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Cytochrome c oxidase subunit 5A, mitochondrial

Component of the cytochrome c oxidase, the last enzyme in the mitochondrial electron transport chain which drives oxidative phosphorylation. The respiratory chain contains 3 multisubunit complexes succinate dehydrogenase (complex II, CII), ubiquinol-cytochrome c oxidoreductase (cytochrome b-c1 complex, complex III, CIII) and cytochrome c oxidase (complex IV, CIV), that cooperate to transfer electrons derived from NADH and succinate to molecular oxygen, creating an electrochemical gradient over the inner membrane that drives transmembrane transport and the ATP synthase. Cytochrome c oxidase is the component of the respiratory chain that catalyzes the reduction of oxygen to water. Electrons originating from reduced cytochrome c in the intermembrane space (IMS) are transferred via the dinuclear copper A center (CU(A)) of subunit 2 and heme A of subunit 1 to the active site in subunit 1, a binuclear center (BNC) formed by heme A3 and copper B (CU(B)). The BNC reduces molecular oxygen to 2 water molecules using 4 electrons from cytochrome c in the IMS and 4 protons from the mitochondrial matrix.

AlphaFold DB , UniProt , Accession A0A087YBY2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 139 aa.

						>A0A087YBY2_POEFO|A0A087YBY2
MLRALSRLSTSGFRSVARTRTGYSAPLASRCYSHGKVETEEEFDSRWVTYFSKPDIDAWELRKGMNTLIGYDLVPEPKILDSALRACRRLNDLASAIRILEAVKDKAGPHKEIYPYVIQELKPTLTELGISTPEELGID
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	46.9	Very low	52.1	Low	235 Å²	235	162 Å²	162	100%	1.158	87%	0.867	S	S	*	*				0	130.3	0	-55.9	-176	176.6	0	0	106
2	L	44.6	Very low	52.6	Low	168 Å²	168	154.8 Å²	154.8	88%	0.88	86%	0.86	S	S	*	*			cis	-146.4	148.5	16.8	-76.8	92.3	0	0	0	108.8
3	R	44.9	Very low	53.3	Low	248 Å²	248	158.2 Å²	158.2	94%	0.936	86%	0.861	S	S	*	*			trans	-74.6	127.2	163.2	-72.2	178.1	171	-168.1	-3.1	108.6
4	A	50.5	Low	53.9	Low	102 Å²	102	164.1 Å²	164.1	84%	0.843	86%	0.864	S	S	*	*			trans	-104.5	112.5	171	0	0	0	0	0	109.8
5	L	55.6	Low	54.3	Low	166 Å²	166	160.8 Å²	160.8	87%	0.869	86%	0.86	S	S	*	*			trans	-72.3	120.7	173.1	-83	139.6	0	0	0	109.9
6	S	50.8	Low	54.8	Low	115 Å²	115	159.1 Å²	159.1	80%	0.804	86%	0.856	S	S	*	*			trans	-79.5	115.3	164.8	41.7	0	0	0	0	109.6
7	R	53.8	Low	55.2	Low	241 Å²	241	154.6 Å²	154.6	91%	0.909	85%	0.847	S	S	*	*			trans	-86.3	118.2	171	-69.3	-174.3	178.1	-156.2	-0.1	109
8	L	52.6	Low	55.6	Low	165 Å²	165	158.8 Å²	158.8	86%	0.864	85%	0.848	S	S	*	*			trans	-70	130.9	165.9	-120	72.3	0	0	0	109.1
9	S	57	Low	56	Low	110 Å²	110	157.6 Å²	157.6	77%	0.769	85%	0.847	S	S	*	*			trans	-121.8	113.7	168	-168.2	0	0	0	0	108.4
10	T	58.2	Low	56.4	Low	132 Å²	132	161.7 Å²	161.7	81%	0.81	85%	0.85	S	S	*	*			trans	-91	108.9	174.4	41.7	0	0	0	0	108.9
11	S	58.8	Low	56.7	Low	100 Å²	100	159.1 Å²	159.1	70%	0.699	84%	0.841	S	S	*	*			trans	-93.6	108.7	167.5	-77.9	0	0	0	0	109.4
12	G	57.8	Low	57.5	Low	75 Å²	75	151.5 Å²	151.5	77%	0.773	82%	0.823	S	S	*	*			trans	-79	117.1	173.6	0	0	0	0	0	111.2
13	F	61.7	Low	58.6	Low	199 Å²	199	153.6 Å²	153.6	87%	0.873	82%	0.82	S	S	*	*			trans	-81.1	114	168.1	-77.2	-89.2	0	0	0	109.5	S15	F13-S15 PolarHBondContact O-N 3.22Å
14	R	61.6	Low	59.8	Low	242 Å²	242	147.5 Å²	147.5	91%	0.913	82%	0.816	S	S	*	*			trans	-83.3	100.8	166.6	-71.2	-174.7	-179.8	-137	0.9	108.6
15	S	60.5	Low	61	Low	114 Å²	114	146.6 Å²	146.6	80%	0.797	81%	0.808	S	S	*	*			trans	-81	113.4	168.5	-175.1	0	0	0	0	109.3	F13	F13-S15 PolarHBondContact O-N 3.22Å
16	V	61.6	Low	61.8	Low	133 Å²	133	144.6 Å²	144.6	81%	0.806	81%	0.805	S	S	*	*			trans	-92.6	91.9	168.5	178.2	0	0	0	0	107.3	R18	V16-R18 PolarHBondContact O-N 3.31Å
17	A	61.5	Low	62.9	Low	84 Å²	84	147.3 Å²	147.3	69%	0.694	81%	0.81	S	S	*	*			trans	-76.5	106.4	169.7	0	0	0	0	0	108.8	T19	A17-T19 PolarHBondContact O-N 3.29Å
18	R	62.3	Low	64	Low	229 Å²	229	140 Å²	140	86%	0.864	80%	0.801	S	S	*	*			trans	-81.1	100.3	173.5	-159.5	174.7	-172.3	174.2	2	108.3	V16 R20	V16-R18 PolarHBondContact O-N 3.31Å; R18-R20 PolarHBondContact O-N 3.05Å
19	T	62.9	Low	64.9	Low	136 Å²	136	137.3 Å²	137.3	83%	0.834	80%	0.796	S	S	*	*			trans	-65.3	112.2	171.3	29.7	0	0	0	0	109.2	A17 T21	A17-T19 PolarHBondContact O-N 3.29Å; T19-T21 PolarHBondContact O-N 3.17Å
20	R	63.9	Low	65.6	Low	240 Å²	240	141 Å²	141	91%	0.906	79%	0.793	S	S	*	*			trans	-77.6	118.6	168	-67.8	-178.7	96.3	177.2	5.4	107.5	R18 G22	R18-R20 PolarHBondContact O-N 3.05Å; R20-G22 PolarHBondContact O-N 3.31Å
21	T	63.4	Low	65.9	Low	107 Å²	107	139.8 Å²	139.8	66%	0.656	79%	0.789	S	S	*	*			trans	-64.8	110.7	165.9	31.4	0	0	0	0	108.6	T19 Y23	T19-T21 PolarHBondContact O-N 3.17Å; T21-Y23 PolarHBondContact O-N 2.92Å
22	G	63.8	Low	66.4	Low	75 Å²	75	144.7 Å²	144.7	77%	0.773	79%	0.793	S	S	*	*			trans	-73.6	110.6	170.9	0	0	0	0	0	109.2	R20 S24	R20-G22 PolarHBondContact O-N 3.31Å; G22-S24 PolarHBondContact O-N 3.49Å
23	Y	66.8	Low	66.7	Low	212 Å²	212	146 Å²	146	83%	0.831	79%	0.79	S	S	*	*			trans	-85	105.3	167.8	-69.4	-87.8	0	0	0	108.2	T21 A25	T21-Y23 PolarHBondContact O-N 2.92Å; Y23-A25 PolarHBondContact O-N 2.77Å
24	S	71.2	Confident	66.9	Low	121 Å²	121	145.7 Å²	145.7	85%	0.846	79%	0.791	S	S	*	*			trans	-81.8	108.7	165.9	-68.7	0	0	0	0	108.3	G22	G22-S24 PolarHBondContact O-N 3.49Å
25	A	74.9	Confident	67.1	Low	82 Å²	82	137.1 Å²	137.1	68%	0.678	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-64.7	135.8	170	0	0	0	0	0	109.1	Y23 L27	Y23-A25 PolarHBondContact O-N 2.77Å; A25-L27 PolarHBondContact O-N 3.01Å
26	P	73.1	Confident	68.1	Low	125 Å²	125	139.6 Å²	139.6	81%	0.812	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-63.4	124	175.1	25.8	-31.9	0	0	0	109.2	A28	P26-A28 PolarHBondContact O-N 3.39Å
27	L	74.3	Confident	69.2	Low	171 Å²	171	139.5 Å²	139.5	90%	0.895	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-68	122.7	170.6	-66.6	175.3	0	0	0	108.1	A25 S29	A25-L27 PolarHBondContact O-N 3.01Å; L27-S29 PolarHBondContact O-N 3.41Å
28	A	75.1	Confident	70.7	Confident	88 Å²	88	138.9 Å²	138.9	73%	0.727	76%	0.757	S	S	*	*			trans	-65.3	108.4	174.7	0	0	0	0	0	109.3	P26 R30	P26-A28 PolarHBondContact O-N 3.39Å; A28-R30 PolarHBondContact O-N 3.06Å
29	S	72.4	Confident	72.3	Confident	109 Å²	109	131.2 Å²	131.2	76%	0.762	74%	0.735	S	S	*	*			trans	-71.4	109.3	168.3	-173.2	0	0	0	0	108.3	L27	L27-S29 PolarHBondContact O-N 3.41Å
30	R	72.8	Confident	73.8	Confident	188 Å²	188	132.1 Å²	132.1	71%	0.709	73%	0.73	S	S	*	*			trans	-90.2	108.7	172.2	-67.2	-176.3	-179	-122.7	1	108	A28 Y32	A28-R30 PolarHBondContact O-N 3.06Å; R30-Y32 HydrophobicContact CB-CD2 4.28Å; R30-Y32 HydrophobicContact CB-CE2 3.81Å; R30-Y32 WeakPolarHBondContact O-CD2 3.47Å; R30-Y32 PolarHBondContact O-N 3.34Å; R30-Y32 VanDerWaalsContact O-N 3.13Å
31	C	64.5	Low	75.3	Confident	105 Å²	105	126.4 Å²	126.4	71%	0.709	71%	0.713	S	S	*	*			trans	-73.1	99.1	172.1	-61.7	0	0	0	0	109.3	S33	C31-S33 PolarHBondContact O-N 3.13Å
32	Y	67.6	Low	76.9	Confident	204 Å²	204	125.1 Å²	125.1	80%	0.8	70%	0.7	S	S	*	*			trans	-81.1	57	174.3	-69	-79.3	0	0	0	111.7	R30	R30-Y32 HydrophobicContact CB-CD2 4.28Å; R30-Y32 HydrophobicContact CB-CE2 3.81Å; R30-Y32 WeakPolarHBondContact O-CD2 3.47Å; R30-Y32 PolarHBondContact O-N 3.34Å; R30-Y32 VanDerWaalsContact O-N 3.13Å
33	S	65.6	Low	78.6	Confident	101 Å²	101	122.6 Å²	122.6	71%	0.706	67%	0.668	S	S	*	*			trans	-103.4	13.5	179.5	58.7	0	0	0	0	114.1	C31	C31-S33 PolarHBondContact O-N 3.13Å
34	H	64.1	Low	80.1	Confident	194 Å²	194	113.4 Å²	113.4	90%	0.898	63%	0.633	S	S	*	*			trans	-109.5	51.5	-169.7	-129	64.1	0	0	0	113.4
35	G	66.8	Low	81.3	Confident	61 Å²	61	110.8 Å²	110.8	63%	0.629	62%	0.615	S	S	*	*			trans	-107.9	133.6	169.8	0	0	0	0	0	110.6	V37	G35-V37 PolarHBondContact O-N 3.48Å
36	K	81.3	Confident	82.5	Confident	166 Å²	166	111.3 Å²	111.3	72%	0.722	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-60.3	121.3	163.3	-176.4	-163.8	175.5	-145.1	0	106.7	E38 E42	K36-E38 PolarHBondContact O-N 3.01Å; K36-E42 VanDerWaalsContact NZ-CD 3.32Å; K36-E42 IonicContact NZ-OE1 2.84Å; K36-E42 PolarHBondContact NZ-OE1 2.9Å; K36-E42 IonicContact NZ-OE2 2.95Å; K36-E42 PolarHBondContact NZ-OE2 3.46Å
37	V	85.5	Confident	83.7	Confident	132 Å²	132	105.9 Å²	105.9	80%	0.8	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-72.4	118.2	169.1	-177.5	0	0	0	0	106.6	G35	G35-V37 PolarHBondContact O-N 3.48Å
38	E	91.5	Very high	84.8	Confident	71 Å²	71	99.6 Å²	99.6	33%	0.332	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-75.9	152.1	174.2	67.2	-174.2	151.1	0	0	110.2	K36 E42 F43 R46	K36-E38 PolarHBondContact O-N 3.01Å; E38-E42 VanDerWaalsContact CA-OE2 3.32Å; E38-E42 WeakPolarHBondContact CA-OE2 3.4Å; E38-E42 HydrophobicContact CB-CB 4.03Å; E38-E42 WeakPolarHBondContact CB-OE2 3.31Å; E38-F43 HydrophobicContact CG-CB 4.2Å; E38-F43 WeakPolarHBondContact OE1-CD2 3.2Å; E38-R46 IonicContact OE1-CZ 3.82Å; E38-R46 IonicContact OE1-NE 2.85Å; E38-R46 IonicContact OE1-NH2 3.98Å; E38-R46 PolarHBondContact OE1-NH2 2.93Å; E38-R46 IonicContact OE2-CZ 3.56Å; E38-R46 IonicContact OE2-NE 3.55Å; E38-R46 PolarHBondContact OE2-NE 2.97Å; E38-R46 IonicContact OE2-NH2 2.73Å
39	T	96.1	Very high	86	Confident	67 Å²	67	100 Å²	100	41%	0.411	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-76	165.6	171.7	79.5	0	0	0	0	110.7	E41 E42 F43	T39-E41 VanDerWaalsContact C-N 3.27Å; T39-E41 VanDerWaalsContact CB-OE2 3.29Å; T39-E41 WeakPolarHBondContact CB-OE2 3.47Å; T39-E41 PolarHBondContact O-N 3.41Å; T39-E41 PolarHBondContact OG1-N 2.78Å; T39-E41 PolarHBondContact OG1-OE2 3.02Å; T39-E42 PolarHBondContact N-OE2 3.42Å; T39-E42 PolarHBondContact O-N 2.8Å; T39-E42 PolarHBondContact OG1-N 2.9Å; T39-F43 PolarHBondContact O-N 3.23Å
40	E	95.1	Very high	87.2	Confident	156 Å²	156	98.5 Å²	98.5	73%	0.729	50%	0.503	S	S	*	.	H	α-helix	trans	-60	-39.6	176.8	-66.4	177.2	-175.2	0	0	111.3	F43 D44	E40-F43 WeakPolarHBondContact O-CB 3.35Å; E40-F43 PolarHBondContact O-N 2.94Å; E40-D44 WeakPolarHBondContact O-CB 3.41Å; E40-D44 VanDerWaalsContact O-CG 3.3Å; E40-D44 PolarHBondContact O-N 2.95Å
