A0A087YI44_POEFO Loading...

Cytochrome c oxidase subunit 4

Component of the cytochrome c oxidase, the last enzyme in the mitochondrial electron transport chain which drives oxidative phosphorylation.

AlphaFold DB , UniProt , Accession A0A087YI44, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 169 aa.

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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	43.8	Very low	48.3	Very low	242 Å²	242	152.5 Å²	152.5	100%	1.192	88%	0.883	S	S	*	*				0	83.7	0	-68.2	-176.3	178.2	0	0	109.3
2	L	46.6	Very low	48.2	Very low	180 Å²	180	156.6 Å²	156.6	94%	0.942	88%	0.882	S	S	*	*			trans	-159.5	45.7	-177.5	-107.8	167.4	0	0	0	111.3
3	A	47.1	Very low	48	Very low	94 Å²	94	163.2 Å²	163.2	78%	0.777	89%	0.885	S	S	*	*			trans	-150	57.5	178.3	0	0	0	0	0	111.4
4	S	50.8	Low	47.9	Very low	121 Å²	121	158.3 Å²	158.3	85%	0.846	88%	0.877	S	S	*	*	S	Bend	trans	-149.3	23	175	-55.7	0	0	0	0	115.3
5	R	53.1	Low	48.2	Very low	250 Å²	250	159 Å²	159	94%	0.943	88%	0.877	S	S	*	*	S	Bend	trans	-130	31.7	-177.3	-80.3	-166	165	-159	-2.2	115.6
6	A	48.7	Very low	48	Very low	101 Å²	101	155.6 Å²	155.6	84%	0.835	87%	0.868	S	S	*	*	S	Bend	trans	-119.9	5.9	178.2	0	0	0	0	0	115.2
7	L	46.6	Very low	47.9	Very low	176 Å²	176	151.2 Å²	151.2	92%	0.921	86%	0.856	S	S	*	*	S	Bend	trans	-112.3	16	-173.6	-82.4	166.2	0	0	0	115.4
8	S	48.9	Very low	47.9	Very low	105 Å²	105	148.2 Å²	148.2	73%	0.734	85%	0.846	S	S	*	*	S	Bend	trans	-104.2	14	-173.9	73.2	0	0	0	0	116.4
9	L	49	Very low	47.3	Very low	164 Å²	164	146.7 Å²	146.7	86%	0.859	84%	0.84	S	S	*	*	S	Bend	trans	-124.8	16.8	-170	-86.1	163.9	0	0	0	117
10	I	51.1	Low	47	Very low	165 Å²	165	144.6 Å²	144.6	85%	0.846	83%	0.833	S	S	*	*	S	Bend	trans	-114.3	-4.6	179.9	-58.6	173.7	0	0	0	113.5	K12	I10-K12 PolarHBondContact O-N 2.74Å
11	G	45.9	Very low	46.6	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	83%	0.83	S	S	*	*	S	Bend	trans	-85.6	5.9	-173	0	0	0	0	0	117.8
12	K	46.7	Very low	46.6	Very low	202 Å²	202	143.2 Å²	143.2	88%	0.878	81%	0.814	S	S	*	*			trans	-132	58.3	-172.2	-62	-171.5	-177.3	-173.3	0	113.2	I10	I10-K12 PolarHBondContact O-N 2.74Å
13	R	46.1	Very low	46	Very low	243 Å²	243	136.8 Å²	136.8	92%	0.917	79%	0.792	S	S	*	*			trans	-126.1	101.5	152.1	-76.8	-168.1	172.4	-166.5	-2.1	107.8	I15	R13-I15 PolarHBondContact O-N 2.71Å
14	A	47.1	Very low	45.5	Very low	94 Å²	94	137.7 Å²	137.7	78%	0.777	80%	0.799	S	S	*	*			trans	-46.9	128.9	174.5	0	0	0	0	0	109.9	S16	A14-S16 PolarHBondContact O-N 3.43Å
15	I	51.8	Low	45.3	Very low	169 Å²	169	137.8 Å²	137.8	87%	0.867	79%	0.786	S	S	*	*			trans	-66.7	90.4	160.3	-56.8	169.6	0	0	0	104.5	R13 A17	R13-I15 PolarHBondContact O-N 2.71Å; I15-A17 PolarHBondContact O-N 3.32Å
16	S	44.3	Very low	45.4	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	78%	0.779	S	S	*	*			trans	-70.4	89.8	168.8	-171.4	0	0	0	0	106.4	A14 S18	A14-S16 PolarHBondContact O-N 3.43Å; S16-S18 PolarHBondContact O-N 2.99Å
17	A	46.3	Very low	45.4	Very low	81 Å²	81	130.8 Å²	130.8	67%	0.669	78%	0.776	S	S	*	*			trans	-65.3	86.7	163.2	0	0	0	0	0	106.7	I15 V19	I15-A17 PolarHBondContact O-N 3.32Å; A17-V19 PolarHBondContact O-N 3.3Å
18	S	48.2	Very low	45.7	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	77%	0.766	S	S	*	*			trans	-64.8	92.8	162.7	54.7	0	0	0	0	106.6	S16 C20	S16-S18 PolarHBondContact O-N 2.99Å; S18-C20 PolarHBondContact O-N 3.49Å
19	V	37.5	Very low	46.4	Very low	120 Å²	120	128.3 Å²	128.3	73%	0.727	76%	0.76	S	S	*	*			trans	-63	96.5	159.3	171.4	0	0	0	0	104.6	A17 V21	A17-V19 PolarHBondContact O-N 3.3Å; V19-V21 HydrophobicContact CG1-CG2 4.45Å; V19-V21 PolarHBondContact O-N 3.22Å
20	C	40.5	Very low	47	Very low	104 Å²	104	126.6 Å²	126.6	70%	0.703	76%	0.757	S	S	*	*			trans	-58.5	98.9	159.9	-67.1	0	0	0	0	105.8	S18 R22	S18-C20 PolarHBondContact O-N 3.49Å; C20-R22 PolarHBondContact O-N 2.99Å
21	V	38.2	Very low	47.8	Very low	127 Å²	127	126.3 Å²	126.3	77%	0.77	75%	0.752	S	S	*	*			trans	-59.5	94.3	156	177.6	0	0	0	0	103.9	V19 G23	V19-V21 HydrophobicContact CG1-CG2 4.45Å; V19-V21 PolarHBondContact O-N 3.22Å; V21-G23 VanDerWaalsContact C-N 3.31Å; V21-G23 PolarHBondContact O-N 3.4Å
22	R	43.4	Very low	49	Very low	231 Å²	231	126 Å²	126	87%	0.872	73%	0.732	S	S	*	*			trans	-57	109	163.6	-74.5	-176.1	-175.1	179.1	1.5	103.9	C20	C20-R22 PolarHBondContact O-N 2.99Å
23	G	35.8	Very low	50.6	Low	46 Å²	46	125.4 Å²	125.4	47%	0.474	73%	0.725	S	S	.	*			trans	-46.7	148.2	168.6	0	0	0	0	0	108.6	V21 H25	V21-G23 VanDerWaalsContact C-N 3.31Å; V21-G23 PolarHBondContact O-N 3.4Å; G23-H25 PolarHBondContact O-N 3.09Å
24	A	36.5	Very low	52.5	Low	112 Å²	112	118.6 Å²	118.6	93%	0.926	71%	0.71	S	S	*	*			trans	-59.9	67.7	-176.2	0	0	0	0	0	112.8	G26	A24-G26 PolarHBondContact O-N 3.22Å
