A0A077ZNA8_TRITR Loading...

Integrase zinc-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZNA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 300 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	H	63.4	Low	75.6	Confident	136 Å²	136	90.1 Å²	90.1	63%	0.63	45%	0.447	S	S	*	.				0	-25.8	0	-57.2	-71.2	0	0	0	115.8	G3 Q4 L41 Q44	H1-G3 PolarHBondContact O-N 3.18Å; H1-G3 VanDerWaalsContact O-N 3.07Å; H1-Q4 PolarHBondContact O-N 3.07Å; H1-L41 HydrophobicContact CB-CD1 3.79Å; H1-Q44 PolarHBondContact CE1-OE1 2.58Å; H1-Q44 PolarHBondContact ND1-OE1 2.63Å
2	R	62.9	Low	76.4	Confident	169 Å²	169	85.3 Å²	85.3	64%	0.638	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-31.3	-178.7	-80.7	-173.9	174.9	166.5	1.2	115.6	W9	R2-W9 HydrophobicContact CG-CD2 3.89Å; R2-W9 HydrophobicContact CG-CE3 4.16Å; R2-W9 HydrophobicContact CG-CG 4.16Å
3	G	70	Confident	76.9	Confident	77 Å²	77	94.5 Å²	94.5	79%	0.794	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-22.7	-178.7	0	0	0	0	0	116.2	H1	H1-G3 PolarHBondContact O-N 3.18Å; H1-G3 VanDerWaalsContact O-N 3.07Å
4	Q	72.8	Confident	77.5	Confident	126 Å²	126	96.4 Å²	96.4	59%	0.589	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-24.2	-175.6	-79.7	-179.2	-2.6	0	0	113.6	H1	H1-Q4 PolarHBondContact O-N 3.07Å
5	F	73.6	Confident	78	Confident	43 Å²	43	92.9 Å²	92.9	19%	0.189	45%	0.451	C	S	.	.			trans	-139.1	70	-174.7	-61.3	-81.8	0	0	0	111.1	D7 V8 W9 A37 T40 L41	F5-D7 PolarHBondContact O-N 3.43Å; F5-D7 VanDerWaalsContact O-N 3.17Å; F5-V8 HydrophobicContact CB-CB 4.19Å; F5-V8 PolarHBondContact O-N 2.87Å; F5-W9 VanDerWaalsContact O-CD1 3.29Å; F5-W9 PolarHBondContact O-N 3.44Å; F5-A37 HydrophobicContact CD1-CB 3.91Å; F5-A37 HydrophobicContact CE1-CB 4.06Å; F5-T40 HydrophobicContact CZ-CG2 3.88Å; F5-L41 HydrophobicContact CD2-CB 4.17Å; F5-L41 HydrophobicContact CD2-CD1 3.85Å; F5-L41 HydrophobicContact CE2-CB 4.44Å
6	P	73.8	Confident	78.5	Confident	71 Å²	71	91.2 Å²	91.2	46%	0.461	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.5	-169.6	22	-32.5	0	0	0	114	W9	P6-W9 PolarHBondContact O-NE1 3.02Å; P6-W9 VanDerWaalsContact O-NE1 3.15Å
7	D	80.5	Confident	78.2	Confident	111 Å²	111	96.2 Å²	96.2	59%	0.594	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-30.8	-176.9	-56.9	-38	0	0	0	112.8	F5	F5-D7 PolarHBondContact O-N 3.43Å; F5-D7 VanDerWaalsContact O-N 3.17Å
8	V	82	Confident	78.2	Confident	10 Å²	10	97.8 Å²	97.8	6%	0.061	47%	0.473	C	S	.	.	H	α-helix	trans	-87.8	-32.7	-170.5	-175.5	0	0	0	0	111.7	F5 R10 K11 V12 A37 L38 L41	F5-V8 HydrophobicContact CB-CB 4.19Å; F5-V8 PolarHBondContact O-N 2.87Å; V8-R10 VanDerWaalsContact C-N 3.28Å; V8-R10 PolarHBondContact O-N 3.4Å; V8-K11 WeakPolarHBondContact O-CB 3.42Å; V8-K11 PolarHBondContact O-N 3.14Å; V8-K11 VanDerWaalsContact O-N 3.13Å; V8-V12 HydrophobicContact CG1-CG2 4.49Å; V8-V12 WeakPolarHBondContact O-CG2 3.43Å; V8-V12 PolarHBondContact O-N 2.96Å; V8-A37 HydrophobicContact CG2-CB 3.72Å; V8-L38 HydrophobicContact CG1-CB 3.96Å; V8-L38 HydrophobicContact CG1-CD1 3.58Å; V8-L38 HydrophobicContact CG1-CG 4.34Å; V8-L41 HydrophobicContact CB-CD2 4.42Å; V8-L41 HydrophobicContact CG1-CD2 4.06Å
9	W	82.7	Confident	78.4	Confident	65 Å²	65	98.9 Å²	98.9	25%	0.246	48%	0.481	C	S	.	.	H	α-helix	trans	-64.2	-32.9	-178.5	82.4	-93.6	0	0	0	112.7	R2 F5 P6 W13 L41	R2-W9 HydrophobicContact CG-CD2 3.89Å; R2-W9 HydrophobicContact CG-CE3 4.16Å; R2-W9 HydrophobicContact CG-CG 4.16Å; F5-W9 VanDerWaalsContact O-CD1 3.29Å; F5-W9 PolarHBondContact O-N 3.44Å; P6-W9 PolarHBondContact O-NE1 3.02Å; P6-W9 VanDerWaalsContact O-NE1 3.15Å; W9-W13 PolarHBondContact O-N 3.18Å; W9-L41 HydrophobicContact CB-CD2 4.33Å
10	R	84	Confident	78.6	Confident	135 Å²	135	98.2 Å²	98.2	51%	0.509	48%	0.48	S	S	.	.	H	α-helix	trans	-66.6	-45	173.2	-71.9	-165.6	-156.4	96.6	-0.1	110.8	V8 V12 W13 D14	V8-R10 VanDerWaalsContact C-N 3.28Å; V8-R10 PolarHBondContact O-N 3.4Å; R10-V12 VanDerWaalsContact C-N 3.29Å; R10-V12 PolarHBondContact O-N 3.34Å; R10-W13 WeakPolarHBondContact O-CB 3.31Å; R10-W13 PolarHBondContact O-N 3.45Å; R10-D14 PolarHBondContact O-N 2.87Å; R10-D14 VanDerWaalsContact O-N 3.09Å
11	K	86	Confident	78.9	Confident	48 Å²	48	95.4 Å²	95.4	21%	0.209	46%	0.464	C	S	.	.	H	α-helix	trans	-59	-40.5	177.1	-64.1	-178.1	175	-170.6	0	111.6	V8 W13 D14 N15 Y21 Y25	V8-K11 WeakPolarHBondContact O-CB 3.42Å; V8-K11 PolarHBondContact O-N 3.14Å; V8-K11 VanDerWaalsContact O-N 3.13Å; K11-W13 PolarHBondContact O-N 3.44Å; K11-D14 PolarHBondContact O-N 3.27Å; K11-N15 WeakPolarHBondContact O-CB 3.26Å; K11-N15 PolarHBondContact O-N 3.17Å; K11-Y21 WeakPolarHBondContact CB-OH 3.35Å; K11-Y25 PolarHBondContact NZ-OH 3.27Å
12	V	85.5	Confident	80	Confident	33 Å²	33	95.1 Å²	95.1	20%	0.2	47%	0.467	C	S	.	.	H	α-helix	trans	-57.1	-38.9	173.7	172.7	0	0	0	0	111.9	V8 R10 F16 L38 L41 L42	V8-V12 HydrophobicContact CG1-CG2 4.49Å; V8-V12 WeakPolarHBondContact O-CG2 3.43Å; V8-V12 PolarHBondContact O-N 2.96Å; R10-V12 VanDerWaalsContact C-N 3.29Å; R10-V12 PolarHBondContact O-N 3.34Å; V12-F16 HydrophobicContact CB-CD2 4.43Å; V12-F16 HydrophobicContact CG1-CD2 3.83Å; V12-F16 HydrophobicContact CG1-CE2 3.86Å; V12-F16 VanDerWaalsContact O-CD2 3.24Å; V12-F16 WeakPolarHBondContact O-CD2 3.46Å; V12-L38 HydrophobicContact CG2-CD1 3.4Å; V12-L38 HydrophobicContact CG2-CG 4.4Å; V12-L41 HydrophobicContact CG2-CD2 3.83Å; V12-L42 HydrophobicContact CG1-CD2 4.27Å
13	W	83.1	Confident	81.2	Confident	205 Å²	205	89.7 Å²	89.7	78%	0.777	45%	0.45	S	S	*	.	H	α-helix	trans	-71.7	-38.7	-179.8	-165.6	-88.1	0	0	0	112.7	W9 R10 K11	W9-W13 PolarHBondContact O-N 3.18Å; R10-W13 WeakPolarHBondContact O-CB 3.31Å; R10-W13 PolarHBondContact O-N 3.45Å; K11-W13 PolarHBondContact O-N 3.44Å
14	D	84.4	Confident	82.1	Confident	120 Å²	120	91 Å²	91	64%	0.642	45%	0.448	S	S	*	.	H	α-helix	trans	-89.7	-27.9	-171.4	-63.2	-25.6	0	0	0	113.5	R10 K11	R10-D14 PolarHBondContact O-N 2.87Å; R10-D14 VanDerWaalsContact O-N 3.09Å; K11-D14 PolarHBondContact O-N 3.27Å
15	N	85.8	Confident	82.7	Confident	44 Å²	44	87.7 Å²	87.7	24%	0.235	43%	0.43	C	S	.	.	H	α-helix	trans	-106.8	-1.9	-168.6	-69.4	-21.1	0	0	0	114.6	K11 Y21 L22 D23	K11-N15 WeakPolarHBondContact O-CB 3.26Å; K11-N15 PolarHBondContact O-N 3.17Å; N15-Y21 HydrophobicContact CB-CD2 4.08Å; N15-Y21 HydrophobicContact CB-CE2 3.66Å; N15-L22 WeakPolarHBondContact CB-O 3.5Å; N15-L22 PolarHBondContact O-N 3.3Å; N15-D23 PolarHBondContact ND2-OD1 2.97Å; N15-D23 VanDerWaalsContact ND2-OD1 3.12Å; N15-D23 PolarHBondContact ND2-OD2 3.28Å
16	F	84.9	Confident	83.3	Confident	66 Å²	66	92.5 Å²	92.5	29%	0.289	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.7	171.5	-99.1	-87.6	0	0	0	111.1	V12 N20 Y21 L42 L49	V12-F16 HydrophobicContact CB-CD2 4.43Å; V12-F16 HydrophobicContact CG1-CD2 3.83Å; V12-F16 HydrophobicContact CG1-CE2 3.86Å; V12-F16 VanDerWaalsContact O-CD2 3.24Å; V12-F16 WeakPolarHBondContact O-CD2 3.46Å; F16-N20 CarbonylContact C-O 3.4Å; F16-N20 WeakPolarHBondContact CA-O 3.42Å; F16-Y21 AromaticContact CD2-CD2 3.55Å; F16-Y21 HydrophobicContact CD2-CD2 3.55Å; F16-Y21 HydrophobicContact CD2-CE2 4.4Å; F16-Y21 HydrophobicContact CD2-CG 4.41Å; F16-Y21 AromaticContact CE2-CD2 3.52Å; F16-Y21 HydrophobicContact CE2-CD2 3.52Å; F16-Y21 HydrophobicContact CE2-CE2 4.44Å; F16-Y21 HydrophobicContact CE2-CG 4.15Å; F16-Y21 HydrophobicContact CG-CD2 4.37Å; F16-Y21 HydrophobicContact CZ-CD2 4.32Å; F16-L42 HydrophobicContact CE2-CD1 3.85Å; F16-L42 HydrophobicContact CE2-CD2 4.21Å; F16-L42 HydrophobicContact CZ-CD1 3.68Å; F16-L42 HydrophobicContact CZ-CD2 4.24Å; F16-L49 HydrophobicContact CE1-CD2 4.5Å; F16-L49 HydrophobicContact CZ-CD2 4.09Å
17	Y	74.1	Confident	84	Confident	176 Å²	176	91.6 Å²	91.6	69%	0.69	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	102.3	169.1	-176.3	-98.3	0	0	0	109.5	D19 N20	Y17-D19 PolarHBondContact O-N 3.15Å; Y17-N20 PolarHBondContact N-O 3.31Å; Y17-N20 PolarHBondContact O-N 3.21Å
18	V	78.2	Confident	84.4	Confident	125 Å²	125	89.1 Å²	89.1	76%	0.758	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-96.7	-174.9	-172.6	0	0	0	0	111
19	D	81.1	Confident	84.7	Confident	119 Å²	119	94.6 Å²	94.6	64%	0.636	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-5.1	-176.6	55.8	-25	0	0	0	112.9	Y17	Y17-D19 PolarHBondContact O-N 3.15Å
20	N	83.7	Confident	85	Confident	84 Å²	84	95.8 Å²	95.8	45%	0.449	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137.4	-175.2	-63.9	-71	0	0	0	111.9	F16 Y17 L22	F16-N20 CarbonylContact C-O 3.4Å; F16-N20 WeakPolarHBondContact CA-O 3.42Å; Y17-N20 PolarHBondContact N-O 3.31Å; Y17-N20 PolarHBondContact O-N 3.21Å; N20-L22 HydrophobicContact CB-CD1 4.45Å
21	Y	85.1	Confident	85.3	Confident	40 Å²	40	89.9 Å²	89.9	16%	0.157	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125	168	-178.9	-96.6	0	0	0	109.6	K11 N15 F16 D23 L38	K11-Y21 WeakPolarHBondContact CB-OH 3.35Å; N15-Y21 HydrophobicContact CB-CD2 4.08Å; N15-Y21 HydrophobicContact CB-CE2 3.66Å; F16-Y21 AromaticContact CD2-CD2 3.55Å; F16-Y21 HydrophobicContact CD2-CD2 3.55Å; F16-Y21 HydrophobicContact CD2-CE2 4.4Å; F16-Y21 HydrophobicContact CD2-CG 4.41Å; F16-Y21 AromaticContact CE2-CD2 3.52Å; F16-Y21 HydrophobicContact CE2-CD2 3.52Å; F16-Y21 HydrophobicContact CE2-CE2 4.44Å; F16-Y21 HydrophobicContact CE2-CG 4.15Å; F16-Y21 HydrophobicContact CG-CD2 4.37Å; F16-Y21 HydrophobicContact CZ-CD2 4.32Å; Y21-D23 HydrophobicContact CD1-CB 4.29Å; Y21-D23 HydrophobicContact CE1-CB 3.42Å; Y21-D23 VanDerWaalsContact CE1-CB 3.42Å; Y21-D23 PolarHBondContact OH-OD2 3.38Å; Y21-L38 HydrophobicContact CD1-CD2 3.45Å; Y21-L38 VanDerWaalsContact CD1-CD2 3.45Å; Y21-L38 HydrophobicContact CD2-CD1 4.03Å; Y21-L38 HydrophobicContact CD2-CD2 3.94Å; Y21-L38 HydrophobicContact CE1-CD1 4.07Å; Y21-L38 HydrophobicContact CE1-CD2 3.54Å; Y21-L38 HydrophobicContact CE1-CG 4.45Å; Y21-L38 HydrophobicContact CE2-CD1 3.42Å; Y21-L38 VanDerWaalsContact CE2-CD1 3.42Å; Y21-L38 HydrophobicContact CE2-CD2 4Å; Y21-L38 HydrophobicContact CE2-CG 4.37Å; Y21-L38 HydrophobicContact CG-CD2 3.64Å; Y21-L38 VanDerWaalsContact CZ-CD1 3.45Å
22	L	86.5	Confident	85.5	Confident	131 Å²	131	88.8 Å²	88.8	69%	0.686	46%	0.462	S	S	*	.			trans	-127.3	121.9	176.7	-112.1	94.7	0	0	0	111.2	N15 N20	N15-L22 WeakPolarHBondContact CB-O 3.5Å; N15-L22 PolarHBondContact O-N 3.3Å; N20-L22 HydrophobicContact CB-CD1 4.45Å
23	D	87.4	Confident	85.8	Confident	54 Å²	54	91.1 Å²	91.1	29%	0.289	48%	0.48	S	S	.	.			trans	-146.2	160	-177.8	-161.3	0	0	0	0	111	N15 Y21 Y25	N15-D23 PolarHBondContact ND2-OD1 2.97Å; N15-D23 VanDerWaalsContact ND2-OD1 3.12Å; N15-D23 PolarHBondContact ND2-OD2 3.28Å; Y21-D23 HydrophobicContact CD1-CB 4.29Å; Y21-D23 HydrophobicContact CE1-CB 3.42Å; Y21-D23 VanDerWaalsContact CE1-CB 3.42Å; Y21-D23 PolarHBondContact OH-OD2 3.38Å; D23-Y25 HydrophobicContact CB-CE2 3.85Å; D23-Y25 WeakPolarHBondContact OD2-CE2 3.07Å; D23-Y25 PolarHBondContact OD2-OH 2.95Å
24	S	88.6	Confident	86.1	Confident	105 Å²	105	82 Å²	82	73%	0.734	45%	0.448	S	S	*	.			trans	-132.7	141.8	-178	65.5	0	0	0	0	110.8
25	Y	86.5	Confident	86.3	Confident	57 Å²	57	76.9 Å²	76.9	22%	0.224	42%	0.421	C	S	.	.			trans	-134.7	146.3	-174.6	-66.7	-92.2	0	0	0	109.6	K11 D23 E30 A31 S34	K11-Y25 PolarHBondContact NZ-OH 3.27Å; D23-Y25 HydrophobicContact CB-CE2 3.85Å; D23-Y25 WeakPolarHBondContact OD2-CE2 3.07Å; D23-Y25 PolarHBondContact OD2-OH 2.95Å; Y25-E30 HydrophobicContact CD1-CB 4.27Å; Y25-E30 HydrophobicContact CD1-CG 3.92Å; Y25-E30 HydrophobicContact CE1-CG 4.34Å; Y25-A31 HydrophobicContact CD1-CB 4.2Å; Y25-A31 HydrophobicContact CD2-CB 3.7Å; Y25-A31 HydrophobicContact CE2-CB 4.5Å; Y25-A31 HydrophobicContact CG-CB 3.56Å; Y25-S34 VanDerWaalsContact CE1-CB 3.44Å; Y25-S34 WeakPolarHBondContact CE1-OG 3.43Å; Y25-S34 VanDerWaalsContact CZ-CB 3.41Å; Y25-S34 WeakPolarHBondContact OH-CB 3.38Å
26	T	86.4	Confident	86.5	Confident	143 Å²	143	79 Å²	79	88%	0.877	43%	0.429	S	S	*	.	S	Bend	trans	-84.4	-23.1	178	54.3	0	0	0	0	112.4
27	S	87.6	Confident	86.8	Confident	52 Å²	52	76.8 Å²	76.8	36%	0.364	42%	0.423	S	S	.	.	S	Bend	trans	-124.3	140.8	179.9	178.8	0	0	0	0	112	N29 E30 A31	S27-N29 VanDerWaalsContact C-N 3.28Å; S27-N29 PolarHBondContact O-N 2.8Å; S27-N29 PolarHBondContact OG-N 3.32Å; S27-E30 PolarHBondContact O-N 3.33Å; S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 2.86Å; S27-A31 VanDerWaalsContact O-N 3.09Å
28	T	88.2	Confident	87.5	Confident	59 Å²	59	68.4 Å²	68.4	36%	0.362	39%	0.39	S	S	.	.	H	α-helix	trans	-66.3	-31.7	179.1	-25.8	0	0	0	0	112.2	T32 S56 A58 L59	T28-T32 WeakPolarHBondContact O-CB 3.49Å; T28-T32 PolarHBondContact O-N 3.43Å; T28-T32 PolarHBondContact O-OG1 2.92Å; T28-S56 WeakPolarHBondContact CG2-OG 3.47Å; T28-A58 HydrophobicContact CG2-CB 4.19Å; T28-L59 HydrophobicContact CG2-CB 4.09Å
29	N	88.7	Confident	88.1	Confident	126 Å²	126	64.4 Å²	64.4	67%	0.674	36%	0.363	S	S	*	.	H	α-helix	trans	-70.7	-44.2	178.1	-68	-12.5	0	0	0	111.2	S27 A31 T32 S33	S27-N29 VanDerWaalsContact C-N 3.28Å; S27-N29 PolarHBondContact O-N 2.8Å; S27-N29 PolarHBondContact OG-N 3.32Å; N29-A31 VanDerWaalsContact C-N 3.33Å; N29-A31 PolarHBondContact O-N 3.02Å; N29-T32 PolarHBondContact O-N 2.91Å; N29-S33 PolarHBondContact O-N 2.81Å; N29-S33 PolarHBondContact O-OG 2.95Å
30	E	90	Very high	88.5	Confident	90 Å²	90	62 Å²	62	42%	0.421	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-42	177.2	-167.4	-166.7	161.6	0	0	111.4	Y25 S27 T32 S34	Y25-E30 HydrophobicContact CD1-CB 4.27Å; Y25-E30 HydrophobicContact CD1-CG 3.92Å; Y25-E30 HydrophobicContact CE1-CG 4.34Å; S27-E30 PolarHBondContact O-N 3.33Å; E30-T32 VanDerWaalsContact C-N 3.35Å; E30-T32 PolarHBondContact O-N 3.34Å; E30-S34 VanDerWaalsContact O-CB 3.31Å; E30-S34 WeakPolarHBondContact O-CB 3.24Å; E30-S34 PolarHBondContact O-N 3.34Å; E30-S34 PolarHBondContact O-OG 2.88Å
31	A	90.3	Very high	88.8	Confident	11 Å²	11	58.8 Å²	58.8	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175.4	0	0	0	0	0	111.7	Y25 S27 N29 C35 L59	Y25-A31 HydrophobicContact CD1-CB 4.2Å; Y25-A31 HydrophobicContact CD2-CB 3.7Å; Y25-A31 HydrophobicContact CE2-CB 4.5Å; Y25-A31 HydrophobicContact CG-CB 3.56Å; S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 2.86Å; S27-A31 VanDerWaalsContact O-N 3.09Å; N29-A31 VanDerWaalsContact C-N 3.33Å; N29-A31 PolarHBondContact O-N 3.02Å; A31-C35 WeakPolarHBondContact O-CB 3.15Å; A31-C35 PolarHBondContact O-N 3.26Å; A31-L59 HydrophobicContact CB-CD1 3.25Å
32	T	90.5	Very high	88.9	Confident	24 Å²	24	57.7 Å²	57.7	15%	0.147	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-48.6	179.7	-56.8	0	0	0	0	111.1	T28 N29 E30 S34 C35 H36 T62	T28-T32 WeakPolarHBondContact O-CB 3.49Å; T28-T32 PolarHBondContact O-N 3.43Å; T28-T32 PolarHBondContact O-OG1 2.92Å; N29-T32 PolarHBondContact O-N 2.91Å; E30-T32 VanDerWaalsContact C-N 3.35Å; E30-T32 PolarHBondContact O-N 3.34Å; T32-S34 VanDerWaalsContact C-N 3.35Å; T32-S34 PolarHBondContact O-N 3.13Å; T32-C35 WeakPolarHBondContact O-CB 3.33Å; T32-C35 PolarHBondContact O-N 3.09Å; T32-H36 PolarHBondContact O-CD2 3.47Å; T32-H36 PolarHBondContact O-N 2.93Å; T32-T62 HydrophobicContact CG2-CG2 4.21Å
33	S	90.1	Very high	89	Confident	82 Å²	82	58.6 Å²	58.6	57%	0.573	33%	0.326	S	S	*	.	H	α-helix	trans	-59.8	-44.2	176.9	-62.9	0	0	0	0	112.1	N29 H36 A37	N29-S33 PolarHBondContact O-N 2.81Å; N29-S33 PolarHBondContact O-OG 2.95Å; S33-H36 PolarHBondContact O-N 3.42Å; S33-A37 WeakPolarHBondContact O-CB 3.49Å; S33-A37 PolarHBondContact O-N 3.05Å
34	S	89.7	Confident	89	Confident	15 Å²	15	60 Å²	60	11%	0.105	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-38	178.6	-59.6	0	0	0	0	111.9	Y25 E30 T32 A37 L38	Y25-S34 VanDerWaalsContact CE1-CB 3.44Å; Y25-S34 WeakPolarHBondContact CE1-OG 3.43Å; Y25-S34 VanDerWaalsContact CZ-CB 3.41Å; Y25-S34 WeakPolarHBondContact OH-CB 3.38Å; E30-S34 VanDerWaalsContact O-CB 3.31Å; E30-S34 WeakPolarHBondContact O-CB 3.24Å; E30-S34 PolarHBondContact O-N 3.34Å; E30-S34 PolarHBondContact O-OG 2.88Å; T32-S34 VanDerWaalsContact C-N 3.35Å; T32-S34 PolarHBondContact O-N 3.13Å; S34-A37 PolarHBondContact O-N 3.25Å; S34-L38 WeakPolarHBondContact O-CB 3.22Å; S34-L38 PolarHBondContact O-N 3.27Å
35	C	89.9	Confident	88.7	Confident	12 Å²	12	57 Å²	57	8%	0.081	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-45.5	176.7	-170	0	0	0	0	111.7	A31 T32 L38 K39 W52	A31-C35 WeakPolarHBondContact O-CB 3.15Å; A31-C35 PolarHBondContact O-N 3.26Å; T32-C35 WeakPolarHBondContact O-CB 3.33Å; T32-C35 PolarHBondContact O-N 3.09Å; C35-L38 PolarHBondContact O-N 2.94Å; C35-K39 WeakPolarHBondContact O-CB 3.19Å; C35-K39 PolarHBondContact O-N 2.58Å; C35-W52 WeakPolarHBondContact SG-CH2 3.35Å; C35-W52 WeakPolarHBondContact SG-CZ3 3.17Å
36	H	89.6	Confident	88.7	Confident	89 Å²	89	57 Å²	57	41%	0.412	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-42.1	174.8	-73.9	-64.1	0	0	0	112.7	T32 S33 K39 T40	T32-H36 PolarHBondContact O-CD2 3.47Å; T32-H36 PolarHBondContact O-N 2.93Å; S33-H36 PolarHBondContact O-N 3.42Å; H36-K39 PolarHBondContact O-N 2.96Å; H36-T40 WeakPolarHBondContact O-CB 3.31Å; H36-T40 PolarHBondContact O-N 2.82Å; H36-T40 PolarHBondContact O-OG1 3.29Å
37	A	90.2	Very high	88.6	Confident	19 Å²	19	56.8 Å²	56.8	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-40.9	177.1	0	0	0	0	0	111.9	F5 V8 S33 S34 T40 L41	F5-A37 HydrophobicContact CD1-CB 3.91Å; F5-A37 HydrophobicContact CE1-CB 4.06Å; V8-A37 HydrophobicContact CG2-CB 3.72Å; S33-A37 WeakPolarHBondContact O-CB 3.49Å; S33-A37 PolarHBondContact O-N 3.05Å; S34-A37 PolarHBondContact O-N 3.25Å; A37-T40 PolarHBondContact O-N 3.47Å; A37-L41 VanDerWaalsContact O-CB 3.26Å; A37-L41 WeakPolarHBondContact O-CB 3.08Å; A37-L41 PolarHBondContact O-N 3.01Å
38	L	89.8	Confident	88.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-46	176	-165.7	95.2	0	0	0	111.3	V8 V12 Y21 S34 C35 T40 L41 L42 L49 W52	V8-L38 HydrophobicContact CG1-CB 3.96Å; V8-L38 HydrophobicContact CG1-CD1 3.58Å; V8-L38 HydrophobicContact CG1-CG 4.34Å; V12-L38 HydrophobicContact CG2-CD1 3.4Å; V12-L38 HydrophobicContact CG2-CG 4.4Å; Y21-L38 HydrophobicContact CD1-CD2 3.45Å; Y21-L38 VanDerWaalsContact CD1-CD2 3.45Å; Y21-L38 HydrophobicContact CD2-CD1 4.03Å; Y21-L38 HydrophobicContact CD2-CD2 3.94Å; Y21-L38 HydrophobicContact CE1-CD1 4.07Å; Y21-L38 HydrophobicContact CE1-CD2 3.54Å; Y21-L38 HydrophobicContact CE1-CG 4.45Å; Y21-L38 HydrophobicContact CE2-CD1 3.42Å; Y21-L38 VanDerWaalsContact CE2-CD1 3.42Å; Y21-L38 HydrophobicContact CE2-CD2 4Å; Y21-L38 HydrophobicContact CE2-CG 4.37Å; Y21-L38 HydrophobicContact CG-CD2 3.64Å; Y21-L38 VanDerWaalsContact CZ-CD1 3.45Å; S34-L38 WeakPolarHBondContact O-CB 3.22Å; S34-L38 PolarHBondContact O-N 3.27Å; C35-L38 PolarHBondContact O-N 2.94Å; L38-T40 VanDerWaalsContact C-N 3.31Å; L38-T40 PolarHBondContact O-N 2.98Å; L38-L41 PolarHBondContact O-N 3.26Å; L38-L42 HydrophobicContact CD2-CD1 4.12Å; L38-L42 HydrophobicContact CG-CD1 3.91Å; L38-L42 WeakPolarHBondContact O-CB 3.33Å; L38-L42 WeakPolarHBondContact O-CG 3.19Å; L38-L42 PolarHBondContact O-N 2.88Å; L38-L49 HydrophobicContact CD2-CD1 3.45Å; L38-L49 VanDerWaalsContact CD2-CD1 3.45Å; L38-L49 HydrophobicContact CG-CD1 4.27Å; L38-W52 HydrophobicContact CD2-CH2 4.16Å
39	K	89.8	Confident	88.4	Confident	41 Å²	41	59 Å²	59	18%	0.178	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-42.9	176.5	-170.3	176.6	174.3	179.3	0	110.9	C35 H36 R43 W52 E67	C35-K39 WeakPolarHBondContact O-CB 3.19Å; C35-K39 PolarHBondContact O-N 2.58Å; H36-K39 PolarHBondContact O-N 2.96Å; K39-R43 WeakPolarHBondContact O-CB 3.43Å; K39-R43 PolarHBondContact O-N 2.94Å; K39-W52 HydrophobicContact CB-CZ2 4.2Å; K39-W52 HydrophobicContact CD-CZ2 4.41Å; K39-W52 HydrophobicContact CG-CZ2 4.38Å; K39-E67 WeakPolarHBondContact CE-OE1 3.47Å; K39-E67 WeakPolarHBondContact CE-OE2 3.35Å; K39-E67 IonicContact NZ-OE1 2.71Å; K39-E67 PolarHBondContact NZ-OE1 2.71Å; K39-E67 IonicContact NZ-OE2 2.58Å; K39-E67 PolarHBondContact NZ-OE2 2.97Å
40	T	90	Very high	88.3	Confident	67 Å²	67	57.4 Å²	57.4	41%	0.411	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-45.9	177.5	-53.4	0	0	0	0	111.7	F5 H36 A37 L38 R43 Q44	F5-T40 HydrophobicContact CZ-CG2 3.88Å; H36-T40 WeakPolarHBondContact O-CB 3.31Å; H36-T40 PolarHBondContact O-N 2.82Å; H36-T40 PolarHBondContact O-OG1 3.29Å; A37-T40 PolarHBondContact O-N 3.47Å; L38-T40 VanDerWaalsContact C-N 3.31Å; L38-T40 PolarHBondContact O-N 2.98Å; T40-R43 PolarHBondContact O-N 3.39Å; T40-Q44 WeakPolarHBondContact O-CG 3.22Å; T40-Q44 PolarHBondContact O-N 3.45Å
