A0A673Y3V4_SALTR Loading...

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 A0A673Y3V4, Species SALTR (Salmo trutta, Brown trout), Gene COX5A, Length 141 aa.

						>A0A673Y3V4_SALTR|A0A673Y3V4|COX5A
MFRAVVRLSTSGVRSLARIRPCYSAPLASRCYSHAKVETDEEFDARWVTYFSKPDIDAWELKKGMNTLIGYDLVPEPKILDSALRACRRLNDLASAIRILEAVKDKSGPHKDIYPYLIQELQPTLIELGISTPEDLGMDKL
					

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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	48.9	Very low	53.3	Low	243 Å²	243	159.8 Å²	159.8	100%	1.197	84%	0.843	S	S	*	*				0	125.7	0	-62.4	-176.8	-169.7	0	0	107.3
2	F	44.4	Very low	53.8	Low	216 Å²	216	152.2 Å²	152.2	95%	0.947	83%	0.831	S	S	*	*			trans	-76.6	139.3	-153.6	-75.1	-94.3	0	0	0	114.7
3	R	44.7	Very low	54.5	Low	242 Å²	242	151.4 Å²	151.4	91%	0.913	83%	0.834	S	S	*	*			trans	-66	125.6	161.8	-79.1	171.3	120.1	171.6	-0.3	108.9
4	A	50.6	Low	55.1	Low	103 Å²	103	156.9 Å²	156.9	85%	0.851	84%	0.836	S	S	*	*			trans	-124.9	115.5	161.2	0	0	0	0	0	108
5	V	57	Low	55.5	Low	115 Å²	115	153.9 Å²	153.9	70%	0.697	83%	0.833	S	S	*	*			trans	-114.6	154.3	172.2	-166.1	0	0	0	0	106.5
6	V	53	Low	56.1	Low	115 Å²	115	154.4 Å²	154.4	70%	0.697	83%	0.833	S	S	*	*			trans	78.1	146.4	156.5	-119.1	0	0	0	0	116.3
7	R	53.2	Low	56.6	Low	214 Å²	214	150.4 Å²	150.4	81%	0.808	83%	0.827	S	S	*	*			cis	-144.6	133.5	9.5	-76.6	170.5	-175.3	-162.4	-3.2	108.6	S9	R7-S9 PolarHBondContact O-N 2.91Å
8	L	52.6	Low	57	Low	166 Å²	166	154.9 Å²	154.9	87%	0.869	83%	0.829	S	S	*	*			trans	-81	108.9	161.8	-167.2	73.8	0	0	0	107.7	T10	L8-T10 PolarHBondContact O-N 3.42Å
9	S	61.8	Low	57.5	Low	104 Å²	104	154.9 Å²	154.9	73%	0.727	83%	0.828	S	S	*	*			trans	-83	104.9	174.7	-58.4	0	0	0	0	109	R7 S11	R7-S9 PolarHBondContact O-N 2.91Å; S9-S11 PolarHBondContact O-N 2.96Å
10	T	59.8	Low	57.9	Low	126 Å²	126	158.2 Å²	158.2	77%	0.773	83%	0.828	S	S	*	*			trans	-85.6	104	166.9	48.3	0	0	0	0	108.8	L8 G12	L8-T10 PolarHBondContact O-N 3.42Å; T10-G12 PolarHBondContact O-N 2.98Å
11	S	60.1	Low	58.2	Low	114 Å²	114	154.5 Å²	154.5	80%	0.797	81%	0.813	S	S	*	*			trans	-70.4	97	169.4	-70.5	0	0	0	0	109.2	S9 V13	S9-S11 PolarHBondContact O-N 2.96Å; S11-V13 PolarHBondContact O-N 3.39Å
12	G	59.3	Low	59.1	Low	68 Å²	68	148.8 Å²	148.8	70%	0.701	80%	0.796	S	S	*	*			trans	-69.2	111.6	170.5	0	0	0	0	0	110.4	T10 R14	T10-G12 PolarHBondContact O-N 2.98Å; G12-R14 PolarHBondContact O-N 3.36Å; G12-R14 VanDerWaalsContact O-N 3.15Å
13	V	62.5	Low	60.2	Low	142 Å²	142	148 Å²	148	86%	0.861	79%	0.788	S	S	*	*			trans	-67.7	110.1	171.1	-165.7	0	0	0	0	107.3	S11 S15	S11-V13 PolarHBondContact O-N 3.39Å; V13-S15 PolarHBondContact O-N 2.96Å; V13-S15 VanDerWaalsContact O-N 3.1Å
14	R	63.9	Low	61.5	Low	228 Å²	228	141.6 Å²	141.6	86%	0.86	78%	0.78	S	S	*	*			trans	-65.7	111.8	173.3	-66.3	-176.1	-175.4	-152.7	1	107.6	G12 L16	G12-R14 PolarHBondContact O-N 3.36Å; G12-R14 VanDerWaalsContact O-N 3.15Å; R14-L16 PolarHBondContact O-N 3.45Å; R14-L16 VanDerWaalsContact O-N 3.08Å
15	S	61	Low	62.7	Low	113 Å²	113	140.5 Å²	140.5	79%	0.79	77%	0.771	S	S	*	*			trans	-57.6	113.6	168	-175.2	0	0	0	0	108.2	V13 A17	V13-S15 PolarHBondContact O-N 2.96Å; V13-S15 VanDerWaalsContact O-N 3.1Å; S15-A17 VanDerWaalsContact C-N 3.33Å; S15-A17 PolarHBondContact O-N 3.06Å
16	L	64.1	Low	63.5	Low	161 Å²	161	141 Å²	141	84%	0.843	78%	0.777	S	S	*	*			trans	-69.2	96.6	169.4	-67.9	175.5	0	0	0	106.9	R14 R18	R14-L16 PolarHBondContact O-N 3.45Å; R14-L16 VanDerWaalsContact O-N 3.08Å; L16-R18 PolarHBondContact O-N 3.4Å
17	A	64.6	Low	64.5	Low	87 Å²	87	143.6 Å²	143.6	72%	0.719	79%	0.786	S	S	*	*			trans	-58.6	105.4	166.1	0	0	0	0	0	107.3	S15 I19	S15-A17 VanDerWaalsContact C-N 3.33Å; S15-A17 PolarHBondContact O-N 3.06Å; A17-I19 PolarHBondContact O-N 3.24Å
18	R	64.9	Low	65.6	Low	231 Å²	231	137.6 Å²	137.6	87%	0.872	78%	0.782	S	S	*	*			trans	-65.9	99.6	176.2	-169.9	-178	-84.2	-175.9	-5.7	106.8	L16 R20	L16-R18 PolarHBondContact O-N 3.4Å; R18-R20 PolarHBondContact O-N 3.28Å
19	I	65.4	Low	66.6	Low	156 Å²	156	134.9 Å²	134.9	80%	0.8	78%	0.777	S	S	*	*			trans	-59.2	105.4	172.5	-59.2	173	0	0	0	106.1	A17 P21	A17-I19 PolarHBondContact O-N 3.24Å; I19-P21 WeakPolarHBondContact O-CD 3.46Å
20	R	66.4	Low	67.1	Low	220 Å²	220	138.8 Å²	138.8	83%	0.83	78%	0.775	S	S	*	*			trans	-71.9	121.6	169.7	-71.6	-173.8	177.7	-163.4	-0.2	106.4	R18 C22	R18-R20 PolarHBondContact O-N 3.28Å; R20-C22 PolarHBondContact O-N 3.38Å
21	P	64.8	Low	67.4	Low	81 Å²	81	137.6 Å²	137.6	53%	0.526	77%	0.771	S	S	.	*			trans	-60.1	116.7	169.6	16	-18.7	0	0	0	107.9	I19 Y23	I19-P21 WeakPolarHBondContact O-CD 3.46Å; P21-Y23 HydrophobicContact CB-CD2 4.39Å; P21-Y23 HydrophobicContact CB-CE1 4.47Å; P21-Y23 HydrophobicContact CB-CE2 3.91Å; P21-Y23 HydrophobicContact CG-CE2 3.68Å; P21-Y23 WeakPolarHBondContact O-CD2 3.35Å; P21-Y23 PolarHBondContact O-N 2.69Å; P21-Y23 VanDerWaalsContact O-N 3.12Å
22	C	66.3	Low	67.9	Low	122 Å²	122	141.7 Å²	141.7	82%	0.824	77%	0.771	S	S	*	*			trans	-73.2	99.4	167.9	-171.8	0	0	0	0	106.2	R20 S24	R20-C22 PolarHBondContact O-N 3.38Å; C22-S24 PolarHBondContact O-N 2.8Å; C22-S24 VanDerWaalsContact O-N 3.14Å
23	Y	68.4	Low	68.2	Low	201 Å²	201	143.3 Å²	143.3	79%	0.788	77%	0.771	S	S	*	*			trans	-76.7	95.9	170.1	-64.6	-78.5	0	0	0	107.6	P21 A25	P21-Y23 HydrophobicContact CB-CD2 4.39Å; P21-Y23 HydrophobicContact CB-CE1 4.47Å; P21-Y23 HydrophobicContact CB-CE2 3.91Å; P21-Y23 HydrophobicContact CG-CE2 3.68Å; P21-Y23 WeakPolarHBondContact O-CD2 3.35Å; P21-Y23 PolarHBondContact O-N 2.69Å; P21-Y23 VanDerWaalsContact O-N 3.12Å; Y23-A25 PolarHBondContact O-N 3.17Å; Y23-A25 VanDerWaalsContact O-N 3.14Å
24	S	72	Confident	68.2	Low	106 Å²	106	145.4 Å²	145.4	74%	0.741	77%	0.771	S	S	*	*			trans	-71.4	100.4	162.6	49.4	0	0	0	0	107.5	C22	C22-S24 PolarHBondContact O-N 2.8Å; C22-S24 VanDerWaalsContact O-N 3.14Å
25	A	75.8	Confident	68.5	Low	81 Å²	81	138.9 Å²	138.9	67%	0.669	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-56.5	133.2	169.1	0	0	0	0	0	108.6	Y23 L27	Y23-A25 PolarHBondContact O-N 3.17Å; Y23-A25 VanDerWaalsContact O-N 3.14Å; A25-L27 PolarHBondContact O-N 3.36Å; A25-L27 VanDerWaalsContact O-N 3.12Å
26	P	73.5	Confident	69.5	Low	126 Å²	126	141 Å²	141	82%	0.818	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-60.3	121.8	175.4	24.7	-31.7	0	0	0	108.3	A28	P26-A28 PolarHBondContact O-N 2.77Å
27	L	74.2	Confident	70.5	Confident	169 Å²	169	139.9 Å²	139.9	89%	0.885	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-63.8	120.2	169.9	-67.2	177.2	0	0	0	107.2	A25 S29	A25-L27 PolarHBondContact O-N 3.36Å; A25-L27 VanDerWaalsContact O-N 3.12Å; L27-S29 PolarHBondContact O-N 3.36Å
28	A	76.2	Confident	71.8	Confident	87 Å²	87	138.7 Å²	138.7	72%	0.719	74%	0.74	S	S	*	*			trans	-61.3	111.8	175.3	0	0	0	0	0	108.9	P26 R30	P26-A28 PolarHBondContact O-N 2.77Å; A28-R30 PolarHBondContact O-N 2.92Å; A28-R30 VanDerWaalsContact O-N 3.11Å
29	S	73.6	Confident	73.3	Confident	110 Å²	110	130.9 Å²	130.9	77%	0.769	72%	0.718	S	S	*	*			trans	-66.6	107.8	168.1	-174.6	0	0	0	0	107.8	L27 C31	L27-S29 PolarHBondContact O-N 3.36Å; S29-C31 PolarHBondContact O-N 2.56Å
30	R	72.5	Confident	74.8	Confident	185 Å²	185	129.5 Å²	129.5	70%	0.698	71%	0.712	S	S	*	*			trans	-85.5	105.6	171.8	-66.1	-173.5	-179.8	-140.9	0.2	107.5	A28 Y32	A28-R30 PolarHBondContact O-N 2.92Å; A28-R30 VanDerWaalsContact O-N 3.11Å; R30-Y32 HydrophobicContact CB-CD2 4.42Å; R30-Y32 HydrophobicContact CB-CE2 3.92Å; R30-Y32 WeakPolarHBondContact O-CD2 3.31Å; R30-Y32 PolarHBondContact O-N 3.4Å; R30-Y32 VanDerWaalsContact O-N 3.1Å
31	C	66.6	Low	76.2	Confident	102 Å²	102	125.2 Å²	125.2	69%	0.689	70%	0.702	S	S	*	*			trans	-72	99.3	173.1	-61.3	0	0	0	0	109.3	S29 S33	S29-C31 PolarHBondContact O-N 2.56Å; C31-S33 PolarHBondContact O-N 2.94Å
32	Y	69.6	Low	77.7	Confident	200 Å²	200	125 Å²	125	78%	0.784	69%	0.694	S	S	*	*			trans	-80.2	47.2	173.7	-66.6	-76.3	0	0	0	112.1	R30	R30-Y32 HydrophobicContact CB-CD2 4.42Å; R30-Y32 HydrophobicContact CB-CE2 3.92Å; R30-Y32 WeakPolarHBondContact O-CD2 3.31Å; R30-Y32 PolarHBondContact O-N 3.4Å; R30-Y32 VanDerWaalsContact O-N 3.1Å
33	S	65	Low	79.2	Confident	101 Å²	101	120.1 Å²	120.1	71%	0.706	66%	0.659	S	S	*	*			trans	-97.4	16.1	-176.3	61.8	0	0	0	0	114	C31	C31-S33 PolarHBondContact O-N 2.94Å
34	H	64.3	Low	80.7	Confident	187 Å²	187	111.5 Å²	111.5	87%	0.866	63%	0.626	S	S	*	*			trans	-107.2	32.5	-168.9	-115.5	-56.5	0	0	0	114.2	K36	H34-K36 PolarHBondContact O-N 3.02Å
35	A	69.5	Low	81.9	Confident	90 Å²	90	109 Å²	109	74%	0.744	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-75.8	119.3	169.8	0	0	0	0	0	109	V37	A35-V37 PolarHBondContact O-N 2.91Å
36	K	81.2	Confident	83	Confident	158 Å²	158	110.3 Å²	110.3	69%	0.687	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-58.5	120.6	164.8	-177.5	-162.8	175	-140.3	0	106.4	H34 E38 E42	H34-K36 PolarHBondContact O-N 3.02Å; K36-E38 PolarHBondContact O-N 3.15Å; K36-E42 VanDerWaalsContact NZ-CD 3.33Å; K36-E42 IonicContact NZ-OE1 2.9Å; K36-E42 PolarHBondContact NZ-OE1 2.88Å; K36-E42 IonicContact NZ-OE2 2.88Å; K36-E42 PolarHBondContact NZ-OE2 2.9Å
37	V	85.6	Confident	84.2	Confident	137 Å²	137	105 Å²	105	83%	0.83	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-68	118	169	-177.8	0	0	0	0	106.4	A35	A35-V37 PolarHBondContact O-N 2.91Å
38	E	91.8	Very high	85.4	Confident	63 Å²	63	98.8 Å²	98.8	29%	0.294	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-80.6	157.1	174.3	65.3	-174.6	146.9	0	0	110.5	K36 E42 F43 R46	K36-E38 PolarHBondContact O-N 3.15Å; E38-E42 WeakPolarHBondContact CA-OE2 3.5Å; E38-E42 HydrophobicContact CB-CB 3.99Å; E38-E42 WeakPolarHBondContact CB-OE2 3.31Å; E38-F43 HydrophobicContact CG-CB 4.22Å; E38-F43 WeakPolarHBondContact OE1-CD2 3.44Å; E38-F43 WeakPolarHBondContact OE2-CA 3.33Å; E38-F43 PolarHBondContact OE2-N 2.85Å; E38-R46 IonicContact OE1-CZ 3.71Å; E38-R46 IonicContact OE1-NE 2.79Å; E38-R46 IonicContact OE1-NH2 3.78Å; E38-R46 PolarHBondContact OE1-NH2 3.33Å; E38-R46 IonicContact OE2-CZ 3.07Å; E38-R46 IonicContact OE2-NE 3.8Å; E38-R46 PolarHBondContact OE2-NE 3.09Å; E38-R46 IonicContact OE2-NH2 2.8Å; E38-R46 PolarHBondContact OE2-NH2 3.34Å