25	H	45.9	Very low	54.4	Low	124 Å²	124	118.8 Å²	118.8	57%	0.574	70%	0.698	S	S	*	*			trans	-72.7	113.9	159.7	-74.8	-68.3	0	0	0	105.6	G23 V27	G23-H25 PolarHBondContact O-N 3.09Å; H25-V27 PolarHBondContact O-N 2.64Å
26	G	54.5	Low	56.2	Low	76 Å²	76	113.7 Å²	113.7	78%	0.784	68%	0.676	S	S	*	*			trans	-42.7	129.2	-175.4	0	0	0	0	0	111.6	A24 A28	A24-G26 PolarHBondContact O-N 3.22Å; G26-A28 PolarHBondContact O-N 3.5Å
27	V	48.4	Very low	58.3	Low	128 Å²	128	112.1 Å²	112.1	78%	0.776	66%	0.663	S	S	*	*			trans	-56.8	112.7	170.1	175.9	0	0	0	0	106.5	H25 K29	H25-V27 PolarHBondContact O-N 2.64Å; V27-K29 PolarHBondContact O-N 3.18Å
28	A	53.9	Low	60.5	Low	87 Å²	87	110.1 Å²	110.1	72%	0.719	64%	0.639	S	S	*	*			trans	-57.2	108.1	166.4	0	0	0	0	0	106.3	G26	G26-A28 PolarHBondContact O-N 3.5Å
29	K	63.1	Low	62.6	Low	141 Å²	141	110.2 Å²	110.2	61%	0.613	63%	0.627	S	S	*	*			trans	-67.4	144.5	178.7	-65.5	174.3	178.4	175.1	0	106.8	V27 E31 D32	V27-K29 PolarHBondContact O-N 3.18Å; K29-E31 PolarHBondContact O-N 3.02Å; K29-D32 WeakPolarHBondContact CB-OD2 3.48Å; K29-D32 PolarHBondContact O-N 3Å
30	V	62.5	Low	65.2	Low	129 Å²	129	106.5 Å²	106.5	78%	0.782	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-8.7	177.5	179.1	0	0	0	0	111.9	Y33	V30-Y33 WeakPolarHBondContact O-CD1 3.49Å; V30-Y33 WeakPolarHBondContact O-CE1 3.48Å
31	E	66.5	Low	67.7	Low	159 Å²	159	107 Å²	107	74%	0.743	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-21.4	176.1	-53.4	-168.4	-169.1	0	0	112.5	K29 T34	K29-E31 PolarHBondContact O-N 3.02Å; E31-T34 PolarHBondContact O-OG1 3.28Å
32	D	72.1	Confident	70.3	Confident	73 Å²	73	108.4 Å²	108.4	39%	0.39	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-88	-5.3	-170.2	-61.1	-28.6	0	0	0	113.7	K29 T34 L35	K29-D32 WeakPolarHBondContact CB-OD2 3.48Å; K29-D32 PolarHBondContact O-N 3Å; D32-T34 PolarHBondContact O-N 3.42Å; D32-L35 PolarHBondContact O-N 3.23Å
33	Y	80.3	Confident	72.8	Confident	189 Å²	189	103.8 Å²	103.8	74%	0.741	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-66.6	-18.4	179.4	75	-86.3	0	0	0	113.5	V30	V30-Y33 WeakPolarHBondContact O-CD1 3.49Å; V30-Y33 WeakPolarHBondContact O-CE1 3.48Å
34	T	85.6	Confident	75.6	Confident	99 Å²	99	104.7 Å²	104.7	61%	0.607	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-84.6	-14.5	175.7	61.6	0	0	0	0	112.6	E31 D32	E31-T34 PolarHBondContact O-OG1 3.28Å; D32-T34 PolarHBondContact O-N 3.42Å
35	L	87.1	Confident	78.3	Confident	99 Å²	99	102.6 Å²	102.6	52%	0.518	54%	0.544	S	S	.	.	S	Bend	trans	-92.7	152.8	177.9	-59.5	176.9	0	0	0	110	D32 P37	D32-L35 PolarHBondContact O-N 3.23Å; L35-P37 WeakPolarHBondContact O-CD 3.19Å
36	P	89.3	Confident	80.7	Confident	61 Å²	61	103.4 Å²	103.4	40%	0.396	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-55.4	118.1	174.2	-30.4	38.6	0	0	0	112.9	E48 V49	P36-E48 HydrophobicContact CB-CB 4.07Å; P36-E48 WeakPolarHBondContact CB-OE2 3.33Å; P36-V49 HydrophobicContact CB-CG1 3.98Å; P36-V49 WeakPolarHBondContact O-CG2 3.06Å
37	P	89.2	Confident	82.5	Confident	72 Å²	72	101.3 Å²	101.3	47%	0.468	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-85	154.5	177.3	34.6	-37.3	0	0	0	112.3	L35 F39	L35-P37 WeakPolarHBondContact O-CD 3.19Å; P37-F39 HydrophobicContact CB-CD2 4.49Å; P37-F39 HydrophobicContact CB-CE2 3.87Å; P37-F39 HydrophobicContact CB-CZ 3.86Å; P37-F39 HydrophobicContact CG-CD2 3.97Å; P37-F39 HydrophobicContact CG-CE2 3.18Å; P37-F39 HydrophobicContact CG-CZ 3.55Å
38	Y	91.9	Very high	84.5	Confident	40 Å²	40	103 Å²	103	16%	0.157	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-80.6	132.7	169.6	-177.7	-88.9	0	0	0	110.9	D40 P47 V49 Y51 F86 K87	Y38-D40 VanDerWaalsContact CE1-OD1 3.32Å; Y38-D40 WeakPolarHBondContact CE1-OD1 3.48Å; Y38-D40 VanDerWaalsContact CZ-OD1 3.28Å; Y38-D40 PolarHBondContact OH-OD1 2.87Å; Y38-P47 HydrophobicContact CD2-CB 3.99Å; Y38-P47 HydrophobicContact CD2-CG 4.21Å; Y38-P47 HydrophobicContact CE2-CB 4.01Å; Y38-P47 HydrophobicContact CE2-CG 3.73Å; Y38-V49 VanDerWaalsContact CD2-O 3.29Å; Y38-V49 WeakPolarHBondContact CD2-O 3.46Å; Y38-Y51 HydrophobicContact CD1-CD2 4.07Å; Y38-Y51 HydrophobicContact CE1-CD2 4.15Å; Y38-Y51 HydrophobicContact CG-CD2 4.47Å; Y38-F86 WeakPolarHBondContact OH-CA 3.25Å; Y38-K87 HydrophobicContact CE1-CB 3.84Å; Y38-K87 PolarHBondContact OH-N 3.32Å
39	F	91.6	Very high	86.4	Confident	98 Å²	98	100.8 Å²	100.8	43%	0.43	50%	0.5	S	S	.	.			trans	-140	132.3	171.1	-62.8	-63.1	0	0	0	111.7	P37 R41 P47	P37-F39 HydrophobicContact CB-CD2 4.49Å; P37-F39 HydrophobicContact CB-CE2 3.87Å; P37-F39 HydrophobicContact CB-CZ 3.86Å; P37-F39 HydrophobicContact CG-CD2 3.97Å; P37-F39 HydrophobicContact CG-CE2 3.18Å; P37-F39 HydrophobicContact CG-CZ 3.55Å; F39-R41 HydrophobicContact CB-CG 4.16Å; F39-R41 PolarHBondContact O-N 3.42Å; F39-P47 WeakPolarHBondContact O-CG 3.16Å
