A0A087Y6K0_POEFO Loading...

Si:ch211-265g22.4

AlphaFold DB , UniProt , Accession A0A087Y6K0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	35.8	Very low	249 Å²	249	141.5 Å²	141.5	100%	1.227	84%	0.841	S	S	*	*				0	125.5	0	-77.8	149.1	168.5	0	0	107.8
2	Q	33.5	Very low	35.5	Very low	195 Å²	195	146.1 Å²	146.1	91%	0.911	84%	0.843	S	S	*	*			trans	-73.6	153.1	-170.5	-77.2	154	-20.6	0	0	112.5
3	C	35.2	Very low	36	Very low	118 Å²	118	142.9 Å²	142.9	80%	0.797	83%	0.834	S	S	*	*			trans	-67.2	142.3	169.4	46.5	0	0	0	0	112
4	S	33.7	Very low	35.9	Very low	125 Å²	125	139.5 Å²	139.5	87%	0.874	82%	0.822	S	S	*	*			trans	-176.3	114	151	-80.9	0	0	0	0	109.6
5	C	35.3	Very low	36.2	Very low	131 Å²	131	136.1 Å²	136.1	89%	0.885	81%	0.805	S	S	*	*			trans	-140.5	109.2	155.6	31.3	0	0	0	0	109.4
6	N	39.5	Very low	36.8	Very low	152 Å²	152	139.4 Å²	139.4	81%	0.813	80%	0.802	S	S	*	*			trans	-73.8	137.5	174.5	-159.5	25	0	0	0	108.7
7	S	33.6	Very low	37.1	Very low	105 Å²	105	143.8 Å²	143.8	73%	0.734	80%	0.802	S	S	*	*			trans	-139.4	90.6	168.8	-65.1	0	0	0	0	109.2	V9	S7-V9 PolarHBondContact O-N 2.85Å
8	S	41.9	Very low	37.3	Very low	114 Å²	114	141.8 Å²	141.8	80%	0.797	80%	0.799	S	S	*	*			trans	-69.7	115.2	154.4	-77.7	0	0	0	0	108
9	V	40.3	Very low	37.7	Very low	121 Å²	121	141.3 Å²	141.3	73%	0.733	78%	0.783	S	S	*	*			trans	-129	115.7	162.1	-170.8	0	0	0	0	107	S7	S7-V9 PolarHBondContact O-N 2.85Å
10	G	31.6	Very low	38	Very low	59 Å²	59	137 Å²	137	61%	0.608	77%	0.767	S	S	*	*			trans	-59.7	145.9	-171.5	0	0	0	0	0	113.3	F12	G10-F12 PolarHBondContact O-N 3.35Å
11	H	31.1	Very low	38.4	Very low	188 Å²	188	132.7 Å²	132.7	87%	0.87	74%	0.744	S	S	*	*			trans	-56.9	99.8	162.2	-78.5	-130.1	0	0	0	108.9	S13	H11-S13 VanDerWaalsContact C-N 3.31Å; H11-S13 PolarHBondContact O-N 3.46Å
12	F	32.7	Very low	39	Very low	196 Å²	196	124.5 Å²	124.5	86%	0.86	71%	0.705	S	S	*	*			trans	-67.6	97.8	160.4	-84.4	-85.2	0	0	0	107.5	G10 S14	G10-F12 PolarHBondContact O-N 3.35Å; F12-S14 PolarHBondContact O-N 3.43Å
13	S	41.6	Very low	39.4	Very low	105 Å²	105	118.3 Å²	118.3	73%	0.734	68%	0.675	S	S	*	*			trans	-58.9	102.7	165.9	-74.4	0	0	0	0	108.2	H11	H11-S13 VanDerWaalsContact C-N 3.31Å; H11-S13 PolarHBondContact O-N 3.46Å
14	S	35.3	Very low	39.7	Very low	95 Å²	95	114 Å²	114	66%	0.664	65%	0.646	S	S	*	*			trans	-61.1	133.1	170.9	-178.9	0	0	0	0	109	F12 Y16	F12-S14 PolarHBondContact O-N 3.43Å; S14-Y16 PolarHBondContact O-N 3.3Å
15	P	40.7	Very low	40.1	Very low	88 Å²	88	113 Å²	113	57%	0.571	63%	0.63	S	S	*	*			trans	-63.6	127	-170.6	-20.7	32.3	0	0	0	112.4	W17	P15-W17 VanDerWaalsContact CB-CD1 3.47Å; P15-W17 PolarHBondContact O-N 3.22Å
16	Y	46.1	Very low	40.5	Very low	190 Å²	190	112.3 Å²	112.3	75%	0.745	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-69.1	19.7	-173.2	-96.4	-97.8	0	0	0	116.3	S14	S14-Y16 PolarHBondContact O-N 3.3Å
17	W	40.7	Very low	40.6	Very low	214 Å²	214	105.6 Å²	105.6	81%	0.811	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-101.3	0.7	-167.8	65.4	-95.8	0	0	0	116.3	P15	P15-W17 VanDerWaalsContact CB-CD1 3.47Å; P15-W17 PolarHBondContact O-N 3.22Å
18	S	42	Very low	41.3	Very low	107 Å²	107	105.6 Å²	105.6	75%	0.748	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-92.5	3.8	170.1	-51.7	0	0	0	0	114.1	A20	S18-A20 PolarHBondContact O-N 3.22Å
19	R	44.9	Very low	42	Very low	132 Å²	132	105.8 Å²	105.8	50%	0.498	55%	0.546	S	S	.	.			trans	-98.3	55.5	-171.9	-162.6	163.5	176.9	148.6	-4.6	112.7	D25	R19-D25 IonicContact CZ-OD1 3.71Å; R19-D25 IonicContact CZ-OD2 2.95Å; R19-D25 IonicContact NH1-OD1 2.75Å; R19-D25 PolarHBondContact NH1-OD1 3.38Å; R19-D25 IonicContact NH1-OD2 3.1Å; R19-D25 PolarHBondContact NH1-OD2 3.47Å; R19-D25 IonicContact NH2-OD1 3.74Å; R19-D25 PolarHBondContact NH2-OD1 3.45Å; R19-D25 IonicContact NH2-OD2 2.78Å; R19-D25 PolarHBondContact NH2-OD2 2.8Å
20	A	43.1	Very low	42.5	Very low	56 Å²	56	105.5 Å²	105.5	46%	0.463	55%	0.547	S	S	.	.			trans	-109.8	43.3	176.3	0	0	0	0	0	112.5	S18 S156	S18-A20 PolarHBondContact O-N 3.22Å; A20-S156 PolarHBondContact O-OG 2.88Å
21	V	46	Very low	43.4	Very low	47 Å²	47	104.5 Å²	104.5	29%	0.285	53%	0.533	S	S	.	.	S	Bend	trans	-136.8	129.4	160.5	-141.5	0	0	0	0	109.1	F23	V21-F23 VanDerWaalsContact C-N 3.28Å; V21-F23 HydrophobicContact CB-CD2 4.26Å; V21-F23 HydrophobicContact CB-CE2 4.45Å; V21-F23 HydrophobicContact CG1-CD2 4.16Å; V21-F23 HydrophobicContact CG1-CE2 3.85Å; V21-F23 PolarHBondContact O-N 3.23Å
22	L	50.5	Low	44.4	Very low	77 Å²	77	98.8 Å²	98.8	40%	0.403	50%	0.504	S	S	.	.	S	Bend	trans	-64.1	64.2	-168.5	-72.1	164.8	0	0	0	114.5	F149 L152	L22-F149 HydrophobicContact CB-CD1 4.14Å; L22-F149 HydrophobicContact CB-CE1 3.37Å; L22-F149 HydrophobicContact CB-CE2 4.22Å; L22-F149 HydrophobicContact CB-CZ 3.42Å; L22-F149 VanDerWaalsContact CB-CZ 3.42Å; L22-F149 HydrophobicContact CD1-CB 4.41Å; L22-F149 HydrophobicContact CD1-CD1 3.55Å; L22-F149 HydrophobicContact CD1-CD2 3.52Å; L22-F149 HydrophobicContact CD1-CE1 3.56Å; L22-F149 HydrophobicContact CD1-CE2 3.54Å; L22-F149 HydrophobicContact CD1-CG 3.54Å; L22-F149 HydrophobicContact CD1-CZ 3.55Å; L22-F149 HydrophobicContact CG-CD1 4.47Å; L22-F149 HydrophobicContact CG-CE1 4.12Å; L22-F149 HydrophobicContact CG-CE2 4.47Å; L22-F149 HydrophobicContact CG-CZ 4.11Å; L22-L152 HydrophobicContact CD1-CD1 3.42Å; L22-L152 VanDerWaalsContact CD1-CD1 3.42Å; L22-L152 HydrophobicContact CD2-CD1 4.14Å; L22-L152 HydrophobicContact CG-CD1 3.74Å
23	F	41.8	Very low	45.6	Very low	64 Å²	64	91.5 Å²	91.5	28%	0.281	48%	0.477	S	S	.	.			trans	-140.8	132.7	177.2	-58	-73.9	0	0	0	112.5	V21 A27 Y28 F149	V21-F23 VanDerWaalsContact C-N 3.28Å; V21-F23 HydrophobicContact CB-CD2 4.26Å; V21-F23 HydrophobicContact CB-CE2 4.45Å; V21-F23 HydrophobicContact CG1-CD2 4.16Å; V21-F23 HydrophobicContact CG1-CE2 3.85Å; V21-F23 PolarHBondContact O-N 3.23Å; F23-A27 HydrophobicContact CB-CB 4.11Å; F23-Y28 HydrophobicContact CB-CD2 4.21Å; F23-Y28 HydrophobicContact CB-CE2 4.19Å; F23-F149 HydrophobicContact CE1-CE1 4.18Å; F23-F149 AromaticContact CZ-CE1 3.89Å; F23-F149 HydrophobicContact CZ-CE1 3.89Å
24	P	42.5	Very low	46.3	Very low	29 Å²	29	90.5 Å²	90.5	19%	0.188	47%	0.468	C	S	.	.			trans	-72.3	160.5	176	16.9	-16.4	0	0	0	113.3	W26 A27 Y28 N126 Y127	P24-W26 HydrophobicContact CG-CZ2 4.45Å; P24-W26 PolarHBondContact O-N 3.36Å; P24-A27 VanDerWaalsContact O-CB 3.32Å; P24-A27 WeakPolarHBondContact O-CB 3.17Å; P24-A27 PolarHBondContact O-N 2.83Å; P24-Y28 PolarHBondContact O-N 3.49Å; P24-N126 WeakPolarHBondContact CG-O 3.5Å; P24-Y127 HydrophobicContact CG-CD2 4.35Å
25	D	40.2	Very low	47.5	Very low	102 Å²	102	88.7 Å²	88.7	55%	0.545	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.6	-168.8	-69.8	-50.5	0	0	0	115.2	R19 Y28	R19-D25 IonicContact CZ-OD1 3.71Å; R19-D25 IonicContact CZ-OD2 2.95Å; R19-D25 IonicContact NH1-OD1 2.75Å; R19-D25 PolarHBondContact NH1-OD1 3.38Å; R19-D25 IonicContact NH1-OD2 3.1Å; R19-D25 PolarHBondContact NH1-OD2 3.47Å; R19-D25 IonicContact NH2-OD1 3.74Å; R19-D25 PolarHBondContact NH2-OD1 3.45Å; R19-D25 IonicContact NH2-OD2 2.78Å; R19-D25 PolarHBondContact NH2-OD2 2.8Å; D25-Y28 CarbonylContact O-C 3.27Å; D25-Y28 PolarHBondContact O-N 3.46Å; D25-Y28 VanDerWaalsContact O-O 3.07Å
26	W	44.9	Very low	49	Very low	117 Å²	117	85.9 Å²	85.9	44%	0.443	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.5	175.3	64.2	-99.2	0	0	0	113.4	P24 Y28 V125 N126	P24-W26 HydrophobicContact CG-CZ2 4.45Å; P24-W26 PolarHBondContact O-N 3.36Å; W26-Y28 VanDerWaalsContact C-N 3.32Å; W26-V125 HydrophobicContact CH2-CG1 4.07Å; W26-V125 WeakPolarHBondContact CH2-O 3.12Å; W26-V125 WeakPolarHBondContact CZ2-O 3.31Å; W26-N126 HydrophobicContact CH2-CB 4.34Å; W26-N126 WeakPolarHBondContact CH2-OD1 3.28Å; W26-N126 HydrophobicContact CZ2-CB 4.22Å; W26-N126 WeakPolarHBondContact CZ2-O 3.48Å
27	A	42.1	Very low	50.4	Low	12 Å²	12	84.9 Å²	84.9	10%	0.099	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-23.9	168.2	0	0	0	0	0	110.8	F23 P24 K29	F23-A27 HydrophobicContact CB-CB 4.11Å; P24-A27 VanDerWaalsContact O-CB 3.32Å; P24-A27 WeakPolarHBondContact O-CB 3.17Å; P24-A27 PolarHBondContact O-N 2.83Å; A27-K29 PolarHBondContact O-N 2.88Å
28	Y	48.4	Very low	52.4	Low	105 Å²	105	80.3 Å²	80.3	41%	0.412	43%	0.43	S	S	.	.			trans	-95.7	60.8	166.5	-91.7	-86.2	0	0	0	111.7	F23 P24 D25 W26	F23-Y28 HydrophobicContact CB-CD2 4.21Å; F23-Y28 HydrophobicContact CB-CE2 4.19Å; P24-Y28 PolarHBondContact O-N 3.49Å; D25-Y28 CarbonylContact O-C 3.27Å; D25-Y28 PolarHBondContact O-N 3.46Å; D25-Y28 VanDerWaalsContact O-O 3.07Å; W26-Y28 VanDerWaalsContact C-N 3.32Å
29	K	54.8	Low	54.4	Low	118 Å²	118	75.4 Å²	75.4	51%	0.513	40%	0.395	S	S	.	.			trans	-70	139.4	156.9	-79	177.5	-176.3	-174.9	0	107.5	A27 A31 W32	A27-K29 PolarHBondContact O-N 2.88Å; K29-A31 PolarHBondContact O-N 3.34Å; K29-W32 HydrophobicContact CB-CG 4.09Å; K29-W32 WeakPolarHBondContact O-CA 3.24Å; K29-W32 WeakPolarHBondContact O-CB 3.32Å; K29-W32 PolarHBondContact O-N 3.33Å
30	P	52.2	Low	56.6	Low	115 Å²	115	72.6 Å²	72.6	75%	0.747	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-52.6	-30.6	-179	-27.6	34	0	0	0	113.6	W32 S33	P30-W32 PolarHBondContact O-N 2.9Å; P30-S33 PolarHBondContact O-N 3.33Å; P30-S33 PolarHBondContact O-OG 2.83Å
31	A	50.6	Low	59	Low	38 Å²	38	70.1 Å²	70.1	31%	0.314	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-67.7	-2.8	173.2	0	0	0	0	0	115.3	K29 S36 Q38 V39	K29-A31 PolarHBondContact O-N 3.34Å; A31-S36 VanDerWaalsContact C-OG 3.24Å; A31-S36 VanDerWaalsContact O-CB 3.3Å; A31-S36 WeakPolarHBondContact O-CB 3.45Å; A31-S36 PolarHBondContact O-OG 2.97Å; A31-Q38 HydrophobicContact CB-CB 3.92Å; A31-Q38 HydrophobicContact CB-CG 3.85Å; A31-Q38 CarbonylContact O-C 3.59Å; A31-Q38 VanDerWaalsContact O-C 3.27Å; A31-Q38 WeakPolarHBondContact O-CA 3.03Å; A31-Q38 WeakPolarHBondContact O-CB 3.2Å; A31-V39 PolarHBondContact O-N 3.38Å
32	W	51.8	Low	61.2	Low	67 Å²	67	69 Å²	69	25%	0.254	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-125.7	1.3	-174.4	-56	61.5	0	0	0	111.3	K29 P30 Q40 H43	K29-W32 HydrophobicContact CB-CG 4.09Å; K29-W32 WeakPolarHBondContact O-CA 3.24Å; K29-W32 WeakPolarHBondContact O-CB 3.32Å; K29-W32 PolarHBondContact O-N 3.33Å; P30-W32 PolarHBondContact O-N 2.9Å; W32-Q40 HydrophobicContact CE3-CG 4.2Å; W32-Q40 HydrophobicContact CH2-CG 3.71Å; W32-Q40 HydrophobicContact CZ3-CB 4.09Å; W32-Q40 HydrophobicContact CZ3-CG 3.42Å; W32-Q40 VanDerWaalsContact CZ3-CG 3.42Å; W32-H43 AromaticContact CE3-CE1 3.4Å; W32-H43 AromaticContact CE3-ND1 3.52Å; W32-H43 AromaticContact CZ3-CE1 3.32Å; W32-H43 WeakPolarHBondContact CZ3-CE1 3.44Å; W32-H43 AromaticContact CZ3-ND1 3.5Å
33	S	57.9	Low	63	Low	43 Å²	43	67 Å²	67	30%	0.301	35%	0.346	S	S	.	.	S	Bend	trans	-52.4	143.1	171.4	-49.2	0	0	0	0	110.3	P30 G35 S36	P30-S33 PolarHBondContact O-N 3.33Å; P30-S33 PolarHBondContact O-OG 2.83Å; S33-G35 PolarHBondContact O-N 3.08Å; S33-G35 VanDerWaalsContact O-N 3.15Å; S33-S36 VanDerWaalsContact O-CB 3.24Å; S33-S36 WeakPolarHBondContact O-CB 3.33Å; S33-S36 PolarHBondContact O-N 3.37Å
34	P	55.7	Low	65.4	Low	85 Å²	85	64.1 Å²	64.1	55%	0.552	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	122.7	168.3	-25.5	34.5	0	0	0	109.6
35	G	60.7	Low	67.8	Low	57 Å²	57	62.8 Å²	62.8	59%	0.588	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	-8.4	-172.7	0	0	0	0	0	116.1	S33	S33-G35 PolarHBondContact O-N 3.08Å; S33-G35 VanDerWaalsContact O-N 3.15Å
36	S	71.7	Confident	70.1	Confident	29 Å²	29	59.4 Å²	59.4	20%	0.203	31%	0.306	C	S	.	.			trans	-74.9	136.1	174.2	-172.5	0	0	0	0	112.1	A31 S33 Q38 V39	A31-S36 VanDerWaalsContact C-OG 3.24Å; A31-S36 VanDerWaalsContact O-CB 3.3Å; A31-S36 WeakPolarHBondContact O-CB 3.45Å; A31-S36 PolarHBondContact O-OG 2.97Å; S33-S36 VanDerWaalsContact O-CB 3.24Å; S33-S36 WeakPolarHBondContact O-CB 3.33Å; S33-S36 PolarHBondContact O-N 3.37Å; S36-Q38 PolarHBondContact O-N 3.14Å; S36-Q38 VanDerWaalsContact O-N 3.16Å; S36-Q38 PolarHBondContact OG-N 3.38Å; S36-V39 VanDerWaalsContact O-CG1 3.27Å; S36-V39 WeakPolarHBondContact O-CG1 3.43Å; S36-V39 PolarHBondContact O-N 3.4Å
37	R	76.2	Confident	72.1	Confident	169 Å²	169	56.5 Å²	56.5	64%	0.638	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.7	172.5	-55	-170.5	-160	-87.3	2.8	112.9	K82	R37-K82 WeakPolarHBondContact O-CD 3.39Å; R37-K82 WeakPolarHBondContact O-CE 3.46Å; R37-K82 PolarHBondContact O-NZ 3.01Å
38	Q	82.1	Confident	74.4	Confident	118 Å²	118	56.7 Å²	56.7	55%	0.551	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	0.3	-178.6	-173.1	66.3	18.3	0	0	113	A31 S36	A31-Q38 HydrophobicContact CB-CB 3.92Å; A31-Q38 HydrophobicContact CB-CG 3.85Å; A31-Q38 CarbonylContact O-C 3.59Å; A31-Q38 VanDerWaalsContact O-C 3.27Å; A31-Q38 WeakPolarHBondContact O-CA 3.03Å; A31-Q38 WeakPolarHBondContact O-CB 3.2Å; S36-Q38 PolarHBondContact O-N 3.14Å; S36-Q38 VanDerWaalsContact O-N 3.16Å; S36-Q38 PolarHBondContact OG-N 3.38Å
39	V	85.4	Confident	76.3	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	28%	0.28	C	S	.	.			trans	-53.7	147.5	172.1	71.5	0	0	0	0	112.1	A31 S36 H43 F44 W78 R81 K82	A31-V39 PolarHBondContact O-N 3.38Å; S36-V39 VanDerWaalsContact O-CG1 3.27Å; S36-V39 WeakPolarHBondContact O-CG1 3.43Å; S36-V39 PolarHBondContact O-N 3.4Å; V39-H43 HydrophobicContact CG2-CB 3.86Å; V39-F44 HydrophobicContact CG2-CB 4.49Å; V39-W78 HydrophobicContact CG1-CH2 4.12Å; V39-W78 HydrophobicContact CG1-CZ3 3.77Å; V39-W78 WeakPolarHBondContact O-CH2 3.4Å; V39-R81 HydrophobicContact CG1-CG 3.64Å; V39-K82 HydrophobicContact CG1-CD 4.4Å; V39-K82 PolarHBondContact O-NZ 3.39Å
40	Q	90.3	Very high	77.6	Confident	74 Å²	74	46.9 Å²	46.9	35%	0.346	26%	0.259	S	S	.	.			trans	-92.2	153.3	174.6	-68.7	-173.8	-18.3	0	0	111.3	W32 W42 H43 F44	W32-Q40 HydrophobicContact CE3-CG 4.2Å; W32-Q40 HydrophobicContact CH2-CG 3.71Å; W32-Q40 HydrophobicContact CZ3-CB 4.09Å; W32-Q40 HydrophobicContact CZ3-CG 3.42Å; W32-Q40 VanDerWaalsContact CZ3-CG 3.42Å; Q40-W42 VanDerWaalsContact C-N 3.32Å; Q40-W42 PolarHBondContact O-N 3.41Å; Q40-H43 WeakPolarHBondContact O-CB 3.33Å; Q40-H43 PolarHBondContact O-N 3.29Å; Q40-F44 PolarHBondContact O-N 3.48Å