39	T	96.6	Very high	86.5	Confident	67 Å²	67	99.5 Å²	99.5	41%	0.411	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-80.3	164.7	170.6	77.9	0	0	0	0	110.6	E41 E42 F43	T39-E41 VanDerWaalsContact CB-OE2 3.28Å; T39-E41 WeakPolarHBondContact CB-OE2 3.34Å; T39-E41 PolarHBondContact O-N 3.2Å; T39-E41 PolarHBondContact OG1-OE2 3.12Å; T39-E42 PolarHBondContact N-OE2 3.41Å; T39-E42 WeakPolarHBondContact O-CB 3.46Å; T39-E42 PolarHBondContact O-N 3.05Å; T39-E42 VanDerWaalsContact O-N 3.13Å; T39-E42 PolarHBondContact OG1-N 3.4Å; T39-F43 PolarHBondContact O-N 2.67Å
40	D	96.1	Very high	87.7	Confident	127 Å²	127	98 Å²	98	68%	0.679	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-36.5	178.9	-61	-14.1	0	0	0	111.1	F43 D44	D40-F43 WeakPolarHBondContact O-CB 3.09Å; D40-F43 PolarHBondContact O-N 3Å; D40-D44 WeakPolarHBondContact O-CB 3.35Å; D40-D44 PolarHBondContact O-N 2.97Å
41	E	96.7	Very high	88.9	Confident	129 Å²	129	89.2 Å²	89.2	60%	0.603	47%	0.472	S	S	*	.	H	α-helix	trans	-69.4	-37.6	176.2	-53.5	78	-171	0	0	112.4	T39 A45	T39-E41 VanDerWaalsContact CB-OE2 3.28Å; T39-E41 WeakPolarHBondContact CB-OE2 3.34Å; T39-E41 PolarHBondContact O-N 3.2Å; T39-E41 PolarHBondContact OG1-OE2 3.12Å; E41-A45 WeakPolarHBondContact O-CB 3.48Å; E41-A45 PolarHBondContact O-N 3.43Å
42	E	97.3	Very high	90.4	Very high	77 Å²	77	87.2 Å²	87.2	36%	0.36	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173.3	-72.5	-177.5	167.1	0	0	110.1	K36 E38 T39 A45 R46	K36-E42 VanDerWaalsContact NZ-CD 3.33Å; K36-E42 IonicContact NZ-OE1 2.9Å; K36-E42 PolarHBondContact NZ-OE1 2.88Å; K36-E42 IonicContact NZ-OE2 2.88Å; K36-E42 PolarHBondContact NZ-OE2 2.9Å; E38-E42 WeakPolarHBondContact CA-OE2 3.5Å; E38-E42 HydrophobicContact CB-CB 3.99Å; E38-E42 WeakPolarHBondContact CB-OE2 3.31Å; T39-E42 PolarHBondContact N-OE2 3.41Å; T39-E42 WeakPolarHBondContact O-CB 3.46Å; T39-E42 PolarHBondContact O-N 3.05Å; T39-E42 VanDerWaalsContact O-N 3.13Å; T39-E42 PolarHBondContact OG1-N 3.4Å; E42-A45 PolarHBondContact O-N 3.39Å; E42-R46 WeakPolarHBondContact O-CG 3.44Å; E42-R46 PolarHBondContact O-N 3.5Å
43	F	97.8	Very high	91.8	Very high	20 Å²	20	81.2 Å²	81.2	9%	0.088	44%	0.438	C	S	.	.	H	α-helix	trans	-59	-50.8	176.9	177.1	-89.1	0	0	0	111.4	E38 T39 D40 A45 R46 W47 L68 Y71 L73	E38-F43 HydrophobicContact CG-CB 4.22Å; E38-F43 WeakPolarHBondContact OE1-CD2 3.44Å; E38-F43 WeakPolarHBondContact OE2-CA 3.33Å; E38-F43 PolarHBondContact OE2-N 2.85Å; T39-F43 PolarHBondContact O-N 2.67Å; D40-F43 WeakPolarHBondContact O-CB 3.09Å; D40-F43 PolarHBondContact O-N 3Å; F43-A45 PolarHBondContact O-N 3Å; F43-R46 PolarHBondContact O-N 3.03Å; F43-W47 AromaticContact CD1-CD1 3.79Å; F43-W47 AromaticContact CE1-CD1 3.41Å; F43-W47 VanDerWaalsContact CE1-CD1 3.41Å; F43-W47 AromaticContact CE1-NE1 3.66Å; F43-W47 AromaticContact CE2-CD1 3.83Å; F43-W47 AromaticContact CE2-NE1 3.36Å; F43-W47 AromaticContact CZ-CD1 3.43Å; F43-W47 VanDerWaalsContact CZ-CD1 3.43Å; F43-W47 AromaticContact CZ-NE1 3.13Å; F43-W47 VanDerWaalsContact O-CD1 3.31Å; F43-W47 PolarHBondContact O-N 3.13Å; F43-W47 VanDerWaalsContact O-N 3.16Å; F43-L68 HydrophobicContact CE1-CD1 4.31Å; F43-L68 HydrophobicContact CZ-CD1 4.15Å; F43-Y71 HydrophobicContact CE2-CD1 4.47Å; F43-Y71 HydrophobicContact CE2-CD2 4.13Å; F43-Y71 HydrophobicContact CE2-CE1 4.31Å; F43-Y71 AromaticContact CE2-CE2 3.98Å; F43-Y71 HydrophobicContact CE2-CE2 3.98Å; F43-Y71 HydrophobicContact CE2-CG 4.38Å; 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 4.2Å; F43-L73 HydrophobicContact CD1-CD2 4.49Å; F43-L73 HydrophobicContact CE1-CD1 4.42Å; F43-L73 HydrophobicContact CE1-CD2 3.69Å; F43-L73 HydrophobicContact CZ-CD2 3.76Å
44	D	98.4	Very high	93.4	Very high	20 Å²	20	81.4 Å²	81.4	11%	0.107	44%	0.437	C	S	.	.	H	α-helix	trans	-61.2	-46.5	179.1	-74	-17	0	0	0	111.9	D40 R46 W47 V48 K78 I79	D40-D44 WeakPolarHBondContact O-CB 3.35Å; D40-D44 PolarHBondContact O-N 2.97Å; D44-R46 VanDerWaalsContact C-N 3.28Å; D44-R46 PolarHBondContact O-N 3.19Å; D44-W47 PolarHBondContact O-N 3.06Å; D44-W47 VanDerWaalsContact O-N 3.16Å; D44-V48 WeakPolarHBondContact O-CG2 3.48Å; D44-V48 PolarHBondContact O-N 3.31Å; D44-K78 WeakPolarHBondContact OD2-CE 3.45Å; D44-K78 IonicContact OD2-NZ 3.12Å; D44-K78 PolarHBondContact OD2-NZ 2.59Å; D44-I79 HydrophobicContact CB-CD1 4.49Å
45	A	98.4	Very high	94.9	Very high	54 Å²	54	78 Å²	78	45%	0.446	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-38.4	-180	0	0	0	0	0	111.5	E41 E42 F43 T49	E41-A45 WeakPolarHBondContact O-CB 3.48Å; E41-A45 PolarHBondContact O-N 3.43Å; E42-A45 PolarHBondContact O-N 3.39Å; F43-A45 PolarHBondContact O-N 3Å; A45-T49 VanDerWaalsContact O-CB 3.28Å; A45-T49 WeakPolarHBondContact O-CB 3.43Å; A45-T49 PolarHBondContact O-N 3.31Å; A45-T49 PolarHBondContact O-OG1 2.92Å
46	R	98.4	Very high	96.3	Very high	108 Å²	108	74.1 Å²	74.1	41%	0.408	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-43.7	174.3	-75.2	-167.6	-49.4	91.3	4.3	112	E38 E42 F43 D44 T49 Y50	E38-R46 IonicContact OE1-CZ 3.71Å; E38-R46 IonicContact OE1-NE 2.79Å; E38-R46 IonicContact OE1-NH2 3.78Å; E38-R46 PolarHBondContact OE1-NH2 3.33Å; E38-R46 IonicContact OE2-CZ 3.07Å; E38-R46 IonicContact OE2-NE 3.8Å; E38-R46 PolarHBondContact OE2-NE 3.09Å; E38-R46 IonicContact OE2-NH2 2.8Å; E38-R46 PolarHBondContact OE2-NH2 3.34Å; E42-R46 WeakPolarHBondContact O-CG 3.44Å; E42-R46 PolarHBondContact O-N 3.5Å; F43-R46 PolarHBondContact O-N 3.03Å; D44-R46 VanDerWaalsContact C-N 3.28Å; D44-R46 PolarHBondContact O-N 3.19Å; R46-T49 PolarHBondContact O-N 3.3Å; R46-Y50 WeakPolarHBondContact O-CB 3.5Å; R46-Y50 PolarHBondContact O-N 3.24Å
47	W	98.7	Very high	97.1	Very high	14 Å²	14	70.1 Å²	70.1	5%	0.053	38%	0.378	C	S	.	.	H	α-helix	trans	-70	-40.2	-179.3	-81.4	110.4	0	0	0	112.9	F43 D44 T49 Y50 F51 G64 T67 L68 Y71 I79	F43-W47 AromaticContact CD1-CD1 3.79Å; F43-W47 AromaticContact CE1-CD1 3.41Å; F43-W47 VanDerWaalsContact CE1-CD1 3.41Å; F43-W47 AromaticContact CE1-NE1 3.66Å; F43-W47 AromaticContact CE2-CD1 3.83Å; F43-W47 AromaticContact CE2-NE1 3.36Å; F43-W47 AromaticContact CZ-CD1 3.43Å; F43-W47 VanDerWaalsContact CZ-CD1 3.43Å; F43-W47 AromaticContact CZ-NE1 3.13Å; F43-W47 VanDerWaalsContact O-CD1 3.31Å; F43-W47 PolarHBondContact O-N 3.13Å; F43-W47 VanDerWaalsContact O-N 3.16Å; D44-W47 PolarHBondContact O-N 3.06Å; D44-W47 VanDerWaalsContact O-N 3.16Å; W47-T49 VanDerWaalsContact C-N 3.32Å; W47-T49 PolarHBondContact O-N 3.01Å; W47-Y50 HydrophobicContact CE3-CD1 4.18Å; W47-Y50 HydrophobicContact CE3-CG 4.45Å; W47-Y50 AromaticContact CZ3-CD1 3.99Å; W47-Y50 HydrophobicContact CZ3-CD1 3.99Å; W47-Y50 HydrophobicContact CZ3-CE1 4.33Å; W47-Y50 HydrophobicContact CZ3-CG 4.43Å; W47-Y50 WeakPolarHBondContact O-CB 3.45Å; W47-Y50 PolarHBondContact O-N 3.45Å; W47-F51 HydrophobicContact CE3-CD2 4.26Å; W47-F51 AromaticContact CE3-CE2 3.54Å; W47-F51 HydrophobicContact CE3-CE2 3.54Å; W47-F51 AromaticContact CE3-CZ 3.98Å; W47-F51 HydrophobicContact CE3-CZ 3.98Å; W47-F51 HydrophobicContact CZ3-CE2 4.03Å; W47-F51 AromaticContact CZ3-CZ 3.97Å; W47-F51 HydrophobicContact CZ3-CZ 3.97Å; W47-F51 VanDerWaalsContact O-CD2 3.27Å; W47-F51 WeakPolarHBondContact O-CD2 3.47Å; W47-F51 PolarHBondContact O-N 3.36Å; W47-F51 VanDerWaalsContact O-N 3.1Å; W47-G64 WeakPolarHBondContact CH2-O 3.2Å; W47-G64 WeakPolarHBondContact CZ3-O 3.23Å; W47-T67 HydrophobicContact CH2-CG2 4.26Å; W47-T67 HydrophobicContact CZ2-CG2 4.35Å; W47-L68 HydrophobicContact CD2-CB 4.5Å; W47-L68 HydrophobicContact CD2-CD1 3.94Å; W47-L68 HydrophobicContact CD2-CD2 4.46Å; W47-L68 HydrophobicContact CE3-CB 4.37Å; W47-L68 HydrophobicContact CE3-CD2 4.37Å; W47-L68 HydrophobicContact CG-CD1 4.12Å; W47-L68 HydrophobicContact CH2-CB 3.98Å; W47-L68 HydrophobicContact CZ2-CB 4.12Å; W47-L68 HydrophobicContact CZ2-CD1 4.33Å; W47-L68 HydrophobicContact CZ3-CB 4.1Å; W47-Y71 AromaticContact CZ2-CE2 3.84Å; W47-Y71 HydrophobicContact CZ2-CE2 3.84Å; W47-I79 HydrophobicContact CB-CD1 3.83Å; W47-I79 HydrophobicContact CB-CG1 3.92Å; W47-I79 HydrophobicContact CB-CG2 3.8Å; W47-I79 HydrophobicContact CG-CD1 4.43Å
48	V	98.8	Very high	97.7	Very high	39 Å²	39	65.7 Å²	65.7	24%	0.236	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-46.7	170.9	173	0	0	0	0	110.2	D44 Y50 F51 S52 K78 I79	D44-V48 WeakPolarHBondContact O-CG2 3.48Å; D44-V48 PolarHBondContact O-N 3.31Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 2.92Å; V48-F51 PolarHBondContact O-N 3.34Å; V48-S52 WeakPolarHBondContact O-CB 3.3Å; V48-S52 PolarHBondContact O-N 2.95Å; V48-S52 PolarHBondContact O-OG 3.45Å; V48-K78 HydrophobicContact CG2-CB 4.23Å; V48-K78 HydrophobicContact CG2-CD 4.49Å; V48-K78 HydrophobicContact CG2-CG 4.02Å; V48-I79 HydrophobicContact CG2-CG1 4.05Å
49	T	98.7	Very high	98.1	Very high	101 Å²	101	71.1 Å²	71.1	62%	0.62	37%	0.373	S	S	*	.	H	α-helix	trans	-61.5	-42.7	178.4	-59.3	0	0	0	0	111.5	A45 R46 W47 S52 K53	A45-T49 VanDerWaalsContact O-CB 3.28Å; A45-T49 WeakPolarHBondContact O-CB 3.43Å; A45-T49 PolarHBondContact O-N 3.31Å; A45-T49 PolarHBondContact O-OG1 2.92Å; R46-T49 PolarHBondContact O-N 3.3Å; W47-T49 VanDerWaalsContact C-N 3.32Å; W47-T49 PolarHBondContact O-N 3.01Å; T49-S52 PolarHBondContact O-N 3.12Å; T49-K53 PolarHBondContact O-N 3.1Å
50	Y	98.8	Very high	98.2	Very high	79 Å²	79	69.8 Å²	69.8	31%	0.31	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-53.6	179.5	-178.7	-92.8	0	0	0	111.7	R46 W47 V48 S52 K53 I56 E60	R46-Y50 WeakPolarHBondContact O-CB 3.5Å; R46-Y50 PolarHBondContact O-N 3.24Å; W47-Y50 HydrophobicContact CE3-CD1 4.18Å; W47-Y50 HydrophobicContact CE3-CG 4.45Å; W47-Y50 AromaticContact CZ3-CD1 3.99Å; W47-Y50 HydrophobicContact CZ3-CD1 3.99Å; W47-Y50 HydrophobicContact CZ3-CE1 4.33Å; W47-Y50 HydrophobicContact CZ3-CG 4.43Å; W47-Y50 WeakPolarHBondContact O-CB 3.45Å; W47-Y50 PolarHBondContact O-N 3.45Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 2.92Å; Y50-S52 VanDerWaalsContact C-N 3.33Å; Y50-S52 PolarHBondContact O-N 3.07Å; Y50-K53 WeakPolarHBondContact O-CB 3.39Å; Y50-K53 PolarHBondContact O-N 3Å; Y50-I56 HydrophobicContact CE1-CD1 4.22Å; Y50-E60 PolarHBondContact OH-O 3.45Å