40	D	93.2	Very high	87.8	Confident	42 Å²	42	96.2 Å²	96.2	23%	0.225	49%	0.489	C	S	.	.			trans	-80.7	109.9	165	-63.1	-54.9	0	0	0	109	Y38 K87 M93	Y38-D40 VanDerWaalsContact CE1-OD1 3.32Å; Y38-D40 WeakPolarHBondContact CE1-OD1 3.48Å; Y38-D40 VanDerWaalsContact CZ-OD1 3.28Å; Y38-D40 PolarHBondContact OH-OD1 2.87Å; D40-K87 WeakPolarHBondContact OD2-CB 3.34Å; D40-M93 HydrophobicContact CB-SD 3.87Å
41	R	93.1	Very high	89.3	Confident	113 Å²	113	94 Å²	94	43%	0.426	47%	0.467	S	S	.	.			trans	-143.5	143.3	-177.3	-80.4	176.4	-170.8	-161.9	10.5	110.1	F39 E43 T44 M93	F39-R41 HydrophobicContact CB-CG 4.16Å; F39-R41 PolarHBondContact O-N 3.42Å; R41-E43 HydrophobicContact CB-CG 4.38Å; R41-E43 WeakPolarHBondContact CB-OE1 3.5Å; R41-E43 WeakPolarHBondContact CD-OE1 3.47Å; R41-E43 WeakPolarHBondContact CG-OE1 3.5Å; R41-T44 VanDerWaalsContact CB-OG1 3.27Å; R41-T44 WeakPolarHBondContact CB-OG1 3.41Å; R41-T44 CarbonylContact O-C 3.37Å; R41-M93 PolarHBondContact N-SD 2.94Å; R41-M93 VanDerWaalsContact N-SD 3.45Å
42	R	93.3	Very high	90.6	Very high	157 Å²	157	88.1 Å²	88.1	59%	0.592	44%	0.442	S	S	*	.	S	Bend	trans	-74.7	-35.1	-176.1	-63.9	173.6	70.9	162.5	-12.6	112.1	T44 F90 M93 N94	R42-T44 VanDerWaalsContact C-N 3.33Å; R42-F90 HydrophobicContact CB-CE1 4.23Å; R42-F90 HydrophobicContact CG-CE1 4.24Å; R42-M93 HydrophobicContact CB-CE 4.46Å; R42-M93 HydrophobicContact CG-CE 3.61Å; R42-M93 HydrophobicContact CG-SD 4.26Å; R42-N94 WeakPolarHBondContact CD-OD1 3.26Å; R42-N94 PolarHBondContact NE-OD1 2.92Å; R42-N94 PolarHBondContact NH1-OD1 3.43Å
43	E	95	Very high	91.4	Very high	134 Å²	134	91.8 Å²	91.8	63%	0.626	46%	0.457	S	S	*	.	S	Bend	trans	-72.3	-27.5	179.8	62.4	-81.5	-169.3	0	0	112.4	R41 P45	R41-E43 HydrophobicContact CB-CG 4.38Å; R41-E43 WeakPolarHBondContact CB-OE1 3.5Å; R41-E43 WeakPolarHBondContact CD-OE1 3.47Å; R41-E43 WeakPolarHBondContact CG-OE1 3.5Å; E43-P45 WeakPolarHBondContact O-CD 3.4Å
44	T	93.8	Very high	92	Very high	66 Å²	66	91.2 Å²	91.2	41%	0.405	46%	0.461	S	S	.	.			trans	-122.1	76.3	176.4	53.9	0	0	0	0	109.5	R41 R42 L46	R41-T44 VanDerWaalsContact CB-OG1 3.27Å; R41-T44 WeakPolarHBondContact CB-OG1 3.41Å; R41-T44 CarbonylContact O-C 3.37Å; R42-T44 VanDerWaalsContact C-N 3.33Å; T44-L46 PolarHBondContact O-N 3.23Å
45	P	94.2	Very high	92.4	Very high	68 Å²	68	89 Å²	89	44%	0.442	45%	0.445	S	S	.	.	S	Bend	trans	-64.2	-19.7	-176.8	26.2	-36.1	0	0	0	113.6	E43 F86 F90	E43-P45 WeakPolarHBondContact O-CD 3.4Å; P45-F86 VanDerWaalsContact O-CE1 3.32Å; P45-F86 WeakPolarHBondContact O-CE1 3.4Å; P45-F90 HydrophobicContact CB-CE2 4.19Å; P45-F90 HydrophobicContact CB-CZ 3.88Å
46	L	95.4	Very high	92.8	Very high	141 Å²	141	87.4 Å²	87.4	74%	0.738	44%	0.439	S	S	*	.	S	Bend	trans	-118.7	94.5	178.5	-60.9	176.8	0	0	0	108.4	T44 F86	T44-L46 PolarHBondContact O-N 3.23Å; L46-F86 HydrophobicContact CD2-CZ 4.02Å
47	P	92.8	Very high	93	Very high	31 Å²	31	89.6 Å²	89.6	20%	0.201	45%	0.454	C	S	.	.			trans	-63.1	154.6	175	-22	35	0	0	0	111.7	Y38 F39 V49 F86	Y38-P47 HydrophobicContact CD2-CB 3.99Å; Y38-P47 HydrophobicContact CD2-CG 4.21Å; Y38-P47 HydrophobicContact CE2-CB 4.01Å; Y38-P47 HydrophobicContact CE2-CG 3.73Å; F39-P47 WeakPolarHBondContact O-CG 3.16Å; P47-V49 PolarHBondContact O-N 3.31Å; P47-F86 HydrophobicContact CG-CE1 4.45Å
48	E	91.3	Very high	93.2	Very high	165 Å²	165	93.5 Å²	93.5	77%	0.771	47%	0.466	S	S	*	.	S	Bend	trans	-66.3	-25.8	-177.7	-65.4	-177.9	-168.8	0	0	113.3	P36	P36-E48 HydrophobicContact CB-CB 4.07Å; P36-E48 WeakPolarHBondContact CB-OE2 3.33Å
49	V	92.9	Very high	93.3	Very high	39 Å²	39	94 Å²	94	24%	0.236	47%	0.469	C	S	.	.	S	Bend	trans	-124.7	153.6	178.1	-67.5	0	0	0	0	109.9	P36 Y38 P47	P36-V49 HydrophobicContact CB-CG1 3.98Å; P36-V49 WeakPolarHBondContact O-CG2 3.06Å; Y38-V49 VanDerWaalsContact CD2-O 3.29Å; Y38-V49 WeakPolarHBondContact CD2-O 3.46Å; P47-V49 PolarHBondContact O-N 3.31Å
50	A	93.3	Very high	93.5	Very high	45 Å²	45	95.1 Å²	95.1	37%	0.372	47%	0.474	S	S	.	.			trans	-73.9	153.6	171.4	0	0	0	0	0	111	V52	A50-V52 PolarHBondContact O-N 3.07Å
51	Y	93.9	Very high	93.6	Very high	83 Å²	83	96.2 Å²	96.2	33%	0.325	49%	0.485	S	S	.	.	S	Bend	trans	-59.2	-47.6	177	174.5	-124.6	0	0	0	112.3	Y38 S85 K87	Y38-Y51 HydrophobicContact CD1-CD2 4.07Å; Y38-Y51 HydrophobicContact CE1-CD2 4.15Å; Y38-Y51 HydrophobicContact CG-CD2 4.47Å; Y51-S85 PolarHBondContact N-O 3.21Å; Y51-K87 HydrophobicContact CD1-CB 3.95Å; Y51-K87 HydrophobicContact CD2-CB 3.58Å; Y51-K87 HydrophobicContact CD2-CD 4.3Å; Y51-K87 HydrophobicContact CD2-CG 4.21Å; Y51-K87 HydrophobicContact CE1-CB 4.05Å; Y51-K87 HydrophobicContact CE1-CG 4.12Å; Y51-K87 HydrophobicContact CE2-CB 3.69Å; Y51-K87 HydrophobicContact CE2-CD 3.65Å; Y51-K87 HydrophobicContact CE2-CG 3.77Å; Y51-K87 HydrophobicContact CG-CB 3.71Å
