L217 HydrophobicContact CD1-CD2 4.05Å; L212-L217 HydrophobicContact CG-CD2 4.42Å; L212-L217 WeakPolarHBondContact O-CD1 3.46Å
213	T	84.8	Confident	88.9	Confident	73 Å²	73	51.1 Å²	51.1	45%	0.448	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-62.5	156.5	169.8	61.4	0	0	0	0	110.3	R211 E215 Q216 L217	R211-T213 PolarHBondContact O-N 3.06Å; T213-E215 PolarHBondContact O-N 3.18Å; T213-E215 VanDerWaalsContact O-N 3.14Å; T213-Q216 WeakPolarHBondContact O-CA 3.12Å; T213-Q216 PolarHBondContact O-N 3.34Å; T213-Q216 WeakPolarHBondContact OG1-CB 3.32Å; T213-Q216 VanDerWaalsContact OG1-CD 3.32Å; T213-Q216 VanDerWaalsContact OG1-CG 3.28Å; T213-Q216 WeakPolarHBondContact OG1-CG 3.22Å; T213-Q216 PolarHBondContact OG1-N 3.19Å; T213-Q216 PolarHBondContact OG1-OE1 3.15Å; T213-L217 WeakPolarHBondContact O-CG 3.49Å; T213-L217 PolarHBondContact O-N 3.22Å
214	C	78.1	Confident	88.3	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-53.5	-37.6	175.1	-58.7	0	0	0	0	112.3	T49 L217 L218	T49-C214 HydrophobicContact CG2-CB 3.8Å; C214-L217 PolarHBondContact O-N 2.92Å; C214-L218 WeakPolarHBondContact O-CB 3.41Å; C214-L218 PolarHBondContact O-N 3.41Å
215	E	78.7	Confident	87	Confident	107 Å²	107	59.3 Å²	59.3	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-66.5	-34.6	176.6	168.1	169.4	-167.5	0	0	112.9	T213 L218 R219	T213-E215 PolarHBondContact O-N 3.18Å; T213-E215 VanDerWaalsContact O-N 3.14Å; E215-L218 WeakPolarHBondContact O-CB 3.44Å; E215-R219 PolarHBondContact O-NH1 3.06Å; E215-R219 VanDerWaalsContact O-NH1 3.09Å; E215-R219 IonicContact OE1-CZ 3.31Å; E215-R219 VanDerWaalsContact OE1-CZ 3.31Å; E215-R219 IonicContact OE1-NH1 2.98Å; E215-R219 PolarHBondContact OE1-NH1 3.35Å; E215-R219 IonicContact OE1-NH2 2.71Å; E215-R219 PolarHBondContact OE1-NH2 2.78Å
216	Q	86.1	Confident	85.2	Confident	94 Å²	94	54.9 Å²	54.9	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-75.1	-42.4	173.1	-73.3	163.4	-42.8	0	0	111.6	L212 T213 L218 R219 H220	L212-Q216 HydrophobicContact CB-CB 4Å; L212-Q216 HydrophobicContact CD1-CB 4.37Å; L212-Q216 HydrophobicContact CD2-CB 4.19Å; L212-Q216 HydrophobicContact CG-CB 4.42Å; T213-Q216 WeakPolarHBondContact O-CA 3.12Å; T213-Q216 PolarHBondContact O-N 3.34Å; T213-Q216 WeakPolarHBondContact OG1-CB 3.32Å; T213-Q216 VanDerWaalsContact OG1-CD 3.32Å; T213-Q216 VanDerWaalsContact OG1-CG 3.28Å; T213-Q216 WeakPolarHBondContact OG1-CG 3.22Å; T213-Q216 PolarHBondContact OG1-N 3.19Å; T213-Q216 PolarHBondContact OG1-OE1 3.15Å; Q216-L218 PolarHBondContact O-N 2.79Å; Q216-R219 PolarHBondContact O-N 3.05Å; Q216-H220 PolarHBondContact O-N 3.35Å