51	F	98.8	Very high	98.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-76.8	-18	180	-67	-62	0	0	0	113.6	W47 V48 K53 I56 L61 M65 L68 I79 S82 A83 R89	W47-F51 HydrophobicContact CE3-CD2 4.26Å; W47-F51 AromaticContact CE3-CE2 3.54Å; W47-F51 HydrophobicContact CE3-CE2 3.54Å; W47-F51 AromaticContact CE3-CZ 3.98Å; W47-F51 HydrophobicContact CE3-CZ 3.98Å; W47-F51 HydrophobicContact CZ3-CE2 4.03Å; W47-F51 AromaticContact CZ3-CZ 3.97Å; W47-F51 HydrophobicContact CZ3-CZ 3.97Å; W47-F51 VanDerWaalsContact O-CD2 3.27Å; W47-F51 WeakPolarHBondContact O-CD2 3.47Å; W47-F51 PolarHBondContact O-N 3.36Å; W47-F51 VanDerWaalsContact O-N 3.1Å; V48-F51 PolarHBondContact O-N 3.34Å; F51-K53 VanDerWaalsContact C-N 3.27Å; F51-K53 PolarHBondContact O-N 3.49Å; F51-I56 HydrophobicContact CD1-CD1 4.08Å; F51-L61 HydrophobicContact CD1-CD1 4.02Å; F51-L61 HydrophobicContact CE1-CD1 3.98Å; F51-M65 HydrophobicContact CE1-CG 4.18Å; F51-M65 HydrophobicContact CE1-SD 4.11Å; F51-M65 HydrophobicContact CE2-SD 4.17Å; F51-M65 HydrophobicContact CZ-CG 4.07Å; F51-M65 HydrophobicContact CZ-SD 3.54Å; F51-M65 VanDerWaalsContact CZ-SD 3.54Å; F51-L68 HydrophobicContact CE2-CD2 3.97Å; F51-L68 HydrophobicContact CZ-CD2 4.41Å; F51-I79 HydrophobicContact CD2-CG2 4.02Å; F51-I79 HydrophobicContact CE2-CG2 3.92Å; F51-S82 WeakPolarHBondContact CB-OG 3.5Å; F51-A83 HydrophobicContact CB-CB 4.42Å; F51-A83 HydrophobicContact CD1-CB 4.09Å; F51-A83 HydrophobicContact CD2-CB 3.98Å; F51-A83 HydrophobicContact CE1-CB 4.34Å; F51-A83 HydrophobicContact CE2-CB 4.22Å; F51-A83 HydrophobicContact CG-CB 3.92Å; F51-A83 HydrophobicContact CZ-CB 4.4Å; F51-R89 PolarHBondContact O-NH2 3Å
52	S	98.6	Very high	98.4	Very high	61 Å²	61	63 Å²	63	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-78.6	-8.8	175.4	-61.7	0	0	0	0	113.5	V48 T49 Y50 P54	V48-S52 WeakPolarHBondContact O-CB 3.3Å; V48-S52 PolarHBondContact O-N 2.95Å; V48-S52 PolarHBondContact O-OG 3.45Å; T49-S52 PolarHBondContact O-N 3.12Å; Y50-S52 VanDerWaalsContact C-N 3.33Å; Y50-S52 PolarHBondContact O-N 3.07Å; S52-P54 VanDerWaalsContact O-N 3.15Å
53	K	98.3	Very high	98.4	Very high	73 Å²	73	64.2 Å²	64.2	32%	0.317	33%	0.329	S	S	.	.			trans	-51.9	120.1	174.9	-179.6	-174.8	173	-155.2	0	110	T49 Y50 F51 D55 I56 E60 R89	T49-K53 PolarHBondContact O-N 3.1Å; Y50-K53 WeakPolarHBondContact O-CB 3.39Å; Y50-K53 PolarHBondContact O-N 3Å; F51-K53 VanDerWaalsContact C-N 3.27Å; F51-K53 PolarHBondContact O-N 3.49Å; K53-D55 VanDerWaalsContact C-N 3.31Å; K53-D55 WeakPolarHBondContact CE-OD1 3.32Å; K53-D55 VanDerWaalsContact CG-OD1 3.22Å; K53-D55 WeakPolarHBondContact CG-OD1 3.46Å; K53-D55 PolarHBondContact O-N 2.93Å; K53-I56 HydrophobicContact CB-CB 4.26Å; K53-I56 WeakPolarHBondContact O-CB 3.47Å; K53-I56 WeakPolarHBondContact O-CG2 3.47Å; K53-I56 PolarHBondContact O-N 3.47Å; K53-E60 IonicContact NZ-OE1 3.55Å; K53-E60 PolarHBondContact NZ-OE1 2.93Å; K53-E60 IonicContact NZ-OE2 2.67Å; K53-E60 PolarHBondContact NZ-OE2 3.3Å; K53-R89 PolarHBondContact O-NH2 3.4Å
54	P	98.1	Very high	98.5	Very high	106 Å²	106	63.3 Å²	63.3	69%	0.688	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-36.7	-168.9	23.7	-33.4	0	0	0	112.6	S52 R89	S52-P54 VanDerWaalsContact O-N 3.15Å; P54-R89 PolarHBondContact O-NE 2.82Å
55	D	97.4	Very high	98.5	Very high	115 Å²	115	63 Å²	63	62%	0.615	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	26.9	-179.6	63.9	-32.9	0	0	0	112.7	K53 D57	K53-D55 VanDerWaalsContact C-N 3.31Å; K53-D55 WeakPolarHBondContact CE-OD1 3.32Å; K53-D55 VanDerWaalsContact CG-OD1 3.22Å; K53-D55 WeakPolarHBondContact CG-OD1 3.46Å; K53-D55 PolarHBondContact O-N 2.93Å; D55-D57 PolarHBondContact O-N 3.28Å
56	I	98.4	Very high	98.5	Very high	8 Å²	8	65.7 Å²	65.7	4%	0.041	33%	0.331	C	S	.	.			trans	-57.4	130.4	172.6	-168.1	171.5	0	0	0	110.1	Y50 F51 K53 E60 L61 A86 R89 L90	Y50-I56 HydrophobicContact CE1-CD1 4.22Å; F51-I56 HydrophobicContact CD1-CD1 4.08Å; K53-I56 HydrophobicContact CB-CB 4.26Å; K53-I56 WeakPolarHBondContact O-CB 3.47Å; K53-I56 WeakPolarHBondContact O-CG2 3.47Å; K53-I56 PolarHBondContact O-N 3.47Å; I56-E60 WeakPolarHBondContact CA-OE2 3.44Å; I56-E60 HydrophobicContact CD1-CB 4.22Å; I56-E60 HydrophobicContact CG1-CB 3.6Å; I56-L61 HydrophobicContact CD1-CB 4.48Å; I56-A86 HydrophobicContact CG2-CB 3.92Å; I56-R89 VanDerWaalsContact CG2-NH2 3.34Å; I56-L90 WeakPolarHBondContact O-CD2 3.39Å
57	D	98.5	Very high	98.5	Very high	74 Å²	74	62.6 Å²	62.6	40%	0.396	32%	0.324	S	S	.	.			trans	-91.7	169.2	177.9	75.6	38.4	0	0	0	112.6	D55 W59 E60 L61	D55-D57 PolarHBondContact O-N 3.28Å; D57-W59 PolarHBondContact O-N 3.13Å; D57-W59 WeakPolarHBondContact OD1-CA 3.27Å; D57-W59 VanDerWaalsContact OD1-CB 3.31Å; D57-W59 WeakPolarHBondContact OD1-CB 3.48Å; D57-W59 PolarHBondContact OD1-N 3.48Å; D57-E60 PolarHBondContact N-OE2 3.4Å; D57-E60 VanDerWaalsContact N-OE2 3.13Å; D57-E60 PolarHBondContact O-N 3.17Å; D57-E60 WeakPolarHBondContact OD1-CG 3.35Å; D57-E60 PolarHBondContact OD1-N 3.42Å; D57-L61 PolarHBondContact O-N 3.1Å
58	A	98.1	Very high	98.4	Very high	45 Å²	45	61.9 Å²	61.9	37%	0.372	32%	0.321	S	S	.	.	H	α-helix	trans	-65.1	-26.2	-178.5	0	0	0	0	0	113.4	K62	A58-K62 WeakPolarHBondContact O-CD 3.33Å; A58-K62 VanDerWaalsContact O-CG 3.27Å; A58-K62 WeakPolarHBondContact O-CG 3.42Å; A58-K62 PolarHBondContact O-N 3.46Å
59	W	98.4	Very high	98.4	Very high	176 Å²	176	62.4 Å²	62.4	67%	0.667	32%	0.322	S	S	*	.	H	α-helix	trans	-75.4	-43.8	175.9	177.5	92.5	0	0	0	110.7	D57 K62 K63	D57-W59 PolarHBondContact O-N 3.13Å; D57-W59 WeakPolarHBondContact OD1-CA 3.27Å; D57-W59 VanDerWaalsContact OD1-CB 3.31Å; D57-W59 WeakPolarHBondContact OD1-CB 3.48Å; D57-W59 PolarHBondContact OD1-N 3.48Å; W59-K62 PolarHBondContact O-N 3.09Å; W59-K63 HydrophobicContact CE3-CB 4.39Å; W59-K63 HydrophobicContact CH2-CB 4.29Å; W59-K63 HydrophobicContact CH2-CG 4.02Å; W59-K63 HydrophobicContact CZ2-CB 4.41Å; W59-K63 HydrophobicContact CZ2-CG 4.33Å; W59-K63 HydrophobicContact CZ3-CB 4.28Å; W59-K63 HydrophobicContact CZ3-CG 4.33Å; W59-K63 VanDerWaalsContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CB 3.44Å; W59-K63 PolarHBondContact O-N 2.8Å
60	E	98.7	Very high	98.3	Very high	40 Å²	40	60.7 Å²	60.7	19%	0.187	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-46	175.6	-70.7	-178.5	136.5	0	0	110.9	Y50 K53 I56 D57 K62 K63 G64	Y50-E60 PolarHBondContact OH-O 3.45Å; K53-E60 IonicContact NZ-OE1 3.55Å; K53-E60 PolarHBondContact NZ-OE1 2.93Å; K53-E60 IonicContact NZ-OE2 2.67Å; K53-E60 PolarHBondContact NZ-OE2 3.3Å; I56-E60 WeakPolarHBondContact CA-OE2 3.44Å; I56-E60 HydrophobicContact CD1-CB 4.22Å; I56-E60 HydrophobicContact CG1-CB 3.6Å; D57-E60 PolarHBondContact N-OE2 3.4Å; D57-E60 VanDerWaalsContact N-OE2 3.13Å; D57-E60 PolarHBondContact O-N 3.17Å; D57-E60 WeakPolarHBondContact OD1-CG 3.35Å; D57-E60 PolarHBondContact OD1-N 3.42Å; E60-K62 PolarHBondContact O-N 3.35Å; E60-K63 PolarHBondContact O-N 3.48Å; E60-G64 PolarHBondContact O-N 2.79Å
61	L	98.8	Very high	98.2	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-54.2	-51.7	174.6	175.9	67.5	0	0	0	111.4	F51 I56 D57 G64 M65 A86 L90	F51-L61 HydrophobicContact CD1-CD1 4.02Å; F51-L61 HydrophobicContact CE1-CD1 3.98Å; I56-L61 HydrophobicContact CD1-CB 4.48Å; D57-L61 PolarHBondContact O-N 3.1Å; L61-G64 PolarHBondContact O-N 3.48Å; L61-M65 HydrophobicContact CD1-CG 4.48Å; L61-M65 PolarHBondContact O-N 3.39Å; L61-A86 HydrophobicContact CD1-CB 4.13Å; L61-L90 HydrophobicContact CB-CD1 3.93Å; L61-L90 HydrophobicContact CD2-CD1 3.74Å; L61-L90 HydrophobicContact CG-CD1 4.41Å
62	K	98.3	Very high	98.2	Very high	112 Å²	112	69.4 Å²	69.4	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-64.8	-41.2	-179.8	-71.6	173	-176.4	179.9	0	111.5	A58 W59 E60 G64 N66	A58-K62 WeakPolarHBondContact O-CD 3.33Å; A58-K62 VanDerWaalsContact O-CG 3.27Å; A58-K62 WeakPolarHBondContact O-CG 3.42Å; A58-K62 PolarHBondContact O-N 3.46Å; W59-K62 PolarHBondContact O-N 3.09Å; E60-K62 PolarHBondContact O-N 3.35Å; K62-G64 VanDerWaalsContact C-N 3.35Å; K62-N66 VanDerWaalsContact O-CB 3.22Å; K62-N66 WeakPolarHBondContact O-CB 3.5Å; K62-N66 PolarHBondContact O-N 3.32Å; K62-N66 PolarHBondContact O-ND2 3.29Å
63	K	98.6	Very high	98.1	Very high	101 Å²	101	69.3 Å²	69.3	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-43.3	178	177.5	55.4	-174.8	155.2	0	110.9	W59 E60 T67	W59-K63 HydrophobicContact CE3-CB 4.39Å; W59-K63 HydrophobicContact CH2-CB 4.29Å; W59-K63 HydrophobicContact CH2-CG 4.02Å; W59-K63 HydrophobicContact CZ2-CB 4.41Å; W59-K63 HydrophobicContact CZ2-CG 4.33Å; W59-K63 HydrophobicContact CZ3-CB 4.28Å; W59-K63 HydrophobicContact CZ3-CG 4.33Å; W59-K63 VanDerWaalsContact O-CB 3.27Å; W59-K63 WeakPolarHBondContact O-CB 3.44Å; W59-K63 PolarHBondContact O-N 2.8Å; E60-K63 PolarHBondContact O-N 3.48Å; K63-T67 WeakPolarHBondContact CE-OG1 3.05Å; K63-T67 PolarHBondContact NZ-OG1 3.35Å; K63-T67 VanDerWaalsContact NZ-OG1 3.1Å; K63-T67 VanDerWaalsContact O-CB 3.3Å; K63-T67 WeakPolarHBondContact O-CB 3.39Å; K63-T67 PolarHBondContact O-N 3.46Å; K63-T67 PolarHBondContact O-OG1 3Å
64	G	98.6	Very high	98.1	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-58.4	-58.1	174.8	0	0	0	0	0	111.3	W47 E60 L61 K62 N66 T67 L68	W47-G64 WeakPolarHBondContact CH2-O 3.2Å; W47-G64 WeakPolarHBondContact CZ3-O 3.23Å; E60-G64 PolarHBondContact O-N 2.79Å; L61-G64 PolarHBondContact O-N 3.48Å; K62-G64 VanDerWaalsContact C-N 3.35Å; G64-N66 PolarHBondContact O-N 2.95Å; G64-T67 PolarHBondContact O-N 3.35Å; G64-T67 VanDerWaalsContact O-N 3.13Å; G64-L68 WeakPolarHBondContact O-CB 3.41Å; G64-L68 PolarHBondContact O-N 3.49Å
65	M	98.5	Very high	98.1	Very high	13 Å²	13	62.6 Å²	62.6	6%	0.064	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-46.1	-179.1	-71.8	-53.6	-48.7	0	0	112.9	F51 L61 T67 L68 I69 A83 I99	F51-M65 HydrophobicContact CE1-CG 4.18Å; F51-M65 HydrophobicContact CE1-SD 4.11Å; F51-M65 HydrophobicContact CE2-SD 4.17Å; F51-M65 HydrophobicContact CZ-CG 4.07Å; F51-M65 HydrophobicContact CZ-SD 3.54Å; F51-M65 VanDerWaalsContact CZ-SD 3.54Å; L61-M65 HydrophobicContact CD1-CG 4.48Å; L61-M65 PolarHBondContact O-N 3.39Å; M65-T67 PolarHBondContact O-N 2.99Å; M65-L68 HydrophobicContact CE-CD2 4.45Å; M65-L68 PolarHBondContact O-N 3.37Å; M65-L68 HydrophobicContact SD-CD2 4.38Å; M65-I69 HydrophobicContact CE-CG2 4.31Å; M65-I69 WeakPolarHBondContact O-CG1 3.48Å; M65-I69 WeakPolarHBondContact O-CG2 3.4Å; M65-I69 PolarHBondContact O-N 3.44Å; M65-A83 HydrophobicContact SD-CB 4.09Å; M65-I99 HydrophobicContact CE-CB 4.44Å; M65-I99 HydrophobicContact CE-CG1 3.97Å; M65-I99 HydrophobicContact CE-CG2 3.89Å; M65-I99 HydrophobicContact CG-CD1 3.94Å; M65-I99 HydrophobicContact CG-CG1 3.98Å; M65-I99 HydrophobicContact SD-CD1 4.04Å; M65-I99 HydrophobicContact SD-CG1 4.1Å; M65-I99 HydrophobicContact SD-CG2 4.46Å