52	V	93.6	Very high	93.7	Very high	36 Å²	36	91.7 Å²	91.7	22%	0.218	47%	0.469	C	S	.	.			trans	-96.6	107.6	177.8	-177.4	0	0	0	0	109.8	A50 Q54 L55 I84	A50-V52 PolarHBondContact O-N 3.07Å; V52-Q54 WeakPolarHBondContact CG1-O 3.38Å; V52-L55 HydrophobicContact CG1-CD2 4.29Å; V52-I84 HydrophobicContact CB-CG2 4.31Å; V52-I84 PolarHBondContact N-O 3.42Å
53	Q	89.6	Confident	93.9	Very high	149 Å²	149	87.1 Å²	87.1	70%	0.696	45%	0.454	S	S	*	.			trans	-83.5	-33.6	178.6	-62.3	-172.7	6.6	0	0	113.2
54	Q	92.4	Very high	93.9	Very high	177 Å²	177	86.1 Å²	86.1	83%	0.827	45%	0.449	S	S	*	.	S	Bend	trans	-108	106.8	-178.6	-66.4	-175.9	-4.7	0	0	110.2	V52	V52-Q54 WeakPolarHBondContact CG1-O 3.38Å
55	L	93.3	Very high	94	Very high	54 Å²	54	88.5 Å²	88.5	28%	0.283	45%	0.454	S	S	.	.			trans	-83.3	133.7	-177.2	-60.4	170.4	0	0	0	111.9	V52 Q59 K60 K63 I84	V52-L55 HydrophobicContact CG1-CD2 4.29Å; L55-Q59 HydrophobicContact CB-CB 4.08Å; L55-Q59 HydrophobicContact CD2-CB 3.96Å; L55-K60 HydrophobicContact CB-CG 3.75Å; L55-K60 HydrophobicContact CD1-CG 4.35Å; L55-K60 WeakPolarHBondContact O-CE 3.41Å; L55-K63 HydrophobicContact CD1-CG 3.91Å; L55-I84 HydrophobicContact CD2-CG2 3.66Å
56	T	94.8	Very high	94	Very high	64 Å²	64	87.3 Å²	87.3	39%	0.393	44%	0.442	S	S	.	.			trans	-66.5	160.3	167.4	68.9	0	0	0	0	110.6	E58 Q59 K60	T56-E58 PolarHBondContact O-N 3.17Å; T56-Q59 PolarHBondContact O-N 2.96Å; T56-Q59 VanDerWaalsContact O-N 3.09Å; T56-Q59 VanDerWaalsContact OG1-CG 3.23Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.42Å; T56-Q59 PolarHBondContact OG1-N 3.32Å; T56-Q59 PolarHBondContact OG1-OE1 2.96Å; T56-K60 WeakPolarHBondContact O-CG 3.27Å; T56-K60 PolarHBondContact O-N 3.04Å
57	P	95.3	Very high	94	Very high	108 Å²	108	87.9 Å²	87.9	70%	0.701	44%	0.439	S	S	*	.	H	α-helix	trans	-56.8	-35.1	178	20.9	-33.3	0	0	0	113.3	K60 S61	P57-K60 PolarHBondContact O-N 3.1Å; P57-S61 PolarHBondContact O-N 3.18Å; P57-S61 VanDerWaalsContact O-N 3.07Å
58	E	93.2	Very high	94.1	Very high	154 Å²	154	88.7 Å²	88.7	72%	0.72	45%	0.453	S	S	*	.	H	α-helix	trans	-68.6	-41.9	174.8	-62.9	177.4	-179.3	0	0	112.1	T56 K60 S61 L62	T56-E58 PolarHBondContact O-N 3.17Å; E58-K60 VanDerWaalsContact C-N 3.3Å; E58-K60 PolarHBondContact O-N 3.44Å; E58-S61 PolarHBondContact O-N 3.31Å; E58-S61 PolarHBondContact O-OG 3.41Å; E58-L62 WeakPolarHBondContact O-CB 3.29Å; E58-L62 PolarHBondContact O-N 3.26Å
59	Q	93.9	Very high	94.3	Very high	49 Å²	49	84.9 Å²	84.9	23%	0.229	44%	0.444	C	S	.	.	H	α-helix	trans	-65.5	-35.6	174.8	-71.3	172.2	-25.3	0	0	111.4	L55 T56 L62 K63 I84	L55-Q59 HydrophobicContact CB-CB 4.08Å; L55-Q59 HydrophobicContact CD2-CB 3.96Å; T56-Q59 PolarHBondContact O-N 2.96Å; T56-Q59 VanDerWaalsContact O-N 3.09Å; T56-Q59 VanDerWaalsContact OG1-CG 3.23Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.42Å; T56-Q59 PolarHBondContact OG1-N 3.32Å; T56-Q59 PolarHBondContact OG1-OE1 2.96Å; Q59-L62 PolarHBondContact O-N 2.97Å; Q59-K63 VanDerWaalsContact O-CG 3.29Å; Q59-K63 WeakPolarHBondContact O-CG 3.32Å; Q59-K63 PolarHBondContact O-N 3.39Å; Q59-I84 HydrophobicContact CB-CD1 4.03Å; Q59-I84 HydrophobicContact CG-CD1 3.86Å; Q59-I84 HydrophobicContact CG-CG1 4.28Å
60	K	95.5	Very high	94.5	Very high	122 Å²	122	90 Å²	90	53%	0.53	46%	0.459	S	S	.	.	H	α-helix	trans	-62.4	-45.8	173.7	-70.6	178.6	-176.8	-179.8	0	111.5	L55 T56 P57 E58 L62 K63 E64	L55-K60 HydrophobicContact CB-CG 3.75Å; L55-K60 HydrophobicContact CD1-CG 4.35Å; L55-K60 WeakPolarHBondContact O-CE 3.41Å; T56-K60 WeakPolarHBondContact O-CG 3.27Å; T56-K60 PolarHBondContact O-N 3.04Å; P57-K60 PolarHBondContact O-N 3.1Å; E58-K60 VanDerWaalsContact C-N 3.3Å; E58-K60 PolarHBondContact O-N 3.44Å; K60-L62 VanDerWaalsContact C-N 3.28Å; K60-L62 PolarHBondContact O-N 2.87Å; K60-K63 PolarHBondContact O-N 2.95Å; K60-E64 PolarHBondContact O-N 3.01Å
61	S	95	Very high	94.6	Very high	65 Å²	65	92.3 Å²	92.3	46%	0.455	48%	0.478	S	S	.	.	H	α-helix	trans	-64.6	-35.3	176.8	71.8	0	0	0	0	111.8	P57 E58 E64 K65	P57-S61 PolarHBondContact O-N 3.18Å; P57-S61 VanDerWaalsContact O-N 3.07Å; E58-S61 PolarHBondContact O-N 3.31Å; E58-S61 PolarHBondContact O-OG 3.41Å; S61-E64 PolarHBondContact O-N 3.27Å; S61-K65 WeakPolarHBondContact O-CG 3.29Å; S61-K65 PolarHBondContact O-N 3.37Å