41	E	96	Very high	88.5	Confident	119 Å²	119	89.5 Å²	89.5	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-68.8	-37	177.7	-53.3	77.8	-171.6	0	0	112.3	T39 S45	T39-E41 VanDerWaalsContact C-N 3.27Å; T39-E41 VanDerWaalsContact CB-OE2 3.29Å; T39-E41 WeakPolarHBondContact CB-OE2 3.47Å; T39-E41 PolarHBondContact O-N 3.41Å; T39-E41 PolarHBondContact OG1-N 2.78Å; T39-E41 PolarHBondContact OG1-OE2 3.02Å; E41-S45 WeakPolarHBondContact O-CB 3.31Å; E41-S45 PolarHBondContact O-N 2.96Å; E41-S45 PolarHBondContact O-OG 3.49Å
42	E	97.1	Very high	90.1	Very high	80 Å²	80	87.3 Å²	87.3	37%	0.374	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-45.6	173.3	-72.8	-177.1	159.1	0	0	110.2	K36 E38 T39 S45 R46	K36-E42 VanDerWaalsContact NZ-CD 3.32Å; K36-E42 IonicContact NZ-OE1 2.84Å; K36-E42 PolarHBondContact NZ-OE1 2.9Å; K36-E42 IonicContact NZ-OE2 2.95Å; K36-E42 PolarHBondContact NZ-OE2 3.46Å; E38-E42 VanDerWaalsContact CA-OE2 3.32Å; E38-E42 WeakPolarHBondContact CA-OE2 3.4Å; E38-E42 HydrophobicContact CB-CB 4.03Å; E38-E42 WeakPolarHBondContact CB-OE2 3.31Å; T39-E42 PolarHBondContact N-OE2 3.42Å; T39-E42 PolarHBondContact O-N 2.8Å; T39-E42 PolarHBondContact OG1-N 2.9Å; E42-S45 PolarHBondContact O-N 3.44Å; E42-R46 VanDerWaalsContact O-CB 3.32Å; E42-R46 WeakPolarHBondContact O-CB 3.38Å; E42-R46 PolarHBondContact O-N 2.9Å
43	F	97.8	Very high	91.6	Very high	22 Å²	22	81 Å²	81	10%	0.096	43%	0.432	C	S	.	.	H	α-helix	trans	-58	-50.7	176.8	177.4	-86.5	0	0	0	111.4	E38 T39 E40 R46 W47 L68 Y71 L73	E38-F43 HydrophobicContact CG-CB 4.2Å; E38-F43 WeakPolarHBondContact OE1-CD2 3.2Å; T39-F43 PolarHBondContact O-N 3.23Å; E40-F43 WeakPolarHBondContact O-CB 3.35Å; E40-F43 PolarHBondContact O-N 2.94Å; F43-R46 WeakPolarHBondContact O-CB 3.49Å; F43-R46 PolarHBondContact O-N 3.48Å; F43-W47 AromaticContact CD1-CD1 3.77Å; F43-W47 AromaticContact CE1-CD1 3.39Å; F43-W47 AromaticContact CE1-NE1 3.65Å; F43-W47 AromaticContact CE2-CD1 3.9Å; F43-W47 AromaticContact CE2-NE1 3.44Å; F43-W47 AromaticContact CZ-CD1 3.45Å; F43-W47 VanDerWaalsContact CZ-CD1 3.45Å; F43-W47 AromaticContact CZ-NE1 3.15Å; F43-W47 VanDerWaalsContact O-CD1 3.29Å; F43-W47 PolarHBondContact O-N 3.31Å; F43-W47 VanDerWaalsContact O-N 3.15Å; F43-L68 HydrophobicContact CE1-CD1 4.25Å; F43-L68 HydrophobicContact CZ-CD1 4.11Å; F43-Y71 HydrophobicContact CE2-CD1 4.33Å; F43-Y71 HydrophobicContact CE2-CD2 4.09Å; F43-Y71 HydrophobicContact CE2-CE1 4.19Å; F43-Y71 AromaticContact CE2-CE2 3.97Å; F43-Y71 HydrophobicContact CE2-CE2 3.97Å; F43-Y71 HydrophobicContact CE2-CG 4.28Å; F43-Y71 AromaticContact CZ-CD2 3.82Å; F43-Y71 HydrophobicContact CZ-CD2 3.82Å; F43-Y71 HydrophobicContact CZ-CE2 4.04Å; F43-Y71 HydrophobicContact CZ-CG 4.15Å; F43-L73 HydrophobicContact CE1-CD1 4.5Å; F43-L73 HydrophobicContact CE1-CD2 3.72Å; F43-L73 HydrophobicContact CZ-CD2 3.73Å
44	D	98.3	Very high	93.1	Very high	19 Å²	19	81.4 Å²	81.4	10%	0.102	43%	0.432	C	S	.	.	H	α-helix	trans	-62.3	-47.2	-179.8	-75.8	-15.5	0	0	0	112	E40 R46 W47 V48 K78 I79	E40-D44 WeakPolarHBondContact O-CB 3.41Å; E40-D44 VanDerWaalsContact O-CG 3.3Å; E40-D44 PolarHBondContact O-N 2.95Å; D44-R46 VanDerWaalsContact C-N 3.25Å; D44-R46 PolarHBondContact O-N 3.33Å; D44-W47 PolarHBondContact O-N 3.03Å; D44-W47 VanDerWaalsContact O-N 3.15Å; D44-V48 WeakPolarHBondContact O-CG2 3.42Å; D44-V48 PolarHBondContact O-N 2.95Å; D44-K78 WeakPolarHBondContact OD2-CE 3.35Å; D44-K78 IonicContact OD2-NZ 3.71Å; D44-K78 PolarHBondContact OD2-NZ 3.09Å; D44-I79 HydrophobicContact CB-CD1 4.42Å; D44-I79 WeakPolarHBondContact OD1-CD1 3.36Å
45	S	98.3	Very high	94.7	Very high	66 Å²	66	77.9 Å²	77.9	46%	0.462	42%	0.419	S	S	.	.	H	α-helix	trans	-61.5	-37.8	-179.6	-60.8	0	0	0	0	111.3	E41 E42 T49	E41-S45 WeakPolarHBondContact O-CB 3.31Å; E41-S45 PolarHBondContact O-N 2.96Å; E41-S45 PolarHBondContact O-OG 3.49Å; E42-S45 PolarHBondContact O-N 3.44Å; S45-T49 VanDerWaalsContact O-CB 3.28Å; S45-T49 WeakPolarHBondContact O-CB 3.48Å; S45-T49 PolarHBondContact O-N 3.39Å; S45-T49 PolarHBondContact O-OG1 2.95Å
46	R	98.4	Very high	96.2	Very high	94 Å²	94	75.3 Å²	75.3	36%	0.355	39%	0.391	S	S	.	.	H	α-helix	trans	-63.6	-42.3	176.1	-175.8	176.1	51.4	61.4	-1	111.5	E38 E42 F43 D44 Y50	E38-R46 IonicContact OE1-CZ 3.82Å; E38-R46 IonicContact OE1-NE 2.85Å; E38-R46 IonicContact OE1-NH2 3.98Å; E38-R46 PolarHBondContact OE1-NH2 2.93Å; E38-R46 IonicContact OE2-CZ 3.56Å; E38-R46 IonicContact OE2-NE 3.55Å; E38-R46 PolarHBondContact OE2-NE 2.97Å; E38-R46 IonicContact OE2-NH2 2.73Å; E42-R46 VanDerWaalsContact O-CB 3.32Å; E42-R46 WeakPolarHBondContact O-CB 3.38Å; E42-R46 PolarHBondContact O-N 2.9Å; F43-R46 WeakPolarHBondContact O-CB 3.49Å; F43-R46 PolarHBondContact O-N 3.48Å; D44-R46 VanDerWaalsContact C-N 3.25Å; D44-R46 PolarHBondContact O-N 3.33Å; R46-Y50 WeakPolarHBondContact O-CB 3.38Å; R46-Y50 PolarHBondContact O-N 3.34Å
47	W	98.8	Very high	97.1	Very high	10 Å²	10	71 Å²	71	4%	0.038	38%	0.376	C	S	.	.	H	α-helix	trans	-72.5	-40.1	178.3	-81.1	111.8	0	0	0	113.5	F43 D44 T49 Y50 F51 G64 T67 L68 Y71 I79	F43-W47 AromaticContact CD1-CD1 3.77Å; F43-W47 AromaticContact CE1-CD1 3.39Å; F43-W47 AromaticContact CE1-NE1 3.65Å; F43-W47 AromaticContact CE2-CD1 3.9Å; F43-W47 AromaticContact CE2-NE1 3.44Å; F43-W47 AromaticContact CZ-CD1 3.45Å; F43-W47 VanDerWaalsContact CZ-CD1 3.45Å; F43-W47 AromaticContact CZ-NE1 3.15Å; F43-W47 VanDerWaalsContact O-CD1 3.29Å; F43-W47 PolarHBondContact O-N 3.31Å; F43-W47 VanDerWaalsContact O-N 3.15Å; D44-W47 PolarHBondContact O-N 3.03Å; D44-W47 VanDerWaalsContact O-N 3.15Å; W47-T49 VanDerWaalsContact C-N 3.32Å; W47-T49 PolarHBondContact O-N 3.44Å; W47-Y50 HydrophobicContact CE3-CD1 4.19Å; W47-Y50 HydrophobicContact CE3-CG 4.42Å; W47-Y50 HydrophobicContact CZ3-CD1 4.02Å; W47-Y50 HydrophobicContact CZ3-CE1 4.36Å; W47-Y50 HydrophobicContact CZ3-CG 4.42Å; W47-Y50 WeakPolarHBondContact O-CB 3.34Å; W47-Y50 PolarHBondContact O-N 3.17Å; W47-F51 HydrophobicContact CE3-CD2 4.32Å; W47-F51 AromaticContact CE3-CE2 3.59Å; W47-F51 HydrophobicContact CE3-CE2 3.59Å; W47-F51 HydrophobicContact CE3-CZ 4Å; W47-F51 HydrophobicContact CZ3-CE2 4.08Å; W47-F51 HydrophobicContact CZ3-CZ 4.01Å; W47-F51 VanDerWaalsContact O-CD2 3.28Å; W47-F51 WeakPolarHBondContact O-CD2 3.41Å; W47-F51 PolarHBondContact O-N 3.19Å; W47-F51 VanDerWaalsContact O-N 3.09Å; W47-G64 WeakPolarHBondContact CH2-O 3.34Å; W47-G64 WeakPolarHBondContact CZ3-O 3.36Å; W47-T67 HydrophobicContact CH2-CG2 3.96Å; W47-T67 HydrophobicContact CZ2-CG2 4.04Å; W47-L68 HydrophobicContact CD2-CB 4.48Å; W47-L68 HydrophobicContact CD2-CD1 3.98Å; W47-L68 HydrophobicContact CD2-CD2 4.48Å; W47-L68 HydrophobicContact CE3-CB 4.37Å; W47-L68 HydrophobicContact CE3-CD2 4.42Å; W47-L68 HydrophobicContact CG-CD1 4.15Å; W47-L68 HydrophobicContact CH2-CB 3.97Å; W47-L68 HydrophobicContact CZ2-CB 4.1Å; W47-L68 HydrophobicContact CZ2-CD1 4.36Å; W47-L68 HydrophobicContact CZ3-CB 4.11Å; W47-Y71 AromaticContact CZ2-CE2 3.85Å; W47-Y71 HydrophobicContact CZ2-CE2 3.85Å; W47-I79 HydrophobicContact CB-CD1 3.88Å; W47-I79 HydrophobicContact CB-CG1 3.89Å; W47-I79 HydrophobicContact CB-CG2 3.79Å; W47-I79 HydrophobicContact CG-CD1 4.48Å
48	V	98.8	Very high	97.7	Very high	39 Å²	39	66.5 Å²	66.5	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-46.7	171.5	172.1	0	0	0	0	110.2	D44 Y50 F51 S52 K78 I79	D44-V48 WeakPolarHBondContact O-CG2 3.42Å; D44-V48 PolarHBondContact O-N 2.95Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.45Å; V48-F51 PolarHBondContact O-N 3.4Å; V48-S52 WeakPolarHBondContact O-CB 3.42Å; V48-S52 PolarHBondContact O-N 2.8Å; V48-S52 PolarHBondContact O-OG 3.48Å; V48-K78 HydrophobicContact CG2-CB 4.31Å; V48-K78 HydrophobicContact CG2-CG 4.06Å; V48-I79 HydrophobicContact CG2-CG1 4.02Å
49	T	98.8	Very high	98	Very high	98 Å²	98	70.7 Å²	70.7	60%	0.601	37%	0.366	S	S	*	.	H	α-helix	trans	-61.1	-43	177.9	-58.9	0	0	0	0	111.4	S45 W47 S52 K53	S45-T49 VanDerWaalsContact O-CB 3.28Å; S45-T49 WeakPolarHBondContact O-CB 3.48Å; S45-T49 PolarHBondContact O-N 3.39Å; S45-T49 PolarHBondContact O-OG1 2.95Å; W47-T49 VanDerWaalsContact C-N 3.32Å; W47-T49 PolarHBondContact O-N 3.44Å; T49-S52 PolarHBondContact O-N 3.44Å; T49-K53 PolarHBondContact O-N 3.36Å
50	Y	98.8	Very high	98.1	Very high	76 Å²	76	69.2 Å²	69.2	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-53	178.3	-177.8	-91.6	0	0	0	112	R46 W47 V48 S52 K53 I56 E60	R46-Y50 WeakPolarHBondContact O-CB 3.38Å; R46-Y50 PolarHBondContact O-N 3.34Å; W47-Y50 HydrophobicContact CE3-CD1 4.19Å; W47-Y50 HydrophobicContact CE3-CG 4.42Å; W47-Y50 HydrophobicContact CZ3-CD1 4.02Å; W47-Y50 HydrophobicContact CZ3-CE1 4.36Å; W47-Y50 HydrophobicContact CZ3-CG 4.42Å; W47-Y50 WeakPolarHBondContact O-CB 3.34Å; W47-Y50 PolarHBondContact O-N 3.17Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.45Å; Y50-S52 VanDerWaalsContact C-N 3.33Å; Y50-S52 PolarHBondContact O-N 3.14Å; Y50-K53 WeakPolarHBondContact O-CB 3.37Å; Y50-K53 PolarHBondContact O-N 3.01Å; Y50-I56 HydrophobicContact CE1-CD1 4.23Å; Y50-E60 PolarHBondContact OH-O 3.37Å
51	F	98.8	Very high	98.3	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-77	-17.8	-179.9	-66	-63	0	0	0	113.7	W47 V48 K53 I56 L61 M65 L68 I79 S82 A83 R89	W47-F51 HydrophobicContact CE3-CD2 4.32Å; W47-F51 AromaticContact CE3-CE2 3.59Å; W47-F51 HydrophobicContact CE3-CE2 3.59Å; W47-F51 HydrophobicContact CE3-CZ 4Å; W47-F51 HydrophobicContact CZ3-CE2 4.08Å; W47-F51 HydrophobicContact CZ3-CZ 4.01Å; W47-F51 VanDerWaalsContact O-CD2 3.28Å; W47-F51 WeakPolarHBondContact O-CD2 3.41Å; W47-F51 PolarHBondContact O-N 3.19Å; W47-F51 VanDerWaalsContact O-N 3.09Å; V48-F51 PolarHBondContact O-N 3.4Å; F51-K53 VanDerWaalsContact C-N 3.28Å; F51-K53 PolarHBondContact O-N 3.33Å; F51-I56 HydrophobicContact CD1-CD1 4.1Å; F51-L61 HydrophobicContact CD1-CD1 4.02Å; F51-L61 HydrophobicContact CE1-CD1 3.99Å; F51-M65 HydrophobicContact CE1-CG 4.19Å; F51-M65 HydrophobicContact CE1-SD 4.13Å; F51-M65 HydrophobicContact CE2-SD 4.21Å; F51-M65 HydrophobicContact CZ-CG 4.09Å; F51-M65 HydrophobicContact CZ-SD 3.58Å; F51-M65 VanDerWaalsContact CZ-SD 3.58Å; F51-L68 HydrophobicContact CE2-CD2 3.98Å; F51-L68 HydrophobicContact CZ-CD2 4.43Å; F51-I79 HydrophobicContact CD2-CG2 4.01Å; F51-I79 HydrophobicContact CE2-CG2 3.92Å; F51-S82 WeakPolarHBondContact CB-OG 3.45Å; F51-A83 HydrophobicContact CB-CB 4.37Å; F51-A83 HydrophobicContact CD1-CB 4.06Å; F51-A83 HydrophobicContact CD2-CB 3.95Å; F51-A83 HydrophobicContact CE1-CB 4.32Å; F51-A83 HydrophobicContact CE2-CB 4.2Å; F51-A83 HydrophobicContact CG-CB 3.87Å; F51-A83 HydrophobicContact CZ-CB 4.39Å; F51-R89 PolarHBondContact O-NH2 3.11Å