41	L	93	Very high	78.5	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-43.1	-176.1	175.6	64.3	0	0	0	112.2	H43 F44 L45 W78 L92 A95 L96 Y99	L41-H43 VanDerWaalsContact C-N 3.33Å; L41-H43 PolarHBondContact O-N 2.88Å; L41-F44 HydrophobicContact CD1-CD1 4.22Å; L41-F44 WeakPolarHBondContact O-CB 3.44Å; L41-F44 PolarHBondContact O-N 2.87Å; L41-L45 HydrophobicContact CD1-CD1 4.27Å; L41-L45 HydrophobicContact CD1-CD2 4.47Å; L41-L45 HydrophobicContact CD1-CG 4.12Å; L41-L45 HydrophobicContact CG-CD1 3.99Å; L41-L45 HydrophobicContact CG-CG 4.3Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.45Å; L41-L45 PolarHBondContact O-N 3.22Å; L41-W78 HydrophobicContact CB-CH2 4.16Å; L41-W78 HydrophobicContact CB-CZ2 3.9Å; L41-W78 HydrophobicContact CD1-CD2 3.87Å; L41-W78 HydrophobicContact CD1-CE3 4.25Å; L41-W78 HydrophobicContact CD1-CG 4.08Å; L41-W78 HydrophobicContact CD1-CZ2 4.42Å; L41-L92 HydrophobicContact CD1-CD1 3.93Å; L41-L92 HydrophobicContact CD1-CD2 4.32Å; L41-L92 HydrophobicContact CD1-CG 3.92Å; L41-L92 HydrophobicContact CD2-CD2 3.94Å; L41-L92 HydrophobicContact CD2-CG 3.85Å; L41-A95 HydrophobicContact CD2-CB 3.68Å; L41-L96 HydrophobicContact CD2-CD2 3.97Å; L41-L96 HydrophobicContact CD2-CG 4.13Å; L41-Y99 HydrophobicContact CB-CE2 4.11Å; L41-Y99 HydrophobicContact CD2-CE2 4.22Å; L41-Y99 HydrophobicContact CG-CE2 4.36Å
42	W	92.4	Very high	79.1	Confident	22 Å²	22	45.1 Å²	45.1	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-35.4	-178.7	71.8	-94.3	0	0	0	113.1	Q40 L45 L46 Y99 I104 F117 L122	Q40-W42 VanDerWaalsContact C-N 3.32Å; Q40-W42 PolarHBondContact O-N 3.41Å; W42-L45 PolarHBondContact O-N 3.24Å; W42-L46 HydrophobicContact CE3-CD1 3.73Å; W42-L46 HydrophobicContact CZ3-CD1 3.77Å; W42-L46 WeakPolarHBondContact O-CG 2.88Å; W42-L46 PolarHBondContact O-N 2.96Å; W42-L46 VanDerWaalsContact O-N 3.15Å; W42-Y99 HydrophobicContact CB-CD2 4.48Å; W42-Y99 HydrophobicContact CB-CE2 3.94Å; W42-Y99 AromaticContact CD1-CZ 3.79Å; W42-I104 HydrophobicContact CB-CG2 3.93Å; W42-I104 HydrophobicContact CD2-CG2 4.47Å; W42-I104 HydrophobicContact CG-CG2 4.03Å; W42-F117 HydrophobicContact CB-CE1 4.23Å; W42-L122 HydrophobicContact CE3-CD2 4.22Å; W42-L122 HydrophobicContact CH2-CD2 4.08Å; W42-L122 HydrophobicContact CZ2-CD2 4.48Å; W42-L122 HydrophobicContact CZ3-CD2 3.96Å
43	H	88.9	Confident	79.1	Confident	37 Å²	37	48.7 Å²	48.7	17%	0.171	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-46	172.4	-75.8	111.7	0	0	0	111	W32 V39 Q40 L41 L45 L46 E47	W32-H43 AromaticContact CE3-CE1 3.4Å; W32-H43 AromaticContact CE3-ND1 3.52Å; W32-H43 AromaticContact CZ3-CE1 3.32Å; W32-H43 WeakPolarHBondContact CZ3-CE1 3.44Å; W32-H43 AromaticContact CZ3-ND1 3.5Å; V39-H43 HydrophobicContact CG2-CB 3.86Å; Q40-H43 WeakPolarHBondContact O-CB 3.33Å; Q40-H43 PolarHBondContact O-N 3.29Å; L41-H43 VanDerWaalsContact C-N 3.33Å; L41-H43 PolarHBondContact O-N 2.88Å; H43-L45 VanDerWaalsContact C-N 3.32Å; H43-L45 PolarHBondContact O-N 3.4Å; H43-L46 PolarHBondContact O-N 3.19Å; H43-E47 PolarHBondContact O-N 2.78Å
44	F	91.3	Very high	79.1	Confident	3 Å²	3	47.7 Å²	47.7	1%	0.013	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-38.3	177.3	172.1	-104.7	0	0	0	113.1	V39 Q40 L41 E47 L48 L74 L77 W78 R81	V39-F44 HydrophobicContact CG2-CB 4.49Å; Q40-F44 PolarHBondContact O-N 3.48Å; L41-F44 HydrophobicContact CD1-CD1 4.22Å; L41-F44 WeakPolarHBondContact O-CB 3.44Å; L41-F44 PolarHBondContact O-N 2.87Å; F44-E47 WeakPolarHBondContact O-CB 3.41Å; F44-E47 PolarHBondContact O-N 2.98Å; F44-L48 HydrophobicContact CD1-CD1 4.12Å; F44-L48 HydrophobicContact CE1-CD1 3.43Å; F44-L48 VanDerWaalsContact CE1-CD1 3.43Å; F44-L48 HydrophobicContact CE1-CG 4.18Å; F44-L48 HydrophobicContact CE2-CD1 4.13Å; F44-L48 HydrophobicContact CE2-CD2 4.4Å; F44-L48 HydrophobicContact CE2-CG 4.07Å; F44-L48 HydrophobicContact CZ-CD1 3.45Å; F44-L48 VanDerWaalsContact CZ-CD1 3.45Å; F44-L48 HydrophobicContact CZ-CD2 4.34Å; F44-L48 HydrophobicContact CZ-CG 3.91Å; F44-L48 WeakPolarHBondContact O-CG 3.33Å; F44-L48 PolarHBondContact O-N 2.99Å; F44-L74 HydrophobicContact CE1-CD1 4.05Å; F44-L77 HydrophobicContact CZ-CB 3.84Å; F44-W78 HydrophobicContact CB-CE3 3.86Å; F44-W78 HydrophobicContact CB-CH2 4.48Å; F44-W78 HydrophobicContact CB-CZ3 3.5Å; F44-W78 HydrophobicContact CD1-CB 4.35Å; F44-W78 HydrophobicContact CD1-CD2 4.14Å; F44-W78 AromaticContact CD1-CE3 3.34Å; F44-W78 HydrophobicContact CD1-CE3 3.34Å; F44-W78 AromaticContact CD1-CZ3 3.94Å; F44-W78 HydrophobicContact CD1-CZ3 3.94Å; F44-W78 HydrophobicContact CD2-CE3 4.09Å; F44-W78 HydrophobicContact CD2-CZ3 4.29Å; F44-W78 HydrophobicContact CE1-CB 3.77Å; F44-W78 HydrophobicContact CE1-CD2 4.4Å; F44-W78 AromaticContact CE1-CE3 3.8Å; F44-W78 HydrophobicContact CE1-CE3 3.8Å; F44-W78 HydrophobicContact CE1-CG 4.45Å; F44-W78 HydrophobicContact CE2-CE3 4.48Å; F44-W78 AromaticContact CG-CE3 3.48Å; F44-W78 HydrophobicContact CG-CE3 3.48Å; F44-W78 VanDerWaalsContact CG-CE3 3.48Å; F44-W78 AromaticContact CG-CZ3 3.65Å; F44-W78 HydrophobicContact CG-CZ3 3.65Å; F44-W78 HydrophobicContact CZ-CB 4.36Å; F44-W78 HydrophobicContact CZ-CE3 4.33Å; F44-R81 HydrophobicContact CD2-CB 4.43Å; F44-R81 HydrophobicContact CD2-CG 4.13Å; F44-R81 HydrophobicContact CE2-CB 4.13Å; F44-R81 HydrophobicContact CE2-CG 4.28Å
45	L	93.2	Very high	80.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-41.3	174.5	-69.8	169.9	0	0	0	111.8	L41 W42 H43 E47 L48 L49 I57 F66 L74 L96 F117	L41-L45 HydrophobicContact CD1-CD1 4.27Å; L41-L45 HydrophobicContact CD1-CD2 4.47Å; L41-L45 HydrophobicContact CD1-CG 4.12Å; L41-L45 HydrophobicContact CG-CD1 3.99Å; L41-L45 HydrophobicContact CG-CG 4.3Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.45Å; L41-L45 PolarHBondContact O-N 3.22Å; W42-L45 PolarHBondContact O-N 3.24Å; H43-L45 VanDerWaalsContact C-N 3.32Å; H43-L45 PolarHBondContact O-N 3.4Å; L45-E47 VanDerWaalsContact C-N 3.34Å; L45-L48 PolarHBondContact O-N 3.36Å; L45-L49 WeakPolarHBondContact O-CB 3.46Å; L45-L49 WeakPolarHBondContact O-CD1 3.47Å; L45-L49 WeakPolarHBondContact O-CG 3.31Å; L45-L49 PolarHBondContact O-N 3.19Å; L45-I57 HydrophobicContact CB-CD1 4.43Å; L45-I57 HydrophobicContact CD2-CD1 3.86Å; L45-I57 WeakPolarHBondContact O-CD1 3.36Å; L45-F66 HydrophobicContact CD1-CE2 4.49Å; L45-F66 HydrophobicContact CD1-CZ 4.16Å; L45-L74 HydrophobicContact CD2-CD1 3.72Å; L45-L74 HydrophobicContact CD2-CD2 3.97Å; L45-L74 HydrophobicContact CD2-CG 4.44Å; L45-L96 HydrophobicContact CD1-CD2 3.7Å; L45-F117 HydrophobicContact CB-CZ 4.06Å
46	L	89.1	Confident	81.4	Confident	32 Å²	32	43 Å²	43	17%	0.168	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-38.9	175.5	-71.7	173.6	0	0	0	112.1	W42 H43 L49 G50 W59 F117 F119	W42-L46 HydrophobicContact CE3-CD1 3.73Å; W42-L46 HydrophobicContact CZ3-CD1 3.77Å; W42-L46 WeakPolarHBondContact O-CG 2.88Å; W42-L46 PolarHBondContact O-N 2.96Å; W42-L46 VanDerWaalsContact O-N 3.15Å; H43-L46 PolarHBondContact O-N 3.19Å; L46-L49 PolarHBondContact O-N 3.31Å; L46-G50 PolarHBondContact O-N 3.1Å; L46-W59 HydrophobicContact CD2-CH2 3.94Å; L46-W59 HydrophobicContact CD2-CZ2 4.43Å; L46-F117 HydrophobicContact CD2-CD2 3.91Å; L46-F117 HydrophobicContact CD2-CE1 4.29Å; L46-F117 HydrophobicContact CD2-CE2 3.61Å; L46-F117 HydrophobicContact CD2-CG 4.37Å; L46-F117 HydrophobicContact CD2-CZ 3.81Å; L46-F117 HydrophobicContact CG-CE1 4.22Å; L46-F117 HydrophobicContact CG-CE2 4.18Å; L46-F117 HydrophobicContact CG-CZ 3.86Å; L46-F119 HydrophobicContact CD2-CE1 4.18Å; L46-F119 HydrophobicContact CD2-CZ 4.44Å
47	E	86.7	Confident	82.4	Confident	55 Å²	55	42.2 Å²	42.2	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-49.9	175.1	-171.8	-173.7	149.7	0	0	111.1	H43 F44 L45 L49 G50 C51 R81	H43-E47 PolarHBondContact O-N 2.78Å; F44-E47 WeakPolarHBondContact O-CB 3.41Å; F44-E47 PolarHBondContact O-N 2.98Å; L45-E47 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 3.25Å; E47-G50 WeakPolarHBondContact O-CA 3.38Å; E47-G50 PolarHBondContact O-N 3.09Å; E47-C51 PolarHBondContact O-N 3.08Å; E47-R81 VanDerWaalsContact CD-NH1 3.32Å; E47-R81 IonicContact OE1-CZ 2.81Å; E47-R81 IonicContact OE1-NH1 3.18Å; E47-R81 PolarHBondContact OE1-NH1 3.3Å; E47-R81 VanDerWaalsContact OE1-NH1 3.1Å; E47-R81 IonicContact OE1-NH2 3.32Å; E47-R81 PolarHBondContact OE1-NH2 2.9Å; E47-R81 IonicContact OE2-CZ 3.35Å; E47-R81 IonicContact OE2-NH1 3.1Å; E47-R81 PolarHBondContact OE2-NH1 3.27Å; E47-R81 IonicContact OE2-NH2 2.72Å
48	L	89.7	Confident	83.1	Confident	16 Å²	16	34.8 Å²	34.8	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-39.9	176.6	-77.2	-175.7	0	0	0	112.8	F44 L45 G50 G52 I57 L74 L77	F44-L48 HydrophobicContact CD1-CD1 4.12Å; F44-L48 HydrophobicContact CE1-CD1 3.43Å; F44-L48 VanDerWaalsContact CE1-CD1 3.43Å; F44-L48 HydrophobicContact CE1-CG 4.18Å; F44-L48 HydrophobicContact CE2-CD1 4.13Å; F44-L48 HydrophobicContact CE2-CD2 4.4Å; F44-L48 HydrophobicContact CE2-CG 4.07Å; F44-L48 HydrophobicContact CZ-CD1 3.45Å; F44-L48 VanDerWaalsContact CZ-CD1 3.45Å; F44-L48 HydrophobicContact CZ-CD2 4.34Å; F44-L48 HydrophobicContact CZ-CG 3.91Å; F44-L48 WeakPolarHBondContact O-CG 3.33Å; F44-L48 PolarHBondContact O-N 2.99Å; L45-L48 PolarHBondContact O-N 3.36Å; L48-G50 PolarHBondContact O-N 2.8Å; L48-G52 PolarHBondContact O-N 2.91Å; L48-I57 HydrophobicContact CB-CD1 3.47Å; L48-I57 VanDerWaalsContact CB-CD1 3.47Å; L48-I57 HydrophobicContact CB-CG1 3.95Å; L48-I57 HydrophobicContact CD1-CD1 4.07Å; L48-I57 HydrophobicContact CG-CD1 4.45Å; L48-L74 HydrophobicContact CD1-CD1 3.59Å; L48-L77 HydrophobicContact CD1-CD1 4.38Å; L48-L77 HydrophobicContact CD2-CD1 4.37Å
49	L	88.9	Confident	83.5	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-16.7	174.2	-74.5	167.1	0	0	0	113.2	L45 L46 E47 I57 W59 F66 F117	L45-L49 WeakPolarHBondContact O-CB 3.46Å; L45-L49 WeakPolarHBondContact O-CD1 3.47Å; L45-L49 WeakPolarHBondContact O-CG 3.31Å; L45-L49 PolarHBondContact O-N 3.19Å; L46-L49 PolarHBondContact O-N 3.31Å; E47-L49 PolarHBondContact O-N 3.25Å; L49-I57 HydrophobicContact CD1-CD1 4.39Å; L49-I57 HydrophobicContact CD2-CB 4.28Å; L49-I57 HydrophobicContact CD2-CD1 4.05Å; L49-I57 HydrophobicContact CD2-CG1 3.85Å; L49-I57 HydrophobicContact CG-CD1 3.65Å; L49-I57 HydrophobicContact CG-CG1 3.99Å; L49-W59 HydrophobicContact CB-CD2 4.44Å; L49-W59 HydrophobicContact CB-CH2 4.32Å; L49-W59 HydrophobicContact CB-CZ2 3.57Å; L49-W59 HydrophobicContact CD1-CD2 4.42Å; L49-W59 HydrophobicContact CD1-CE3 4.31Å; L49-W59 HydrophobicContact CD1-CH2 3.67Å; L49-W59 HydrophobicContact CD1-CZ2 3.81Å; L49-W59 HydrophobicContact CD1-CZ3 3.94Å; L49-W59 HydrophobicContact CD2-CD2 4.17Å; L49-W59 HydrophobicContact CD2-CG 4.34Å; L49-W59 HydrophobicContact CG-CZ2 4.18Å; L49-W59 PolarHBondContact O-NE1 3.04Å; L49-F66 HydrophobicContact CD1-CB 3.77Å; L49-F66 HydrophobicContact CD1-CD1 4.28Å; L49-F66 HydrophobicContact CD1-CD2 4.35Å; L49-F66 HydrophobicContact CD1-CG 3.9Å; L49-F66 HydrophobicContact CD2-CB 3.86Å; L49-F66 HydrophobicContact CG-CB 4.48Å; L49-F117 HydrophobicContact CD1-CE2 3.76Å
50	G	81.1	Confident	83.6	Confident	7 Å²	7	33.4 Å²	33.4	7%	0.072	21%	0.205	C	C	.	.	H	α-helix	trans	-88.3	-51.4	-178.6	0	0	0	0	0	114.2	L46 E47 L48 G52 N153	L46-G50 PolarHBondContact O-N 3.1Å; E47-G50 WeakPolarHBondContact O-CA 3.38Å; E47-G50 PolarHBondContact O-N 3.09Å; L48-G50 PolarHBondContact O-N 2.8Å; G50-G52 PolarHBondContact O-N 2.89Å; G50-N153 WeakPolarHBondContact CA-ND2 3.47Å
51	C	71.8	Confident	83.2	Confident	58 Å²	58	33.8 Å²	33.8	39%	0.392	23%	0.23	S	C	.	.	H	α-helix	trans	-74.4	-15.5	178	-68.9	0	0	0	0	112.6	E47 E53	E47-C51 PolarHBondContact O-N 3.08Å; C51-E53 HydrophobicContact CB-CB 4.14Å; C51-E53 HydrophobicContact CB-CG 3.97Å; C51-E53 PolarHBondContact O-N 3.34Å
52	G	63.2	Low	82.8	Confident	58 Å²	58	38.2 Å²	38.2	60%	0.598	25%	0.25	S	S	*	.			trans	63	9.8	-172.5	0	0	0	0	0	112.9	L48 G50 G54	L48-G52 PolarHBondContact O-N 2.91Å; G50-G52 PolarHBondContact O-N 2.89Å; G52-G54 PolarHBondContact O-N 2.94Å
53	E	51.1	Low	82.4	Confident	142 Å²	142	40 Å²	40	66%	0.664	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	122.6	-173	-84.8	-172	156.2	0	0	110.7	C51	C51-E53 HydrophobicContact CB-CB 4.14Å; C51-E53 HydrophobicContact CB-CG 3.97Å; C51-E53 PolarHBondContact O-N 3.34Å
54	G	57.7	Low	82.3	Confident	23 Å²	23	38.2 Å²	38.2	24%	0.237	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	2.6	162.5	0	0	0	0	0	116.2	G52 A56 R73	G52-G54 PolarHBondContact O-N 2.94Å; G54-A56 PolarHBondContact O-N 3.3Å; G54-R73 WeakPolarHBondContact O-CD 3.43Å; G54-R73 PolarHBondContact O-NE 3.16Å; G54-R73 VanDerWaalsContact O-NE 3.11Å; G54-R73 PolarHBondContact O-NH1 2.69Å
55	G	77.4	Confident	82.5	Confident	42 Å²	42	38.3 Å²	38.3	43%	0.433	25%	0.249	S	C	.	.	S	Bend	trans	59.4	1.4	169.3	0	0	0	0	0	116.1	I57	G55-I57 VanDerWaalsContact C-N 3.32Å
56	A	88.1	Confident	82.5	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.008	25%	0.249	C	C	.	.	S	Bend	trans	-72.4	-31.3	-176	0	0	0	0	0	111.3	G54 I68 R69 D70 R73 L74 L77	G54-A56 PolarHBondContact O-N 3.3Å; A56-I68 CarbonylContact O-C 3.55Å; A56-R69 PolarHBondContact O-N 3.12Å; A56-D70 HydrophobicContact CB-CB 4.33Å; A56-D70 PolarHBondContact O-N 3.29Å; A56-R73 HydrophobicContact CB-CB 4.09Å; A56-R73 HydrophobicContact CB-CG 4.03Å; A56-L74 HydrophobicContact CB-CB 4.24Å; A56-L77 HydrophobicContact CB-CD1 4.48Å
57	I	92.8	Very high	82.8	Confident	12 Å²	12	38.9 Å²	38.9	6%	0.062	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.9	174.4	69.2	-179.8	0	0	0	109.9	L45 L48 L49 G55 V67 I68 L74	L45-I57 HydrophobicContact CB-CD1 4.43Å; L45-I57 HydrophobicContact CD2-CD1 3.86Å; L45-I57 WeakPolarHBondContact O-CD1 3.36Å; L48-I57 HydrophobicContact CB-CD1 3.47Å; L48-I57 VanDerWaalsContact CB-CD1 3.47Å; L48-I57 HydrophobicContact CB-CG1 3.95Å; L48-I57 HydrophobicContact CD1-CD1 4.07Å; L48-I57 HydrophobicContact CG-CD1 4.45Å; L49-I57 HydrophobicContact CD1-CD1 4.39Å; L49-I57 HydrophobicContact CD2-CB 4.28Å; L49-I57 HydrophobicContact CD2-CD1 4.05Å; L49-I57 HydrophobicContact CD2-CG1 3.85Å; L49-I57 HydrophobicContact CG-CD1 3.65Å; L49-I57 HydrophobicContact CG-CG1 3.99Å; G55-I57 VanDerWaalsContact C-N 3.32Å; I57-V67 CarbonylContact C-O 3.57Å; I57-V67 VanDerWaalsContact CA-O 3.31Å; I57-V67 WeakPolarHBondContact CA-O 3.43Å; I57-I68 HydrophobicContact CG2-CB 4.11Å; I57-I68 HydrophobicContact CG2-CG1 3.82Å; I57-I68 HydrophobicContact CG2-CG2 4.03Å; I57-L74 HydrophobicContact CG2-CB 4.39Å; I57-L74 HydrophobicContact CG2-CD1 3.88Å; I57-L74 HydrophobicContact CG2-CD2 3.75Å; I57-L74 HydrophobicContact CG2-CG 4.2Å
58	G	90.6	Very high	83.2	Confident	13 Å²	13	36.3 Å²	36.3	13%	0.134	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	158.8	175.7	0	0	0	0	0	111.8	F66 V67	G58-F66 CarbonylContact O-C 3.59Å; G58-F66 VanDerWaalsContact O-CA 3.29Å; G58-F66 WeakPolarHBondContact O-CA 3.44Å; G58-F66 WeakPolarHBondContact O-CB 3.31Å; G58-V67 PolarHBondContact N-O 3.28Å; G58-V67 PolarHBondContact O-N 3.07Å