62	L	95.9	Very high	94.6	Very high	18 Å²	18	92.5 Å²	92.5	9%	0.094	50%	0.497	C	S	.	.	H	α-helix	trans	-65.2	-41.5	173	-176.4	61.2	0	0	0	112.6	E58 Q59 K60 E64 K65 E66 L73 E77 A80 L81 I84	E58-L62 WeakPolarHBondContact O-CB 3.29Å; E58-L62 PolarHBondContact O-N 3.26Å; Q59-L62 PolarHBondContact O-N 2.97Å; K60-L62 VanDerWaalsContact C-N 3.28Å; K60-L62 PolarHBondContact O-N 2.87Å; L62-E64 VanDerWaalsContact C-N 3.28Å; L62-E64 PolarHBondContact O-N 3.46Å; L62-K65 WeakPolarHBondContact O-CB 3.47Å; L62-K65 PolarHBondContact O-N 2.94Å; L62-E66 PolarHBondContact O-N 3.29Å; L62-L73 HydrophobicContact CD1-CD2 4.43Å; L62-E77 HydrophobicContact CD1-CB 3.8Å; L62-E77 HydrophobicContact CD1-CG 3.79Å; L62-A80 HydrophobicContact CD2-CB 3.68Å; L62-L81 HydrophobicContact CD1-CG 4.44Å; L62-L81 HydrophobicContact CD2-CD2 4.14Å; L62-L81 HydrophobicContact CD2-CG 4.07Å; L62-L81 HydrophobicContact CG-CD2 3.86Å; L62-L81 HydrophobicContact CG-CG 4.02Å; L62-I84 HydrophobicContact CD2-CD1 4.28Å
63	K	95.8	Very high	94.7	Very high	61 Å²	61	91.3 Å²	91.3	27%	0.265	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-29.3	173.3	-68.4	-65.8	-67	174.9	0	112.5	L55 Q59 K60 E66 L81	L55-K63 HydrophobicContact CD1-CG 3.91Å; Q59-K63 VanDerWaalsContact O-CG 3.29Å; Q59-K63 WeakPolarHBondContact O-CG 3.32Å; Q59-K63 PolarHBondContact O-N 3.39Å; K60-K63 PolarHBondContact O-N 2.95Å; K63-E66 WeakPolarHBondContact CD-OE2 3.4Å; K63-E66 WeakPolarHBondContact CE-OE2 3.37Å; K63-E66 IonicContact NZ-OE1 2.64Å; K63-E66 PolarHBondContact NZ-OE1 2.78Å; K63-E66 IonicContact NZ-OE2 3.64Å; K63-E66 PolarHBondContact NZ-OE2 3.37Å; K63-E66 WeakPolarHBondContact O-CB 3.4Å; K63-L81 HydrophobicContact CD-CD2 3.88Å
64	E	95.9	Very high	95	Very high	114 Å²	114	86.8 Å²	86.8	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-70.8	-40.6	170.9	-68.7	-55.6	136.4	0	0	111.7	K60 S61 L62 E66 K67	K60-E64 PolarHBondContact O-N 3.01Å; S61-E64 PolarHBondContact O-N 3.27Å; L62-E64 VanDerWaalsContact C-N 3.28Å; L62-E64 PolarHBondContact O-N 3.46Å; E64-E66 VanDerWaalsContact C-N 3.3Å; E64-E66 PolarHBondContact O-N 3.47Å; E64-K67 WeakPolarHBondContact O-CB 3.42Å; E64-K67 PolarHBondContact O-N 3.07Å; E64-K67 IonicContact OE1-NZ 2.74Å; E64-K67 PolarHBondContact OE1-NZ 3.05Å; E64-K67 WeakPolarHBondContact OE2-CE 3.21Å; E64-K67 IonicContact OE2-NZ 2.71Å; E64-K67 PolarHBondContact OE2-NZ 3.19Å
65	K	95	Very high	95.3	Very high	115 Å²	115	84.3 Å²	84.3	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-35	173.3	-69.3	-174.3	-174.9	-175.1	0	112.8	S61 L62 K67 G68 L73 E77	S61-K65 WeakPolarHBondContact O-CG 3.29Å; S61-K65 PolarHBondContact O-N 3.37Å; L62-K65 WeakPolarHBondContact O-CB 3.47Å; L62-K65 PolarHBondContact O-N 2.94Å; K65-K67 PolarHBondContact O-N 3.42Å; K65-G68 PolarHBondContact O-N 3.49Å; K65-L73 HydrophobicContact CB-CD2 4.19Å; K65-E77 IonicContact NZ-OE1 3.5Å; K65-E77 PolarHBondContact NZ-OE1 3.09Å
66	E	95.2	Very high	95.5	Very high	43 Å²	43	89.3 Å²	89.3	20%	0.201	49%	0.489	C	S	.	.	H	α-helix	trans	-58.1	-28.7	178.1	-176.6	-173.3	-174.8	0	0	113.2	L62 K63 E64 G68 W70 L81	L62-E66 PolarHBondContact O-N 3.29Å; K63-E66 WeakPolarHBondContact CD-OE2 3.4Å; K63-E66 WeakPolarHBondContact CE-OE2 3.37Å; K63-E66 IonicContact NZ-OE1 2.64Å; K63-E66 PolarHBondContact NZ-OE1 2.78Å; K63-E66 IonicContact NZ-OE2 3.64Å; K63-E66 PolarHBondContact NZ-OE2 3.37Å; K63-E66 WeakPolarHBondContact O-CB 3.4Å; E64-E66 VanDerWaalsContact C-N 3.3Å; E64-E66 PolarHBondContact O-N 3.47Å; E66-G68 PolarHBondContact O-N 3.42Å; E66-W70 HydrophobicContact CG-CZ2 4.07Å; E66-W70 PolarHBondContact O-NE1 3.42Å; E66-L81 HydrophobicContact CB-CD1 3.99Å; E66-L81 HydrophobicContact CB-CD2 4.12Å; E66-L81 HydrophobicContact CG-CD1 3.9Å; E66-L81 HydrophobicContact CG-CD2 4.27Å; E66-L81 WeakPolarHBondContact OE2-CD2 3.4Å
67	K	95.9	Very high	95.5	Very high	154 Å²	154	88.2 Å²	88.2	67%	0.67	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18	176.3	-60.5	176.2	-171.3	165.8	0	112.9	E64 K65	E64-K67 WeakPolarHBondContact O-CB 3.42Å; E64-K67 PolarHBondContact O-N 3.07Å; E64-K67 IonicContact OE1-NZ 2.74Å; E64-K67 PolarHBondContact OE1-NZ 3.05Å; E64-K67 WeakPolarHBondContact OE2-CE 3.21Å; E64-K67 IonicContact OE2-NZ 2.71Å; E64-K67 PolarHBondContact OE2-NZ 3.19Å; K65-K67 PolarHBondContact O-N 3.42Å
68	G	94.7	Very high	95.6	Very high	47 Å²	47	86.9 Å²	86.9	49%	0.485	46%	0.462	S	S	.	.	S	Bend	trans	-88.3	-159.8	177.4	0	0	0	0	0	113.7	K65 E66 W70	K65-G68 PolarHBondContact O-N 3.49Å; E66-G68 PolarHBondContact O-N 3.42Å; G68-W70 PolarHBondContact O-N 2.99Å
69	S	95.4	Very high	95.8	Very high	85 Å²	85	84.7 Å²	84.7	59%	0.594	46%	0.455	S	S	*	.			trans	-74.9	125.1	179.2	179.6	0	0	0	0	112.3	A71 A72	S69-A71 PolarHBondContact O-N 3.09Å; S69-A71 PolarHBondContact OG-N 3.24Å; S69-A72 WeakPolarHBondContact O-CB 3.44Å; S69-A72 PolarHBondContact O-N 2.88Å; S69-A72 VanDerWaalsContact O-N 3.09Å