41	L	89.2	Confident	88	Confident	17 Å²	17	60.8 Å²	60.8	9%	0.089	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-47.8	179.9	176.2	66	0	0	0	112.1	H1 F5 V8 W9 V12 A37 L38 Q44 G45	H1-L41 HydrophobicContact CB-CD1 3.79Å; F5-L41 HydrophobicContact CD2-CB 4.17Å; F5-L41 HydrophobicContact CD2-CD1 3.85Å; F5-L41 HydrophobicContact CE2-CB 4.44Å; V8-L41 HydrophobicContact CB-CD2 4.42Å; V8-L41 HydrophobicContact CG1-CD2 4.06Å; W9-L41 HydrophobicContact CB-CD2 4.33Å; V12-L41 HydrophobicContact CG2-CD2 3.83Å; A37-L41 VanDerWaalsContact O-CB 3.26Å; A37-L41 WeakPolarHBondContact O-CB 3.08Å; A37-L41 PolarHBondContact O-N 3.01Å; L38-L41 PolarHBondContact O-N 3.26Å; L41-Q44 PolarHBondContact O-N 3.43Å; L41-G45 PolarHBondContact O-N 3.39Å
42	L	87	Confident	87.9	Confident	17 Å²	17	61.8 Å²	61.8	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-72	-35.5	-179.3	-72	168.8	0	0	0	111.9	V12 F16 L38 Q44 G45 G46 F47 L49	V12-L42 HydrophobicContact CG1-CD2 4.27Å; F16-L42 HydrophobicContact CE2-CD1 3.85Å; F16-L42 HydrophobicContact CE2-CD2 4.21Å; F16-L42 HydrophobicContact CZ-CD1 3.68Å; F16-L42 HydrophobicContact CZ-CD2 4.24Å; L38-L42 HydrophobicContact CD2-CD1 4.12Å; L38-L42 HydrophobicContact CG-CD1 3.91Å; L38-L42 WeakPolarHBondContact O-CB 3.33Å; L38-L42 WeakPolarHBondContact O-CG 3.19Å; L38-L42 PolarHBondContact O-N 2.88Å; L42-Q44 VanDerWaalsContact C-N 3.32Å; L42-Q44 PolarHBondContact O-N 3.46Å; L42-G45 CarbonylContact O-C 3.59Å; L42-G45 WeakPolarHBondContact O-CA 3.43Å; L42-G45 PolarHBondContact O-N 3.21Å; L42-G46 PolarHBondContact O-N 2.77Å; L42-F47 CarbonylContact C-O 3.6Å; L42-F47 HydrophobicContact CB-CB 4.12Å; L42-F47 WeakPolarHBondContact CB-O 3.48Å; L42-F47 HydrophobicContact CD2-CB 4.35Å; L42-F47 PolarHBondContact O-N 2.88Å; L42-L49 HydrophobicContact CD1-CD1 3.34Å; L42-L49 HydrophobicContact CD1-CD2 3.96Å; L42-L49 HydrophobicContact CD1-CG 3.57Å
43	R	90	Very high	87.6	Confident	150 Å²	150	67.8 Å²	67.8	57%	0.566	36%	0.359	S	S	*	.	H	α-helix	trans	-65	-35.6	175.4	-161.8	176.2	-167.7	-175.6	2.5	111.9	K39 T40 G45 G46 F47	K39-R43 WeakPolarHBondContact O-CB 3.43Å; K39-R43 PolarHBondContact O-N 2.94Å; T40-R43 PolarHBondContact O-N 3.39Å; R43-G45 PolarHBondContact O-N 2.97Å; R43-G46 PolarHBondContact O-N 3.12Å; R43-G46 VanDerWaalsContact O-N 3.14Å; R43-F47 PolarHBondContact N-O 2.99Å
44	Q	86.9	Confident	87.2	Confident	85 Å²	85	66 Å²	66	40%	0.397	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-30.6	169.4	-74.9	-178.5	0.1	0	0	112.6	H1 T40 L41 L42 G46	H1-Q44 PolarHBondContact CE1-OE1 2.58Å; H1-Q44 PolarHBondContact ND1-OE1 2.63Å; T40-Q44 WeakPolarHBondContact O-CG 3.22Å; T40-Q44 PolarHBondContact O-N 3.45Å; L41-Q44 PolarHBondContact O-N 3.43Å; L42-Q44 VanDerWaalsContact C-N 3.32Å; L42-Q44 PolarHBondContact O-N 3.46Å; Q44-G46 VanDerWaalsContact C-N 3.31Å
45	G	82.8	Confident	86.9	Confident	42 Å²	42	71.6 Å²	71.6	43%	0.433	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	3.4	174.5	0	0	0	0	0	114.9	L41 L42 R43 F47	L41-G45 PolarHBondContact O-N 3.39Å; L42-G45 CarbonylContact O-C 3.59Å; L42-G45 WeakPolarHBondContact O-CA 3.43Å; L42-G45 PolarHBondContact O-N 3.21Å; R43-G45 PolarHBondContact O-N 2.97Å; G45-F47 VanDerWaalsContact C-N 3.32Å; G45-F47 VanDerWaalsContact O-CD2 3.31Å; G45-F47 WeakPolarHBondContact O-CD2 3.14Å; G45-F47 WeakPolarHBondContact O-CE2 3.37Å
46	G	86	Confident	86.5	Confident	55 Å²	55	72.7 Å²	72.7	57%	0.567	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	1.9	-176.3	0	0	0	0	0	115.1	L42 R43 Q44	L42-G46 PolarHBondContact O-N 2.77Å; R43-G46 PolarHBondContact O-N 3.12Å; R43-G46 VanDerWaalsContact O-N 3.14Å; Q44-G46 VanDerWaalsContact C-N 3.31Å
47	F	85.3	Confident	86.2	Confident	140 Å²	140	77.5 Å²	77.5	61%	0.614	41%	0.408	S	S	*	.			trans	-95.4	113.4	180	-62.1	-80.2	0	0	0	110.8	L42 R43 G45	L42-F47 CarbonylContact C-O 3.6Å; L42-F47 HydrophobicContact CB-CB 4.12Å; L42-F47 WeakPolarHBondContact CB-O 3.48Å; L42-F47 HydrophobicContact CD2-CB 4.35Å; L42-F47 PolarHBondContact O-N 2.88Å; R43-F47 PolarHBondContact N-O 2.99Å; G45-F47 VanDerWaalsContact C-N 3.32Å; G45-F47 VanDerWaalsContact O-CD2 3.31Å; G45-F47 WeakPolarHBondContact O-CD2 3.14Å; G45-F47 WeakPolarHBondContact O-CE2 3.37Å
48	H	86.1	Confident	85.9	Confident	127 Å²	127	79.5 Å²	79.5	59%	0.588	43%	0.425	S	S	*	.			trans	-94	107.6	176.7	-67.9	85.7	0	0	0	110.1
49	L	85	Confident	85.7	Confident	30 Å²	30	80.2 Å²	80.2	16%	0.157	43%	0.428	C	S	.	.			trans	-71.4	132.7	172.9	-72.3	-177.2	0	0	0	111	F16 L38 L42 W52	F16-L49 HydrophobicContact CE1-CD2 4.5Å; F16-L49 HydrophobicContact CZ-CD2 4.09Å; L38-L49 HydrophobicContact CD2-CD1 3.45Å; L38-L49 VanDerWaalsContact CD2-CD1 3.45Å; L38-L49 HydrophobicContact CG-CD1 4.27Å; L42-L49 HydrophobicContact CD1-CD1 3.34Å; L42-L49 HydrophobicContact CD1-CD2 3.96Å; L42-L49 HydrophobicContact CD1-CG 3.57Å; L49-W52 HydrophobicContact CB-CH2 4.34Å; L49-W52 HydrophobicContact CB-CZ2 3.64Å; L49-W52 HydrophobicContact CD1-CH2 3.51Å; L49-W52 HydrophobicContact CD1-CZ2 3.65Å; L49-W52 HydrophobicContact CD1-CZ3 4.4Å; L49-W52 HydrophobicContact CG-CZ2 4.34Å
50	T	86.4	Confident	85.4	Confident	92 Å²	92	80 Å²	80	56%	0.564	43%	0.429	S	S	*	.			trans	-137.2	175	179	59.7	0	0	0	0	109.7	W52	T50-W52 PolarHBondContact O-N 2.8Å
51	K	84	Confident	85.2	Confident	162 Å²	162	84.6 Å²	84.6	70%	0.704	44%	0.443	S	S	*	.	S	Bend	trans	58.4	43.7	179.8	-57.6	-179.8	179.4	177.6	0	113.1	M53 E67	K51-M53 PolarHBondContact O-N 3.13Å; K51-E67 CarbonylContact C-O 3.12Å; K51-E67 WeakPolarHBondContact CA-O 3.32Å; K51-E67 PolarHBondContact N-O 2.93Å
52	W	86.9	Confident	85	Confident	32 Å²	32	87.2 Å²	87.2	12%	0.121	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-60	137.1	178	-67.7	96.5	0	0	0	111.9	C35 L38 K39 L49 T50 L63 E67 S69	C35-W52 WeakPolarHBondContact SG-CH2 3.35Å; C35-W52 WeakPolarHBondContact SG-CZ3 3.17Å; L38-W52 HydrophobicContact CD2-CH2 4.16Å; K39-W52 HydrophobicContact CB-CZ2 4.2Å; K39-W52 HydrophobicContact CD-CZ2 4.41Å; K39-W52 HydrophobicContact CG-CZ2 4.38Å; L49-W52 HydrophobicContact CB-CH2 4.34Å; L49-W52 HydrophobicContact CB-CZ2 3.64Å; L49-W52 HydrophobicContact CD1-CH2 3.51Å; L49-W52 HydrophobicContact CD1-CZ2 3.65Å; L49-W52 HydrophobicContact CD1-CZ3 4.4Å; L49-W52 HydrophobicContact CG-CZ2 4.34Å; T50-W52 PolarHBondContact O-N 2.8Å; W52-L63 HydrophobicContact CB-CD1 3.66Å; W52-L63 HydrophobicContact CD2-CD1 3.87Å; W52-L63 HydrophobicContact CE3-CD1 4.08Å; W52-L63 HydrophobicContact CG-CD1 3.71Å; W52-E67 PolarHBondContact N-O 2.87Å; W52-E67 PolarHBondContact NE1-OE2 3.41Å; W52-S69 PolarHBondContact O-N 3.35Å
53	M	84.4	Confident	84.9	Confident	149 Å²	149	86.7 Å²	86.7	73%	0.734	46%	0.458	S	S	*	.			trans	-139.7	140.2	-179.6	-117	164	49	0	0	109	K51	K51-M53 PolarHBondContact O-N 3.13Å
54	S	82.9	Confident	84.6	Confident	45 Å²	45	84 Å²	84	32%	0.315	46%	0.455	S	S	.	.			trans	-149.9	149.2	176.3	-170.3	0	0	0	0	110.6	S56 L60	S54-S56 PolarHBondContact OG-N 2.98Å; S54-L60 VanDerWaalsContact O-CD1 3.26Å; S54-L60 WeakPolarHBondContact O-CD1 3.49Å
55	S	82.7	Confident	84.3	Confident	133 Å²	133	83 Å²	83	93%	0.93	46%	0.46	S	S	*	.	S	Bend	trans	-70.5	-21.6	168	52.4	0	0	0	0	112.5
56	S	81.7	Confident	84.3	Confident	35 Å²	35	88 Å²	88	25%	0.245	48%	0.478	C	S	.	.			trans	-94	113.8	177	-179.8	0	0	0	0	111.6	T28 S54 A58 L59 L60	T28-S56 WeakPolarHBondContact CG2-OG 3.47Å; S54-S56 PolarHBondContact OG-N 2.98Å; S56-A58 PolarHBondContact O-N 3.24Å; S56-A58 PolarHBondContact OG-N 3.47Å; S56-L59 PolarHBondContact O-N 3.25Å; S56-L60 PolarHBondContact O-N 3.46Å; S56-L60 VanDerWaalsContact O-N 3.12Å
57	R	83	Confident	84.1	Confident	190 Å²	190	87.3 Å²	87.3	72%	0.717	46%	0.459	S	S	*	.	H	α-helix	trans	-61.6	-28.4	173.6	-70.1	-173.8	179.7	-173.7	1.7	112.5	K61 D76	R57-K61 WeakPolarHBondContact O-CG 3.11Å; R57-K61 PolarHBondContact O-N 3.4Å; R57-D76 IonicContact NH2-OD2 3.95Å
58	A	83.4	Confident	83.9	Confident	61 Å²	61	84.6 Å²	84.6	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-40.5	177.6	0	0	0	0	0	111.9	T28 S56 K61	T28-A58 HydrophobicContact CG2-CB 4.19Å; S56-A58 PolarHBondContact O-N 3.24Å; S56-A58 PolarHBondContact OG-N 3.47Å; A58-K61 PolarHBondContact O-N 3.07Å
59	L	86.3	Confident	83.3	Confident	14 Å²	14	80.1 Å²	80.1	7%	0.073	43%	0.428	C	S	.	.	H	α-helix	trans	-70.9	-40.9	175	-175.5	145.9	0	0	0	111.9	T28 A31 S56 K61 T62 L63	T28-L59 HydrophobicContact CG2-CB 4.09Å; A31-L59 HydrophobicContact CB-CD1 3.25Å; S56-L59 PolarHBondContact O-N 3.25Å; L59-K61 PolarHBondContact O-N 3.19Å; L59-T62 PolarHBondContact O-N 3.01Å; L59-T62 PolarHBondContact O-OG1 3.09Å; L59-L63 HydrophobicContact CD2-CD1 4.01Å
60	L	84.2	Confident	82.4	Confident	38 Å²	38	86.9 Å²	86.9	20%	0.199	46%	0.459	C	S	.	.	H	α-helix	trans	-57.7	-35.8	176.4	-91.4	159.6	0	0	0	111.9	S54 S56 T62 L63 R68	S54-L60 VanDerWaalsContact O-CD1 3.26Å; S54-L60 WeakPolarHBondContact O-CD1 3.49Å; S56-L60 PolarHBondContact O-N 3.46Å; S56-L60 VanDerWaalsContact O-N 3.12Å; L60-T62 VanDerWaalsContact C-N 3.28Å; L60-T62 PolarHBondContact O-N 3.5Å; L60-L63 PolarHBondContact O-N 3.4Å; L60-R68 HydrophobicContact CD2-CB 4.47Å; L60-R68 HydrophobicContact CD2-CG 4.1Å; L60-R68 PolarHBondContact O-NE 3.04Å; L60-R68 PolarHBondContact O-NH2 3.01Å; L60-R68 VanDerWaalsContact O-NH2 3.1Å
61	K	85.1	Confident	81	Confident	162 Å²	162	87.3 Å²	87.3	70%	0.704	46%	0.463	S	S	*	.	H	α-helix	trans	-65.3	-24.2	177.7	-76.4	178.6	-179.6	-173.6	0	114.3	R57 A58 L59 R68	R57-K61 WeakPolarHBondContact O-CG 3.11Å; R57-K61 PolarHBondContact O-N 3.4Å; A58-K61 PolarHBondContact O-N 3.07Å; L59-K61 PolarHBondContact O-N 3.19Å; K61-R68 PolarHBondContact O-NH2 3.47Å; K61-R68 VanDerWaalsContact O-NH2 3.08Å
62	T	85.7	Confident	79.4	Confident	72 Å²	72	87.6 Å²	87.6	44%	0.442	47%	0.472	S	S	.	.	H	α-helix	trans	-82.2	-17.5	179.9	62.5	0	0	0	0	113.3	T32 L59 L60	T32-T62 HydrophobicContact CG2-CG2 4.21Å; L59-T62 PolarHBondContact O-N 3.01Å; L59-T62 PolarHBondContact O-OG1 3.09Å; L60-T62 VanDerWaalsContact C-N 3.28Å; L60-T62 PolarHBondContact O-N 3.5Å
63	L	83.7	Confident	77.5	Confident	7 Å²	7	91.2 Å²	91.2	4%	0.037	49%	0.494	C	S	.	.	S	Bend	trans	-87.8	150.6	177.3	-65.4	170.4	0	0	0	111.4	W52 L59 L60 A65 R68	W52-L63 HydrophobicContact CB-CD1 3.66Å; W52-L63 HydrophobicContact CD2-CD1 3.87Å; W52-L63 HydrophobicContact CE3-CD1 4.08Å; W52-L63 HydrophobicContact CG-CD1 3.71Å; L59-L63 HydrophobicContact CD2-CD1 4.01Å; L60-L63 PolarHBondContact O-N 3.4Å; L63-A65 PolarHBondContact O-N 2.89Å; L63-R68 PolarHBondContact O-NE 2.86Å; L63-R68 PolarHBondContact O-NH2 2.93Å
64	D	84	Confident	75.4	Confident	94 Å²	94	88.8 Å²	88.8	50%	0.503	48%	0.484	S	S	.	.			trans	-62.7	137	-179.4	-162.3	-6.8	0	0	0	111.3	N66 E67 R68	D64-N66 PolarHBondContact O-N 3.47Å; D64-E67 HydrophobicContact CB-CG 4.49Å; D64-E67 PolarHBondContact O-N 3.02Å; D64-E67 VanDerWaalsContact O-N 3.07Å; D64-R68 WeakPolarHBondContact O-CG 3.45Å
65	A	80.9	Confident	73.8	Confident	62 Å²	62	93.7 Å²	93.7	51%	0.512	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-60.4	-32.1	-173.2	0	0	0	0	0	112.4	L63 E67 R68	L63-A65 PolarHBondContact O-N 2.89Å; A65-E67 VanDerWaalsContact C-N 3.28Å; A65-E67 PolarHBondContact O-N 2.91Å; A65-R68 PolarHBondContact O-N 3.08Å
66	N	82.8	Confident	72	Confident	149 Å²	149	91.9 Å²	91.9	80%	0.797	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-72.7	-18.6	-179.5	-64.5	-22	0	0	0	113.6	D64	D64-N66 PolarHBondContact O-N 3.47Å
67	E	81.9	Confident	70	Confident	40 Å²	40	99 Å²	99	19%	0.187	52%	0.516	C	S	.	.	G	3₁₀ helix	trans	-100.4	-6.1	179.9	-61.2	-177	178.8	0	0	113.1	K39 K51 W52 D64 A65	K39-E67 WeakPolarHBondContact CE-OE1 3.47Å; K39-E67 WeakPolarHBondContact CE-OE2 3.35Å; K39-E67 IonicContact NZ-OE1 2.71Å; K39-E67 PolarHBondContact NZ-OE1 2.71Å; K39-E67 IonicContact NZ-OE2 2.58Å; K39-E67 PolarHBondContact NZ-OE2 2.97Å; K51-E67 CarbonylContact C-O 3.12Å; K51-E67 WeakPolarHBondContact CA-O 3.32Å; K51-E67 PolarHBondContact N-O 2.93Å; W52-E67 PolarHBondContact N-O 2.87Å; W52-E67 PolarHBondContact NE1-OE2 3.41Å; D64-E67 HydrophobicContact CB-CG 4.49Å; D64-E67 PolarHBondContact O-N 3.02Å; D64-E67 VanDerWaalsContact O-N 3.07Å; A65-E67 VanDerWaalsContact C-N 3.28Å; A65-E67 PolarHBondContact O-N 2.91Å
68	R	80.8	Confident	67.6	Low	83 Å²	83	95.2 Å²	95.2	31%	0.313	51%	0.51	S	S	.	.	B	Isolated β-bridge	trans	-73.5	144.2	178.4	-61.6	173.2	-163.9	170.1	-1.6	110	L60 K61 L63 D64 A65 Q70	L60-R68 HydrophobicContact CD2-CB 4.47Å; L60-R68 HydrophobicContact CD2-CG 4.1Å; L60-R68 PolarHBondContact O-NE 3.04Å; L60-R68 PolarHBondContact O-NH2 3.01Å; L60-R68 VanDerWaalsContact O-NH2 3.1Å; K61-R68 PolarHBondContact O-NH2 3.47Å; K61-R68 VanDerWaalsContact O-NH2 3.08Å; L63-R68 PolarHBondContact O-NE 2.86Å; L63-R68 PolarHBondContact O-NH2 2.93Å; D64-R68 WeakPolarHBondContact O-CG 3.45Å; A65-R68 PolarHBondContact O-N 3.08Å; R68-Q70 PolarHBondContact O-N 3.08Å
69	S	73.1	Confident	65.7	Low	33 Å²	33	97.9 Å²	97.9	23%	0.231	52%	0.522	C	S	.	.			trans	-63.5	126.6	165.7	174.2	0	0	0	0	108.4	W52 P71	W52-S69 PolarHBondContact O-N 3.35Å; S69-P71 VanDerWaalsContact O-CD 3.25Å; S69-P71 WeakPolarHBondContact O-CD 3.32Å
70	Q	66.1	Low	63.3	Low	172 Å²	172	104 Å²	104	80%	0.804	56%	0.555	S	S	*	*			trans	-76.7	112.7	165.1	-69	-174.8	1.2	0	0	107.3	R68 D72	R68-Q70 PolarHBondContact O-N 3.08Å; Q70-D72 PolarHBondContact O-N 3.42Å; Q70-D72 VanDerWaalsContact O-N 3.17Å
71	P	56.4	Low	60.9	Low	101 Å²	101	106.6 Å²	106.6	66%	0.656	57%	0.574	S	S	*	*			trans	-75.9	106.1	173.9	30.7	-27	0	0	0	107.3	S69 L73	S69-P71 VanDerWaalsContact O-CD 3.25Å; S69-P71 WeakPolarHBondContact O-CD 3.32Å; P71-L73 PolarHBondContact O-N 3.23Å
72	D	51.9	Low	58.4	Low	167 Å²	167	105.9 Å²	105.9	89%	0.893	58%	0.582	S	S	*	*	S	Bend	trans	-62.1	-11.8	158.5	-80.5	-24.3	0	0	0	111.1	Q70	Q70-D72 PolarHBondContact O-N 3.42Å; Q70-D72 VanDerWaalsContact O-N 3.17Å
73	L	46.5	Very low	56	Low	109 Å²	109	107.9 Å²	107.9	57%	0.571	59%	0.587	S	S	*	*			trans	-99.7	94.2	179.9	-150.6	75.8	0	0	0	110.5	P71 I75	P71-L73 PolarHBondContact O-N 3.23Å; L73-I75 HydrophobicContact CD2-CG1 4.13Å; L73-I75 HydrophobicContact CG-CG1 4.32Å; L73-I75 PolarHBondContact O-N 3.11Å; L73-I75 VanDerWaalsContact O-N 3.1Å
74	N	40.6	Very low	53.6	Low	98 Å²	98	118.9 Å²	118.9	52%	0.524	63%	0.628	S	S	.	*			trans	-69.4	99.8	159.1	-163.6	16.9	0	0	0	107.4	D76	N74-D76 PolarHBondContact ND2-O 2.99Å; N74-D76 PolarHBondContact O-N 3.31Å
75	I	49.9	Very low	51.3	Low	148 Å²	148	117 Å²	117	76%	0.759	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-8.7	179.7	-48.5	177.8	0	0	0	110.4	L73	L73-I75 HydrophobicContact CD2-CG1 4.13Å; L73-I75 HydrophobicContact CG-CG1 4.32Å; L73-I75 PolarHBondContact O-N 3.11Å; L73-I75 VanDerWaalsContact O-N 3.1Å
76	D	43	Very low	49.1	Very low	94 Å²	94	121.1 Å²	121.1	50%	0.503	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91	108.4	175.1	-64	-35.1	0	0	0	110.5	R57 N74 D78	R57-D76 IonicContact NH2-OD2 3.95Å; N74-D76 PolarHBondContact ND2-O 2.99Å; N74-D76 PolarHBondContact O-N 3.31Å; D76-D78 PolarHBondContact O-N 3.5Å
77	M	40	Very low	47.4	Very low	185 Å²	185	118.6 Å²	118.6	91%	0.911	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.5	-1	150.4	-61.9	-83.7	-77	0	0	120.7
78	D	33.6	Very low	45.7	Very low	110 Å²	110	122 Å²	122	59%	0.588	65%	0.651	S	S	*	*			trans	-81.2	138.9	176	-73.6	-41.1	0	0	0	112.9	D76 L80	D76-D78 PolarHBondContact O-N 3.5Å; D78-L80 PolarHBondContact O-N 2.66Å
79	P	42.3	Very low	44.2	Very low	117 Å²	117	120.8 Å²	120.8	76%	0.76	65%	0.654	S	S	*	*			trans	-59.9	124.1	172.2	24.4	-29.4	0	0	0	108.7
80	L	35.7	Very low	43	Very low	144 Å²	144	125.9 Å²	125.9	75%	0.754	67%	0.673	S	S	*	*			trans	-40	123.8	-174.7	-75.3	161.6	0	0	0	111.9	D78 V82	D78-L80 PolarHBondContact O-N 2.66Å; L80-V82 PolarHBondContact O-N 3.1Å
81	P	34.8	Very low	42.2	Very low	92 Å²	92	127.8 Å²	127.8	60%	0.597	67%	0.672	S	S	*	*			trans	-65.4	129.1	176.2	24.8	-28.8	0	0	0	108.4	E83	P81-E83 PolarHBondContact O-N 3.08Å
82	V	33.2	Very low	42	Very low	146 Å²	146	123.3 Å²	123.3	89%	0.885	65%	0.645	S	S	*	*			trans	-70.3	71.3	171.2	-177.6	0	0	0	0	107.8	L80 R84	L80-V82 PolarHBondContact O-N 3.1Å; V82-R84 PolarHBondContact O-N 2.97Å
83	E	33.9	Very low	42	Very low	115 Å²	115	117.5 Å²	117.5	54%	0.537	61%	0.613	S	S	.	*			trans	-77.5	118	173.5	-121.1	-172.8	172	0	0	108.3	P81 T85 R95	P81-E83 PolarHBondContact O-N 3.08Å; E83-T85 PolarHBondContact O-N 2.8Å; E83-R95 IonicContact OE2-CZ 3.5Å; E83-R95 IonicContact OE2-NH1 3.58Å; E83-R95 IonicContact OE2-NH2 2.93Å; E83-R95 PolarHBondContact OE2-NH2 2.93Å
84	R	35	Very low	42.3	Very low	237 Å²	237	115.1 Å²	115.1	89%	0.894	60%	0.6	S	S	*	*			trans	-67	77	172.1	-69.5	176.4	174.9	171.1	-2.4	109.2	V82 L86	V82-R84 PolarHBondContact O-N 2.97Å; R84-L86 PolarHBondContact O-N 3.36Å; R84-L86 VanDerWaalsContact O-N 3.13Å
85	T	34	Very low	43	Very low	55 Å²	55	116.9 Å²	116.9	34%	0.337	60%	0.6	S	S	.	*			trans	-72.7	107.8	170.8	31.4	0	0	0	0	109.6	E83 V87	E83-T85 PolarHBondContact O-N 2.8Å; T85-V87 WeakPolarHBondContact O-CG2 3.39Å; T85-V87 PolarHBondContact O-N 3.35Å; T85-V87 VanDerWaalsContact O-N 3.1Å
86	L	35.1	Very low	43.1	Very low	148 Å²	148	111.2 Å²	111.2	78%	0.775	58%	0.575	S	S	*	*			trans	-49.1	114.1	161.9	-79.2	158.6	0	0	0	108.7	R84 S88	R84-L86 PolarHBondContact O-N 3.36Å; R84-L86 VanDerWaalsContact O-N 3.13Å; L86-S88 PolarHBondContact O-N 3.07Å
87	V	47.7	Very low	43.5	Very low	97 Å²	97	108.2 Å²	108.2	59%	0.588	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	16.1	-173.8	-161	0	0	0	0	111.8	T85 S89 M93	T85-V87 WeakPolarHBondContact O-CG2 3.39Å; T85-V87 PolarHBondContact O-N 3.35Å; T85-V87 VanDerWaalsContact O-N 3.1Å; V87-S89 PolarHBondContact O-N 2.83Å; V87-M93 HydrophobicContact CG1-CG 3.52Å
88	S	46.4	Very low	44.1	Very low	112 Å²	112	103.8 Å²	103.8	78%	0.783	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.5	-172.2	62	0	0	0	0	114.5	L86	L86-S88 PolarHBondContact O-N 3.07Å
89	S	49.2	Very low	45.2	Very low	56 Å²	56	102.1 Å²	102.1	39%	0.392	54%	0.544	S	S	.	.	S	Bend	trans	-111.1	147	178.5	72.7	0	0	0	0	111.6	V87 R91 G92 M93	V87-S89 PolarHBondContact O-N 2.83Å; S89-R91 PolarHBondContact O-N 3.18Å; S89-R91 VanDerWaalsContact O-N 3.08Å; S89-G92 WeakPolarHBondContact O-CA 3.34Å; S89-G92 PolarHBondContact O-N 3.25Å; S89-G92 PolarHBondContact OG-N 2.73Å; S89-M93 PolarHBondContact O-N 3.4Å
90	K	48.2	Very low	45.7	Very low	141 Å²	141	97.9 Å²	97.9	61%	0.613	52%	0.515	S	S	*	.	H	α-helix	trans	-48.1	-38.5	170.8	-169.7	177.6	-179.1	179.4	0	111	L94	K90-L94 HydrophobicContact CG-CD1 4.02Å; K90-L94 VanDerWaalsContact O-CB 3.32Å; K90-L94 WeakPolarHBondContact O-CB 3.26Å; K90-L94 WeakPolarHBondContact O-CD1 3.41Å; K90-L94 WeakPolarHBondContact O-CG 3.42Å; K90-L94 PolarHBondContact O-N 3.21Å
91	R	49.6	Very low	46.4	Very low	211 Å²	211	98.4 Å²	98.4	80%	0.796	51%	0.511	S	S	*	.	H	α-helix	trans	-68.5	-38.9	177.5	-159.5	176.3	179.2	-178.2	-0	113.1	S89 L94 R95	S89-R91 PolarHBondContact O-N 3.18Å; S89-R91 VanDerWaalsContact O-N 3.08Å; R91-L94 PolarHBondContact O-N 3.47Å; R91-R95 WeakPolarHBondContact O-CB 3.04Å; R91-R95 PolarHBondContact O-N 3.12Å
92	G	52.5	Low	47.5	Very low	8 Å²	8	96 Å²	96	8%	0.082	49%	0.493	C	S	.	.	H	α-helix	trans	-64.6	-45.3	174.3	0	0	0	0	0	112.4	S89 R95 A96	S89-G92 WeakPolarHBondContact O-CA 3.34Å; S89-G92 PolarHBondContact O-N 3.25Å; S89-G92 PolarHBondContact OG-N 2.73Å; G92-R95 PolarHBondContact O-N 2.87Å; G92-A96 PolarHBondContact O-N 3.09Å
93	M	50	Low	48.3	Very low	44 Å²	44	90.4 Å²	90.4	22%	0.217	46%	0.46	C	S	.	.	H	α-helix	trans	-59.1	-46.9	171.6	-77.5	177.1	49.5	0	0	111.9	V87 S89 R95 A96 V97	V87-M93 HydrophobicContact CG1-CG 3.52Å; S89-M93 PolarHBondContact O-N 3.4Å; M93-R95 PolarHBondContact O-N 3.21Å; M93-A96 WeakPolarHBondContact O-CB 3.47Å; M93-A96 PolarHBondContact O-N 3.13Å; M93-V97 VanDerWaalsContact O-CG2 3.22Å; M93-V97 WeakPolarHBondContact O-CG2 3.25Å; M93-V97 PolarHBondContact O-N 2.86Å