52	S	98.6	Very high	98.4	Very high	58 Å²	58	62.1 Å²	62.1	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-79	-9	176.2	-61.8	0	0	0	0	113.6	V48 T49 Y50 P54	V48-S52 WeakPolarHBondContact O-CB 3.42Å; V48-S52 PolarHBondContact O-N 2.8Å; V48-S52 PolarHBondContact O-OG 3.48Å; T49-S52 PolarHBondContact O-N 3.44Å; Y50-S52 VanDerWaalsContact C-N 3.33Å; Y50-S52 PolarHBondContact O-N 3.14Å; S52-P54 WeakPolarHBondContact O-CD 3.43Å; S52-P54 VanDerWaalsContact O-N 3.12Å
53	K	98.4	Very high	98.5	Very high	72 Å²	72	63.1 Å²	63.1	31%	0.313	32%	0.319	S	S	.	.			trans	-50.8	117.8	174.9	180	-175.8	171.2	-157.1	0	110.2	T49 Y50 F51 D55 I56 E60 R89	T49-K53 PolarHBondContact O-N 3.36Å; Y50-K53 WeakPolarHBondContact O-CB 3.37Å; Y50-K53 PolarHBondContact O-N 3.01Å; F51-K53 VanDerWaalsContact C-N 3.28Å; F51-K53 PolarHBondContact O-N 3.33Å; K53-D55 VanDerWaalsContact C-N 3.31Å; K53-D55 WeakPolarHBondContact CE-OD1 3.02Å; K53-D55 VanDerWaalsContact CG-OD1 3.24Å; K53-D55 WeakPolarHBondContact CG-OD1 3.49Å; K53-D55 PolarHBondContact O-N 3.46Å; K53-I56 HydrophobicContact CB-CB 4.22Å; K53-I56 HydrophobicContact CG-CB 4.48Å; K53-I56 WeakPolarHBondContact O-CB 3.35Å; K53-I56 WeakPolarHBondContact O-CG2 3.35Å; K53-I56 PolarHBondContact O-N 3.32Å; K53-E60 IonicContact NZ-OE1 3.02Å; K53-E60 PolarHBondContact NZ-OE1 3Å; K53-E60 IonicContact NZ-OE2 3.52Å; K53-E60 PolarHBondContact NZ-OE2 3.3Å; K53-R89 PolarHBondContact O-NH2 3.24Å
54	P	98.3	Very high	98.6	Very high	109 Å²	109	62.1 Å²	62.1	71%	0.708	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-39.8	-171.2	-27.2	35.1	0	0	0	113.8	S52 R89	S52-P54 WeakPolarHBondContact O-CD 3.43Å; S52-P54 VanDerWaalsContact O-N 3.12Å; P54-R89 PolarHBondContact O-NE 2.94Å
55	D	97.8	Very high	98.6	Very high	120 Å²	120	61.9 Å²	61.9	64%	0.642	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	26.7	-178.3	64.3	-31.3	0	0	0	112.6	K53 D57	K53-D55 VanDerWaalsContact C-N 3.31Å; K53-D55 WeakPolarHBondContact CE-OD1 3.02Å; K53-D55 VanDerWaalsContact CG-OD1 3.24Å; K53-D55 WeakPolarHBondContact CG-OD1 3.49Å; K53-D55 PolarHBondContact O-N 3.46Å; D55-D57 PolarHBondContact O-N 3.15Å
56	I	98.6	Very high	98.6	Very high	7 Å²	7	63.9 Å²	63.9	4%	0.036	32%	0.319	C	S	.	.			trans	-56.3	129.8	172.5	-168	172.3	0	0	0	110	Y50 F51 K53 E60 L61 A86 R89 L90	Y50-I56 HydrophobicContact CE1-CD1 4.23Å; F51-I56 HydrophobicContact CD1-CD1 4.1Å; K53-I56 HydrophobicContact CB-CB 4.22Å; K53-I56 HydrophobicContact CG-CB 4.48Å; K53-I56 WeakPolarHBondContact O-CB 3.35Å; K53-I56 WeakPolarHBondContact O-CG2 3.35Å; K53-I56 PolarHBondContact O-N 3.32Å; I56-E60 WeakPolarHBondContact CA-OE2 3.34Å; I56-E60 HydrophobicContact CD1-CB 4.2Å; I56-E60 HydrophobicContact CG1-CB 3.59Å; I56-L61 HydrophobicContact CD1-CB 4.48Å; I56-A86 HydrophobicContact CG2-CB 3.88Å; I56-R89 VanDerWaalsContact CG2-NH2 3.34Å; I56-L90 WeakPolarHBondContact O-CD2 3.46Å
57	D	98.7	Very high	98.6	Very high	75 Å²	75	61.7 Å²	61.7	40%	0.401	32%	0.316	S	S	.	.			trans	-91.3	168.7	177.9	75.6	41	0	0	0	112.5	D55 W59 E60 L61	D55-D57 PolarHBondContact O-N 3.15Å; D57-W59 PolarHBondContact O-N 3.16Å; D57-W59 VanDerWaalsContact OD1-CA 3.29Å; D57-W59 WeakPolarHBondContact OD1-CA 3.5Å; D57-W59 VanDerWaalsContact OD1-CB 3.28Å; D57-W59 WeakPolarHBondContact OD1-CB 3.34Å; D57-W59 PolarHBondContact OD1-N 3.02Å; D57-E60 PolarHBondContact N-OE2 3.38Å; D57-E60 VanDerWaalsContact N-OE2 3.08Å; D57-E60 PolarHBondContact O-N 2.94Å; D57-E60 PolarHBondContact OD1-N 3.44Å; D57-L61 PolarHBondContact O-N 3.31Å
58	A	98.4	Very high	98.6	Very high	38 Å²	38	61.2 Å²	61.2	31%	0.314	31%	0.314	S	S	.	.	H	α-helix	trans	-64.4	-28.4	-178.6	0	0	0	0	0	113.1	R62 L90	A58-R62 WeakPolarHBondContact O-CG 3.43Å; A58-R62 PolarHBondContact O-N 2.85Å; A58-R62 PolarHBondContact O-NH1 3.17Å; A58-L90 HydrophobicContact CB-CD2 4.5Å
59	W	98.6	Very high	98.5	Very high	159 Å²	159	62 Å²	62	60%	0.602	32%	0.316	S	S	*	.	H	α-helix	trans	-72.4	-43.7	175.8	177.4	94.5	0	0	0	110.9	D57 R62 K63	D57-W59 PolarHBondContact O-N 3.16Å; D57-W59 VanDerWaalsContact OD1-CA 3.29Å; D57-W59 WeakPolarHBondContact OD1-CA 3.5Å; D57-W59 VanDerWaalsContact OD1-CB 3.28Å; D57-W59 WeakPolarHBondContact OD1-CB 3.34Å; D57-W59 PolarHBondContact OD1-N 3.02Å; W59-R62 PolarHBondContact O-N 3.31Å; W59-K63 HydrophobicContact CE3-CB 4.4Å; W59-K63 HydrophobicContact CH2-CB 4.33Å; W59-K63 HydrophobicContact CH2-CG 4.05Å; W59-K63 HydrophobicContact CZ2-CB 4.45Å; W59-K63 HydrophobicContact CZ2-CG 4.36Å; W59-K63 HydrophobicContact CZ3-CB 4.31Å; W59-K63 HydrophobicContact CZ3-CG 4.35Å; W59-K63 VanDerWaalsContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CB 3.4Å; W59-K63 PolarHBondContact O-N 3.33Å
60	E	98.8	Very high	98.4	Very high	37 Å²	37	60.5 Å²	60.5	17%	0.173	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-45.7	176	-69.9	-179.3	134.7	0	0	111	Y50 K53 I56 D57 R62 K63 G64	Y50-E60 PolarHBondContact OH-O 3.37Å; K53-E60 IonicContact NZ-OE1 3.02Å; K53-E60 PolarHBondContact NZ-OE1 3Å; K53-E60 IonicContact NZ-OE2 3.52Å; K53-E60 PolarHBondContact NZ-OE2 3.3Å; I56-E60 WeakPolarHBondContact CA-OE2 3.34Å; I56-E60 HydrophobicContact CD1-CB 4.2Å; I56-E60 HydrophobicContact CG1-CB 3.59Å; D57-E60 PolarHBondContact N-OE2 3.38Å; D57-E60 VanDerWaalsContact N-OE2 3.08Å; D57-E60 PolarHBondContact O-N 2.94Å; D57-E60 PolarHBondContact OD1-N 3.44Å; E60-R62 PolarHBondContact O-N 3.14Å; E60-K63 PolarHBondContact O-N 3.1Å; E60-G64 PolarHBondContact O-N 3.48Å
61	L	98.8	Very high	98.4	Very high	3 Å²	3	61.2 Å²	61.2	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-54.1	-52.5	174.7	175.9	67.2	0	0	0	111.5	F51 I56 D57 K63 G64 M65 A86 L90	F51-L61 HydrophobicContact CD1-CD1 4.02Å; F51-L61 HydrophobicContact CE1-CD1 3.99Å; I56-L61 HydrophobicContact CD1-CB 4.48Å; D57-L61 PolarHBondContact O-N 3.31Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 2.82Å; L61-G64 PolarHBondContact O-N 2.55Å; L61-M65 HydrophobicContact CD1-CG 4.47Å; L61-M65 PolarHBondContact O-N 3.06Å; L61-A86 HydrophobicContact CD1-CB 4.14Å; L61-L90 HydrophobicContact CB-CD1 3.93Å; L61-L90 HydrophobicContact CD2-CD1 3.75Å; L61-L90 HydrophobicContact CG-CD1 4.42Å
62	R	98.6	Very high	98.3	Very high	123 Å²	123	69.3 Å²	69.3	46%	0.464	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-40.5	179.6	-69.8	-170.5	-53	-87.7	-0.3	111.7	A58 W59 E60 N66	A58-R62 WeakPolarHBondContact O-CG 3.43Å; A58-R62 PolarHBondContact O-N 2.85Å; A58-R62 PolarHBondContact O-NH1 3.17Å; W59-R62 PolarHBondContact O-N 3.31Å; E60-R62 PolarHBondContact O-N 3.14Å; R62-N66 VanDerWaalsContact O-CB 3.22Å; R62-N66 WeakPolarHBondContact O-CB 3.22Å; R62-N66 PolarHBondContact O-N 2.97Å; R62-N66 PolarHBondContact O-ND2 3.2Å
63	K	98.7	Very high	98.3	Very high	101 Å²	101	69.3 Å²	69.3	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-45.2	178.6	178	55.9	-175.6	162	0	110.7	W59 E60 L61 T67	W59-K63 HydrophobicContact CE3-CB 4.4Å; W59-K63 HydrophobicContact CH2-CB 4.33Å; W59-K63 HydrophobicContact CH2-CG 4.05Å; W59-K63 HydrophobicContact CZ2-CB 4.45Å; W59-K63 HydrophobicContact CZ2-CG 4.36Å; W59-K63 HydrophobicContact CZ3-CB 4.31Å; W59-K63 HydrophobicContact CZ3-CG 4.35Å; W59-K63 VanDerWaalsContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CB 3.4Å; W59-K63 PolarHBondContact O-N 3.33Å; E60-K63 PolarHBondContact O-N 3.1Å; L61-K63 VanDerWaalsContact C-N 3.34Å; L61-K63 PolarHBondContact O-N 2.82Å; K63-T67 PolarHBondContact NZ-OG1 2.6Å; K63-T67 WeakPolarHBondContact O-CB 3.5Å; K63-T67 PolarHBondContact O-N 3.36Å; K63-T67 PolarHBondContact O-OG1 3.11Å
64	G	98.6	Very high	98.2	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-58.1	-56	175.5	0	0	0	0	0	111.7	W47 E60 L61 N66 T67 L68	W47-G64 WeakPolarHBondContact CH2-O 3.34Å; W47-G64 WeakPolarHBondContact CZ3-O 3.36Å; E60-G64 PolarHBondContact O-N 3.48Å; L61-G64 PolarHBondContact O-N 2.55Å; G64-N66 PolarHBondContact O-N 3.07Å; G64-T67 PolarHBondContact O-N 2.92Å; G64-L68 VanDerWaalsContact O-CB 3.31Å; G64-L68 WeakPolarHBondContact O-CB 3.06Å; G64-L68 PolarHBondContact O-N 3.1Å
65	M	98.6	Very high	98.3	Very high	14 Å²	14	62.3 Å²	62.3	7%	0.069	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-46.3	-179.5	-72.2	-53.8	-48.8	0	0	112.6	F51 L61 T67 L68 I69 A83 I99	F51-M65 HydrophobicContact CE1-CG 4.19Å; F51-M65 HydrophobicContact CE1-SD 4.13Å; F51-M65 HydrophobicContact CE2-SD 4.21Å; F51-M65 HydrophobicContact CZ-CG 4.09Å; F51-M65 HydrophobicContact CZ-SD 3.58Å; F51-M65 VanDerWaalsContact CZ-SD 3.58Å; L61-M65 HydrophobicContact CD1-CG 4.47Å; L61-M65 PolarHBondContact O-N 3.06Å; M65-T67 VanDerWaalsContact C-N 3.25Å; M65-T67 PolarHBondContact O-N 2.98Å; M65-L68 HydrophobicContact CE-CD2 4.49Å; M65-L68 PolarHBondContact O-N 3.28Å; M65-L68 HydrophobicContact SD-CD2 4.41Å; M65-I69 HydrophobicContact CE-CG2 4.3Å; M65-I69 WeakPolarHBondContact O-CG1 3.35Å; M65-I69 WeakPolarHBondContact O-CG2 3.26Å; M65-I69 PolarHBondContact O-N 3.13Å; M65-A83 HydrophobicContact SD-CB 4.1Å; M65-I99 HydrophobicContact CE-CB 4.42Å; M65-I99 HydrophobicContact CE-CG1 3.94Å; M65-I99 HydrophobicContact CE-CG2 3.89Å; M65-I99 HydrophobicContact CG-CD1 3.95Å; M65-I99 HydrophobicContact CG-CG1 3.97Å; M65-I99 HydrophobicContact SD-CD1 4.04Å; M65-I99 HydrophobicContact SD-CG1 4.06Å; M65-I99 HydrophobicContact SD-CG2 4.43Å