70	W	96.3	Very high	95.9	Very high	147 Å²	147	84.3 Å²	84.3	56%	0.557	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.6	178	-72.2	26.9	0	0	0	113.9	E66 G68 L73 K78	E66-W70 HydrophobicContact CG-CZ2 4.07Å; E66-W70 PolarHBondContact O-NE1 3.42Å; G68-W70 PolarHBondContact O-N 2.99Å; W70-L73 HydrophobicContact CB-CD1 4.29Å; W70-L73 HydrophobicContact CD2-CD1 4.45Å; W70-L73 HydrophobicContact CG-CD1 4.01Å; W70-L73 PolarHBondContact O-N 3.45Å; W70-K78 WeakPolarHBondContact O-CE 3.32Å; W70-K78 PolarHBondContact O-NZ 2.92Å
71	A	95.1	Very high	96	Very high	93 Å²	93	79 Å²	79	77%	0.769	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.4	170.5	0	0	0	0	0	112.1	S69	S69-A71 PolarHBondContact O-N 3.09Å; S69-A71 PolarHBondContact OG-N 3.24Å
72	A	94.4	Very high	96.1	Very high	87 Å²	87	79.6 Å²	79.6	72%	0.719	43%	0.43	S	S	*	.	S	Bend	trans	-85.8	-10.6	177.5	0	0	0	0	0	113.4	S69	S69-A72 WeakPolarHBondContact O-CB 3.44Å; S69-A72 PolarHBondContact O-N 2.88Å; S69-A72 VanDerWaalsContact O-N 3.09Å
73	L	95.9	Very high	96.1	Very high	12 Å²	12	83.2 Å²	83.2	6%	0.063	44%	0.443	C	S	.	.	S	Bend	trans	-80.6	134.6	178.7	-67.4	172.5	0	0	0	111.1	L62 K65 W70 E77 K78 L81	L62-L73 HydrophobicContact CD1-CD2 4.43Å; K65-L73 HydrophobicContact CB-CD2 4.19Å; W70-L73 HydrophobicContact CB-CD1 4.29Å; W70-L73 HydrophobicContact CD2-CD1 4.45Å; W70-L73 HydrophobicContact CG-CD1 4.01Å; W70-L73 PolarHBondContact O-N 3.45Å; L73-E77 WeakPolarHBondContact CA-OE2 3.22Å; L73-E77 HydrophobicContact CB-CB 4.38Å; L73-E77 HydrophobicContact CD2-CB 4.14Å; L73-K78 HydrophobicContact CB-CG 4.04Å; L73-K78 HydrophobicContact CD1-CG 4.45Å; L73-K78 WeakPolarHBondContact O-CE 3.25Å; L73-L81 HydrophobicContact CD1-CD1 3.87Å
74	S	96.9	Very high	96.1	Very high	53 Å²	53	80.7 Å²	80.7	37%	0.371	43%	0.432	S	S	.	.			trans	-67.9	162.9	170.9	83.4	0	0	0	0	111.3	E76 E77 K78	S74-E76 PolarHBondContact O-N 2.98Å; S74-E76 PolarHBondContact OG-N 2.5Å; S74-E77 PolarHBondContact N-OE2 2.94Å; S74-E77 PolarHBondContact O-N 2.76Å; S74-E77 WeakPolarHBondContact OG-CG 3.4Å; S74-E77 PolarHBondContact OG-N 3.36Å; S74-E77 VanDerWaalsContact OG-N 3.09Å; S74-K78 WeakPolarHBondContact O-CG 3.18Å; S74-K78 PolarHBondContact O-N 3.44Å
75	N	97.4	Very high	96	Very high	126 Å²	126	76.9 Å²	76.9	67%	0.674	42%	0.418	S	S	*	.	H	α-helix	trans	-62.8	-34	175.9	-70.7	-25.7	0	0	0	112	K78 L79	N75-K78 PolarHBondContact O-N 3.23Å; N75-L79 WeakPolarHBondContact O-CG 3.35Å; N75-L79 PolarHBondContact O-N 2.91Å
76	E	96.9	Very high	96.1	Very high	158 Å²	158	73.5 Å²	73.5	74%	0.738	40%	0.403	S	S	*	.	H	α-helix	trans	-68.4	-41.1	176.6	-63.2	177.1	-176	0	0	111.5	S74 K78 L79 A80	S74-E76 PolarHBondContact O-N 2.98Å; S74-E76 PolarHBondContact OG-N 2.5Å; E76-K78 VanDerWaalsContact C-N 3.33Å; E76-K78 PolarHBondContact O-N 3.22Å; E76-L79 PolarHBondContact O-N 3.44Å; E76-A80 WeakPolarHBondContact O-CB 3.23Å; E76-A80 PolarHBondContact O-N 2.74Å
77	E	96.6	Very high	96.1	Very high	41 Å²	41	74.3 Å²	74.3	19%	0.192	41%	0.406	C	S	.	.	H	α-helix	trans	-63.2	-39.5	175.6	-76.4	177.8	144	0	0	111.5	L62 K65 L73 S74 A80 L81	L62-E77 HydrophobicContact CD1-CB 3.8Å; L62-E77 HydrophobicContact CD1-CG 3.79Å; K65-E77 IonicContact NZ-OE1 3.5Å; K65-E77 PolarHBondContact NZ-OE1 3.09Å; L73-E77 WeakPolarHBondContact CA-OE2 3.22Å; L73-E77 HydrophobicContact CB-CB 4.38Å; L73-E77 HydrophobicContact CD2-CB 4.14Å; S74-E77 PolarHBondContact N-OE2 2.94Å; S74-E77 PolarHBondContact O-N 2.76Å; S74-E77 WeakPolarHBondContact OG-CG 3.4Å; S74-E77 PolarHBondContact OG-N 3.36Å; S74-E77 VanDerWaalsContact OG-N 3.09Å; E77-A80 PolarHBondContact O-N 3.4Å; E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.14Å
78	K	97.1	Very high	96.1	Very high	80 Å²	80	69.3 Å²	69.3	35%	0.348	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-43.5	174	-69	171.4	-173.6	171.2	0	112	W70 L73 S74 N75 E76 A80 L81 Y82	W70-K78 WeakPolarHBondContact O-CE 3.32Å; W70-K78 PolarHBondContact O-NZ 2.92Å; L73-K78 HydrophobicContact CB-CG 4.04Å; L73-K78 HydrophobicContact CD1-CG 4.45Å; L73-K78 WeakPolarHBondContact O-CE 3.25Å; S74-K78 WeakPolarHBondContact O-CG 3.18Å; S74-K78 PolarHBondContact O-N 3.44Å; N75-K78 PolarHBondContact O-N 3.23Å; E76-K78 VanDerWaalsContact C-N 3.33Å; E76-K78 PolarHBondContact O-N 3.22Å; K78-A80 VanDerWaalsContact C-N 3.34Å; K78-L81 PolarHBondContact O-N 3.31Å; K78-Y82 PolarHBondContact O-N 2.89Å
79	L	96.8	Very high	96.1	Very high	109 Å²	109	68.3 Å²	68.3	57%	0.571	37%	0.372	S	S	*	.	H	α-helix	trans	-64.3	-39.1	175.2	-77.5	166.7	0	0	0	111.8	N75 E76 Y82 R83	N75-L79 WeakPolarHBondContact O-CG 3.35Å; N75-L79 PolarHBondContact O-N 2.91Å; E76-L79 PolarHBondContact O-N 3.44Å; L79-Y82 WeakPolarHBondContact O-CB 3.42Å; L79-Y82 PolarHBondContact O-N 3.09Å; L79-R83 WeakPolarHBondContact O-CG 3.38Å; L79-R83 PolarHBondContact O-N 3.3Å