59	W	90.8	Very high	83.5	Confident	66 Å²	66	44 Å²	44	25%	0.25	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	140.6	171.8	-65.9	108.4	0	0	0	110.5	L46 L49 F66 F117 F119 F146	L46-W59 HydrophobicContact CD2-CH2 3.94Å; L46-W59 HydrophobicContact CD2-CZ2 4.43Å; L49-W59 HydrophobicContact CB-CD2 4.44Å; L49-W59 HydrophobicContact CB-CH2 4.32Å; L49-W59 HydrophobicContact CB-CZ2 3.57Å; L49-W59 HydrophobicContact CD1-CD2 4.42Å; L49-W59 HydrophobicContact CD1-CE3 4.31Å; L49-W59 HydrophobicContact CD1-CH2 3.67Å; L49-W59 HydrophobicContact CD1-CZ2 3.81Å; L49-W59 HydrophobicContact CD1-CZ3 3.94Å; L49-W59 HydrophobicContact CD2-CD2 4.17Å; L49-W59 HydrophobicContact CD2-CG 4.34Å; L49-W59 HydrophobicContact CG-CZ2 4.18Å; L49-W59 PolarHBondContact O-NE1 3.04Å; W59-F66 HydrophobicContact CE3-CB 4.26Å; W59-F66 HydrophobicContact CZ3-CB 4.47Å; W59-F117 HydrophobicContact CH2-CD2 4.26Å; W59-F117 HydrophobicContact CZ3-CD2 4.21Å; W59-F119 AromaticContact CH2-CZ 3.88Å; W59-F119 HydrophobicContact CH2-CZ 3.88Å; W59-F119 HydrophobicContact CZ3-CZ 4.19Å; W59-F146 HydrophobicContact CD2-CE2 4.32Å; W59-F146 AromaticContact CD2-CZ 3.88Å; W59-F146 HydrophobicContact CD2-CZ 3.88Å; W59-F146 HydrophobicContact CE3-CE2 4.18Å; W59-F146 AromaticContact CE3-CZ 3.96Å; W59-F146 HydrophobicContact CE3-CZ 3.96Å; W59-F146 HydrophobicContact CG-CZ 4.39Å; W59-F146 AromaticContact CH2-CE2 4Å; W59-F146 HydrophobicContact CH2-CE2 4Å; W59-F146 HydrophobicContact CZ2-CE2 4.1Å; W59-F146 HydrophobicContact CZ2-CZ 4.41Å; W59-F146 HydrophobicContact CZ3-CE2 4.03Å; W59-F146 HydrophobicContact CZ3-CZ 4.29Å
60	G	87.7	Confident	83.8	Confident	26 Å²	26	46.5 Å²	46.5	27%	0.268	28%	0.283	S	S	.	.			trans	-85.2	-170	173.4	0	0	0	0	0	112.1	E65	G60-E65 PolarHBondContact N-O 3.11Å
61	G	80.8	Confident	84.5	Confident	83 Å²	83	47.5 Å²	47.5	86%	0.856	29%	0.288	S	S	*	.	S	Bend	trans	-80	-22.9	178.9	0	0	0	0	0	113.6
62	E	86.5	Confident	85.6	Confident	96 Å²	96	50.4 Å²	50.4	45%	0.449	30%	0.296	S	S	.	.	S	Bend	trans	-96.8	151.8	178.4	-64.8	-173.4	-176.3	0	0	112.8	G64 E65 K116	E62-G64 PolarHBondContact O-N 2.73Å; E62-E65 HydrophobicContact CB-CB 3.8Å; E62-E65 VanDerWaalsContact O-CB 3.31Å; E62-E65 WeakPolarHBondContact O-CB 3.45Å; E62-E65 PolarHBondContact O-N 3.35Å; E62-K116 IonicContact OE2-NZ 3.55Å; E62-K116 PolarHBondContact OE2-NZ 3.05Å
63	W	84	Confident	87.1	Confident	59 Å²	59	53.3 Å²	53.3	22%	0.223	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	121	178.1	-179.6	80.9	0	0	0	112.7	E65 K116 F119 S142 F146	W63-E65 PolarHBondContact O-N 2.83Å; W63-K116 WeakPolarHBondContact O-CE 3.29Å; W63-F119 HydrophobicContact CD2-CD2 4.23Å; W63-F119 AromaticContact CE2-CD2 3.82Å; W63-F119 HydrophobicContact CE3-CD2 4.34Å; W63-F119 HydrophobicContact CH2-CB 3.49Å; W63-F119 VanDerWaalsContact CH2-CB 3.49Å; W63-F119 AromaticContact CH2-CD2 3.85Å; W63-F119 HydrophobicContact CH2-CD2 3.85Å; W63-F119 HydrophobicContact CH2-CG 4.18Å; W63-F119 HydrophobicContact CZ2-CB 3.73Å; W63-F119 AromaticContact CZ2-CD2 3.61Å; W63-F119 HydrophobicContact CZ2-CD2 3.61Å; W63-F119 HydrophobicContact CZ2-CG 4.11Å; W63-F119 HydrophobicContact CZ3-CB 4.25Å; W63-F119 HydrophobicContact CZ3-CD2 4.17Å; W63-S142 PolarHBondContact NE1-O 3.33Å; W63-F146 AromaticContact CD1-CD1 4Å; W63-F146 AromaticContact CD1-CG 3.7Å; W63-F146 AromaticContact NE1-CG 3.65Å
64	G	86.9	Confident	89.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	0.1	-177.3	0	0	0	0	0	115.6	E62 K116 F117	E62-G64 PolarHBondContact O-N 2.73Å; G64-K116 CarbonylContact O-C 3.59Å; G64-K116 WeakPolarHBondContact O-CA 3.47Å; G64-F117 PolarHBondContact O-N 2.95Å
65	E	93.9	Very high	91.1	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.028	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.2	169.4	-171.9	-179.4	-120.8	0	0	109.2	G60 E62 W63 T108 K111 T114 Y115 K116	G60-E65 PolarHBondContact N-O 3.11Å; E62-E65 HydrophobicContact CB-CB 3.8Å; E62-E65 VanDerWaalsContact O-CB 3.31Å; E62-E65 WeakPolarHBondContact O-CB 3.45Å; E62-E65 PolarHBondContact O-N 3.35Å; W63-E65 PolarHBondContact O-N 2.83Å; E65-T108 WeakPolarHBondContact OE1-CG2 3.26Å; E65-T108 PolarHBondContact OE1-OG1 3.17Å; E65-K111 IonicContact OE1-NZ 2.87Å; E65-K111 PolarHBondContact OE1-NZ 2.95Å; E65-K111 IonicContact OE2-NZ 3.17Å; E65-K111 PolarHBondContact OE2-NZ 3.24Å; E65-T114 VanDerWaalsContact CD-CG2 3.44Å; E65-T114 HydrophobicContact CG-CG2 3.4Å; E65-T114 VanDerWaalsContact OE1-CG2 3.26Å; E65-T114 WeakPolarHBondContact OE1-CG2 3.4Å; E65-Y115 CarbonylContact C-O 3.15Å; E65-Y115 WeakPolarHBondContact CA-O 3.5Å; E65-K116 HydrophobicContact CB-CG 4.46Å
66	F	94.5	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.4	171.4	71.9	-87.3	0	0	0	110.2	L45 L49 G58 W59 I68 L105 T114 Y115 F117	L45-F66 HydrophobicContact CD1-CE2 4.49Å; L45-F66 HydrophobicContact CD1-CZ 4.16Å; L49-F66 HydrophobicContact CD1-CB 3.77Å; L49-F66 HydrophobicContact CD1-CD1 4.28Å; L49-F66 HydrophobicContact CD1-CD2 4.35Å; L49-F66 HydrophobicContact CD1-CG 3.9Å; L49-F66 HydrophobicContact CD2-CB 3.86Å; L49-F66 HydrophobicContact CG-CB 4.48Å; G58-F66 CarbonylContact O-C 3.59Å; G58-F66 VanDerWaalsContact O-CA 3.29Å; G58-F66 WeakPolarHBondContact O-CA 3.44Å; G58-F66 WeakPolarHBondContact O-CB 3.31Å; W59-F66 HydrophobicContact CE3-CB 4.26Å; W59-F66 HydrophobicContact CZ3-CB 4.47Å; F66-I68 HydrophobicContact CD2-CG1 4.3Å; F66-I68 HydrophobicContact CE2-CD1 4.3Å; F66-I68 HydrophobicContact CE2-CG1 3.98Å; F66-L105 HydrophobicContact CZ-CD2 4.47Å; F66-T114 WeakPolarHBondContact O-CA 3.36Å; F66-T114 WeakPolarHBondContact O-CG2 3.4Å; F66-Y115 WeakPolarHBondContact CD1-O 3.26Å; F66-Y115 HydrophobicContact CE2-CD2 4.16Å; F66-Y115 HydrophobicContact CE2-CG 4.48Å; F66-Y115 VanDerWaalsContact CZ-CB 3.48Å; F66-Y115 HydrophobicContact CZ-CD2 4.22Å; F66-Y115 HydrophobicContact CZ-CG 4.1Å; F66-Y115 PolarHBondContact N-O 2.87Å; F66-Y115 PolarHBondContact O-N 3.28Å; F66-Y115 VanDerWaalsContact O-O 3.1Å; F66-F117 AromaticContact CD1-CD2 3.57Å; F66-F117 HydrophobicContact CD1-CD2 3.57Å; F66-F117 AromaticContact CD1-CE2 3.43Å; F66-F117 HydrophobicContact CD1-CE2 3.43Å; F66-F117 VanDerWaalsContact CD1-CE2 3.43Å; F66-F117 HydrophobicContact CD1-CZ 4.37Å; F66-F117 AromaticContact CE1-CD2 3.67Å; F66-F117 HydrophobicContact CE1-CD2 3.67Å; F66-F117 AromaticContact CE1-CE2 3.32Å; F66-F117 HydrophobicContact CE1-CE2 3.32Å; F66-F117 HydrophobicContact CE1-CG 4.41Å; F66-F117 AromaticContact CE1-CZ 3.83Å; F66-F117 HydrophobicContact CE1-CZ 3.83Å; F66-F117 HydrophobicContact CG-CE2 4.31Å; F66-F117 HydrophobicContact CZ-CE2 4.16Å; F66-F117 HydrophobicContact CZ-CZ 4.36Å
67	V	94.8	Very high	92.2	Very high	43 Å²	43	53.7 Å²	53.7	26%	0.261	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.8	-179.9	-175.1	0	0	0	0	108.3	I57 G58 T114	I57-V67 CarbonylContact C-O 3.57Å; I57-V67 VanDerWaalsContact CA-O 3.31Å; I57-V67 WeakPolarHBondContact CA-O 3.43Å; G58-V67 PolarHBondContact N-O 3.28Å; G58-V67 PolarHBondContact O-N 3.07Å; V67-T114 HydrophobicContact CG2-CG2 3.92Å
68	I	95.9	Very high	92.3	Very high	2 Å²	2	54 Å²	54	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	111.3	168.1	-52.8	167.5	0	0	0	106.9	A56 I57 F66 P71 L74 Y89 L96 F113 Y115	A56-I68 CarbonylContact O-C 3.55Å; I57-I68 HydrophobicContact CG2-CB 4.11Å; I57-I68 HydrophobicContact CG2-CG1 3.82Å; I57-I68 HydrophobicContact CG2-CG2 4.03Å; F66-I68 HydrophobicContact CD2-CG1 4.3Å; F66-I68 HydrophobicContact CE2-CD1 4.3Å; F66-I68 HydrophobicContact CE2-CG1 3.98Å; I68-P71 HydrophobicContact CG2-CB 4.12Å; I68-L74 HydrophobicContact CB-CD2 4.37Å; I68-L74 HydrophobicContact CD1-CD2 3.63Å; I68-L74 HydrophobicContact CG1-CD2 3.85Å; I68-L74 HydrophobicContact CG2-CB 4.28Å; I68-L74 HydrophobicContact CG2-CD2 3.65Å; I68-Y89 HydrophobicContact CD1-CE2 3.92Å; I68-L96 HydrophobicContact CD1-CD1 4.09Å; I68-F113 HydrophobicContact CB-CB 4.1Å; I68-F113 PolarHBondContact N-O 3Å; I68-F113 VanDerWaalsContact O-CB 3.28Å; I68-F113 WeakPolarHBondContact O-CB 3Å; I68-Y115 HydrophobicContact CD1-CD2 4.04Å; I68-Y115 HydrophobicContact CD1-CE2 3.77Å
69	R	94.7	Very high	92.5	Very high	176 Å²	176	53.5 Å²	53.5	66%	0.664	26%	0.262	S	S	*	.	S	Bend	trans	-83.9	-42.4	-179.2	-60	-179.1	-179.8	-174.7	0	111	A56	A56-R69 PolarHBondContact O-N 3.12Å
70	D	95.4	Very high	92.6	Very high	64 Å²	64	57.4 Å²	57.4	34%	0.342	28%	0.283	S	S	.	.			trans	-124	94.1	178.1	-172.5	-19.6	0	0	0	109.8	A56 E72 R73 L74	A56-D70 HydrophobicContact CB-CB 4.33Å; A56-D70 PolarHBondContact O-N 3.29Å; D70-E72 VanDerWaalsContact C-N 3.31Å; D70-E72 PolarHBondContact O-N 3.45Å; D70-E72 PolarHBondContact OD1-N 3.02Å; D70-R73 HydrophobicContact CB-CB 3.96Å; D70-R73 PolarHBondContact OD1-N 2.94Å; D70-R73 VanDerWaalsContact OD2-CB 3.22Å; D70-R73 WeakPolarHBondContact OD2-CB 3.34Å; D70-L74 WeakPolarHBondContact O-CB 3.19Å; D70-L74 PolarHBondContact O-N 2.97Å
71	P	95.7	Very high	92.7	Very high	27 Å²	27	58.6 Å²	58.6	18%	0.175	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-30.5	-177.6	25.7	-32.4	0	0	0	112.9	I68 A75 Y89 F113	I68-P71 HydrophobicContact CG2-CB 4.12Å; P71-A75 WeakPolarHBondContact O-CB 3.44Å; P71-A75 PolarHBondContact O-N 2.83Å; P71-A75 VanDerWaalsContact O-N 3.08Å; P71-Y89 HydrophobicContact CB-CD1 4.19Å; P71-Y89 HydrophobicContact CB-CD2 3.38Å; P71-Y89 HydrophobicContact CB-CE2 3.86Å; P71-Y89 HydrophobicContact CB-CG 3.57Å; P71-F113 HydrophobicContact CG-CZ 4.42Å
72	E	96.1	Very high	93.1	Very high	120 Å²	120	57.1 Å²	57.1	56%	0.561	25%	0.25	S	C	*	.	H	α-helix	trans	-70.7	-49	178.3	-69.8	-165.7	-165.8	0	0	111	D70 L74 A75 R76	D70-E72 VanDerWaalsContact C-N 3.31Å; D70-E72 PolarHBondContact O-N 3.45Å; D70-E72 PolarHBondContact OD1-N 3.02Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 3.39Å; E72-A75 PolarHBondContact O-N 3.37Å; E72-A75 VanDerWaalsContact O-N 3.12Å; E72-R76 WeakPolarHBondContact O-CG 3.36Å; E72-R76 PolarHBondContact O-N 3.4Å; E72-R76 IonicContact OE2-NH2 2.83Å; E72-R76 PolarHBondContact OE2-NH2 2.99Å; E72-R76 VanDerWaalsContact OE2-NH2 3.1Å
73	R	94.6	Very high	93.4	Very high	118 Å²	118	54.4 Å²	54.4	45%	0.445	25%	0.248	S	C	.	.	H	α-helix	trans	-60.7	-42.9	177.2	-175.7	174.6	-177.6	167.3	2.3	111.4	G54 A56 D70 A75 R76 L77	G54-R73 WeakPolarHBondContact O-CD 3.43Å; G54-R73 PolarHBondContact O-NE 3.16Å; G54-R73 VanDerWaalsContact O-NE 3.11Å; G54-R73 PolarHBondContact O-NH1 2.69Å; A56-R73 HydrophobicContact CB-CB 4.09Å; A56-R73 HydrophobicContact CB-CG 4.03Å; D70-R73 HydrophobicContact CB-CB 3.96Å; D70-R73 PolarHBondContact OD1-N 2.94Å; D70-R73 VanDerWaalsContact OD2-CB 3.22Å; D70-R73 WeakPolarHBondContact OD2-CB 3.34Å; R73-A75 VanDerWaalsContact C-N 3.29Å; R73-A75 PolarHBondContact O-N 2.79Å; R73-R76 PolarHBondContact O-N 3.2Å; R73-L77 HydrophobicContact CG-CD1 4.14Å; R73-L77 HydrophobicContact CG-CG 4.44Å; R73-L77 VanDerWaalsContact O-CG 3.31Å; R73-L77 WeakPolarHBondContact O-CG 3.02Å; R73-L77 PolarHBondContact O-N 2.97Å
74	L	95.6	Very high	93.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-44.8	174.5	174	63.1	0	0	0	111.6	F44 L45 L48 A56 I57 I68 D70 E72 W78 L92	F44-L74 HydrophobicContact CE1-CD1 4.05Å; L45-L74 HydrophobicContact CD2-CD1 3.72Å; L45-L74 HydrophobicContact CD2-CD2 3.97Å; L45-L74 HydrophobicContact CD2-CG 4.44Å; L48-L74 HydrophobicContact CD1-CD1 3.59Å; A56-L74 HydrophobicContact CB-CB 4.24Å; I57-L74 HydrophobicContact CG2-CB 4.39Å; I57-L74 HydrophobicContact CG2-CD1 3.88Å; I57-L74 HydrophobicContact CG2-CD2 3.75Å; I57-L74 HydrophobicContact CG2-CG 4.2Å; I68-L74 HydrophobicContact CB-CD2 4.37Å; I68-L74 HydrophobicContact CD1-CD2 3.63Å; I68-L74 HydrophobicContact CG1-CD2 3.85Å; I68-L74 HydrophobicContact CG2-CB 4.28Å; I68-L74 HydrophobicContact CG2-CD2 3.65Å; D70-L74 WeakPolarHBondContact O-CB 3.19Å; D70-L74 PolarHBondContact O-N 2.97Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 3.39Å; L74-W78 WeakPolarHBondContact O-CB 3.49Å; L74-W78 PolarHBondContact O-N 2.93Å; L74-L92 HydrophobicContact CD2-CD1 4.24Å; L74-L92 HydrophobicContact CD2-CD2 4.23Å; L74-L92 HydrophobicContact CG-CD1 3.94Å
75	A	96.3	Very high	94	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-66.8	-37.8	179.7	0	0	0	0	0	112.8	P71 E72 R73 W78 G79 M87 L92	P71-A75 WeakPolarHBondContact O-CB 3.44Å; P71-A75 PolarHBondContact O-N 2.83Å; P71-A75 VanDerWaalsContact O-N 3.08Å; E72-A75 PolarHBondContact O-N 3.37Å; E72-A75 VanDerWaalsContact O-N 3.12Å; R73-A75 VanDerWaalsContact C-N 3.29Å; R73-A75 PolarHBondContact O-N 2.79Å; A75-W78 PolarHBondContact O-N 3.18Å; A75-G79 PolarHBondContact O-N 3.46Å; A75-M87 HydrophobicContact CB-CG 4.5Å; A75-M87 VanDerWaalsContact O-CG 3.23Å; A75-M87 WeakPolarHBondContact O-CG 3.15Å; A75-L92 HydrophobicContact CB-CD1 4.46Å
76	R	95.1	Very high	94.1	Very high	167 Å²	167	70.4 Å²	70.4	63%	0.63	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-49	175.1	-68.9	178.6	-162.1	178.4	8.8	111.3	E72 R73 W78 G79 E80	E72-R76 WeakPolarHBondContact O-CG 3.36Å; E72-R76 PolarHBondContact O-N 3.4Å; E72-R76 IonicContact OE2-NH2 2.83Å; E72-R76 PolarHBondContact OE2-NH2 2.99Å; E72-R76 VanDerWaalsContact OE2-NH2 3.1Å; R73-R76 PolarHBondContact O-N 3.2Å; R76-W78 VanDerWaalsContact C-N 3.25Å; R76-W78 PolarHBondContact O-N 2.83Å; R76-G79 CarbonylContact O-C 3.53Å; R76-G79 WeakPolarHBondContact O-CA 3.25Å; R76-G79 PolarHBondContact O-N 3.31Å; R76-E80 WeakPolarHBondContact O-CB 3.22Å; R76-E80 PolarHBondContact O-N 2.8Å
77	L	93.9	Very high	94.2	Very high	49 Å²	49	72.2 Å²	72.2	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-58.6	-39.9	176.6	-67.4	169.5	0	0	0	111.3	F44 L48 A56 R73 R81	F44-L77 HydrophobicContact CZ-CB 3.84Å; L48-L77 HydrophobicContact CD1-CD1 4.38Å; L48-L77 HydrophobicContact CD2-CD1 4.37Å; A56-L77 HydrophobicContact CB-CD1 4.48Å; R73-L77 HydrophobicContact CG-CD1 4.14Å; R73-L77 HydrophobicContact CG-CG 4.44Å; R73-L77 VanDerWaalsContact O-CG 3.31Å; R73-L77 WeakPolarHBondContact O-CG 3.02Å; R73-L77 PolarHBondContact O-N 2.97Å; L77-R81 WeakPolarHBondContact O-CB 3.42Å; L77-R81 PolarHBondContact O-N 3.37Å