66	N	98.3	Very high	98.1	Very high	112 Å²	112	61 Å²	61	60%	0.599	32%	0.316	S	S	*	.	H	α-helix	trans	-63.2	-30	178.5	-72.5	-19.7	0	0	0	113	K62 G64	K62-N66 VanDerWaalsContact O-CB 3.22Å; K62-N66 WeakPolarHBondContact O-CB 3.5Å; K62-N66 PolarHBondContact O-N 3.32Å; K62-N66 PolarHBondContact O-ND2 3.29Å; G64-N66 PolarHBondContact O-N 2.95Å
67	T	98.4	Very high	98.2	Very high	42 Å²	42	61.3 Å²	61.3	26%	0.258	32%	0.319	S	S	.	.	H	α-helix	trans	-79.1	-43.4	176	-54.1	0	0	0	0	110.2	W47 K63 G64 M65 G70 Y71	W47-T67 HydrophobicContact CH2-CG2 4.26Å; W47-T67 HydrophobicContact CZ2-CG2 4.35Å; K63-T67 WeakPolarHBondContact CE-OG1 3.05Å; K63-T67 PolarHBondContact NZ-OG1 3.35Å; K63-T67 VanDerWaalsContact NZ-OG1 3.1Å; K63-T67 VanDerWaalsContact O-CB 3.3Å; K63-T67 WeakPolarHBondContact O-CB 3.39Å; K63-T67 PolarHBondContact O-N 3.46Å; K63-T67 PolarHBondContact O-OG1 3Å; G64-T67 PolarHBondContact O-N 3.35Å; G64-T67 VanDerWaalsContact O-N 3.13Å; M65-T67 PolarHBondContact O-N 2.99Å; T67-G70 PolarHBondContact O-N 3.12Å; T67-G70 VanDerWaalsContact O-N 3.09Å; T67-Y71 HydrophobicContact CG2-CE2 4.33Å
68	L	98.2	Very high	98.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-44.9	-178.5	179	59.3	0	0	0	112.4	F43 W47 F51 G64 M65 G70 Y71 L73 P75 I79	F43-L68 HydrophobicContact CE1-CD1 4.31Å; F43-L68 HydrophobicContact CZ-CD1 4.15Å; W47-L68 HydrophobicContact CD2-CB 4.5Å; W47-L68 HydrophobicContact CD2-CD1 3.94Å; W47-L68 HydrophobicContact CD2-CD2 4.46Å; W47-L68 HydrophobicContact CE3-CB 4.37Å; W47-L68 HydrophobicContact CE3-CD2 4.37Å; W47-L68 HydrophobicContact CG-CD1 4.12Å; W47-L68 HydrophobicContact CH2-CB 3.98Å; W47-L68 HydrophobicContact CZ2-CB 4.12Å; W47-L68 HydrophobicContact CZ2-CD1 4.33Å; W47-L68 HydrophobicContact CZ3-CB 4.1Å; F51-L68 HydrophobicContact CE2-CD2 3.97Å; F51-L68 HydrophobicContact CZ-CD2 4.41Å; G64-L68 WeakPolarHBondContact O-CB 3.41Å; G64-L68 PolarHBondContact O-N 3.49Å; M65-L68 HydrophobicContact CE-CD2 4.45Å; M65-L68 PolarHBondContact O-N 3.37Å; M65-L68 HydrophobicContact SD-CD2 4.38Å; L68-G70 PolarHBondContact O-N 3.15Å; L68-Y71 HydrophobicContact CD1-CD2 4.4Å; L68-Y71 WeakPolarHBondContact O-CD2 3.29Å; L68-Y71 PolarHBondContact O-N 3.35Å; L68-L73 HydrophobicContact CD1-CD1 4.49Å; L68-P75 HydrophobicContact CD1-CB 4.39Å; L68-P75 HydrophobicContact CD1-CG 4.08Å; L68-P75 HydrophobicContact CD2-CB 3.91Å; L68-P75 HydrophobicContact CD2-CG 3.73Å; L68-P75 HydrophobicContact CG-CB 4.27Å; L68-P75 HydrophobicContact CG-CG 3.68Å; L68-I79 HydrophobicContact CD2-CG2 3.65Å
69	I	97.1	Very high	98.2	Very high	50 Å²	50	60.4 Å²	60.4	26%	0.256	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.2	176.7	66.1	-177.3	0	0	0	113.1	M65 Y71 A102 K106	M65-I69 HydrophobicContact CE-CG2 4.31Å; M65-I69 WeakPolarHBondContact O-CG1 3.48Å; M65-I69 WeakPolarHBondContact O-CG2 3.4Å; M65-I69 PolarHBondContact O-N 3.44Å; I69-Y71 VanDerWaalsContact C-N 3.3Å; I69-A102 HydrophobicContact CG2-CB 4.49Å; I69-K106 HydrophobicContact CB-CD 4.22Å; I69-K106 HydrophobicContact CB-CG 4.25Å; I69-K106 HydrophobicContact CG2-CG 4.31Å; I69-K106 WeakPolarHBondContact O-CD 3.31Å; I69-K106 WeakPolarHBondContact O-CE 3.49Å; I69-K106 PolarHBondContact O-NZ 2.94Å
70	G	97.3	Very high	98.2	Very high	64 Å²	64	52 Å²	52	66%	0.66	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.5	177.3	0	0	0	0	0	114.1	T67 L68	T67-G70 PolarHBondContact O-N 3.12Å; T67-G70 VanDerWaalsContact O-N 3.09Å; L68-G70 PolarHBondContact O-N 3.15Å
71	Y	97.8	Very high	98.2	Very high	92 Å²	92	52 Å²	52	36%	0.361	27%	0.273	S	S	.	.	S	Bend	trans	-76.1	154.3	173.5	-65	-73.2	0	0	0	111.5	F43 W47 T67 L68 I69 L73 K106	F43-Y71 HydrophobicContact CE2-CD1 4.47Å; F43-Y71 HydrophobicContact CE2-CD2 4.13Å; F43-Y71 HydrophobicContact CE2-CE1 4.31Å; F43-Y71 AromaticContact CE2-CE2 3.98Å; F43-Y71 HydrophobicContact CE2-CE2 3.98Å; F43-Y71 HydrophobicContact CE2-CG 4.38Å; 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 4.2Å; W47-Y71 AromaticContact CZ2-CE2 3.84Å; W47-Y71 HydrophobicContact CZ2-CE2 3.84Å; T67-Y71 HydrophobicContact CG2-CE2 4.33Å; L68-Y71 HydrophobicContact CD1-CD2 4.4Å; L68-Y71 WeakPolarHBondContact O-CD2 3.29Å; L68-Y71 PolarHBondContact O-N 3.35Å; I69-Y71 VanDerWaalsContact C-N 3.3Å; Y71-L73 PolarHBondContact O-N 3.25Å; Y71-K106 PolarHBondContact O-NZ 3.34Å
72	D	97	Very high	98.2	Very high	170 Å²	170	52.2 Å²	52.2	91%	0.909	27%	0.274	S	S	*	.	S	Bend	trans	-81.8	59.8	176.1	-166.5	23.5	0	0	0	111.4
73	L	96.7	Very high	98.2	Very high	60 Å²	60	46.9 Å²	46.9	31%	0.314	25%	0.251	S	S	.	.	S	Bend	trans	-153.8	163.9	178	60.9	85.8	0	0	0	110.4	F43 L68 Y71 P75 K106	F43-L73 HydrophobicContact CD1-CD2 4.49Å; F43-L73 HydrophobicContact CE1-CD1 4.42Å; F43-L73 HydrophobicContact CE1-CD2 3.69Å; F43-L73 HydrophobicContact CZ-CD2 3.76Å; L68-L73 HydrophobicContact CD1-CD1 4.49Å; Y71-L73 PolarHBondContact O-N 3.25Å; L73-P75 HydrophobicContact CD1-CG 4.25Å; L73-K106 WeakPolarHBondContact O-CE 3.38Å
74	V	98.3	Very high	98.2	Very high	35 Å²	35	42 Å²	42	21%	0.212	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-98.6	128.8	162.4	-174.3	0	0	0	0	107.7	V103 K106 I113 L117	V74-V103 HydrophobicContact CG1-CG1 4Å; V74-K106 HydrophobicContact CG2-CB 4.38Å; V74-I113 HydrophobicContact CB-CG2 4.18Å; V74-I113 HydrophobicContact CG1-CG2 3.92Å; V74-I113 HydrophobicContact CG2-CD1 4.26Å; V74-I113 HydrophobicContact CG2-CG2 4.2Å; V74-L117 HydrophobicContact CG1-CD1 3.61Å
75	P	98.4	Very high	98.3	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.013	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-64.2	140.5	-176.8	-23.5	34.9	0	0	0	113.1	L68 L73 I79 L80	L68-P75 HydrophobicContact CD1-CB 4.39Å; L68-P75 HydrophobicContact CD1-CG 4.08Å; L68-P75 HydrophobicContact CD2-CB 3.91Å; L68-P75 HydrophobicContact CD2-CG 3.73Å; L68-P75 HydrophobicContact CG-CB 4.27Å; L68-P75 HydrophobicContact CG-CG 3.68Å; L73-P75 HydrophobicContact CD1-CG 4.25Å; P75-I79 HydrophobicContact CB-CB 4.47Å; P75-I79 HydrophobicContact CB-CD1 4.47Å; P75-I79 HydrophobicContact CB-CG2 4.47Å; P75-L80 HydrophobicContact CB-CD2 3.99Å; P75-L80 HydrophobicContact CB-CG 4.26Å; P75-L80 HydrophobicContact CG-CD2 4.43Å
76	E	98.6	Very high	98.3	Very high	82 Å²	82	45 Å²	45	38%	0.383	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-60.4	148.3	176.8	-75.9	-67.3	152.4	0	0	112.8	K78 I79 L80	E76-K78 HydrophobicContact CB-CG 4.03Å; E76-K78 PolarHBondContact O-N 2.79Å; E76-K78 VanDerWaalsContact O-N 3.12Å; E76-I79 HydrophobicContact CB-CD1 4.31Å; E76-I79 HydrophobicContact CB-CG1 4.42Å; E76-I79 WeakPolarHBondContact O-CB 3.39Å; E76-I79 PolarHBondContact O-N 2.66Å; E76-L80 PolarHBondContact O-N 3.48Å
77	P	98.7	Very high	98.3	Very high	15 Å²	15	39.8 Å²	39.8	10%	0.097	21%	0.212	C	C	.	.	H	α-helix	trans	-51.6	-39.1	179.5	-26.8	32.7	0	0	0	113.9	I79 L80 D81 Y116 L117 E120 L121	P77-I79 VanDerWaalsContact C-N 3.3Å; P77-I79 PolarHBondContact O-N 3.29Å; P77-L80 PolarHBondContact O-N 3.31Å; P77-L80 VanDerWaalsContact O-N 3.17Å; P77-D81 PolarHBondContact O-N 3.41Å; P77-Y116 HydrophobicContact CG-CE1 4.08Å; P77-L117 HydrophobicContact CG-CD2 3.65Å; P77-E120 HydrophobicContact CB-CB 3.8Å; P77-E120 HydrophobicContact CG-CB 3.81Å; P77-E120 HydrophobicContact CG-CG 4.1Å; P77-L121 HydrophobicContact CB-CD2 4.43Å; P77-L121 WeakPolarHBondContact O-CD2 3.37Å
78	K	98.6	Very high	98.3	Very high	99 Å²	99	44.4 Å²	44.4	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-61.3	-34.5	177.5	59.9	-173.6	165.1	175.6	0	113.3	D44 V48 E76 S82	D44-K78 WeakPolarHBondContact OD2-CE 3.45Å; D44-K78 IonicContact OD2-NZ 3.12Å; D44-K78 PolarHBondContact OD2-NZ 2.59Å; V48-K78 HydrophobicContact CG2-CB 4.23Å; V48-K78 HydrophobicContact CG2-CD 4.49Å; V48-K78 HydrophobicContact CG2-CG 4.02Å; E76-K78 HydrophobicContact CB-CG 4.03Å; E76-K78 PolarHBondContact O-N 2.79Å; E76-K78 VanDerWaalsContact O-N 3.12Å; K78-S82 PolarHBondContact O-N 2.69Å
79	I	98.8	Very high	98.3	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-46.5	175.3	-60.6	171.4	0	0	0	108.8	D44 W47 V48 F51 L68 P75 E76 P77 D81 S82 A83	D44-I79 HydrophobicContact CB-CD1 4.49Å; W47-I79 HydrophobicContact CB-CD1 3.83Å; W47-I79 HydrophobicContact CB-CG1 3.92Å; W47-I79 HydrophobicContact CB-CG2 3.8Å; W47-I79 HydrophobicContact CG-CD1 4.43Å; V48-I79 HydrophobicContact CG2-CG1 4.05Å; F51-I79 HydrophobicContact CD2-CG2 4.02Å; F51-I79 HydrophobicContact CE2-CG2 3.92Å; L68-I79 HydrophobicContact CD2-CG2 3.65Å; P75-I79 HydrophobicContact CB-CB 4.47Å; P75-I79 HydrophobicContact CB-CD1 4.47Å; P75-I79 HydrophobicContact CB-CG2 4.47Å; E76-I79 HydrophobicContact CB-CD1 4.31Å; E76-I79 HydrophobicContact CB-CG1 4.42Å; E76-I79 WeakPolarHBondContact O-CB 3.39Å; E76-I79 PolarHBondContact O-N 2.66Å; P77-I79 VanDerWaalsContact C-N 3.3Å; P77-I79 PolarHBondContact O-N 3.29Å; I79-D81 PolarHBondContact O-N 3.03Å; I79-S82 PolarHBondContact O-N 3.35Å; I79-S82 PolarHBondContact O-OG 3.14Å; I79-A83 PolarHBondContact O-N 2.91Å
80	L	98.8	Very high	98.4	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-41.5	179.4	-61.4	-179.6	0	0	0	112	P75 E76 P77 S82 A83 L84 I99 V103 L117 L121	P75-L80 HydrophobicContact CB-CD2 3.99Å; P75-L80 HydrophobicContact CB-CG 4.26Å; P75-L80 HydrophobicContact CG-CD2 4.43Å; E76-L80 PolarHBondContact O-N 3.48Å; P77-L80 PolarHBondContact O-N 3.31Å; P77-L80 VanDerWaalsContact O-N 3.17Å; L80-S82 VanDerWaalsContact C-N 3.33Å; L80-S82 PolarHBondContact O-N 2.9Å; L80-A83 PolarHBondContact O-N 2.67Å; L80-A83 VanDerWaalsContact O-N 3.14Å; L80-L84 VanDerWaalsContact O-CG 3.27Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.21Å; L80-I99 HydrophobicContact CD2-CG2 4.02Å; L80-V103 HydrophobicContact CD1-CB 4.45Å; L80-V103 HydrophobicContact CD1-CG1 3.9Å; L80-V103 HydrophobicContact CD1-CG2 3.81Å; L80-V103 HydrophobicContact CD2-CG2 3.59Å; L80-V103 HydrophobicContact CG-CG2 4.37Å; L80-L117 HydrophobicContact CD1-CD1 4.27Å; L80-L117 HydrophobicContact CD1-CD2 4.47Å; L80-L121 HydrophobicContact CB-CD1 3.84Å; L80-L121 HydrophobicContact CB-CD2 4.11Å; L80-L121 HydrophobicContact CD1-CD1 3.93Å