80	A	96.2	Very high	96.1	Very high	40 Å²	40	68.8 Å²	68.8	33%	0.331	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-44.1	175.6	0	0	0	0	0	111.5	L62 E76 E77 K78 Y82 R83 I84	L62-A80 HydrophobicContact CD2-CB 3.68Å; E76-A80 WeakPolarHBondContact O-CB 3.23Å; E76-A80 PolarHBondContact O-N 2.74Å; E77-A80 PolarHBondContact O-N 3.4Å; K78-A80 VanDerWaalsContact C-N 3.34Å; A80-Y82 VanDerWaalsContact C-N 3.29Å; A80-Y82 PolarHBondContact O-N 3.24Å; A80-R83 PolarHBondContact O-N 2.82Å; A80-I84 VanDerWaalsContact O-CG1 3.25Å; A80-I84 WeakPolarHBondContact O-CG1 3.15Å; A80-I84 PolarHBondContact O-N 2.91Å
81	L	96.9	Very high	96.1	Very high	11 Å²	11	65.5 Å²	65.5	6%	0.058	37%	0.368	C	S	.	.	H	α-helix	trans	-59.6	-39.8	172.7	-73.7	172.3	0	0	0	112.4	L62 K63 E66 L73 E77 K78 I84 S85	L62-L81 HydrophobicContact CD1-CG 4.44Å; L62-L81 HydrophobicContact CD2-CD2 4.14Å; L62-L81 HydrophobicContact CD2-CG 4.07Å; L62-L81 HydrophobicContact CG-CD2 3.86Å; L62-L81 HydrophobicContact CG-CG 4.02Å; K63-L81 HydrophobicContact CD-CD2 3.88Å; E66-L81 HydrophobicContact CB-CD1 3.99Å; E66-L81 HydrophobicContact CB-CD2 4.12Å; E66-L81 HydrophobicContact CG-CD1 3.9Å; E66-L81 HydrophobicContact CG-CD2 4.27Å; E66-L81 WeakPolarHBondContact OE2-CD2 3.4Å; L73-L81 HydrophobicContact CD1-CD1 3.87Å; E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.14Å; K78-L81 PolarHBondContact O-N 3.31Å; L81-I84 HydrophobicContact CD2-CD1 4.49Å; L81-I84 PolarHBondContact O-N 2.93Å; L81-S85 PolarHBondContact O-N 2.71Å; L81-S85 PolarHBondContact O-OG 3.16Å
82	Y	96.9	Very high	96.1	Very high	77 Å²	77	64.7 Å²	64.7	30%	0.302	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-48.7	174	-175.1	-97.3	0	0	0	111.4	K78 L79 A80 I84 S85 F86 S89	K78-Y82 PolarHBondContact O-N 2.89Å; L79-Y82 WeakPolarHBondContact O-CB 3.42Å; L79-Y82 PolarHBondContact O-N 3.09Å; A80-Y82 VanDerWaalsContact C-N 3.29Å; A80-Y82 PolarHBondContact O-N 3.24Å; Y82-I84 VanDerWaalsContact C-N 3.28Å; Y82-I84 PolarHBondContact O-N 2.93Å; Y82-S85 PolarHBondContact O-N 2.75Å; Y82-S85 VanDerWaalsContact O-N 3.1Å; Y82-F86 AromaticContact CD2-CD2 3.73Å; Y82-F86 HydrophobicContact CD2-CD2 3.73Å; Y82-F86 HydrophobicContact CD2-CE2 4.35Å; Y82-F86 HydrophobicContact CE1-CB 4.15Å; Y82-F86 HydrophobicContact CE2-CB 4.32Å; Y82-F86 AromaticContact CE2-CD2 3.46Å; Y82-F86 HydrophobicContact CE2-CD2 3.46Å; Y82-F86 VanDerWaalsContact CE2-CD2 3.46Å; Y82-F86 HydrophobicContact CE2-CE2 4.09Å; Y82-F86 HydrophobicContact CE2-CG 4.14Å; Y82-F86 HydrophobicContact CG-CD2 4.44Å; Y82-F86 AromaticContact CZ-CD2 3.99Å; Y82-F86 PolarHBondContact O-N 3.22Å; Y82-S89 WeakPolarHBondContact OH-CA 2.96Å
83	R	96.2	Very high	96	Very high	95 Å²	95	63 Å²	63	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-71	-18.3	-179.9	-65.5	-63.5	-174.9	-180	0.6	114.5	L79 A80 F86 K87 E92	L79-R83 WeakPolarHBondContact O-CG 3.38Å; L79-R83 PolarHBondContact O-N 3.3Å; A80-R83 PolarHBondContact O-N 2.82Å; R83-F86 CarbonylContact C-O 3.38Å; R83-F86 VanDerWaalsContact CA-O 3.28Å; R83-F86 WeakPolarHBondContact CA-O 3.39Å; R83-K87 PolarHBondContact NH1-O 3.42Å; R83-E92 IonicContact CZ-OE1 2.79Å; R83-E92 IonicContact CZ-OE2 2.75Å; R83-E92 IonicContact NH1-OE1 2.75Å; R83-E92 IonicContact NH1-OE2 2.78Å; R83-E92 PolarHBondContact NH1-OE2 2.82Å; R83-E92 IonicContact NH2-OE1 3.9Å; R83-E92 PolarHBondContact NH2-OE1 3.36Å; R83-E92 IonicContact NH2-OE2 2.77Å; R83-E92 PolarHBondContact NH2-OE2 3.49Å
84	I	95.9	Very high	95.9	Very high	7 Å²	7	65.7 Å²	65.7	4%	0.036	34%	0.341	C	S	.	.	H	α-helix	trans	-72.3	-42.5	168.5	-70.7	165	0	0	0	109.9	V52 L55 Q59 L62 A80 L81 Y82	V52-I84 HydrophobicContact CB-CG2 4.31Å; V52-I84 PolarHBondContact N-O 3.42Å; L55-I84 HydrophobicContact CD2-CG2 3.66Å; Q59-I84 HydrophobicContact CB-CD1 4.03Å; Q59-I84 HydrophobicContact CG-CD1 3.86Å; Q59-I84 HydrophobicContact CG-CG1 4.28Å; L62-I84 HydrophobicContact CD2-CD1 4.28Å; A80-I84 VanDerWaalsContact O-CG1 3.25Å; A80-I84 WeakPolarHBondContact O-CG1 3.15Å; A80-I84 PolarHBondContact O-N 2.91Å; L81-I84 HydrophobicContact CD2-CD1 4.49Å; L81-I84 PolarHBondContact O-N 2.93Å; Y82-I84 VanDerWaalsContact C-N 3.28Å; Y82-I84 PolarHBondContact O-N 2.93Å
85	S	94.7	Very high	95.8	Very high	34 Å²	34	70.6 Å²	70.6	24%	0.238	36%	0.358	C	S	.	.	H	α-helix	trans	-80.8	-41.2	-175.3	-52.9	0	0	0	0	112	Y51 L81 Y82	Y51-S85 PolarHBondContact N-O 3.21Å; L81-S85 PolarHBondContact O-N 2.71Å; L81-S85 PolarHBondContact O-OG 3.16Å; Y82-S85 PolarHBondContact O-N 2.75Å; Y82-S85 VanDerWaalsContact O-N 3.1Å