217	L	84.8	Confident	83.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-36.9	176.7	-71.3	166.3	0	0	0	111.3	F43 V121 L199 L212 T213 C214 R219 H220 F223	F43-L217 HydrophobicContact CD1-CB 3.53Å; F43-L217 HydrophobicContact CD1-CD1 4.07Å; F43-L217 HydrophobicContact CD1-CG 4.39Å; F43-L217 HydrophobicContact CE1-CB 3.66Å; F43-L217 HydrophobicContact CE1-CD1 3.38Å; F43-L217 HydrophobicContact CE1-CG 4.04Å; F43-L217 HydrophobicContact CG-CB 4.34Å; F43-L217 HydrophobicContact CZ-CB 4.5Å; F43-L217 HydrophobicContact CZ-CD1 4.15Å; V121-L217 HydrophobicContact CG1-CD1 3.86Å; L199-L217 HydrophobicContact CD1-CB 4.44Å; L199-L217 HydrophobicContact CD1-CD2 3.66Å; L212-L217 HydrophobicContact CB-CD1 4.36Å; L212-L217 HydrophobicContact CB-CD2 3.75Å; L212-L217 HydrophobicContact CB-CG 3.65Å; L212-L217 HydrophobicContact CD1-CD2 4.05Å; L212-L217 HydrophobicContact CG-CD2 4.42Å; L212-L217 WeakPolarHBondContact O-CD1 3.46Å; T213-L217 WeakPolarHBondContact O-CG 3.49Å; T213-L217 PolarHBondContact O-N 3.22Å; C214-L217 PolarHBondContact O-N 2.92Å; L217-R219 PolarHBondContact O-N 3.47Å; L217-H220 WeakPolarHBondContact O-CB 3.29Å; L217-H220 PolarHBondContact O-N 3.38Å; L217-F223 VanDerWaalsContact O-CD2 3.23Å; L217-F223 WeakPolarHBondContact O-CD2 3.47Å; L217-F223 WeakPolarHBondContact O-CE2 3.31Å
218	L	79.3	Confident	81.8	Confident	45 Å²	45	58.1 Å²	58.1	24%	0.236	31%	0.314	C	S	.	.	H	α-helix	trans	-54.3	-36.7	171.8	-102.5	175	0	0	0	115.4	F43 K44 C214 E215 Q216 H220 R227	F43-L218 HydrophobicContact CB-CD2 4.12Å; F43-L218 HydrophobicContact CB-CG 4.09Å; F43-L218 WeakPolarHBondContact O-CD1 3.32Å; F43-L218 WeakPolarHBondContact O-CD2 3.44Å; F43-L218 WeakPolarHBondContact O-CG 3.45Å; K44-L218 HydrophobicContact CB-CD2 3.89Å; K44-L218 HydrophobicContact CG-CD2 4.19Å; C214-L218 WeakPolarHBondContact O-CB 3.41Å; C214-L218 PolarHBondContact O-N 3.41Å; E215-L218 WeakPolarHBondContact O-CB 3.44Å; Q216-L218 PolarHBondContact O-N 2.79Å; L218-H220 VanDerWaalsContact C-N 3.28Å; L218-R227 PolarHBondContact O-NH1 2.76Å
219	R	83.6	Confident	79.7	Confident	153 Å²	153	63.6 Å²	63.6	58%	0.577	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.2	-179.7	-62.7	-174.1	-179	95.7	-4.8	112.1	E215 Q216 L217 R227	E215-R219 PolarHBondContact O-NH1 3.06Å; E215-R219 VanDerWaalsContact O-NH1 3.09Å; E215-R219 IonicContact OE1-CZ 3.31Å; E215-R219 VanDerWaalsContact OE1-CZ 3.31Å; E215-R219 IonicContact OE1-NH1 2.98Å; E215-R219 PolarHBondContact OE1-NH1 3.35Å; E215-R219 IonicContact OE1-NH2 2.71Å; E215-R219 PolarHBondContact OE1-NH2 2.78Å; Q216-R219 PolarHBondContact O-N 3.05Å; L217-R219 PolarHBondContact O-N 3.47Å; R219-R227 PolarHBondContact O-NH2 2.85Å