94	L	54.7	Low	49.3	Very low	59 Å²	59	85.9 Å²	85.9	31%	0.309	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-42.1	179.3	-73.9	168	0	0	0	112.3	K90 R91 A96 V97 S98 W132	K90-L94 HydrophobicContact CG-CD1 4.02Å; K90-L94 VanDerWaalsContact O-CB 3.32Å; K90-L94 WeakPolarHBondContact O-CB 3.26Å; K90-L94 WeakPolarHBondContact O-CD1 3.41Å; K90-L94 WeakPolarHBondContact O-CG 3.42Å; K90-L94 PolarHBondContact O-N 3.21Å; R91-L94 PolarHBondContact O-N 3.47Å; L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 3.19Å; L94-V97 PolarHBondContact O-N 3.48Å; L94-S98 WeakPolarHBondContact O-CB 3.43Å; L94-S98 PolarHBondContact O-N 3.35Å; L94-S98 PolarHBondContact O-OG 3.27Å; L94-W132 HydrophobicContact CD2-CE3 3.91Å; L94-W132 HydrophobicContact CD2-CH2 3.06Å; L94-W132 HydrophobicContact CD2-CZ2 3.99Å; L94-W132 HydrophobicContact CD2-CZ3 3.02Å; L94-W132 HydrophobicContact CG-CZ3 4.49Å
95	R	54.8	Low	50.2	Low	135 Å²	135	76.5 Å²	76.5	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-43.1	176.4	-167	172.8	-179.5	-168.6	-10.5	110.7	E83 R91 G92 M93 S98 S99	E83-R95 IonicContact OE2-CZ 3.5Å; E83-R95 IonicContact OE2-NH1 3.58Å; E83-R95 IonicContact OE2-NH2 2.93Å; E83-R95 PolarHBondContact OE2-NH2 2.93Å; R91-R95 WeakPolarHBondContact O-CB 3.04Å; R91-R95 PolarHBondContact O-N 3.12Å; G92-R95 PolarHBondContact O-N 2.87Å; M93-R95 PolarHBondContact O-N 3.21Å; R95-S98 WeakPolarHBondContact CA-OG 3.22Å; R95-S98 PolarHBondContact O-N 3.17Å; R95-S98 PolarHBondContact O-OG 3.06Å; R95-S99 WeakPolarHBondContact O-CB 3.46Å; R95-S99 PolarHBondContact O-N 3.48Å
96	A	51.4	Low	51.3	Low	30 Å²	30	77.5 Å²	77.5	25%	0.248	42%	0.416	C	S	.	.	H	α-helix	trans	-61.3	-48.6	173.9	0	0	0	0	0	111.9	G92 M93 L94 S98 S99 I100	G92-A96 PolarHBondContact O-N 3.09Å; M93-A96 WeakPolarHBondContact O-CB 3.47Å; M93-A96 PolarHBondContact O-N 3.13Å; L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 3.19Å; A96-S98 VanDerWaalsContact C-N 3.32Å; A96-S98 PolarHBondContact O-N 3.48Å; A96-S99 PolarHBondContact O-N 3.4Å; A96-S99 PolarHBondContact O-OG 2.85Å; A96-I100 WeakPolarHBondContact O-CD1 3.49Å; A96-I100 VanDerWaalsContact O-CG1 3.32Å; A96-I100 WeakPolarHBondContact O-CG1 3.31Å
97	V	51.7	Low	52.2	Low	30 Å²	30	70.6 Å²	70.6	18%	0.182	38%	0.38	C	S	.	.	H	α-helix	trans	-56.5	-45.3	176	175.8	0	0	0	0	111.1	M93 L94 I100 V111	M93-V97 VanDerWaalsContact O-CG2 3.22Å; M93-V97 WeakPolarHBondContact O-CG2 3.25Å; M93-V97 PolarHBondContact O-N 2.86Å; L94-V97 PolarHBondContact O-N 3.48Å; V97-I100 PolarHBondContact O-N 2.88Å; V97-V111 HydrophobicContact CB-CG1 4.26Å; V97-V111 HydrophobicContact CG2-CB 4.17Å; V97-V111 HydrophobicContact CG2-CG1 3.36Å
98	S	52.3	Low	52.4	Low	93 Å²	93	68.7 Å²	68.7	65%	0.65	37%	0.371	S	S	*	.	H	α-helix	trans	-72.8	-25.8	-178.4	66.4	0	0	0	0	114.3	L94 R95 A96 I100	L94-S98 WeakPolarHBondContact O-CB 3.43Å; L94-S98 PolarHBondContact O-N 3.35Å; L94-S98 PolarHBondContact O-OG 3.27Å; R95-S98 WeakPolarHBondContact CA-OG 3.22Å; R95-S98 PolarHBondContact O-N 3.17Å; R95-S98 PolarHBondContact O-OG 3.06Å; A96-S98 VanDerWaalsContact C-N 3.32Å; A96-S98 PolarHBondContact O-N 3.48Å; S98-I100 PolarHBondContact O-N 2.86Å
99	S	57.5	Low	52.6	Low	74 Å²	74	67.6 Å²	67.6	52%	0.517	36%	0.362	S	S	.	.	H	α-helix	trans	-71	-14.9	177.2	74.2	0	0	0	0	112.4	R95 A96 F101	R95-S99 WeakPolarHBondContact O-CB 3.46Å; R95-S99 PolarHBondContact O-N 3.48Å; A96-S99 PolarHBondContact O-N 3.4Å; A96-S99 PolarHBondContact O-OG 2.85Å; S99-F101 PolarHBondContact O-N 3.28Å
100	I	52.7	Low	52.7	Low	28 Å²	28	66.7 Å²	66.7	14%	0.144	35%	0.352	C	S	.	.	S	Bend	trans	-90.4	109.5	-179	-59.4	161.2	0	0	0	107.7	A96 V97 S98 D102 V107 V111 F166	A96-I100 WeakPolarHBondContact O-CD1 3.49Å; A96-I100 VanDerWaalsContact O-CG1 3.32Å; A96-I100 WeakPolarHBondContact O-CG1 3.31Å; V97-I100 PolarHBondContact O-N 2.88Å; S98-I100 PolarHBondContact O-N 2.86Å; I100-D102 PolarHBondContact O-N 3.1Å; I100-V107 HydrophobicContact CG2-CB 4.24Å; I100-V107 HydrophobicContact CG2-CG1 3.69Å; I100-V107 HydrophobicContact CG2-CG2 4.48Å; I100-V111 HydrophobicContact CD1-CG1 4.23Å; I100-V111 HydrophobicContact CD1-CG2 3.71Å; I100-F166 HydrophobicContact CB-CE1 4.05Å; I100-F166 HydrophobicContact CB-CZ 4.39Å; I100-F166 HydrophobicContact CD1-CE1 3.43Å; I100-F166 VanDerWaalsContact CD1-CE1 3.43Å; I100-F166 HydrophobicContact CD1-CZ 3.58Å; I100-F166 HydrophobicContact CG1-CE1 3.45Å; I100-F166 VanDerWaalsContact CG1-CE1 3.45Å; I100-F166 HydrophobicContact CG1-CZ 3.42Å; I100-F166 VanDerWaalsContact CG1-CZ 3.42Å; I100-F166 HydrophobicContact CG2-CD1 3.84Å; I100-F166 HydrophobicContact CG2-CE1 3.38Å; I100-F166 HydrophobicContact CG2-CZ 4.12Å
101	F	50.3	Low	52.9	Low	155 Å²	155	61.7 Å²	61.7	68%	0.68	33%	0.333	S	S	*	.			trans	-62.3	103.2	166.9	-172	-109.7	0	0	0	108.4	S99 P103	S99-F101 PolarHBondContact O-N 3.28Å; F101-P103 HydrophobicContact CD1-CB 4.23Å; F101-P103 VanDerWaalsContact CD1-CD 3.48Å; F101-P103 HydrophobicContact CD1-CG 3.76Å; F101-P103 HydrophobicContact CE1-CB 3.62Å; F101-P103 HydrophobicContact CE1-CG 3.53Å; F101-P103 HydrophobicContact CZ-CB 3.96Å; F101-P103 HydrophobicContact CZ-CG 4.35Å; F101-P103 WeakPolarHBondContact O-CD 3.39Å
102	D	58.2	Low	52.9	Low	41 Å²	41	55.5 Å²	55.5	22%	0.219	32%	0.315	C	S	.	.			trans	-107	70.4	176.4	-175	17.8	0	0	0	110.6	I100 L104 G105 F106 V107 S108	I100-D102 PolarHBondContact O-N 3.1Å; D102-L104 PolarHBondContact O-N 3.1Å; D102-G105 VanDerWaalsContact CG-CA 3.44Å; D102-G105 PolarHBondContact O-N 2.89Å; D102-G105 WeakPolarHBondContact OD1-CA 3.46Å; D102-G105 PolarHBondContact OD1-N 2.99Å; D102-G105 WeakPolarHBondContact OD2-CA 3.42Å; D102-F106 PolarHBondContact OD1-N 3.43Å; D102-F106 PolarHBondContact OD2-N 3.45Å; D102-V107 HydrophobicContact CB-CB 3.96Å; D102-V107 HydrophobicContact CB-CG2 4.28Å; D102-V107 WeakPolarHBondContact OD1-CG2 3.37Å; D102-V107 PolarHBondContact OD1-N 3.37Å; D102-V107 WeakPolarHBondContact OD2-CA 3.35Å; D102-V107 PolarHBondContact OD2-N 3.29Å; D102-S108 PolarHBondContact OD2-N 3.18Å
103	P	49.8	Very low	52.5	Low	29 Å²	29	62.8 Å²	62.8	19%	0.188	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.4	-175.8	25	-32.6	0	0	0	111.2	F101 P142 V163	F101-P103 HydrophobicContact CD1-CB 4.23Å; F101-P103 VanDerWaalsContact CD1-CD 3.48Å; F101-P103 HydrophobicContact CD1-CG 3.76Å; F101-P103 HydrophobicContact CE1-CB 3.62Å; F101-P103 HydrophobicContact CE1-CG 3.53Å; F101-P103 HydrophobicContact CZ-CB 3.96Å; F101-P103 HydrophobicContact CZ-CG 4.35Å; F101-P103 WeakPolarHBondContact O-CD 3.39Å; P103-P142 WeakPolarHBondContact O-CB 3.41Å; P103-V163 HydrophobicContact CG-CG2 4.36Å
104	L	54	Low	52	Low	21 Å²	21	71.4 Å²	71.4	11%	0.11	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-2.3	-173.8	-61.2	160.3	0	0	0	113.7	D102 F106 P142 L146 V160 V163	D102-L104 PolarHBondContact O-N 3.1Å; L104-F106 HydrophobicContact CB-CB 4.48Å; L104-F106 HydrophobicContact CB-CD2 3.24Å; L104-F106 HydrophobicContact CB-CE2 3.48Å; L104-F106 VanDerWaalsContact CB-CE2 3.48Å; L104-F106 HydrophobicContact CB-CG 3.91Å; L104-F106 HydrophobicContact CB-CZ 4.3Å; L104-F106 HydrophobicContact CD1-CD2 3.67Å; L104-F106 HydrophobicContact CD1-CE2 3.72Å; L104-F106 HydrophobicContact CD2-CE2 4.24Å; L104-F106 HydrophobicContact CG-CD2 4.02Å; L104-F106 HydrophobicContact CG-CE2 4Å; L104-F106 PolarHBondContact O-N 2.81Å; L104-F106 VanDerWaalsContact O-N 3.15Å; L104-P142 HydrophobicContact CD2-CB 3.93Å; L104-P142 HydrophobicContact CD2-CG 3.9Å; L104-L146 HydrophobicContact CD2-CD1 4.3Å; L104-V160 HydrophobicContact CD1-CB 4.38Å; L104-V160 HydrophobicContact CD1-CG1 4Å; L104-V160 HydrophobicContact CD1-CG2 4Å; L104-V163 HydrophobicContact CD1-CG1 4.5Å
105	G	53.7	Low	51.1	Low	39 Å²	39	71.3 Å²	71.3	40%	0.402	37%	0.374	S	S	.	.	S	Bend	trans	66.4	7.1	-173.5	0	0	0	0	0	114.3	D102 P109	D102-G105 VanDerWaalsContact CG-CA 3.44Å; D102-G105 PolarHBondContact O-N 2.89Å; D102-G105 WeakPolarHBondContact OD1-CA 3.46Å; D102-G105 PolarHBondContact OD1-N 2.99Å; D102-G105 WeakPolarHBondContact OD2-CA 3.42Å; G105-P109 WeakPolarHBondContact O-CD 3.39Å
106	F	57.1	Low	50.5	Low	77 Å²	77	67.9 Å²	67.9	34%	0.338	37%	0.369	S	S	.	.			trans	-78	-25.8	-176.3	-67.9	-40.2	0	0	0	112.4	D102 L104 P109 I110 F164 A193	D102-F106 PolarHBondContact OD1-N 3.43Å; D102-F106 PolarHBondContact OD2-N 3.45Å; L104-F106 HydrophobicContact CB-CB 4.48Å; L104-F106 HydrophobicContact CB-CD2 3.24Å; L104-F106 HydrophobicContact CB-CE2 3.48Å; L104-F106 VanDerWaalsContact CB-CE2 3.48Å; L104-F106 HydrophobicContact CB-CG 3.91Å; L104-F106 HydrophobicContact CB-CZ 4.3Å; L104-F106 HydrophobicContact CD1-CD2 3.67Å; L104-F106 HydrophobicContact CD1-CE2 3.72Å; L104-F106 HydrophobicContact CD2-CE2 4.24Å; L104-F106 HydrophobicContact CG-CD2 4.02Å; L104-F106 HydrophobicContact CG-CE2 4Å; L104-F106 PolarHBondContact O-N 2.81Å; L104-F106 VanDerWaalsContact O-N 3.15Å; F106-P109 WeakPolarHBondContact O-CD 3.5Å; F106-I110 WeakPolarHBondContact O-CD1 3.48Å; F106-I110 VanDerWaalsContact O-CG1 3.25Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; F106-F164 HydrophobicContact CB-CE1 4.33Å; F106-F164 AromaticContact CD2-CE1 3.58Å; F106-F164 HydrophobicContact CD2-CE1 3.58Å; F106-F164 AromaticContact CD2-CZ 3.8Å; F106-F164 HydrophobicContact CD2-CZ 3.8Å; F106-F164 HydrophobicContact CE2-CE1 4.08Å; F106-F164 AromaticContact CE2-CZ 3.83Å; F106-F164 HydrophobicContact CE2-CZ 3.83Å; F106-F164 HydrophobicContact CG-CE1 4.03Å; F106-A193 HydrophobicContact CE2-CB 4.48Å
107	V	54.7	Low	50.1	Low	2 Å²	2	69.7 Å²	69.7	1%	0.012	37%	0.371	C	S	.	.	S	Bend	trans	-87.3	-28.9	-174.1	-168.7	0	0	0	0	111.1	I100 D102 I110 V111 V163 F166 A167	I100-V107 HydrophobicContact CG2-CB 4.24Å; I100-V107 HydrophobicContact CG2-CG1 3.69Å; I100-V107 HydrophobicContact CG2-CG2 4.48Å; D102-V107 HydrophobicContact CB-CB 3.96Å; D102-V107 HydrophobicContact CB-CG2 4.28Å; D102-V107 WeakPolarHBondContact OD1-CG2 3.37Å; D102-V107 PolarHBondContact OD1-N 3.37Å; D102-V107 WeakPolarHBondContact OD2-CA 3.35Å; D102-V107 PolarHBondContact OD2-N 3.29Å; V107-I110 WeakPolarHBondContact O-CA 3.12Å; V107-I110 WeakPolarHBondContact O-CB 3.38Å; V107-I110 PolarHBondContact O-N 3.41Å; V107-V111 HydrophobicContact CG1-CG2 3.39Å; V107-V111 WeakPolarHBondContact O-CG2 3.45Å; V107-V111 PolarHBondContact O-N 2.73Å; V107-V163 HydrophobicContact CG2-CG1 3.5Å; V107-F166 HydrophobicContact CG1-CD1 4.24Å; V107-F166 HydrophobicContact CG1-CE1 4.22Å; V107-A167 HydrophobicContact CG2-CB 4.43Å
108	S	52.7	Low	49.6	Very low	57 Å²	57	72.4 Å²	72.4	40%	0.399	39%	0.392	S	S	.	.	H	α-helix	trans	-55.9	-42.7	-178	84.9	0	0	0	0	114.7	D102 I110 L112	D102-S108 PolarHBondContact OD2-N 3.18Å; S108-I110 PolarHBondContact O-N 2.77Å; S108-L112 WeakPolarHBondContact O-CB 3.44Å; S108-L112 WeakPolarHBondContact O-CD1 3.25Å; S108-L112 VanDerWaalsContact O-CG 3.31Å; S108-L112 WeakPolarHBondContact O-CG 3.04Å; S108-L112 PolarHBondContact O-N 3.24Å
109	P	49.4	Very low	49.4	Very low	90 Å²	90	74.4 Å²	74.4	58%	0.584	40%	0.395	S	S	*	.	H	α-helix	trans	-76.1	-16.1	178.2	-11.7	30.2	0	0	0	112.7	G105 F106	G105-P109 WeakPolarHBondContact O-CD 3.39Å; F106-P109 WeakPolarHBondContact O-CD 3.5Å
110	I	51.8	Low	48.5	Very low	36 Å²	36	74.8 Å²	74.8	19%	0.185	39%	0.39	C	S	.	.	H	α-helix	trans	-89.1	-42.4	-174.1	-57.8	-177.8	0	0	0	110.8	F106 V107 S108 L112 A167 R171	F106-I110 WeakPolarHBondContact O-CD1 3.48Å; F106-I110 VanDerWaalsContact O-CG1 3.25Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; V107-I110 WeakPolarHBondContact O-CA 3.12Å; V107-I110 WeakPolarHBondContact O-CB 3.38Å; V107-I110 PolarHBondContact O-N 3.41Å; S108-I110 PolarHBondContact O-N 2.77Å; I110-L112 VanDerWaalsContact C-N 3.3Å; I110-A167 HydrophobicContact CD1-CB 3.71Å; I110-A167 HydrophobicContact CG2-CB 4.18Å; I110-R171 HydrophobicContact CG2-CG 4.06Å; I110-R171 VanDerWaalsContact CG2-NH2 3.3Å
111	V	51.5	Low	47.8	Very low	37 Å²	37	79.7 Å²	79.7	22%	0.224	42%	0.424	C	S	.	.	H	α-helix	trans	-72.2	-30.3	177.9	-173	0	0	0	0	110.5	V97 I100 V107 R113	V97-V111 HydrophobicContact CB-CG1 4.26Å; V97-V111 HydrophobicContact CG2-CB 4.17Å; V97-V111 HydrophobicContact CG2-CG1 3.36Å; I100-V111 HydrophobicContact CD1-CG1 4.23Å; I100-V111 HydrophobicContact CD1-CG2 3.71Å; V107-V111 HydrophobicContact CG1-CG2 3.39Å; V107-V111 WeakPolarHBondContact O-CG2 3.45Å; V107-V111 PolarHBondContact O-N 2.73Å; V111-R113 VanDerWaalsContact C-N 3.26Å; V111-R113 PolarHBondContact O-N 2.94Å
112	L	51	Low	47.7	Very low	80 Å²	80	76.4 Å²	76.4	42%	0.419	43%	0.434	S	S	.	.	S	Bend	trans	-79.3	70	171.7	-64.8	173.7	0	0	0	110.9	S108 I110 R114	S108-L112 WeakPolarHBondContact O-CB 3.44Å; S108-L112 WeakPolarHBondContact O-CD1 3.25Å; S108-L112 VanDerWaalsContact O-CG 3.31Å; S108-L112 WeakPolarHBondContact O-CG 3.04Å; S108-L112 PolarHBondContact O-N 3.24Å; I110-L112 VanDerWaalsContact C-N 3.3Å; L112-R114 PolarHBondContact O-N 3.36Å
113	R	42.6	Very low	46.7	Very low	161 Å²	161	77.1 Å²	77.1	61%	0.608	44%	0.441	S	S	*	.			trans	-69.5	121.2	174.8	-157	177.7	-177.9	162.9	0.7	109.8	V111 S115 T116	V111-R113 VanDerWaalsContact C-N 3.26Å; V111-R113 PolarHBondContact O-N 2.94Å; R113-S115 WeakPolarHBondContact CD-OG 3.42Å; R113-S115 WeakPolarHBondContact CG-OG 3.49Å; R113-S115 PolarHBondContact O-N 3.3Å; R113-T116 PolarHBondContact O-N 3.38Å; R113-T116 PolarHBondContact O-OG1 3.16Å; R113-T116 VanDerWaalsContact O-OG1 3.08Å
114	R	40.4	Very low	45.9	Very low	226 Å²	226	79.2 Å²	79.2	85%	0.853	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-52.7	-23.8	177.7	-168.6	173.8	-179.2	142.5	-1.8	114	L112 T116 F117	L112-R114 PolarHBondContact O-N 3.36Å; R114-T116 VanDerWaalsContact C-N 3.34Å; R114-T116 PolarHBondContact O-N 2.82Å; R114-F117 PolarHBondContact O-N 2.98Å
115	S	35.8	Very low	45.4	Very low	56 Å²	56	83.5 Å²	83.5	39%	0.392	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-71.7	-20.8	-177	62.8	0	0	0	0	114.5	R113 F117 S118	R113-S115 WeakPolarHBondContact CD-OG 3.42Å; R113-S115 WeakPolarHBondContact CG-OG 3.49Å; R113-S115 PolarHBondContact O-N 3.3Å; S115-F117 VanDerWaalsContact C-N 3.28Å; S115-S118 PolarHBondContact O-OG 3.35Å; S115-S118 VanDerWaalsContact O-OG 3.11Å
116	T	41.3	Very low	44.7	Very low	64 Å²	64	86.6 Å²	86.6	39%	0.393	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-82.3	-8.5	177	53.2	0	0	0	0	113.2	R113 R114	R113-T116 PolarHBondContact O-N 3.38Å; R113-T116 PolarHBondContact O-OG1 3.16Å; R113-T116 VanDerWaalsContact O-OG1 3.08Å; R114-T116 VanDerWaalsContact C-N 3.34Å; R114-T116 PolarHBondContact O-N 2.82Å
117	F	43.2	Very low	43.6	Very low	67 Å²	67	91.8 Å²	91.8	29%	0.294	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-20.6	178.6	-101.1	-80.5	0	0	0	113.9	R114 S115 L128	R114-F117 PolarHBondContact O-N 2.98Å; S115-F117 VanDerWaalsContact C-N 3.28Å; F117-L128 HydrophobicContact CD1-CD1 3.56Å; F117-L128 HydrophobicContact CE1-CD1 3.2Å; F117-L128 HydrophobicContact CE1-CD2 3.67Å; F117-L128 HydrophobicContact CE1-CG 4.07Å; F117-L128 HydrophobicContact CZ-CD1 3.98Å; F117-L128 HydrophobicContact CZ-CD2 4.15Å
118	S	42.5	Very low	42.7	Very low	88 Å²	88	94.3 Å²	94.3	62%	0.615	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.9	-179.6	32.3	0	0	0	0	114.1	S115	S115-S118 PolarHBondContact O-OG 3.35Å; S115-S118 VanDerWaalsContact O-OG 3.11Å
119	D	47.2	Very low	41.7	Very low	134 Å²	134	99.5 Å²	99.5	72%	0.717	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	13.4	-174.2	-61	-25.5	0	0	0	113.8	P121	D119-P121 WeakPolarHBondContact O-CD 3.48Å
120	I	39.8	Very low	41.1	Very low	83 Å²	83	100 Å²	100	43%	0.426	56%	0.555	S	S	.	*	S	Bend	trans	-96.8	105.6	174.6	-55.8	175.8	0	0	0	108.4	G122 C123	I120-G122 PolarHBondContact O-N 3.37Å; I120-C123 HydrophobicContact CB-CB 3.99Å; I120-C123 HydrophobicContact CG2-CB 3.91Å; I120-C123 PolarHBondContact O-N 2.95Å
121	P	37.2	Very low	40.1	Very low	130 Å²	130	107.6 Å²	107.6	84%	0.844	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	128.1	175.3	-13.8	27.6	0	0	0	109	D119	D119-P121 WeakPolarHBondContact O-CD 3.48Å
122	G	48.6	Very low	39.5	Very low	87 Å²	87	112.8 Å²	112.8	90%	0.897	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	91	-1.9	177.8	0	0	0	0	0	116.1	I120 S124	I120-G122 PolarHBondContact O-N 3.37Å; G122-S124 PolarHBondContact O-N 2.77Å
123	C	37.4	Very low	38.6	Very low	55 Å²	55	114.5 Å²	114.5	37%	0.372	63%	0.627	S	S	.	*			trans	-87.7	94.2	174.9	-116.8	0	0	0	0	111.5	I120 V125	I120-C123 HydrophobicContact CB-CB 3.99Å; I120-C123 HydrophobicContact CG2-CB 3.91Å; I120-C123 PolarHBondContact O-N 2.95Å; C123-V125 PolarHBondContact O-N 2.73Å
124	S	32.2	Very low	38.3	Very low	73 Å²	73	109.3 Å²	109.3	51%	0.51	62%	0.624	S	S	.	*			trans	-66.6	116.3	162.1	-174.8	0	0	0	0	109.1	G122 S126 K127	G122-S124 PolarHBondContact O-N 2.77Å; S124-S126 PolarHBondContact O-N 2.97Å; S124-S126 PolarHBondContact OG-OG 2.97Å; S124-K127 PolarHBondContact O-N 3.33Å
125	V	43.6	Very low	38	Very low	111 Å²	111	106.5 Å²	106.5	67%	0.673	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-53.4	-20.5	-178.1	179.8	0	0	0	0	112.7	C123 K127	C123-V125 PolarHBondContact O-N 2.73Å; V125-K127 PolarHBondContact O-N 3.22Å
126	S	38	Very low	38.4	Very low	105 Å²	105	109.3 Å²	109.3	73%	0.734	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-76.5	-12.3	179.1	58.1	0	0	0	0	115.3	S124	S124-S126 PolarHBondContact O-N 2.97Å; S124-S126 PolarHBondContact OG-OG 2.97Å
127	K	34.3	Very low	38.6	Very low	185 Å²	185	115.4 Å²	115.4	80%	0.804	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-101.5	4.9	-178.4	-93.6	-177	179.3	177.5	0	115.4	S124 V125 Q129	S124-K127 PolarHBondContact O-N 3.33Å; V125-K127 PolarHBondContact O-N 3.22Å; K127-Q129 PolarHBondContact O-N 3.28Å
128	L	35.8	Very low	39.2	Very low	55 Å²	55	117.8 Å²	117.8	29%	0.288	67%	0.671	S	S	.	*			trans	-76.9	71.6	174.1	-71.6	157.4	0	0	0	110.2	F117 T130	F117-L128 HydrophobicContact CD1-CD1 3.56Å; F117-L128 HydrophobicContact CE1-CD1 3.2Å; F117-L128 HydrophobicContact CE1-CD2 3.67Å; F117-L128 HydrophobicContact CE1-CG 4.07Å; F117-L128 HydrophobicContact CZ-CD1 3.98Å; F117-L128 HydrophobicContact CZ-CD2 4.15Å; L128-T130 VanDerWaalsContact C-N 3.26Å; L128-T130 PolarHBondContact O-N 3.49Å
129	Q	31.7	Very low	39.8	Very low	166 Å²	166	115.3 Å²	115.3	78%	0.776	65%	0.652	S	S	*	*			trans	-61.5	99.5	153.8	-82.6	-170	-16.3	0	0	107	K127 K131	K127-Q129 PolarHBondContact O-N 3.28Å; Q129-K131 PolarHBondContact O-N 2.94Å
130	T	37.2	Very low	40.5	Very low	102 Å²	102	118.1 Å²	118.1	63%	0.626	66%	0.661	S	S	*	*			trans	-64	75.9	173.4	29	0	0	0	0	109.6	L128 W132	L128-T130 VanDerWaalsContact C-N 3.26Å; L128-T130 PolarHBondContact O-N 3.49Å; T130-W132 VanDerWaalsContact CB-NE1 3.29Å; T130-W132 PolarHBondContact O-N 3.18Å
131	K	31.6	Very low	42	Very low	195 Å²	195	115.8 Å²	115.8	85%	0.848	65%	0.652	S	S	*	*			trans	-72.7	81	163.7	-74.5	-172.3	176.9	-175.7	0	108.4	Q129	Q129-K131 PolarHBondContact O-N 2.94Å
132	W	38.8	Very low	43.5	Very low	146 Å²	146	110.5 Å²	110.5	55%	0.553	62%	0.618	S	S	*	*			trans	-89.9	129.4	168.4	-64.1	84.3	0	0	0	108.8	L94 T130	L94-W132 HydrophobicContact CD2-CE3 3.91Å; L94-W132 HydrophobicContact CD2-CH2 3.06Å; L94-W132 HydrophobicContact CD2-CZ2 3.99Å; L94-W132 HydrophobicContact CD2-CZ3 3.02Å; L94-W132 HydrophobicContact CG-CZ3 4.49Å; T130-W132 VanDerWaalsContact CB-NE1 3.29Å; T130-W132 PolarHBondContact O-N 3.18Å
133	A	31	Very low	45	Very low	115 Å²	115	106.4 Å²	106.4	95%	0.95	58%	0.575	S	S	*	*			trans	-114.5	77.2	163.1	0	0	0	0	0	107.3
134	G	35.7	Very low	46.9	Very low	52 Å²	52	105 Å²	105	54%	0.536	57%	0.568	S	S	.	*	S	Bend	trans	-143.5	127	168.1	0	0	0	0	0	106.2	T136	G134-T136 PolarHBondContact O-N 2.91Å
135	H	36.1	Very low	49.1	Very low	168 Å²	168	105.3 Å²	105.3	78%	0.778	56%	0.564	S	S	*	*			trans	-73.5	87.3	174.9	-172.7	74.8	0	0	0	108.2	R137	H135-R137 VanDerWaalsContact C-N 3.3Å; H135-R137 PolarHBondContact O-N 3.03Å; H135-R137 VanDerWaalsContact O-N 3.09Å
136	T	44	Very low	51	Low	115 Å²	115	100.5 Å²	100.5	71%	0.706	53%	0.534	S	S	*	.			trans	-70.5	98.7	156	50.6	0	0	0	0	105.6	G134 V138	G134-T136 PolarHBondContact O-N 2.91Å; T136-V138 PolarHBondContact O-N 2.99Å
137	R	45.8	Very low	53.2	Low	191 Å²	191	96 Å²	96	72%	0.721	50%	0.502	S	S	*	.			trans	-65.4	97	161.6	-165.5	177.9	-173.6	-163.7	0.5	104.9	H135 T139	H135-R137 VanDerWaalsContact C-N 3.3Å; H135-R137 PolarHBondContact O-N 3.03Å; H135-R137 VanDerWaalsContact O-N 3.09Å; R137-T139 PolarHBondContact O-N 3.29Å