66	N	98.4	Very high	98.3	Very high	108 Å²	108	60.5 Å²	60.5	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-31.6	178.8	-73	-20.9	0	0	0	113	R62 G64	R62-N66 VanDerWaalsContact O-CB 3.22Å; R62-N66 WeakPolarHBondContact O-CB 3.22Å; R62-N66 PolarHBondContact O-N 2.97Å; R62-N66 PolarHBondContact O-ND2 3.2Å; G64-N66 PolarHBondContact O-N 3.07Å
67	T	98.5	Very high	98.3	Very high	48 Å²	48	60.9 Å²	60.9	29%	0.294	31%	0.314	S	S	.	.	H	α-helix	trans	-78.2	-41.9	174.6	-73.2	0	0	0	0	111.3	W47 K63 G64 M65 G70 Y71	W47-T67 HydrophobicContact CH2-CG2 3.96Å; W47-T67 HydrophobicContact CZ2-CG2 4.04Å; K63-T67 PolarHBondContact NZ-OG1 2.6Å; K63-T67 WeakPolarHBondContact O-CB 3.5Å; K63-T67 PolarHBondContact O-N 3.36Å; K63-T67 PolarHBondContact O-OG1 3.11Å; G64-T67 PolarHBondContact O-N 2.92Å; M65-T67 VanDerWaalsContact C-N 3.25Å; M65-T67 PolarHBondContact O-N 2.98Å; T67-G70 PolarHBondContact O-N 2.99Å; T67-G70 VanDerWaalsContact O-N 3.12Å; T67-Y71 HydrophobicContact CG2-CE2 4.2Å
68	L	98.3	Very high	98.3	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-44.2	-179.1	178.5	58.9	0	0	0	112.5	F43 W47 F51 G64 M65 G70 Y71 L73 P75 I79	F43-L68 HydrophobicContact CE1-CD1 4.25Å; F43-L68 HydrophobicContact CZ-CD1 4.11Å; W47-L68 HydrophobicContact CD2-CB 4.48Å; W47-L68 HydrophobicContact CD2-CD1 3.98Å; W47-L68 HydrophobicContact CD2-CD2 4.48Å; W47-L68 HydrophobicContact CE3-CB 4.37Å; W47-L68 HydrophobicContact CE3-CD2 4.42Å; W47-L68 HydrophobicContact CG-CD1 4.15Å; W47-L68 HydrophobicContact CH2-CB 3.97Å; W47-L68 HydrophobicContact CZ2-CB 4.1Å; W47-L68 HydrophobicContact CZ2-CD1 4.36Å; W47-L68 HydrophobicContact CZ3-CB 4.11Å; F51-L68 HydrophobicContact CE2-CD2 3.98Å; F51-L68 HydrophobicContact CZ-CD2 4.43Å; G64-L68 VanDerWaalsContact O-CB 3.31Å; G64-L68 WeakPolarHBondContact O-CB 3.06Å; G64-L68 PolarHBondContact O-N 3.1Å; M65-L68 HydrophobicContact CE-CD2 4.49Å; M65-L68 PolarHBondContact O-N 3.28Å; M65-L68 HydrophobicContact SD-CD2 4.41Å; L68-G70 PolarHBondContact O-N 3.33Å; L68-Y71 HydrophobicContact CD1-CD2 4.42Å; L68-Y71 WeakPolarHBondContact O-CD2 3.38Å; L68-Y71 PolarHBondContact O-N 2.94Å; L68-L73 HydrophobicContact CD1-CD1 4.43Å; L68-P75 HydrophobicContact CD1-CB 4.42Å; L68-P75 HydrophobicContact CD1-CG 4.15Å; L68-P75 HydrophobicContact CD2-CB 3.91Å; L68-P75 HydrophobicContact CD2-CG 3.79Å; L68-P75 HydrophobicContact CG-CB 4.26Å; L68-P75 HydrophobicContact CG-CG 3.72Å; L68-I79 HydrophobicContact CD2-CG2 3.64Å
69	I	97.4	Very high	98.3	Very high	54 Å²	54	60.2 Å²	60.2	28%	0.277	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.5	177.2	66.1	179.3	0	0	0	113.2	M65 Y71 A102 K106	M65-I69 HydrophobicContact CE-CG2 4.3Å; M65-I69 WeakPolarHBondContact O-CG1 3.35Å; M65-I69 WeakPolarHBondContact O-CG2 3.26Å; M65-I69 PolarHBondContact O-N 3.13Å; I69-Y71 VanDerWaalsContact C-N 3.29Å; I69-Y71 PolarHBondContact O-N 3.22Å; I69-A102 HydrophobicContact CG2-CB 4.41Å; I69-K106 HydrophobicContact CB-CD 4.2Å; I69-K106 HydrophobicContact CB-CG 4.28Å; I69-K106 HydrophobicContact CG2-CG 4.33Å; I69-K106 WeakPolarHBondContact O-CD 3.45Å; I69-K106 WeakPolarHBondContact O-CE 3.48Å; I69-K106 PolarHBondContact O-NZ 3.47Å
70	G	97.6	Very high	98.3	Very high	67 Å²	67	52.6 Å²	52.6	69%	0.691	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.5	177.4	0	0	0	0	0	114.2	T67 L68	T67-G70 PolarHBondContact O-N 2.99Å; T67-G70 VanDerWaalsContact O-N 3.12Å; L68-G70 PolarHBondContact O-N 3.33Å
71	Y	98	Very high	98.3	Very high	91 Å²	91	52.7 Å²	52.7	36%	0.357	27%	0.273	S	S	.	.	S	Bend	trans	-77.3	154.6	173.4	-65.2	-75.5	0	0	0	111.4	F43 W47 T67 L68 I69 L73 K106	F43-Y71 HydrophobicContact CE2-CD1 4.33Å; F43-Y71 HydrophobicContact CE2-CD2 4.09Å; F43-Y71 HydrophobicContact CE2-CE1 4.19Å; F43-Y71 AromaticContact CE2-CE2 3.97Å; F43-Y71 HydrophobicContact CE2-CE2 3.97Å; F43-Y71 HydrophobicContact CE2-CG 4.28Å; F43-Y71 AromaticContact CZ-CD2 3.82Å; F43-Y71 HydrophobicContact CZ-CD2 3.82Å; F43-Y71 HydrophobicContact CZ-CE2 4.04Å; F43-Y71 HydrophobicContact CZ-CG 4.15Å; W47-Y71 AromaticContact CZ2-CE2 3.85Å; W47-Y71 HydrophobicContact CZ2-CE2 3.85Å; T67-Y71 HydrophobicContact CG2-CE2 4.2Å; L68-Y71 HydrophobicContact CD1-CD2 4.42Å; L68-Y71 WeakPolarHBondContact O-CD2 3.38Å; L68-Y71 PolarHBondContact O-N 2.94Å; I69-Y71 VanDerWaalsContact C-N 3.29Å; I69-Y71 PolarHBondContact O-N 3.22Å; Y71-L73 PolarHBondContact O-N 3.31Å; Y71-K106 PolarHBondContact O-NZ 3.33Å
72	D	97.2	Very high	98.4	Very high	171 Å²	171	52.8 Å²	52.8	91%	0.914	27%	0.274	S	S	*	.	S	Bend	trans	-81.5	61.7	176	-166.9	23.2	0	0	0	111.3
73	L	97.1	Very high	98.4	Very high	57 Å²	57	47 Å²	47	30%	0.298	25%	0.252	S	S	.	.	S	Bend	trans	-155.1	162.9	178.8	59.9	86.2	0	0	0	110.8	F43 L68 Y71 P75 K106	F43-L73 HydrophobicContact CE1-CD1 4.5Å; F43-L73 HydrophobicContact CE1-CD2 3.72Å; F43-L73 HydrophobicContact CZ-CD2 3.73Å; L68-L73 HydrophobicContact CD1-CD1 4.43Å; Y71-L73 PolarHBondContact O-N 3.31Å; L73-P75 HydrophobicContact CD1-CG 4.21Å; L73-K106 WeakPolarHBondContact O-CE 3.28Å
74	V	98.4	Very high	98.4	Very high	32 Å²	32	42.1 Å²	42.1	19%	0.194	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-95.9	128.8	161	-178.6	0	0	0	0	107.5	V103 K106 A107 I113	V74-V103 HydrophobicContact CG1-CG1 3.86Å; V74-K106 HydrophobicContact CG2-CB 4.24Å; V74-A107 HydrophobicContact CG2-CB 4.3Å; V74-I113 HydrophobicContact CB-CG2 4.06Å; V74-I113 HydrophobicContact CG1-CG2 3.82Å; V74-I113 HydrophobicContact CG2-CD1 4.25Å; V74-I113 HydrophobicContact CG2-CG2 4.06Å
75	P	98.5	Very high	98.4	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.013	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-63.4	139.4	-177.6	-24.6	35.7	0	0	0	113.2	L68 L73 L80	L68-P75 HydrophobicContact CD1-CB 4.42Å; L68-P75 HydrophobicContact CD1-CG 4.15Å; L68-P75 HydrophobicContact CD2-CB 3.91Å; L68-P75 HydrophobicContact CD2-CG 3.79Å; L68-P75 HydrophobicContact CG-CB 4.26Å; L68-P75 HydrophobicContact CG-CG 3.72Å; L73-P75 HydrophobicContact CD1-CG 4.21Å; P75-L80 HydrophobicContact CB-CD2 3.98Å; P75-L80 HydrophobicContact CB-CG 4.16Å; P75-L80 HydrophobicContact CG-CD2 4.44Å
76	E	98.7	Very high	98.4	Very high	83 Å²	83	45 Å²	45	39%	0.388	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-59.8	145.6	176.8	-77.1	-66.9	149.4	0	0	112.4	K78 I79 L80	E76-K78 HydrophobicContact CB-CG 4.06Å; E76-K78 PolarHBondContact O-N 2.95Å; E76-K78 VanDerWaalsContact O-N 3.11Å; E76-I79 HydrophobicContact CB-CD1 4.24Å; E76-I79 HydrophobicContact CB-CG1 4.44Å; E76-I79 WeakPolarHBondContact O-CB 3.31Å; E76-I79 PolarHBondContact O-N 3.42Å; E76-L80 PolarHBondContact O-N 2.91Å
77	P	98.8	Very high	98.4	Very high	14 Å²	14	40 Å²	40	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-53.6	-35.2	-179.8	-28.8	36.5	0	0	0	114.1	I79 L80 D81 Y116 E120 L121	P77-I79 VanDerWaalsContact C-N 3.34Å; P77-I79 PolarHBondContact O-N 2.94Å; P77-L80 PolarHBondContact O-N 2.91Å; P77-D81 PolarHBondContact O-N 3.25Å; P77-Y116 HydrophobicContact CG-CE1 4.14Å; P77-E120 HydrophobicContact CB-CB 3.7Å; P77-E120 HydrophobicContact CG-CB 3.76Å; P77-E120 HydrophobicContact CG-CG 4.1Å; P77-L121 HydrophobicContact CB-CD2 4.3Å; P77-L121 HydrophobicContact CB-CG 4.4Å; P77-L121 WeakPolarHBondContact O-CD2 3.38Å
78	K	98.7	Very high	98.4	Very high	99 Å²	99	44.1 Å²	44.1	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-62.6	-36	175.5	61	-172.9	166.2	175.9	0	113.4	D44 V48 E76 S82	D44-K78 WeakPolarHBondContact OD2-CE 3.35Å; D44-K78 IonicContact OD2-NZ 3.71Å; D44-K78 PolarHBondContact OD2-NZ 3.09Å; V48-K78 HydrophobicContact CG2-CB 4.31Å; V48-K78 HydrophobicContact CG2-CG 4.06Å; E76-K78 HydrophobicContact CB-CG 4.06Å; E76-K78 PolarHBondContact O-N 2.95Å; E76-K78 VanDerWaalsContact O-N 3.11Å; K78-S82 PolarHBondContact O-N 3.05Å
79	I	98.8	Very high	98.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-46.7	174.5	-63	167.4	0	0	0	108.8	D44 W47 V48 F51 L68 E76 P77 D81 S82 A83	D44-I79 HydrophobicContact CB-CD1 4.42Å; D44-I79 WeakPolarHBondContact OD1-CD1 3.36Å; W47-I79 HydrophobicContact CB-CD1 3.88Å; W47-I79 HydrophobicContact CB-CG1 3.89Å; W47-I79 HydrophobicContact CB-CG2 3.79Å; W47-I79 HydrophobicContact CG-CD1 4.48Å; V48-I79 HydrophobicContact CG2-CG1 4.02Å; F51-I79 HydrophobicContact CD2-CG2 4.01Å; F51-I79 HydrophobicContact CE2-CG2 3.92Å; L68-I79 HydrophobicContact CD2-CG2 3.64Å; E76-I79 HydrophobicContact CB-CD1 4.24Å; E76-I79 HydrophobicContact CB-CG1 4.44Å; E76-I79 WeakPolarHBondContact O-CB 3.31Å; E76-I79 PolarHBondContact O-N 3.42Å; P77-I79 VanDerWaalsContact C-N 3.34Å; P77-I79 PolarHBondContact O-N 2.94Å; I79-D81 PolarHBondContact O-N 3.35Å; I79-S82 PolarHBondContact O-N 3.45Å; I79-S82 PolarHBondContact O-OG 3.26Å; I79-A83 PolarHBondContact O-N 2.99Å
80	L	98.8	Very high	98.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-39.8	179.9	-61.4	174.8	0	0	0	112.4	P75 E76 P77 S82 A83 L84 I99 V103 V117 L121	P75-L80 HydrophobicContact CB-CD2 3.98Å; P75-L80 HydrophobicContact CB-CG 4.16Å; P75-L80 HydrophobicContact CG-CD2 4.44Å; E76-L80 PolarHBondContact O-N 2.91Å; P77-L80 PolarHBondContact O-N 2.91Å; L80-S82 PolarHBondContact O-N 3.48Å; L80-A83 PolarHBondContact O-N 3.49Å; L80-A83 VanDerWaalsContact O-N 3.16Å; L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.26Å; L80-L84 WeakPolarHBondContact O-CG 3.45Å; L80-L84 PolarHBondContact O-N 2.98Å; L80-I99 HydrophobicContact CD2-CG2 3.89Å; L80-V103 HydrophobicContact CD1-CB 4.47Å; L80-V103 HydrophobicContact CD1-CG1 4.06Å; L80-V103 HydrophobicContact CD1-CG2 3.63Å; L80-V103 HydrophobicContact CD2-CG2 3.57Å; L80-V103 HydrophobicContact CG-CG2 4.26Å; L80-V117 HydrophobicContact CD1-CG1 3.48Å; L80-V117 VanDerWaalsContact CD1-CG1 3.48Å; L80-L121 HydrophobicContact CB-CD1 3.82Å; L80-L121 HydrophobicContact CB-CD2 4.16Å; L80-L121 HydrophobicContact CD1-CD1 4.02Å