220	H	86.8	Confident	77.5	Confident	16 Å²	16	61.6 Å²	61.6	7%	0.074	32%	0.32	C	S	.	.	S	Bend	trans	-60.4	144	-179.1	-169.2	-93.1	0	0	0	111.2	Q195 S198 L199 Q216 L217 L218 Y222 F223 R227	Q195-H220 PolarHBondContact O-CE1 3.47Å; S198-H220 PolarHBondContact OG-NE2 3.27Å; L199-H220 HydrophobicContact CD1-CB 3.82Å; L199-H220 PolarHBondContact N-CE1 2.98Å; L199-H220 VanDerWaalsContact N-CE1 3.34Å; Q216-H220 PolarHBondContact O-N 3.35Å; L217-H220 WeakPolarHBondContact O-CB 3.29Å; L217-H220 PolarHBondContact O-N 3.38Å; L218-H220 VanDerWaalsContact C-N 3.28Å; H220-Y222 VanDerWaalsContact ND1-CB 3.29Å; H220-Y222 WeakPolarHBondContact ND1-CB 3.25Å; H220-Y222 PolarHBondContact ND1-N 2.95Å; H220-Y222 PolarHBondContact O-N 3.43Å; H220-Y222 VanDerWaalsContact O-N 3.1Å; H220-F223 HydrophobicContact CB-CD2 4.24Å; H220-F223 PolarHBondContact O-N 2.96Å; H220-R227 PolarHBondContact O-NH2 2.79Å
221	P	89	Confident	75.1	Confident	71 Å²	71	63.1 Å²	63.1	46%	0.461	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-59.1	-23	-178.1	-28.3	36	0	0	0	115.1	F223 D224	P221-F223 PolarHBondContact O-N 3.36Å; P221-F223 VanDerWaalsContact O-N 3.09Å; P221-D224 VanDerWaalsContact CA-OD2 3.32Å; P221-D224 WeakPolarHBondContact CA-OD2 3.46Å; P221-D224 WeakPolarHBondContact O-CB 3.49Å; P221-D224 PolarHBondContact O-N 3.01Å
222	Y	84.1	Confident	72.5	Confident	37 Å²	37	66 Å²	66	15%	0.145	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-50.1	-34.3	171.5	179.3	-95	0	0	0	112.5	L39 F128 Q195 T196 L199 H220 C225	L39-Y222 HydrophobicContact CD1-CE1 3.75Å; L39-Y222 VanDerWaalsContact CD1-OH 3.26Å; L39-Y222 WeakPolarHBondContact CD1-OH 3.48Å; F128-Y222 HydrophobicContact CZ-CE2 4.31Å; Q195-Y222 HydrophobicContact CB-CD2 4.49Å; T196-Y222 HydrophobicContact CG2-CE2 4.05Å; T196-Y222 VanDerWaalsContact OG1-CE2 3.3Å; T196-Y222 WeakPolarHBondContact OG1-CE2 3.39Å; L199-Y222 HydrophobicContact CB-CG 4.33Å; L199-Y222 HydrophobicContact CD2-CD1 3.45Å; L199-Y222 VanDerWaalsContact CD2-CD1 3.45Å; L199-Y222 HydrophobicContact CD2-CD2 4.39Å; L199-Y222 HydrophobicContact CD2-CE1 3.92Å; L199-Y222 HydrophobicContact CD2-CG 3.71Å; H220-Y222 VanDerWaalsContact ND1-CB 3.29Å; H220-Y222 WeakPolarHBondContact ND1-CB 3.25Å; H220-Y222 PolarHBondContact ND1-N 2.95Å; H220-Y222 PolarHBondContact O-N 3.43Å; H220-Y222 VanDerWaalsContact O-N 3.1Å; Y222-C225 PolarHBondContact O-SG 3.48Å