138	V	53.9	Low	55.5	Low	118 Å²	118	95.3 Å²	95.3	72%	0.715	50%	0.502	S	S	*	.			trans	-66.2	91.2	167.8	-179.6	0	0	0	0	104.5	T136 Q140	T136-V138 PolarHBondContact O-N 2.99Å; V138-Q140 PolarHBondContact O-N 3.21Å; V138-Q140 VanDerWaalsContact O-N 3.16Å
139	T	57	Low	57.8	Low	36 Å²	36	100 Å²	100	22%	0.221	52%	0.519	C	S	.	.			trans	-62	120.6	171.4	-57.4	0	0	0	0	105.8	R137 S141 D145	R137-T139 PolarHBondContact O-N 3.29Å; T139-S141 WeakPolarHBondContact CG2-O 3.41Å; T139-S141 PolarHBondContact O-N 3.18Å; T139-D145 HydrophobicContact CG2-CB 4.49Å; T139-D145 VanDerWaalsContact CG2-CG 3.47Å; T139-D145 WeakPolarHBondContact CG2-OD2 2.86Å; T139-D145 PolarHBondContact OG1-OD2 3.44Å
140	Q	61.6	Low	60.4	Low	193 Å²	193	93.9 Å²	93.9	90%	0.902	49%	0.491	S	S	*	.	S	Bend	trans	-60.8	-27	179.6	-66.6	-177.4	-5.8	0	0	111.7	V138	V138-Q140 PolarHBondContact O-N 3.21Å; V138-Q140 VanDerWaalsContact O-N 3.16Å
141	S	69.9	Low	62.7	Low	34 Å²	34	99.5 Å²	99.5	24%	0.238	50%	0.5	C	S	.	.			trans	-138.3	81.4	179.9	46.9	0	0	0	0	110.6	T139 L143 A144 D145 E201	T139-S141 WeakPolarHBondContact CG2-O 3.41Å; T139-S141 PolarHBondContact O-N 3.18Å; S141-L143 PolarHBondContact O-N 3.16Å; S141-A144 WeakPolarHBondContact O-CA 3.29Å; S141-A144 VanDerWaalsContact O-CB 3.28Å; S141-A144 WeakPolarHBondContact O-CB 3.48Å; S141-A144 PolarHBondContact O-N 2.91Å; S141-A144 VanDerWaalsContact OG-CB 3.28Å; S141-A144 WeakPolarHBondContact OG-CB 3.35Å; S141-D145 PolarHBondContact O-N 3.17Å; S141-E201 VanDerWaalsContact CB-CD 3.5Å; S141-E201 WeakPolarHBondContact CB-OE2 2.99Å
142	P	70.2	Confident	65.4	Low	19 Å²	19	94.7 Å²	94.7	12%	0.123	48%	0.481	C	S	.	.	H	α-helix	trans	-65.6	-25.5	-177	30.2	-38.2	0	0	0	113.1	P103 L104 L146	P103-P142 WeakPolarHBondContact O-CB 3.41Å; L104-P142 HydrophobicContact CD2-CB 3.93Å; L104-P142 HydrophobicContact CD2-CG 3.9Å; P142-L146 PolarHBondContact O-N 3.13Å
143	L	80.3	Confident	67.9	Low	0 Å²	0	88.6 Å²	88.6	0%	0	46%	0.459	C	S	.	.	H	α-helix	trans	-67.3	-37.8	169.7	-176.2	65.3	0	0	0	111.5	S141 D145 L146 T147 I156 C194 A198 L262	S141-L143 PolarHBondContact O-N 3.16Å; L143-D145 VanDerWaalsContact C-N 3.33Å; L143-D145 PolarHBondContact O-N 3.15Å; L143-L146 PolarHBondContact O-N 2.86Å; L143-T147 HydrophobicContact CD1-CG2 3.98Å; L143-T147 HydrophobicContact CG-CG2 3.88Å; L143-T147 WeakPolarHBondContact O-CB 3.48Å; L143-T147 WeakPolarHBondContact O-CG2 3.32Å; L143-T147 PolarHBondContact O-N 2.96Å; L143-T147 PolarHBondContact O-OG1 3.27Å; L143-I156 HydrophobicContact CD1-CG2 4.37Å; L143-C194 HydrophobicContact CD1-CB 4.08Å; L143-C194 HydrophobicContact CD2-CB 4.36Å; L143-C194 WeakPolarHBondContact CD2-O 3.41Å; L143-A198 HydrophobicContact CD2-CB 4.05Å; L143-L262 HydrophobicContact CD2-CD2 4.2Å
144	A	77.3	Confident	70.7	Confident	27 Å²	27	88.6 Å²	88.6	22%	0.223	44%	0.437	C	S	.	.	H	α-helix	trans	-60.6	-43.5	177.4	0	0	0	0	0	111.2	S141 L146 T147 H148	S141-A144 WeakPolarHBondContact O-CA 3.29Å; S141-A144 VanDerWaalsContact O-CB 3.28Å; S141-A144 WeakPolarHBondContact O-CB 3.48Å; S141-A144 PolarHBondContact O-N 2.91Å; S141-A144 VanDerWaalsContact OG-CB 3.28Å; S141-A144 WeakPolarHBondContact OG-CB 3.35Å; A144-L146 VanDerWaalsContact C-N 3.34Å; A144-L146 PolarHBondContact O-N 2.97Å; A144-T147 WeakPolarHBondContact CA-OG1 3.04Å; A144-T147 PolarHBondContact O-N 3.35Å; A144-T147 PolarHBondContact O-OG1 3.43Å; A144-H148 WeakPolarHBondContact O-CB 3.46Å; A144-H148 PolarHBondContact O-N 3.02Å
145	D	78.4	Confident	73.3	Confident	79 Å²	79	90.6 Å²	90.6	42%	0.422	43%	0.431	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.1	-77.6	-8.5	0	0	0	111.7	T139 S141 L143 K149	T139-D145 HydrophobicContact CG2-CB 4.49Å; T139-D145 VanDerWaalsContact CG2-CG 3.47Å; T139-D145 WeakPolarHBondContact CG2-OD2 2.86Å; T139-D145 PolarHBondContact OG1-OD2 3.44Å; S141-D145 PolarHBondContact O-N 3.17Å; L143-D145 VanDerWaalsContact C-N 3.33Å; L143-D145 PolarHBondContact O-N 3.15Å; D145-K149 VanDerWaalsContact O-CB 3.28Å; D145-K149 WeakPolarHBondContact O-CB 3.48Å; D145-K149 PolarHBondContact O-N 3.16Å
146	L	82.6	Confident	75.9	Confident	10 Å²	10	82.6 Å²	82.6	5%	0.052	39%	0.394	C	S	.	.	H	α-helix	trans	-65.8	-44.5	177.6	-72	175.7	0	0	0	112.2	L104 P142 L143 A144 H148 K149 F150 I156 I159 V160	L104-L146 HydrophobicContact CD2-CD1 4.3Å; P142-L146 PolarHBondContact O-N 3.13Å; L143-L146 PolarHBondContact O-N 2.86Å; A144-L146 VanDerWaalsContact C-N 3.34Å; A144-L146 PolarHBondContact O-N 2.97Å; L146-H148 VanDerWaalsContact C-N 3.31Å; L146-H148 PolarHBondContact O-N 3.05Å; L146-K149 PolarHBondContact O-N 2.9Å; L146-F150 HydrophobicContact CD2-CD2 4.29Å; L146-F150 HydrophobicContact CD2-CE2 4.14Å; L146-F150 PolarHBondContact O-N 2.87Å; L146-I156 HydrophobicContact CB-CG2 4.46Å; L146-I156 HydrophobicContact CD1-CG2 4.48Å; L146-I159 HydrophobicContact CD2-CG2 4.26Å; L146-V160 HydrophobicContact CD1-CG2 4.16Å
147	T	84.3	Confident	78.3	Confident	11 Å²	11	78.1 Å²	78.1	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-69.5	-28.3	-179.3	66.2	0	0	0	0	112.7	L143 A144 F150 I156 P261 M265	L143-T147 HydrophobicContact CD1-CG2 3.98Å; L143-T147 HydrophobicContact CG-CG2 3.88Å; L143-T147 WeakPolarHBondContact O-CB 3.48Å; L143-T147 WeakPolarHBondContact O-CG2 3.32Å; L143-T147 PolarHBondContact O-N 2.96Å; L143-T147 PolarHBondContact O-OG1 3.27Å; A144-T147 WeakPolarHBondContact CA-OG1 3.04Å; A144-T147 PolarHBondContact O-N 3.35Å; A144-T147 PolarHBondContact O-OG1 3.43Å; T147-F150 CarbonylContact C-O 3.57Å; T147-I156 HydrophobicContact CG2-CD1 4.24Å; T147-P261 HydrophobicContact CG2-CB 4.23Å; T147-P261 WeakPolarHBondContact OG1-CB 3.48Å; T147-M265 HydrophobicContact CG2-CE 3.5Å; T147-M265 VanDerWaalsContact CG2-CE 3.5Å
148	H	82.4	Confident	80.4	Confident	170 Å²	170	72.3 Å²	72.3	79%	0.787	35%	0.349	S	S	*	.	H	α-helix	trans	-77.2	-36.8	173.7	-172.4	-81.7	0	0	0	111.4	A144 L146	A144-H148 WeakPolarHBondContact O-CB 3.46Å; A144-H148 PolarHBondContact O-N 3.02Å; L146-H148 VanDerWaalsContact C-N 3.31Å; L146-H148 PolarHBondContact O-N 3.05Å
149	K	83.9	Confident	82.1	Confident	152 Å²	152	68.8 Å²	68.8	66%	0.661	33%	0.326	S	S	*	.	H	α-helix	trans	-75.8	-35.5	-179.8	-173.7	172.6	-179	175.7	0	113	D145 L146	D145-K149 VanDerWaalsContact O-CB 3.28Å; D145-K149 WeakPolarHBondContact O-CB 3.48Å; D145-K149 PolarHBondContact O-N 3.16Å; L146-K149 PolarHBondContact O-N 2.9Å
150	F	86.4	Confident	83.6	Confident	39 Å²	39	67.1 Å²	67.1	17%	0.171	32%	0.315	C	S	.	.			trans	-125.5	132.9	-176.1	-56.1	-68.3	0	0	0	110.5	L146 T147 K155 I156 I159	L146-F150 HydrophobicContact CD2-CD2 4.29Å; L146-F150 HydrophobicContact CD2-CE2 4.14Å; L146-F150 PolarHBondContact O-N 2.87Å; T147-F150 CarbonylContact C-O 3.57Å; F150-K155 HydrophobicContact CD1-CD 3.64Å; F150-K155 HydrophobicContact CD1-CG 4.32Å; F150-K155 HydrophobicContact CE1-CD 4.05Å; F150-K155 HydrophobicContact CG-CD 4.24Å; F150-I156 HydrophobicContact CB-CD1 4.32Å; F150-I156 HydrophobicContact CB-CG1 3.94Å; F150-I159 HydrophobicContact CD2-CD1 3.79Å; F150-I159 HydrophobicContact CE2-CD1 3.38Å; F150-I159 HydrophobicContact CZ-CD1 3.85Å
151	R	84.7	Confident	85	Confident	220 Å²	220	58 Å²	58	83%	0.83	27%	0.273	S	S	*	.			trans	-98.5	7.2	177.5	-64.3	-172	176.4	-134.4	0.7	113.9
152	E	88.4	Confident	85.9	Confident	94 Å²	94	60.7 Å²	60.7	44%	0.439	29%	0.285	S	S	.	.			trans	-115.6	118.9	-175.5	-173.9	-176.8	-172	0	0	110.1	K154 K155 I156	E152-K154 HydrophobicContact CG-CB 4.33Å; E152-K154 PolarHBondContact O-N 3.4Å; E152-K155 HydrophobicContact CB-CB 4.03Å; E152-K155 HydrophobicContact CG-CB 4.3Å; E152-K155 PolarHBondContact O-N 3.29Å; E152-I156 PolarHBondContact O-N 3.3Å
153	L	91.1	Very high	86.6	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.089	28%	0.283	C	S	.	.	H	α-helix	trans	-58.6	-47.8	-178.1	179.8	61.8	0	0	0	111.4	K155 I156 L157 L262 M265 I266 E269	L153-K155 VanDerWaalsContact C-N 3.26Å; L153-K155 PolarHBondContact O-N 2.67Å; L153-I156 PolarHBondContact O-N 3.02Å; L153-I156 VanDerWaalsContact O-N 3.12Å; L153-L157 HydrophobicContact CD1-CD1 4.35Å; L153-L157 HydrophobicContact CD1-CD2 4.48Å; L153-L157 HydrophobicContact CD1-CG 4.19Å; L153-L157 HydrophobicContact CG-CD1 4.07Å; L153-L157 HydrophobicContact CG-CG 4.3Å; L153-L157 WeakPolarHBondContact O-CG 3.3Å; L153-L157 PolarHBondContact O-N 3.09Å; L153-L262 HydrophobicContact CD1-CD1 3.76Å; L153-M265 HydrophobicContact CB-CB 4.46Å; L153-I266 HydrophobicContact CD1-CG1 4.37Å; L153-I266 HydrophobicContact CD2-CG1 3.8Å; L153-E269 HydrophobicContact CD2-CB 4.46Å
154	K	91.5	Very high	87	Confident	115 Å²	115	61.7 Å²	61.7	50%	0.5	29%	0.288	S	S	.	.	H	α-helix	trans	-55.4	-40.9	179.1	-72.4	173.7	172	139.4	0	112.3	E152 L157 N158 E269	E152-K154 HydrophobicContact CG-CB 4.33Å; E152-K154 PolarHBondContact O-N 3.4Å; K154-L157 PolarHBondContact O-N 3.41Å; K154-N158 WeakPolarHBondContact O-CB 3.32Å; K154-N158 VanDerWaalsContact O-CG 3.24Å; K154-N158 PolarHBondContact O-N 3.04Å; K154-N158 PolarHBondContact O-ND2 2.91Å; K154-E269 VanDerWaalsContact CE-OE1 3.25Å; K154-E269 WeakPolarHBondContact CE-OE1 3.29Å; K154-E269 IonicContact NZ-OE1 3.62Å; K154-E269 PolarHBondContact NZ-OE1 2.88Å
155	K	90.3	Very high	87.5	Confident	94 Å²	94	61.5 Å²	61.5	41%	0.409	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-43.5	178.4	-170.3	168.5	-174.1	171.5	0	112	F150 E152 L153 N158 I159	F150-K155 HydrophobicContact CD1-CD 3.64Å; F150-K155 HydrophobicContact CD1-CG 4.32Å; F150-K155 HydrophobicContact CE1-CD 4.05Å; F150-K155 HydrophobicContact CG-CD 4.24Å; E152-K155 HydrophobicContact CB-CB 4.03Å; E152-K155 HydrophobicContact CG-CB 4.3Å; E152-K155 PolarHBondContact O-N 3.29Å; L153-K155 VanDerWaalsContact C-N 3.26Å; L153-K155 PolarHBondContact O-N 2.67Å; K155-N158 PolarHBondContact O-N 3.02Å; K155-I159 HydrophobicContact CG-CD1 4.26Å; K155-I159 VanDerWaalsContact O-CG1 3.28Å; K155-I159 WeakPolarHBondContact O-CG1 3.49Å; K155-I159 PolarHBondContact O-N 3.07Å
156	I	91	Very high	87.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-46.4	176.6	-65.3	173.7	0	0	0	110.4	L143 L146 T147 F150 E152 L153 N158 I159 V160 M265	L143-I156 HydrophobicContact CD1-CG2 4.37Å; L146-I156 HydrophobicContact CB-CG2 4.46Å; L146-I156 HydrophobicContact CD1-CG2 4.48Å; T147-I156 HydrophobicContact CG2-CD1 4.24Å; F150-I156 HydrophobicContact CB-CD1 4.32Å; F150-I156 HydrophobicContact CB-CG1 3.94Å; E152-I156 PolarHBondContact O-N 3.3Å; L153-I156 PolarHBondContact O-N 3.02Å; L153-I156 VanDerWaalsContact O-N 3.12Å; I156-N158 VanDerWaalsContact C-N 3.32Å; I156-N158 PolarHBondContact O-N 3.26Å; I156-I159 PolarHBondContact O-N 3.18Å; I156-V160 HydrophobicContact CG2-CG2 4.25Å; I156-V160 VanDerWaalsContact O-CG2 3.26Å; I156-V160 WeakPolarHBondContact O-CG2 3.42Å; I156-V160 PolarHBondContact O-N 2.83Å; I156-M265 HydrophobicContact CD1-CE 3.45Å; I156-M265 VanDerWaalsContact CD1-CE 3.45Å; I156-M265 HydrophobicContact CD1-SD 3.66Å
157	L	92.5	Very high	87.8	Confident	22 Å²	22	60.9 Å²	60.9	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-42.7	178.1	-65.9	-178.6	0	0	0	111.7	L153 K154 I159 V160 A161 L187 A190 L191	L153-L157 HydrophobicContact CD1-CD1 4.35Å; L153-L157 HydrophobicContact CD1-CD2 4.48Å; L153-L157 HydrophobicContact CD1-CG 4.19Å; L153-L157 HydrophobicContact CG-CD1 4.07Å; L153-L157 HydrophobicContact CG-CG 4.3Å; L153-L157 WeakPolarHBondContact O-CG 3.3Å; L153-L157 PolarHBondContact O-N 3.09Å; K154-L157 PolarHBondContact O-N 3.41Å; L157-I159 PolarHBondContact O-N 3.31Å; L157-V160 PolarHBondContact O-N 2.8Å; L157-A161 WeakPolarHBondContact O-CB 3.29Å; L157-A161 PolarHBondContact O-N 3.22Å; L157-L187 HydrophobicContact CB-CD2 4.42Å; L157-A190 HydrophobicContact CD2-CB 4.35Å; L157-A190 WeakPolarHBondContact O-CB 3.44Å; L157-L191 VanDerWaalsContact CD2-CA 3.48Å; L157-L191 HydrophobicContact CD2-CB 3.84Å; L157-L191 HydrophobicContact CD2-CD1 4.08Å
158	N	90.7	Very high	87.8	Confident	69 Å²	69	62.7 Å²	62.7	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-40.2	176.1	-74.5	-19.9	0	0	0	112.5	K154 K155 I156 N162 F182 L187	K154-N158 WeakPolarHBondContact O-CB 3.32Å; K154-N158 VanDerWaalsContact O-CG 3.24Å; K154-N158 PolarHBondContact O-N 3.04Å; K154-N158 PolarHBondContact O-ND2 2.91Å; K155-N158 PolarHBondContact O-N 3.02Å; I156-N158 VanDerWaalsContact C-N 3.32Å; I156-N158 PolarHBondContact O-N 3.26Å; N158-N162 VanDerWaalsContact O-CB 3.3Å; N158-N162 WeakPolarHBondContact O-CB 3.42Å; N158-N162 PolarHBondContact O-N 3.46Å; N158-F182 HydrophobicContact CB-CE2 4.14Å; N158-L187 WeakPolarHBondContact OD1-CD2 3.49Å
159	I	88.8	Confident	88	Confident	43 Å²	43	55.9 Å²	55.9	22%	0.221	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-49	176.2	-69.1	164.1	0	0	0	110.1	L146 F150 K155 I156 L157 A161 N162 V163	L146-I159 HydrophobicContact CD2-CG2 4.26Å; F150-I159 HydrophobicContact CD2-CD1 3.79Å; F150-I159 HydrophobicContact CE2-CD1 3.38Å; F150-I159 HydrophobicContact CZ-CD1 3.85Å; K155-I159 HydrophobicContact CG-CD1 4.26Å; K155-I159 VanDerWaalsContact O-CG1 3.28Å; K155-I159 WeakPolarHBondContact O-CG1 3.49Å; K155-I159 PolarHBondContact O-N 3.07Å; I156-I159 PolarHBondContact O-N 3.18Å; L157-I159 PolarHBondContact O-N 3.31Å; I159-A161 PolarHBondContact O-N 3.06Å; I159-N162 WeakPolarHBondContact O-CB 3.2Å; I159-N162 PolarHBondContact O-N 3.46Å; I159-V163 WeakPolarHBondContact O-CG2 3.3Å; I159-V163 PolarHBondContact O-N 2.93Å
160	V	89.9	Confident	87.8	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-41.6	-179.3	176.6	0	0	0	0	110.9	L104 L146 I156 L157 N162 V163 F164 A190 A193	L104-V160 HydrophobicContact CD1-CB 4.38Å; L104-V160 HydrophobicContact CD1-CG1 4Å; L104-V160 HydrophobicContact CD1-CG2 4Å; L146-V160 HydrophobicContact CD1-CG2 4.16Å; I156-V160 HydrophobicContact CG2-CG2 4.25Å; I156-V160 VanDerWaalsContact O-CG2 3.26Å; I156-V160 WeakPolarHBondContact O-CG2 3.42Å; I156-V160 PolarHBondContact O-N 2.83Å; L157-V160 PolarHBondContact O-N 2.8Å; V160-N162 VanDerWaalsContact C-N 3.32Å; V160-N162 PolarHBondContact O-N 3.42Å; V160-V163 PolarHBondContact O-N 3.21Å; V160-F164 HydrophobicContact CG1-CD2 4.02Å; V160-F164 HydrophobicContact CG1-CE2 3.6Å; V160-F164 HydrophobicContact CG1-CZ 4.31Å; V160-F164 WeakPolarHBondContact O-CD2 3.49Å; V160-F164 PolarHBondContact O-N 3.29Å; V160-A190 HydrophobicContact CB-CB 3.95Å; V160-A190 HydrophobicContact CG1-CB 3.8Å; V160-A193 HydrophobicContact CG1-CB 4.38Å
161	A	91.3	Very high	87.5	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-39.9	174.8	0	0	0	0	0	111.6	L157 I159 F164 R165 F182 L187 A190	L157-A161 WeakPolarHBondContact O-CB 3.29Å; L157-A161 PolarHBondContact O-N 3.22Å; I159-A161 PolarHBondContact O-N 3.06Å; A161-F164 PolarHBondContact O-N 3.2Å; A161-R165 VanDerWaalsContact O-CB 3.31Å; A161-R165 WeakPolarHBondContact O-CB 3.28Å; A161-R165 PolarHBondContact O-N 3.44Å; A161-F182 HydrophobicContact CB-CD1 3.76Å; A161-F182 HydrophobicContact CB-CE1 3.75Å; A161-F182 HydrophobicContact CB-CG 4.2Å; A161-F182 HydrophobicContact CB-CZ 4.19Å; A161-L187 HydrophobicContact CB-CD2 4.28Å; A161-A190 HydrophobicContact CB-CB 3.98Å
162	N	87.9	Confident	87.3	Confident	92 Å²	92	47.1 Å²	47.1	49%	0.492	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-44.6	174.6	-163	-49	0	0	0	111.3	N158 I159 V160 F164 R165 F166 F182	N158-N162 VanDerWaalsContact O-CB 3.3Å; N158-N162 WeakPolarHBondContact O-CB 3.42Å; N158-N162 PolarHBondContact O-N 3.46Å; I159-N162 WeakPolarHBondContact O-CB 3.2Å; I159-N162 PolarHBondContact O-N 3.46Å; V160-N162 VanDerWaalsContact C-N 3.32Å; V160-N162 PolarHBondContact O-N 3.42Å; N162-F164 VanDerWaalsContact C-N 3.35Å; N162-F164 PolarHBondContact O-N 3.42Å; N162-R165 PolarHBondContact O-N 3.31Å; N162-F166 WeakPolarHBondContact O-CB 3.28Å; N162-F166 PolarHBondContact O-N 2.98Å; N162-F182 HydrophobicContact CB-CE1 4.5Å; N162-F182 HydrophobicContact CB-CZ 3.9Å
163	V	85.6	Confident	86.8	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.085	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-45.8	176.2	172.7	0	0	0	0	111.2	P103 L104 V107 I159 V160 F166 A167	P103-V163 HydrophobicContact CG-CG2 4.36Å; L104-V163 HydrophobicContact CD1-CG1 4.5Å; V107-V163 HydrophobicContact CG2-CG1 3.5Å; I159-V163 WeakPolarHBondContact O-CG2 3.3Å; I159-V163 PolarHBondContact O-N 2.93Å; V160-V163 PolarHBondContact O-N 3.21Å; V163-F166 PolarHBondContact O-N 3.5Å; V163-A167 PolarHBondContact O-N 3.39Å
164	F	87.4	Confident	86.2	Confident	25 Å²	25	56.9 Å²	56.9	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-46.4	176.5	-71.9	-44	0	0	0	112.8	F106 V160 A161 N162 F166 A167 D168 R189 A193	F106-F164 HydrophobicContact CB-CE1 4.33Å; F106-F164 AromaticContact CD2-CE1 3.58Å; F106-F164 HydrophobicContact CD2-CE1 3.58Å; F106-F164 AromaticContact CD2-CZ 3.8Å; F106-F164 HydrophobicContact CD2-CZ 3.8Å; F106-F164 HydrophobicContact CE2-CE1 4.08Å; F106-F164 AromaticContact CE2-CZ 3.83Å; F106-F164 HydrophobicContact CE2-CZ 3.83Å; F106-F164 HydrophobicContact CG-CE1 4.03Å; V160-F164 HydrophobicContact CG1-CD2 4.02Å; V160-F164 HydrophobicContact CG1-CE2 3.6Å; V160-F164 HydrophobicContact CG1-CZ 4.31Å; V160-F164 WeakPolarHBondContact O-CD2 3.49Å; V160-F164 PolarHBondContact O-N 3.29Å; A161-F164 PolarHBondContact O-N 3.2Å; N162-F164 VanDerWaalsContact C-N 3.35Å; N162-F164 PolarHBondContact O-N 3.42Å; F164-F166 VanDerWaalsContact C-N 3.28Å; F164-F166 PolarHBondContact O-N 2.96Å; F164-A167 WeakPolarHBondContact O-CB 3.42Å; F164-A167 PolarHBondContact O-N 3.46Å; F164-A167 VanDerWaalsContact O-N 3.17Å; F164-D168 PolarHBondContact O-N 2.76Å; F164-R189 HydrophobicContact CD2-CG 4.2Å; F164-R189 HydrophobicContact CE2-CG 4.29Å; F164-A193 HydrophobicContact CE2-CB 3.59Å; F164-A193 HydrophobicContact CZ-CB 3.54Å
165	R	87.5	Confident	85.7	Confident	23 Å²	23	55.5 Å²	55.5	9%	0.087	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-39.4	177.4	-179.2	179.2	-74.8	-174.4	-16.7	111.6	A161 N162 D168 N169 S180 P181 F182 E186	A161-R165 VanDerWaalsContact O-CB 3.31Å; A161-R165 WeakPolarHBondContact O-CB 3.28Å; A161-R165 PolarHBondContact O-N 3.44Å; N162-R165 PolarHBondContact O-N 3.31Å; R165-D168 PolarHBondContact O-N 2.89Å; R165-N169 WeakPolarHBondContact O-CB 3.39Å; R165-N169 VanDerWaalsContact O-CG 3.25Å; R165-N169 PolarHBondContact O-N 2.92Å; R165-S180 PolarHBondContact NH1-O 3.31Å; R165-S180 PolarHBondContact NH2-O 3.31Å; R165-P181 PolarHBondContact NH2-O 3.22Å; R165-P181 VanDerWaalsContact NH2-O 3.09Å; R165-F182 VanDerWaalsContact CZ-CD1 3.46Å; R165-E186 IonicContact CZ-OE1 3.71Å; R165-E186 IonicContact CZ-OE2 3.74Å; R165-E186 IonicContact NE-OE1 3.34Å; R165-E186 PolarHBondContact NE-OE1 3.49Å; R165-E186 IonicContact NE-OE2 2.64Å; R165-E186 IonicContact NH2-OE1 3.03Å; R165-E186 PolarHBondContact NH2-OE1 2.97Å; R165-E186 IonicContact NH2-OE2 2.91Å; R165-E186 PolarHBondContact NH2-OE2 2.78Å
166	F	84.3	Confident	85.2	Confident	74 Å²	74	55.9 Å²	55.9	33%	0.325	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-46.8	175.1	177.4	-89.7	0	0	0	110.8	I100 V107 N162 V163 F164 D168 N169 C170	I100-F166 HydrophobicContact CB-CE1 4.05Å; I100-F166 HydrophobicContact CB-CZ 4.39Å; I100-F166 HydrophobicContact CD1-CE1 3.43Å; I100-F166 VanDerWaalsContact CD1-CE1 3.43Å; I100-F166 HydrophobicContact CD1-CZ 3.58Å; I100-F166 HydrophobicContact CG1-CE1 3.45Å; I100-F166 VanDerWaalsContact CG1-CE1 3.45Å; I100-F166 HydrophobicContact CG1-CZ 3.42Å; I100-F166 VanDerWaalsContact CG1-CZ 3.42Å; I100-F166 HydrophobicContact CG2-CD1 3.84Å; I100-F166 HydrophobicContact CG2-CE1 3.38Å; I100-F166 HydrophobicContact CG2-CZ 4.12Å; V107-F166 HydrophobicContact CG1-CD1 4.24Å; V107-F166 HydrophobicContact CG1-CE1 4.22Å; N162-F166 WeakPolarHBondContact O-CB 3.28Å; N162-F166 PolarHBondContact O-N 2.98Å; V163-F166 PolarHBondContact O-N 3.5Å; F164-F166 VanDerWaalsContact C-N 3.28Å; F164-F166 PolarHBondContact O-N 2.96Å; F166-D168 VanDerWaalsContact C-N 3.32Å; F166-D168 PolarHBondContact O-N 2.93Å; F166-N169 PolarHBondContact O-N 3.23Å; F166-C170 WeakPolarHBondContact CE1-SG 3.43Å; F166-C170 WeakPolarHBondContact CZ-SG 3.48Å; F166-C170 WeakPolarHBondContact O-CB 3.07Å; F166-C170 PolarHBondContact O-N 2.98Å; F166-C170 PolarHBondContact O-SG 3.42Å