78	W	94.6	Very high	94.4	Very high	19 Å²	19	73.1 Å²	73.1	7%	0.072	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-42	174.6	179.6	-125.7	0	0	0	112.8	V39 L41 F44 L74 A75 R76 R81 K82 M87 L92	V39-W78 HydrophobicContact CG1-CH2 4.12Å; V39-W78 HydrophobicContact CG1-CZ3 3.77Å; V39-W78 WeakPolarHBondContact O-CH2 3.4Å; L41-W78 HydrophobicContact CB-CH2 4.16Å; L41-W78 HydrophobicContact CB-CZ2 3.9Å; L41-W78 HydrophobicContact CD1-CD2 3.87Å; L41-W78 HydrophobicContact CD1-CE3 4.25Å; L41-W78 HydrophobicContact CD1-CG 4.08Å; L41-W78 HydrophobicContact CD1-CZ2 4.42Å; F44-W78 HydrophobicContact CB-CE3 3.86Å; F44-W78 HydrophobicContact CB-CH2 4.48Å; F44-W78 HydrophobicContact CB-CZ3 3.5Å; F44-W78 HydrophobicContact CD1-CB 4.35Å; F44-W78 HydrophobicContact CD1-CD2 4.14Å; F44-W78 AromaticContact CD1-CE3 3.34Å; F44-W78 HydrophobicContact CD1-CE3 3.34Å; F44-W78 AromaticContact CD1-CZ3 3.94Å; F44-W78 HydrophobicContact CD1-CZ3 3.94Å; F44-W78 HydrophobicContact CD2-CE3 4.09Å; F44-W78 HydrophobicContact CD2-CZ3 4.29Å; F44-W78 HydrophobicContact CE1-CB 3.77Å; F44-W78 HydrophobicContact CE1-CD2 4.4Å; F44-W78 AromaticContact CE1-CE3 3.8Å; F44-W78 HydrophobicContact CE1-CE3 3.8Å; F44-W78 HydrophobicContact CE1-CG 4.45Å; F44-W78 HydrophobicContact CE2-CE3 4.48Å; F44-W78 AromaticContact CG-CE3 3.48Å; F44-W78 HydrophobicContact CG-CE3 3.48Å; F44-W78 VanDerWaalsContact CG-CE3 3.48Å; F44-W78 AromaticContact CG-CZ3 3.65Å; F44-W78 HydrophobicContact CG-CZ3 3.65Å; F44-W78 HydrophobicContact CZ-CB 4.36Å; F44-W78 HydrophobicContact CZ-CE3 4.33Å; L74-W78 WeakPolarHBondContact O-CB 3.49Å; L74-W78 PolarHBondContact O-N 2.93Å; A75-W78 PolarHBondContact O-N 3.18Å; R76-W78 VanDerWaalsContact C-N 3.25Å; R76-W78 PolarHBondContact O-N 2.83Å; W78-R81 HydrophobicContact CE3-CB 4.33Å; W78-R81 HydrophobicContact CE3-CG 4.46Å; W78-R81 HydrophobicContact CZ3-CG 4.34Å; W78-R81 PolarHBondContact O-N 2.96Å; W78-K82 HydrophobicContact CD2-CG 3.93Å; W78-K82 HydrophobicContact CE3-CG 4.02Å; W78-K82 HydrophobicContact CH2-CD 3.5Å; W78-K82 HydrophobicContact CH2-CG 3.66Å; W78-K82 HydrophobicContact CZ2-CD 3.7Å; W78-K82 HydrophobicContact CZ2-CG 3.51Å; W78-K82 HydrophobicContact CZ3-CD 3.98Å; W78-K82 HydrophobicContact CZ3-CG 3.89Å; W78-K82 WeakPolarHBondContact O-CG 3.28Å; W78-K82 PolarHBondContact O-N 3.07Å; W78-M87 HydrophobicContact CG-CG 4.48Å; W78-L92 HydrophobicContact CB-CD1 3.85Å; W78-L92 HydrophobicContact CG-CD1 4.01Å
79	G	94.8	Very high	94.5	Very high	1 Å²	1	74.6 Å²	74.6	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-58.6	-48.9	174.8	0	0	0	0	0	111.7	A75 R76 R81 K82 G83 K84 M87	A75-G79 PolarHBondContact O-N 3.46Å; R76-G79 CarbonylContact O-C 3.53Å; R76-G79 WeakPolarHBondContact O-CA 3.25Å; R76-G79 PolarHBondContact O-N 3.31Å; G79-R81 PolarHBondContact O-N 2.83Å; G79-K82 CarbonylContact O-C 3.54Å; G79-K82 PolarHBondContact O-N 3.03Å; G79-G83 CarbonylContact O-C 3.54Å; G79-G83 WeakPolarHBondContact O-CA 3.36Å; G79-G83 PolarHBondContact O-N 2.78Å; G79-K84 VanDerWaalsContact CA-O 3.23Å; G79-K84 WeakPolarHBondContact CA-O 3.4Å; G79-K84 PolarHBondContact O-N 3.06Å; G79-M87 VanDerWaalsContact CA-CB 3.46Å
80	E	92.4	Very high	94.6	Very high	148 Å²	148	71.7 Å²	71.7	69%	0.692	35%	0.349	S	S	*	.	H	α-helix	trans	-57.2	-50.1	176.1	-175.9	173.7	-164.1	0	0	111.4	R76 K82 G83	R76-E80 WeakPolarHBondContact O-CB 3.22Å; R76-E80 PolarHBondContact O-N 2.8Å; E80-K82 VanDerWaalsContact C-N 3.25Å; E80-K82 PolarHBondContact O-N 2.83Å; E80-G83 PolarHBondContact O-N 2.96Å; E80-G83 VanDerWaalsContact O-N 3.1Å
81	R	90.4	Very high	94.6	Very high	51 Å²	51	74.2 Å²	74.2	19%	0.192	36%	0.357	C	S	.	.	H	α-helix	trans	-56.4	-37.9	177.7	-175.8	62.5	67.3	89.7	-1.6	113	V39 F44 E47 L77 W78 G79	V39-R81 HydrophobicContact CG1-CG 3.64Å; F44-R81 HydrophobicContact CD2-CB 4.43Å; F44-R81 HydrophobicContact CD2-CG 4.13Å; F44-R81 HydrophobicContact CE2-CB 4.13Å; F44-R81 HydrophobicContact CE2-CG 4.28Å; E47-R81 VanDerWaalsContact CD-NH1 3.32Å; E47-R81 IonicContact OE1-CZ 2.81Å; E47-R81 IonicContact OE1-NH1 3.18Å; E47-R81 PolarHBondContact OE1-NH1 3.3Å; E47-R81 VanDerWaalsContact OE1-NH1 3.1Å; E47-R81 IonicContact OE1-NH2 3.32Å; E47-R81 PolarHBondContact OE1-NH2 2.9Å; E47-R81 IonicContact OE2-CZ 3.35Å; E47-R81 IonicContact OE2-NH1 3.1Å; E47-R81 PolarHBondContact OE2-NH1 3.27Å; E47-R81 IonicContact OE2-NH2 2.72Å; L77-R81 WeakPolarHBondContact O-CB 3.42Å; L77-R81 PolarHBondContact O-N 3.37Å; W78-R81 HydrophobicContact CE3-CB 4.33Å; W78-R81 HydrophobicContact CE3-CG 4.46Å; W78-R81 HydrophobicContact CZ3-CG 4.34Å; W78-R81 PolarHBondContact O-N 2.96Å; G79-R81 PolarHBondContact O-N 2.83Å
82	K	89.7	Confident	94.7	Very high	52 Å²	52	73 Å²	73	23%	0.226	35%	0.349	C	S	.	.	H	α-helix	trans	-93.6	-3.8	-179	-62.5	-66.7	-74.2	-171.3	0	114	R37 V39 W78 G79 E80 K84	R37-K82 WeakPolarHBondContact O-CD 3.39Å; R37-K82 WeakPolarHBondContact O-CE 3.46Å; R37-K82 PolarHBondContact O-NZ 3.01Å; V39-K82 HydrophobicContact CG1-CD 4.4Å; V39-K82 PolarHBondContact O-NZ 3.39Å; W78-K82 HydrophobicContact CD2-CG 3.93Å; W78-K82 HydrophobicContact CE3-CG 4.02Å; W78-K82 HydrophobicContact CH2-CD 3.5Å; W78-K82 HydrophobicContact CH2-CG 3.66Å; W78-K82 HydrophobicContact CZ2-CD 3.7Å; W78-K82 HydrophobicContact CZ2-CG 3.51Å; W78-K82 HydrophobicContact CZ3-CD 3.98Å; W78-K82 HydrophobicContact CZ3-CG 3.89Å; W78-K82 WeakPolarHBondContact O-CG 3.28Å; W78-K82 PolarHBondContact O-N 3.07Å; G79-K82 CarbonylContact O-C 3.54Å; G79-K82 PolarHBondContact O-N 3.03Å; E80-K82 VanDerWaalsContact C-N 3.25Å; E80-K82 PolarHBondContact O-N 2.83Å; K82-K84 VanDerWaalsContact C-N 3.35Å; K82-K84 HydrophobicContact CB-CG 4.04Å
83	G	91.6	Very high	94.8	Very high	40 Å²	40	67.9 Å²	67.9	41%	0.412	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	37.8	-171.1	0	0	0	0	0	113.3	G79 E80	G79-G83 CarbonylContact O-C 3.54Å; G79-G83 WeakPolarHBondContact O-CA 3.36Å; G79-G83 PolarHBondContact O-N 2.78Å; E80-G83 PolarHBondContact O-N 2.96Å; E80-G83 VanDerWaalsContact O-N 3.1Å
84	K	93.5	Very high	94.9	Very high	128 Å²	128	67.5 Å²	67.5	56%	0.557	32%	0.324	S	S	*	.			trans	-117.6	89.9	-179.5	-64.3	-60.9	-177.6	-174.8	0	109.8	G79 K82 H86 M87	G79-K84 VanDerWaalsContact CA-O 3.23Å; G79-K84 WeakPolarHBondContact CA-O 3.4Å; G79-K84 PolarHBondContact O-N 3.06Å; K82-K84 VanDerWaalsContact C-N 3.35Å; K82-K84 HydrophobicContact CB-CG 4.04Å; K84-H86 VanDerWaalsContact C-N 3.26Å; K84-H86 PolarHBondContact O-N 2.96Å; K84-M87 HydrophobicContact CB-CB 4.41Å; K84-M87 HydrophobicContact CB-CE 4.15Å; K84-M87 VanDerWaalsContact O-CB 3.28Å; K84-M87 WeakPolarHBondContact O-CB 3.43Å; K84-M87 PolarHBondContact O-N 3.3Å; K84-M87 VanDerWaalsContact O-N 3.14Å
85	P	90.9	Very high	94.8	Very high	117 Å²	117	68.9 Å²	68.9	76%	0.76	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.8	-173.4	25.6	-34.4	0	0	0	113.4	M87	P85-M87 VanDerWaalsContact C-N 3.28Å; P85-M87 PolarHBondContact O-N 2.72Å
86	H	95.3	Very high	94.9	Very high	155 Å²	155	68.8 Å²	68.8	72%	0.718	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	28.7	176.4	-52.8	-64	0	0	0	113.1	K84 K91	K84-H86 VanDerWaalsContact C-N 3.26Å; K84-H86 PolarHBondContact O-N 2.96Å; H86-K91 PolarHBondContact O-NZ 3.06Å
87	M	97.6	Very high	94.9	Very high	39 Å²	39	67.8 Å²	67.8	19%	0.192	33%	0.332	C	S	.	.			trans	-74	136.5	170.6	-173.2	59.4	68.1	0	0	109.5	A75 W78 G79 K84 P85 K91	A75-M87 HydrophobicContact CB-CG 4.5Å; A75-M87 VanDerWaalsContact O-CG 3.23Å; A75-M87 WeakPolarHBondContact O-CG 3.15Å; W78-M87 HydrophobicContact CG-CG 4.48Å; G79-M87 VanDerWaalsContact CA-CB 3.46Å; K84-M87 HydrophobicContact CB-CB 4.41Å; K84-M87 HydrophobicContact CB-CE 4.15Å; K84-M87 VanDerWaalsContact O-CB 3.28Å; K84-M87 WeakPolarHBondContact O-CB 3.43Å; K84-M87 PolarHBondContact O-N 3.3Å; K84-M87 VanDerWaalsContact O-N 3.14Å; P85-M87 VanDerWaalsContact C-N 3.28Å; P85-M87 PolarHBondContact O-N 2.72Å; M87-K91 HydrophobicContact SD-CB 3.99Å
88	N	97.9	Very high	95	Very high	61 Å²	61	72 Å²	72	33%	0.326	35%	0.345	S	S	.	.			trans	-140.6	173.2	176.3	68.5	8.7	0	0	0	109.8	D90 K91 L92	N88-D90 VanDerWaalsContact C-N 3.31Å; N88-D90 PolarHBondContact O-N 3.1Å; N88-D90 PolarHBondContact OD1-N 2.94Å; N88-K91 PolarHBondContact O-N 3.47Å; N88-K91 WeakPolarHBondContact OD1-CB 3.5Å; N88-K91 VanDerWaalsContact OD1-CG 3.27Å; N88-K91 WeakPolarHBondContact OD1-CG 3.47Å; N88-K91 PolarHBondContact OD1-N 3.36Å; N88-L92 WeakPolarHBondContact O-CB 3.44Å; N88-L92 PolarHBondContact O-N 2.98Å; N88-L92 VanDerWaalsContact O-N 3.1Å
89	Y	97.6	Very high	95	Very high	33 Å²	33	72.3 Å²	72.3	13%	0.129	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-35.3	-177.9	-176.6	-101.8	0	0	0	112.3	I68 P71 K91 L92 S93 F113 Y115	I68-Y89 HydrophobicContact CD1-CE2 3.92Å; P71-Y89 HydrophobicContact CB-CD1 4.19Å; P71-Y89 HydrophobicContact CB-CD2 3.38Å; P71-Y89 HydrophobicContact CB-CE2 3.86Å; P71-Y89 HydrophobicContact CB-CG 3.57Å; Y89-K91 PolarHBondContact O-N 2.85Å; Y89-L92 HydrophobicContact CD2-CD2 4.4Å; Y89-L92 HydrophobicContact CE2-CD2 4.31Å; Y89-L92 PolarHBondContact O-N 3.18Å; Y89-S93 WeakPolarHBondContact O-CB 3.42Å; Y89-S93 PolarHBondContact O-N 2.79Å; Y89-S93 PolarHBondContact O-OG 3.44Å; Y89-F113 HydrophobicContact CD1-CE1 4.37Å; Y89-F113 AromaticContact CE1-CD1 3.99Å; Y89-F113 HydrophobicContact CE1-CD1 3.99Å; Y89-F113 AromaticContact CE1-CE1 3.66Å; Y89-F113 HydrophobicContact CE1-CE1 3.66Å; Y89-F113 AromaticContact CZ-CD1 3.77Å; Y89-F113 AromaticContact CZ-CE1 3.94Å; Y89-F113 WeakPolarHBondContact OH-CD1 3.09Å; Y89-Y115 PolarHBondContact OH-OH 2.92Å
90	D	97.3	Very high	94.9	Very high	115 Å²	115	75 Å²	75	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-59.1	-47.3	179.7	-60.7	-45.8	0	0	0	111.9	N88 S93 R94	N88-D90 VanDerWaalsContact C-N 3.31Å; N88-D90 PolarHBondContact O-N 3.1Å; N88-D90 PolarHBondContact OD1-N 2.94Å; D90-S93 PolarHBondContact O-N 3.02Å; D90-S93 PolarHBondContact O-OG 3.41Å; D90-R94 PolarHBondContact O-N 2.9Å
91	K	96.6	Very high	94.7	Very high	118 Å²	118	75.1 Å²	75.1	51%	0.513	36%	0.362	S	S	.	.	H	α-helix	trans	-65.7	-42.5	176.6	-67.8	171.8	-171.1	174.4	0	111.8	H86 M87 N88 Y89 R94	H86-K91 PolarHBondContact O-NZ 3.06Å; M87-K91 HydrophobicContact SD-CB 3.99Å; N88-K91 PolarHBondContact O-N 3.47Å; N88-K91 WeakPolarHBondContact OD1-CB 3.5Å; N88-K91 VanDerWaalsContact OD1-CG 3.27Å; N88-K91 WeakPolarHBondContact OD1-CG 3.47Å; N88-K91 PolarHBondContact OD1-N 3.36Å; Y89-K91 PolarHBondContact O-N 2.85Å; K91-R94 VanDerWaalsContact O-CB 3.3Å; K91-R94 WeakPolarHBondContact O-CB 3.19Å; K91-R94 PolarHBondContact O-N 3.03Å
92	L	97.3	Very high	94.5	Very high	1 Å²	1	79.7 Å²	79.7	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-44.1	176.6	-175.1	156.2	0	0	0	111.1	L41 L74 A75 W78 N88 Y89 R94 A95 L96	L41-L92 HydrophobicContact CD1-CD1 3.93Å; L41-L92 HydrophobicContact CD1-CD2 4.32Å; L41-L92 HydrophobicContact CD1-CG 3.92Å; L41-L92 HydrophobicContact CD2-CD2 3.94Å; L41-L92 HydrophobicContact CD2-CG 3.85Å; L74-L92 HydrophobicContact CD2-CD1 4.24Å; L74-L92 HydrophobicContact CD2-CD2 4.23Å; L74-L92 HydrophobicContact CG-CD1 3.94Å; A75-L92 HydrophobicContact CB-CD1 4.46Å; W78-L92 HydrophobicContact CB-CD1 3.85Å; W78-L92 HydrophobicContact CG-CD1 4.01Å; N88-L92 WeakPolarHBondContact O-CB 3.44Å; N88-L92 PolarHBondContact O-N 2.98Å; N88-L92 VanDerWaalsContact O-N 3.1Å; Y89-L92 HydrophobicContact CD2-CD2 4.4Å; Y89-L92 HydrophobicContact CE2-CD2 4.31Å; Y89-L92 PolarHBondContact O-N 3.18Å; L92-R94 PolarHBondContact O-N 3.15Å; L92-A95 WeakPolarHBondContact O-CA 3.32Å; L92-A95 WeakPolarHBondContact O-CB 3.33Å; L92-A95 PolarHBondContact O-N 2.94Å; L92-L96 HydrophobicContact CD2-CD1 3.72Å; L92-L96 HydrophobicContact CD2-CG 3.96Å; L92-L96 PolarHBondContact O-N 3.35Å; L92-L96 VanDerWaalsContact O-N 3.1Å
93	S	97.4	Very high	94.4	Very high	12 Å²	12	84.4 Å²	84.4	8%	0.084	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-28.8	179.3	82.6	0	0	0	0	111.5	Y89 D90 A95 L96 R97	Y89-S93 WeakPolarHBondContact O-CB 3.42Å; Y89-S93 PolarHBondContact O-N 2.79Å; Y89-S93 PolarHBondContact O-OG 3.44Å; D90-S93 PolarHBondContact O-N 3.02Å; D90-S93 PolarHBondContact O-OG 3.41Å; S93-A95 VanDerWaalsContact C-N 3.32Å; S93-A95 PolarHBondContact O-N 3.19Å; S93-L96 WeakPolarHBondContact O-CB 3.44Å; S93-L96 PolarHBondContact O-N 3.38Å; S93-R97 WeakPolarHBondContact O-CG 3.39Å; S93-R97 PolarHBondContact O-N 3.23Å
94	R	97.3	Very high	94.3	Very high	110 Å²	110	83.8 Å²	83.8	42%	0.415	39%	0.386	S	S	.	.	H	α-helix	trans	-61.1	-41.2	171.8	-170	67.6	-167.9	86.1	-11	111.9	D90 K91 L92 R97 Y98	D90-R94 PolarHBondContact O-N 2.9Å; K91-R94 VanDerWaalsContact O-CB 3.3Å; K91-R94 WeakPolarHBondContact O-CB 3.19Å; K91-R94 PolarHBondContact O-N 3.03Å; L92-R94 PolarHBondContact O-N 3.15Å; R94-R97 PolarHBondContact O-N 3.4Å; R94-Y98 HydrophobicContact CG-CD2 4.49Å; R94-Y98 HydrophobicContact CG-CE2 3.84Å; R94-Y98 VanDerWaalsContact NH1-CD1 3.29Å; R94-Y98 VanDerWaalsContact NH1-CE2 3.28Å; R94-Y98 PolarHBondContact NH2-OH 2.94Å; R94-Y98 WeakPolarHBondContact O-CD2 3.47Å; R94-Y98 PolarHBondContact O-N 2.76Å
95	A	94.4	Very high	94.3	Very high	29 Å²	29	77.7 Å²	77.7	24%	0.24	36%	0.36	C	S	.	.	H	α-helix	trans	-66.8	-41.4	174.2	0	0	0	0	0	112.1	L41 L92 S93 R97 Y98 Y99	L41-A95 HydrophobicContact CD2-CB 3.68Å; L92-A95 WeakPolarHBondContact O-CA 3.32Å; L92-A95 WeakPolarHBondContact O-CB 3.33Å; L92-A95 PolarHBondContact O-N 2.94Å; S93-A95 VanDerWaalsContact C-N 3.32Å; S93-A95 PolarHBondContact O-N 3.19Å; A95-R97 VanDerWaalsContact C-N 3.29Å; A95-R97 PolarHBondContact O-N 2.93Å; A95-Y98 PolarHBondContact O-N 3.05Å; A95-Y98 VanDerWaalsContact O-N 3.14Å; A95-Y99 WeakPolarHBondContact O-CD2 3.45Å; A95-Y99 PolarHBondContact O-N 3.49Å
96	L	96.7	Very high	94.5	Very high	0 Å²	0	75 Å²	75	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.1	-42.9	173.8	-66.6	177	0	0	0	112	L41 L45 I68 L92 S93 Y98 Y99 Y100 L105 Y115	L41-L96 HydrophobicContact CD2-CD2 3.97Å; L41-L96 HydrophobicContact CD2-CG 4.13Å; L45-L96 HydrophobicContact CD1-CD2 3.7Å; I68-L96 HydrophobicContact CD1-CD1 4.09Å; L92-L96 HydrophobicContact CD2-CD1 3.72Å; L92-L96 HydrophobicContact CD2-CG 3.96Å; L92-L96 PolarHBondContact O-N 3.35Å; L92-L96 VanDerWaalsContact O-N 3.1Å; S93-L96 WeakPolarHBondContact O-CB 3.44Å; S93-L96 PolarHBondContact O-N 3.38Å; L96-Y98 VanDerWaalsContact C-N 3.33Å; L96-Y98 PolarHBondContact O-N 3.15Å; L96-Y99 HydrophobicContact CD2-CD2 4.44Å; L96-Y99 WeakPolarHBondContact O-CB 3.23Å; L96-Y99 PolarHBondContact O-N 2.8Å; L96-Y99 VanDerWaalsContact O-N 3.09Å; L96-Y100 WeakPolarHBondContact O-CD1 3.18Å; L96-Y100 VanDerWaalsContact O-CE1 3.29Å; L96-Y100 WeakPolarHBondContact O-CE1 3.41Å; L96-L105 HydrophobicContact CD2-CD2 3.83Å; L96-Y115 HydrophobicContact CB-CE1 4.28Å; L96-Y115 HydrophobicContact CD1-CD2 4.49Å; L96-Y115 HydrophobicContact CD1-CE1 4.13Å; L96-Y115 HydrophobicContact CD1-CE2 3.96Å