223	F	81.2	Confident	70.1	Confident	5 Å²	5	68.2 Å²	68.2	2%	0.022	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-87.2	-2.7	-178.7	-63.5	-71	0	0	0	114.5	L39 F43 L199 L217 H220 P221 C225 M226 R227	L39-F223 HydrophobicContact CB-CE1 4.16Å; L39-F223 HydrophobicContact CB-CZ 4.39Å; F43-F223 HydrophobicContact CB-CE2 4.2Å; F43-F223 HydrophobicContact CB-CZ 3.93Å; F43-F223 HydrophobicContact CD2-CE1 4.28Å; F43-F223 HydrophobicContact CD2-CE2 4.02Å; F43-F223 AromaticContact CD2-CZ 3.37Å; F43-F223 HydrophobicContact CD2-CZ 3.37Å; F43-F223 HydrophobicContact CE2-CZ 4.15Å; F43-F223 HydrophobicContact CG-CE2 4.19Å; F43-F223 AromaticContact CG-CZ 3.88Å; F43-F223 HydrophobicContact CG-CZ 3.88Å; L199-F223 HydrophobicContact CD1-CE2 3.9Å; L199-F223 HydrophobicContact CD2-CE2 3.9Å; L199-F223 HydrophobicContact CD2-CZ 3.82Å; L217-F223 VanDerWaalsContact O-CD2 3.23Å; L217-F223 WeakPolarHBondContact O-CD2 3.47Å; L217-F223 WeakPolarHBondContact O-CE2 3.31Å; H220-F223 HydrophobicContact CB-CD2 4.24Å; H220-F223 PolarHBondContact O-N 2.96Å; P221-F223 PolarHBondContact O-N 3.36Å; P221-F223 VanDerWaalsContact O-N 3.09Å; F223-C225 PolarHBondContact O-N 2.96Å; F223-M226 HydrophobicContact CD1-CE 3.38Å; F223-M226 HydrophobicContact CE1-CE 3.67Å; F223-M226 PolarHBondContact O-N 3.11Å; F223-M226 VanDerWaalsContact O-N 3.09Å; F223-R227 PolarHBondContact O-N 2.87Å; F223-R227 VanDerWaalsContact O-N 3.13Å
224	D	81.7	Confident	67.9	Low	88 Å²	88	69.6 Å²	69.6	47%	0.471	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-40.8	-178	-77.3	-33.3	0	0	0	112.6	P221 M226 R227	P221-D224 VanDerWaalsContact CA-OD2 3.32Å; P221-D224 WeakPolarHBondContact CA-OD2 3.46Å; P221-D224 WeakPolarHBondContact O-CB 3.49Å; P221-D224 PolarHBondContact O-N 3.01Å; D224-M226 PolarHBondContact O-N 2.68Å; D224-M226 VanDerWaalsContact O-N 3.14Å; D224-R227 VanDerWaalsContact CG-NH2 3.33Å; D224-R227 PolarHBondContact O-N 3.2Å; D224-R227 VanDerWaalsContact O-N 3.11Å; D224-R227 IonicContact OD1-CZ 3.1Å; D224-R227 IonicContact OD1-NE 2.78Å; D224-R227 PolarHBondContact OD1-NE 2.96Å; D224-R227 IonicContact OD1-NH2 2.63Å; D224-R227 PolarHBondContact OD1-NH2 2.88Å; D224-R227 IonicContact OD2-NH2 3.89Å
225	C	68.7	Low	65.9	Low	88 Å²	88	78.2 Å²	78.2	60%	0.595	41%	0.405	S	S	*	.	H	α-helix	trans	-60	-26	175.8	64.1	0	0	0	0	112.6	Y222 F223	Y222-C225 PolarHBondContact O-SG 3.48Å; F223-C225 PolarHBondContact O-N 2.96Å
226	M	61.9	Low	64	Low	18 Å²	18	81.1 Å²	81.1	9%	0.089	42%	0.418	C	S	.	.	H	α-helix	trans	-90.7	-19.3	179.6	-62.4	-147.5	-79	0	0	113.6	E36 C40 F223 D224	E36-M226 HydrophobicContact CB-SD 3.98Å; E36-M226 HydrophobicContact CG-SD 3.87Å; C40-M226 WeakPolarHBondContact SG-CE 3.38Å; F223-M226 HydrophobicContact CD1-CE 3.38Å; F223-M226 HydrophobicContact CE1-CE 3.67Å; F223-M226 PolarHBondContact O-N 3.11Å; F223-M226 VanDerWaalsContact O-N 3.09Å; D224-M226 PolarHBondContact O-N 2.68Å; D224-M226 VanDerWaalsContact O-N 3.14Å