81	D	98.8	Very high	98.4	Very high	40 Å²	40	52 Å²	52	21%	0.214	24%	0.243	C	C	.	.	H	α-helix	trans	-55	-49	173.7	176.1	65.9	0	0	0	111.3	P77 I79 A83 L84 R85 L121 T124	P77-D81 PolarHBondContact O-N 3.41Å; I79-D81 PolarHBondContact O-N 3.03Å; D81-A83 VanDerWaalsContact C-N 3.3Å; D81-A83 PolarHBondContact O-N 3.3Å; D81-L84 PolarHBondContact O-N 3.17Å; D81-R85 WeakPolarHBondContact O-CB 3.46Å; D81-R85 VanDerWaalsContact O-CG 3.32Å; D81-R85 WeakPolarHBondContact O-CG 3.28Å; D81-R85 PolarHBondContact O-N 3.26Å; D81-R85 IonicContact OD1-CZ 3.72Å; D81-R85 IonicContact OD1-NE 3.36Å; D81-R85 PolarHBondContact OD1-NE 3.5Å; D81-R85 VanDerWaalsContact OD1-NE 3.07Å; D81-R85 IonicContact OD1-NH2 3.71Å; D81-R85 IonicContact OD2-NE 3.52Å; D81-R85 PolarHBondContact OD2-NE 2.95Å; D81-R85 VanDerWaalsContact OD2-NE 3.12Å; D81-L121 HydrophobicContact CB-CD2 4.11Å; D81-T124 WeakPolarHBondContact OD1-CB 3.37Å; D81-T124 WeakPolarHBondContact OD1-CG2 3.48Å; D81-T124 PolarHBondContact OD1-OG1 2.88Å
82	S	98.8	Very high	98.4	Very high	5 Å²	5	49.6 Å²	49.6	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-36.6	178.6	71	0	0	0	0	112.6	F51 K78 I79 L80 A86	F51-S82 WeakPolarHBondContact CB-OG 3.5Å; K78-S82 PolarHBondContact O-N 2.69Å; I79-S82 PolarHBondContact O-N 3.35Å; I79-S82 PolarHBondContact O-OG 3.14Å; L80-S82 VanDerWaalsContact C-N 3.33Å; L80-S82 PolarHBondContact O-N 2.9Å; S82-A86 PolarHBondContact O-N 2.92Å
83	A	98.8	Very high	98.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.8	-42.1	176.5	0	0	0	0	0	112.3	F51 M65 I79 L80 D81 R85 A86 C87 I99	F51-A83 HydrophobicContact CB-CB 4.42Å; F51-A83 HydrophobicContact CD1-CB 4.09Å; F51-A83 HydrophobicContact CD2-CB 3.98Å; F51-A83 HydrophobicContact CE1-CB 4.34Å; F51-A83 HydrophobicContact CE2-CB 4.22Å; F51-A83 HydrophobicContact CG-CB 3.92Å; F51-A83 HydrophobicContact CZ-CB 4.4Å; M65-A83 HydrophobicContact SD-CB 4.09Å; I79-A83 PolarHBondContact O-N 2.91Å; L80-A83 PolarHBondContact O-N 2.67Å; L80-A83 VanDerWaalsContact O-N 3.14Å; D81-A83 VanDerWaalsContact C-N 3.3Å; D81-A83 PolarHBondContact O-N 3.3Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 2.96Å; A83-A86 WeakPolarHBondContact O-CA 3.15Å; A83-A86 VanDerWaalsContact O-CB 3.29Å; A83-A86 WeakPolarHBondContact O-CB 3.41Å; A83-A86 PolarHBondContact O-N 3.25Å; A83-A86 VanDerWaalsContact O-N 3.1Å; A83-C87 PolarHBondContact O-N 3.09Å; A83-C87 PolarHBondContact O-SG 3.25Å; A83-C87 VanDerWaalsContact O-SG 3.41Å; A83-I99 HydrophobicContact CB-CD1 4.3Å
84	L	98.8	Very high	98.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-39.6	175.6	-66.5	175.1	0	0	0	111.3	L80 D81 A86 C87 R88 A96 L121 T124 L125 L128 I130	L80-L84 VanDerWaalsContact O-CG 3.27Å; L80-L84 WeakPolarHBondContact O-CG 3.39Å; L80-L84 PolarHBondContact O-N 3.21Å; D81-L84 PolarHBondContact O-N 3.17Å; L84-A86 VanDerWaalsContact C-N 3.3Å; L84-A86 PolarHBondContact O-N 3.37Å; L84-C87 WeakPolarHBondContact O-CB 3.29Å; L84-C87 PolarHBondContact O-N 2.94Å; L84-R88 PolarHBondContact O-N 3.4Å; L84-A96 HydrophobicContact CD2-CB 3.83Å; L84-L121 HydrophobicContact CD1-CD1 4.36Å; L84-L121 HydrophobicContact CD1-CD2 4.38Å; L84-T124 HydrophobicContact CB-CG2 4.42Å; L84-T124 HydrophobicContact CD1-CG2 4.4Å; L84-L125 HydrophobicContact CD1-CD2 4.04Å; L84-L128 HydrophobicContact CB-CD1 4.24Å; L84-I130 HydrophobicContact CB-CD1 4.2Å; L84-I130 HydrophobicContact CD2-CD1 4.19Å
85	R	98.8	Very high	98.6	Very high	76 Å²	76	46.1 Å²	46.1	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-64.5	-34.9	172.1	-69.5	177.3	-174.6	-74.9	-6.3	111.7	D81 A83 R88 R89 E127 L128	D81-R85 WeakPolarHBondContact O-CB 3.46Å; D81-R85 VanDerWaalsContact O-CG 3.32Å; D81-R85 WeakPolarHBondContact O-CG 3.28Å; D81-R85 PolarHBondContact O-N 3.26Å; D81-R85 IonicContact OD1-CZ 3.72Å; D81-R85 IonicContact OD1-NE 3.36Å; D81-R85 PolarHBondContact OD1-NE 3.5Å; D81-R85 VanDerWaalsContact OD1-NE 3.07Å; D81-R85 IonicContact OD1-NH2 3.71Å; D81-R85 IonicContact OD2-NE 3.52Å; D81-R85 PolarHBondContact OD2-NE 2.95Å; D81-R85 VanDerWaalsContact OD2-NE 3.12Å; A83-R85 VanDerWaalsContact C-N 3.34Å; A83-R85 PolarHBondContact O-N 2.96Å; R85-R88 WeakPolarHBondContact O-CB 3.23Å; R85-R88 PolarHBondContact O-N 2.88Å; R85-R89 WeakPolarHBondContact O-CG 2.99Å; R85-R89 PolarHBondContact O-N 2.95Å; R85-R89 PolarHBondContact O-NH1 3.14Å; R85-E127 IonicContact CZ-OE1 2.82Å; R85-E127 IonicContact CZ-OE2 2.8Å; R85-E127 IonicContact NH1-OE1 2.68Å; R85-E127 PolarHBondContact NH1-OE1 3.1Å; R85-E127 IonicContact NH1-OE2 3.72Å; R85-E127 PolarHBondContact NH1-OE2 3.12Å; R85-E127 IonicContact NH2-OE1 3.41Å; R85-E127 IonicContact NH2-OE2 3.49Å; R85-E127 PolarHBondContact NH2-OE2 3.45Å; R85-L128 HydrophobicContact CG-CD1 4.14Å
86	A	98.8	Very high	98.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-44	171.9	0	0	0	0	0	112.1	I56 L61 S82 A83 L84 R88 R89 L90	I56-A86 HydrophobicContact CG2-CB 3.92Å; L61-A86 HydrophobicContact CD1-CB 4.13Å; S82-A86 PolarHBondContact O-N 2.92Å; A83-A86 WeakPolarHBondContact O-CA 3.15Å; A83-A86 VanDerWaalsContact O-CB 3.29Å; A83-A86 WeakPolarHBondContact O-CB 3.41Å; A83-A86 PolarHBondContact O-N 3.25Å; A83-A86 VanDerWaalsContact O-N 3.1Å; L84-A86 VanDerWaalsContact C-N 3.3Å; L84-A86 PolarHBondContact O-N 3.37Å; A86-R88 PolarHBondContact O-N 3.42Å; A86-R89 PolarHBondContact O-N 3.2Å; A86-R89 VanDerWaalsContact O-N 3.13Å; A86-L90 PolarHBondContact O-N 3.24Å
87	C	98.8	Very high	98.6	Very high	2 Å²	2	43 Å²	43	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-55.6	-41	172.1	-67.5	0	0	0	0	111.9	A83 L84 L90 N91 D92 A96	A83-C87 PolarHBondContact O-N 3.09Å; A83-C87 PolarHBondContact O-SG 3.25Å; A83-C87 VanDerWaalsContact O-SG 3.41Å; L84-C87 WeakPolarHBondContact O-CB 3.29Å; L84-C87 PolarHBondContact O-N 2.94Å; C87-L90 CarbonylContact O-C 3.52Å; C87-L90 PolarHBondContact O-N 3.35Å; C87-N91 PolarHBondContact O-N 3.13Å; C87-D92 WeakPolarHBondContact CB-O 3.39Å; C87-D92 PolarHBondContact O-N 3.3Å; C87-A96 HydrophobicContact CB-CB 3.85Å
88	R	98.4	Very high	98.5	Very high	140 Å²	140	49.7 Å²	49.7	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-44	175.6	-175.1	68.5	-136.7	170.2	3.8	112.5	L84 R85 A86 L90 N91 L128	L84-R88 PolarHBondContact O-N 3.4Å; R85-R88 WeakPolarHBondContact O-CB 3.23Å; R85-R88 PolarHBondContact O-N 2.88Å; A86-R88 PolarHBondContact O-N 3.42Å; R88-L90 VanDerWaalsContact C-N 3.25Å; R88-L90 PolarHBondContact O-N 2.79Å; R88-N91 PolarHBondContact O-N 2.82Å; R88-N91 VanDerWaalsContact O-N 3.09Å; R88-L128 HydrophobicContact CB-CD1 4.41Å; R88-L128 HydrophobicContact CB-CD2 4.23Å; R88-L128 HydrophobicContact CG-CD2 4.03Å
89	R	98.5	Very high	98.5	Very high	97 Å²	97	45.4 Å²	45.4	37%	0.366	22%	0.219	S	C	.	.	H	α-helix	trans	-61.1	-36.5	176.4	-66.9	-167.6	-56.6	-79.6	6	111.9	F51 K53 P54 I56 R85 A86 N91	F51-R89 PolarHBondContact O-NH2 3Å; K53-R89 PolarHBondContact O-NH2 3.4Å; P54-R89 PolarHBondContact O-NE 2.82Å; I56-R89 VanDerWaalsContact CG2-NH2 3.34Å; R85-R89 WeakPolarHBondContact O-CG 2.99Å; R85-R89 PolarHBondContact O-N 2.95Å; R85-R89 PolarHBondContact O-NH1 3.14Å; A86-R89 PolarHBondContact O-N 3.2Å; A86-R89 VanDerWaalsContact O-N 3.13Å; R89-N91 VanDerWaalsContact C-N 3.29Å; R89-N91 PolarHBondContact O-N 3.42Å
90	L	98.5	Very high	98.5	Very high	52 Å²	52	45.5 Å²	45.5	27%	0.272	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.4	177.1	-72.1	168.9	0	0	0	114.1	I56 L61 A86 C87 R88 D92	I56-L90 WeakPolarHBondContact O-CD2 3.39Å; L61-L90 HydrophobicContact CB-CD1 3.93Å; L61-L90 HydrophobicContact CD2-CD1 3.74Å; L61-L90 HydrophobicContact CG-CD1 4.41Å; A86-L90 PolarHBondContact O-N 3.24Å; C87-L90 CarbonylContact O-C 3.52Å; C87-L90 PolarHBondContact O-N 3.35Å; R88-L90 VanDerWaalsContact C-N 3.25Å; R88-L90 PolarHBondContact O-N 2.79Å; L90-D92 HydrophobicContact CB-CB 4.41Å; L90-D92 PolarHBondContact O-N 2.82Å
91	N	98.3	Very high	98.5	Very high	124 Å²	124	47.4 Å²	47.4	66%	0.663	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	36.5	-172.4	-59.1	-70.4	0	0	0	113.5	C87 R88 R89	C87-N91 PolarHBondContact O-N 3.13Å; R88-N91 PolarHBondContact O-N 2.82Å; R88-N91 VanDerWaalsContact O-N 3.09Å; R89-N91 VanDerWaalsContact C-N 3.29Å; R89-N91 PolarHBondContact O-N 3.42Å
92	D	98.1	Very high	98.5	Very high	42 Å²	42	46.6 Å²	46.6	23%	0.225	23%	0.227	C	C	.	.			trans	-112.4	84.6	-177.2	-171	-9.4	0	0	0	111.3	C87 L90 A94 S95 A96	C87-D92 WeakPolarHBondContact CB-O 3.39Å; C87-D92 PolarHBondContact O-N 3.3Å; L90-D92 HydrophobicContact CB-CB 4.41Å; L90-D92 PolarHBondContact O-N 2.82Å; D92-A94 PolarHBondContact OD1-N 3.47Å; D92-S95 VanDerWaalsContact CG-CB 3.42Å; D92-S95 PolarHBondContact OD1-N 3.44Å; D92-S95 PolarHBondContact OD1-OG 3.34Å; D92-S95 VanDerWaalsContact OD2-CB 3.28Å; D92-S95 WeakPolarHBondContact OD2-CB 3.25Å; D92-S95 PolarHBondContact OD2-OG 3.3Å; D92-A96 PolarHBondContact O-N 2.75Å
93	L	98.1	Very high	98.4	Very high	96 Å²	96	46.4 Å²	46.4	50%	0.503	23%	0.226	S	C	.	.	H	α-helix	trans	-67	-36.1	178.3	-179.9	63.4	0	0	0	112.3	S95 A96 I97 I130	L93-S95 VanDerWaalsContact C-N 3.34Å; L93-S95 PolarHBondContact O-N 3.38Å; L93-A96 WeakPolarHBondContact O-CB 3.05Å; L93-A96 PolarHBondContact O-N 2.99Å; L93-A96 VanDerWaalsContact O-N 3.17Å; L93-I97 HydrophobicContact CD1-CD1 4.42Å; L93-I97 HydrophobicContact CG-CD1 4.03Å; L93-I97 PolarHBondContact O-N 2.92Å; L93-I97 VanDerWaalsContact O-N 3.13Å; L93-I130 HydrophobicContact CD1-CG1 4.16Å; L93-I130 HydrophobicContact CD1-CG2 4.48Å