97	R	96.7	Very high	94.5	Very high	146 Å²	146	71 Å²	71	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-63.1	-37.2	177.5	-69.3	175.3	-171.2	-168.9	3.7	112.6	S93 R94 A95 Y99 Y100	S93-R97 WeakPolarHBondContact O-CG 3.39Å; S93-R97 PolarHBondContact O-N 3.23Å; R94-R97 PolarHBondContact O-N 3.4Å; A95-R97 VanDerWaalsContact C-N 3.29Å; A95-R97 PolarHBondContact O-N 2.93Å; R97-Y99 PolarHBondContact O-N 3.29Å; R97-Y100 HydrophobicContact CB-CE2 4.14Å; R97-Y100 HydrophobicContact CG-CE2 3.95Å; R97-Y100 WeakPolarHBondContact O-CD2 3.32Å; R97-Y100 PolarHBondContact O-N 3.5Å
98	Y	94.9	Very high	94.5	Very high	136 Å²	136	70.2 Å²	70.2	53%	0.533	32%	0.315	S	S	.	.	H	α-helix	trans	-64	-23	175.6	-70.6	-55.2	0	0	0	113	R94 A95 L96 Y100	R94-Y98 HydrophobicContact CG-CD2 4.49Å; R94-Y98 HydrophobicContact CG-CE2 3.84Å; R94-Y98 VanDerWaalsContact NH1-CD1 3.29Å; R94-Y98 VanDerWaalsContact NH1-CE2 3.28Å; R94-Y98 PolarHBondContact NH2-OH 2.94Å; R94-Y98 WeakPolarHBondContact O-CD2 3.47Å; R94-Y98 PolarHBondContact O-N 2.76Å; A95-Y98 PolarHBondContact O-N 3.05Å; A95-Y98 VanDerWaalsContact O-N 3.14Å; L96-Y98 VanDerWaalsContact C-N 3.33Å; L96-Y98 PolarHBondContact O-N 3.15Å; Y98-Y100 VanDerWaalsContact C-N 3.32Å; Y98-Y100 PolarHBondContact O-N 2.95Å
99	Y	94.1	Very high	94.3	Very high	26 Å²	26	76.6 Å²	76.6	10%	0.102	34%	0.34	C	S	.	.	H	α-helix	trans	-76.5	-14.8	179.5	-66.2	-36.2	0	0	0	114.7	L41 W42 A95 L96 R97 K102 R103 I104 L105	L41-Y99 HydrophobicContact CB-CE2 4.11Å; L41-Y99 HydrophobicContact CD2-CE2 4.22Å; L41-Y99 HydrophobicContact CG-CE2 4.36Å; W42-Y99 HydrophobicContact CB-CD2 4.48Å; W42-Y99 HydrophobicContact CB-CE2 3.94Å; W42-Y99 AromaticContact CD1-CZ 3.79Å; A95-Y99 WeakPolarHBondContact O-CD2 3.45Å; A95-Y99 PolarHBondContact O-N 3.49Å; L96-Y99 HydrophobicContact CD2-CD2 4.44Å; L96-Y99 WeakPolarHBondContact O-CB 3.23Å; L96-Y99 PolarHBondContact O-N 2.8Å; L96-Y99 VanDerWaalsContact O-N 3.09Å; R97-Y99 PolarHBondContact O-N 3.29Å; Y99-K102 CarbonylContact O-C 3.46Å; Y99-K102 PolarHBondContact O-N 3.24Å; Y99-R103 PolarHBondContact O-N 2.81Å; Y99-R103 VanDerWaalsContact O-N 3.14Å; Y99-I104 HydrophobicContact CD1-CB 4.33Å; Y99-I104 HydrophobicContact CD1-CD1 3.65Å; Y99-I104 HydrophobicContact CD1-CG2 4.35Å; Y99-I104 HydrophobicContact CE1-CD1 4Å; Y99-I104 HydrophobicContact CG-CB 4.3Å; Y99-I104 HydrophobicContact CG-CD1 4.45Å; Y99-I104 HydrophobicContact CG-CG2 4.16Å; Y99-I104 PolarHBondContact O-N 3.32Å; Y99-I104 VanDerWaalsContact O-N 3.13Å; Y99-L105 HydrophobicContact CD2-CD2 3.85Å; Y99-L105 HydrophobicContact CD2-CG 4.31Å; Y99-L105 HydrophobicContact CG-CD2 4.48Å; Y99-L105 HydrophobicContact CG-CG 4.48Å
100	Y	92.8	Very high	94.1	Very high	59 Å²	59	79.5 Å²	79.5	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-63.2	-51.9	178	-55	-15.3	0	0	0	111.1	L96 R97 Y98 K102 R103 L105 K107 Y115	L96-Y100 WeakPolarHBondContact O-CD1 3.18Å; L96-Y100 VanDerWaalsContact O-CE1 3.29Å; L96-Y100 WeakPolarHBondContact O-CE1 3.41Å; R97-Y100 HydrophobicContact CB-CE2 4.14Å; R97-Y100 HydrophobicContact CG-CE2 3.95Å; R97-Y100 WeakPolarHBondContact O-CD2 3.32Å; R97-Y100 PolarHBondContact O-N 3.5Å; Y98-Y100 VanDerWaalsContact C-N 3.32Å; Y98-Y100 PolarHBondContact O-N 2.95Å; Y100-K102 VanDerWaalsContact C-N 3.29Å; Y100-K102 PolarHBondContact O-N 2.78Å; Y100-R103 PolarHBondContact O-N 2.85Å; Y100-L105 WeakPolarHBondContact CA-O 3.14Å; Y100-L105 HydrophobicContact CD1-CD1 3.89Å; Y100-L105 HydrophobicContact CE1-CD1 3.69Å; Y100-K107 HydrophobicContact CE1-CB 3.99Å; Y100-K107 HydrophobicContact CE2-CB 4.18Å; Y100-Y115 HydrophobicContact CE1-CD1 4.31Å; Y100-Y115 HydrophobicContact CE1-CE1 4.29Å; Y100-Y115 WeakPolarHBondContact OH-CE1 3.41Å
101	N	89	Confident	94	Very high	149 Å²	149	78.2 Å²	78.2	80%	0.797	37%	0.369	S	S	*	.	H	α-helix	trans	-67	-34.1	179.5	-66.8	-1.2	0	0	0	111.5	R103	N101-R103 PolarHBondContact O-N 3.39Å
102	K	86.1	Confident	94	Very high	148 Å²	148	82.2 Å²	82.2	64%	0.643	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.2	174.8	-67.3	-164.9	166.1	-168.1	0	113.7	Y99 Y100 I104	Y99-K102 CarbonylContact O-C 3.46Å; Y99-K102 PolarHBondContact O-N 3.24Å; Y100-K102 VanDerWaalsContact C-N 3.29Å; Y100-K102 PolarHBondContact O-N 2.78Å; K102-I104 HydrophobicContact CB-CD1 3.88Å; K102-I104 HydrophobicContact CB-CG1 4.1Å; K102-I104 HydrophobicContact CD-CD1 4.29Å; K102-I104 PolarHBondContact O-N 2.81Å; K102-I104 VanDerWaalsContact O-N 3.1Å
103	R	87.8	Confident	94	Very high	151 Å²	151	85.1 Å²	85.1	57%	0.57	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	28.7	-179.1	-54.9	-64.8	-170	154.6	1.2	112.8	Y99 Y100 N101 N118 K121	Y99-R103 PolarHBondContact O-N 2.81Å; Y99-R103 VanDerWaalsContact O-N 3.14Å; Y100-R103 PolarHBondContact O-N 2.85Å; N101-R103 PolarHBondContact O-N 3.39Å; R103-N118 VanDerWaalsContact O-CB 3.23Å; R103-N118 WeakPolarHBondContact O-CB 3.43Å; R103-N118 PolarHBondContact O-ND2 2.86Å; R103-K121 HydrophobicContact CB-CG 4.49Å
104	I	89.8	Confident	93.9	Very high	26 Å²	26	84.9 Å²	84.9	13%	0.133	39%	0.391	C	S	.	.	S	Bend	trans	-82.5	-45.7	177.6	-74.9	167.4	0	0	0	109.6	W42 Y99 K102 N118 L122	W42-I104 HydrophobicContact CB-CG2 3.93Å; W42-I104 HydrophobicContact CD2-CG2 4.47Å; W42-I104 HydrophobicContact CG-CG2 4.03Å; Y99-I104 HydrophobicContact CD1-CB 4.33Å; Y99-I104 HydrophobicContact CD1-CD1 3.65Å; Y99-I104 HydrophobicContact CD1-CG2 4.35Å; Y99-I104 HydrophobicContact CE1-CD1 4Å; Y99-I104 HydrophobicContact CG-CB 4.3Å; Y99-I104 HydrophobicContact CG-CD1 4.45Å; Y99-I104 HydrophobicContact CG-CG2 4.16Å; Y99-I104 PolarHBondContact O-N 3.32Å; Y99-I104 VanDerWaalsContact O-N 3.13Å; K102-I104 HydrophobicContact CB-CD1 3.88Å; K102-I104 HydrophobicContact CB-CG1 4.1Å; K102-I104 HydrophobicContact CD-CD1 4.29Å; K102-I104 PolarHBondContact O-N 2.81Å; K102-I104 VanDerWaalsContact O-N 3.1Å; I104-N118 PolarHBondContact O-N 3.03Å; I104-L122 HydrophobicContact CG1-CD2 4.46Å; I104-L122 HydrophobicContact CG2-CD2 4.27Å
105	L	94.1	Very high	93.9	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	161.9	173.4	63.4	83.5	0	0	0	109.9	F66 L96 Y99 Y100 Y115 K116 F117	F66-L105 HydrophobicContact CZ-CD2 4.47Å; L96-L105 HydrophobicContact CD2-CD2 3.83Å; Y99-L105 HydrophobicContact CD2-CD2 3.85Å; Y99-L105 HydrophobicContact CD2-CG 4.31Å; Y99-L105 HydrophobicContact CG-CD2 4.48Å; Y99-L105 HydrophobicContact CG-CG 4.48Å; Y100-L105 WeakPolarHBondContact CA-O 3.14Å; Y100-L105 HydrophobicContact CD1-CD1 3.89Å; Y100-L105 HydrophobicContact CE1-CD1 3.69Å; L105-Y115 HydrophobicContact CD1-CD1 3.93Å; L105-K116 CarbonylContact C-O 3.54Å; L105-K116 WeakPolarHBondContact CA-O 3.27Å; L105-K116 WeakPolarHBondContact CB-O 3.29Å; L105-F117 HydrophobicContact CB-CD1 4.15Å; L105-F117 HydrophobicContact CD2-CE1 4.22Å
106	H	95.1	Very high	93.9	Very high	61 Å²	61	82 Å²	82	28%	0.282	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.1	177.5	-61.8	-64.5	0	0	0	110.6	Y115 K116 N118	H106-Y115 CarbonylContact O-C 3.59Å; H106-Y115 WeakPolarHBondContact O-CA 3.43Å; H106-K116 PolarHBondContact N-O 3.42Å; H106-K116 PolarHBondContact O-N 3.35Å; H106-N118 PolarHBondContact NE2-ND2 2.95Å
107	K	95.2	Very high	93.7	Very high	70 Å²	70	82.1 Å²	82.1	30%	0.304	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.5	170.4	-178.7	63.5	-166.1	156	0	109.6	Y100 K109 K111 T114 Y115	Y100-K107 HydrophobicContact CE1-CB 3.99Å; Y100-K107 HydrophobicContact CE2-CB 4.18Å; K107-K109 PolarHBondContact O-N 3.34Å; K107-K111 WeakPolarHBondContact CE-O 3.29Å; K107-K111 PolarHBondContact NZ-O 3.28Å; K107-T114 WeakPolarHBondContact CD-O 3.31Å; K107-T114 PolarHBondContact NZ-O 3.08Å; K107-Y115 HydrophobicContact CB-CD1 4.48Å; K107-Y115 HydrophobicContact CD-CD1 3.8Å; K107-Y115 HydrophobicContact CD-CE1 3.4Å; K107-Y115 VanDerWaalsContact CD-CE1 3.4Å
108	T	96	Very high	93.4	Very high	23 Å²	23	76.9 Å²	76.9	14%	0.141	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-70.5	119.8	168.9	-53.8	0	0	0	0	108.8	E65 K111 T114	E65-T108 WeakPolarHBondContact OE1-CG2 3.26Å; E65-T108 PolarHBondContact OE1-OG1 3.17Å; T108-K111 HydrophobicContact CG2-CB 4.12Å; T108-K111 HydrophobicContact CG2-CD 3.81Å; T108-K111 HydrophobicContact CG2-CG 3.99Å; T108-T114 HydrophobicContact CG2-CG2 4.34Å; T108-T114 PolarHBondContact N-O 3.42Å
109	K	94	Very high	92.7	Very high	196 Å²	196	71.7 Å²	71.7	85%	0.852	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	145.4	177.9	-64.2	-174.2	179.5	-177.8	0	109.8	K107 K111	K107-K109 PolarHBondContact O-N 3.34Å; K109-K111 PolarHBondContact O-N 3.1Å
110	G	94.9	Very high	91.8	Very high	93 Å²	93	74.4 Å²	74.4	96%	0.959	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	-9.9	179.2	0	0	0	0	0	115.9
111	K	95	Very high	90.6	Very high	89 Å²	89	76.3 Å²	76.3	39%	0.387	37%	0.372	S	S	.	.			trans	-112.4	127.1	179	-60	-171.3	-167.4	165.6	0	112.6	E65 K107 T108 K109 T114	E65-K111 IonicContact OE1-NZ 2.87Å; E65-K111 PolarHBondContact OE1-NZ 2.95Å; E65-K111 IonicContact OE2-NZ 3.17Å; E65-K111 PolarHBondContact OE2-NZ 3.24Å; K107-K111 WeakPolarHBondContact CE-O 3.29Å; K107-K111 PolarHBondContact NZ-O 3.28Å; T108-K111 HydrophobicContact CG2-CB 4.12Å; T108-K111 HydrophobicContact CG2-CD 3.81Å; T108-K111 HydrophobicContact CG2-CG 3.99Å; K109-K111 PolarHBondContact O-N 3.1Å; K111-T114 HydrophobicContact CB-CG2 4.33Å; K111-T114 WeakPolarHBondContact CB-OG1 3.47Å; K111-T114 HydrophobicContact CD-CG2 4.06Å
112	R	95.7	Very high	89.4	Confident	201 Å²	201	69.8 Å²	69.8	76%	0.758	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	137.6	175.8	-64.2	-172	73.7	180	3	109.7	T114	R112-T114 PolarHBondContact O-N 3.37Å; R112-T114 PolarHBondContact O-OG1 3.12Å; R112-T114 VanDerWaalsContact O-OG1 3.06Å
113	F	96.7	Very high	88.3	Confident	62 Å²	62	66.1 Å²	66.1	27%	0.272	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	11.6	174.8	-51.8	-54	0	0	0	116.8	I68 P71 Y89 Y115	I68-F113 HydrophobicContact CB-CB 4.1Å; I68-F113 PolarHBondContact N-O 3Å; I68-F113 VanDerWaalsContact O-CB 3.28Å; I68-F113 WeakPolarHBondContact O-CB 3Å; P71-F113 HydrophobicContact CG-CZ 4.42Å; Y89-F113 HydrophobicContact CD1-CE1 4.37Å; Y89-F113 AromaticContact CE1-CD1 3.99Å; Y89-F113 HydrophobicContact CE1-CD1 3.99Å; Y89-F113 AromaticContact CE1-CE1 3.66Å; Y89-F113 HydrophobicContact CE1-CE1 3.66Å; Y89-F113 AromaticContact CZ-CD1 3.77Å; Y89-F113 AromaticContact CZ-CE1 3.94Å; Y89-F113 WeakPolarHBondContact OH-CD1 3.09Å; F113-Y115 WeakPolarHBondContact O-CD2 3.39Å
114	T	96.3	Very high	86.5	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.043	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.1	176.3	-45.7	0	0	0	0	111.6	E65 F66 V67 K107 T108 K111 R112	E65-T114 VanDerWaalsContact CD-CG2 3.44Å; E65-T114 HydrophobicContact CG-CG2 3.4Å; E65-T114 VanDerWaalsContact OE1-CG2 3.26Å; E65-T114 WeakPolarHBondContact OE1-CG2 3.4Å; F66-T114 WeakPolarHBondContact O-CA 3.36Å; F66-T114 WeakPolarHBondContact O-CG2 3.4Å; V67-T114 HydrophobicContact CG2-CG2 3.92Å; K107-T114 WeakPolarHBondContact CD-O 3.31Å; K107-T114 PolarHBondContact NZ-O 3.08Å; T108-T114 HydrophobicContact CG2-CG2 4.34Å; T108-T114 PolarHBondContact N-O 3.42Å; K111-T114 HydrophobicContact CB-CG2 4.33Å; K111-T114 WeakPolarHBondContact CB-OG1 3.47Å; K111-T114 HydrophobicContact CD-CG2 4.06Å; R112-T114 PolarHBondContact O-N 3.37Å; R112-T114 PolarHBondContact O-OG1 3.12Å; R112-T114 VanDerWaalsContact O-OG1 3.06Å
115	Y	96.6	Very high	84.3	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	159.5	-177.5	-61.1	-91.7	0	0	0	109.2	E65 F66 I68 Y89 L96 Y100 L105 H106 K107 F113	E65-Y115 CarbonylContact C-O 3.15Å; E65-Y115 WeakPolarHBondContact CA-O 3.5Å; F66-Y115 WeakPolarHBondContact CD1-O 3.26Å; F66-Y115 HydrophobicContact CE2-CD2 4.16Å; F66-Y115 HydrophobicContact CE2-CG 4.48Å; F66-Y115 VanDerWaalsContact CZ-CB 3.48Å; F66-Y115 HydrophobicContact CZ-CD2 4.22Å; F66-Y115 HydrophobicContact CZ-CG 4.1Å; F66-Y115 PolarHBondContact N-O 2.87Å; F66-Y115 PolarHBondContact O-N 3.28Å; F66-Y115 VanDerWaalsContact O-O 3.1Å; I68-Y115 HydrophobicContact CD1-CD2 4.04Å; I68-Y115 HydrophobicContact CD1-CE2 3.77Å; Y89-Y115 PolarHBondContact OH-OH 2.92Å; L96-Y115 HydrophobicContact CB-CE1 4.28Å; L96-Y115 HydrophobicContact CD1-CD2 4.49Å; L96-Y115 HydrophobicContact CD1-CE1 4.13Å; L96-Y115 HydrophobicContact CD1-CE2 3.96Å; Y100-Y115 HydrophobicContact CE1-CD1 4.31Å; Y100-Y115 HydrophobicContact CE1-CE1 4.29Å; Y100-Y115 WeakPolarHBondContact OH-CE1 3.41Å; L105-Y115 HydrophobicContact CD1-CD1 3.93Å; H106-Y115 CarbonylContact O-C 3.59Å; H106-Y115 WeakPolarHBondContact O-CA 3.43Å; K107-Y115 HydrophobicContact CB-CD1 4.48Å; K107-Y115 HydrophobicContact CD-CD1 3.8Å; K107-Y115 HydrophobicContact CD-CE1 3.4Å; K107-Y115 VanDerWaalsContact CD-CE1 3.4Å; F113-Y115 WeakPolarHBondContact O-CD2 3.39Å
116	K	94.7	Very high	81.9	Confident	67 Å²	67	66.3 Å²	66.3	29%	0.291	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.1	-178.3	-170.4	168.9	-170.1	166.7	0	110.8	E62 W63 G64 E65 L105 H106	E62-K116 IonicContact OE2-NZ 3.55Å; E62-K116 PolarHBondContact OE2-NZ 3.05Å; W63-K116 WeakPolarHBondContact O-CE 3.29Å; G64-K116 CarbonylContact O-C 3.59Å; G64-K116 WeakPolarHBondContact O-CA 3.47Å; E65-K116 HydrophobicContact CB-CG 4.46Å; L105-K116 CarbonylContact C-O 3.54Å; L105-K116 WeakPolarHBondContact CA-O 3.27Å; L105-K116 WeakPolarHBondContact CB-O 3.29Å; H106-K116 PolarHBondContact N-O 3.42Å; H106-K116 PolarHBondContact O-N 3.35Å
117	F	93.3	Very high	79.2	Confident	3 Å²	3	68.9 Å²	68.9	1%	0.013	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	139.7	172.8	-78.2	-72.5	0	0	0	110.5	W42 L45 L46 L49 W59 G64 F66 L105 F119 L122	W42-F117 HydrophobicContact CB-CE1 4.23Å; L45-F117 HydrophobicContact CB-CZ 4.06Å; L46-F117 HydrophobicContact CD2-CD2 3.91Å; L46-F117 HydrophobicContact CD2-CE1 4.29Å; L46-F117 HydrophobicContact CD2-CE2 3.61Å; L46-F117 HydrophobicContact CD2-CG 4.37Å; L46-F117 HydrophobicContact CD2-CZ 3.81Å; L46-F117 HydrophobicContact CG-CE1 4.22Å; L46-F117 HydrophobicContact CG-CE2 4.18Å; L46-F117 HydrophobicContact CG-CZ 3.86Å; L49-F117 HydrophobicContact CD1-CE2 3.76Å; W59-F117 HydrophobicContact CH2-CD2 4.26Å; W59-F117 HydrophobicContact CZ3-CD2 4.21Å; G64-F117 PolarHBondContact O-N 2.95Å; F66-F117 AromaticContact CD1-CD2 3.57Å; F66-F117 HydrophobicContact CD1-CD2 3.57Å; F66-F117 AromaticContact CD1-CE2 3.43Å; F66-F117 HydrophobicContact CD1-CE2 3.43Å; F66-F117 VanDerWaalsContact CD1-CE2 3.43Å; F66-F117 HydrophobicContact CD1-CZ 4.37Å; F66-F117 AromaticContact CE1-CD2 3.67Å; F66-F117 HydrophobicContact CE1-CD2 3.67Å; F66-F117 AromaticContact CE1-CE2 3.32Å; F66-F117 HydrophobicContact CE1-CE2 3.32Å; F66-F117 HydrophobicContact CE1-CG 4.41Å; F66-F117 AromaticContact CE1-CZ 3.83Å; F66-F117 HydrophobicContact CE1-CZ 3.83Å; F66-F117 HydrophobicContact CG-CE2 4.31Å; F66-F117 HydrophobicContact CZ-CE2 4.16Å; F66-F117 HydrophobicContact CZ-CZ 4.36Å; L105-F117 HydrophobicContact CB-CD1 4.15Å; L105-F117 HydrophobicContact CD2-CE1 4.22Å; F117-F119 HydrophobicContact CB-CD1 4.21Å; F117-F119 HydrophobicContact CB-CD2 4.38Å; F117-F119 HydrophobicContact CB-CE1 3.91Å; F117-F119 HydrophobicContact CB-CE2 4.14Å; F117-F119 HydrophobicContact CB-CG 4.43Å; F117-F119 HydrophobicContact CB-CZ 3.88Å; F117-F119 HydrophobicContact CD2-CZ 4.43Å; F117-F119 HydrophobicContact CG-CE1 4.35Å; F117-F119 HydrophobicContact CG-CZ 4.39Å; F117-F119 PolarHBondContact O-N 2.98Å; F117-L122 HydrophobicContact CB-CD1 4.23Å; F117-L122 HydrophobicContact CD1-CD1 3.8Å; F117-L122 HydrophobicContact CG-CD1 4.37Å