227	R	66.1	Low	61.9	Low	81 Å²	81	85.1 Å²	85.1	31%	0.306	44%	0.437	S	S	.	.	H	α-helix	trans	-70.4	-36.6	175.8	-74.6	-177	-97.6	-88.4	4.8	111.7	L218 R219 H220 F223 D224 K229 S230	L218-R227 PolarHBondContact O-NH1 2.76Å; R219-R227 PolarHBondContact O-NH2 2.85Å; H220-R227 PolarHBondContact O-NH2 2.79Å; F223-R227 PolarHBondContact O-N 2.87Å; F223-R227 VanDerWaalsContact O-N 3.13Å; D224-R227 VanDerWaalsContact CG-NH2 3.33Å; D224-R227 PolarHBondContact O-N 3.2Å; D224-R227 VanDerWaalsContact O-N 3.11Å; D224-R227 IonicContact OD1-CZ 3.1Å; D224-R227 IonicContact OD1-NE 2.78Å; D224-R227 PolarHBondContact OD1-NE 2.96Å; D224-R227 IonicContact OD1-NH2 2.63Å; D224-R227 PolarHBondContact OD1-NH2 2.88Å; D224-R227 IonicContact OD2-NH2 3.89Å; R227-K229 PolarHBondContact O-N 3.22Å; R227-S230 PolarHBondContact O-N 2.87Å; R227-S230 PolarHBondContact O-OG 2.49Å
228	G	54.1	Low	59.8	Low	52 Å²	52	94.1 Å²	94.1	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-66.5	-28.3	-179.7	0	0	0	0	0	115.3
229	K	50.9	Low	58.1	Low	143 Å²	143	102.6 Å²	102.6	62%	0.622	51%	0.505	S	S	*	.	H	α-helix	trans	-77.8	-21.3	-179	-67.5	179.5	-176.5	170.4	0	113.8	R227 S232	R227-K229 PolarHBondContact O-N 3.22Å; K229-S232 PolarHBondContact O-OG 2.85Å
230	S	47.1	Very low	56	Low	57 Å²	57	101.7 Å²	101.7	40%	0.399	52%	0.517	S	S	.	.	H	α-helix	trans	-86.9	-16.3	-179.6	48.7	0	0	0	0	114.7	R227 T234	R227-S230 PolarHBondContact O-N 2.87Å; R227-S230 PolarHBondContact O-OG 2.49Å; S230-T234 PolarHBondContact O-OG1 2.95Å
231	E	45.2	Very low	53.5	Low	126 Å²	126	112.8 Å²	112.8	59%	0.589	56%	0.558	S	S	*	*	H	α-helix	trans	-88.5	-19.4	-179.5	-69.4	-167.9	161.6	0	0	113.9
232	S	39.3	Very low	51.2	Low	74 Å²	74	116.9 Å²	116.9	52%	0.517	58%	0.575	S	S	.	*	H	α-helix	trans	-76.1	-32.3	179.4	54.8	0	0	0	0	113.1	K229	K229-S232 PolarHBondContact O-OG 2.85Å
233	T	39.9	Very low	48.8	Very low	95 Å²	95	120.9 Å²	120.9	58%	0.583	61%	0.606	S	S	*	*	H	α-helix	trans	-78	-21.3	-178.5	34.8	0	0	0	0	114
234	T	39.7	Very low	46.6	Very low	102 Å²	102	132.3 Å²	132.3	63%	0.626	65%	0.648	S	S	*	*	H	α-helix	trans	-85.3	-16	-179.8	-19.2	0	0	0	0	113.4	S230	S230-T234 PolarHBondContact O-OG1 2.95Å
235	R	37	Very low	44.4	Very low	191 Å²	191	139.5 Å²	139.5	72%	0.721	67%	0.669	S	S	*	*	H	α-helix	trans	-91.4	-25.1	-175.9	-72.3	-175.2	177.9	-177.3	3.1	114.4