167	A	83.2	Confident	84.8	Confident	2 Å²	2	60.9 Å²	60.9	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-39.1	176.6	0	0	0	0	0	112.5	V107 I110 V163 F164 R171	V107-A167 HydrophobicContact CG2-CB 4.43Å; I110-A167 HydrophobicContact CD1-CB 3.71Å; I110-A167 HydrophobicContact CG2-CB 4.18Å; V163-A167 PolarHBondContact O-N 3.39Å; F164-A167 WeakPolarHBondContact O-CB 3.42Å; F164-A167 PolarHBondContact O-N 3.46Å; F164-A167 VanDerWaalsContact O-N 3.17Å; A167-R171 WeakPolarHBondContact O-CG 3.19Å
168	D	85.1	Confident	84.1	Confident	50 Å²	50	63.9 Å²	63.9	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-70.7	-43.9	176.5	-67.4	-22.5	0	0	0	111.1	F164 R165 F166 C170 R171 S172 R189	F164-D168 PolarHBondContact O-N 2.76Å; R165-D168 PolarHBondContact O-N 2.89Å; F166-D168 VanDerWaalsContact C-N 3.32Å; F166-D168 PolarHBondContact O-N 2.93Å; D168-C170 VanDerWaalsContact C-N 3.26Å; D168-C170 PolarHBondContact O-N 2.86Å; D168-R171 WeakPolarHBondContact O-CB 3.21Å; D168-R171 PolarHBondContact O-N 3.35Å; D168-R171 IonicContact OD1-NH1 2.87Å; D168-R171 PolarHBondContact OD1-NH1 3.03Å; D168-S172 PolarHBondContact O-N 3.25Å; D168-S172 PolarHBondContact O-OG 2.77Å; D168-R189 IonicContact OD2-CZ 3.39Å; D168-R189 IonicContact OD2-NH1 3.94Å; D168-R189 PolarHBondContact OD2-NH1 3.33Å; D168-R189 IonicContact OD2-NH2 3.06Å
169	N	86	Confident	83.7	Confident	27 Å²	27	67 Å²	67	14%	0.144	33%	0.334	C	S	.	.	H	α-helix	trans	-62.7	-28.1	174.7	-79.1	-13.2	0	0	0	113.6	R165 F166 R171 R177 M178	R165-N169 WeakPolarHBondContact O-CB 3.39Å; R165-N169 VanDerWaalsContact O-CG 3.25Å; R165-N169 PolarHBondContact O-N 2.92Å; F166-N169 PolarHBondContact O-N 3.23Å; N169-R171 VanDerWaalsContact C-N 3.27Å; N169-R177 HydrophobicContact CB-CB 4.45Å; N169-R177 HydrophobicContact CB-CG 4.07Å; N169-R177 PolarHBondContact O-NE 3.01Å; N169-R177 WeakPolarHBondContact OD1-CA 3.31Å; N169-M178 PolarHBondContact ND2-O 3.3Å; N169-M178 PolarHBondContact OD1-N 3.49Å
170	C	79.3	Confident	83.5	Confident	59 Å²	59	67.7 Å²	67.7	40%	0.399	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-25.8	172.9	-74.2	0	0	0	0	112.7	F166 D168	F166-C170 WeakPolarHBondContact CE1-SG 3.43Å; F166-C170 WeakPolarHBondContact CZ-SG 3.48Å; F166-C170 WeakPolarHBondContact O-CB 3.07Å; F166-C170 PolarHBondContact O-N 2.98Å; F166-C170 PolarHBondContact O-SG 3.42Å; D168-C170 VanDerWaalsContact C-N 3.26Å; D168-C170 PolarHBondContact O-N 2.86Å
171	R	81.1	Confident	83.4	Confident	122 Å²	122	73.3 Å²	73.3	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-89.2	-27.3	177.1	-63.7	166.6	172.2	139.5	-8.4	112.5	I110 A167 D168 N169	I110-R171 HydrophobicContact CG2-CG 4.06Å; I110-R171 VanDerWaalsContact CG2-NH2 3.3Å; A167-R171 WeakPolarHBondContact O-CG 3.19Å; D168-R171 WeakPolarHBondContact O-CB 3.21Å; D168-R171 PolarHBondContact O-N 3.35Å; D168-R171 IonicContact OD1-NH1 2.87Å; D168-R171 PolarHBondContact OD1-NH1 3.03Å; N169-R171 VanDerWaalsContact C-N 3.27Å
172	S	79.7	Confident	83.3	Confident	45 Å²	45	75.9 Å²	75.9	32%	0.315	39%	0.391	S	S	.	.	S	Bend	trans	-80.3	152.7	-178.9	-59.1	0	0	0	0	113.1	D168	D168-S172 PolarHBondContact O-N 3.25Å; D168-S172 PolarHBondContact O-OG 2.77Å
173	H	79.6	Confident	83.5	Confident	129 Å²	129	74.3 Å²	74.3	60%	0.597	39%	0.385	S	S	*	.			trans	-64.5	155.4	168.5	-172.8	-102.3	0	0	0	110.2	S175 D176	H173-S175 PolarHBondContact ND1-N 3.28Å; H173-S175 PolarHBondContact ND1-OG 2.98Å; H173-S175 PolarHBondContact O-N 3.33Å; H173-S175 VanDerWaalsContact O-N 3.13Å; H173-D176 PolarHBondContact O-N 3.47Å
174	R	78.5	Confident	83.9	Confident	188 Å²	188	78.9 Å²	78.9	71%	0.709	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-56.2	-33	-175.4	-75.6	-177.4	179.2	-109.1	1.3	113.4	D176	R174-D176 VanDerWaalsContact C-N 3.29Å; R174-D176 PolarHBondContact O-N 3.44Å
175	S	79.3	Confident	84.1	Confident	86 Å²	86	81.1 Å²	81.1	60%	0.601	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-66.5	-28.6	177.5	51.2	0	0	0	0	113.5	H173	H173-S175 PolarHBondContact ND1-N 3.28Å; H173-S175 PolarHBondContact ND1-OG 2.98Å; H173-S175 PolarHBondContact O-N 3.33Å; H173-S175 VanDerWaalsContact O-N 3.13Å
176	D	81	Confident	84.4	Confident	102 Å²	102	81.5 Å²	81.5	55%	0.545	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-102.2	7.9	-170.7	-43.6	-28.1	0	0	0	111.3	H173 R174 M178	H173-D176 PolarHBondContact O-N 3.47Å; R174-D176 VanDerWaalsContact C-N 3.29Å; R174-D176 PolarHBondContact O-N 3.44Å; D176-M178 PolarHBondContact O-N 2.94Å
177	R	82.8	Confident	84.8	Confident	105 Å²	105	80.4 Å²	80.4	40%	0.396	44%	0.435	S	S	.	.			trans	-74	128.1	179.9	-69.6	-179.8	-179.1	179.3	-1.3	109.9	N169	N169-R177 HydrophobicContact CB-CB 4.45Å; N169-R177 HydrophobicContact CB-CG 4.07Å; N169-R177 PolarHBondContact O-NE 3.01Å; N169-R177 WeakPolarHBondContact OD1-CA 3.31Å
178	M	77.5	Confident	85.3	Confident	85 Å²	85	83.8 Å²	83.8	42%	0.419	45%	0.453	S	S	.	.			trans	-86.9	126.6	178.6	-62.2	-179.4	69.6	0	0	110.1	N169 D176	N169-M178 PolarHBondContact ND2-O 3.3Å; N169-M178 PolarHBondContact OD1-N 3.49Å; D176-M178 PolarHBondContact O-N 2.94Å
179	T	82	Confident	85.7	Confident	133 Å²	133	87 Å²	87	82%	0.816	46%	0.461	S	S	*	.			trans	-126.9	4.6	174.3	58.2	0	0	0	0	112.8
180	S	84.5	Confident	86	Confident	58 Å²	58	85.7 Å²	85.7	41%	0.406	45%	0.454	S	S	.	.	S	Bend	trans	-68	171.1	177	53.6	0	0	0	0	112.1	R165	R165-S180 PolarHBondContact NH1-O 3.31Å; R165-S180 PolarHBondContact NH2-O 3.31Å
181	P	88.1	Confident	86.7	Confident	119 Å²	119	83.8 Å²	83.8	77%	0.773	44%	0.44	S	S	*	.	S	Bend	trans	-52.7	157.9	168.4	-27	36.4	0	0	0	112.7	R165 T183	R165-P181 PolarHBondContact NH2-O 3.22Å; R165-P181 VanDerWaalsContact NH2-O 3.09Å; P181-T183 PolarHBondContact O-N 2.86Å
182	F	89.2	Confident	87.2	Confident	56 Å²	56	78.3 Å²	78.3	25%	0.246	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-65.2	131.2	178.4	-65.1	-65.2	0	0	0	111	N158 A161 N162 R165 E186 L187	N158-F182 HydrophobicContact CB-CE2 4.14Å; A161-F182 HydrophobicContact CB-CD1 3.76Å; A161-F182 HydrophobicContact CB-CE1 3.75Å; A161-F182 HydrophobicContact CB-CG 4.2Å; A161-F182 HydrophobicContact CB-CZ 4.19Å; N162-F182 HydrophobicContact CB-CE1 4.5Å; N162-F182 HydrophobicContact CB-CZ 3.9Å; R165-F182 VanDerWaalsContact CZ-CD1 3.46Å; F182-E186 HydrophobicContact CD1-CB 4.48Å; F182-L187 HydrophobicContact CB-CD2 4Å; F182-L187 HydrophobicContact CB-CG 4.03Å; F182-L187 HydrophobicContact CG-CD2 4.37Å
183	T	92.4	Very high	87.8	Confident	59 Å²	59	76.9 Å²	76.9	36%	0.362	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-72.8	154.9	170.4	62.5	0	0	0	0	109.8	P181 A185 E186 L187	P181-T183 PolarHBondContact O-N 2.86Å; T183-A185 PolarHBondContact O-N 3.4Å; T183-E186 PolarHBondContact N-OE2 3.38Å; T183-E186 PolarHBondContact O-N 3.18Å; T183-E186 WeakPolarHBondContact OG1-CG 3.44Å; T183-E186 PolarHBondContact OG1-N 2.78Å; T183-E186 PolarHBondContact OG1-OE2 2.9Å; T183-L187 PolarHBondContact O-N 3.07Å; T183-L187 VanDerWaalsContact O-N 3.16Å
184	V	92.9	Very high	88.5	Confident	110 Å²	110	70.9 Å²	70.9	67%	0.667	38%	0.384	S	S	*	.	H	α-helix	trans	-55.2	-37.7	174.7	-179.2	0	0	0	0	110.8	E186 L187 D188	V184-E186 VanDerWaalsContact C-N 3.35Å; V184-E186 PolarHBondContact O-N 3.49Å; V184-L187 PolarHBondContact O-N 2.91Å; V184-D188 WeakPolarHBondContact O-CB 3.46Å; V184-D188 VanDerWaalsContact O-CG 3.28Å; V184-D188 PolarHBondContact O-N 2.92Å
185	A	93	Very high	89.1	Confident	71 Å²	71	61.9 Å²	61.9	59%	0.587	35%	0.351	S	S	*	.	H	α-helix	trans	-63.7	-35.4	177.8	0	0	0	0	0	113.6	T183 R189	T183-A185 PolarHBondContact O-N 3.4Å; A185-R189 WeakPolarHBondContact O-CB 3.33Å; A185-R189 PolarHBondContact O-N 3.41Å
186	E	92.8	Very high	89.8	Confident	31 Å²	31	59 Å²	59	15%	0.145	33%	0.328	C	S	.	.	H	α-helix	trans	-71.4	-39.8	175.7	-74.2	166	121.6	0	0	111.8	R165 F182 T183 V184 R189 A190	R165-E186 IonicContact CZ-OE1 3.71Å; R165-E186 IonicContact CZ-OE2 3.74Å; R165-E186 IonicContact NE-OE1 3.34Å; R165-E186 PolarHBondContact NE-OE1 3.49Å; R165-E186 IonicContact NE-OE2 2.64Å; R165-E186 IonicContact NH2-OE1 3.03Å; R165-E186 PolarHBondContact NH2-OE1 2.97Å; R165-E186 IonicContact NH2-OE2 2.91Å; R165-E186 PolarHBondContact NH2-OE2 2.78Å; F182-E186 HydrophobicContact CD1-CB 4.48Å; T183-E186 PolarHBondContact N-OE2 3.38Å; T183-E186 PolarHBondContact O-N 3.18Å; T183-E186 WeakPolarHBondContact OG1-CG 3.44Å; T183-E186 PolarHBondContact OG1-N 2.78Å; T183-E186 PolarHBondContact OG1-OE2 2.9Å; V184-E186 VanDerWaalsContact C-N 3.35Å; V184-E186 PolarHBondContact O-N 3.49Å; E186-R189 PolarHBondContact O-N 2.74Å; E186-A190 WeakPolarHBondContact O-CB 3.21Å; E186-A190 PolarHBondContact O-N 2.91Å
187	L	93.8	Very high	90.2	Very high	52 Å²	52	55.2 Å²	55.2	27%	0.272	31%	0.309	S	S	.	.	H	α-helix	trans	-66.2	-39.9	174.2	-64.9	178.7	0	0	0	111.4	L157 N158 A161 F182 T183 V184 R189 A190 L191	L157-L187 HydrophobicContact CB-CD2 4.42Å; N158-L187 WeakPolarHBondContact OD1-CD2 3.49Å; A161-L187 HydrophobicContact CB-CD2 4.28Å; F182-L187 HydrophobicContact CB-CD2 4Å; F182-L187 HydrophobicContact CB-CG 4.03Å; F182-L187 HydrophobicContact CG-CD2 4.37Å; T183-L187 PolarHBondContact O-N 3.07Å; T183-L187 VanDerWaalsContact O-N 3.16Å; V184-L187 PolarHBondContact O-N 2.91Å; L187-R189 VanDerWaalsContact C-N 3.32Å; L187-R189 PolarHBondContact O-N 3.38Å; L187-A190 WeakPolarHBondContact O-CB 3.25Å; L187-A190 PolarHBondContact O-N 3.29Å; L187-L191 WeakPolarHBondContact O-CB 3.29Å; L187-L191 PolarHBondContact O-N 2.91Å
188	D	92.7	Very high	90.7	Very high	72 Å²	72	50.2 Å²	50.2	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-38.3	174.1	-76.9	-14.1	0	0	0	112	V184 A192	V184-D188 WeakPolarHBondContact O-CB 3.46Å; V184-D188 VanDerWaalsContact O-CG 3.28Å; V184-D188 PolarHBondContact O-N 2.92Å; D188-A192 VanDerWaalsContact O-CB 3.32Å; D188-A192 WeakPolarHBondContact O-CB 3.47Å; D188-A192 PolarHBondContact O-N 2.97Å
189	R	93.2	Very high	91.4	Very high	117 Å²	117	46.1 Å²	46.1	44%	0.442	27%	0.271	S	S	.	.	H	α-helix	trans	-67.5	-41.9	175	-175.8	-179.8	-178.8	-169.5	-1.7	111.2	F164 D168 A185 E186 L187 A192 A193	F164-R189 HydrophobicContact CD2-CG 4.2Å; F164-R189 HydrophobicContact CE2-CG 4.29Å; D168-R189 IonicContact OD2-CZ 3.39Å; D168-R189 IonicContact OD2-NH1 3.94Å; D168-R189 PolarHBondContact OD2-NH1 3.33Å; D168-R189 IonicContact OD2-NH2 3.06Å; A185-R189 WeakPolarHBondContact O-CB 3.33Å; A185-R189 PolarHBondContact O-N 3.41Å; E186-R189 PolarHBondContact O-N 2.74Å; L187-R189 VanDerWaalsContact C-N 3.32Å; L187-R189 PolarHBondContact O-N 3.38Å; R189-A192 PolarHBondContact O-N 2.84Å; R189-A193 PolarHBondContact O-N 2.98Å
190	A	93.1	Very high	91.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-45.4	174.8	0	0	0	0	0	111.7	L157 V160 A161 E186 L187 A193 C194	L157-A190 HydrophobicContact CD2-CB 4.35Å; L157-A190 WeakPolarHBondContact O-CB 3.44Å; V160-A190 HydrophobicContact CB-CB 3.95Å; V160-A190 HydrophobicContact CG1-CB 3.8Å; A161-A190 HydrophobicContact CB-CB 3.98Å; E186-A190 WeakPolarHBondContact O-CB 3.21Å; E186-A190 PolarHBondContact O-N 2.91Å; L187-A190 WeakPolarHBondContact O-CB 3.25Å; L187-A190 PolarHBondContact O-N 3.29Å; A190-A193 PolarHBondContact O-N 3.3Å; A190-C194 PolarHBondContact O-N 3.47Å; A190-C194 PolarHBondContact O-SG 2.9Å; A190-C194 VanDerWaalsContact O-SG 3.38Å
191	L	93.3	Very high	92	Very high	19 Å²	19	47.3 Å²	47.3	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-49.3	176.2	178.3	63.7	0	0	0	110.9	L157 L187 A193 C194 L195	L157-L191 VanDerWaalsContact CD2-CA 3.48Å; L157-L191 HydrophobicContact CD2-CB 3.84Å; L157-L191 HydrophobicContact CD2-CD1 4.08Å; L187-L191 WeakPolarHBondContact O-CB 3.29Å; L187-L191 PolarHBondContact O-N 2.91Å; L191-A193 VanDerWaalsContact C-N 3.27Å; L191-A193 PolarHBondContact O-N 3.02Å; L191-C194 WeakPolarHBondContact O-CB 3.32Å; L191-C194 PolarHBondContact O-N 3.24Å; L191-C194 VanDerWaalsContact O-N 3.15Å; L191-L195 HydrophobicContact CD1-CD1 4.36Å; L191-L195 HydrophobicContact CD1-CG 4.28Å; L191-L195 HydrophobicContact CG-CD1 4.02Å; L191-L195 HydrophobicContact CG-CG 4.37Å; L191-L195 VanDerWaalsContact O-CG 3.27Å; L191-L195 WeakPolarHBondContact O-CG 3.35Å; L191-L195 PolarHBondContact O-N 3.05Å
192	A	92.8	Very high	92.1	Very high	7 Å²	7	44 Å²	44	6%	0.058	23%	0.233	C	C	.	.	H	α-helix	trans	-56.5	-41.4	177	0	0	0	0	0	112.1	D188 R189 L195 I196 K232 T234	D188-A192 VanDerWaalsContact O-CB 3.32Å; D188-A192 WeakPolarHBondContact O-CB 3.47Å; D188-A192 PolarHBondContact O-N 2.97Å; R189-A192 PolarHBondContact O-N 2.84Å; A192-L195 PolarHBondContact O-N 3.06Å; A192-I196 WeakPolarHBondContact O-CD1 3.3Å; A192-I196 WeakPolarHBondContact O-CG1 3.46Å; A192-I196 PolarHBondContact O-N 2.95Å; A192-K232 HydrophobicContact CB-CD 4.49Å; A192-T234 HydrophobicContact CB-CG2 3.82Å
193	A	92.4	Very high	92.2	Very high	15 Å²	15	43.1 Å²	43.1	12%	0.124	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-42.6	176.9	0	0	0	0	0	112.8	F106 V160 F164 R189 A190 L191 I196 S197	F106-A193 HydrophobicContact CE2-CB 4.48Å; V160-A193 HydrophobicContact CG1-CB 4.38Å; F164-A193 HydrophobicContact CE2-CB 3.59Å; F164-A193 HydrophobicContact CZ-CB 3.54Å; R189-A193 PolarHBondContact O-N 2.98Å; A190-A193 PolarHBondContact O-N 3.3Å; L191-A193 VanDerWaalsContact C-N 3.27Å; L191-A193 PolarHBondContact O-N 3.02Å; A193-I196 PolarHBondContact O-N 2.87Å; A193-S197 PolarHBondContact O-N 3.17Å
194	C	92.6	Very high	92.1	Very high	3 Å²	3	44 Å²	44	2%	0.02	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-45	173.5	-68.6	0	0	0	0	111.5	L143 A190 L191 I196 S197 A198 L262	L143-C194 HydrophobicContact CD1-CB 4.08Å; L143-C194 HydrophobicContact CD2-CB 4.36Å; L143-C194 WeakPolarHBondContact CD2-O 3.41Å; A190-C194 PolarHBondContact O-N 3.47Å; A190-C194 PolarHBondContact O-SG 2.9Å; A190-C194 VanDerWaalsContact O-SG 3.38Å; L191-C194 WeakPolarHBondContact O-CB 3.32Å; L191-C194 PolarHBondContact O-N 3.24Å; L191-C194 VanDerWaalsContact O-N 3.15Å; C194-I196 PolarHBondContact O-N 2.83Å; C194-S197 PolarHBondContact O-N 3.04Å; C194-A198 PolarHBondContact O-N 3.08Å; C194-L262 HydrophobicContact CB-CD1 4.3Å; C194-L262 HydrophobicContact CB-CD2 3.96Å
195	L	92.9	Very high	92.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-45.6	177.3	-67.6	172.6	0	0	0	111.3	L191 A192 S197 A198 Q199 T234 F254 L256 L262 I266 Y290	L191-L195 HydrophobicContact CD1-CD1 4.36Å; L191-L195 HydrophobicContact CD1-CG 4.28Å; L191-L195 HydrophobicContact CG-CD1 4.02Å; L191-L195 HydrophobicContact CG-CG 4.37Å; L191-L195 VanDerWaalsContact O-CG 3.27Å; L191-L195 WeakPolarHBondContact O-CG 3.35Å; L191-L195 PolarHBondContact O-N 3.05Å; A192-L195 PolarHBondContact O-N 3.06Å; L195-S197 VanDerWaalsContact C-N 3.34Å; L195-S197 PolarHBondContact O-N 3.49Å; L195-A198 PolarHBondContact O-N 2.64Å; L195-Q199 WeakPolarHBondContact O-CB 3.17Å; L195-Q199 WeakPolarHBondContact O-CG 3.4Å; L195-Q199 PolarHBondContact O-N 3.38Å; L195-T234 HydrophobicContact CB-CG2 4.44Å; L195-F254 HydrophobicContact CD1-CB 4.24Å; L195-F254 HydrophobicContact CD1-CD1 3.77Å; L195-F254 HydrophobicContact CD1-CD2 3.83Å; L195-F254 HydrophobicContact CD1-CE1 3.89Å; L195-F254 HydrophobicContact CD1-CE2 3.98Å; L195-F254 HydrophobicContact CD1-CG 3.71Å; L195-F254 HydrophobicContact CD1-CZ 3.98Å; L195-L256 HydrophobicContact CD2-CD2 3.26Å; L195-L256 HydrophobicContact CD2-CG 4.34Å; L195-L262 HydrophobicContact CD2-CD2 4.17Å; L195-I266 HydrophobicContact CD2-CD1 4.4Å; L195-Y290 HydrophobicContact CD1-CE1 4.46Å; L195-Y290 HydrophobicContact CD2-CE1 4.31Å
196	I	92.2	Very high	92	Very high	24 Å²	24	41.5 Å²	41.5	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-43.3	177.7	-69.8	164.8	0	0	0	111.1	A192 A193 C194 Q199 R200 M207 K232 G233 T234	A192-I196 WeakPolarHBondContact O-CD1 3.3Å; A192-I196 WeakPolarHBondContact O-CG1 3.46Å; A192-I196 PolarHBondContact O-N 2.95Å; A193-I196 PolarHBondContact O-N 2.87Å; C194-I196 PolarHBondContact O-N 2.83Å; I196-Q199 PolarHBondContact O-N 3.15Å; I196-R200 HydrophobicContact CG2-CG 4.36Å; I196-R200 WeakPolarHBondContact O-CB 3.48Å; I196-R200 VanDerWaalsContact O-CG 3.29Å; I196-R200 WeakPolarHBondContact O-CG 3.3Å; I196-R200 PolarHBondContact O-N 3.37Å; I196-M207 HydrophobicContact CG2-CE 4.37Å; I196-K232 WeakPolarHBondContact CD1-O 3.37Å; I196-G233 WeakPolarHBondContact CG1-O 3.38Å; I196-T234 HydrophobicContact CD1-CG2 3.94Å; I196-T234 HydrophobicContact CG1-CG2 3.7Å
197	S	91	Very high	92	Very high	23 Å²	23	40.2 Å²	40.2	16%	0.161	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-50.4	177.4	-163	0	0	0	0	110.6	A193 C194 L195 Q199 R200 E201	A193-S197 PolarHBondContact O-N 3.17Å; C194-S197 PolarHBondContact O-N 3.04Å; L195-S197 VanDerWaalsContact C-N 3.34Å; L195-S197 PolarHBondContact O-N 3.49Å; S197-Q199 VanDerWaalsContact C-N 3.3Å; S197-Q199 PolarHBondContact O-N 3.02Å; S197-R200 PolarHBondContact O-N 3.39Å; S197-E201 WeakPolarHBondContact O-CB 3.28Å; S197-E201 VanDerWaalsContact O-CG 3.29Å; S197-E201 WeakPolarHBondContact O-CG 3.26Å; S197-E201 PolarHBondContact O-N 2.67Å; S197-E201 PolarHBondContact OG-OE1 2.83Å
198	A	92.2	Very high	91.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-40.1	178.3	0	0	0	0	0	112.5	L143 C194 L195 E201 C202 P257 H260 L262	L143-A198 HydrophobicContact CD2-CB 4.05Å; C194-A198 PolarHBondContact O-N 3.08Å; L195-A198 PolarHBondContact O-N 2.64Å; A198-E201 PolarHBondContact O-N 2.82Å; A198-C202 WeakPolarHBondContact O-CB 3.36Å; A198-C202 PolarHBondContact O-N 2.81Å; A198-C202 VanDerWaalsContact O-N 3.07Å; A198-P257 HydrophobicContact CB-CG 4.28Å; A198-H260 VanDerWaalsContact CB-CE1 3.47Å; A198-H260 WeakPolarHBondContact CB-CE1 3.48Å; A198-L262 HydrophobicContact CB-CD2 3.94Å
199	Q	92.3	Very high	91.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.1	-40.1	177.6	-73	171.1	-16.7	0	0	112.2	L195 I196 S197 Y203 M207 M235 I255	L195-Q199 WeakPolarHBondContact O-CB 3.17Å; L195-Q199 WeakPolarHBondContact O-CG 3.4Å; L195-Q199 PolarHBondContact O-N 3.38Å; I196-Q199 PolarHBondContact O-N 3.15Å; S197-Q199 VanDerWaalsContact C-N 3.3Å; S197-Q199 PolarHBondContact O-N 3.02Å; Q199-Y203 CarbonylContact O-C 3.57Å; Q199-Y203 VanDerWaalsContact O-CA 3.3Å; Q199-Y203 WeakPolarHBondContact O-CA 3.28Å; Q199-Y203 WeakPolarHBondContact O-CB 3.35Å; Q199-Y203 PolarHBondContact O-N 2.96Å; Q199-M207 HydrophobicContact CB-CE 4.28Å; Q199-M207 HydrophobicContact CB-CG 4.13Å; Q199-M207 HydrophobicContact CB-SD 3.82Å; Q199-M235 HydrophobicContact CG-CE 4.28Å; Q199-M235 PolarHBondContact NE2-O 3.47Å; Q199-I255 PolarHBondContact NE2-O 3.29Å
200	R	90.2	Very high	91.8	Very high	148 Å²	148	37.6 Å²	37.6	56%	0.558	19%	0.194	S	C	*	.	H	α-helix	trans	-67.9	-36.6	175.7	-74.4	175.4	178.2	178.6	0.6	112.3	I196 S197 P204 M207	I196-R200 HydrophobicContact CG2-CG 4.36Å; I196-R200 WeakPolarHBondContact O-CB 3.48Å; I196-R200 VanDerWaalsContact O-CG 3.29Å; I196-R200 WeakPolarHBondContact O-CG 3.3Å; I196-R200 PolarHBondContact O-N 3.37Å; S197-R200 PolarHBondContact O-N 3.39Å; R200-P204 WeakPolarHBondContact O-CB 3.47Å; R200-M207 HydrophobicContact CG-CB 4.39Å; R200-M207 HydrophobicContact CG-CE 3.99Å; R200-M207 HydrophobicContact CG-CG 4.26Å
201	E	89.4	Confident	91.6	Very high	68 Å²	68	41.3 Å²	41.3	32%	0.318	22%	0.22	S	C	.	.	H	α-helix	trans	-67.5	-40.3	177.6	-72.4	172.8	-141.6	0	0	111.7	S141 S197 A198 H260	S141-E201 VanDerWaalsContact CB-CD 3.5Å; S141-E201 WeakPolarHBondContact CB-OE2 2.99Å; S197-E201 WeakPolarHBondContact O-CB 3.28Å; S197-E201 VanDerWaalsContact O-CG 3.29Å; S197-E201 WeakPolarHBondContact O-CG 3.26Å; S197-E201 PolarHBondContact O-N 2.67Å; S197-E201 PolarHBondContact OG-OE1 2.83Å; A198-E201 PolarHBondContact O-N 2.82Å; E201-H260 IonicContact OE2-NE2 3.61Å
202	C	90.2	Very high	91.5	Very high	49 Å²	49	43.4 Å²	43.4	33%	0.331	24%	0.236	S	C	.	.	H	α-helix	trans	-96	-26.8	-175.4	-65.9	0	0	0	0	115.1	A198 P204 P257	A198-C202 WeakPolarHBondContact O-CB 3.36Å; A198-C202 PolarHBondContact O-N 2.81Å; A198-C202 VanDerWaalsContact O-N 3.07Å; C202-P204 VanDerWaalsContact C-CD 3.44Å; C202-P257 HydrophobicContact CB-CB 3.47Å; C202-P257 VanDerWaalsContact CB-CB 3.47Å; C202-P257 HydrophobicContact CB-CG 3.95Å; C202-P257 WeakPolarHBondContact SG-CB 3.47Å