81	D	98.9	Very high	98.5	Very high	39 Å²	39	51 Å²	51	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-54.9	-51.7	173.8	174.1	65.6	0	0	0	111.2	P77 I79 A83 L84 R85 L121 T124	P77-D81 PolarHBondContact O-N 3.25Å; I79-D81 PolarHBondContact O-N 3.35Å; D81-A83 VanDerWaalsContact C-N 3.31Å; D81-A83 PolarHBondContact O-N 2.82Å; D81-L84 PolarHBondContact O-N 3.16Å; D81-R85 WeakPolarHBondContact O-CB 3.42Å; D81-R85 WeakPolarHBondContact O-CG 3.5Å; D81-R85 PolarHBondContact O-N 3.32Å; D81-R85 IonicContact OD1-CZ 3.55Å; D81-R85 IonicContact OD1-NE 3.7Å; D81-R85 PolarHBondContact OD1-NE 2.8Å; D81-R85 IonicContact OD1-NH2 2.78Å; D81-R85 IonicContact OD2-NE 2.8Å; D81-R85 PolarHBondContact OD2-NE 3.21Å; D81-R85 VanDerWaalsContact OD2-NE 3.17Å; D81-L121 HydrophobicContact CB-CD2 4.1Å; D81-T124 WeakPolarHBondContact OD1-CB 3.38Å; D81-T124 WeakPolarHBondContact OD1-CG2 3.28Å; D81-T124 PolarHBondContact OD1-OG1 2.91Å
82	S	98.9	Very high	98.6	Very high	5 Å²	5	49 Å²	49	4%	0.035	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-37.9	176.7	65.2	0	0	0	0	113.3	F51 K78 I79 L80 A86	F51-S82 WeakPolarHBondContact CB-OG 3.45Å; K78-S82 PolarHBondContact O-N 3.05Å; I79-S82 PolarHBondContact O-N 3.45Å; I79-S82 PolarHBondContact O-OG 3.26Å; L80-S82 PolarHBondContact O-N 3.48Å; S82-A86 PolarHBondContact O-N 3.2Å
83	A	98.9	Very high	98.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.9	-42.6	176	0	0	0	0	0	112.3	F51 M65 I79 L80 D81 R85 A86 C87 I99	F51-A83 HydrophobicContact CB-CB 4.37Å; F51-A83 HydrophobicContact CD1-CB 4.06Å; F51-A83 HydrophobicContact CD2-CB 3.95Å; F51-A83 HydrophobicContact CE1-CB 4.32Å; F51-A83 HydrophobicContact CE2-CB 4.2Å; F51-A83 HydrophobicContact CG-CB 3.87Å; F51-A83 HydrophobicContact CZ-CB 4.39Å; M65-A83 HydrophobicContact SD-CB 4.1Å; I79-A83 PolarHBondContact O-N 2.99Å; L80-A83 PolarHBondContact O-N 3.49Å; L80-A83 VanDerWaalsContact O-N 3.16Å; D81-A83 VanDerWaalsContact C-N 3.31Å; D81-A83 PolarHBondContact O-N 2.82Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 3.48Å; A83-A86 WeakPolarHBondContact O-CA 3.26Å; A83-A86 VanDerWaalsContact O-CB 3.29Å; A83-A86 WeakPolarHBondContact O-CB 3.49Å; A83-A86 PolarHBondContact O-N 3.42Å; A83-A86 VanDerWaalsContact O-N 3.09Å; A83-C87 PolarHBondContact O-N 2.91Å; A83-C87 PolarHBondContact O-SG 3.18Å; A83-I99 HydrophobicContact CB-CD1 4.32Å
84	L	98.9	Very high	98.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-39.1	176	-67.2	174.5	0	0	0	111.4	L80 D81 A86 C87 R88 A96 L121 T124 L125 L128 I130	L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.26Å; L80-L84 WeakPolarHBondContact O-CG 3.45Å; L80-L84 PolarHBondContact O-N 2.98Å; D81-L84 PolarHBondContact O-N 3.16Å; L84-A86 VanDerWaalsContact C-N 3.29Å; L84-A86 PolarHBondContact O-N 2.69Å; L84-C87 WeakPolarHBondContact O-CB 3.41Å; L84-C87 PolarHBondContact O-N 3.34Å; L84-R88 PolarHBondContact O-N 3.16Å; L84-A96 HydrophobicContact CD2-CB 3.79Å; L84-L121 HydrophobicContact CD1-CD1 4.16Å; L84-L121 HydrophobicContact CD1-CD2 4.41Å; L84-T124 HydrophobicContact CB-CG2 4.42Å; L84-T124 HydrophobicContact CD1-CG2 4.39Å; L84-L125 HydrophobicContact CD1-CD2 3.96Å; L84-L128 HydrophobicContact CB-CD1 4.28Å; L84-I130 HydrophobicContact CB-CD1 4.23Å; L84-I130 HydrophobicContact CD2-CD1 4.19Å
85	R	98.9	Very high	98.7	Very high	76 Å²	76	45.9 Å²	45.9	29%	0.287	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-34.4	171.8	-69.7	176.5	-174.8	-74.7	-5.6	111.6	D81 A83 R88 R89 E127 L128	D81-R85 WeakPolarHBondContact O-CB 3.42Å; D81-R85 WeakPolarHBondContact O-CG 3.5Å; D81-R85 PolarHBondContact O-N 3.32Å; D81-R85 IonicContact OD1-CZ 3.55Å; D81-R85 IonicContact OD1-NE 3.7Å; D81-R85 PolarHBondContact OD1-NE 2.8Å; D81-R85 IonicContact OD1-NH2 2.78Å; D81-R85 IonicContact OD2-NE 2.8Å; D81-R85 PolarHBondContact OD2-NE 3.21Å; D81-R85 VanDerWaalsContact OD2-NE 3.17Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 3.48Å; R85-R88 WeakPolarHBondContact O-CB 3.45Å; R85-R88 PolarHBondContact O-N 3.33Å; R85-R89 WeakPolarHBondContact O-CG 3.29Å; R85-R89 PolarHBondContact O-N 2.97Å; R85-R89 VanDerWaalsContact O-N 3.07Å; R85-R89 PolarHBondContact O-NH1 3.3Å; R85-E127 IonicContact CZ-OE1 3.56Å; R85-E127 IonicContact CZ-OE2 3.55Å; R85-E127 IonicContact NH1-OE1 3.02Å; R85-E127 PolarHBondContact NH1-OE1 2.73Å; R85-E127 IonicContact NH1-OE2 3.68Å; R85-E127 PolarHBondContact NH1-OE2 2.84Å; R85-E127 IonicContact NH2-OE1 3.94Å; R85-E127 IonicContact NH2-OE2 3.17Å; R85-E127 PolarHBondContact NH2-OE2 3.29Å; R85-L128 HydrophobicContact CG-CD1 4.12Å
86	A	98.9	Very high	98.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-43.7	171.8	0	0	0	0	0	111.9	I56 L61 S82 A83 L84 R88 R89 L90	I56-A86 HydrophobicContact CG2-CB 3.88Å; L61-A86 HydrophobicContact CD1-CB 4.14Å; S82-A86 PolarHBondContact O-N 3.2Å; A83-A86 WeakPolarHBondContact O-CA 3.26Å; A83-A86 VanDerWaalsContact O-CB 3.29Å; A83-A86 WeakPolarHBondContact O-CB 3.49Å; A83-A86 PolarHBondContact O-N 3.42Å; A83-A86 VanDerWaalsContact O-N 3.09Å; L84-A86 VanDerWaalsContact C-N 3.29Å; L84-A86 PolarHBondContact O-N 2.69Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.37Å; A86-R89 PolarHBondContact O-N 3.24Å; A86-R89 VanDerWaalsContact O-N 3.13Å; A86-L90 PolarHBondContact O-N 3.35Å
87	C	98.8	Very high	98.7	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-55.6	-41.9	172.2	-67.4	0	0	0	0	111.9	A83 L84 L90 N91 D92 A96	A83-C87 PolarHBondContact O-N 2.91Å; A83-C87 PolarHBondContact O-SG 3.18Å; L84-C87 WeakPolarHBondContact O-CB 3.41Å; L84-C87 PolarHBondContact O-N 3.34Å; C87-L90 CarbonylContact O-C 3.5Å; C87-L90 PolarHBondContact O-N 3.41Å; C87-N91 PolarHBondContact O-N 3.47Å; C87-D92 WeakPolarHBondContact CB-O 3.21Å; C87-D92 PolarHBondContact O-N 3.3Å; C87-A96 HydrophobicContact CB-CB 3.84Å
88	R	98.6	Very high	98.7	Very high	135 Å²	135	49.2 Å²	49.2	51%	0.509	24%	0.236	S	C	.	.	H	α-helix	trans	-62.7	-43.2	175.5	-176.7	65.1	-101.7	-173.7	-8.7	112.8	L84 R85 A86 L90 N91 L128	L84-R88 PolarHBondContact O-N 3.16Å; R85-R88 WeakPolarHBondContact O-CB 3.45Å; R85-R88 PolarHBondContact O-N 3.33Å; A86-R88 VanDerWaalsContact C-N 3.27Å; A86-R88 PolarHBondContact O-N 3.37Å; R88-L90 VanDerWaalsContact C-N 3.27Å; R88-L90 PolarHBondContact O-N 2.91Å; R88-N91 PolarHBondContact NH2-OD1 3.03Å; R88-N91 PolarHBondContact O-N 3.46Å; R88-N91 VanDerWaalsContact O-N 3.14Å; R88-L128 HydrophobicContact CB-CD1 4.41Å; R88-L128 HydrophobicContact CB-CD2 4.29Å; R88-L128 HydrophobicContact CG-CD2 4.05Å
89	R	98.6	Very high	98.7	Very high	96 Å²	96	45 Å²	45	36%	0.362	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-36.7	176.2	-67.4	-167.4	-56.1	-79.8	6.8	111.8	F51 K53 P54 I56 R85 A86 N91	F51-R89 PolarHBondContact O-NH2 3.11Å; K53-R89 PolarHBondContact O-NH2 3.24Å; P54-R89 PolarHBondContact O-NE 2.94Å; I56-R89 VanDerWaalsContact CG2-NH2 3.34Å; R85-R89 WeakPolarHBondContact O-CG 3.29Å; R85-R89 PolarHBondContact O-N 2.97Å; R85-R89 VanDerWaalsContact O-N 3.07Å; R85-R89 PolarHBondContact O-NH1 3.3Å; A86-R89 PolarHBondContact O-N 3.24Å; A86-R89 VanDerWaalsContact O-N 3.13Å; R89-N91 VanDerWaalsContact C-N 3.3Å
90	L	98.6	Very high	98.7	Very high	52 Å²	52	45 Å²	45	27%	0.272	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-3.8	177.1	-72.1	168.3	0	0	0	114	I56 A58 L61 A86 C87 R88 D92	I56-L90 WeakPolarHBondContact O-CD2 3.46Å; A58-L90 HydrophobicContact CB-CD2 4.5Å; L61-L90 HydrophobicContact CB-CD1 3.93Å; L61-L90 HydrophobicContact CD2-CD1 3.75Å; L61-L90 HydrophobicContact CG-CD1 4.42Å; A86-L90 PolarHBondContact O-N 3.35Å; C87-L90 CarbonylContact O-C 3.5Å; C87-L90 PolarHBondContact O-N 3.41Å; R88-L90 VanDerWaalsContact C-N 3.27Å; R88-L90 PolarHBondContact O-N 2.91Å; L90-D92 HydrophobicContact CB-CB 4.43Å; L90-D92 PolarHBondContact O-N 3.04Å
91	N	98.5	Very high	98.7	Very high	118 Å²	118	47.5 Å²	47.5	63%	0.631	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	37.1	-173.1	-58.6	-65.7	0	0	0	113.5	C87 R88 R89	C87-N91 PolarHBondContact O-N 3.47Å; R88-N91 PolarHBondContact NH2-OD1 3.03Å; R88-N91 PolarHBondContact O-N 3.46Å; R88-N91 VanDerWaalsContact O-N 3.14Å; R89-N91 VanDerWaalsContact C-N 3.3Å
92	D	98.4	Very high	98.6	Very high	48 Å²	48	46.4 Å²	46.4	26%	0.257	23%	0.226	S	C	.	.			trans	-113.2	86.2	-177.2	-171.6	-9.8	0	0	0	111.2	C87 L90 A94 S95 A96	C87-D92 WeakPolarHBondContact CB-O 3.21Å; C87-D92 PolarHBondContact O-N 3.3Å; L90-D92 HydrophobicContact CB-CB 4.43Å; L90-D92 PolarHBondContact O-N 3.04Å; D92-A94 PolarHBondContact OD1-N 3.27Å; D92-S95 VanDerWaalsContact CG-CB 3.42Å; D92-S95 WeakPolarHBondContact OD1-CB 3.5Å; D92-S95 PolarHBondContact OD1-N 2.81Å; D92-S95 PolarHBondContact OD1-OG 3.39Å; D92-S95 VanDerWaalsContact OD2-CB 3.26Å; D92-S95 WeakPolarHBondContact OD2-CB 3.43Å; D92-S95 PolarHBondContact OD2-OG 3.34Å; D92-A96 PolarHBondContact O-N 3.3Å
93	L	98.3	Very high	98.6	Very high	96 Å²	96	46.2 Å²	46.2	50%	0.503	23%	0.225	S	C	.	.	H	α-helix	trans	-68.1	-36.6	178.3	178.9	62.4	0	0	0	112.3	S95 A96 I97 I130	L93-S95 PolarHBondContact O-N 3.19Å; L93-A96 WeakPolarHBondContact O-CB 3.36Å; L93-A96 PolarHBondContact O-N 2.98Å; L93-A96 VanDerWaalsContact O-N 3.16Å; L93-I97 HydrophobicContact CD1-CD1 4.33Å; L93-I97 HydrophobicContact CG-CD1 4.02Å; L93-I97 PolarHBondContact O-N 3.36Å; L93-I97 VanDerWaalsContact O-N 3.15Å; L93-I130 HydrophobicContact CD1-CG1 4.13Å; L93-I130 HydrophobicContact CD1-CG2 4.44Å
94	A	98.3	Very high	98.6	Very high	69 Å²	69	49.1 Å²	49.1	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-64.2	-42	-177.8	0	0	0	0	0	111.3	D92 A96 I97 R98	D92-A94 PolarHBondContact OD1-N 3.27Å; A94-A96 VanDerWaalsContact C-N 3.31Å; A94-A96 PolarHBondContact O-N 3.3Å; A94-I97 PolarHBondContact O-N 3.35Å; A94-R98 WeakPolarHBondContact O-CB 3.26Å; A94-R98 PolarHBondContact O-N 3.48Å
95	S	98.6	Very high	98.6	Very high	29 Å²	29	55.3 Å²	55.3	20%	0.203	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-36.7	174	-71.5	0	0	0	0	112.5	D92 L93 R98 I99	D92-S95 VanDerWaalsContact CG-CB 3.42Å; D92-S95 WeakPolarHBondContact OD1-CB 3.5Å; D92-S95 PolarHBondContact OD1-N 2.81Å; D92-S95 PolarHBondContact OD1-OG 3.39Å; D92-S95 VanDerWaalsContact OD2-CB 3.26Å; D92-S95 WeakPolarHBondContact OD2-CB 3.43Å; D92-S95 PolarHBondContact OD2-OG 3.34Å; L93-S95 PolarHBondContact O-N 3.19Å; S95-R98 PolarHBondContact O-N 2.67Å; S95-I99 WeakPolarHBondContact O-CG1 3.25Å; S95-I99 PolarHBondContact O-N 2.7Å