236	E	37.4	Very low	42.8	Very low	167 Å²	167	144.5 Å²	144.5	78%	0.78	68%	0.683	S	S	*	*	H	α-helix	trans	-76.7	-26.4	-179.9	-86.1	-175.3	147.7	0	0	114.3	K238	E236-K238 PolarHBondContact O-N 3.21Å
237	H	42.2	Very low	41.5	Very low	179 Å²	179	151.2 Å²	151.2	83%	0.829	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	4.5	-179.5	-78.1	89.1	0	0	0	115.2
238	K	39.9	Very low	40.1	Very low	189 Å²	189	152.9 Å²	152.9	82%	0.822	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	4.8	-179.8	-92	-174.5	178.9	179	0	116	E236	E236-K238 PolarHBondContact O-N 3.21Å
239	R	43.8	Very low	39.2	Very low	223 Å²	223	156.8 Å²	156.8	84%	0.842	76%	0.756	S	S	*	*	S	Bend	trans	-129	76.7	178.5	-85.1	-178.1	154.2	173.5	-6.3	113
240	T	39.5	Very low	38.3	Very low	134 Å²	134	153 Å²	153	82%	0.822	76%	0.757	S	S	*	*			trans	-172.9	79	140.3	17.5	0	0	0	0	109.1
241	R	35.8	Very low	37.5	Very low	248 Å²	248	161.5 Å²	161.5	94%	0.936	78%	0.782	S	S	*	*			trans	-113.2	100.2	153.6	-76.5	-169.2	175.7	-169.9	-0.3	107
242	L	39.1	Very low	37	Very low	158 Å²	158	163.6 Å²	163.6	83%	0.827	80%	0.796	S	S	*	*			trans	-58.1	141.2	168.4	-76	149.8	0	0	0	109.3	R244	L242-R244 PolarHBondContact O-N 2.86Å
243	P	34.2	Very low	36.7	Very low	121 Å²	121	165.9 Å²	165.9	79%	0.786	81%	0.809	S	S	*	*			trans	-69.2	127	179.2	27.1	-31.7	0	0	0	110.5	R245	P243-R245 PolarHBondContact O-N 2.77Å
244	R	35.4	Very low	36.2	Very low	244 Å²	244	170.8 Å²	170.8	92%	0.921	83%	0.826	S	S	*	*			trans	-72.1	113.9	-179.5	-145.7	176.3	-171.1	177.2	1.4	108.8	L242	L242-R244 PolarHBondContact O-N 2.86Å
245	R	35.9	Very low	35.8	Very low	240 Å²	240	174 Å²	174	91%	0.906	84%	0.838	S	S	*	*			trans	-61.9	131.5	170.6	-85.1	177.7	164.1	166.4	-5.4	109.8	P243	P243-R245 PolarHBondContact O-N 2.77Å
246	H	34	Very low	35.4	Very low	193 Å²	193	171.7 Å²	171.7	89%	0.894	85%	0.845	S	S	*	*			trans	-66	131.6	170.6	-82.5	-79.3	0	0	0	110.5
247	L	36	Very low	35	Very low	159 Å²	159	168.8 Å²	168.8	83%	0.832	84%	0.844	S	S	*	*			trans	-111.5	142	162.3	-119.2	85.8	0	0	0	108.9
248	P	34.9	Very low	34.4	Very low	116 Å²	116	165.3 Å²	165.3	75%	0.753	84%	0.84	S	S	*	*			trans	-80.7	164.1	-177.8	33.2	-32.6	0	0	0	112.6
249	P	36.2	Very low	33.8	Very low	134 Å²	134	161.1 Å²	161.1	87%	0.87	83%	0.834	S	S	*	*			trans	-89.9	137.3	-170.4	34	-30	0	0	0	112.3
250	G	31.2	Very low	33.2	Very low	62 Å²	62	157.1 Å²	157.1	64%	0.639	83%	0.828	S	S	*	*			trans	154.3	130.3	161.8	0	0	0	0	0	115.2
251	Y	30.4	Very low	32.7	Very low	236 Å²	236	160 Å²	160	93%	0.925	83%	0.83	S	S	*	*			trans	87.8	102	162.6	-58.4	-81.2	0	0	0	118.6