94	A	97.9	Very high	98.3	Very high	70 Å²	70	50.2 Å²	50.2	58%	0.579	24%	0.243	S	C	*	.	H	α-helix	trans	-64.5	-40.7	-178	0	0	0	0	0	111.1	D92 A96 I97 R98	D92-A94 PolarHBondContact OD1-N 3.47Å; A94-A96 VanDerWaalsContact C-N 3.33Å; A94-A96 PolarHBondContact O-N 3.24Å; A94-I97 PolarHBondContact O-N 3.3Å; A94-R98 WeakPolarHBondContact O-CB 3.47Å; A94-R98 PolarHBondContact O-N 3.1Å
95	S	98.4	Very high	98.3	Very high	25 Å²	25	56.4 Å²	56.4	18%	0.175	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-37	174	-71.5	0	0	0	0	112.4	D92 L93 R98 I99	D92-S95 VanDerWaalsContact CG-CB 3.42Å; D92-S95 PolarHBondContact OD1-N 3.44Å; D92-S95 PolarHBondContact OD1-OG 3.34Å; D92-S95 VanDerWaalsContact OD2-CB 3.28Å; D92-S95 WeakPolarHBondContact OD2-CB 3.25Å; D92-S95 PolarHBondContact OD2-OG 3.3Å; L93-S95 VanDerWaalsContact C-N 3.34Å; L93-S95 PolarHBondContact O-N 3.38Å; S95-R98 PolarHBondContact O-N 3.44Å; S95-I99 VanDerWaalsContact O-CG1 3.23Å; S95-I99 WeakPolarHBondContact O-CG1 3.33Å; S95-I99 PolarHBondContact O-N 3.35Å
96	A	98.6	Very high	98.2	Very high	2 Å²	2	55.6 Å²	55.6	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-47	176.4	0	0	0	0	0	112	L84 C87 D92 L93 A94 R98 I99 L100 I130	L84-A96 HydrophobicContact CD2-CB 3.83Å; C87-A96 HydrophobicContact CB-CB 3.85Å; D92-A96 PolarHBondContact O-N 2.75Å; L93-A96 WeakPolarHBondContact O-CB 3.05Å; L93-A96 PolarHBondContact O-N 2.99Å; L93-A96 VanDerWaalsContact O-N 3.17Å; A94-A96 VanDerWaalsContact C-N 3.33Å; A94-A96 PolarHBondContact O-N 3.24Å; A96-R98 VanDerWaalsContact C-N 3.32Å; A96-R98 PolarHBondContact O-N 2.85Å; A96-I99 WeakPolarHBondContact O-CB 3.42Å; A96-I99 PolarHBondContact O-N 2.79Å; A96-L100 PolarHBondContact O-N 2.96Å; A96-I130 HydrophobicContact CB-CD1 4.04Å; A96-I130 HydrophobicContact CB-CG1 4.47Å; A96-I130 HydrophobicContact CB-CG2 4.29Å
97	I	98.6	Very high	98.1	Very high	18 Å²	18	55.8 Å²	55.8	9%	0.092	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-43.2	175.7	-63.4	158.6	0	0	0	110.1	L93 A94 I99 L100 E101 P133 L136 M138	L93-I97 HydrophobicContact CD1-CD1 4.42Å; L93-I97 HydrophobicContact CG-CD1 4.03Å; L93-I97 PolarHBondContact O-N 2.92Å; L93-I97 VanDerWaalsContact O-N 3.13Å; A94-I97 PolarHBondContact O-N 3.3Å; I97-I99 VanDerWaalsContact C-N 3.28Å; I97-I99 PolarHBondContact O-N 3.5Å; I97-L100 WeakPolarHBondContact O-CB 3.35Å; I97-L100 PolarHBondContact O-N 2.92Å; I97-L100 VanDerWaalsContact O-N 3.09Å; I97-E101 PolarHBondContact O-N 2.72Å; I97-E101 VanDerWaalsContact O-N 3.1Å; I97-P133 HydrophobicContact CG2-CG 4.18Å; I97-L136 HydrophobicContact CD1-CD1 3.57Å; I97-L136 HydrophobicContact CG1-CD1 4.15Å; I97-L136 HydrophobicContact CG2-CD1 4.14Å; I97-M138 HydrophobicContact CG2-CE 4.41Å; I97-M138 HydrophobicContact CG2-SD 4.06Å
98	R	98.4	Very high	98	Very high	155 Å²	155	58.2 Å²	58.2	59%	0.585	30%	0.301	S	S	*	.	H	α-helix	trans	-62.8	-33.1	179.3	-172.7	56.3	177.8	168.1	6.5	113	A94 S95 A96 E101 A102	A94-R98 WeakPolarHBondContact O-CB 3.47Å; A94-R98 PolarHBondContact O-N 3.1Å; S95-R98 PolarHBondContact O-N 3.44Å; A96-R98 VanDerWaalsContact C-N 3.32Å; A96-R98 PolarHBondContact O-N 2.85Å; R98-E101 WeakPolarHBondContact CD-OE2 3.43Å; R98-E101 IonicContact CZ-OE2 2.69Å; R98-E101 IonicContact NE-OE2 2.77Å; R98-E101 IonicContact NH1-OE1 3.54Å; R98-E101 IonicContact NH1-OE2 2.69Å; R98-E101 PolarHBondContact NH1-OE2 3.37Å; R98-E101 PolarHBondContact O-N 2.93Å; R98-A102 WeakPolarHBondContact O-CB 3.16Å; R98-A102 PolarHBondContact O-N 2.91Å
99	I	98.6	Very high	97.9	Very high	9 Å²	9	56.7 Å²	56.7	5%	0.046	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-43.9	173.8	-71.9	166	0	0	0	110.2	M65 L80 A83 S95 A96 I97 E101 A102 V103	M65-I99 HydrophobicContact CE-CB 4.44Å; M65-I99 HydrophobicContact CE-CG1 3.97Å; M65-I99 HydrophobicContact CE-CG2 3.89Å; M65-I99 HydrophobicContact CG-CD1 3.94Å; M65-I99 HydrophobicContact CG-CG1 3.98Å; M65-I99 HydrophobicContact SD-CD1 4.04Å; M65-I99 HydrophobicContact SD-CG1 4.1Å; M65-I99 HydrophobicContact SD-CG2 4.46Å; L80-I99 HydrophobicContact CD2-CG2 4.02Å; A83-I99 HydrophobicContact CB-CD1 4.3Å; S95-I99 VanDerWaalsContact O-CG1 3.23Å; S95-I99 WeakPolarHBondContact O-CG1 3.33Å; S95-I99 PolarHBondContact O-N 3.35Å; A96-I99 WeakPolarHBondContact O-CB 3.42Å; A96-I99 PolarHBondContact O-N 2.79Å; I97-I99 VanDerWaalsContact C-N 3.28Å; I97-I99 PolarHBondContact O-N 3.5Å; I99-E101 PolarHBondContact O-N 3.48Å; I99-A102 PolarHBondContact O-N 3.16Å; I99-V103 HydrophobicContact CG2-CG2 4.37Å; I99-V103 WeakPolarHBondContact O-CB 3.29Å; I99-V103 VanDerWaalsContact O-CG2 3.25Å; I99-V103 WeakPolarHBondContact O-CG2 3.4Å; I99-V103 PolarHBondContact O-N 3.3Å
100	L	98.4	Very high	97.9	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-43	177.3	-61.2	177.7	0	0	0	111.6	A96 I97 A102 V103 K104 Y114 I118 L121 L125 I130 P133	A96-L100 PolarHBondContact O-N 2.96Å; I97-L100 WeakPolarHBondContact O-CB 3.35Å; I97-L100 PolarHBondContact O-N 2.92Å; I97-L100 VanDerWaalsContact O-N 3.09Å; L100-A102 PolarHBondContact O-N 3.16Å; L100-V103 PolarHBondContact O-N 3.24Å; L100-K104 PolarHBondContact O-N 3.36Å; L100-Y114 WeakPolarHBondContact O-CE2 3.48Å; L100-I118 HydrophobicContact CD2-CD1 4.22Å; L100-L121 HydrophobicContact CD2-CD1 4.33Å; L100-L125 HydrophobicContact CD1-CD2 4.04Å; L100-I130 HydrophobicContact CD1-CG2 4.31Å; L100-P133 HydrophobicContact CB-CG 3.97Å
101	E	98.3	Very high	97.7	Very high	40 Å²	40	63.8 Å²	63.8	19%	0.187	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-46.9	173.6	-63.7	-178.6	116.4	0	0	112.1	I97 R98 I99 V103 K104 D105 P133	I97-E101 PolarHBondContact O-N 2.72Å; I97-E101 VanDerWaalsContact O-N 3.1Å; R98-E101 WeakPolarHBondContact CD-OE2 3.43Å; R98-E101 IonicContact CZ-OE2 2.69Å; R98-E101 IonicContact NE-OE2 2.77Å; R98-E101 IonicContact NH1-OE1 3.54Å; R98-E101 IonicContact NH1-OE2 2.69Å; R98-E101 PolarHBondContact NH1-OE2 3.37Å; R98-E101 PolarHBondContact O-N 2.93Å; I99-E101 PolarHBondContact O-N 3.48Å; E101-V103 VanDerWaalsContact C-N 3.3Å; E101-V103 PolarHBondContact O-N 3.23Å; E101-K104 WeakPolarHBondContact O-CB 3.32Å; E101-K104 PolarHBondContact O-N 3.42Å; E101-D105 PolarHBondContact O-N 3.19Å; E101-P133 HydrophobicContact CG-CB 3.89Å; E101-P133 HydrophobicContact CG-CG 3.52Å
102	A	97.9	Very high	97.6	Very high	23 Å²	23	63.5 Å²	63.5	19%	0.19	34%	0.34	C	S	.	.	H	α-helix	trans	-63.5	-37.3	-178.8	0	0	0	0	0	111.8	I69 R98 I99 L100 D105 K106	I69-A102 HydrophobicContact CG2-CB 4.49Å; R98-A102 WeakPolarHBondContact O-CB 3.16Å; R98-A102 PolarHBondContact O-N 2.91Å; I99-A102 PolarHBondContact O-N 3.16Å; L100-A102 PolarHBondContact O-N 3.16Å; A102-D105 PolarHBondContact O-N 3.38Å; A102-K106 WeakPolarHBondContact O-CB 3.22Å; A102-K106 VanDerWaalsContact O-CG 3.29Å; A102-K106 WeakPolarHBondContact O-CG 3.38Å; A102-K106 PolarHBondContact O-N 2.99Å
103	V	97.6	Very high	97.6	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-70	-37.9	176.8	168.8	0	0	0	0	111.6	V74 L80 I99 L100 E101 K106 S107 L117	V74-V103 HydrophobicContact CG1-CG1 4Å; L80-V103 HydrophobicContact CD1-CB 4.45Å; L80-V103 HydrophobicContact CD1-CG1 3.9Å; L80-V103 HydrophobicContact CD1-CG2 3.81Å; L80-V103 HydrophobicContact CD2-CG2 3.59Å; L80-V103 HydrophobicContact CG-CG2 4.37Å; I99-V103 HydrophobicContact CG2-CG2 4.37Å; I99-V103 WeakPolarHBondContact O-CB 3.29Å; I99-V103 VanDerWaalsContact O-CG2 3.25Å; I99-V103 WeakPolarHBondContact O-CG2 3.4Å; I99-V103 PolarHBondContact O-N 3.3Å; L100-V103 PolarHBondContact O-N 3.24Å; E101-V103 VanDerWaalsContact C-N 3.3Å; E101-V103 PolarHBondContact O-N 3.23Å; V103-K106 PolarHBondContact O-N 3.28Å; V103-S107 PolarHBondContact O-N 2.68Å; V103-S107 VanDerWaalsContact O-N 3.09Å; V103-S107 PolarHBondContact O-OG 3.49Å; V103-L117 HydrophobicContact CG1-CD1 3.17Å
104	K	97.4	Very high	97.6	Very high	79 Å²	79	60.1 Å²	60.1	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-60.4	-46.3	171.5	-172	178.5	179.3	178.1	0	111.2	L100 E101 S107 Y114 E134	L100-K104 PolarHBondContact O-N 3.36Å; E101-K104 WeakPolarHBondContact O-CB 3.32Å; E101-K104 PolarHBondContact O-N 3.42Å; K104-S107 WeakPolarHBondContact O-CB 3.46Å; K104-S107 PolarHBondContact O-N 2.93Å; K104-Y114 HydrophobicContact CB-CD1 4.32Å; K104-Y114 HydrophobicContact CB-CD2 3.6Å; K104-Y114 HydrophobicContact CB-CE1 4.42Å; K104-Y114 HydrophobicContact CB-CE2 3.71Å; K104-Y114 HydrophobicContact CB-CG 3.91Å; K104-Y114 HydrophobicContact CD-CD1 4.04Å; K104-Y114 HydrophobicContact CD-CE1 3.87Å; K104-Y114 HydrophobicContact CD-CG 4.44Å; K104-Y114 HydrophobicContact CG-CD1 3.94Å; K104-Y114 HydrophobicContact CG-CD2 4.09Å; K104-Y114 HydrophobicContact CG-CE1 4.2Å; K104-Y114 HydrophobicContact CG-CE2 4.35Å; K104-Y114 HydrophobicContact CG-CG 3.86Å; K104-E134 WeakPolarHBondContact CD-OE1 3.43Å; K104-E134 WeakPolarHBondContact CE-OE1 3.38Å; K104-E134 IonicContact NZ-OE1 3.29Å; K104-E134 PolarHBondContact NZ-OE1 2.91Å
105	D	97.4	Very high	97.6	Very high	131 Å²	131	60.4 Å²	60.4	70%	0.701	32%	0.317	S	S	*	.	H	α-helix	trans	-62	-43.6	176.1	-175.6	66.3	0	0	0	111.8	E101 A102 S107 G108	E101-D105 PolarHBondContact O-N 3.19Å; A102-D105 PolarHBondContact O-N 3.38Å; D105-S107 PolarHBondContact O-N 2.79Å; D105-G108 PolarHBondContact O-N 2.67Å
106	K	97.4	Very high	97.7	Very high	58 Å²	58	64.4 Å²	64.4	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-25.5	175.3	-79.1	-62.7	-57.7	-171.3	0	114.2	I69 Y71 L73 V74 A102 V103 G108	I69-K106 HydrophobicContact CB-CD 4.22Å; I69-K106 HydrophobicContact CB-CG 4.25Å; I69-K106 HydrophobicContact CG2-CG 4.31Å; I69-K106 WeakPolarHBondContact O-CD 3.31Å; I69-K106 WeakPolarHBondContact O-CE 3.49Å; I69-K106 PolarHBondContact O-NZ 2.94Å; Y71-K106 PolarHBondContact O-NZ 3.34Å; L73-K106 WeakPolarHBondContact O-CE 3.38Å; V74-K106 HydrophobicContact CG2-CB 4.38Å; A102-K106 WeakPolarHBondContact O-CB 3.22Å; A102-K106 VanDerWaalsContact O-CG 3.29Å; A102-K106 WeakPolarHBondContact O-CG 3.38Å; A102-K106 PolarHBondContact O-N 2.99Å; V103-K106 PolarHBondContact O-N 3.28Å; K106-G108 PolarHBondContact O-N 3.37Å
107	S	96.9	Very high	97.6	Very high	5 Å²	5	64.5 Å²	64.5	4%	0.035	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.2	174.7	-55.5	0	0	0	0	112.4	V103 K104 D105 H110	V103-S107 PolarHBondContact O-N 2.68Å; V103-S107 VanDerWaalsContact O-N 3.09Å; V103-S107 PolarHBondContact O-OG 3.49Å; K104-S107 WeakPolarHBondContact O-CB 3.46Å; K104-S107 PolarHBondContact O-N 2.93Å; D105-S107 PolarHBondContact O-N 2.79Å; S107-H110 WeakPolarHBondContact O-CB 3.27Å; S107-H110 PolarHBondContact O-N 3.1Å