118	N	89.8	Confident	76.7	Confident	35 Å²	35	71.3 Å²	71.3	19%	0.187	37%	0.37	C	S	.	.			trans	-94.2	80.4	171.8	-175.4	-9.5	0	0	0	109	R103 I104 H106 S120 K121 L122	R103-N118 VanDerWaalsContact O-CB 3.23Å; R103-N118 WeakPolarHBondContact O-CB 3.43Å; R103-N118 PolarHBondContact O-ND2 2.86Å; I104-N118 PolarHBondContact O-N 3.03Å; H106-N118 PolarHBondContact NE2-ND2 2.95Å; N118-S120 PolarHBondContact O-N 3.4Å; N118-K121 PolarHBondContact O-N 2.99Å; N118-K121 PolarHBondContact OD1-N 3.49Å; N118-L122 WeakPolarHBondContact O-CG 3.43Å; N118-L122 PolarHBondContact O-N 2.75Å
119	F	79.9	Confident	74.4	Confident	28 Å²	28	73.1 Å²	73.1	12%	0.123	39%	0.393	C	S	.	.	H	α-helix	trans	-64.6	-28	-177.6	-66.3	-60.7	0	0	0	113.1	L46 W59 W63 F117 K121 L122 I123 F146	L46-F119 HydrophobicContact CD2-CE1 4.18Å; L46-F119 HydrophobicContact CD2-CZ 4.44Å; W59-F119 AromaticContact CH2-CZ 3.88Å; W59-F119 HydrophobicContact CH2-CZ 3.88Å; W59-F119 HydrophobicContact CZ3-CZ 4.19Å; W63-F119 HydrophobicContact CD2-CD2 4.23Å; W63-F119 AromaticContact CE2-CD2 3.82Å; W63-F119 HydrophobicContact CE3-CD2 4.34Å; W63-F119 HydrophobicContact CH2-CB 3.49Å; W63-F119 VanDerWaalsContact CH2-CB 3.49Å; W63-F119 AromaticContact CH2-CD2 3.85Å; W63-F119 HydrophobicContact CH2-CD2 3.85Å; W63-F119 HydrophobicContact CH2-CG 4.18Å; W63-F119 HydrophobicContact CZ2-CB 3.73Å; W63-F119 AromaticContact CZ2-CD2 3.61Å; W63-F119 HydrophobicContact CZ2-CD2 3.61Å; W63-F119 HydrophobicContact CZ2-CG 4.11Å; W63-F119 HydrophobicContact CZ3-CB 4.25Å; W63-F119 HydrophobicContact CZ3-CD2 4.17Å; F117-F119 HydrophobicContact CB-CD1 4.21Å; F117-F119 HydrophobicContact CB-CD2 4.38Å; F117-F119 HydrophobicContact CB-CE1 3.91Å; F117-F119 HydrophobicContact CB-CE2 4.14Å; F117-F119 HydrophobicContact CB-CG 4.43Å; F117-F119 HydrophobicContact CB-CZ 3.88Å; F117-F119 HydrophobicContact CD2-CZ 4.43Å; F117-F119 HydrophobicContact CG-CE1 4.35Å; F117-F119 HydrophobicContact CG-CZ 4.39Å; F117-F119 PolarHBondContact O-N 2.98Å; F119-K121 PolarHBondContact O-N 3.22Å; F119-L122 HydrophobicContact CD1-CD1 3.97Å; F119-L122 HydrophobicContact CE1-CD1 4.37Å; F119-L122 PolarHBondContact O-N 3.41Å; F119-L122 VanDerWaalsContact O-N 3.15Å; F119-I123 HydrophobicContact CB-CD1 4.14Å; F119-I123 VanDerWaalsContact O-CB 3.25Å; F119-I123 WeakPolarHBondContact O-CB 3.4Å; F119-I123 WeakPolarHBondContact O-CD1 3.02Å; F119-I123 WeakPolarHBondContact O-CG1 3.32Å; F119-I123 PolarHBondContact O-N 2.83Å; F119-F146 AromaticContact CE2-CD2 3.95Å; F119-F146 HydrophobicContact CE2-CD2 3.95Å; F119-F146 HydrophobicContact CE2-CE2 4.05Å; F119-F146 HydrophobicContact CZ-CD2 4.31Å; F119-F146 HydrophobicContact CZ-CE2 4.22Å
120	S	74.6	Confident	72	Confident	83 Å²	83	70.8 Å²	70.8	58%	0.58	38%	0.38	S	S	*	.	H	α-helix	trans	-57.2	-38.7	175.4	-48.6	0	0	0	0	111.7	N118 L124	N118-S120 PolarHBondContact O-N 3.4Å; S120-L124 VanDerWaalsContact O-CB 3.29Å; S120-L124 WeakPolarHBondContact O-CB 3.24Å; S120-L124 PolarHBondContact O-N 3.04Å
121	K	67.6	Low	69.5	Low	98 Å²	98	73.8 Å²	73.8	43%	0.426	37%	0.373	S	S	.	.	H	α-helix	trans	-83	-35.3	174.7	-160.9	66.1	175.6	-179.3	0	112.4	R103 N118 F119 I123 L124 V125	R103-K121 HydrophobicContact CB-CG 4.49Å; N118-K121 PolarHBondContact O-N 2.99Å; N118-K121 PolarHBondContact OD1-N 3.49Å; F119-K121 PolarHBondContact O-N 3.22Å; K121-I123 VanDerWaalsContact C-N 3.34Å; K121-I123 PolarHBondContact O-N 3.15Å; K121-L124 HydrophobicContact CD-CD2 4.43Å; K121-L124 PolarHBondContact O-N 3.19Å; K121-V125 HydrophobicContact CG-CG2 4.18Å; K121-V125 VanDerWaalsContact O-CB 3.26Å; K121-V125 WeakPolarHBondContact O-CB 3.49Å; K121-V125 WeakPolarHBondContact O-CG2 3.42Å; K121-V125 PolarHBondContact O-N 3.31Å
122	L	65.5	Low	67.1	Low	13 Å²	13	74 Å²	74	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-35	177.5	-67.9	170.3	0	0	0	112.8	W42 I104 F117 N118 F119 N126	W42-L122 HydrophobicContact CE3-CD2 4.22Å; W42-L122 HydrophobicContact CH2-CD2 4.08Å; W42-L122 HydrophobicContact CZ2-CD2 4.48Å; W42-L122 HydrophobicContact CZ3-CD2 3.96Å; I104-L122 HydrophobicContact CG1-CD2 4.46Å; I104-L122 HydrophobicContact CG2-CD2 4.27Å; F117-L122 HydrophobicContact CB-CD1 4.23Å; F117-L122 HydrophobicContact CD1-CD1 3.8Å; F117-L122 HydrophobicContact CG-CD1 4.37Å; N118-L122 WeakPolarHBondContact O-CG 3.43Å; N118-L122 PolarHBondContact O-N 2.75Å; F119-L122 HydrophobicContact CD1-CD1 3.97Å; F119-L122 HydrophobicContact CE1-CD1 4.37Å; F119-L122 PolarHBondContact O-N 3.41Å; F119-L122 VanDerWaalsContact O-N 3.15Å; L122-N126 WeakPolarHBondContact O-CB 3.45Å; L122-N126 PolarHBondContact O-N 2.84Å; L122-N126 PolarHBondContact O-ND2 2.73Å
123	I	61.1	Low	64.5	Low	71 Å²	71	68.2 Å²	68.2	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-71.6	-44.4	174.3	-65.2	166.4	0	0	0	109.7	F119 K121 V125 N126 Y127	F119-I123 HydrophobicContact CB-CD1 4.14Å; F119-I123 VanDerWaalsContact O-CB 3.25Å; F119-I123 WeakPolarHBondContact O-CB 3.4Å; F119-I123 WeakPolarHBondContact O-CD1 3.02Å; F119-I123 WeakPolarHBondContact O-CG1 3.32Å; F119-I123 PolarHBondContact O-N 2.83Å; K121-I123 VanDerWaalsContact C-N 3.34Å; K121-I123 PolarHBondContact O-N 3.15Å; I123-V125 PolarHBondContact O-N 3.48Å; I123-N126 CarbonylContact O-C 3.56Å; I123-N126 WeakPolarHBondContact O-CA 2.87Å; I123-N126 PolarHBondContact O-N 3.45Å; I123-Y127 PolarHBondContact O-N 2.95Å
124	L	50.3	Low	61.7	Low	80 Å²	80	70.1 Å²	70.1	42%	0.419	39%	0.393	S	S	.	.	H	α-helix	trans	-67	-36.5	178	-173.1	66.6	0	0	0	112.7	S120 K121 N126 Y127	S120-L124 VanDerWaalsContact O-CB 3.29Å; S120-L124 WeakPolarHBondContact O-CB 3.24Å; S120-L124 PolarHBondContact O-N 3.04Å; K121-L124 HydrophobicContact CD-CD2 4.43Å; K121-L124 PolarHBondContact O-N 3.19Å; L124-N126 VanDerWaalsContact C-N 3.3Å; L124-Y127 CarbonylContact O-C 3.51Å
125	V	45	Very low	58.9	Low	82 Å²	82	75 Å²	75	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-68.9	-34.9	171.3	173.3	0	0	0	0	109.5	W26 K121 I123	W26-V125 HydrophobicContact CH2-CG1 4.07Å; W26-V125 WeakPolarHBondContact CH2-O 3.12Å; W26-V125 WeakPolarHBondContact CZ2-O 3.31Å; K121-V125 HydrophobicContact CG-CG2 4.18Å; K121-V125 VanDerWaalsContact O-CB 3.26Å; K121-V125 WeakPolarHBondContact O-CB 3.49Å; K121-V125 WeakPolarHBondContact O-CG2 3.42Å; K121-V125 PolarHBondContact O-N 3.31Å; I123-V125 PolarHBondContact O-N 3.48Å
126	N	43.8	Very low	56.5	Low	19 Å²	19	82.8 Å²	82.8	10%	0.102	46%	0.464	C	S	.	.	H	α-helix	trans	-73.6	-26.3	177.2	-91.3	-73.3	0	0	0	115.7	P24 W26 L122 I123 L124	P24-N126 WeakPolarHBondContact CG-O 3.5Å; W26-N126 HydrophobicContact CH2-CB 4.34Å; W26-N126 WeakPolarHBondContact CH2-OD1 3.28Å; W26-N126 HydrophobicContact CZ2-CB 4.22Å; W26-N126 WeakPolarHBondContact CZ2-O 3.48Å; L122-N126 WeakPolarHBondContact O-CB 3.45Å; L122-N126 PolarHBondContact O-N 2.84Å; L122-N126 PolarHBondContact O-ND2 2.73Å; I123-N126 CarbonylContact O-C 3.56Å; I123-N126 WeakPolarHBondContact O-CA 2.87Å; I123-N126 PolarHBondContact O-N 3.45Å; L124-N126 VanDerWaalsContact C-N 3.3Å
127	Y	38.3	Very low	53.8	Low	115 Å²	115	84.4 Å²	84.4	45%	0.451	47%	0.473	S	S	.	.			trans	-144	93	-177.3	-122.1	-89.4	0	0	0	110.1	P24 I123 L124 G129 Y130	P24-Y127 HydrophobicContact CG-CD2 4.35Å; I123-Y127 PolarHBondContact O-N 2.95Å; L124-Y127 CarbonylContact O-C 3.51Å; Y127-G129 PolarHBondContact O-N 3.1Å; Y127-Y130 AromaticContact CD1-CD2 3.1Å; Y127-Y130 HydrophobicContact CD1-CD2 3.1Å; Y127-Y130 AromaticContact CD1-CE2 3.28Å; Y127-Y130 HydrophobicContact CD1-CE2 3.28Å; Y127-Y130 HydrophobicContact CD1-CG 4.15Å; Y127-Y130 HydrophobicContact CD2-CD2 4.06Å; Y127-Y130 HydrophobicContact CD2-CE2 4.05Å; Y127-Y130 AromaticContact CE1-CD2 3.6Å; Y127-Y130 HydrophobicContact CE1-CD2 3.6Å; Y127-Y130 AromaticContact CE1-CE2 3.2Å; Y127-Y130 HydrophobicContact CE1-CE2 3.2Å; Y127-Y130 HydrophobicContact CE2-CD2 4.46Å; Y127-Y130 AromaticContact CE2-CE2 3.99Å; Y127-Y130 HydrophobicContact CE2-CE2 3.99Å; Y127-Y130 AromaticContact CG-CD2 3.36Å; Y127-Y130 HydrophobicContact CG-CD2 3.36Å; Y127-Y130 AromaticContact CG-CE2 3.71Å; Y127-Y130 HydrophobicContact CG-CE2 3.71Å; Y127-Y130 AromaticContact CZ-CE2 3.57Å; Y127-Y130 PolarHBondContact O-N 3.21Å
128	P	42.2	Very low	51.4	Low	120 Å²	120	90.1 Å²	90.1	78%	0.779	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	14.1	178.4	27.1	-33.3	0	0	0	114.5
129	G	46.5	Very low	49.3	Very low	62 Å²	62	93.3 Å²	93.3	64%	0.639	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	-2.9	179.2	0	0	0	0	0	115.9	Y127 L131	Y127-G129 PolarHBondContact O-N 3.1Å; G129-L131 PolarHBondContact O-N 3.48Å
130	Y	43.6	Very low	47.6	Very low	147 Å²	147	95.6 Å²	95.6	58%	0.576	55%	0.546	S	S	*	.			trans	-90.5	95	169.9	-81.2	-67.5	0	0	0	109	Y127	Y127-Y130 AromaticContact CD1-CD2 3.1Å; Y127-Y130 HydrophobicContact CD1-CD2 3.1Å; Y127-Y130 AromaticContact CD1-CE2 3.28Å; Y127-Y130 HydrophobicContact CD1-CE2 3.28Å; Y127-Y130 HydrophobicContact CD1-CG 4.15Å; Y127-Y130 HydrophobicContact CD2-CD2 4.06Å; Y127-Y130 HydrophobicContact CD2-CE2 4.05Å; Y127-Y130 AromaticContact CE1-CD2 3.6Å; Y127-Y130 HydrophobicContact CE1-CD2 3.6Å; Y127-Y130 AromaticContact CE1-CE2 3.2Å; Y127-Y130 HydrophobicContact CE1-CE2 3.2Å; Y127-Y130 HydrophobicContact CE2-CD2 4.46Å; Y127-Y130 AromaticContact CE2-CE2 3.99Å; Y127-Y130 HydrophobicContact CE2-CE2 3.99Å; Y127-Y130 AromaticContact CG-CD2 3.36Å; Y127-Y130 HydrophobicContact CG-CD2 3.36Å; Y127-Y130 AromaticContact CG-CE2 3.71Å; Y127-Y130 HydrophobicContact CG-CE2 3.71Å; Y127-Y130 AromaticContact CZ-CE2 3.57Å; Y127-Y130 PolarHBondContact O-N 3.21Å
131	L	42.6	Very low	46.4	Very low	156 Å²	156	95.3 Å²	95.3	82%	0.817	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-61	124.4	159.8	-75.6	161.1	0	0	0	107.5	G129	G129-L131 PolarHBondContact O-N 3.48Å
132	P	44.2	Very low	45.5	Very low	94 Å²	94	92.7 Å²	92.7	61%	0.61	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-59.2	136.4	166.5	25.6	-30.9	0	0	0	107.6	S134	P132-S134 PolarHBondContact O-N 3.48Å; P132-S134 VanDerWaalsContact O-N 3.12Å
133	P	41.1	Very low	44.7	Very low	79 Å²	79	96.7 Å²	96.7	51%	0.513	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-52.6	124.7	171	-23.3	34.4	0	0	0	108.3	S135 Q137	P133-S135 PolarHBondContact O-N 3.31Å; P133-S135 VanDerWaalsContact O-N 3.16Å; P133-Q137 HydrophobicContact CB-CG 4.44Å; P133-Q137 VanDerWaalsContact CG-NE2 3.32Å
134	S	38.4	Very low	44.2	Very low	102 Å²	102	97.6 Å²	97.6	71%	0.713	56%	0.557	S	S	*	*	S	Bend	trans	-39.9	117.9	-172.2	-63.9	0	0	0	0	113.1	P132 H136	P132-S134 PolarHBondContact O-N 3.48Å; P132-S134 VanDerWaalsContact O-N 3.12Å; S134-H136 PolarHBondContact O-N 2.83Å
135	S	37	Very low	44.2	Very low	110 Å²	110	97.2 Å²	97.2	77%	0.769	56%	0.559	S	S	*	*	S	Bend	trans	45.6	4.6	146.8	51.2	0	0	0	0	121.7	P133	P133-S135 PolarHBondContact O-N 3.31Å; P133-S135 VanDerWaalsContact O-N 3.16Å
136	H	46.9	Very low	44.6	Very low	175 Å²	175	94.5 Å²	94.5	81%	0.81	54%	0.54	S	S	*	.			trans	-136.9	64.2	175.6	-66.6	-76.2	0	0	0	110.3	S134	S134-H136 PolarHBondContact O-N 2.83Å
137	Q	38.2	Very low	45	Very low	101 Å²	101	99.5 Å²	99.5	47%	0.472	56%	0.561	S	S	.	*			trans	-117.9	117.3	172.8	-70.5	-161.9	-36.8	0	0	111.5	P133 D141	P133-Q137 HydrophobicContact CB-CG 4.44Å; P133-Q137 VanDerWaalsContact CG-NE2 3.32Å; Q137-D141 PolarHBondContact NE2-OD2 3.42Å
138	N	43	Very low	45.7	Very low	123 Å²	123	100.7 Å²	100.7	66%	0.658	57%	0.568	S	S	*	*			trans	-47.6	144.4	168.8	-103.4	-52.8	0	0	0	110.6	S140 D141	N138-S140 PolarHBondContact O-N 3.47Å; N138-D141 PolarHBondContact O-N 3.1Å
139	P	45.7	Very low	46	Very low	102 Å²	102	98.4 Å²	98.4	66%	0.662	55%	0.546	S	S	*	.	H	α-helix	trans	-49.5	-24.1	176.1	-26.9	33.1	0	0	0	114.8	D141 S142 F143	P139-D141 PolarHBondContact O-N 3.06Å; P139-S142 PolarHBondContact O-OG 3.32Å; P139-F143 PolarHBondContact O-N 3.49Å
140	S	44.4	Very low	46.2	Very low	76 Å²	76	98.3 Å²	98.3	53%	0.531	53%	0.529	S	S	.	.	H	α-helix	trans	-64	-29.7	-177.4	-63.9	0	0	0	0	115.9	N138 F143 T144	N138-S140 PolarHBondContact O-N 3.47Å; S140-F143 WeakPolarHBondContact O-CB 3.46Å; S140-F143 PolarHBondContact O-N 3.4Å; S140-T144 PolarHBondContact O-N 2.76Å; S140-T144 PolarHBondContact O-OG1 2.83Å
141	D	48.5	Very low	46.3	Very low	77 Å²	77	97 Å²	97	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-74	-41.8	-176.7	-72.9	-21.8	0	0	0	111.7	Q137 N138 P139 F143 T144 V145	Q137-D141 PolarHBondContact NE2-OD2 3.42Å; N138-D141 PolarHBondContact O-N 3.1Å; P139-D141 PolarHBondContact O-N 3.06Å; D141-F143 PolarHBondContact O-N 3.1Å; D141-T144 PolarHBondContact O-N 2.86Å; D141-T144 VanDerWaalsContact O-N 3.14Å; D141-V145 PolarHBondContact O-N 3.07Å; D141-V145 VanDerWaalsContact O-N 3.08Å
142	S	49.1	Very low	46.5	Very low	43 Å²	43	92.2 Å²	92.2	30%	0.301	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-33	173.1	67.4	0	0	0	0	112.3	W63 P139 F146	W63-S142 PolarHBondContact NE1-O 3.33Å; P139-S142 PolarHBondContact O-OG 3.32Å; S142-F146 WeakPolarHBondContact O-CB 3.23Å; S142-F146 PolarHBondContact O-N 2.71Å; S142-F146 VanDerWaalsContact O-N 3.08Å
143	F	48	Very low	46.5	Very low	96 Å²	96	90 Å²	90	42%	0.421	48%	0.484	S	S	.	.	H	α-helix	trans	-68	-35.8	173.7	-165	-106.9	0	0	0	112.3	P139 S140 D141 F146 K147	P139-F143 PolarHBondContact O-N 3.49Å; S140-F143 WeakPolarHBondContact O-CB 3.46Å; S140-F143 PolarHBondContact O-N 3.4Å; D141-F143 PolarHBondContact O-N 3.1Å; F143-F146 PolarHBondContact O-N 3.21Å; F143-K147 HydrophobicContact CD1-CG 4.45Å; F143-K147 HydrophobicContact CE1-CD 4.23Å; F143-K147 VanDerWaalsContact CE1-CE 3.49Å; F143-K147 HydrophobicContact CE1-CG 4.26Å; F143-K147 PolarHBondContact O-N 3.4Å