96	A	98.8	Very high	98.5	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-46.2	177	0	0	0	0	0	111.9	L84 C87 D92 L93 A94 R98 I99 L100 I130	L84-A96 HydrophobicContact CD2-CB 3.79Å; C87-A96 HydrophobicContact CB-CB 3.84Å; D92-A96 PolarHBondContact O-N 3.3Å; L93-A96 WeakPolarHBondContact O-CB 3.36Å; L93-A96 PolarHBondContact O-N 2.98Å; L93-A96 VanDerWaalsContact O-N 3.16Å; A94-A96 VanDerWaalsContact C-N 3.31Å; A94-A96 PolarHBondContact O-N 3.3Å; A96-R98 VanDerWaalsContact C-N 3.34Å; A96-I99 WeakPolarHBondContact O-CB 3.47Å; A96-I99 PolarHBondContact O-N 3.47Å; A96-L100 PolarHBondContact O-N 2.97Å; A96-I130 HydrophobicContact CB-CD1 4.02Å; A96-I130 HydrophobicContact CB-CG1 4.44Å; A96-I130 HydrophobicContact CB-CG2 4.26Å
97	I	98.8	Very high	98.5	Very high	22 Å²	22	54.7 Å²	54.7	11%	0.113	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176	-64.2	159.1	0	0	0	110.2	L93 A94 I99 L100 E101 I130 P133 L136 I138	L93-I97 HydrophobicContact CD1-CD1 4.33Å; L93-I97 HydrophobicContact CG-CD1 4.02Å; L93-I97 PolarHBondContact O-N 3.36Å; L93-I97 VanDerWaalsContact O-N 3.15Å; A94-I97 PolarHBondContact O-N 3.35Å; I97-I99 VanDerWaalsContact C-N 3.26Å; I97-I99 PolarHBondContact O-N 3.47Å; I97-L100 WeakPolarHBondContact O-CB 3.33Å; I97-L100 PolarHBondContact O-N 2.9Å; I97-E101 PolarHBondContact O-N 3.09Å; I97-E101 VanDerWaalsContact O-N 3.1Å; I97-I130 HydrophobicContact CG1-CG2 4.44Å; I97-P133 HydrophobicContact CG2-CG 4.21Å; I97-L136 HydrophobicContact CD1-CD1 3.54Å; I97-L136 HydrophobicContact CG1-CD1 4.13Å; I97-L136 HydrophobicContact CG2-CD1 4.17Å; I97-I138 HydrophobicContact CG2-CD1 3.9Å
98	R	98.6	Very high	98.4	Very high	146 Å²	146	57 Å²	57	55%	0.551	30%	0.295	S	S	*	.	H	α-helix	trans	-63.3	-31.7	179.4	-172.9	59.9	-177.6	145.5	9.4	113.3	A94 S95 A96 L100 E101 A102	A94-R98 WeakPolarHBondContact O-CB 3.26Å; A94-R98 PolarHBondContact O-N 3.48Å; S95-R98 PolarHBondContact O-N 2.67Å; A96-R98 VanDerWaalsContact C-N 3.34Å; R98-L100 VanDerWaalsContact C-N 3.35Å; R98-E101 WeakPolarHBondContact CA-OE2 3.4Å; R98-E101 WeakPolarHBondContact CD-OE2 3.36Å; R98-E101 IonicContact CZ-OE1 2.77Å; R98-E101 IonicContact NH1-OE1 3.72Å; R98-E101 PolarHBondContact NH1-OE1 3.21Å; R98-E101 IonicContact NH1-OE2 2.79Å; R98-E101 PolarHBondContact O-N 3.3Å; R98-A102 WeakPolarHBondContact O-CB 3.37Å; R98-A102 PolarHBondContact O-N 3Å
99	I	98.7	Very high	98.3	Very high	10 Å²	10	56 Å²	56	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-43.2	172.2	-72.2	165.7	0	0	0	110.3	M65 L80 A83 S95 A96 I97 A102 V103	M65-I99 HydrophobicContact CE-CB 4.42Å; M65-I99 HydrophobicContact CE-CG1 3.94Å; M65-I99 HydrophobicContact CE-CG2 3.89Å; M65-I99 HydrophobicContact CG-CD1 3.95Å; M65-I99 HydrophobicContact CG-CG1 3.97Å; M65-I99 HydrophobicContact SD-CD1 4.04Å; M65-I99 HydrophobicContact SD-CG1 4.06Å; M65-I99 HydrophobicContact SD-CG2 4.43Å; L80-I99 HydrophobicContact CD2-CG2 3.89Å; A83-I99 HydrophobicContact CB-CD1 4.32Å; S95-I99 WeakPolarHBondContact O-CG1 3.25Å; S95-I99 PolarHBondContact O-N 2.7Å; A96-I99 WeakPolarHBondContact O-CB 3.47Å; A96-I99 PolarHBondContact O-N 3.47Å; I97-I99 VanDerWaalsContact C-N 3.26Å; I97-I99 PolarHBondContact O-N 3.47Å; I99-A102 PolarHBondContact O-N 3.47Å; I99-V103 HydrophobicContact CG2-CG2 4.49Å; I99-V103 VanDerWaalsContact O-CG2 3.26Å; I99-V103 WeakPolarHBondContact O-CG2 3.03Å; I99-V103 PolarHBondContact O-N 3.48Å
100	L	98.7	Very high	98.3	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-42.4	177.9	-59.8	178.9	0	0	0	111.7	A96 I97 R98 A102 V103 K104 Y114 I118 L121 L125 I130 P133	A96-L100 PolarHBondContact O-N 2.97Å; I97-L100 WeakPolarHBondContact O-CB 3.33Å; I97-L100 PolarHBondContact O-N 2.9Å; R98-L100 VanDerWaalsContact C-N 3.35Å; L100-A102 PolarHBondContact O-N 2.93Å; L100-V103 PolarHBondContact O-N 3.29Å; L100-K104 PolarHBondContact O-N 3.45Å; L100-Y114 VanDerWaalsContact O-CE2 3.22Å; L100-Y114 WeakPolarHBondContact O-CE2 3.36Å; L100-I118 HydrophobicContact CD2-CD1 4.18Å; L100-L121 HydrophobicContact CD2-CD1 4.17Å; L100-L125 HydrophobicContact CD1-CD2 4.01Å; L100-I130 HydrophobicContact CD1-CG2 4.33Å; L100-P133 HydrophobicContact CB-CG 4.07Å
101	E	98.6	Very high	98.2	Very high	53 Å²	53	62 Å²	62	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-59.2	-45.9	173.2	-65.1	173	66.8	0	0	111.7	I97 R98 V103 K104 D105 P133	I97-E101 PolarHBondContact O-N 3.09Å; I97-E101 VanDerWaalsContact O-N 3.1Å; R98-E101 WeakPolarHBondContact CA-OE2 3.4Å; R98-E101 WeakPolarHBondContact CD-OE2 3.36Å; R98-E101 IonicContact CZ-OE1 2.77Å; R98-E101 IonicContact NH1-OE1 3.72Å; R98-E101 PolarHBondContact NH1-OE1 3.21Å; R98-E101 IonicContact NH1-OE2 2.79Å; R98-E101 PolarHBondContact O-N 3.3Å; E101-V103 VanDerWaalsContact C-N 3.28Å; E101-V103 PolarHBondContact O-N 3.27Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 2.95Å; E101-D105 PolarHBondContact O-N 2.71Å; E101-P133 HydrophobicContact CG-CB 3.99Å; E101-P133 HydrophobicContact CG-CG 3.56Å
102	A	98.3	Very high	98.1	Very high	16 Å²	16	62.1 Å²	62.1	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-35.7	-179.8	0	0	0	0	0	111.9	I69 R98 I99 L100 D105 K106	I69-A102 HydrophobicContact CG2-CB 4.41Å; R98-A102 WeakPolarHBondContact O-CB 3.37Å; R98-A102 PolarHBondContact O-N 3Å; I99-A102 PolarHBondContact O-N 3.47Å; L100-A102 PolarHBondContact O-N 2.93Å; A102-D105 PolarHBondContact O-N 3.44Å; A102-K106 WeakPolarHBondContact O-CB 3.4Å; A102-K106 VanDerWaalsContact O-CG 3.25Å; A102-K106 WeakPolarHBondContact O-CG 3.43Å; A102-K106 PolarHBondContact O-N 2.89Å
103	V	98.3	Very high	98.1	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-67.4	-40.8	175.3	172.4	0	0	0	0	111.3	V74 L80 I99 L100 E101 K106 A107 Y114 V117	V74-V103 HydrophobicContact CG1-CG1 3.86Å; L80-V103 HydrophobicContact CD1-CB 4.47Å; L80-V103 HydrophobicContact CD1-CG1 4.06Å; L80-V103 HydrophobicContact CD1-CG2 3.63Å; L80-V103 HydrophobicContact CD2-CG2 3.57Å; L80-V103 HydrophobicContact CG-CG2 4.26Å; I99-V103 HydrophobicContact CG2-CG2 4.49Å; I99-V103 VanDerWaalsContact O-CG2 3.26Å; I99-V103 WeakPolarHBondContact O-CG2 3.03Å; I99-V103 PolarHBondContact O-N 3.48Å; L100-V103 PolarHBondContact O-N 3.29Å; E101-V103 VanDerWaalsContact C-N 3.28Å; E101-V103 PolarHBondContact O-N 3.27Å; V103-K106 PolarHBondContact O-N 2.68Å; V103-A107 PolarHBondContact O-N 3.43Å; V103-A107 VanDerWaalsContact O-N 3.16Å; V103-Y114 HydrophobicContact CG1-CD2 4.14Å; V103-V117 HydrophobicContact CG1-CB 4.43Å; V103-V117 HydrophobicContact CG1-CG1 4.06Å; V103-V117 HydrophobicContact CG1-CG2 4.32Å
104	K	98.2	Very high	98.1	Very high	61 Å²	61	58.5 Å²	58.5	27%	0.265	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-46	173.9	-172.3	-179.9	178.2	-178.6	0	111.3	L100 E101 A107 Y114 E134 D139	L100-K104 PolarHBondContact O-N 3.45Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 2.95Å; K104-A107 WeakPolarHBondContact O-CB 3.16Å; K104-A107 PolarHBondContact O-N 3.35Å; K104-Y114 HydrophobicContact CB-CD1 4.17Å; K104-Y114 HydrophobicContact CB-CD2 3.62Å; K104-Y114 HydrophobicContact CB-CE1 4.27Å; K104-Y114 HydrophobicContact CB-CE2 3.74Å; K104-Y114 HydrophobicContact CB-CG 3.83Å; K104-Y114 HydrophobicContact CD-CD1 4.11Å; K104-Y114 HydrophobicContact CD-CE1 3.98Å; K104-Y114 HydrophobicContact CG-CD1 3.92Å; K104-Y114 HydrophobicContact CG-CD2 4.24Å; K104-Y114 HydrophobicContact CG-CE1 4.21Å; K104-Y114 HydrophobicContact CG-CG 3.91Å; K104-E134 IonicContact NZ-OE1 2.68Å; K104-E134 PolarHBondContact NZ-OE1 3.06Å; K104-D139 IonicContact NZ-OD2 3.41Å; K104-D139 PolarHBondContact NZ-OXT 3.38Å
105	D	98.3	Very high	98.2	Very high	130 Å²	130	58.9 Å²	58.9	70%	0.695	31%	0.306	S	S	*	.	H	α-helix	trans	-62.1	-43.2	176	-177.2	67.2	0	0	0	111.9	E101 A102 A107 G108	E101-D105 PolarHBondContact O-N 2.71Å; A102-D105 PolarHBondContact O-N 3.44Å; D105-A107 PolarHBondContact O-N 2.95Å; D105-G108 PolarHBondContact O-N 2.68Å
106	K	97.9	Very high	98.2	Very high	57 Å²	57	63 Å²	63	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-26.9	177.5	-79.4	-61.5	-57.2	-175.3	0	114.3	I69 Y71 L73 V74 A102 V103 G108	I69-K106 HydrophobicContact CB-CD 4.2Å; I69-K106 HydrophobicContact CB-CG 4.28Å; I69-K106 HydrophobicContact CG2-CG 4.33Å; I69-K106 WeakPolarHBondContact O-CD 3.45Å; I69-K106 WeakPolarHBondContact O-CE 3.48Å; I69-K106 PolarHBondContact O-NZ 3.47Å; Y71-K106 PolarHBondContact O-NZ 3.33Å; L73-K106 WeakPolarHBondContact O-CE 3.28Å; V74-K106 HydrophobicContact CG2-CB 4.24Å; A102-K106 WeakPolarHBondContact O-CB 3.4Å; A102-K106 VanDerWaalsContact O-CG 3.25Å; A102-K106 WeakPolarHBondContact O-CG 3.43Å; A102-K106 PolarHBondContact O-N 2.89Å; V103-K106 PolarHBondContact O-N 2.68Å; K106-G108 PolarHBondContact O-N 2.77Å
107	A	97.8	Very high	98.1	Very high	5 Å²	5	63 Å²	63	4%	0.041	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.1	174.2	0	0	0	0	0	112.9	V74 V103 K104 D105 H110 I113	V74-A107 HydrophobicContact CG2-CB 4.3Å; V103-A107 PolarHBondContact O-N 3.43Å; V103-A107 VanDerWaalsContact O-N 3.16Å; K104-A107 WeakPolarHBondContact O-CB 3.16Å; K104-A107 PolarHBondContact O-N 3.35Å; D105-A107 PolarHBondContact O-N 2.95Å; A107-H110 WeakPolarHBondContact O-CB 3.46Å; A107-H110 PolarHBondContact O-CD2 2.8Å; A107-H110 PolarHBondContact O-N 3.08Å; A107-I113 HydrophobicContact CB-CB 3.97Å; A107-I113 HydrophobicContact CB-CD1 4.46Å; A107-I113 HydrophobicContact CB-CG2 4.37Å
108	G	97.1	Very high	98.1	Very high	51 Å²	51	63.7 Å²	63.7	53%	0.526	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	-125.1	177.4	0	0	0	0	0	112.5	D105 K106 H110	D105-G108 PolarHBondContact O-N 2.68Å; K106-G108 PolarHBondContact O-N 2.77Å; G108-H110 PolarHBondContact O-N 2.79Å
109	P	97.9	Very high	98.1	Very high	113 Å²	113	62.7 Å²	62.7	73%	0.734	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-10.1	-179.6	32.4	-35.4	0	0	0	114.2	K111	P109-K111 PolarHBondContact O-N 2.77Å; P109-K111 VanDerWaalsContact O-N 3.1Å