252	L	34.2	Very low	32.4	Very low	170 Å²	170	153.9 Å²	153.9	89%	0.89	82%	0.821	S	S	*	*			trans	-64.4	145.9	153.5	-81.1	158.4	0	0	0	110.4
253	P	33	Very low	31.9	Very low	122 Å²	122	150.4 Å²	150.4	79%	0.792	82%	0.816	S	S	*	*			trans	-119.8	154.9	139.1	5.1	15.7	0	0	0	113.1
254	Q	31.1	Very low	31.8	Very low	198 Å²	198	152.6 Å²	152.6	93%	0.925	82%	0.82	S	S	*	*			trans	-71.1	163.2	-169.1	-67.2	173.1	-29.3	0	0	115.4
255	L	31.1	Very low	31.6	Very low	169 Å²	169	148.5 Å²	148.5	89%	0.885	82%	0.816	S	S	*	*			trans	-58.6	149.4	177.9	-65.4	157.8	0	0	0	114.4
256	T	28.2	Very low	31.3	Very low	143 Å²	143	143.9 Å²	143.9	88%	0.877	81%	0.809	S	S	*	*			trans	-133.7	144.3	142.8	54.5	0	0	0	0	111
257	S	29	Very low	31.1	Very low	106 Å²	106	143.7 Å²	143.7	74%	0.741	81%	0.806	S	S	*	*			trans	-63	144.5	-165.8	54.1	0	0	0	0	115.8
258	S	28.5	Very low	30.7	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	81%	0.806	S	S	*	*				129	135.6	105.9	56.1	0	0	0	0	105.9
259	S	29	Very low	30.3	Very low	100 Å²	100	150.1 Å²	150.1	70%	0.699	81%	0.811	S	S	*	*			cis	-163.9	133	42.2	-50.3	0	0	0	0	110.1
260	I	30.3	Very low	29.9	Very low	139 Å²	139	154.6 Å²	154.6	71%	0.713	81%	0.812	S	S	*	*			trans	42	113.7	130.7	-53.1	169.4	0	0	0	118.4
261	F	29	Very low	29.8	Very low	196 Å²	196	157.5 Å²	157.5	86%	0.86	81%	0.813	S	S	*	*				-174.2	156.2	113.1	-90.3	-60.2	0	0	0	110.1
262	P	30.7	Very low	29.7	Very low	118 Å²	118	153.9 Å²	153.9	77%	0.766	81%	0.81	S	S	*	*			trans	-101.2	155.6	-134.8	9	13.4	0	0	0	114.3
263	A	28.6	Very low	29.7	Very low	85 Å²	85	153.9 Å²	153.9	70%	0.702	81%	0.81	S	S	*	*			trans	-69.7	156.6	164.3	0	0	0	0	0	112.4
264	L	30.5	Very low	29.6	Very low	167 Å²	167	158.9 Å²	158.9	87%	0.874	81%	0.813	S	S	*	*				178.5	99.1	116.1	-91.8	151.9	0	0	0	107.7
265	D	31	Very low	29.8	Very low	158 Å²	158	158 Å²	158	85%	0.845	81%	0.806	S	S	*	*				78.6	128.4	79.5	-135.5	0.4	0	0	0	114.2
266	N	31.3	Very low	29.7	Very low	143 Å²	143	158.6 Å²	158.6	77%	0.765	80%	0.802	S	S	*	*			trans	-118.9	120.8	-166.9	-160.1	-1.3	0	0	0	106.6
267	K	29.5	Very low	29.7	Very low	190 Å²	190	159 Å²	159	83%	0.826	80%	0.799	S	S	*	*			trans	146	114.4	153.1	-85.6	165.8	-179.7	171.1	0	111.7
268	K	27.5	Very low	30	Very low	192 Å²	192	163.2 Å²	163.2	84%	0.835	80%	0.799	S	S	*	*				154.1	101.9	116.7	-85.2	175.4	-173.8	177.4	0	108
269	Y	25.9	Very low	30.1	Very low	218 Å²	218	166.8 Å²	166.8	86%	0.855	80%	0.804	S	S	*	*			trans	-150.4	80.9	136.1	-110.2	-80.9	0	0	0	107.8	N271	Y269-N271 HydrophobicContact CD1-CB 4.4Å; Y269-N271 PolarHBondContact O-N 2.7Å
270	Y	29	Very low	30.3	Very low	227 Å²	227	169.6 Å²	169.6	89%	0.89	81%	0.811	S	S	*	*			trans	-65.8	106.9	145.5	-101	-92.8	0	0	0	105.5