144	T	50.9	Low	46.3	Very low	90 Å²	90	90.6 Å²	90.6	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-69.6	-44.3	176.7	-58.8	0	0	0	0	112	S140 D141 F146 K147 K148	S140-T144 PolarHBondContact O-N 2.76Å; S140-T144 PolarHBondContact O-OG1 2.83Å; D141-T144 PolarHBondContact O-N 2.86Å; D141-T144 VanDerWaalsContact O-N 3.14Å; T144-F146 VanDerWaalsContact C-N 3.25Å; T144-F146 PolarHBondContact O-N 3.22Å; T144-K147 PolarHBondContact O-N 3.1Å; T144-K148 WeakPolarHBondContact O-CB 3.48Å; T144-K148 PolarHBondContact O-N 2.99Å
145	V	51.8	Low	46.2	Very low	73 Å²	73	88.8 Å²	88.8	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-59.3	-40.1	173.2	174.2	0	0	0	0	110.6	D141 K148 F149	D141-V145 PolarHBondContact O-N 3.07Å; D141-V145 VanDerWaalsContact O-N 3.08Å; V145-K148 WeakPolarHBondContact O-CB 3.23Å; V145-K148 PolarHBondContact O-N 3.25Å; V145-F149 HydrophobicContact CG1-CD2 4.02Å; V145-F149 HydrophobicContact CG1-CE2 4.22Å; V145-F149 WeakPolarHBondContact O-CD2 3.47Å; V145-F149 PolarHBondContact O-N 3.39Å
146	F	52.6	Low	46.4	Very low	24 Å²	24	85.5 Å²	85.5	11%	0.105	44%	0.443	C	S	.	.	H	α-helix	trans	-69.5	-43.4	177	176.2	-99.1	0	0	0	113.5	W59 W63 F119 S142 F143 T144 K148 F149 Q150	W59-F146 HydrophobicContact CD2-CE2 4.32Å; W59-F146 AromaticContact CD2-CZ 3.88Å; W59-F146 HydrophobicContact CD2-CZ 3.88Å; W59-F146 HydrophobicContact CE3-CE2 4.18Å; W59-F146 AromaticContact CE3-CZ 3.96Å; W59-F146 HydrophobicContact CE3-CZ 3.96Å; W59-F146 HydrophobicContact CG-CZ 4.39Å; W59-F146 AromaticContact CH2-CE2 4Å; W59-F146 HydrophobicContact CH2-CE2 4Å; W59-F146 HydrophobicContact CZ2-CE2 4.1Å; W59-F146 HydrophobicContact CZ2-CZ 4.41Å; W59-F146 HydrophobicContact CZ3-CE2 4.03Å; W59-F146 HydrophobicContact CZ3-CZ 4.29Å; W63-F146 AromaticContact CD1-CD1 4Å; W63-F146 AromaticContact CD1-CG 3.7Å; W63-F146 AromaticContact NE1-CG 3.65Å; F119-F146 AromaticContact CE2-CD2 3.95Å; F119-F146 HydrophobicContact CE2-CD2 3.95Å; F119-F146 HydrophobicContact CE2-CE2 4.05Å; F119-F146 HydrophobicContact CZ-CD2 4.31Å; F119-F146 HydrophobicContact CZ-CE2 4.22Å; S142-F146 WeakPolarHBondContact O-CB 3.23Å; S142-F146 PolarHBondContact O-N 2.71Å; S142-F146 VanDerWaalsContact O-N 3.08Å; F143-F146 PolarHBondContact O-N 3.21Å; T144-F146 VanDerWaalsContact C-N 3.25Å; T144-F146 PolarHBondContact O-N 3.22Å; F146-K148 PolarHBondContact O-N 3.24Å; F146-F149 CarbonylContact O-C 3.45Å; F146-F149 WeakPolarHBondContact O-CB 3.36Å; F146-F149 PolarHBondContact O-N 3.36Å; F146-F149 VanDerWaalsContact O-N 3.1Å; F146-Q150 HydrophobicContact CD1-CG 4.3Å; F146-Q150 HydrophobicContact CE1-CG 3.88Å; F146-Q150 HydrophobicContact CE2-CG 4.23Å; F146-Q150 VanDerWaalsContact CZ-CD 3.4Å; F146-Q150 HydrophobicContact CZ-CG 3.84Å; F146-Q150 PolarHBondContact O-N 3.28Å
147	K	52	Low	46.2	Very low	124 Å²	124	79.2 Å²	79.2	54%	0.539	42%	0.417	S	S	.	.	H	α-helix	trans	-60.1	-36.1	171.6	-82.1	-150.5	177	177.8	0	111.3	F143 T144 K151	F143-K147 HydrophobicContact CD1-CG 4.45Å; F143-K147 HydrophobicContact CE1-CD 4.23Å; F143-K147 VanDerWaalsContact CE1-CE 3.49Å; F143-K147 HydrophobicContact CE1-CG 4.26Å; F143-K147 PolarHBondContact O-N 3.4Å; T144-K147 PolarHBondContact O-N 3.1Å; K147-K151 WeakPolarHBondContact O-CB 3.21Å; K147-K151 PolarHBondContact O-N 3.06Å
148	K	52.4	Low	45.9	Very low	140 Å²	140	77.5 Å²	77.5	61%	0.609	41%	0.413	S	S	*	.	H	α-helix	trans	-66	-41	173.3	-167	169.8	-175.5	174.3	0	111.8	T144 V145 F146 K151 L152	T144-K148 WeakPolarHBondContact O-CB 3.48Å; T144-K148 PolarHBondContact O-N 2.99Å; V145-K148 WeakPolarHBondContact O-CB 3.23Å; V145-K148 PolarHBondContact O-N 3.25Å; F146-K148 PolarHBondContact O-N 3.24Å; K148-K151 PolarHBondContact O-N 2.8Å; K148-L152 HydrophobicContact CG-CD1 3.99Å; K148-L152 WeakPolarHBondContact O-CB 3.34Å; K148-L152 WeakPolarHBondContact O-CD1 3.17Å; K148-L152 WeakPolarHBondContact O-CG 3.48Å; K148-L152 PolarHBondContact O-N 3.14Å
149	F	49.6	Very low	45.4	Very low	73 Å²	73	79.6 Å²	79.6	32%	0.32	42%	0.416	S	S	.	.	H	α-helix	trans	-63	-47.9	172.8	-101.6	-84.3	0	0	0	112.6	L22 F23 V145 F146 L152 N153	L22-F149 HydrophobicContact CB-CD1 4.14Å; L22-F149 HydrophobicContact CB-CE1 3.37Å; L22-F149 HydrophobicContact CB-CE2 4.22Å; L22-F149 HydrophobicContact CB-CZ 3.42Å; L22-F149 VanDerWaalsContact CB-CZ 3.42Å; L22-F149 HydrophobicContact CD1-CB 4.41Å; L22-F149 HydrophobicContact CD1-CD1 3.55Å; L22-F149 HydrophobicContact CD1-CD2 3.52Å; L22-F149 HydrophobicContact CD1-CE1 3.56Å; L22-F149 HydrophobicContact CD1-CE2 3.54Å; L22-F149 HydrophobicContact CD1-CG 3.54Å; L22-F149 HydrophobicContact CD1-CZ 3.55Å; L22-F149 HydrophobicContact CG-CD1 4.47Å; L22-F149 HydrophobicContact CG-CE1 4.12Å; L22-F149 HydrophobicContact CG-CE2 4.47Å; L22-F149 HydrophobicContact CG-CZ 4.11Å; F23-F149 HydrophobicContact CE1-CE1 4.18Å; F23-F149 AromaticContact CZ-CE1 3.89Å; F23-F149 HydrophobicContact CZ-CE1 3.89Å; V145-F149 HydrophobicContact CG1-CD2 4.02Å; V145-F149 HydrophobicContact CG1-CE2 4.22Å; V145-F149 WeakPolarHBondContact O-CD2 3.47Å; V145-F149 PolarHBondContact O-N 3.39Å; F146-F149 CarbonylContact O-C 3.45Å; F146-F149 WeakPolarHBondContact O-CB 3.36Å; F146-F149 PolarHBondContact O-N 3.36Å; F146-F149 VanDerWaalsContact O-N 3.1Å; F149-L152 PolarHBondContact O-N 3.36Å; F149-N153 WeakPolarHBondContact O-CB 3.49Å; F149-N153 PolarHBondContact O-N 3.42Å
150	Q	50.4	Low	44.7	Very low	59 Å²	59	79.1 Å²	79.1	28%	0.276	42%	0.415	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.7	-74.8	-174.7	-49.8	0	0	111.5	F146 N153 N154	F146-Q150 HydrophobicContact CD1-CG 4.3Å; F146-Q150 HydrophobicContact CE1-CG 3.88Å; F146-Q150 HydrophobicContact CE2-CG 4.23Å; F146-Q150 VanDerWaalsContact CZ-CD 3.4Å; F146-Q150 HydrophobicContact CZ-CG 3.84Å; F146-Q150 PolarHBondContact O-N 3.28Å; Q150-N153 PolarHBondContact O-N 3.28Å; Q150-N154 WeakPolarHBondContact O-CB 3.39Å; Q150-N154 PolarHBondContact O-N 3.27Å; Q150-N154 PolarHBondContact O-ND2 3.44Å
151	K	45.6	Very low	44.2	Very low	120 Å²	120	81.7 Å²	81.7	52%	0.522	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-45.6	177.6	-174.8	62.1	178	146.9	0	111.4	K147 K148 N153 N154 D155	K147-K151 WeakPolarHBondContact O-CB 3.21Å; K147-K151 PolarHBondContact O-N 3.06Å; K148-K151 PolarHBondContact O-N 2.8Å; K151-N153 VanDerWaalsContact C-N 3.34Å; K151-N153 PolarHBondContact O-N 2.97Å; K151-N154 PolarHBondContact O-N 3.26Å; K151-D155 WeakPolarHBondContact CD-OD2 3.38Å; K151-D155 WeakPolarHBondContact CE-OD2 3.46Å; K151-D155 WeakPolarHBondContact CG-OD2 3.3Å; K151-D155 IonicContact NZ-OD1 2.85Å; K151-D155 PolarHBondContact NZ-OD1 3.47Å; K151-D155 IonicContact NZ-OD2 3.35Å; K151-D155 PolarHBondContact NZ-OD2 3.36Å; K151-D155 VanDerWaalsContact O-CB 3.24Å; K151-D155 WeakPolarHBondContact O-CB 3.27Å; K151-D155 PolarHBondContact O-N 3.09Å
152	L	46.1	Very low	43.4	Very low	56 Å²	56	85 Å²	85	29%	0.293	43%	0.431	S	S	.	.	H	α-helix	trans	-67.7	-31.4	176.8	-71.8	166.5	0	0	0	113.3	L22 K148 F149 S156	L22-L152 HydrophobicContact CD1-CD1 3.42Å; L22-L152 VanDerWaalsContact CD1-CD1 3.42Å; L22-L152 HydrophobicContact CD2-CD1 4.14Å; L22-L152 HydrophobicContact CG-CD1 3.74Å; K148-L152 HydrophobicContact CG-CD1 3.99Å; K148-L152 WeakPolarHBondContact O-CB 3.34Å; K148-L152 WeakPolarHBondContact O-CD1 3.17Å; K148-L152 WeakPolarHBondContact O-CG 3.48Å; K148-L152 PolarHBondContact O-N 3.14Å; F149-L152 PolarHBondContact O-N 3.36Å; L152-S156 WeakPolarHBondContact O-CB 3.48Å; L152-S156 PolarHBondContact O-N 3.26Å; L152-S156 VanDerWaalsContact O-N 3.09Å; L152-S156 PolarHBondContact O-OG 3.33Å
153	N	43.8	Very low	42.8	Very low	47 Å²	47	89.5 Å²	89.5	25%	0.251	46%	0.456	S	S	.	.	H	α-helix	trans	-71.6	-45.2	174.3	-147.3	-2.2	0	0	0	111.2	G50 F149 Q150 K151 D155 S156 V157	G50-N153 WeakPolarHBondContact CA-ND2 3.47Å; F149-N153 WeakPolarHBondContact O-CB 3.49Å; F149-N153 PolarHBondContact O-N 3.42Å; Q150-N153 PolarHBondContact O-N 3.28Å; K151-N153 VanDerWaalsContact C-N 3.34Å; K151-N153 PolarHBondContact O-N 2.97Å; N153-D155 PolarHBondContact O-N 3.47Å; N153-S156 PolarHBondContact O-N 3.16Å; N153-V157 WeakPolarHBondContact O-CG2 3.27Å; N153-V157 PolarHBondContact O-N 3Å
154	N	37.6	Very low	42	Very low	91 Å²	91	88.8 Å²	88.8	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-66.2	-36.4	176.8	-67.2	-15.3	0	0	0	112.5	Q150 K151 V157 T158	Q150-N154 WeakPolarHBondContact O-CB 3.39Å; Q150-N154 PolarHBondContact O-N 3.27Å; Q150-N154 PolarHBondContact O-ND2 3.44Å; K151-N154 PolarHBondContact O-N 3.26Å; N154-V157 PolarHBondContact O-N 3.24Å; N154-T158 PolarHBondContact O-N 3.48Å; N154-T158 PolarHBondContact O-OG1 3.41Å
155	D	37.5	Very low	41.1	Very low	64 Å²	64	95.3 Å²	95.3	34%	0.342	48%	0.478	S	S	.	.	H	α-helix	trans	-76.7	-21.8	178.1	-64.1	-20.5	0	0	0	112.1	K151 N153 T158	K151-D155 WeakPolarHBondContact CD-OD2 3.38Å; K151-D155 WeakPolarHBondContact CE-OD2 3.46Å; K151-D155 WeakPolarHBondContact CG-OD2 3.3Å; K151-D155 IonicContact NZ-OD1 2.85Å; K151-D155 PolarHBondContact NZ-OD1 3.47Å; K151-D155 IonicContact NZ-OD2 3.35Å; K151-D155 PolarHBondContact NZ-OD2 3.36Å; K151-D155 VanDerWaalsContact O-CB 3.24Å; K151-D155 WeakPolarHBondContact O-CB 3.27Å; K151-D155 PolarHBondContact O-N 3.09Å; N153-D155 PolarHBondContact O-N 3.47Å; D155-T158 WeakPolarHBondContact CA-OG1 3.43Å; D155-T158 PolarHBondContact O-OG1 3.13Å
156	S	40.3	Very low	40.3	Very low	42 Å²	42	98.8 Å²	98.8	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-72.3	-33.7	168.3	-84.6	0	0	0	0	112.4	A20 L152 N153	A20-S156 PolarHBondContact O-OG 2.88Å; L152-S156 WeakPolarHBondContact O-CB 3.48Å; L152-S156 PolarHBondContact O-N 3.26Å; L152-S156 VanDerWaalsContact O-N 3.09Å; L152-S156 PolarHBondContact O-OG 3.33Å; N153-S156 PolarHBondContact O-N 3.16Å
157	V	43.4	Very low	39.5	Very low	43 Å²	43	106.9 Å²	106.9	26%	0.261	53%	0.532	S	S	.	.	H	α-helix	trans	-72.8	-33.4	177.6	174.1	0	0	0	0	110.9	N153 N154 K159 S160 Y161	N153-V157 WeakPolarHBondContact O-CG2 3.27Å; N153-V157 PolarHBondContact O-N 3Å; N154-V157 PolarHBondContact O-N 3.24Å; V157-K159 VanDerWaalsContact C-N 3.26Å; V157-K159 PolarHBondContact O-N 3.45Å; V157-S160 PolarHBondContact O-N 2.68Å; V157-S160 PolarHBondContact O-OG 3.14Å; V157-Y161 HydrophobicContact CG1-CE1 3.59Å; V157-Y161 WeakPolarHBondContact O-CD1 3.3Å; V157-Y161 WeakPolarHBondContact O-CE1 3.14Å
158	T	31.6	Very low	38.7	Very low	64 Å²	64	106.4 Å²	106.4	39%	0.393	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-17	176.7	31.5	0	0	0	0	115.8	N154 D155 Y161	N154-T158 PolarHBondContact O-N 3.48Å; N154-T158 PolarHBondContact O-OG1 3.41Å; D155-T158 WeakPolarHBondContact CA-OG1 3.43Å; D155-T158 PolarHBondContact O-OG1 3.13Å; T158-Y161 VanDerWaalsContact CA-CE2 3.44Å; T158-Y161 VanDerWaalsContact CA-OH 3.31Å; T158-Y161 WeakPolarHBondContact CA-OH 3.16Å; T158-Y161 HydrophobicContact CG2-CE2 3.77Å; T158-Y161 WeakPolarHBondContact CG2-OH 3.16Å; T158-Y161 PolarHBondContact N-OH 3.4Å
159	K	32	Very low	38.2	Very low	168 Å²	168	106.8 Å²	106.8	73%	0.73	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.4	174.7	-75.1	-175.1	177.6	-179.9	0	114.2	V157	V157-K159 VanDerWaalsContact C-N 3.26Å; V157-K159 PolarHBondContact O-N 3.45Å
160	S	31.9	Very low	37.4	Very low	91 Å²	91	109.1 Å²	109.1	64%	0.636	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-17.3	-179	66.1	0	0	0	0	114.1	V157	V157-S160 PolarHBondContact O-N 2.68Å; V157-S160 PolarHBondContact O-OG 3.14Å
161	Y	32.5	Very low	37.3	Very low	130 Å²	130	113.7 Å²	113.7	51%	0.51	59%	0.593	S	S	.	*	S	Bend	trans	-107.2	-0.8	177.5	32.1	-101.9	0	0	0	115.8	V157 T158	V157-Y161 HydrophobicContact CG1-CE1 3.59Å; V157-Y161 WeakPolarHBondContact O-CD1 3.3Å; V157-Y161 WeakPolarHBondContact O-CE1 3.14Å; T158-Y161 VanDerWaalsContact CA-CE2 3.44Å; T158-Y161 VanDerWaalsContact CA-OH 3.31Å; T158-Y161 WeakPolarHBondContact CA-OH 3.16Å; T158-Y161 HydrophobicContact CG2-CE2 3.77Å; T158-Y161 WeakPolarHBondContact CG2-OH 3.16Å; T158-Y161 PolarHBondContact N-OH 3.4Å
162	L	33.1	Very low	36.7	Very low	147 Å²	147	113.9 Å²	113.9	77%	0.77	60%	0.604	S	S	*	*	S	Bend	trans	-111.5	15.5	172.8	-68.5	-177.6	0	0	0	114.3	S164	L162-S164 VanDerWaalsContact C-N 3.27Å; L162-S164 PolarHBondContact O-N 3.02Å
163	V	35.7	Very low	36.6	Very low	137 Å²	137	120.6 Å²	120.6	83%	0.83	63%	0.631	S	S	*	*			trans	-98.1	64.4	158.6	-176	0	0	0	0	107.7
164	S	31.2	Very low	36.3	Very low	81 Å²	81	126 Å²	126	57%	0.566	66%	0.66	S	S	*	*			trans	-116.1	117.1	168.6	-154.2	0	0	0	0	106	L162	L162-S164 VanDerWaalsContact C-N 3.27Å; L162-S164 PolarHBondContact O-N 3.02Å
165	W	32.8	Very low	37	Very low	227 Å²	227	129 Å²	129	86%	0.86	67%	0.674	S	S	*	*	S	Bend	trans	64.5	98.3	169.3	-56.3	83.8	0	0	0	116.7
166	N	34.8	Very low	37.1	Very low	147 Å²	147	131.7 Å²	131.7	79%	0.786	70%	0.696	S	S	*	*				174.9	104.9	127.2	-83.8	-29	0	0	0	106.3
167	H	35.9	Very low	37.6	Very low	193 Å²	193	139 Å²	139	89%	0.894	72%	0.722	S	S	*	*	S	Bend	trans	179.9	149.9	144.4	-86.5	107.4	0	0	0	108.9
168	P	34.9	Very low	37.7	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	75%	0.749	S	S	*	*			trans	-81.5	150.5	-154.1	31.8	-34.5	0	0	0	114
169	L	40.8	Very low	39.1	Very low	149 Å²	149	147.4 Å²	147.4	78%	0.78	77%	0.77	S	S	*	*			trans	-42.5	131.1	173.2	-72.1	151.3	0	0	0	113.5
170	P	33.9	Very low	39.9	Very low	121 Å²	121	145.1 Å²	145.1	79%	0.786	77%	0.772	S	S	*	*			trans	-92.3	104.1	148	31.2	-23	0	0	0	108.6	T172	P170-T172 PolarHBondContact O-N 3.19Å
171	H	47.6	Very low	41.4	Very low	156 Å²	156	147 Å²	147	72%	0.722	78%	0.779	S	S	*	*			trans	-64.6	119.8	159.2	-98.1	-81.2	0	0	0	109
172	T	32.8	Very low	42.2	Very low	124 Å²	124	146.4 Å²	146.4	76%	0.761	79%	0.791	S	S	*	*			trans	-172.9	95.4	136.8	12.3	0	0	0	0	109.2	P170 L174	P170-T172 PolarHBondContact O-N 3.19Å; T172-L174 PolarHBondContact O-N 3.4Å
173	F	45.5	Very low	43.7	Very low	196 Å²	196	147.8 Å²	147.8	86%	0.86	79%	0.794	S	S	*	*			trans	-70	116.9	157.9	-84.9	-94.1	0	0	0	108
174	L	36.4	Very low	44.5	Very low	162 Å²	162	146.5 Å²	146.5	85%	0.848	79%	0.788	S	S	*	*			trans	-126.9	115	157.1	-74.3	178.2	0	0	0	108.6	T172	T172-L174 PolarHBondContact O-N 3.4Å
175	L	51.8	Low	45.3	Very low	152 Å²	152	151.1 Å²	151.1	80%	0.796	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-48.2	149.6	171.5	-105.7	71.4	0	0	0	112.3	K177	L175-K177 PolarHBondContact O-N 3.14Å
176	P	40.7	Very low	46.4	Very low	122 Å²	122	149.1 Å²	149.1	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.2	130.1	163.7	-2	18.1	0	0	0	109.7