110	H	97.9	Very high	98.1	Very high	97 Å²	97	66.4 Å²	66.4	45%	0.449	34%	0.341	S	S	.	.			trans	-85.1	79.3	-174.4	-59.9	-78	0	0	0	111.4	A107 G108 E112 I113	A107-H110 WeakPolarHBondContact O-CB 3.46Å; A107-H110 PolarHBondContact O-CD2 2.8Å; A107-H110 PolarHBondContact O-N 3.08Å; G108-H110 PolarHBondContact O-N 2.79Å; H110-E112 VanDerWaalsContact C-OE2 3.23Å; H110-E112 WeakPolarHBondContact CA-OE2 3.36Å; H110-E112 IonicContact CG-OE1 2.9Å; H110-E112 IonicContact ND1-OE1 3.69Å; H110-E112 PolarHBondContact O-N 2.91Å; H110-E112 VanDerWaalsContact O-N 3.11Å; H110-I113 HydrophobicContact CB-CD1 3.45Å; H110-I113 VanDerWaalsContact CB-CD1 3.45Å; H110-I113 HydrophobicContact CB-CG1 3.82Å; H110-I113 PolarHBondContact O-N 2.79Å
111	K	95.6	Very high	98.1	Very high	177 Å²	177	66.5 Å²	66.5	77%	0.77	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.8	-172.6	-63.9	-175.4	178.5	-175.8	0	114.5	P109 P115	P109-K111 PolarHBondContact O-N 2.77Å; P109-K111 VanDerWaalsContact O-N 3.1Å; K111-P115 WeakPolarHBondContact O-CD 3.42Å; K111-P115 WeakPolarHBondContact O-CG 3.46Å
112	E	97.8	Very high	98.1	Very high	122 Å²	122	70.6 Å²	70.6	57%	0.57	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.7	179	66.6	-78.1	-176.4	0	0	113.6	H110 Y116	H110-E112 VanDerWaalsContact C-OE2 3.23Å; H110-E112 WeakPolarHBondContact CA-OE2 3.36Å; H110-E112 IonicContact CG-OE1 2.9Å; H110-E112 IonicContact ND1-OE1 3.69Å; H110-E112 PolarHBondContact O-N 2.91Å; H110-E112 VanDerWaalsContact O-N 3.11Å; E112-Y116 PolarHBondContact O-N 3.21Å
113	I	98.4	Very high	98.2	Very high	48 Å²	48	74 Å²	74	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-72.2	-48.9	-171.9	-58.7	177.9	0	0	0	111.2	V74 A107 H110 Y116 V117	V74-I113 HydrophobicContact CB-CG2 4.06Å; V74-I113 HydrophobicContact CG1-CG2 3.82Å; V74-I113 HydrophobicContact CG2-CD1 4.25Å; V74-I113 HydrophobicContact CG2-CG2 4.06Å; A107-I113 HydrophobicContact CB-CB 3.97Å; A107-I113 HydrophobicContact CB-CD1 4.46Å; A107-I113 HydrophobicContact CB-CG2 4.37Å; H110-I113 HydrophobicContact CB-CD1 3.45Å; H110-I113 VanDerWaalsContact CB-CD1 3.45Å; H110-I113 HydrophobicContact CB-CG1 3.82Å; H110-I113 PolarHBondContact O-N 2.79Å; I113-Y116 WeakPolarHBondContact O-CB 3.38Å; I113-Y116 PolarHBondContact O-N 2.81Å; I113-V117 HydrophobicContact CG2-CG2 4.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.28Å; I113-V117 PolarHBondContact O-N 3.22Å
114	Y	98.5	Very high	98.2	Very high	20 Å²	20	74.5 Å²	74.5	8%	0.078	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-45.6	-176.7	-177.3	-110	0	0	0	113.2	L100 V103 K104 Y116 V117 I118 P133 E134	L100-Y114 VanDerWaalsContact O-CE2 3.22Å; L100-Y114 WeakPolarHBondContact O-CE2 3.36Å; V103-Y114 HydrophobicContact CG1-CD2 4.14Å; K104-Y114 HydrophobicContact CB-CD1 4.17Å; K104-Y114 HydrophobicContact CB-CD2 3.62Å; K104-Y114 HydrophobicContact CB-CE1 4.27Å; K104-Y114 HydrophobicContact CB-CE2 3.74Å; K104-Y114 HydrophobicContact CB-CG 3.83Å; K104-Y114 HydrophobicContact CD-CD1 4.11Å; K104-Y114 HydrophobicContact CD-CE1 3.98Å; K104-Y114 HydrophobicContact CG-CD1 3.92Å; K104-Y114 HydrophobicContact CG-CD2 4.24Å; K104-Y114 HydrophobicContact CG-CE1 4.21Å; K104-Y114 HydrophobicContact CG-CG 3.91Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 2.92Å; Y114-V117 PolarHBondContact O-N 3.2Å; Y114-V117 VanDerWaalsContact O-N 3.14Å; Y114-I118 HydrophobicContact CD1-CG1 4.17Å; Y114-I118 HydrophobicContact CD2-CG1 4.25Å; Y114-I118 HydrophobicContact CE1-CD1 4.17Å; Y114-I118 HydrophobicContact CE1-CG1 3.75Å; Y114-I118 HydrophobicContact CE2-CD1 3.8Å; Y114-I118 HydrophobicContact CE2-CG1 3.84Å; Y114-I118 HydrophobicContact CG-CG1 4.41Å; Y114-I118 WeakPolarHBondContact O-CG1 3.29Å; Y114-I118 PolarHBondContact O-N 3.03Å; Y114-I118 WeakPolarHBondContact OH-CD1 3.11Å; Y114-P133 WeakPolarHBondContact OH-CD 3.32Å; Y114-E134 WeakPolarHBondContact CE1-OE1 3.41Å; Y114-E134 PolarHBondContact OH-OE2 3.35Å
115	P	98.5	Very high	98.2	Very high	76 Å²	76	72.1 Å²	72.1	49%	0.494	37%	0.372	S	S	.	.	H	α-helix	trans	-57	-39.7	172.9	-26.7	35.8	0	0	0	113.8	K111 I118 Q119	K111-P115 WeakPolarHBondContact O-CD 3.42Å; K111-P115 WeakPolarHBondContact O-CG 3.46Å; P115-I118 PolarHBondContact O-N 3.44Å; P115-Q119 WeakPolarHBondContact O-CB 3.24Å; P115-Q119 PolarHBondContact O-N 2.73Å
116	Y	98.6	Very high	98.2	Very high	115 Å²	115	71 Å²	71	45%	0.451	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-47.1	174.3	164.5	-101.3	0	0	0	111.4	P77 E112 I113 Y114 I118 Q119 E120	P77-Y116 HydrophobicContact CG-CE1 4.14Å; E112-Y116 PolarHBondContact O-N 3.21Å; I113-Y116 WeakPolarHBondContact O-CB 3.38Å; I113-Y116 PolarHBondContact O-N 2.81Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 2.92Å; Y116-I118 VanDerWaalsContact C-N 3.34Å; Y116-I118 PolarHBondContact O-N 2.82Å; Y116-Q119 WeakPolarHBondContact O-CB 3.43Å; Y116-Q119 PolarHBondContact O-N 2.94Å; Y116-Q119 VanDerWaalsContact O-N 3.17Å; Y116-E120 HydrophobicContact CD2-CG 4.14Å; Y116-E120 HydrophobicContact CE1-CG 4.32Å; Y116-E120 HydrophobicContact CE2-CG 3.65Å; Y116-E120 WeakPolarHBondContact O-CG 3.04Å; Y116-E120 PolarHBondContact O-N 3.15Å
117	V	98.7	Very high	98.3	Very high	3 Å²	3	74.1 Å²	74.1	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-60.4	-43.9	178.2	173.3	0	0	0	0	111.5	L80 V103 I113 Y114 Q119 E120 L121	L80-V117 HydrophobicContact CD1-CG1 3.48Å; L80-V117 VanDerWaalsContact CD1-CG1 3.48Å; V103-V117 HydrophobicContact CG1-CB 4.43Å; V103-V117 HydrophobicContact CG1-CG1 4.06Å; V103-V117 HydrophobicContact CG1-CG2 4.32Å; I113-V117 HydrophobicContact CG2-CG2 4.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.28Å; I113-V117 PolarHBondContact O-N 3.22Å; Y114-V117 PolarHBondContact O-N 3.2Å; Y114-V117 VanDerWaalsContact O-N 3.14Å; V117-Q119 VanDerWaalsContact C-N 3.31Å; V117-Q119 PolarHBondContact O-N 3.15Å; V117-E120 PolarHBondContact O-N 3.24Å; V117-L121 HydrophobicContact CG1-CD1 3.62Å; V117-L121 HydrophobicContact CG1-CG 4.22Å; V117-L121 WeakPolarHBondContact O-CB 3.27Å; V117-L121 VanDerWaalsContact O-CG 3.31Å; V117-L121 WeakPolarHBondContact O-CG 3.22Å; V117-L121 PolarHBondContact O-N 3.18Å
118	I	98.6	Very high	98.3	Very high	35 Å²	35	75.1 Å²	75.1	18%	0.179	39%	0.39	C	S	.	.	H	α-helix	trans	-64.5	-37.4	178	-64	-69.6	0	0	0	111.3	L100 Y114 P115 Y116 L121 K122 L125 T132	L100-I118 HydrophobicContact CD2-CD1 4.18Å; Y114-I118 HydrophobicContact CD1-CG1 4.17Å; Y114-I118 HydrophobicContact CD2-CG1 4.25Å; Y114-I118 HydrophobicContact CE1-CD1 4.17Å; Y114-I118 HydrophobicContact CE1-CG1 3.75Å; Y114-I118 HydrophobicContact CE2-CD1 3.8Å; Y114-I118 HydrophobicContact CE2-CG1 3.84Å; Y114-I118 HydrophobicContact CG-CG1 4.41Å; Y114-I118 WeakPolarHBondContact O-CG1 3.29Å; Y114-I118 PolarHBondContact O-N 3.03Å; Y114-I118 WeakPolarHBondContact OH-CD1 3.11Å; P115-I118 PolarHBondContact O-N 3.44Å; Y116-I118 VanDerWaalsContact C-N 3.34Å; Y116-I118 PolarHBondContact O-N 2.82Å; I118-L121 PolarHBondContact O-N 3.28Å; I118-K122 PolarHBondContact O-N 3.5Å; I118-L125 HydrophobicContact CD1-CD1 4.37Å; I118-L125 HydrophobicContact CG2-CD1 4.47Å; I118-T132 HydrophobicContact CD1-CG2 4.12Å; I118-T132 HydrophobicContact CG2-CG2 4.29Å
119	Q	98.6	Very high	98.3	Very high	125 Å²	125	75.4 Å²	75.4	58%	0.584	39%	0.393	S	S	*	.	H	α-helix	trans	-59.6	-49.8	174.4	-176.8	-169.6	-70.8	0	0	111.4	P115 Y116 V117 L121 K122	P115-Q119 WeakPolarHBondContact O-CB 3.24Å; P115-Q119 PolarHBondContact O-N 2.73Å; Y116-Q119 WeakPolarHBondContact O-CB 3.43Å; Y116-Q119 PolarHBondContact O-N 2.94Å; Y116-Q119 VanDerWaalsContact O-N 3.17Å; V117-Q119 VanDerWaalsContact C-N 3.31Å; V117-Q119 PolarHBondContact O-N 3.15Å; Q119-L121 VanDerWaalsContact C-N 3.33Å; Q119-L121 PolarHBondContact O-N 3.12Å; Q119-K122 VanDerWaalsContact O-CB 3.31Å; Q119-K122 WeakPolarHBondContact O-CB 3.45Å; Q119-K122 PolarHBondContact O-N 2.97Å
120	E	98.8	Very high	98.4	Very high	88 Å²	88	70.7 Å²	70.7	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-68.6	-32.6	-178.9	-64.2	-54.1	113.9	0	0	112.3	P77 Y116 V117 P123	P77-E120 HydrophobicContact CB-CB 3.7Å; P77-E120 HydrophobicContact CG-CB 3.76Å; P77-E120 HydrophobicContact CG-CG 4.1Å; Y116-E120 HydrophobicContact CD2-CG 4.14Å; Y116-E120 HydrophobicContact CE1-CG 4.32Å; Y116-E120 HydrophobicContact CE2-CG 3.65Å; Y116-E120 WeakPolarHBondContact O-CG 3.04Å; Y116-E120 PolarHBondContact O-N 3.15Å; V117-E120 PolarHBondContact O-N 3.24Å; E120-P123 WeakPolarHBondContact O-CD 3.36Å
121	L	98.8	Very high	98.4	Very high	2 Å²	2	68.4 Å²	68.4	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-83.2	-10.3	177.6	-69.2	178.3	0	0	0	114	P77 L80 D81 L84 L100 V117 I118 Q119 P123 T124 L125	P77-L121 HydrophobicContact CB-CD2 4.3Å; P77-L121 HydrophobicContact CB-CG 4.4Å; P77-L121 WeakPolarHBondContact O-CD2 3.38Å; L80-L121 HydrophobicContact CB-CD1 3.82Å; L80-L121 HydrophobicContact CB-CD2 4.16Å; L80-L121 HydrophobicContact CD1-CD1 4.02Å; D81-L121 HydrophobicContact CB-CD2 4.1Å; L84-L121 HydrophobicContact CD1-CD1 4.16Å; L84-L121 HydrophobicContact CD1-CD2 4.41Å; L100-L121 HydrophobicContact CD2-CD1 4.17Å; V117-L121 HydrophobicContact CG1-CD1 3.62Å; V117-L121 HydrophobicContact CG1-CG 4.22Å; V117-L121 WeakPolarHBondContact O-CB 3.27Å; V117-L121 VanDerWaalsContact O-CG 3.31Å; V117-L121 WeakPolarHBondContact O-CG 3.22Å; V117-L121 PolarHBondContact O-N 3.18Å; I118-L121 PolarHBondContact O-N 3.28Å; Q119-L121 VanDerWaalsContact C-N 3.33Å; Q119-L121 PolarHBondContact O-N 3.12Å; L121-P123 VanDerWaalsContact C-N 3.32Å; L121-T124 WeakPolarHBondContact O-CA 3.31Å; L121-T124 WeakPolarHBondContact O-CB 3.32Å; L121-T124 PolarHBondContact O-N 3.34Å; L121-L125 HydrophobicContact CB-CD1 4.32Å; L121-L125 HydrophobicContact CB-CG 4.24Å; L121-L125 WeakPolarHBondContact O-CG 3.39Å; L121-L125 PolarHBondContact O-N 3.31Å