271	N	28.5	Very low	30.3	Very low	124 Å²	124	168.7 Å²	168.7	66%	0.663	81%	0.814	S	S	*	*			trans	-172.1	107.9	148.5	-92.1	-21.5	0	0	0	107.9	Y269	Y269-N271 HydrophobicContact CD1-CB 4.4Å; Y269-N271 PolarHBondContact O-N 2.7Å
272	N	27.6	Very low	30.4	Very low	159 Å²	159	166.8 Å²	166.8	85%	0.85	81%	0.813	S	S	*	*			trans	149.3	71.6	141.4	-73.5	-33.5	0	0	0	110.7	R274	N272-R274 PolarHBondContact O-N 3.34Å
273	L	33.6	Very low	30.6	Very low	170 Å²	170	172.9 Å²	172.9	89%	0.89	84%	0.836	S	S	*	*			trans	-64.1	111.6	141.5	-116	90.1	0	0	0	106.8
274	R	31.3	Very low	30.7	Very low	227 Å²	227	177.3 Å²	177.3	86%	0.857	84%	0.843	S	S	*	*			trans	-174.9	128.3	140.2	-104.6	166.2	-174.6	-162.4	1.8	111.9	N272	N272-R274 PolarHBondContact O-N 3.34Å
275	K	35.3	Very low	30.8	Very low	179 Å²	179	177.8 Å²	177.8	78%	0.778	84%	0.841	S	S	*	*			trans	69.9	106.4	156	-63.6	179.2	175.7	-177.5	0	116.8
276	F	30	Very low	30.7	Very low	182 Å²	182	178.9 Å²	178.9	80%	0.798	84%	0.841	S	S	*	*				-146.3	107.2	123.3	-89.6	-73.9	0	0	0	108.9	Y278	F276-Y278 HydrophobicContact CB-CD2 4.33Å; F276-Y278 HydrophobicContact CB-CE2 3.85Å; F276-Y278 HydrophobicContact CD1-CE2 4.45Å; F276-Y278 HydrophobicContact CG-CE2 4.38Å
277	N	28.7	Very low	30.7	Very low	152 Å²	152	181.1 Å²	181.1	81%	0.813	85%	0.845	S	S	*	*			trans	-69.8	125.4	164.9	-82.1	-20.3	0	0	0	107.8
278	Y	33.9	Very low	30.8	Very low	194 Å²	194	180.5 Å²	180.5	76%	0.761	85%	0.847	S	S	*	*			trans	-118.9	109	159.1	-74.1	-76.4	0	0	0	108.4	F276	F276-Y278 HydrophobicContact CB-CD2 4.33Å; F276-Y278 HydrophobicContact CB-CE2 3.85Å; F276-Y278 HydrophobicContact CD1-CE2 4.45Å; F276-Y278 HydrophobicContact CG-CE2 4.38Å
279	H	30.8	Very low	31	Very low	182 Å²	182	179.7 Å²	179.7	84%	0.843	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-61.6	127.9	163.9	-90.6	-82.2	0	0	0	109.1
280	L	34.3	Very low	31.4	Very low	160 Å²	160	177 Å²	177	84%	0.838	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-78.8	129.4	162	-80	144.4	0	0	0	108.4
281	P	29.7	Very low	31.5	Very low	120 Å²	120	173.2 Å²	173.2	78%	0.779	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-75.9	132.6	166.1	30.1	-29.9	0	0	0	109.6
282	N	30.6	Very low	31.8	Very low	156 Å²	156	177.3 Å²	177.3	83%	0.834	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-69.9	130.4	166.2	-70.9	-26.1	0	0	0	109.1
283	I	35.9	Very low	32.2	Very low	246 Å²	246	178.9 Å²	178.9	100%	1.262	86%	0.859	S	S	*	*			trans	-151.6	0	134.8	-81.4	137	0	0	0	105.8

Retrieved 283 of 283 residues in 160.7 ms (Link to these results)

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