203	Y	90.9	Very high	91.3	Very high	38 Å²	38	46.4 Å²	46.4	15%	0.149	27%	0.268	C	S	.	.			trans	-132.2	54.9	-175.4	-54.6	-62.9	0	0	0	111.9	Q199 E205 E206 M207 L222 M235 I255 P257	Q199-Y203 CarbonylContact O-C 3.57Å; Q199-Y203 VanDerWaalsContact O-CA 3.3Å; Q199-Y203 WeakPolarHBondContact O-CA 3.28Å; Q199-Y203 WeakPolarHBondContact O-CB 3.35Å; Q199-Y203 PolarHBondContact O-N 2.96Å; Y203-E205 PolarHBondContact O-N 3.3Å; Y203-E206 PolarHBondContact O-N 2.71Å; Y203-M207 VanDerWaalsContact O-CB 3.3Å; Y203-M207 WeakPolarHBondContact O-CB 3.47Å; Y203-M207 VanDerWaalsContact O-CG 3.25Å; Y203-M207 WeakPolarHBondContact O-CG 3.44Å; Y203-M207 PolarHBondContact O-N 3.09Å; Y203-L222 HydrophobicContact CD1-CD1 3.87Å; Y203-L222 HydrophobicContact CD2-CD1 4.16Å; Y203-L222 HydrophobicContact CE1-CD1 3.93Å; Y203-L222 HydrophobicContact CE1-CD2 4.49Å; Y203-L222 HydrophobicContact CE1-CG 4.33Å; Y203-L222 HydrophobicContact CE2-CD1 4.2Å; Y203-L222 HydrophobicContact CG-CD1 3.99Å; Y203-M235 HydrophobicContact CD2-CE 3.61Å; Y203-M235 HydrophobicContact CE2-CE 4.24Å; Y203-M235 HydrophobicContact CG-CE 4.14Å; Y203-I255 HydrophobicContact CE2-CG2 4.45Å; Y203-P257 HydrophobicContact CE2-CB 3.72Å; Y203-P257 HydrophobicContact CE2-CG 4.46Å
204	P	91.1	Very high	91.2	Very high	78 Å²	78	51.9 Å²	51.9	51%	0.506	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-39.2	-175.2	24.7	-34.2	0	0	0	112.8	R200 C202 S208	R200-P204 WeakPolarHBondContact O-CB 3.47Å; C202-P204 VanDerWaalsContact C-CD 3.44Å; P204-S208 VanDerWaalsContact O-CB 3.32Å; P204-S208 WeakPolarHBondContact O-CB 3.16Å; P204-S208 PolarHBondContact O-N 3.05Å
205	E	91.4	Very high	90.9	Very high	96 Å²	96	56.6 Å²	56.6	45%	0.449	32%	0.32	S	S	.	.	H	α-helix	trans	-65.9	-48.3	178.4	-69.9	-172.7	-172.7	0	0	111.2	Y203 S208 R209 R219	Y203-E205 PolarHBondContact O-N 3.3Å; E205-S208 PolarHBondContact O-N 3.33Å; E205-R209 WeakPolarHBondContact O-CB 3.19Å; E205-R209 VanDerWaalsContact O-CG 3.3Å; E205-R209 WeakPolarHBondContact O-CG 3.33Å; E205-R209 PolarHBondContact O-N 3.27Å; E205-R219 IonicContact OE1-NH2 2.91Å; E205-R219 PolarHBondContact OE1-NH2 3.39Å; E205-R219 IonicContact OE2-CZ 2.96Å; E205-R219 IonicContact OE2-NH2 2.71Å; E205-R219 PolarHBondContact OE2-NH2 2.91Å
206	E	92.5	Very high	90.8	Very high	31 Å²	31	57.5 Å²	57.5	15%	0.145	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-46	179.2	-67.3	82.5	174.8	0	0	111.5	Y203 S208 R209 L210 L216 S220 L222 M235	Y203-E206 PolarHBondContact O-N 2.71Å; E206-S208 VanDerWaalsContact C-N 3.34Å; E206-S208 PolarHBondContact O-N 3.45Å; E206-R209 PolarHBondContact O-N 3.34Å; E206-L210 WeakPolarHBondContact O-CB 3.21Å; E206-L210 VanDerWaalsContact O-CG 3.29Å; E206-L210 WeakPolarHBondContact O-CG 3.44Å; E206-L210 PolarHBondContact O-N 3.25Å; E206-L216 HydrophobicContact CB-CD1 4.46Å; E206-L216 HydrophobicContact CB-CD2 3.74Å; E206-L216 HydrophobicContact CG-CD1 3.93Å; E206-L216 HydrophobicContact CG-CD2 3.74Å; E206-L216 HydrophobicContact CG-CG 4.48Å; E206-S220 WeakPolarHBondContact CG-OG 3.28Å; E206-S220 PolarHBondContact OE1-OG 3.03Å; E206-L222 HydrophobicContact CG-CD1 4.34Å; E206-M235 HydrophobicContact CB-SD 4.42Å
207	M	91.1	Very high	90.7	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-59.4	-44.2	178	-76.1	-64.1	-71.4	0	0	111.6	I196 Q199 R200 Y203 S211 I229 M235	I196-M207 HydrophobicContact CG2-CE 4.37Å; Q199-M207 HydrophobicContact CB-CE 4.28Å; Q199-M207 HydrophobicContact CB-CG 4.13Å; Q199-M207 HydrophobicContact CB-SD 3.82Å; R200-M207 HydrophobicContact CG-CB 4.39Å; R200-M207 HydrophobicContact CG-CE 3.99Å; R200-M207 HydrophobicContact CG-CG 4.26Å; Y203-M207 VanDerWaalsContact O-CB 3.3Å; Y203-M207 WeakPolarHBondContact O-CB 3.47Å; Y203-M207 VanDerWaalsContact O-CG 3.25Å; Y203-M207 WeakPolarHBondContact O-CG 3.44Å; Y203-M207 PolarHBondContact O-N 3.09Å; M207-S211 WeakPolarHBondContact O-CB 3.4Å; M207-S211 PolarHBondContact O-N 3.47Å; M207-S211 PolarHBondContact O-OG 2.88Å; M207-I229 HydrophobicContact CE-CD1 3.98Å; M207-I229 HydrophobicContact SD-CD1 3.71Å; M207-M235 HydrophobicContact SD-CB 3.79Å; M207-M235 HydrophobicContact SD-SD 4.4Å
208	S	91.2	Very high	90.4	Very high	81 Å²	81	62.2 Å²	62.2	57%	0.566	36%	0.361	S	S	*	.	H	α-helix	trans	-64.6	-45.5	178.1	179.8	0	0	0	0	111.9	P204 E205 E206 S212	P204-S208 VanDerWaalsContact O-CB 3.32Å; P204-S208 WeakPolarHBondContact O-CB 3.16Å; P204-S208 PolarHBondContact O-N 3.05Å; E205-S208 PolarHBondContact O-N 3.33Å; E206-S208 VanDerWaalsContact C-N 3.34Å; E206-S208 PolarHBondContact O-N 3.45Å; S208-S212 WeakPolarHBondContact O-CB 3.47Å; S208-S212 PolarHBondContact O-N 3Å; S208-S212 VanDerWaalsContact O-N 3.09Å; S208-S212 PolarHBondContact O-OG 3.3Å
209	R	92.4	Very high	90.4	Very high	74 Å²	74	70.8 Å²	70.8	28%	0.279	39%	0.393	S	S	.	.	H	α-helix	trans	-65.8	-48.9	-179.2	-71.1	179.5	78.4	116.3	-1.6	112.1	E205 E206 S211 S212 G213 K214 P215 L216 L217	E205-R209 WeakPolarHBondContact O-CB 3.19Å; E205-R209 VanDerWaalsContact O-CG 3.3Å; E205-R209 WeakPolarHBondContact O-CG 3.33Å; E205-R209 PolarHBondContact O-N 3.27Å; E206-R209 PolarHBondContact O-N 3.34Å; R209-S211 VanDerWaalsContact C-N 3.34Å; R209-S211 PolarHBondContact O-N 2.92Å; R209-S212 CarbonylContact O-C 3.49Å; R209-S212 WeakPolarHBondContact O-CA 3.48Å; R209-S212 PolarHBondContact O-N 2.81Å; R209-S212 PolarHBondContact O-OG 2.85Å; R209-G213 PolarHBondContact O-N 2.83Å; R209-K214 CarbonylContact C-O 3.58Å; R209-K214 HydrophobicContact CB-CB 4.34Å; R209-K214 PolarHBondContact O-N 2.87Å; R209-P215 VanDerWaalsContact CZ-O 3.22Å; R209-P215 PolarHBondContact NE-O 3.03Å; R209-P215 PolarHBondContact NH2-O 3.14Å; R209-L216 HydrophobicContact CB-CD2 4.29Å; R209-L217 VanDerWaalsContact NH1-CG 3.27Å
210	L	91.8	Very high	90.2	Very high	31 Å²	31	71.3 Å²	71.3	16%	0.162	40%	0.396	C	S	.	.	H	α-helix	trans	-65.5	-38.1	-179.9	-64.1	173.4	0	0	0	111.8	E206 S212 G213 L216 P227 I229 M235	E206-L210 WeakPolarHBondContact O-CB 3.21Å; E206-L210 VanDerWaalsContact O-CG 3.29Å; E206-L210 WeakPolarHBondContact O-CG 3.44Å; E206-L210 PolarHBondContact O-N 3.25Å; L210-S212 PolarHBondContact O-N 2.83Å; L210-G213 PolarHBondContact O-N 2.9Å; L210-G213 VanDerWaalsContact O-N 3.07Å; L210-L216 HydrophobicContact CD1-CD2 4.21Å; L210-L216 HydrophobicContact CD2-CD2 3.92Å; L210-L216 HydrophobicContact CD2-CG 4.04Å; L210-L216 HydrophobicContact CG-CD2 3.74Å; L210-L216 HydrophobicContact CG-CG 4.33Å; L210-P227 HydrophobicContact CD1-CB 3.94Å; L210-P227 HydrophobicContact CD1-CG 4.12Å; L210-P227 WeakPolarHBondContact CD2-O 3.38Å; L210-I229 HydrophobicContact CB-CD1 4.28Å; L210-I229 HydrophobicContact CB-CG1 3.55Å; L210-M235 HydrophobicContact CD1-CG 3.99Å; L210-M235 HydrophobicContact CD1-SD 3.77Å
211	S	90.1	Very high	89.9	Confident	78 Å²	78	72.6 Å²	72.6	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-30.2	173.7	-59.4	0	0	0	0	112.3	M207 R209 G213	M207-S211 WeakPolarHBondContact O-CB 3.4Å; M207-S211 PolarHBondContact O-N 3.47Å; M207-S211 PolarHBondContact O-OG 2.88Å; R209-S211 VanDerWaalsContact C-N 3.34Å; R209-S211 PolarHBondContact O-N 2.92Å; S211-G213 VanDerWaalsContact C-N 3.34Å
212	S	90.7	Very high	89.9	Confident	63 Å²	63	69.5 Å²	69.5	44%	0.441	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.7	175.5	71.4	0	0	0	0	114.6	S208 R209 L210 K214	S208-S212 WeakPolarHBondContact O-CB 3.47Å; S208-S212 PolarHBondContact O-N 3Å; S208-S212 VanDerWaalsContact O-N 3.09Å; S208-S212 PolarHBondContact O-OG 3.3Å; R209-S212 CarbonylContact O-C 3.49Å; R209-S212 WeakPolarHBondContact O-CA 3.48Å; R209-S212 PolarHBondContact O-N 2.81Å; R209-S212 PolarHBondContact O-OG 2.85Å; L210-S212 PolarHBondContact O-N 2.83Å; S212-K214 PolarHBondContact O-N 2.85Å; S212-K214 WeakPolarHBondContact OG-CG 3.27Å
213	G	89.1	Confident	89.8	Confident	70 Å²	70	70.9 Å²	70.9	72%	0.722	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	16.2	-176.5	0	0	0	0	0	114.5	R209 L210 S211	R209-G213 PolarHBondContact O-N 2.83Å; L210-G213 PolarHBondContact O-N 2.9Å; L210-G213 VanDerWaalsContact O-N 3.07Å; S211-G213 VanDerWaalsContact C-N 3.34Å
214	K	89.3	Confident	89.5	Confident	129 Å²	129	75.7 Å²	75.7	56%	0.561	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-90.8	142.9	179.2	-68.4	179.4	-176.3	177.3	0	110.5	R209 S212	R209-K214 CarbonylContact C-O 3.58Å; R209-K214 HydrophobicContact CB-CB 4.34Å; R209-K214 PolarHBondContact O-N 2.87Å; S212-K214 PolarHBondContact O-N 2.85Å; S212-K214 WeakPolarHBondContact OG-CG 3.27Å
215	P	87.8	Confident	89.4	Confident	103 Å²	103	72.5 Å²	72.5	67%	0.669	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-62.1	148.8	174.9	27.2	-34.6	0	0	0	110.6	R209	R209-P215 VanDerWaalsContact CZ-O 3.22Å; R209-P215 PolarHBondContact NE-O 3.03Å; R209-P215 PolarHBondContact NH2-O 3.14Å
216	L	89.7	Confident	89.3	Confident	19 Å²	19	71.1 Å²	71.1	10%	0.099	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-62.8	158.2	173.1	-70.3	-165.4	0	0	0	111.9	E206 R209 L210 L222 L223 P227	E206-L216 HydrophobicContact CB-CD1 4.46Å; E206-L216 HydrophobicContact CB-CD2 3.74Å; E206-L216 HydrophobicContact CG-CD1 3.93Å; E206-L216 HydrophobicContact CG-CD2 3.74Å; E206-L216 HydrophobicContact CG-CG 4.48Å; R209-L216 HydrophobicContact CB-CD2 4.29Å; L210-L216 HydrophobicContact CD1-CD2 4.21Å; L210-L216 HydrophobicContact CD2-CD2 3.92Å; L210-L216 HydrophobicContact CD2-CG 4.04Å; L210-L216 HydrophobicContact CG-CD2 3.74Å; L210-L216 HydrophobicContact CG-CG 4.33Å; L216-L222 HydrophobicContact CD1-CB 4.32Å; L216-L223 HydrophobicContact CB-CD1 3.96Å; L216-P227 HydrophobicContact CD1-CG 3.22Å; L216-P227 HydrophobicContact CG-CG 4.14Å
217	L	89.5	Confident	89.3	Confident	53 Å²	53	70.2 Å²	70.2	28%	0.277	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-68	144.7	171.6	-69.2	172.6	0	0	0	110.3	R209 R219 S220	R209-L217 VanDerWaalsContact NH1-CG 3.27Å; L217-R219 HydrophobicContact CB-CG 3.95Å; L217-R219 HydrophobicContact CD1-CG 4.43Å; L217-R219 PolarHBondContact O-N 2.92Å; L217-S220 WeakPolarHBondContact O-CB 3.32Å; L217-S220 PolarHBondContact O-N 3.13Å
218	A	86.7	Confident	89.3	Confident	93 Å²	93	72.1 Å²	72.1	77%	0.769	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.7	176.2	0	0	0	0	0	113.3	S220	A218-S220 VanDerWaalsContact C-N 3.33Å
219	R	90.8	Very high	89.4	Confident	179 Å²	179	70.3 Å²	70.3	68%	0.675	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.9	177.5	73.4	-176.1	-177.2	-178.3	1.8	114.7	E205 L217 K221	E205-R219 IonicContact OE1-NH2 2.91Å; E205-R219 PolarHBondContact OE1-NH2 3.39Å; E205-R219 IonicContact OE2-CZ 2.96Å; E205-R219 IonicContact OE2-NH2 2.71Å; E205-R219 PolarHBondContact OE2-NH2 2.91Å; L217-R219 HydrophobicContact CB-CG 3.95Å; L217-R219 HydrophobicContact CD1-CG 4.43Å; L217-R219 PolarHBondContact O-N 2.92Å; R219-K221 PolarHBondContact O-N 3.14Å
220	S	87.7	Confident	89.4	Confident	11 Å²	11	67.6 Å²	67.6	8%	0.077	38%	0.378	C	S	.	.			trans	-69	129.5	-175.8	-177.9	0	0	0	0	110.2	E206 L217 A218 L222 L223	E206-S220 WeakPolarHBondContact CG-OG 3.28Å; E206-S220 PolarHBondContact OE1-OG 3.03Å; L217-S220 WeakPolarHBondContact O-CB 3.32Å; L217-S220 PolarHBondContact O-N 3.13Å; A218-S220 VanDerWaalsContact C-N 3.33Å; S220-L222 PolarHBondContact O-N 3.39Å; S220-L222 VanDerWaalsContact O-N 3.13Å; S220-L222 PolarHBondContact OG-N 2.98Å; S220-L223 WeakPolarHBondContact O-CB 3.16Å; S220-L223 PolarHBondContact O-N 3.21Å; S220-L223 VanDerWaalsContact O-N 3.14Å
221	K	85	Confident	89.3	Confident	176 Å²	176	76.8 Å²	76.8	77%	0.765	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.5	175.9	-66.2	175.4	-176.9	167.9	0	112.1	R219 H224	R219-K221 PolarHBondContact O-N 3.14Å; K221-H224 PolarHBondContact O-CE1 2.91Å; K221-H224 PolarHBondContact O-ND1 2.88Å
222	L	88.5	Confident	89.1	Confident	2 Å²	2	79 Å²	79	1%	0.01	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.2	-179.6	-57.6	-178.4	0	0	0	113	Y203 E206 L216 S220 H224 L225 P227 M235 I255 P293	Y203-L222 HydrophobicContact CD1-CD1 3.87Å; Y203-L222 HydrophobicContact CD2-CD1 4.16Å; Y203-L222 HydrophobicContact CE1-CD1 3.93Å; Y203-L222 HydrophobicContact CE1-CD2 4.49Å; Y203-L222 HydrophobicContact CE1-CG 4.33Å; Y203-L222 HydrophobicContact CE2-CD1 4.2Å; Y203-L222 HydrophobicContact CG-CD1 3.99Å; E206-L222 HydrophobicContact CG-CD1 4.34Å; L216-L222 HydrophobicContact CD1-CB 4.32Å; S220-L222 PolarHBondContact O-N 3.39Å; S220-L222 VanDerWaalsContact O-N 3.13Å; S220-L222 PolarHBondContact OG-N 2.98Å; L222-H224 PolarHBondContact O-N 2.96Å; L222-H224 VanDerWaalsContact O-N 3.14Å; L222-L225 HydrophobicContact CD2-CD1 4.02Å; L222-L225 WeakPolarHBondContact O-CB 3.41Å; L222-L225 PolarHBondContact O-N 3.3Å; L222-P227 HydrophobicContact CB-CG 4.16Å; L222-P227 VanDerWaalsContact O-CD 3.25Å; L222-P227 WeakPolarHBondContact O-CD 3.33Å; L222-M235 HydrophobicContact CD1-CE 3.65Å; L222-M235 HydrophobicContact CD1-SD 4.05Å; L222-I255 HydrophobicContact CD1-CG2 4.25Å; L222-I255 HydrophobicContact CD2-CG2 4.01Å; L222-P293 HydrophobicContact CD2-CG 4.08Å
223	L	87.8	Confident	89.1	Confident	79 Å²	79	77.1 Å²	77.1	41%	0.414	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-55.3	-38.2	-173.8	-171.9	71.4	0	0	0	113.5	L216 S220 L225 S226	L216-L223 HydrophobicContact CB-CD1 3.96Å; S220-L223 WeakPolarHBondContact O-CB 3.16Å; S220-L223 PolarHBondContact O-N 3.21Å; S220-L223 VanDerWaalsContact O-N 3.14Å; L223-L225 PolarHBondContact O-N 3.22Å; L223-S226 PolarHBondContact O-N 3.36Å
224	H	86.5	Confident	89.2	Confident	138 Å²	138	73.8 Å²	73.8	64%	0.639	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-67.9	-13.4	179.3	71.8	-79.1	0	0	0	114.5	K221 L222	K221-H224 PolarHBondContact O-CE1 2.91Å; K221-H224 PolarHBondContact O-ND1 2.88Å; L222-H224 PolarHBondContact O-N 2.96Å; L222-H224 VanDerWaalsContact O-N 3.14Å
225	L	87.4	Confident	89.4	Confident	12 Å²	12	67.7 Å²	67.7	6%	0.063	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-95.8	5.2	178.3	-57.6	174.9	0	0	0	112.7	L222 L223 P227 A237 E238 I255 W291	L222-L225 HydrophobicContact CD2-CD1 4.02Å; L222-L225 WeakPolarHBondContact O-CB 3.41Å; L222-L225 PolarHBondContact O-N 3.3Å; L223-L225 PolarHBondContact O-N 3.22Å; L225-P227 VanDerWaalsContact C-N 3.33Å; L225-A237 HydrophobicContact CB-CB 4.12Å; L225-A237 WeakPolarHBondContact O-CA 3.33Å; L225-E238 CarbonylContact C-O 3.33Å; L225-E238 PolarHBondContact O-N 3.35Å; L225-I255 HydrophobicContact CB-CD1 4.41Å; L225-I255 HydrophobicContact CD1-CD1 4.22Å; L225-W291 VanDerWaalsContact CD1-CD1 3.45Å; L225-W291 HydrophobicContact CD2-CD2 4.41Å; L225-W291 HydrophobicContact CD2-CZ2 3.83Å
226	S	89.4	Confident	89.7	Confident	66 Å²	66	63.1 Å²	63.1	46%	0.462	32%	0.316	S	S	.	.			trans	39.6	57.6	-175.6	-63.4	0	0	0	0	112.7	L223 E238	L223-S226 PolarHBondContact O-N 3.36Å; S226-E238 WeakPolarHBondContact O-CB 3.37Å; S226-E238 PolarHBondContact O-N 3.44Å
227	P	92	Very high	89.8	Confident	12 Å²	12	62.5 Å²	62.5	8%	0.078	31%	0.314	C	S	.	.			trans	-69.2	141	-169.3	28.5	-35.8	0	0	0	111.1	L210 L216 L222 L225 M235 R236 I255	L210-P227 HydrophobicContact CD1-CB 3.94Å; L210-P227 HydrophobicContact CD1-CG 4.12Å; L210-P227 WeakPolarHBondContact CD2-O 3.38Å; L216-P227 HydrophobicContact CD1-CG 3.22Å; L216-P227 HydrophobicContact CG-CG 4.14Å; L222-P227 HydrophobicContact CB-CG 4.16Å; L222-P227 VanDerWaalsContact O-CD 3.25Å; L222-P227 WeakPolarHBondContact O-CD 3.33Å; L225-P227 VanDerWaalsContact C-N 3.33Å; P227-M235 HydrophobicContact CB-CG 4.05Å; P227-M235 HydrophobicContact CB-SD 4.15Å; P227-R236 CarbonylContact C-O 3.47Å; P227-R236 VanDerWaalsContact CA-O 3.25Å; P227-R236 WeakPolarHBondContact CA-O 3.36Å; P227-I255 HydrophobicContact CB-CD1 3.63Å
228	F	92.8	Very high	89.7	Confident	46 Å²	46	64.2 Å²	64.2	20%	0.202	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	162.3	177	72.5	-80.3	0	0	0	110.9	D230 M235 R236 E238 H252	F228-D230 HydrophobicContact CE2-CB 4.41Å; F228-M235 CarbonylContact O-C 3.57Å; F228-M235 WeakPolarHBondContact O-CA 3.14Å; F228-R236 HydrophobicContact CD1-CB 4.34Å; F228-R236 HydrophobicContact CE1-CB 3.8Å; F228-R236 HydrophobicContact CE2-CB 4.44Å; F228-R236 HydrophobicContact CZ-CB 3.86Å; F228-R236 PolarHBondContact N-O 3.11Å; F228-R236 PolarHBondContact O-N 3.47Å; F228-E238 HydrophobicContact CD1-CB 3.8Å; F228-E238 HydrophobicContact CE1-CB 3.96Å; F228-E238 HydrophobicContact CE1-CG 4.49Å; F228-H252 HydrophobicContact CE1-CB 4.11Å; F228-H252 AromaticContact CE1-ND1 3.7Å; F228-H252 HydrophobicContact CZ-CB 3.88Å; F228-H252 AromaticContact CZ-CG 3.86Å; F228-H252 AromaticContact CZ-ND1 3.86Å
229	I	93.2	Very high	89.3	Confident	43 Å²	43	61.3 Å²	61.3	22%	0.221	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.2	176.6	-63.4	-70.9	0	0	0	108.8	M207 L210 T234 M235	M207-I229 HydrophobicContact CE-CD1 3.98Å; M207-I229 HydrophobicContact SD-CD1 3.71Å; L210-I229 HydrophobicContact CB-CD1 4.28Å; L210-I229 HydrophobicContact CB-CG1 3.55Å; I229-T234 WeakPolarHBondContact CA-O 3.25Å; I229-M235 HydrophobicContact CD1-CB 3.86Å; I229-M235 HydrophobicContact CD1-CG 4.47Å
230	D	91.3	Very high	88.5	Confident	17 Å²	17	65.1 Å²	65.1	9%	0.091	31%	0.314	C	S	.	.			trans	-76	174	177.6	81.3	-9.2	0	0	0	112.5	F228 K232 G233 T234 R236	F228-D230 HydrophobicContact CE2-CB 4.41Å; D230-K232 PolarHBondContact O-N 3.12Å; D230-K232 WeakPolarHBondContact OD1-CA 3.25Å; D230-K232 WeakPolarHBondContact OD1-CB 3.38Å; D230-K232 PolarHBondContact OD1-N 3.22Å; D230-G233 PolarHBondContact O-N 3.42Å; D230-G233 PolarHBondContact OD1-N 3.26Å; D230-T234 PolarHBondContact N-O 2.95Å; D230-T234 PolarHBondContact OD1-N 3.23Å; D230-T234 PolarHBondContact OD1-OG1 3.44Å; D230-T234 PolarHBondContact OD2-OG1 3Å; D230-R236 IonicContact OD2-CZ 3.05Å; D230-R236 IonicContact OD2-NE 3.88Å; D230-R236 PolarHBondContact OD2-NE 3.44Å; D230-R236 IonicContact OD2-NH2 3.42Å; D230-R236 PolarHBondContact OD2-NH2 2.93Å
231	K	89.5	Confident	88.2	Confident	224 Å²	224	68.3 Å²	68.3	97%	0.974	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.5	178.7	-62.6	-177.6	-178.7	179.4	0	113.5
232	K	87	Confident	87.7	Confident	123 Å²	123	62.5 Å²	62.5	54%	0.535	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-7.2	177.8	-62.2	-176.4	178.5	-177.2	0	112.3	A192 I196 D230	A192-K232 HydrophobicContact CB-CD 4.49Å; I196-K232 WeakPolarHBondContact CD1-O 3.37Å; D230-K232 PolarHBondContact O-N 3.12Å; D230-K232 WeakPolarHBondContact OD1-CA 3.25Å; D230-K232 WeakPolarHBondContact OD1-CB 3.38Å; D230-K232 PolarHBondContact OD1-N 3.22Å
233	G	89.2	Confident	87.4	Confident	25 Å²	25	74.5 Å²	74.5	26%	0.258	35%	0.352	S	S	.	.	S	Bend	trans	90.2	6.9	-178.9	0	0	0	0	0	114.6	I196 D230	I196-G233 WeakPolarHBondContact CG1-O 3.38Å; D230-G233 PolarHBondContact O-N 3.42Å; D230-G233 PolarHBondContact OD1-N 3.26Å
234	T	92.4	Very high	87.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.345	C	S	.	.			trans	-87.9	144.2	178.5	64	0	0	0	0	111	A192 L195 I196 I229 D230 F254	A192-T234 HydrophobicContact CB-CG2 3.82Å; L195-T234 HydrophobicContact CB-CG2 4.44Å; I196-T234 HydrophobicContact CD1-CG2 3.94Å; I196-T234 HydrophobicContact CG1-CG2 3.7Å; I229-T234 WeakPolarHBondContact CA-O 3.25Å; D230-T234 PolarHBondContact N-O 2.95Å; D230-T234 PolarHBondContact OD1-N 3.23Å; D230-T234 PolarHBondContact OD1-OG1 3.44Å; D230-T234 PolarHBondContact OD2-OG1 3Å; T234-F254 HydrophobicContact CG2-CD1 4.4Å; T234-F254 HydrophobicContact CG2-CE1 3.98Å; T234-F254 VanDerWaalsContact OG1-CE1 3.28Å; T234-F254 WeakPolarHBondContact OG1-CE1 3.36Å
235	M	93.6	Very high	87.3	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.2	174.9	-174.4	176.9	59.1	0	0	111	Q199 Y203 E206 M207 L210 L222 P227 F228 I229 I255	Q199-M235 HydrophobicContact CG-CE 4.28Å; Q199-M235 PolarHBondContact NE2-O 3.47Å; Y203-M235 HydrophobicContact CD2-CE 3.61Å; Y203-M235 HydrophobicContact CE2-CE 4.24Å; Y203-M235 HydrophobicContact CG-CE 4.14Å; E206-M235 HydrophobicContact CB-SD 4.42Å; M207-M235 HydrophobicContact SD-CB 3.79Å; M207-M235 HydrophobicContact SD-SD 4.4Å; L210-M235 HydrophobicContact CD1-CG 3.99Å; L210-M235 HydrophobicContact CD1-SD 3.77Å; L222-M235 HydrophobicContact CD1-CE 3.65Å; L222-M235 HydrophobicContact CD1-SD 4.05Å; P227-M235 HydrophobicContact CB-CG 4.05Å; P227-M235 HydrophobicContact CB-SD 4.15Å; F228-M235 CarbonylContact O-C 3.57Å; F228-M235 WeakPolarHBondContact O-CA 3.14Å; I229-M235 HydrophobicContact CD1-CB 3.86Å; I229-M235 HydrophobicContact CD1-CG 4.47Å; M235-I255 HydrophobicContact CE-CB 4.02Å; M235-I255 HydrophobicContact CE-CG2 3.91Å; M235-I255 HydrophobicContact CG-CD1 4.15Å; M235-I255 PolarHBondContact O-N 3.36Å