122	K	98.5	Very high	98.5	Very high	139 Å²	139	60.6 Å²	60.6	60%	0.604	32%	0.324	S	S	*	.	H	α-helix	trans	-50.5	-41.9	-176.1	-172.5	174.1	-176.8	174.1	0	114.2	I118 Q119 T124 L125 T126	I118-K122 PolarHBondContact O-N 3.5Å; Q119-K122 VanDerWaalsContact O-CB 3.31Å; Q119-K122 WeakPolarHBondContact O-CB 3.45Å; Q119-K122 PolarHBondContact O-N 2.97Å; K122-T124 PolarHBondContact O-N 2.97Å; K122-L125 PolarHBondContact O-N 2.93Å; K122-T126 WeakPolarHBondContact O-CB 3.37Å; K122-T126 PolarHBondContact O-N 3.24Å; K122-T126 PolarHBondContact O-OG1 2.78Å
123	P	98.8	Very high	98.6	Very high	89 Å²	89	54.8 Å²	54.8	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-58.5	-46.3	175.2	-23.7	35.5	0	0	0	112.3	E120 L121 T126 E127	E120-P123 WeakPolarHBondContact O-CD 3.36Å; L121-P123 VanDerWaalsContact C-N 3.32Å; P123-T126 PolarHBondContact O-N 3.23Å; P123-E127 WeakPolarHBondContact O-CB 3.32Å; P123-E127 PolarHBondContact O-N 3.23Å
124	T	98.7	Very high	98.6	Very high	11 Å²	11	55.7 Å²	55.7	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-67.2	-43.2	179.2	-57.8	0	0	0	0	112.1	D81 L84 L121 K122 T126 E127 L128	D81-T124 WeakPolarHBondContact OD1-CB 3.38Å; D81-T124 WeakPolarHBondContact OD1-CG2 3.28Å; D81-T124 PolarHBondContact OD1-OG1 2.91Å; L84-T124 HydrophobicContact CB-CG2 4.42Å; L84-T124 HydrophobicContact CD1-CG2 4.39Å; L121-T124 WeakPolarHBondContact O-CA 3.31Å; L121-T124 WeakPolarHBondContact O-CB 3.32Å; L121-T124 PolarHBondContact O-N 3.34Å; K122-T124 PolarHBondContact O-N 2.97Å; T124-T126 VanDerWaalsContact C-N 3.28Å; T124-T126 PolarHBondContact O-N 3.48Å; T124-E127 PolarHBondContact O-N 3.02Å; T124-L128 HydrophobicContact CG2-CD1 3.65Å; T124-L128 HydrophobicContact CG2-CG 4.12Å; T124-L128 WeakPolarHBondContact O-CB 3.49Å; T124-L128 VanDerWaalsContact O-CG 3.31Å; T124-L128 WeakPolarHBondContact O-CG 3.21Å; T124-L128 PolarHBondContact O-N 2.95Å
125	L	98.8	Very high	98.5	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-41.9	177.3	-63.7	178	0	0	0	111.2	L84 L100 I118 L121 K122 G129 I130 T132	L84-L125 HydrophobicContact CD1-CD2 3.96Å; L100-L125 HydrophobicContact CD1-CD2 4.01Å; I118-L125 HydrophobicContact CD1-CD1 4.37Å; I118-L125 HydrophobicContact CG2-CD1 4.47Å; L121-L125 HydrophobicContact CB-CD1 4.32Å; L121-L125 HydrophobicContact CB-CG 4.24Å; L121-L125 WeakPolarHBondContact O-CG 3.39Å; L121-L125 PolarHBondContact O-N 3.31Å; K122-L125 PolarHBondContact O-N 2.93Å; L125-G129 WeakPolarHBondContact O-CA 3.4Å; L125-G129 PolarHBondContact O-N 3.37Å; L125-I130 HydrophobicContact CD2-CB 3.89Å; L125-I130 HydrophobicContact CD2-CG2 3.91Å; L125-I130 PolarHBondContact O-N 3.23Å; L125-T132 HydrophobicContact CD1-CG2 4.07Å
126	T	98.6	Very high	98.5	Very high	106 Å²	106	61.5 Å²	61.5	65%	0.65	32%	0.323	S	S	*	.	H	α-helix	trans	-67.1	-46	177	-52.9	0	0	0	0	111.6	K122 P123 T124 L128	K122-T126 WeakPolarHBondContact O-CB 3.37Å; K122-T126 PolarHBondContact O-N 3.24Å; K122-T126 PolarHBondContact O-OG1 2.78Å; P123-T126 PolarHBondContact O-N 3.23Å; T124-T126 VanDerWaalsContact C-N 3.28Å; T124-T126 PolarHBondContact O-N 3.48Å; T126-L128 PolarHBondContact O-N 3.39Å
127	E	98.6	Very high	98.5	Very high	122 Å²	122	58.8 Å²	58.8	57%	0.57	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-44.4	178.7	-177.3	-166.4	146.5	0	0	111.9	R85 P123 T124	R85-E127 IonicContact CZ-OE1 3.56Å; R85-E127 IonicContact CZ-OE2 3.55Å; R85-E127 IonicContact NH1-OE1 3.02Å; R85-E127 PolarHBondContact NH1-OE1 2.73Å; R85-E127 IonicContact NH1-OE2 3.68Å; R85-E127 PolarHBondContact NH1-OE2 2.84Å; R85-E127 IonicContact NH2-OE1 3.94Å; R85-E127 IonicContact NH2-OE2 3.17Å; R85-E127 PolarHBondContact NH2-OE2 3.29Å; P123-E127 WeakPolarHBondContact O-CB 3.32Å; P123-E127 PolarHBondContact O-N 3.23Å; T124-E127 PolarHBondContact O-N 3.02Å
128	L	98.5	Very high	98.3	Very high	27 Å²	27	63 Å²	63	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-88.7	-9.7	-174	-59.6	-174.7	0	0	0	113.7	L84 R85 R88 T124 T126 I130	L84-L128 HydrophobicContact CB-CD1 4.28Å; R85-L128 HydrophobicContact CG-CD1 4.12Å; R88-L128 HydrophobicContact CB-CD1 4.41Å; R88-L128 HydrophobicContact CB-CD2 4.29Å; R88-L128 HydrophobicContact CG-CD2 4.05Å; T124-L128 HydrophobicContact CG2-CD1 3.65Å; T124-L128 HydrophobicContact CG2-CG 4.12Å; T124-L128 WeakPolarHBondContact O-CB 3.49Å; T124-L128 VanDerWaalsContact O-CG 3.31Å; T124-L128 WeakPolarHBondContact O-CG 3.21Å; T124-L128 PolarHBondContact O-N 2.95Å; T126-L128 PolarHBondContact O-N 3.39Å; L128-I130 HydrophobicContact CB-CD1 3.65Å; L128-I130 HydrophobicContact CB-CG1 3.87Å; L128-I130 HydrophobicContact CD1-CD1 3.82Å; L128-I130 HydrophobicContact CG-CD1 4.39Å
129	G	98.3	Very high	97.8	Very high	57 Å²	57	68 Å²	68	59%	0.588	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	41	-177.1	0	0	0	0	0	113	L125	L125-G129 WeakPolarHBondContact O-CA 3.4Å; L125-G129 PolarHBondContact O-N 3.37Å
130	I	98.6	Very high	97.7	Very high	13 Å²	13	65.2 Å²	65.2	7%	0.067	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-99.1	116.3	-179.6	-59.9	165.1	0	0	0	108.4	L84 L93 A96 I97 L100 L125 L128	L84-I130 HydrophobicContact CB-CD1 4.23Å; L84-I130 HydrophobicContact CD2-CD1 4.19Å; L93-I130 HydrophobicContact CD1-CG1 4.13Å; L93-I130 HydrophobicContact CD1-CG2 4.44Å; A96-I130 HydrophobicContact CB-CD1 4.02Å; A96-I130 HydrophobicContact CB-CG1 4.44Å; A96-I130 HydrophobicContact CB-CG2 4.26Å; I97-I130 HydrophobicContact CG1-CG2 4.44Å; L100-I130 HydrophobicContact CD1-CG2 4.33Å; L125-I130 HydrophobicContact CD2-CB 3.89Å; L125-I130 HydrophobicContact CD2-CG2 3.91Å; L125-I130 PolarHBondContact O-N 3.23Å; L128-I130 HydrophobicContact CB-CD1 3.65Å; L128-I130 HydrophobicContact CB-CG1 3.87Å; L128-I130 HydrophobicContact CD1-CD1 3.82Å; L128-I130 HydrophobicContact CG-CD1 4.39Å
131	S	98.4	Very high	97.7	Very high	49 Å²	49	63.9 Å²	63.9	34%	0.343	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-75.6	145.2	171.5	-63.9	0	0	0	0	111.4	E135	S131-E135 WeakPolarHBondContact CA-OE2 3.44Å; S131-E135 WeakPolarHBondContact CB-OE2 3.29Å
132	T	98.6	Very high	97.6	Very high	13 Å²	13	67.4 Å²	67.4	8%	0.08	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-74.7	160	173.1	80.7	0	0	0	0	111	I118 L125 E134 E135 L136	I118-T132 HydrophobicContact CD1-CG2 4.12Å; I118-T132 HydrophobicContact CG2-CG2 4.29Å; L125-T132 HydrophobicContact CD1-CG2 4.07Å; T132-E134 WeakPolarHBondContact CB-OE2 3.46Å; T132-E134 PolarHBondContact O-N 3.05Å; T132-E134 PolarHBondContact OG1-N 3.23Å; T132-E134 PolarHBondContact OG1-OE2 3.13Å; T132-E135 PolarHBondContact N-OE2 3.47Å; T132-E135 PolarHBondContact O-N 3.23Å; T132-E135 VanDerWaalsContact O-N 3.13Å; T132-E135 PolarHBondContact OG1-N 3.47Å; T132-L136 PolarHBondContact O-N 3.33Å
133	P	98.4	Very high	97.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-52.8	-37.4	173.1	-27.4	37.1	0	0	0	113.1	I97 L100 E101 Y114 L136 G137 I138	I97-P133 HydrophobicContact CG2-CG 4.21Å; L100-P133 HydrophobicContact CB-CG 4.07Å; E101-P133 HydrophobicContact CG-CB 3.99Å; E101-P133 HydrophobicContact CG-CG 3.56Å; Y114-P133 WeakPolarHBondContact OH-CD 3.32Å; P133-L136 CarbonylContact O-C 3.6Å; P133-L136 PolarHBondContact O-N 3.19Å; P133-G137 PolarHBondContact O-N 3.49Å; P133-I138 HydrophobicContact CB-CG1 4.13Å; P133-I138 WeakPolarHBondContact O-CG1 3.37Å; P133-I138 PolarHBondContact O-N 3.3Å
134	E	98.1	Very high	97.5	Very high	67 Å²	67	61.6 Å²	61.6	31%	0.313	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-41.7	177.5	-62.5	70.7	-156	0	0	112.5	K104 Y114 T132 L136 G137 D139	K104-E134 IonicContact NZ-OE1 2.68Å; K104-E134 PolarHBondContact NZ-OE1 3.06Å; Y114-E134 WeakPolarHBondContact CE1-OE1 3.41Å; Y114-E134 PolarHBondContact OH-OE2 3.35Å; T132-E134 WeakPolarHBondContact CB-OE2 3.46Å; T132-E134 PolarHBondContact O-N 3.05Å; T132-E134 PolarHBondContact OG1-N 3.23Å; T132-E134 PolarHBondContact OG1-OE2 3.13Å; E134-L136 PolarHBondContact O-N 3.2Å; E134-G137 PolarHBondContact O-N 3.28Å; E134-D139 HydrophobicContact CG-CB 3.97Å
135	E	98.1	Very high	97.4	Very high	135 Å²	135	64.9 Å²	64.9	63%	0.631	38%	0.38	S	S	*	.	H	α-helix	trans	-65.6	-26	177.3	-68.9	175.6	162.9	0	0	112.4	S131 T132	S131-E135 WeakPolarHBondContact CA-OE2 3.44Å; S131-E135 WeakPolarHBondContact CB-OE2 3.29Å; T132-E135 PolarHBondContact N-OE2 3.47Å; T132-E135 PolarHBondContact O-N 3.23Å; T132-E135 VanDerWaalsContact O-N 3.13Å; T132-E135 PolarHBondContact OG1-N 3.47Å
136	L	97.8	Very high	97.3	Very high	83 Å²	83	68.7 Å²	68.7	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-91.3	-9.4	177.5	-64	177	0	0	0	113.4	I97 T132 P133 E134 I138	I97-L136 HydrophobicContact CD1-CD1 3.54Å; I97-L136 HydrophobicContact CG1-CD1 4.13Å; I97-L136 HydrophobicContact CG2-CD1 4.17Å; T132-L136 PolarHBondContact O-N 3.33Å; P133-L136 CarbonylContact O-C 3.6Å; P133-L136 PolarHBondContact O-N 3.19Å; E134-L136 PolarHBondContact O-N 3.2Å; L136-I138 HydrophobicContact CB-CD1 4.21Å; L136-I138 HydrophobicContact CB-CG1 3.91Å; L136-I138 HydrophobicContact CD1-CD1 4.2Å
137	G	97.6	Very high	97.2	Very high	59 Å²	59	65.8 Å²	65.8	61%	0.608	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	33.4	-178.2	0	0	0	0	0	114.3	P133 E134	P133-G137 PolarHBondContact O-N 3.49Å; E134-G137 PolarHBondContact O-N 3.28Å
138	I	95.8	Very high	97.1	Very high	90 Å²	90	61.2 Å²	61.2	46%	0.462	37%	0.368	S	S	.	.			trans	-122.8	31.8	-178.6	58.9	168.9	0	0	0	111.9	I97 P133 L136	I97-I138 HydrophobicContact CG2-CD1 3.9Å; P133-I138 HydrophobicContact CB-CG1 4.13Å; P133-I138 WeakPolarHBondContact O-CG1 3.37Å; P133-I138 PolarHBondContact O-N 3.3Å; L136-I138 HydrophobicContact CB-CD1 4.21Å; L136-I138 HydrophobicContact CB-CG1 3.91Å; L136-I138 HydrophobicContact CD1-CD1 4.2Å
139	D	87.1	Confident	97	Very high	141 Å²	141	64.3 Å²	64.3	75%	0.754	39%	0.389	S	S	*	.			trans	-85	0	-165.5	77.2	-66.2	0	0	0	116.5	K104 E134	K104-D139 IonicContact NZ-OD2 3.41Å; K104-D139 PolarHBondContact NZ-OXT 3.38Å; E134-D139 HydrophobicContact CG-CB 3.97Å

Retrieved 139 of 139 residues in 417.9 ms (Link to these results)

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