108	G	95.8	Very high	97.6	Very high	52 Å²	52	65 Å²	65	54%	0.536	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	-126.5	174.7	0	0	0	0	0	112.6	D105 K106 H110	D105-G108 PolarHBondContact O-N 2.67Å; K106-G108 PolarHBondContact O-N 3.37Å; G108-H110 VanDerWaalsContact C-N 3.26Å; G108-H110 PolarHBondContact O-N 3.42Å
109	P	97.4	Very high	97.6	Very high	109 Å²	109	63.9 Å²	63.9	71%	0.708	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.5	179.3	32.7	-35.3	0	0	0	114	K111	P109-K111 PolarHBondContact O-N 2.83Å; P109-K111 VanDerWaalsContact O-N 3.14Å
110	H	97.3	Very high	97.6	Very high	112 Å²	112	67.8 Å²	67.8	52%	0.519	35%	0.351	S	S	.	.			trans	-84.6	87.3	-174.8	-56.6	-79	0	0	0	110.8	S107 G108 D112 I113	S107-H110 WeakPolarHBondContact O-CB 3.27Å; S107-H110 PolarHBondContact O-N 3.1Å; G108-H110 VanDerWaalsContact C-N 3.26Å; G108-H110 PolarHBondContact O-N 3.42Å; H110-D112 PolarHBondContact O-N 3.13Å; H110-I113 HydrophobicContact CB-CD1 3.48Å; H110-I113 VanDerWaalsContact CB-CD1 3.48Å; H110-I113 HydrophobicContact CB-CG1 3.83Å; H110-I113 PolarHBondContact O-N 3.06Å
111	K	94.7	Very high	97.6	Very high	186 Å²	186	67.9 Å²	67.9	81%	0.809	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.8	-172	-63.5	-176.1	179.9	-178.2	0	114.7	P109 P115	P109-K111 PolarHBondContact O-N 2.83Å; P109-K111 VanDerWaalsContact O-N 3.14Å; K111-P115 WeakPolarHBondContact O-CD 3.22Å; K111-P115 VanDerWaalsContact O-CG 3.29Å; K111-P115 WeakPolarHBondContact O-CG 3.27Å
112	D	97.3	Very high	97.6	Very high	117 Å²	117	70 Å²	70	63%	0.626	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-24.9	-179.5	55.1	-44.3	0	0	0	113.2	H110 Y116	H110-D112 PolarHBondContact O-N 3.13Å; D112-Y116 PolarHBondContact O-N 3.19Å
113	I	97.9	Very high	97.7	Very high	47 Å²	47	73 Å²	73	24%	0.241	38%	0.379	C	S	.	.	H	α-helix	trans	-68	-53.1	-176.2	-57.8	178.9	0	0	0	111.6	V74 H110 Y116 L117	V74-I113 HydrophobicContact CB-CG2 4.18Å; V74-I113 HydrophobicContact CG1-CG2 3.92Å; V74-I113 HydrophobicContact CG2-CD1 4.26Å; V74-I113 HydrophobicContact CG2-CG2 4.2Å; H110-I113 HydrophobicContact CB-CD1 3.48Å; H110-I113 VanDerWaalsContact CB-CD1 3.48Å; H110-I113 HydrophobicContact CB-CG1 3.83Å; H110-I113 PolarHBondContact O-N 3.06Å; I113-Y116 WeakPolarHBondContact O-CB 3.28Å; I113-Y116 PolarHBondContact O-N 3.31Å; I113-Y116 VanDerWaalsContact O-N 3.15Å; I113-L117 HydrophobicContact CG2-CD1 3.99Å; I113-L117 HydrophobicContact CG2-CG 4.33Å; I113-L117 WeakPolarHBondContact O-CG 3.34Å; I113-L117 PolarHBondContact O-N 3.13Å
114	Y	98.3	Very high	97.7	Very high	20 Å²	20	73.5 Å²	73.5	8%	0.078	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-44.9	-176.4	179.8	-107.2	0	0	0	113.4	L100 K104 Y116 L117 I118 E134	L100-Y114 WeakPolarHBondContact O-CE2 3.48Å; K104-Y114 HydrophobicContact CB-CD1 4.32Å; K104-Y114 HydrophobicContact CB-CD2 3.6Å; K104-Y114 HydrophobicContact CB-CE1 4.42Å; K104-Y114 HydrophobicContact CB-CE2 3.71Å; K104-Y114 HydrophobicContact CB-CG 3.91Å; K104-Y114 HydrophobicContact CD-CD1 4.04Å; K104-Y114 HydrophobicContact CD-CE1 3.87Å; K104-Y114 HydrophobicContact CD-CG 4.44Å; K104-Y114 HydrophobicContact CG-CD1 3.94Å; K104-Y114 HydrophobicContact CG-CD2 4.09Å; K104-Y114 HydrophobicContact CG-CE1 4.2Å; K104-Y114 HydrophobicContact CG-CE2 4.35Å; K104-Y114 HydrophobicContact CG-CG 3.86Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 3Å; Y114-L117 PolarHBondContact O-N 2.9Å; Y114-L117 VanDerWaalsContact O-N 3.12Å; Y114-I118 HydrophobicContact CD1-CG1 4.24Å; Y114-I118 HydrophobicContact CD2-CG1 4.35Å; Y114-I118 HydrophobicContact CE1-CD1 4.31Å; Y114-I118 HydrophobicContact CE1-CG1 3.83Å; Y114-I118 HydrophobicContact CE2-CD1 3.83Å; Y114-I118 HydrophobicContact CE2-CG1 3.96Å; Y114-I118 HydrophobicContact CG-CG1 4.5Å; Y114-I118 WeakPolarHBondContact O-CG1 3.34Å; Y114-I118 PolarHBondContact O-N 2.91Å; Y114-E134 VanDerWaalsContact CE1-OE1 3.3Å; Y114-E134 WeakPolarHBondContact CE1-OE1 3.46Å; Y114-E134 PolarHBondContact OH-OE2 2.98Å
115	P	98.3	Very high	97.8	Very high	76 Å²	76	70 Å²	70	49%	0.494	37%	0.367	S	S	.	.	H	α-helix	trans	-56.8	-39.8	172.8	-26.9	35.8	0	0	0	113.8	K111 I118 Q119	K111-P115 WeakPolarHBondContact O-CD 3.22Å; K111-P115 VanDerWaalsContact O-CG 3.29Å; K111-P115 WeakPolarHBondContact O-CG 3.27Å; P115-I118 PolarHBondContact O-N 3.09Å; P115-Q119 WeakPolarHBondContact O-CB 3.45Å; P115-Q119 PolarHBondContact O-N 2.95Å
116	Y	98.4	Very high	97.8	Very high	109 Å²	109	69.6 Å²	69.6	43%	0.427	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-45	173.9	162.7	-102.1	0	0	0	111.5	P77 D112 I113 Y114 I118 Q119 E120	P77-Y116 HydrophobicContact CG-CE1 4.08Å; D112-Y116 PolarHBondContact O-N 3.19Å; I113-Y116 WeakPolarHBondContact O-CB 3.28Å; I113-Y116 PolarHBondContact O-N 3.31Å; I113-Y116 VanDerWaalsContact O-N 3.15Å; Y114-Y116 VanDerWaalsContact C-N 3.3Å; Y114-Y116 PolarHBondContact O-N 3Å; Y116-I118 PolarHBondContact O-N 3.28Å; Y116-Q119 WeakPolarHBondContact O-CB 3.19Å; Y116-Q119 PolarHBondContact O-N 2.73Å; Y116-E120 HydrophobicContact CD2-CG 4.04Å; Y116-E120 HydrophobicContact CE1-CG 4.36Å; Y116-E120 HydrophobicContact CE2-CG 3.54Å; Y116-E120 WeakPolarHBondContact O-CG 3.42Å; Y116-E120 PolarHBondContact O-N 3.23Å
117	L	98.4	Very high	97.9	Very high	5 Å²	5	72.5 Å²	72.5	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-41.7	178.3	-63.6	175.2	0	0	0	112.2	V74 P77 L80 V103 I113 Y114 Q119 E120 L121	V74-L117 HydrophobicContact CG1-CD1 3.61Å; P77-L117 HydrophobicContact CG-CD2 3.65Å; L80-L117 HydrophobicContact CD1-CD1 4.27Å; L80-L117 HydrophobicContact CD1-CD2 4.47Å; V103-L117 HydrophobicContact CG1-CD1 3.17Å; I113-L117 HydrophobicContact CG2-CD1 3.99Å; I113-L117 HydrophobicContact CG2-CG 4.33Å; I113-L117 WeakPolarHBondContact O-CG 3.34Å; I113-L117 PolarHBondContact O-N 3.13Å; Y114-L117 PolarHBondContact O-N 2.9Å; Y114-L117 VanDerWaalsContact O-N 3.12Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.49Å; L117-E120 PolarHBondContact O-N 3.35Å; L117-L121 VanDerWaalsContact O-CB 3.23Å; L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 WeakPolarHBondContact O-CG 3.15Å; L117-L121 PolarHBondContact O-N 2.9Å
118	I	98.3	Very high	97.9	Very high	28 Å²	28	73.6 Å²	73.6	14%	0.144	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-40.8	175.3	-64.6	-58.2	0	0	0	110.9	L100 Y114 P115 Y116 L121 Q122 L125 T132	L100-I118 HydrophobicContact CD2-CD1 4.22Å; Y114-I118 HydrophobicContact CD1-CG1 4.24Å; Y114-I118 HydrophobicContact CD2-CG1 4.35Å; Y114-I118 HydrophobicContact CE1-CD1 4.31Å; Y114-I118 HydrophobicContact CE1-CG1 3.83Å; Y114-I118 HydrophobicContact CE2-CD1 3.83Å; Y114-I118 HydrophobicContact CE2-CG1 3.96Å; Y114-I118 HydrophobicContact CG-CG1 4.5Å; Y114-I118 WeakPolarHBondContact O-CG1 3.34Å; Y114-I118 PolarHBondContact O-N 2.91Å; P115-I118 PolarHBondContact O-N 3.09Å; Y116-I118 PolarHBondContact O-N 3.28Å; I118-L121 PolarHBondContact O-N 2.79Å; I118-Q122 WeakPolarHBondContact O-CA 3.27Å; I118-Q122 WeakPolarHBondContact O-CB 3.48Å; I118-Q122 PolarHBondContact O-N 3.32Å; I118-L125 HydrophobicContact CD1-CD1 4.31Å; I118-T132 HydrophobicContact CD1-CG2 4.11Å; I118-T132 HydrophobicContact CG2-CG2 4.48Å
119	Q	98.4	Very high	98	Very high	132 Å²	132	73.8 Å²	73.8	62%	0.617	39%	0.385	S	S	*	.	H	α-helix	trans	-59.5	-48.9	175.9	-176.5	-171.1	-59.9	0	0	111.9	P115 Y116 L117 Q122	P115-Q119 WeakPolarHBondContact O-CB 3.45Å; P115-Q119 PolarHBondContact O-N 2.95Å; Y116-Q119 WeakPolarHBondContact O-CB 3.19Å; Y116-Q119 PolarHBondContact O-N 2.73Å; L117-Q119 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.49Å; Q119-Q122 WeakPolarHBondContact O-CB 3.3Å; Q119-Q122 PolarHBondContact O-N 3.29Å
120	E	98.6	Very high	98.1	Very high	90 Å²	90	69.3 Å²	69.3	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-70	-32.5	-179.1	-65.1	-56.2	118.9	0	0	112.5	P77 Y116 L117 P123	P77-E120 HydrophobicContact CB-CB 3.8Å; P77-E120 HydrophobicContact CG-CB 3.81Å; P77-E120 HydrophobicContact CG-CG 4.1Å; Y116-E120 HydrophobicContact CD2-CG 4.04Å; Y116-E120 HydrophobicContact CE1-CG 4.36Å; Y116-E120 HydrophobicContact CE2-CG 3.54Å; Y116-E120 WeakPolarHBondContact O-CG 3.42Å; Y116-E120 PolarHBondContact O-N 3.23Å; L117-E120 PolarHBondContact O-N 3.35Å; E120-P123 WeakPolarHBondContact O-CD 3.33Å
121	L	98.6	Very high	98.1	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-84.6	-10.1	178.2	-67.8	172.8	0	0	0	113.6	P77 L80 D81 L84 L100 L117 I118 P123 T124 L125	P77-L121 HydrophobicContact CB-CD2 4.43Å; P77-L121 WeakPolarHBondContact O-CD2 3.37Å; L80-L121 HydrophobicContact CB-CD1 3.84Å; L80-L121 HydrophobicContact CB-CD2 4.11Å; L80-L121 HydrophobicContact CD1-CD1 3.93Å; D81-L121 HydrophobicContact CB-CD2 4.11Å; L84-L121 HydrophobicContact CD1-CD1 4.36Å; L84-L121 HydrophobicContact CD1-CD2 4.38Å; L100-L121 HydrophobicContact CD2-CD1 4.33Å; L117-L121 VanDerWaalsContact O-CB 3.23Å; L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 WeakPolarHBondContact O-CG 3.15Å; L117-L121 PolarHBondContact O-N 2.9Å; I118-L121 PolarHBondContact O-N 2.79Å; L121-P123 VanDerWaalsContact C-N 3.32Å; L121-T124 WeakPolarHBondContact O-CA 3.45Å; L121-T124 WeakPolarHBondContact O-CB 3.39Å; L121-T124 PolarHBondContact O-N 2.69Å; L121-L125 HydrophobicContact CB-CD1 4.45Å; L121-L125 HydrophobicContact CB-CG 4.33Å; L121-L125 WeakPolarHBondContact O-CG 3.47Å; L121-L125 PolarHBondContact O-N 3.47Å
122	Q	98.2	Very high	98.3	Very high	86 Å²	86	58.2 Å²	58.2	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-49.6	-43.5	-176.3	-168.4	68.2	11.9	0	0	113.7	I118 Q119 T124 L125 I126	I118-Q122 WeakPolarHBondContact O-CA 3.27Å; I118-Q122 WeakPolarHBondContact O-CB 3.48Å; I118-Q122 PolarHBondContact O-N 3.32Å; Q119-Q122 WeakPolarHBondContact O-CB 3.3Å; Q119-Q122 PolarHBondContact O-N 3.29Å; Q122-T124 VanDerWaalsContact C-N 3.32Å; Q122-T124 PolarHBondContact O-N 2.69Å; Q122-L125 PolarHBondContact O-N 2.9Å; Q122-I126 HydrophobicContact CG-CD1 3.95Å; Q122-I126 VanDerWaalsContact O-CG1 3.31Å; Q122-I126 WeakPolarHBondContact O-CG1 3.45Å; Q122-I126 PolarHBondContact O-N 3.26Å