236	R	94.3	Very high	87.2	Confident	7 Å²	7	77.1 Å²	77.1	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	155	179.4	-66.6	179.8	178.3	-100.2	9.3	110.7	P227 F228 D230 N249 H252 P253 F254	P227-R236 CarbonylContact C-O 3.47Å; P227-R236 VanDerWaalsContact CA-O 3.25Å; P227-R236 WeakPolarHBondContact CA-O 3.36Å; F228-R236 HydrophobicContact CD1-CB 4.34Å; F228-R236 HydrophobicContact CE1-CB 3.8Å; F228-R236 HydrophobicContact CE2-CB 4.44Å; F228-R236 HydrophobicContact CZ-CB 3.86Å; F228-R236 PolarHBondContact N-O 3.11Å; F228-R236 PolarHBondContact O-N 3.47Å; D230-R236 IonicContact OD2-CZ 3.05Å; D230-R236 IonicContact OD2-NE 3.88Å; D230-R236 PolarHBondContact OD2-NE 3.44Å; D230-R236 IonicContact OD2-NH2 3.42Å; D230-R236 PolarHBondContact OD2-NH2 2.93Å; R236-N249 PolarHBondContact NH1-OD1 2.83Å; R236-N249 PolarHBondContact NH2-OD1 3.26Å; R236-H252 HydrophobicContact CB-CB 4.37Å; R236-H252 WeakPolarHBondContact CD-O 3.49Å; R236-H252 PolarHBondContact NH1-O 2.77Å; R236-P253 WeakPolarHBondContact CA-O 3.43Å; R236-F254 HydrophobicContact CG-CD1 3.94Å; R236-F254 HydrophobicContact CG-CE1 4.46Å; R236-F254 VanDerWaalsContact CZ-CZ 3.43Å
237	A	91.9	Very high	87.1	Confident	7 Å²	7	78.4 Å²	78.4	6%	0.058	38%	0.382	C	S	.	.			trans	-84.4	137.2	172.6	0	0	0	0	0	109.9	L225 H252 P253 I255	L225-A237 HydrophobicContact CB-CB 4.12Å; L225-A237 WeakPolarHBondContact O-CA 3.33Å; A237-H252 WeakPolarHBondContact O-CA 3.08Å; A237-P253 HydrophobicContact CB-CG 4.34Å; A237-P253 PolarHBondContact N-O 2.82Å; A237-I255 HydrophobicContact CB-CD1 4.03Å; A237-I255 HydrophobicContact CB-CG1 3.94Å
238	E	87.7	Confident	87	Confident	89 Å²	89	82.9 Å²	82.9	42%	0.416	40%	0.398	S	S	.	.			trans	-102.5	138	167.8	-163.8	170.8	-137.3	0	0	108.6	L225 S226 F228	L225-E238 CarbonylContact C-O 3.33Å; L225-E238 PolarHBondContact O-N 3.35Å; S226-E238 WeakPolarHBondContact O-CB 3.37Å; S226-E238 PolarHBondContact O-N 3.44Å; F228-E238 HydrophobicContact CD1-CB 3.8Å; F228-E238 HydrophobicContact CE1-CB 3.96Å; F228-E238 HydrophobicContact CE1-CG 4.49Å
239	G	77.5	Confident	86.8	Confident	32 Å²	32	83.5 Å²	83.5	33%	0.33	40%	0.404	S	S	.	.			trans	-135.9	174.1	-165	0	0	0	0	0	113.3	I241 D242	G239-I241 PolarHBondContact O-N 3.28Å; G239-I241 VanDerWaalsContact O-N 3.12Å; G239-D242 VanDerWaalsContact O-CG 3.25Å; G239-D242 VanDerWaalsContact O-OD1 3.11Å
240	R	74.6	Confident	86.5	Confident	259 Å²	259	82.3 Å²	82.3	98%	0.977	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-5.1	174	-61.6	-177.9	-176.8	173.4	-0.3	113.4
241	I	80.1	Confident	86.5	Confident	77 Å²	77	85 Å²	85	40%	0.395	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	14.6	-176.2	60.3	170.1	0	0	0	113.1	G239 R243 A244 L246	G239-I241 PolarHBondContact O-N 3.28Å; G239-I241 VanDerWaalsContact O-N 3.12Å; I241-R243 PolarHBondContact O-N 2.86Å; I241-R243 VanDerWaalsContact O-N 3.1Å; I241-A244 HydrophobicContact CB-CB 4.09Å; I241-A244 VanDerWaalsContact O-CB 3.25Å; I241-A244 WeakPolarHBondContact O-CB 3.49Å; I241-A244 PolarHBondContact O-N 3.23Å; I241-L246 HydrophobicContact CD1-CD1 4.4Å
242	D	75.7	Confident	86.6	Confident	55 Å²	55	75.2 Å²	75.2	29%	0.294	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-31.4	179.5	-70.7	-7.3	0	0	0	113.2	G239 R251 H252	G239-D242 VanDerWaalsContact O-CG 3.25Å; G239-D242 VanDerWaalsContact O-OD1 3.11Å; D242-R251 WeakPolarHBondContact O-CD 3.3Å; D242-R251 PolarHBondContact O-NH1 2.85Å; D242-H252 IonicContact OD1-CE1 3.29Å; D242-H252 PolarHBondContact OD1-CE1 2.94Å; D242-H252 IonicContact OD1-ND1 3.53Å; D242-H252 IonicContact OD1-NE2 2.88Å
243	R	80.7	Confident	86.9	Confident	253 Å²	253	69.9 Å²	69.9	96%	0.955	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	1.4	177.7	-62.3	-173.4	-179.3	173.5	0.2	114.6	I241	I241-R243 PolarHBondContact O-N 2.86Å; I241-R243 VanDerWaalsContact O-N 3.1Å
244	A	84.3	Confident	87.2	Confident	34 Å²	34	69.4 Å²	69.4	28%	0.281	34%	0.336	S	S	.	.	S	Bend	trans	-73.1	147	177.5	0	0	0	0	0	110.7	I241 L246 R251	I241-A244 HydrophobicContact CB-CB 4.09Å; I241-A244 VanDerWaalsContact O-CB 3.25Å; I241-A244 WeakPolarHBondContact O-CB 3.49Å; I241-A244 PolarHBondContact O-N 3.23Å; A244-L246 HydrophobicContact CB-CB 4.47Å; A244-L246 HydrophobicContact CB-CD1 3.89Å; A244-L246 HydrophobicContact CB-CG 4.02Å; A244-L246 PolarHBondContact O-N 3.48Å; A244-R251 WeakPolarHBondContact O-CD 3.36Å
245	D	88.3	Confident	87.3	Confident	171 Å²	171	69.4 Å²	69.4	91%	0.914	34%	0.336	S	S	*	.	S	Bend	trans	-77.5	73.7	172.5	-170.2	22.8	0	0	0	110
246	L	85.1	Confident	87.3	Confident	79 Å²	79	69.4 Å²	69.4	41%	0.414	34%	0.336	S	S	.	.			trans	-134.8	150.7	-175.8	-71.4	176.2	0	0	0	111.2	I241 A244 A250 R251	I241-L246 HydrophobicContact CD1-CD1 4.4Å; A244-L246 HydrophobicContact CB-CB 4.47Å; A244-L246 HydrophobicContact CB-CD1 3.89Å; A244-L246 HydrophobicContact CB-CG 4.02Å; A244-L246 PolarHBondContact O-N 3.48Å; L246-A250 HydrophobicContact CB-CB 4.39Å; L246-R251 HydrophobicContact CB-CG 3.76Å; L246-R251 PolarHBondContact O-NE 2.97Å
247	P	88.3	Confident	87.1	Confident	94 Å²	94	69.2 Å²	69.2	61%	0.61	34%	0.335	S	S	*	.			trans	-53.5	147.7	172.5	-24.9	33.9	0	0	0	112	N249 A250 R251	P247-N249 VanDerWaalsContact C-N 3.26Å; P247-N249 PolarHBondContact O-N 3.16Å; P247-A250 WeakPolarHBondContact O-CB 3.31Å; P247-A250 PolarHBondContact O-N 3.36Å; P247-R251 PolarHBondContact O-N 2.63Å
248	Y	89.4	Confident	87	Confident	105 Å²	105	72.9 Å²	72.9	41%	0.412	35%	0.348	S	S	.	.	H	α-helix	trans	-53.4	-41.4	-176.6	-178.9	-96.2	0	0	0	113.3	A250 R251 H252	Y248-A250 VanDerWaalsContact C-N 3.3Å; Y248-A250 PolarHBondContact O-N 3.37Å; Y248-R251 PolarHBondContact O-N 3.39Å; Y248-H252 AromaticContact CD2-CD2 3.64Å; Y248-H252 HydrophobicContact CE1-CB 4.5Å; Y248-H252 AromaticContact CE2-CD2 3.37Å; Y248-H252 WeakPolarHBondContact CE2-CD2 3.46Å; Y248-H252 AromaticContact CZ-CD2 3.89Å; Y248-H252 PolarHBondContact O-N 3.21Å
249	N	89	Confident	87	Confident	59 Å²	59	77.3 Å²	77.3	32%	0.316	37%	0.365	S	S	.	.	H	α-helix	trans	-66.4	-30.8	178.7	-70.1	-31	0	0	0	113.1	R236 P247 H252 P253 Q288 Q289	R236-N249 PolarHBondContact NH1-OD1 2.83Å; R236-N249 PolarHBondContact NH2-OD1 3.26Å; P247-N249 VanDerWaalsContact C-N 3.26Å; P247-N249 PolarHBondContact O-N 3.16Å; N249-H252 CarbonylContact O-C 3.28Å; N249-P253 WeakPolarHBondContact O-CA 3.42Å; N249-Q288 CarbonylContact C-O 3.57Å; N249-Q288 VanDerWaalsContact C-O 3.28Å; N249-Q289 HydrophobicContact CB-CG 4.37Å
250	A	87.4	Confident	87.6	Confident	19 Å²	19	76.1 Å²	76.1	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-78.6	-34.3	177.5	0	0	0	0	0	111.6	L246 P247 Y248 Q288	L246-A250 HydrophobicContact CB-CB 4.39Å; P247-A250 WeakPolarHBondContact O-CB 3.31Å; P247-A250 PolarHBondContact O-N 3.36Å; Y248-A250 VanDerWaalsContact C-N 3.3Å; Y248-A250 PolarHBondContact O-N 3.37Å; A250-Q288 WeakPolarHBondContact CA-O 3.5Å; A250-Q288 PolarHBondContact N-O 3.36Å
251	R	90.3	Very high	88.3	Confident	74 Å²	74	66.7 Å²	66.7	28%	0.279	32%	0.324	S	S	.	.	H	α-helix	trans	-69.4	-41.6	172.3	-70.7	-168.8	-79.6	165.8	0.2	112.4	D242 A244 L246 P247 Y248 P253	D242-R251 WeakPolarHBondContact O-CD 3.3Å; D242-R251 PolarHBondContact O-NH1 2.85Å; A244-R251 WeakPolarHBondContact O-CD 3.36Å; L246-R251 HydrophobicContact CB-CG 3.76Å; L246-R251 PolarHBondContact O-NE 2.97Å; P247-R251 PolarHBondContact O-N 2.63Å; Y248-R251 PolarHBondContact O-N 3.39Å; R251-P253 VanDerWaalsContact C-CD 3.46Å; R251-P253 WeakPolarHBondContact O-CD 3.3Å
252	H	92.2	Very high	88.9	Confident	18 Å²	18	63 Å²	63	8%	0.083	31%	0.305	C	S	.	.	S	Bend	trans	-124	72.1	-176.5	-53.3	-70.3	0	0	0	111.1	F228 R236 A237 D242 Y248 N249	F228-H252 HydrophobicContact CE1-CB 4.11Å; F228-H252 AromaticContact CE1-ND1 3.7Å; F228-H252 HydrophobicContact CZ-CB 3.88Å; F228-H252 AromaticContact CZ-CG 3.86Å; F228-H252 AromaticContact CZ-ND1 3.86Å; R236-H252 HydrophobicContact CB-CB 4.37Å; R236-H252 WeakPolarHBondContact CD-O 3.49Å; R236-H252 PolarHBondContact NH1-O 2.77Å; A237-H252 WeakPolarHBondContact O-CA 3.08Å; D242-H252 IonicContact OD1-CE1 3.29Å; D242-H252 PolarHBondContact OD1-CE1 2.94Å; D242-H252 IonicContact OD1-ND1 3.53Å; D242-H252 IonicContact OD1-NE2 2.88Å; Y248-H252 AromaticContact CD2-CD2 3.64Å; Y248-H252 HydrophobicContact CE1-CB 4.5Å; Y248-H252 AromaticContact CE2-CD2 3.37Å; Y248-H252 WeakPolarHBondContact CE2-CD2 3.46Å; Y248-H252 AromaticContact CZ-CD2 3.89Å; Y248-H252 PolarHBondContact O-N 3.21Å; N249-H252 CarbonylContact O-C 3.28Å
253	P	93.2	Very high	89.7	Confident	10 Å²	10	60.4 Å²	60.4	7%	0.065	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-67	149.1	-177.8	27.9	-34.9	0	0	0	111.6	R236 A237 N249 R251 Q289 W291	R236-P253 WeakPolarHBondContact CA-O 3.43Å; A237-P253 HydrophobicContact CB-CG 4.34Å; A237-P253 PolarHBondContact N-O 2.82Å; N249-P253 WeakPolarHBondContact O-CA 3.42Å; R251-P253 VanDerWaalsContact C-CD 3.46Å; R251-P253 WeakPolarHBondContact O-CD 3.3Å; P253-Q289 CarbonylContact C-O 3.58Å; P253-Q289 WeakPolarHBondContact CA-O 3.37Å; P253-W291 HydrophobicContact CB-CB 4.18Å; P253-W291 HydrophobicContact CG-CB 3.95Å; P253-W291 HydrophobicContact CG-CE3 4.47Å
254	F	94.6	Very high	90.3	Very high	15 Å²	15	52.5 Å²	52.5	7%	0.066	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.3	174.7	-62.6	-72.3	0	0	0	110.8	L195 T234 R236 L256 Q289 Y290 W291	L195-F254 HydrophobicContact CD1-CB 4.24Å; L195-F254 HydrophobicContact CD1-CD1 3.77Å; L195-F254 HydrophobicContact CD1-CD2 3.83Å; L195-F254 HydrophobicContact CD1-CE1 3.89Å; L195-F254 HydrophobicContact CD1-CE2 3.98Å; L195-F254 HydrophobicContact CD1-CG 3.71Å; L195-F254 HydrophobicContact CD1-CZ 3.98Å; T234-F254 HydrophobicContact CG2-CD1 4.4Å; T234-F254 HydrophobicContact CG2-CE1 3.98Å; T234-F254 VanDerWaalsContact OG1-CE1 3.28Å; T234-F254 WeakPolarHBondContact OG1-CE1 3.36Å; R236-F254 HydrophobicContact CG-CD1 3.94Å; R236-F254 HydrophobicContact CG-CE1 4.46Å; R236-F254 VanDerWaalsContact CZ-CZ 3.43Å; F254-L256 PolarHBondContact O-N 3.04Å; F254-Q289 VanDerWaalsContact CD2-O 3.3Å; F254-Q289 WeakPolarHBondContact CD2-O 3.19Å; F254-Q289 PolarHBondContact N-O 3.43Å; F254-Y290 HydrophobicContact CB-CD1 3.97Å; F254-Y290 HydrophobicContact CB-CE1 4.45Å; F254-Y290 HydrophobicContact CD2-CD1 4.05Å; F254-Y290 AromaticContact CD2-CE1 3.86Å; F254-Y290 HydrophobicContact CD2-CE1 3.86Å; F254-Y290 HydrophobicContact CG-CD1 4.5Å; F254-Y290 CarbonylContact O-C 3.44Å; F254-Y290 WeakPolarHBondContact O-CA 3.38Å; F254-W291 PolarHBondContact O-N 3.35Å
255	I	94.4	Very high	90.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	117	176	-61.2	179.8	0	0	0	109.1	Q199 Y203 L222 L225 P227 M235 A237	Q199-I255 PolarHBondContact NE2-O 3.29Å; Y203-I255 HydrophobicContact CE2-CG2 4.45Å; L222-I255 HydrophobicContact CD1-CG2 4.25Å; L222-I255 HydrophobicContact CD2-CG2 4.01Å; L225-I255 HydrophobicContact CB-CD1 4.41Å; L225-I255 HydrophobicContact CD1-CD1 4.22Å; P227-I255 HydrophobicContact CB-CD1 3.63Å; M235-I255 HydrophobicContact CE-CB 4.02Å; M235-I255 HydrophobicContact CE-CG2 3.91Å; M235-I255 HydrophobicContact CG-CD1 4.15Å; M235-I255 PolarHBondContact O-N 3.36Å; A237-I255 HydrophobicContact CB-CD1 4.03Å; A237-I255 HydrophobicContact CB-CG1 3.94Å
256	L	93.5	Very high	90.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-104	130.8	178.9	-79.6	-177.4	0	0	0	111.6	L195 F254 R258 T263 I266 Y290 W291 I292 P293	L195-L256 HydrophobicContact CD2-CD2 3.26Å; L195-L256 HydrophobicContact CD2-CG 4.34Å; F254-L256 PolarHBondContact O-N 3.04Å; L256-R258 PolarHBondContact O-N 3.35Å; L256-T263 HydrophobicContact CB-CG2 4.23Å; L256-T263 HydrophobicContact CD1-CG2 4.34Å; L256-I266 HydrophobicContact CD1-CD1 3.71Å; L256-I266 HydrophobicContact CD1-CG2 4.24Å; L256-I266 HydrophobicContact CD2-CD1 4.14Å; L256-Y290 HydrophobicContact CD1-CD1 3.49Å; L256-Y290 VanDerWaalsContact CD1-CD1 3.49Å; L256-Y290 HydrophobicContact CD1-CE1 4.24Å; L256-Y290 HydrophobicContact CD1-CG 3.75Å; L256-Y290 HydrophobicContact CG-CD1 3.87Å; L256-Y290 HydrophobicContact CG-CG 4.44Å; L256-W291 PolarHBondContact N-O 3.41Å; L256-I292 HydrophobicContact CB-CG1 3.84Å; L256-I292 HydrophobicContact CD1-CD1 4.43Å; L256-I292 HydrophobicContact CD1-CG1 4.18Å; L256-P293 WeakPolarHBondContact O-CD 3.37Å
257	P	91.9	Very high	91.2	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.019	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-66.6	127.4	173.5	25.5	-30.9	0	0	0	110.8	A198 C202 Y203 K259 H260 T263	A198-P257 HydrophobicContact CB-CG 4.28Å; C202-P257 HydrophobicContact CB-CB 3.47Å; C202-P257 VanDerWaalsContact CB-CB 3.47Å; C202-P257 HydrophobicContact CB-CG 3.95Å; C202-P257 WeakPolarHBondContact SG-CB 3.47Å; Y203-P257 HydrophobicContact CE2-CB 3.72Å; Y203-P257 HydrophobicContact CE2-CG 4.46Å; P257-K259 VanDerWaalsContact C-N 3.27Å; P257-K259 PolarHBondContact O-N 2.86Å; P257-H260 HydrophobicContact CB-CB 4.19Å; P257-H260 HydrophobicContact CG-CB 3.65Å; P257-T263 VanDerWaalsContact O-CB 3.3Å; P257-T263 WeakPolarHBondContact O-CB 3.37Å; P257-T263 PolarHBondContact O-OG1 2.91Å
258	R	89.3	Confident	91.4	Very high	85 Å²	85	38.6 Å²	38.6	32%	0.321	18%	0.183	S	C	.	.	S	Bend	trans	-57	-36.9	-178.9	172.8	179.5	163.8	-142.1	-1.9	113.9	L256 I292 A298	L256-R258 PolarHBondContact O-N 3.35Å; R258-I292 HydrophobicContact CB-CG2 4.3Å; R258-A298 HydrophobicContact CG-CB 4.18Å
259	K	86.2	Confident	91.5	Very high	181 Å²	181	35.2 Å²	35.2	79%	0.787	17%	0.171	S	C	*	.	S	Bend	trans	-107.6	66.6	-174.9	-68.5	-171.5	175.2	-170.7	0	110	P257	P257-K259 VanDerWaalsContact C-N 3.27Å; P257-K259 PolarHBondContact O-N 2.86Å
260	H	90.3	Very high	91.6	Very high	7 Å²	7	33 Å²	33	3%	0.032	16%	0.161	C	C	.	.			trans	-145.4	134.4	178.2	-170.8	-84.3	0	0	0	109.8	A198 E201 P257 L262 T263 D264	A198-H260 VanDerWaalsContact CB-CE1 3.47Å; A198-H260 WeakPolarHBondContact CB-CE1 3.48Å; E201-H260 IonicContact OE2-NE2 3.61Å; P257-H260 HydrophobicContact CB-CB 4.19Å; P257-H260 HydrophobicContact CG-CB 3.65Å; H260-L262 WeakPolarHBondContact ND1-CB 3.35Å; H260-L262 PolarHBondContact ND1-N 3.06Å; H260-L262 PolarHBondContact O-N 3.03Å; H260-L262 VanDerWaalsContact O-N 3.11Å; H260-T263 WeakPolarHBondContact O-CA 3.21Å; H260-T263 WeakPolarHBondContact O-CB 3.35Å; H260-T263 PolarHBondContact O-N 2.97Å; H260-D264 PolarHBondContact O-N 2.89Å
261	P	91.1	Very high	91.8	Very high	61 Å²	61	34.8 Å²	34.8	40%	0.396	17%	0.166	S	C	.	.	H	α-helix	trans	-54.5	-34.4	-177.8	-29.4	36.3	0	0	0	114.2	T147 T263 D264 M265	T147-P261 HydrophobicContact CG2-CB 4.23Å; T147-P261 WeakPolarHBondContact OG1-CB 3.48Å; P261-T263 VanDerWaalsContact C-N 3.32Å; P261-T263 PolarHBondContact O-N 3.12Å; P261-D264 PolarHBondContact O-N 2.64Å; P261-M265 WeakPolarHBondContact O-CG 3.37Å; P261-M265 PolarHBondContact O-N 3.24Å
262	L	92.3	Very high	91.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-42.1	173.2	-173.4	68.5	0	0	0	112.6	L143 L153 C194 L195 A198 H260 M265 I266	L143-L262 HydrophobicContact CD2-CD2 4.2Å; L153-L262 HydrophobicContact CD1-CD1 3.76Å; C194-L262 HydrophobicContact CB-CD1 4.3Å; C194-L262 HydrophobicContact CB-CD2 3.96Å; L195-L262 HydrophobicContact CD2-CD2 4.17Å; A198-L262 HydrophobicContact CB-CD2 3.94Å; H260-L262 WeakPolarHBondContact ND1-CB 3.35Å; H260-L262 PolarHBondContact ND1-N 3.06Å; H260-L262 PolarHBondContact O-N 3.03Å; H260-L262 VanDerWaalsContact O-N 3.11Å; L262-M265 HydrophobicContact CD1-CE 4.35Å; L262-M265 PolarHBondContact O-N 3.48Å; L262-I266 HydrophobicContact CG-CD1 4.03Å; L262-I266 VanDerWaalsContact O-CG1 3.31Å; L262-I266 WeakPolarHBondContact O-CG1 3.25Å; L262-I266 PolarHBondContact O-N 3.48Å
263	T	92.9	Very high	91.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.6	-41.6	-180	-56.2	0	0	0	0	110.5	L256 P257 H260 P261 M265 I266 I267 I292	L256-T263 HydrophobicContact CB-CG2 4.23Å; L256-T263 HydrophobicContact CD1-CG2 4.34Å; P257-T263 VanDerWaalsContact O-CB 3.3Å; P257-T263 WeakPolarHBondContact O-CB 3.37Å; P257-T263 PolarHBondContact O-OG1 2.91Å; H260-T263 WeakPolarHBondContact O-CA 3.21Å; H260-T263 WeakPolarHBondContact O-CB 3.35Å; H260-T263 PolarHBondContact O-N 2.97Å; P261-T263 VanDerWaalsContact C-N 3.32Å; P261-T263 PolarHBondContact O-N 3.12Å; T263-M265 VanDerWaalsContact C-N 3.33Å; T263-M265 PolarHBondContact O-N 3.33Å; T263-I266 PolarHBondContact O-N 2.95Å; T263-I267 HydrophobicContact CG2-CD1 4.1Å; T263-I267 VanDerWaalsContact O-CG1 3.3Å; T263-I267 WeakPolarHBondContact O-CG1 3.48Å; T263-I267 PolarHBondContact O-N 2.9Å; T263-I292 HydrophobicContact CG2-CD1 3.82Å; T263-I292 HydrophobicContact CG2-CG1 4.05Å; T263-I292 HydrophobicContact CG2-CG2 4.26Å
264	D	91.7	Very high	91.7	Very high	87 Å²	87	42.5 Å²	42.5	47%	0.465	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-42.7	176.2	-60.2	-29.9	0	0	0	111	H260 P261 I266 I267 D268	H260-D264 PolarHBondContact O-N 2.89Å; P261-D264 PolarHBondContact O-N 2.64Å; D264-I266 PolarHBondContact O-N 3.06Å; D264-I267 PolarHBondContact O-N 2.98Å; D264-D268 VanDerWaalsContact O-CB 3.28Å; D264-D268 WeakPolarHBondContact O-CB 3.3Å; D264-D268 PolarHBondContact O-N 3.16Å
265	M	91.8	Very high	91.4	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.069	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-37.3	175.2	-75.3	-173.2	-71.5	0	0	113.3	T147 L153 I156 P261 L262 T263 E269	T147-M265 HydrophobicContact CG2-CE 3.5Å; T147-M265 VanDerWaalsContact CG2-CE 3.5Å; L153-M265 HydrophobicContact CB-CB 4.46Å; I156-M265 HydrophobicContact CD1-CE 3.45Å; I156-M265 VanDerWaalsContact CD1-CE 3.45Å; I156-M265 HydrophobicContact CD1-SD 3.66Å; P261-M265 WeakPolarHBondContact O-CG 3.37Å; P261-M265 PolarHBondContact O-N 3.24Å; L262-M265 HydrophobicContact CD1-CE 4.35Å; L262-M265 PolarHBondContact O-N 3.48Å; T263-M265 VanDerWaalsContact C-N 3.33Å; T263-M265 PolarHBondContact O-N 3.33Å; M265-E269 WeakPolarHBondContact O-CB 3.28Å; M265-E269 PolarHBondContact O-N 3.03Å
266	I	93.4	Very high	91	Very high	6 Å²	6	56 Å²	56	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-41.7	176.2	-70.7	167.5	0	0	0	110.6	L153 L195 L256 L262 T263 D264 A270 L286 Y290	L153-I266 HydrophobicContact CD1-CG1 4.37Å; L153-I266 HydrophobicContact CD2-CG1 3.8Å; L195-I266 HydrophobicContact CD2-CD1 4.4Å; L256-I266 HydrophobicContact CD1-CD1 3.71Å; L256-I266 HydrophobicContact CD1-CG2 4.24Å; L256-I266 HydrophobicContact CD2-CD1 4.14Å; L262-I266 HydrophobicContact CG-CD1 4.03Å; L262-I266 VanDerWaalsContact O-CG1 3.31Å; L262-I266 WeakPolarHBondContact O-CG1 3.25Å; L262-I266 PolarHBondContact O-N 3.48Å; T263-I266 PolarHBondContact O-N 2.95Å; D264-I266 PolarHBondContact O-N 3.06Å; I266-A270 WeakPolarHBondContact O-CB 3.48Å; I266-A270 PolarHBondContact O-N 3Å; I266-L286 HydrophobicContact CG2-CD2 3.66Å; I266-Y290 HydrophobicContact CD1-CE1 4.19Å; I266-Y290 HydrophobicContact CG2-CD2 4.01Å; I266-Y290 HydrophobicContact CG2-CE2 3.88Å; I266-Y290 HydrophobicContact CG2-CG 4.48Å
267	I	92.4	Very high	90.4	Very high	15 Å²	15	56.6 Å²	56.6	8%	0.077	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-47.1	175.4	-67.3	166	0	0	0	110.4	T263 D264 A270 H271 L286 I292 A298 V299	T263-I267 HydrophobicContact CG2-CD1 4.1Å; T263-I267 VanDerWaalsContact O-CG1 3.3Å; T263-I267 WeakPolarHBondContact O-CG1 3.48Å; T263-I267 PolarHBondContact O-N 2.9Å; D264-I267 PolarHBondContact O-N 2.98Å; I267-A270 PolarHBondContact O-N 3.13Å; I267-H271 WeakPolarHBondContact O-CB 3.48Å; I267-H271 PolarHBondContact O-N 2.91Å; I267-L286 HydrophobicContact CB-CD1 4.5Å; I267-L286 HydrophobicContact CG1-CD1 3.88Å; I267-I292 HydrophobicContact CD1-CD1 4.01Å; I267-I292 HydrophobicContact CG1-CD1 3.92Å; I267-A298 HydrophobicContact CD1-CB 3.96Å; I267-V299 HydrophobicContact CD1-CG2 4.29Å; I267-V299 HydrophobicContact CG1-CG2 4.31Å; I267-V299 HydrophobicContact CG2-CB 4.41Å; I267-V299 HydrophobicContact CG2-CG1 4.29Å; I267-V299 HydrophobicContact CG2-CG2 3.95Å
268	D	91.3	Very high	90.3	Very high	52 Å²	52	59.5 Å²	59.5	28%	0.278	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-42.1	179.8	-179.4	48.7	0	0	0	111.8	D264 H271 R272	D264-D268 VanDerWaalsContact O-CB 3.28Å; D264-D268 WeakPolarHBondContact O-CB 3.3Å; D264-D268 PolarHBondContact O-N 3.16Å; D268-H271 PolarHBondContact O-N 3.17Å; D268-R272 VanDerWaalsContact CG-CZ 3.45Å; D268-R272 WeakPolarHBondContact O-CB 3.41Å; D268-R272 WeakPolarHBondContact O-CG 3.42Å; D268-R272 PolarHBondContact O-N 2.94Å; D268-R272 IonicContact OD1-CZ 3.8Å; D268-R272 IonicContact OD1-NE 3.98Å; D268-R272 PolarHBondContact OD1-NE 3.1Å; D268-R272 IonicContact OD1-NH2 2.78Å; D268-R272 PolarHBondContact OD1-NH2 2.93Å; D268-R272 IonicContact OD2-CZ 2.71Å; D268-R272 IonicContact OD2-NE 3.96Å; D268-R272 IonicContact OD2-NH1 3.36Å; D268-R272 PolarHBondContact OD2-NH1 2.74Å; D268-R272 IonicContact OD2-NH2 3.06Å; D268-R272 PolarHBondContact OD2-NH2 3.13Å