177	K	50.9	Low	47.6	Very low	194 Å²	194	144.7 Å²	144.7	84%	0.843	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62.3	145.2	170.5	-86.3	171.4	173.7	161.4	0	110.8	L175	L175-K177 PolarHBondContact O-N 3.14Å
178	P	44.9	Very low	48.9	Very low	126 Å²	126	141.9 Å²	141.9	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.7	137.2	172.8	-15.8	28.5	0	0	0	111.4
179	L	61.7	Low	50	Low	159 Å²	159	143.8 Å²	143.8	83%	0.832	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-67.6	147.4	171	-71.6	165.4	0	0	0	110.7
180	P	47.5	Very low	50.4	Low	120 Å²	120	141.9 Å²	141.9	78%	0.779	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.4	138.2	175	28.2	-31.4	0	0	0	111.5
181	V	64.2	Low	51.4	Low	130 Å²	130	145.8 Å²	145.8	79%	0.788	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.4	133.2	176.4	-177.9	0	0	0	0	109.9
182	P	50.3	Low	51.7	Low	117 Å²	117	145.6 Å²	145.6	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.1	130.2	174.5	26.6	-30.1	0	0	0	111.1
183	Q	63.5	Low	52.2	Low	177 Å²	177	144.8 Å²	144.8	83%	0.827	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.4	146.6	174.7	-59.5	-170.1	3.1	0	0	110.9	L185	Q183-L185 PolarHBondContact O-N 2.88Å
184	P	52.2	Low	52.3	Low	110 Å²	110	140.3 Å²	140.3	71%	0.714	80%	0.796	S	S	*	*			trans	-72.5	115.5	174.4	-7.7	23.6	0	0	0	110.5	H186	P184-H186 PolarHBondContact O-N 3.27Å; P184-H186 VanDerWaalsContact O-N 3.09Å
185	L	48.9	Very low	52.6	Low	178 Å²	178	139.3 Å²	139.3	93%	0.932	80%	0.796	S	S	*	*			trans	-71.9	97	165.1	-94.7	140.4	0	0	0	108.6	Q183 G187	Q183-L185 PolarHBondContact O-N 2.88Å; L185-G187 PolarHBondContact O-N 2.96Å; L185-G187 VanDerWaalsContact O-N 3.17Å
186	H	55.2	Low	52.2	Low	185 Å²	185	136.1 Å²	136.1	86%	0.856	79%	0.792	S	S	*	*			trans	-67.3	105.2	164.1	-78.2	-95.3	0	0	0	108.8	P184	P184-H186 PolarHBondContact O-N 3.27Å; P184-H186 VanDerWaalsContact O-N 3.09Å
187	G	61.3	Low	52.5	Low	54 Å²	54	141.8 Å²	141.8	56%	0.557	80%	0.798	S	S	*	*			trans	-140.1	136.9	168.3	0	0	0	0	0	109.4	L185 I189	L185-G187 PolarHBondContact O-N 2.96Å; L185-G187 VanDerWaalsContact O-N 3.17Å; G187-I189 PolarHBondContact O-N 3.15Å
188	P	62.3	Low	52	Low	133 Å²	133	138.4 Å²	138.4	86%	0.864	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62.8	129.5	177.2	-18	29.8	0	0	0	111.1
189	I	57.7	Low	51.5	Low	155 Å²	155	141.5 Å²	141.5	80%	0.795	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.6	123.7	171.4	-58.6	172.3	0	0	0	107.7	G187 F191	G187-I189 PolarHBondContact O-N 3.15Å; I189-F191 PolarHBondContact O-N 2.87Å
190	P	50	Low	50.5	Low	109 Å²	109	140.7 Å²	140.7	71%	0.708	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.1	122.6	170.4	26.6	-30.5	0	0	0	109.4	I192	P190-I192 PolarHBondContact O-N 3.07Å
191	F	54.1	Low	49.9	Very low	202 Å²	202	138 Å²	138	89%	0.886	79%	0.794	S	S	*	*			trans	-62.1	114.9	172.4	-120.1	-99.8	0	0	0	109.1	I189 P193	I189-F191 PolarHBondContact O-N 2.87Å; F191-P193 WeakPolarHBondContact O-CD 3.44Å
192	I	53.3	Low	48.3	Very low	153 Å²	153	141.5 Å²	141.5	79%	0.785	80%	0.802	S	S	*	*			trans	-89.6	115.4	167.9	-56.9	175.4	0	0	0	106.7	P190 A194	P190-I192 PolarHBondContact O-N 3.07Å; I192-A194 PolarHBondContact O-N 3.13Å
193	P	44.7	Very low	47.5	Very low	106 Å²	106	147.2 Å²	147.2	69%	0.688	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.4	129.7	172.8	28.3	-31.4	0	0	0	109.8	F191 V195	F191-P193 WeakPolarHBondContact O-CD 3.44Å; P193-V195 PolarHBondContact O-N 3.31Å
194	A	46.1	Very low	45.9	Very low	102 Å²	102	147.2 Å²	147.2	84%	0.843	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.5	119.6	173.8	0	0	0	0	0	109.9	I192 A196	I192-A194 PolarHBondContact O-N 3.13Å; A194-A196 PolarHBondContact O-N 3.09Å
195	V	44.5	Very low	45.4	Very low	142 Å²	142	146.1 Å²	146.1	86%	0.861	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.9	126.9	171.2	168.2	0	0	0	0	109.1	P193	P193-V195 PolarHBondContact O-N 3.31Å
196	A	41.8	Very low	44.5	Very low	85 Å²	85	148.2 Å²	148.2	70%	0.702	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-62.3	138.6	-177.6	0	0	0	0	0	112.7	A194	A194-A196 PolarHBondContact O-N 3.09Å
197	R	47.3	Very low	43.3	Very low	241 Å²	241	146.9 Å²	146.9	91%	0.909	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-78.2	127.1	165.6	-175.2	-174.4	-161.2	-173.6	4.9	108.8
198	P	41	Very low	42	Very low	122 Å²	122	149.7 Å²	149.7	79%	0.792	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-88.2	143.8	165.6	-7.9	26.6	0	0	0	111.8
199	E	34.5	Very low	40.5	Very low	192 Å²	192	147.1 Å²	147.1	90%	0.897	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-79.1	172.8	-174.3	-152.4	178.9	117.9	0	0	113.2
200	V	40.6	Very low	39.6	Very low	142 Å²	142	148.5 Å²	148.5	86%	0.861	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.8	152.5	-171.7	158	0	0	0	0	114.5
201	G	35	Very low	39.1	Very low	63 Å²	63	150.3 Å²	150.3	65%	0.649	81%	0.811	S	S	*	*			trans	139.7	141.5	155.4	0	0	0	0	0	112.3
202	Q	31.1	Very low	38.2	Very low	203 Å²	203	144.2 Å²	144.2	95%	0.949	80%	0.798	S	S	*	*			cis	-155.7	-177.2	6.7	-74.6	-156.8	-6.9	0	0	109.7
203	R	31.6	Very low	37.9	Very low	237 Å²	237	144.5 Å²	144.5	89%	0.894	80%	0.801	S	S	*	*			trans	-80.8	151.4	-163.9	-62.4	173.4	-172.5	153.4	2.7	117.8
204	E	30.3	Very low	37.2	Very low	177 Å²	177	142.7 Å²	142.7	83%	0.827	80%	0.802	S	S	*	*			trans	64	162.4	138.1	-80.3	-125.9	122.1	0	0	123.1
205	P	42.1	Very low	36.6	Very low	88 Å²	88	150.3 Å²	150.3	57%	0.571	81%	0.809	S	S	*	*			cis	-139.8	-177.9	-37.4	36.7	-17.2	0	0	0	116.1
206	R	30.1	Very low	35.8	Very low	222 Å²	222	151.6 Å²	151.6	84%	0.838	81%	0.811	S	S	*	*			trans	85.5	143.4	167.5	-59.8	-174.4	177	160.1	-0.6	116.1
207	E	29.4	Very low	35.5	Very low	156 Å²	156	156 Å²	156	73%	0.729	82%	0.817	S	S	*	*			cis	-161.2	154.1	13.4	-129.2	165.6	-147.3	0	0	110.4
208	S	35.1	Very low	34.7	Very low	114 Å²	114	155 Å²	155	80%	0.797	81%	0.813	S	S	*	*			trans	20.7	121	156.5	55.6	0	0	0	0	121.7
209	G	31.1	Very low	34.1	Very low	79 Å²	79	154 Å²	154	81%	0.814	81%	0.808	S	S	*	*			trans	-158.5	126.1	160.7	0	0	0	0	0	111.3
210	L	38.1	Very low	34.2	Very low	183 Å²	183	150.2 Å²	150.2	96%	0.958	80%	0.803	S	S	*	*			trans	-72.7	158.1	-167.3	-71.7	154.7	0	0	0	114.8
211	N	38.4	Very low	34.1	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	79%	0.794	S	S	*	*			trans	-37.9	139.6	170.6	176.2	29.2	0	0	0	117	N213	N211-N213 PolarHBondContact OD1-N 3.3Å
212	A	36.6	Very low	33.7	Very low	74 Å²	74	150.7 Å²	150.7	61%	0.612	80%	0.797	S	S	*	*				-165.8	115.3	124.6	0	0	0	0	0	110.1
213	N	47.3	Very low	34	Very low	159 Å²	159	153.4 Å²	153.4	85%	0.85	80%	0.799	S	S	*	*			trans	87.9	80.3	160.3	-38.3	-36.7	0	0	0	116.1	N211	N211-N213 PolarHBondContact OD1-N 3.3Å
214	G	28.5	Very low	34	Very low	69 Å²	69	148.7 Å²	148.7	71%	0.711	79%	0.791	S	S	*	*			trans	-160.8	101.4	173.9	0	0	0	0	0	113
215	W	33.3	Very low	34.2	Very low	261 Å²	261	145.9 Å²	145.9	99%	0.989	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.6	142.9	168.8	-77	61.8	0	0	0	111
216	L	29.3	Very low	33.9	Very low	170 Å²	170	148.5 Å²	148.5	89%	0.89	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.4	127.8	178.6	-95	149.7	0	0	0	111.9
217	H	35.3	Very low	34.7	Very low	178 Å²	178	142.2 Å²	142.2	82%	0.824	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.4	124.9	157.7	-138.3	-98.2	0	0	0	108.2
218	R	30.9	Very low	34.9	Very low	220 Å²	220	143.6 Å²	143.6	83%	0.83	79%	0.79	S	S	*	*			trans	-136.1	117	157.8	-169.7	174	-95.8	-123	1	109.3
219	S	27.6	Very low	34.9	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	79%	0.79	S	S	*	*			trans	-95.4	145.9	168.2	-164.7	0	0	0	0	109.2
220	S	36.7	Very low	34.8	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	78%	0.783	S	S	*	*	S	Bend	trans	51.2	130.2	149.7	-156	0	0	0	0	120.9
221	A	37.8	Very low	34.5	Very low	81 Å²	81	148.9 Å²	148.9	67%	0.669	78%	0.78	S	S	*	*			trans	79.8	88.5	173	0	0	0	0	0	115.4
222	D	27.1	Very low	33.9	Very low	133 Å²	133	148.5 Å²	148.5	71%	0.711	78%	0.778	S	S	*	*			trans	-169	92.6	144.7	-90	-27.2	0	0	0	107.1
223	W	36.9	Very low	33.7	Very low	260 Å²	260	153 Å²	153	99%	0.985	79%	0.791	S	S	*	*			trans	-96.4	70.5	164.2	-73.4	100.1	0	0	0	108.3
224	D	31.7	Very low	33.3	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	77%	0.774	S	S	*	*			trans	-99.9	106.9	160.6	-89	-33.2	0	0	0	109.1
225	V	35.9	Very low	33.6	Very low	119 Å²	119	153.2 Å²	153.2	72%	0.721	78%	0.781	S	S	*	*				25.7	116.8	126.4	-173.6	0	0	0	0	114.9
226	N	34.8	Very low	33.4	Very low	143 Å²	143	151.7 Å²	151.7	77%	0.765	78%	0.777	S	S	*	*				-178.7	177.5	108	-129.5	-1	0	0	0	113.3
227	P	46.9	Very low	33.7	Very low	90 Å²	90	152.8 Å²	152.8	58%	0.584	77%	0.774	S	S	*	*				-128.9	122.2	-115.3	40.2	-19.8	0	0	0	112.2
228	H	32.6	Very low	33.5	Very low	185 Å²	185	155.4 Å²	155.4	86%	0.856	78%	0.779	S	S	*	*			trans	-153.3	90.9	166.1	-111.1	-85.3	0	0	0	110.2
229	I	36.5	Very low	33.7	Very low	156 Å²	156	153.1 Å²	153.1	80%	0.8	78%	0.782	S	S	*	*			trans	-156.4	96	132.7	-84.1	136	0	0	0	104.2	W231	I229-W231 PolarHBondContact O-N 3.17Å
230	S	29.4	Very low	33.9	Very low	97 Å²	97	155.4 Å²	155.4	68%	0.678	79%	0.787	S	S	*	*			trans	-58.8	120	168.4	175.5	0	0	0	0	108.4	N232	S230-N232 PolarHBondContact O-N 3.28Å; S230-N232 VanDerWaalsContact O-N 3.13Å
231	W	31.1	Very low	33.7	Very low	233 Å²	233	156 Å²	156	88%	0.883	79%	0.785	S	S	*	*			trans	-66.9	104.5	158.6	-71.9	94	0	0	0	106.6	I229 L233	I229-W231 PolarHBondContact O-N 3.17Å; W231-L233 VanDerWaalsContact C-N 3.25Å; W231-L233 PolarHBondContact O-N 3.4Å
232	N	25.6	Very low	33.5	Very low	139 Å²	139	159.2 Å²	159.2	74%	0.743	79%	0.791	S	S	*	*			trans	-68.7	93	169	-125.1	-25.5	0	0	0	107.5	S230 S234	S230-N232 PolarHBondContact O-N 3.28Å; S230-N232 VanDerWaalsContact O-N 3.13Å; N232-S234 PolarHBondContact O-N 3.25Å; N232-S234 VanDerWaalsContact O-N 3.15Å
233	L	32.8	Very low	34.3	Very low	169 Å²	169	159.5 Å²	159.5	89%	0.885	79%	0.793	S	S	*	*			trans	-83.3	66.9	169.4	-164.2	76.5	0	0	0	107.8	W231	W231-L233 VanDerWaalsContact C-N 3.25Å; W231-L233 PolarHBondContact O-N 3.4Å
234	S	38.3	Very low	34.6	Very low	72 Å²	72	155.6 Å²	155.6	50%	0.503	78%	0.782	S	S	.	*			trans	-137.5	84.2	171.9	58.1	0	0	0	0	107.2	N232	N232-S234 PolarHBondContact O-N 3.25Å; N232-S234 VanDerWaalsContact O-N 3.15Å
235	D	33.9	Very low	34.8	Very low	160 Å²	160	156.6 Å²	156.6	86%	0.856	79%	0.788	S	S	*	*	S	Bend	trans	-170.5	22.7	151.4	-89.9	-18.5	0	0	0	113.2
236	Y	31	Very low	35.2	Very low	230 Å²	230	158.2 Å²	158.2	90%	0.902	79%	0.792	S	S	*	*			trans	-114	77.7	160.3	-75.1	-78.2	0	0	0	109.5
237	K	35	Very low	35.3	Very low	192 Å²	192	160.2 Å²	160.2	84%	0.835	80%	0.797	S	S	*	*			trans	-127.7	90.5	161.2	-85.8	-171.3	178.1	-178.5	0	108.7
238	Y	31.2	Very low	34.8	Very low	233 Å²	233	165.4 Å²	165.4	91%	0.914	81%	0.811	S	S	*	*			trans	-146.3	86.1	144.3	-79.3	-71.2	0	0	0	107.6
239	L	35.4	Very low	34.9	Very low	172 Å²	172	164.9 Å²	164.9	90%	0.901	81%	0.808	S	S	*	*			trans	-133.2	112.3	153.8	-77	176.7	0	0	0	107.2
240	N	32.2	Very low	34.7	Very low	148 Å²	148	164.9 Å²	164.9	79%	0.791	81%	0.808	S	S	*	*			trans	-66.8	122.9	170.4	-172.3	26.5	0	0	0	107.9	N242	N240-N242 PolarHBondContact O-N 3.48Å
241	V	32	Very low	35	Very low	125 Å²	125	167 Å²	167	76%	0.758	81%	0.81	S	S	*	*			trans	-79.2	108.3	169.7	173.9	0	0	0	0	106.3
242	N	32.1	Very low	35.1	Very low	150 Å²	150	164.4 Å²	164.4	80%	0.802	81%	0.806	S	S	*	*			trans	-107.2	115.4	156.5	-134.2	12.3	0	0	0	107	N240 K244	N240-N242 PolarHBondContact O-N 3.48Å; N242-K244 PolarHBondContact O-N 3.33Å
243	D	44.6	Very low	35.6	Very low	139 Å²	139	164 Å²	164	74%	0.743	81%	0.811	S	S	*	*			trans	-70.4	109.5	-179.3	-154.1	-12.5	0	0	0	108.5
244	K	43.1	Very low	35.4	Very low	178 Å²	178	163.3 Å²	163.3	77%	0.774	81%	0.808	S	S	*	*			trans	165.6	125.7	144.9	-87.8	156.9	-167.4	-174.6	0	111.2	N242	N242-K244 PolarHBondContact O-N 3.33Å
245	N	36.1	Very low	35.3	Very low	159 Å²	159	164.3 Å²	164.3	85%	0.85	81%	0.811	S	S	*	*			trans	92.8	107.3	162.1	-51.9	-17.2	0	0	0	116.2	E247	N245-E247 PolarHBondContact O-N 3.43Å
246	N	45.2	Very low	35.2	Very low	152 Å²	152	166.1 Å²	166.1	81%	0.813	81%	0.807	S	S	*	*			trans	-82.5	87.1	-176.2	178.5	37.4	0	0	0	111.6
247	E	35.3	Very low	35.3	Very low	185 Å²	185	162.2 Å²	162.2	86%	0.864	80%	0.801	S	S	*	*			trans	-138.6	132	164.6	-69	-171.3	162.2	0	0	110.9	N245	N245-E247 PolarHBondContact O-N 3.43Å
248	K	37	Very low	35.2	Very low	200 Å²	200	158.6 Å²	158.6	87%	0.87	80%	0.795	S	S	*	*			trans	-100.8	106.2	-178.9	-65.5	177.5	-177.6	173.9	0	109
249	E	34.4	Very low	35.2	Very low	174 Å²	174	154.6 Å²	154.6	81%	0.813	79%	0.789	S	S	*	*			trans	-110.5	133.5	166.1	-86.4	-164.2	143.5	0	0	112.1
250	I	33.3	Very low	35.1	Very low	156 Å²	156	151.3 Å²	151.3	80%	0.8	78%	0.781	S	S	*	*			trans	-87.9	111.3	175.3	-62.6	170.8	0	0	0	107	F252	I250-F252 HydrophobicContact CG2-CE2 4.17Å
251	I	35.6	Very low	35.5	Very low	140 Å²	140	156.4 Å²	156.4	72%	0.718	80%	0.799	S	S	*	*			trans	-114.2	115	177.8	-56.6	-179.2	0	0	0	109.7
252	F	32.3	Very low	35.7	Very low	180 Å²	180	158 Å²	158	79%	0.789	80%	0.801	S	S	*	*			trans	-79.3	134	166.3	-67.2	-89.4	0	0	0	109.5	I250 N254	I250-F252 HydrophobicContact CG2-CE2 4.17Å; F252-N254 PolarHBondContact O-N 3.42Å
253	P	35.9	Very low	35.9	Very low	131 Å²	131	158.4 Å²	158.4	85%	0.851	80%	0.801	S	S	*	*			trans	-86.2	104.6	171.6	30.8	-27.8	0	0	0	110
254	N	30	Very low	35.4	Very low	153 Å²	153	159.5 Å²	159.5	82%	0.818	80%	0.804	S	S	*	*			trans	-87.2	154	154	-138.8	-6.1	0	0	0	109	F252	F252-N254 PolarHBondContact O-N 3.42Å
255	T	35.9	Very low	35	Very low	93 Å²	93	158.4 Å²	158.4	57%	0.571	81%	0.806	S	S	*	*			trans	-64.8	175.4	-171.5	40.8	0	0	0	0	116.4
256	Y	32.5	Very low	34.9	Very low	198 Å²	198	158.4 Å²	158.4	78%	0.776	80%	0.803	S	S	*	*			trans	99.1	108.7	164.1	-52.1	-66.4	0	0	0	114.9
257	L	32.3	Very low	34.2	Very low	148 Å²	148	158.8 Å²	158.8	78%	0.775	80%	0.803	S	S	*	*				95.5	140.7	73.5	-87.2	-178.1	0	0	0	113
258	T	33.2	Very low	34.1	Very low	116 Å²	116	156.9 Å²	156.9	71%	0.712	80%	0.798	S	S	*	*			trans	84.4	110.7	156.6	70.2	0	0	0	0	123
259	L	31.8	Very low	33.9	Very low	150 Å²	150	153.6 Å²	153.6	79%	0.785	79%	0.793	S	S	*	*				61.7	132.1	121.2	-90.4	109.2	0	0	0	124
260	S	33.3	Very low	33.9	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	79%	0.791	S	S	*	*			trans	56.5	130.6	144.9	57	0	0	0	0	118
261	H	40.1	Very low	33.9	Very low	255 Å²	255	151.5 Å²	151.5	100%	1.181	79%	0.791	S	S	*	*			cis	-156.3	0	44.9	-154.3	-64.5	0	0	0	111.1

Retrieved 261 of 261 residues in 606 ms (Link to these results)

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