123	P	98.6	Very high	98.3	Very high	86 Å²	86	52.8 Å²	52.8	56%	0.558	29%	0.285	S	S	*	.	H	α-helix	trans	-59.1	-43.1	176.7	-23.2	35.4	0	0	0	112.5	E120 L121 E127	E120-P123 WeakPolarHBondContact O-CD 3.33Å; L121-P123 VanDerWaalsContact C-N 3.32Å; P123-E127 WeakPolarHBondContact O-CB 3.45Å; P123-E127 PolarHBondContact O-N 3.39Å
124	T	98.5	Very high	98.3	Very high	11 Å²	11	53.3 Å²	53.3	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-69.8	-40.6	179.3	-59.3	0	0	0	0	111.8	D81 L84 L121 Q122 I126 E127 L128	D81-T124 WeakPolarHBondContact OD1-CB 3.37Å; D81-T124 WeakPolarHBondContact OD1-CG2 3.48Å; D81-T124 PolarHBondContact OD1-OG1 2.88Å; L84-T124 HydrophobicContact CB-CG2 4.42Å; L84-T124 HydrophobicContact CD1-CG2 4.4Å; L121-T124 WeakPolarHBondContact O-CA 3.45Å; L121-T124 WeakPolarHBondContact O-CB 3.39Å; L121-T124 PolarHBondContact O-N 2.69Å; Q122-T124 VanDerWaalsContact C-N 3.32Å; Q122-T124 PolarHBondContact O-N 2.69Å; T124-I126 VanDerWaalsContact C-N 3.32Å; T124-I126 PolarHBondContact O-N 3.18Å; T124-E127 PolarHBondContact O-N 3.05Å; T124-L128 HydrophobicContact CG2-CD1 3.61Å; T124-L128 HydrophobicContact CG2-CG 4.08Å; T124-L128 WeakPolarHBondContact O-CB 3.42Å; T124-L128 VanDerWaalsContact O-CG 3.31Å; T124-L128 WeakPolarHBondContact O-CG 3.28Å; T124-L128 PolarHBondContact O-N 3.11Å
125	L	98.6	Very high	98.2	Very high	7 Å²	7	58 Å²	58	4%	0.037	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-42.8	177.3	-64.2	178.7	0	0	0	111.3	L84 L100 I118 L121 Q122 G129 I130 T132	L84-L125 HydrophobicContact CD1-CD2 4.04Å; L100-L125 HydrophobicContact CD1-CD2 4.04Å; I118-L125 HydrophobicContact CD1-CD1 4.31Å; L121-L125 HydrophobicContact CB-CD1 4.45Å; L121-L125 HydrophobicContact CB-CG 4.33Å; L121-L125 WeakPolarHBondContact O-CG 3.47Å; L121-L125 PolarHBondContact O-N 3.47Å; Q122-L125 PolarHBondContact O-N 2.9Å; L125-G129 WeakPolarHBondContact O-CA 3.36Å; L125-G129 PolarHBondContact O-N 3.04Å; L125-I130 HydrophobicContact CD2-CB 3.88Å; L125-I130 HydrophobicContact CD2-CG2 3.91Å; L125-I130 PolarHBondContact O-N 3.14Å; L125-T132 HydrophobicContact CD1-CG2 4.04Å
126	I	98.4	Very high	98.2	Very high	121 Å²	121	58.4 Å²	58.4	62%	0.621	31%	0.31	S	S	*	.	H	α-helix	trans	-66.8	-47.5	176.1	-66.4	168.6	0	0	0	110.9	Q122 T124 L128 G129	Q122-I126 HydrophobicContact CG-CD1 3.95Å; Q122-I126 VanDerWaalsContact O-CG1 3.31Å; Q122-I126 WeakPolarHBondContact O-CG1 3.45Å; Q122-I126 PolarHBondContact O-N 3.26Å; T124-I126 VanDerWaalsContact C-N 3.32Å; T124-I126 PolarHBondContact O-N 3.18Å; I126-L128 VanDerWaalsContact C-N 3.34Å; I126-L128 PolarHBondContact O-N 3.21Å; I126-G129 PolarHBondContact O-N 3.12Å
127	E	98.4	Very high	98	Very high	120 Å²	120	54.8 Å²	54.8	56%	0.561	31%	0.306	S	S	*	.	H	α-helix	trans	-58.1	-45.2	179.6	-176.8	-166.2	148.2	0	0	111.9	R85 P123 T124	R85-E127 IonicContact CZ-OE1 2.82Å; R85-E127 IonicContact CZ-OE2 2.8Å; R85-E127 IonicContact NH1-OE1 2.68Å; R85-E127 PolarHBondContact NH1-OE1 3.1Å; R85-E127 IonicContact NH1-OE2 3.72Å; R85-E127 PolarHBondContact NH1-OE2 3.12Å; R85-E127 IonicContact NH2-OE1 3.41Å; R85-E127 IonicContact NH2-OE2 3.49Å; R85-E127 PolarHBondContact NH2-OE2 3.45Å; P123-E127 WeakPolarHBondContact O-CB 3.45Å; P123-E127 PolarHBondContact O-N 3.39Å; T124-E127 PolarHBondContact O-N 3.05Å
128	L	98.3	Very high	97.8	Very high	27 Å²	27	59 Å²	59	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-88.6	-8.7	-174.6	-59.4	-175.2	0	0	0	113.6	L84 R85 R88 T124 I126 I130	L84-L128 HydrophobicContact CB-CD1 4.24Å; R85-L128 HydrophobicContact CG-CD1 4.14Å; R88-L128 HydrophobicContact CB-CD1 4.41Å; R88-L128 HydrophobicContact CB-CD2 4.23Å; R88-L128 HydrophobicContact CG-CD2 4.03Å; T124-L128 HydrophobicContact CG2-CD1 3.61Å; T124-L128 HydrophobicContact CG2-CG 4.08Å; T124-L128 WeakPolarHBondContact O-CB 3.42Å; T124-L128 VanDerWaalsContact O-CG 3.31Å; T124-L128 WeakPolarHBondContact O-CG 3.28Å; T124-L128 PolarHBondContact O-N 3.11Å; I126-L128 VanDerWaalsContact C-N 3.34Å; I126-L128 PolarHBondContact O-N 3.21Å; L128-I130 HydrophobicContact CB-CD1 3.65Å; L128-I130 HydrophobicContact CB-CG1 3.83Å; L128-I130 HydrophobicContact CD1-CD1 3.81Å; L128-I130 HydrophobicContact CG-CD1 4.38Å
129	G	98	Very high	97.5	Very high	56 Å²	56	61.1 Å²	61.1	58%	0.577	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	40.2	-177.2	0	0	0	0	0	113.2	L125 I126	L125-G129 WeakPolarHBondContact O-CA 3.36Å; L125-G129 PolarHBondContact O-N 3.04Å; I126-G129 PolarHBondContact O-N 3.12Å
130	I	98.4	Very high	97.1	Very high	15 Å²	15	62.1 Å²	62.1	8%	0.077	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-96.7	117.3	-178.6	-59.5	166.6	0	0	0	108.7	L84 L93 A96 L100 L125 L128	L84-I130 HydrophobicContact CB-CD1 4.2Å; L84-I130 HydrophobicContact CD2-CD1 4.19Å; L93-I130 HydrophobicContact CD1-CG1 4.16Å; L93-I130 HydrophobicContact CD1-CG2 4.48Å; A96-I130 HydrophobicContact CB-CD1 4.04Å; A96-I130 HydrophobicContact CB-CG1 4.47Å; A96-I130 HydrophobicContact CB-CG2 4.29Å; L100-I130 HydrophobicContact CD1-CG2 4.31Å; L125-I130 HydrophobicContact CD2-CB 3.88Å; L125-I130 HydrophobicContact CD2-CG2 3.91Å; L125-I130 PolarHBondContact O-N 3.14Å; L128-I130 HydrophobicContact CB-CD1 3.65Å; L128-I130 HydrophobicContact CB-CG1 3.83Å; L128-I130 HydrophobicContact CD1-CD1 3.81Å; L128-I130 HydrophobicContact CG-CD1 4.38Å
131	S	98	Very high	96.1	Very high	52 Å²	52	69.8 Å²	69.8	36%	0.364	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-75.4	142.6	170.7	-59.1	0	0	0	0	110.8
132	T	98.2	Very high	96	Very high	13 Å²	13	73.1 Å²	73.1	8%	0.08	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-72.3	157.9	172.8	63.7	0	0	0	0	110.8	I118 L125 E134 D135 L136	I118-T132 HydrophobicContact CD1-CG2 4.11Å; I118-T132 HydrophobicContact CG2-CG2 4.48Å; L125-T132 HydrophobicContact CD1-CG2 4.04Å; T132-E134 PolarHBondContact O-N 3.12Å; T132-D135 PolarHBondContact N-OD2 3.14Å; T132-D135 PolarHBondContact O-N 3.05Å; T132-D135 VanDerWaalsContact O-N 3.12Å; T132-D135 PolarHBondContact OG1-N 3.1Å; T132-D135 VanDerWaalsContact OG1-N 3.17Å; T132-D135 PolarHBondContact OG1-OD2 3.08Å; T132-L136 WeakPolarHBondContact O-CG 3.37Å; T132-L136 PolarHBondContact O-N 3.15Å
133	P	97.9	Very high	95.8	Very high	4 Å²	4	72.4 Å²	72.4	3%	0.026	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.8	171.5	-26.5	35.2	0	0	0	112.9	I97 L100 E101 L136 G137 M138	I97-P133 HydrophobicContact CG2-CG 4.18Å; L100-P133 HydrophobicContact CB-CG 3.97Å; E101-P133 HydrophobicContact CG-CB 3.89Å; E101-P133 HydrophobicContact CG-CG 3.52Å; P133-L136 PolarHBondContact O-N 3.28Å; P133-G137 PolarHBondContact O-N 2.94Å; P133-G137 VanDerWaalsContact O-N 3.15Å; P133-M138 HydrophobicContact CB-CB 4.41Å; P133-M138 PolarHBondContact O-N 2.93Å
134	E	97.3	Very high	95.7	Very high	58 Å²	58	71.7 Å²	71.7	27%	0.271	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-43.2	176.6	-66.6	72.2	-158.2	0	0	112.7	K104 Y114 T132 L136 G137 D139	K104-E134 WeakPolarHBondContact CD-OE1 3.43Å; K104-E134 WeakPolarHBondContact CE-OE1 3.38Å; K104-E134 IonicContact NZ-OE1 3.29Å; K104-E134 PolarHBondContact NZ-OE1 2.91Å; Y114-E134 VanDerWaalsContact CE1-OE1 3.3Å; Y114-E134 WeakPolarHBondContact CE1-OE1 3.46Å; Y114-E134 PolarHBondContact OH-OE2 2.98Å; T132-E134 PolarHBondContact O-N 3.12Å; E134-L136 PolarHBondContact O-N 3.05Å; E134-G137 PolarHBondContact O-N 3.44Å; E134-D139 HydrophobicContact CG-CB 4.36Å
135	D	96.9	Very high	95.5	Very high	119 Å²	119	75.2 Å²	75.2	64%	0.636	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-31.1	177	-63.1	-41.5	0	0	0	111.9	T132	T132-D135 PolarHBondContact N-OD2 3.14Å; T132-D135 PolarHBondContact O-N 3.05Å; T132-D135 VanDerWaalsContact O-N 3.12Å; T132-D135 PolarHBondContact OG1-N 3.1Å; T132-D135 VanDerWaalsContact OG1-N 3.17Å; T132-D135 PolarHBondContact OG1-OD2 3.08Å
136	L	96.8	Very high	95.3	Very high	84 Å²	84	79.5 Å²	79.5	44%	0.44	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-6.3	178.4	-60.1	176.7	0	0	0	113	I97 T132 P133 E134 M138	I97-L136 HydrophobicContact CD1-CD1 3.57Å; I97-L136 HydrophobicContact CG1-CD1 4.15Å; I97-L136 HydrophobicContact CG2-CD1 4.14Å; T132-L136 WeakPolarHBondContact O-CG 3.37Å; T132-L136 PolarHBondContact O-N 3.15Å; P133-L136 PolarHBondContact O-N 3.28Å; E134-L136 PolarHBondContact O-N 3.05Å; L136-M138 HydrophobicContact CB-CG 3.9Å; L136-M138 HydrophobicContact CB-SD 4.06Å; L136-M138 HydrophobicContact CD1-SD 3.92Å; L136-M138 PolarHBondContact O-N 3.45Å
137	G	96.1	Very high	95.1	Very high	32 Å²	32	76.7 Å²	76.7	33%	0.33	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	21.2	-176	0	0	0	0	0	114.4	P133 E134 D139	P133-G137 PolarHBondContact O-N 2.94Å; P133-G137 VanDerWaalsContact O-N 3.15Å; E134-G137 PolarHBondContact O-N 3.44Å; G137-D139 VanDerWaalsContact C-N 3.26Å
138	M	93.7	Very high	94.9	Very high	94 Å²	94	73.6 Å²	73.6	46%	0.463	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.6	178.8	-65.8	177.8	60.2	0	0	112.9	I97 P133 L136 K140	I97-M138 HydrophobicContact CG2-CE 4.41Å; I97-M138 HydrophobicContact CG2-SD 4.06Å; P133-M138 HydrophobicContact CB-CB 4.41Å; P133-M138 PolarHBondContact O-N 2.93Å; L136-M138 HydrophobicContact CB-CG 3.9Å; L136-M138 HydrophobicContact CB-SD 4.06Å; L136-M138 HydrophobicContact CD1-SD 3.92Å; L136-M138 PolarHBondContact O-N 3.45Å; M138-K140 PolarHBondContact O-N 3.41Å
139	D	91.5	Very high	94.6	Very high	73 Å²	73	77.2 Å²	77.2	39%	0.39	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-9.3	177.2	68	-52.4	0	0	0	113.5	E134 G137	E134-D139 HydrophobicContact CG-CB 4.36Å; G137-D139 VanDerWaalsContact C-N 3.26Å
140	K	89.8	Confident	94.3	Very high	152 Å²	152	79 Å²	79	66%	0.661	42%	0.421	S	S	*	.			trans	-103.4	141.9	-176.3	-61.4	168.4	-168.6	168.6	0	110.4	M138	M138-K140 PolarHBondContact O-N 3.41Å
141	L	77.6	Confident	94	Very high	252 Å²	252	84.8 Å²	84.8	100%	1.319	45%	0.453	S	S	*	.			trans	-93.2	0	173.7	-67.6	175	0	0	0	111.9

Retrieved 141 of 141 residues in 67.4 ms (Link to these results)

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