269	E	91.9	Very high	90.3	Very high	33 Å²	33	58.3 Å²	58.3	15%	0.154	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-44.4	174.4	-173.8	70.6	-169.5	0	0	111.7	L153 K154 M265 R272 T273	L153-E269 HydrophobicContact CD2-CB 4.46Å; K154-E269 VanDerWaalsContact CE-OE1 3.25Å; K154-E269 WeakPolarHBondContact CE-OE1 3.29Å; K154-E269 IonicContact NZ-OE1 3.62Å; K154-E269 PolarHBondContact NZ-OE1 2.88Å; M265-E269 WeakPolarHBondContact O-CB 3.28Å; M265-E269 PolarHBondContact O-N 3.03Å; E269-R272 PolarHBondContact O-N 3.18Å; E269-T273 VanDerWaalsContact O-CB 3.32Å; E269-T273 WeakPolarHBondContact O-CB 3.45Å; E269-T273 PolarHBondContact O-N 3.23Å; E269-T273 PolarHBondContact O-OG1 3.05Å
270	A	92.1	Very high	90.5	Very high	12 Å²	12	53.7 Å²	53.7	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-43.3	177.6	0	0	0	0	0	111.6	I266 I267 R272 T273 L274 T282 L286	I266-A270 WeakPolarHBondContact O-CB 3.48Å; I266-A270 PolarHBondContact O-N 3Å; I267-A270 PolarHBondContact O-N 3.13Å; A270-R272 PolarHBondContact O-N 3.03Å; A270-T273 PolarHBondContact O-N 3.34Å; A270-L274 WeakPolarHBondContact O-CB 3.41Å; A270-L274 WeakPolarHBondContact O-CG 3.46Å; A270-L274 PolarHBondContact O-N 3.18Å; A270-T282 HydrophobicContact CB-CG2 4.05Å; A270-L286 HydrophobicContact CB-CD2 3.79Å; A270-L286 HydrophobicContact CB-CG 4.05Å
271	H	91.7	Very high	90.5	Very high	58 Å²	58	58.7 Å²	58.7	27%	0.269	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-41.5	177.8	-176.6	63.4	0	0	0	112.2	I267 D268 H276 G277 T282	I267-H271 WeakPolarHBondContact O-CB 3.48Å; I267-H271 PolarHBondContact O-N 2.91Å; D268-H271 PolarHBondContact O-N 3.17Å; H271-H276 AromaticContact CD2-ND1 3.31Å; H271-H276 PolarHBondContact CD2-ND1 3.43Å; H271-H276 VanDerWaalsContact CD2-ND1 3.31Å; H271-H276 WeakPolarHBondContact CE1-CA 3.19Å; H271-H276 AromaticContact CE1-ND1 3.91Å; H271-H276 AromaticContact NE2-CG 3.7Å; H271-H276 AromaticContact NE2-ND1 2.95Å; H271-H276 PolarHBondContact NE2-ND1 3.4Å; H271-H276 WeakPolarHBondContact O-CA 3.3Å; H271-H276 PolarHBondContact O-N 2.93Å; H271-G277 PolarHBondContact CE1-O 2.73Å; H271-G277 PolarHBondContact ND1-O 2.71Å; H271-T282 HydrophobicContact CB-CG2 4.24Å
272	R	91	Very high	90.6	Very high	123 Å²	123	55.8 Å²	55.8	46%	0.464	28%	0.283	S	S	.	.	H	α-helix	trans	-67.2	-42.1	174.6	-74	-178.9	-174.1	144.2	13.1	112.7	D268 E269 A270 L274 H275	D268-R272 VanDerWaalsContact CG-CZ 3.45Å; D268-R272 WeakPolarHBondContact O-CB 3.41Å; D268-R272 WeakPolarHBondContact O-CG 3.42Å; D268-R272 PolarHBondContact O-N 2.94Å; D268-R272 IonicContact OD1-CZ 3.8Å; D268-R272 IonicContact OD1-NE 3.98Å; D268-R272 PolarHBondContact OD1-NE 3.1Å; D268-R272 IonicContact OD1-NH2 2.78Å; D268-R272 PolarHBondContact OD1-NH2 2.93Å; D268-R272 IonicContact OD2-CZ 2.71Å; D268-R272 IonicContact OD2-NE 3.96Å; D268-R272 IonicContact OD2-NH1 3.36Å; D268-R272 PolarHBondContact OD2-NH1 2.74Å; D268-R272 IonicContact OD2-NH2 3.06Å; D268-R272 PolarHBondContact OD2-NH2 3.13Å; E269-R272 PolarHBondContact O-N 3.18Å; A270-R272 PolarHBondContact O-N 3.03Å; R272-L274 PolarHBondContact O-N 2.95Å; R272-H275 PolarHBondContact O-N 2.92Å
273	T	90.7	Very high	90.6	Very high	85 Å²	85	55.9 Å²	55.9	52%	0.521	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-36	178.7	-59.5	0	0	0	0	111.2	E269 A270 H275	E269-T273 VanDerWaalsContact O-CB 3.32Å; E269-T273 WeakPolarHBondContact O-CB 3.45Å; E269-T273 PolarHBondContact O-N 3.23Å; E269-T273 PolarHBondContact O-OG1 3.05Å; A270-T273 PolarHBondContact O-N 3.34Å; T273-H275 PolarHBondContact O-N 3.42Å
274	L	91	Very high	90.4	Very high	56 Å²	56	59.5 Å²	59.5	29%	0.293	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	15.4	175.4	-64.3	172.2	0	0	0	113.6	A270 R272 H276 G277 Q281 E285	A270-L274 WeakPolarHBondContact O-CB 3.41Å; A270-L274 WeakPolarHBondContact O-CG 3.46Å; A270-L274 PolarHBondContact O-N 3.18Å; R272-L274 PolarHBondContact O-N 2.95Å; L274-H276 VanDerWaalsContact C-N 3.35Å; L274-H276 PolarHBondContact O-N 3.49Å; L274-G277 PolarHBondContact O-N 2.89Å; L274-Q281 HydrophobicContact CD1-CB 4.24Å; L274-E285 HydrophobicContact CD1-CB 3.89Å; L274-E285 HydrophobicContact CD1-CG 4.39Å
275	H	88.8	Confident	90.4	Very high	167 Å²	167	58.8 Å²	58.8	77%	0.773	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	47.7	-179.2	-58.4	-66	0	0	0	113.6	R272 T273 G277	R272-H275 PolarHBondContact O-N 2.92Å; T273-H275 PolarHBondContact O-N 3.42Å; H275-G277 VanDerWaalsContact C-N 3.28Å; H275-G277 PolarHBondContact O-N 3.31Å
276	H	85	Confident	90.5	Very high	132 Å²	132	58.4 Å²	58.4	61%	0.611	30%	0.301	S	S	*	.	S	Bend	trans	62.2	35.2	-175.6	-56.7	-76.4	0	0	0	113.7	H271 L274	H271-H276 AromaticContact CD2-ND1 3.31Å; H271-H276 PolarHBondContact CD2-ND1 3.43Å; H271-H276 VanDerWaalsContact CD2-ND1 3.31Å; H271-H276 WeakPolarHBondContact CE1-CA 3.19Å; H271-H276 AromaticContact CE1-ND1 3.91Å; H271-H276 AromaticContact NE2-CG 3.7Å; H271-H276 AromaticContact NE2-ND1 2.95Å; H271-H276 PolarHBondContact NE2-ND1 3.4Å; H271-H276 WeakPolarHBondContact O-CA 3.3Å; H271-H276 PolarHBondContact O-N 2.93Å; L274-H276 VanDerWaalsContact C-N 3.35Å; L274-H276 PolarHBondContact O-N 3.49Å
277	G	82.6	Confident	90.3	Very high	12 Å²	12	63.1 Å²	63.1	12%	0.124	32%	0.318	C	S	.	.			trans	-54.7	163.3	174.4	0	0	0	0	0	112.8	H271 L274 H275	H271-G277 PolarHBondContact CE1-O 2.73Å; H271-G277 PolarHBondContact ND1-O 2.71Å; L274-G277 PolarHBondContact O-N 2.89Å; H275-G277 VanDerWaalsContact C-N 3.28Å; H275-G277 PolarHBondContact O-N 3.31Å
278	S	89.1	Confident	90.2	Very high	64 Å²	64	66.9 Å²	66.9	45%	0.448	34%	0.335	S	S	.	.			trans	-58.9	160.8	-177.9	65.5	0	0	0	0	112.3	E280 Q281 T282	S278-E280 PolarHBondContact O-N 3.04Å; S278-Q281 PolarHBondContact O-N 3.35Å; S278-Q281 VanDerWaalsContact O-N 3.11Å; S278-Q281 WeakPolarHBondContact OG-CG 3.46Å; S278-Q281 PolarHBondContact OG-N 2.89Å; S278-Q281 PolarHBondContact OG-OE1 3.29Å; S278-T282 PolarHBondContact O-N 2.97Å; S278-T282 PolarHBondContact O-OG1 2.92Å; S278-T282 VanDerWaalsContact O-OG1 3.11Å
279	V	89.7	Confident	90.2	Very high	59 Å²	59	67.9 Å²	67.9	36%	0.358	34%	0.338	S	S	.	.	H	α-helix	trans	-53.2	-42.5	175.5	174.7	0	0	0	0	111.1	T282 L283 V299	V279-T282 PolarHBondContact O-N 3.29Å; V279-L283 HydrophobicContact CG1-CD1 3.9Å; V279-L283 HydrophobicContact CG1-CG 4.33Å; V279-L283 WeakPolarHBondContact O-CB 3.49Å; V279-L283 WeakPolarHBondContact O-CG 3.43Å; V279-L283 PolarHBondContact O-N 3.13Å; V279-V299 HydrophobicContact CB-CG1 4.38Å; V279-V299 HydrophobicContact CG1-CB 4.11Å; V279-V299 HydrophobicContact CG1-CG1 3.91Å; V279-V299 HydrophobicContact CG2-CG1 4.36Å
280	E	90.1	Very high	90.3	Very high	85 Å²	85	67.4 Å²	67.4	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-70.9	-34.3	-179.4	-68	-65.8	164.6	0	0	112.6	S278 L283 C284 R296	S278-E280 PolarHBondContact O-N 3.04Å; E280-L283 PolarHBondContact O-N 3.44Å; E280-C284 VanDerWaalsContact O-CB 3.32Å; E280-C284 WeakPolarHBondContact O-CB 3.45Å; E280-C284 PolarHBondContact O-N 3.17Å; E280-R296 IonicContact OE1-CZ 3.92Å; E280-R296 IonicContact OE1-NE 2.67Å; E280-R296 PolarHBondContact OE1-NE 2.88Å; E280-R296 IonicContact OE1-NH2 3.2Å; E280-R296 PolarHBondContact OE1-NH2 2.91Å; E280-R296 IonicContact OE2-NH2 2.91Å
281	Q	91.1	Very high	90.3	Very high	111 Å²	111	71.5 Å²	71.5	52%	0.519	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-46.6	172.3	-75.7	170	-37.4	0	0	111.2	L274 S278 L283 C284 E285	L274-Q281 HydrophobicContact CD1-CB 4.24Å; S278-Q281 PolarHBondContact O-N 3.35Å; S278-Q281 VanDerWaalsContact O-N 3.11Å; S278-Q281 WeakPolarHBondContact OG-CG 3.46Å; S278-Q281 PolarHBondContact OG-N 2.89Å; S278-Q281 PolarHBondContact OG-OE1 3.29Å; Q281-L283 VanDerWaalsContact C-N 3.31Å; Q281-L283 PolarHBondContact O-N 2.96Å; Q281-C284 WeakPolarHBondContact O-CB 3.33Å; Q281-C284 PolarHBondContact O-N 2.87Å; Q281-E285 PolarHBondContact O-N 3.41Å
282	T	92.4	Very high	90.3	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-42	177	-52.6	0	0	0	0	110.9	A270 H271 S278 V279 E285 L286 V299	A270-T282 HydrophobicContact CB-CG2 4.05Å; H271-T282 HydrophobicContact CB-CG2 4.24Å; S278-T282 PolarHBondContact O-N 2.97Å; S278-T282 PolarHBondContact O-OG1 2.92Å; S278-T282 VanDerWaalsContact O-OG1 3.11Å; V279-T282 PolarHBondContact O-N 3.29Å; T282-E285 PolarHBondContact O-N 3.46Å; T282-L286 HydrophobicContact CG2-CD1 4.02Å; T282-L286 HydrophobicContact CG2-CG 4.45Å; T282-L286 WeakPolarHBondContact O-CB 3.32Å; T282-L286 WeakPolarHBondContact O-CG 3.33Å; T282-L286 PolarHBondContact O-N 2.95Å; T282-V299 HydrophobicContact CG2-CG1 4.16Å
283	L	91.6	Very high	90.1	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-38.1	175.5	-73.9	175.2	0	0	0	113	V279 E280 Q281 R287 S295 R296 V299	V279-L283 HydrophobicContact CG1-CD1 3.9Å; V279-L283 HydrophobicContact CG1-CG 4.33Å; V279-L283 WeakPolarHBondContact O-CB 3.49Å; V279-L283 WeakPolarHBondContact O-CG 3.43Å; V279-L283 PolarHBondContact O-N 3.13Å; E280-L283 PolarHBondContact O-N 3.44Å; Q281-L283 VanDerWaalsContact C-N 3.31Å; Q281-L283 PolarHBondContact O-N 2.96Å; L283-R287 WeakPolarHBondContact O-CB 3.48Å; L283-R287 WeakPolarHBondContact O-CG 3.25Å; L283-R287 PolarHBondContact O-N 3.46Å; L283-S295 VanDerWaalsContact CD2-CB 3.45Å; L283-S295 WeakPolarHBondContact CD2-OG 3.36Å; L283-R296 HydrophobicContact CD1-CG 3.66Å; L283-V299 HydrophobicContact CD2-CB 4.34Å; L283-V299 HydrophobicContact CD2-CG2 3.57Å; L283-V299 HydrophobicContact CG-CG2 4.15Å
284	C	90.1	Very high	89.7	Confident	76 Å²	76	69 Å²	69	51%	0.514	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-47.4	176.1	-169	0	0	0	0	110.6	E280 Q281 R287 Q288	E280-C284 VanDerWaalsContact O-CB 3.32Å; E280-C284 WeakPolarHBondContact O-CB 3.45Å; E280-C284 PolarHBondContact O-N 3.17Å; Q281-C284 WeakPolarHBondContact O-CB 3.33Å; Q281-C284 PolarHBondContact O-N 2.87Å; C284-R287 PolarHBondContact O-N 3.02Å; C284-Q288 PolarHBondContact O-N 2.9Å
285	E	91.3	Very high	89.2	Confident	72 Å²	72	67.3 Å²	67.3	34%	0.336	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-49.1	177.3	-175.9	57	-154.1	0	0	111.5	L274 Q281 T282 R287 Q288	L274-E285 HydrophobicContact CD1-CB 3.89Å; L274-E285 HydrophobicContact CD1-CG 4.39Å; Q281-E285 PolarHBondContact O-N 3.41Å; T282-E285 PolarHBondContact O-N 3.46Å; E285-R287 VanDerWaalsContact C-N 3.29Å; E285-R287 PolarHBondContact O-N 3.06Å; E285-Q288 WeakPolarHBondContact O-CB 3.37Å; E285-Q288 PolarHBondContact O-N 3.49Å; E285-Q288 VanDerWaalsContact O-N 3.13Å; E285-Q288 PolarHBondContact OE2-NE2 2.89Å
286	L	92.7	Very high	88.9	Confident	7 Å²	7	67.2 Å²	67.2	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-58.6	-40.2	177.3	-71.8	171.4	0	0	0	112	I266 I267 A270 T282 Q288 Q289 Y290 I292 V299	I266-L286 HydrophobicContact CG2-CD2 3.66Å; I267-L286 HydrophobicContact CB-CD1 4.5Å; I267-L286 HydrophobicContact CG1-CD1 3.88Å; A270-L286 HydrophobicContact CB-CD2 3.79Å; A270-L286 HydrophobicContact CB-CG 4.05Å; T282-L286 HydrophobicContact CG2-CD1 4.02Å; T282-L286 HydrophobicContact CG2-CG 4.45Å; T282-L286 WeakPolarHBondContact O-CB 3.32Å; T282-L286 WeakPolarHBondContact O-CG 3.33Å; T282-L286 PolarHBondContact O-N 2.95Å; L286-Q288 PolarHBondContact O-N 3.31Å; L286-Q289 PolarHBondContact O-N 3.37Å; L286-Q289 VanDerWaalsContact O-N 3.13Å; L286-Y290 HydrophobicContact CD2-CD2 4.19Å; L286-Y290 WeakPolarHBondContact O-CA 3.33Å; L286-Y290 WeakPolarHBondContact O-CB 3.18Å; L286-Y290 PolarHBondContact O-N 3Å; L286-Y290 VanDerWaalsContact O-O 3.11Å; L286-I292 HydrophobicContact CD1-CD1 4.2Å; L286-V299 HydrophobicContact CD1-CG2 4.11Å
287	R	90	Very high	88.6	Confident	104 Å²	104	65.6 Å²	65.6	39%	0.392	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-17.5	-179.4	-80.6	173	-176.5	140.6	1	114.1	L283 C284 E285 Q289 Y290	L283-R287 WeakPolarHBondContact O-CB 3.48Å; L283-R287 WeakPolarHBondContact O-CG 3.25Å; L283-R287 PolarHBondContact O-N 3.46Å; C284-R287 PolarHBondContact O-N 3.02Å; E285-R287 VanDerWaalsContact C-N 3.29Å; E285-R287 PolarHBondContact O-N 3.06Å; R287-Q289 PolarHBondContact O-N 3.32Å; R287-Y290 WeakPolarHBondContact CA-O 3.44Å
288	Q	89.9	Confident	88.2	Confident	94 Å²	94	66.1 Å²	66.1	44%	0.439	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.7	175.2	-61.8	-180	33.8	0	0	112.7	N249 A250 C284 E285 L286	N249-Q288 CarbonylContact C-O 3.57Å; N249-Q288 VanDerWaalsContact C-O 3.28Å; A250-Q288 WeakPolarHBondContact CA-O 3.5Å; A250-Q288 PolarHBondContact N-O 3.36Å; C284-Q288 PolarHBondContact O-N 2.9Å; E285-Q288 WeakPolarHBondContact O-CB 3.37Å; E285-Q288 PolarHBondContact O-N 3.49Å; E285-Q288 VanDerWaalsContact O-N 3.13Å; E285-Q288 PolarHBondContact OE2-NE2 2.89Å; L286-Q288 PolarHBondContact O-N 3.31Å
289	Q	91.1	Very high	87.4	Confident	74 Å²	74	63.5 Å²	63.5	35%	0.346	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137	-22.9	-176.9	-61.7	-171.1	4.6	0	0	114.1	N249 P253 F254 L286 R287	N249-Q289 HydrophobicContact CB-CG 4.37Å; P253-Q289 CarbonylContact C-O 3.58Å; P253-Q289 WeakPolarHBondContact CA-O 3.37Å; F254-Q289 VanDerWaalsContact CD2-O 3.3Å; F254-Q289 WeakPolarHBondContact CD2-O 3.19Å; F254-Q289 PolarHBondContact N-O 3.43Å; L286-Q289 PolarHBondContact O-N 3.37Å; L286-Q289 VanDerWaalsContact O-N 3.13Å; R287-Q289 PolarHBondContact O-N 3.32Å
290	Y	93.7	Very high	86.2	Confident	23 Å²	23	72 Å²	72	9%	0.09	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143	-169.1	-52.6	-77.6	0	0	0	112.6	L195 F254 L256 I266 L286 R287	L195-Y290 HydrophobicContact CD1-CE1 4.46Å; L195-Y290 HydrophobicContact CD2-CE1 4.31Å; F254-Y290 HydrophobicContact CB-CD1 3.97Å; F254-Y290 HydrophobicContact CB-CE1 4.45Å; F254-Y290 HydrophobicContact CD2-CD1 4.05Å; F254-Y290 AromaticContact CD2-CE1 3.86Å; F254-Y290 HydrophobicContact CD2-CE1 3.86Å; F254-Y290 HydrophobicContact CG-CD1 4.5Å; F254-Y290 CarbonylContact O-C 3.44Å; F254-Y290 WeakPolarHBondContact O-CA 3.38Å; L256-Y290 HydrophobicContact CD1-CD1 3.49Å; L256-Y290 VanDerWaalsContact CD1-CD1 3.49Å; L256-Y290 HydrophobicContact CD1-CE1 4.24Å; L256-Y290 HydrophobicContact CD1-CG 3.75Å; L256-Y290 HydrophobicContact CG-CD1 3.87Å; L256-Y290 HydrophobicContact CG-CG 4.44Å; I266-Y290 HydrophobicContact CD1-CE1 4.19Å; I266-Y290 HydrophobicContact CG2-CD2 4.01Å; I266-Y290 HydrophobicContact CG2-CE2 3.88Å; I266-Y290 HydrophobicContact CG2-CG 4.48Å; L286-Y290 HydrophobicContact CD2-CD2 4.19Å; L286-Y290 WeakPolarHBondContact O-CA 3.33Å; L286-Y290 WeakPolarHBondContact O-CB 3.18Å; L286-Y290 PolarHBondContact O-N 3Å; L286-Y290 VanDerWaalsContact O-O 3.11Å; R287-Y290 WeakPolarHBondContact CA-O 3.44Å
291	W	92.1	Very high	86	Confident	98 Å²	98	71.4 Å²	71.4	37%	0.371	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	109.5	171.6	-170.9	-87.7	0	0	0	110.2	L225 P253 F254 L256	L225-W291 VanDerWaalsContact CD1-CD1 3.45Å; L225-W291 HydrophobicContact CD2-CD2 4.41Å; L225-W291 HydrophobicContact CD2-CZ2 3.83Å; P253-W291 HydrophobicContact CB-CB 4.18Å; P253-W291 HydrophobicContact CG-CB 3.95Å; P253-W291 HydrophobicContact CG-CE3 4.47Å; F254-W291 PolarHBondContact O-N 3.35Å; L256-W291 PolarHBondContact N-O 3.41Å
292	I	92.2	Very high	85.7	Confident	9 Å²	9	69.3 Å²	69.3	5%	0.046	31%	0.312	C	S	.	.			trans	-102.5	116.5	178	-57.8	165.9	0	0	0	108.4	L256 R258 T263 I267 L286 R294 S295 A298	L256-I292 HydrophobicContact CB-CG1 3.84Å; L256-I292 HydrophobicContact CD1-CD1 4.43Å; L256-I292 HydrophobicContact CD1-CG1 4.18Å; R258-I292 HydrophobicContact CB-CG2 4.3Å; T263-I292 HydrophobicContact CG2-CD1 3.82Å; T263-I292 HydrophobicContact CG2-CG1 4.05Å; T263-I292 HydrophobicContact CG2-CG2 4.26Å; I267-I292 HydrophobicContact CD1-CD1 4.01Å; I267-I292 HydrophobicContact CG1-CD1 3.92Å; L286-I292 HydrophobicContact CD1-CD1 4.2Å; I292-R294 PolarHBondContact O-N 3.11Å; I292-S295 VanDerWaalsContact O-CB 3.3Å; I292-S295 WeakPolarHBondContact O-CB 3.18Å; I292-S295 PolarHBondContact O-N 2.95Å; I292-A298 HydrophobicContact CG2-CB 4.07Å
293	P	86.4	Confident	85.3	Confident	30 Å²	30	73.1 Å²	73.1	20%	0.195	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	125.9	175.6	-25	35	0	0	0	111.2	L222 L256 S295	L222-P293 HydrophobicContact CD2-CG 4.08Å; L256-P293 WeakPolarHBondContact O-CD 3.37Å; P293-S295 VanDerWaalsContact C-N 3.34Å
294	R	83.3	Confident	84.9	Confident	174 Å²	174	77.3 Å²	77.3	66%	0.657	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	42.4	-174	-52.8	-179.3	179.8	-179.3	-1.9	112.9	I292 R296 Q297	I292-R294 PolarHBondContact O-N 3.11Å; R294-R296 VanDerWaalsContact C-N 3.29Å; R294-R296 PolarHBondContact O-N 3.41Å; R294-R296 VanDerWaalsContact O-N 3.16Å; R294-Q297 WeakPolarHBondContact O-CB 3.44Å; R294-Q297 PolarHBondContact O-N 2.91Å
295	S	79.7	Confident	84.6	Confident	21 Å²	21	77.4 Å²	77.4	15%	0.147	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-48.8	-40.4	-175.6	60.4	0	0	0	0	115.2	L283 I292 P293 Q297 A298 V299	L283-S295 VanDerWaalsContact CD2-CB 3.45Å; L283-S295 WeakPolarHBondContact CD2-OG 3.36Å; I292-S295 VanDerWaalsContact O-CB 3.3Å; I292-S295 WeakPolarHBondContact O-CB 3.18Å; I292-S295 PolarHBondContact O-N 2.95Å; P293-S295 VanDerWaalsContact C-N 3.34Å; S295-Q297 PolarHBondContact O-N 3.11Å; S295-Q297 VanDerWaalsContact O-N 3.13Å; S295-A298 WeakPolarHBondContact O-CA 3.32Å; S295-A298 WeakPolarHBondContact O-CB 3.35Å; S295-A298 PolarHBondContact O-N 3.24Å; S295-V299 PolarHBondContact O-N 3.3Å
296	R	82.3	Confident	84.2	Confident	164 Å²	164	77.7 Å²	77.7	62%	0.619	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-57.1	-26.5	175.4	-78	-175.9	171.5	167.1	0.4	114.6	E280 L283 R294	E280-R296 IonicContact OE1-CZ 3.92Å; E280-R296 IonicContact OE1-NE 2.67Å; E280-R296 PolarHBondContact OE1-NE 2.88Å; E280-R296 IonicContact OE1-NH2 3.2Å; E280-R296 PolarHBondContact OE1-NH2 2.91Å; E280-R296 IonicContact OE2-NH2 2.91Å; L283-R296 HydrophobicContact CD1-CG 3.66Å; R294-R296 VanDerWaalsContact C-N 3.29Å; R294-R296 PolarHBondContact O-N 3.41Å; R294-R296 VanDerWaalsContact O-N 3.16Å
297	Q	79.8	Confident	83.6	Confident	99 Å²	99	82.8 Å²	82.8	46%	0.463	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-88.7	-14.3	176.6	-62.4	179.2	0.6	0	0	112.6	R294 S295	R294-Q297 WeakPolarHBondContact O-CB 3.44Å; R294-Q297 PolarHBondContact O-N 2.91Å; S295-Q297 PolarHBondContact O-N 3.11Å; S295-Q297 VanDerWaalsContact O-N 3.13Å
298	A	73.4	Confident	83.1	Confident	23 Å²	23	81.2 Å²	81.2	19%	0.19	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-39.5	179.5	0	0	0	0	0	111.3	R258 I267 I292 S295 K300	R258-A298 HydrophobicContact CG-CB 4.18Å; I267-A298 HydrophobicContact CD1-CB 3.96Å; I292-A298 HydrophobicContact CG2-CB 4.07Å; S295-A298 WeakPolarHBondContact O-CA 3.32Å; S295-A298 WeakPolarHBondContact O-CB 3.35Å; S295-A298 PolarHBondContact O-N 3.24Å; A298-K300 PolarHBondContact O-N 3.23Å
299	V	73	Confident	82.5	Confident	8 Å²	8	80.1 Å²	80.1	5%	0.048	35%	0.351	C	S	.	.			trans	-83.7	109.7	172.9	-172.6	0	0	0	0	108.2	I267 V279 T282 L283 L286 S295	I267-V299 HydrophobicContact CD1-CG2 4.29Å; I267-V299 HydrophobicContact CG1-CG2 4.31Å; I267-V299 HydrophobicContact CG2-CB 4.41Å; I267-V299 HydrophobicContact CG2-CG1 4.29Å; I267-V299 HydrophobicContact CG2-CG2 3.95Å; V279-V299 HydrophobicContact CB-CG1 4.38Å; V279-V299 HydrophobicContact CG1-CB 4.11Å; V279-V299 HydrophobicContact CG1-CG1 3.91Å; V279-V299 HydrophobicContact CG2-CG1 4.36Å; T282-V299 HydrophobicContact CG2-CG1 4.16Å; L283-V299 HydrophobicContact CD2-CB 4.34Å; L283-V299 HydrophobicContact CD2-CG2 3.57Å; L283-V299 HydrophobicContact CG-CG2 4.15Å; L286-V299 HydrophobicContact CD1-CG2 4.11Å; S295-V299 PolarHBondContact O-N 3.3Å
300	K	63.1	Low	81.7	Confident	238 Å²	238	80.6 Å²	80.6	100%	1.035	35%	0.351	S	S	*	.			trans	-135.3	0	178.4	-76.5	-168.6	176.4	-170.2	0	110.6	A298	A298-K300 PolarHBondContact O-N 3.23Å

Retrieved 300 of 300 residues in 288.7 ms (Link to these results)

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