86	F	96.6	Very high	95.5	Very high	45 Å²	45	67.9 Å²	67.9	20%	0.197	36%	0.36	C	S	.	.			trans	-127.6	143.1	-174.3	-55.8	-78.2	0	0	0	112.2	Y38 P45 L46 P47 Y82 R83	Y38-F86 WeakPolarHBondContact OH-CA 3.25Å; P45-F86 VanDerWaalsContact O-CE1 3.32Å; P45-F86 WeakPolarHBondContact O-CE1 3.4Å; L46-F86 HydrophobicContact CD2-CZ 4.02Å; P47-F86 HydrophobicContact CG-CE1 4.45Å; Y82-F86 AromaticContact CD2-CD2 3.73Å; Y82-F86 HydrophobicContact CD2-CD2 3.73Å; Y82-F86 HydrophobicContact CD2-CE2 4.35Å; Y82-F86 HydrophobicContact CE1-CB 4.15Å; Y82-F86 HydrophobicContact CE2-CB 4.32Å; Y82-F86 AromaticContact CE2-CD2 3.46Å; Y82-F86 HydrophobicContact CE2-CD2 3.46Å; Y82-F86 VanDerWaalsContact CE2-CD2 3.46Å; Y82-F86 HydrophobicContact CE2-CE2 4.09Å; Y82-F86 HydrophobicContact CE2-CG 4.14Å; Y82-F86 HydrophobicContact CG-CD2 4.44Å; Y82-F86 AromaticContact CZ-CD2 3.99Å; Y82-F86 PolarHBondContact O-N 3.22Å; R83-F86 CarbonylContact C-O 3.38Å; R83-F86 VanDerWaalsContact CA-O 3.28Å; R83-F86 WeakPolarHBondContact CA-O 3.39Å
87	K	95.1	Very high	95.3	Very high	60 Å²	60	63.9 Å²	63.9	26%	0.261	35%	0.349	S	S	.	.	S	Bend	trans	-77.6	-64.6	174.8	179.3	-179.9	163.1	-84.9	0	110.7	Y38 D40 Y51 R83	Y38-K87 HydrophobicContact CE1-CB 3.84Å; Y38-K87 PolarHBondContact OH-N 3.32Å; D40-K87 WeakPolarHBondContact OD2-CB 3.34Å; Y51-K87 HydrophobicContact CD1-CB 3.95Å; Y51-K87 HydrophobicContact CD2-CB 3.58Å; Y51-K87 HydrophobicContact CD2-CD 4.3Å; Y51-K87 HydrophobicContact CD2-CG 4.21Å; Y51-K87 HydrophobicContact CE1-CB 4.05Å; Y51-K87 HydrophobicContact CE1-CG 4.12Å; Y51-K87 HydrophobicContact CE2-CB 3.69Å; Y51-K87 HydrophobicContact CE2-CD 3.65Å; Y51-K87 HydrophobicContact CE2-CG 3.77Å; Y51-K87 HydrophobicContact CG-CB 3.71Å; R83-K87 PolarHBondContact NH1-O 3.42Å
88	D	95.2	Very high	95.3	Very high	48 Å²	48	68.1 Å²	68.1	26%	0.257	37%	0.369	S	S	.	.	S	Bend	trans	-108.3	145.2	-175.8	-62.8	-27.8	0	0	0	110.8	E92	D88-E92 WeakPolarHBondContact CA-OE2 3.11Å; D88-E92 HydrophobicContact CB-CB 4.15Å
89	S	95.9	Very high	95.3	Very high	27 Å²	27	70.9 Å²	70.9	19%	0.189	38%	0.383	C	S	.	.			trans	-75.8	163.4	169.5	68.6	0	0	0	0	112	Y82 A91 E92 M93	Y82-S89 WeakPolarHBondContact OH-CA 2.96Å; S89-A91 PolarHBondContact O-N 2.92Å; S89-A91 VanDerWaalsContact O-N 3.14Å; S89-E92 PolarHBondContact N-OE2 3.27Å; S89-E92 PolarHBondContact O-N 2.75Å; S89-E92 VanDerWaalsContact O-N 3.09Å; S89-E92 WeakPolarHBondContact OG-CG 3.48Å; S89-E92 PolarHBondContact OG-N 3.31Å; S89-E92 PolarHBondContact OG-OE2 3.34Å; S89-M93 WeakPolarHBondContact O-CB 3.49Å; S89-M93 PolarHBondContact O-N 3.04Å
90	F	95.5	Very high	95.3	Very high	94 Å²	94	73.3 Å²	73.3	41%	0.412	39%	0.385	S	S	.	.	H	α-helix	trans	-56.9	-29.6	172.9	-91.4	-98.6	0	0	0	112.9	R42 P45 M93 N94	R42-F90 HydrophobicContact CB-CE1 4.23Å; R42-F90 HydrophobicContact CG-CE1 4.24Å; P45-F90 HydrophobicContact CB-CE2 4.19Å; P45-F90 HydrophobicContact CB-CZ 3.88Å; F90-M93 HydrophobicContact CD1-CE 4.08Å; F90-M93 HydrophobicContact CE1-CE 4.1Å; F90-M93 HydrophobicContact CG-CE 4.35Å; F90-M93 HydrophobicContact CZ-CE 4.37Å; F90-N94 VanDerWaalsContact O-CB 3.25Å; F90-N94 WeakPolarHBondContact O-CB 3.39Å; F90-N94 VanDerWaalsContact O-CG 3.29Å; F90-N94 PolarHBondContact O-N 2.63Å; F90-N94 PolarHBondContact O-ND2 2.97Å
91	A	95.1	Very high	95.3	Very high	79 Å²	79	75.9 Å²	75.9	65%	0.653	39%	0.389	S	S	*	.	H	α-helix	trans	-72.7	-44.1	176	0	0	0	0	0	111.7	S89 N94 Q95	S89-A91 PolarHBondContact O-N 2.92Å; S89-A91 VanDerWaalsContact O-N 3.14Å; A91-N94 PolarHBondContact O-N 2.81Å; A91-Q95 PolarHBondContact O-N 2.99Å
92	E	95.3	Very high	95.3	Very high	75 Å²	75	79.9 Å²	79.9	35%	0.35	42%	0.417	S	S	.	.	H	α-helix	trans	-67.4	-45.3	180	-70.4	162.9	167.5	0	0	111.5	R83 D88 S89 N94 Q95	R83-E92 IonicContact CZ-OE1 2.79Å; R83-E92 IonicContact CZ-OE2 2.75Å; R83-E92 IonicContact NH1-OE1 2.75Å; R83-E92 IonicContact NH1-OE2 2.78Å; R83-E92 PolarHBondContact NH1-OE2 2.82Å; R83-E92 IonicContact NH2-OE1 3.9Å; R83-E92 PolarHBondContact NH2-OE1 3.36Å; R83-E92 IonicContact NH2-OE2 2.77Å; R83-E92 PolarHBondContact NH2-OE2 3.49Å; D88-E92 WeakPolarHBondContact CA-OE2 3.11Å; D88-E92 HydrophobicContact CB-CB 4.15Å; S89-E92 PolarHBondContact N-OE2 3.27Å; S89-E92 PolarHBondContact O-N 2.75Å; S89-E92 VanDerWaalsContact O-N 3.09Å; S89-E92 WeakPolarHBondContact OG-CG 3.48Å; S89-E92 PolarHBondContact OG-N 3.31Å; S89-E92 PolarHBondContact OG-OE2 3.34Å; E92-N94 VanDerWaalsContact C-N 3.26Å; E92-N94 PolarHBondContact O-N 2.86Å; E92-Q95 VanDerWaalsContact O-CB 3.26Å; E92-Q95 WeakPolarHBondContact O-CB 3.48Å; E92-Q95 PolarHBondContact O-N 3.15Å; E92-Q95 VanDerWaalsContact O-N 3.16Å
93	M	93	Very high	95.4	Very high	51 Å²	51	81.1 Å²	81.1	25%	0.251	43%	0.433	S	S	.	.	H	α-helix	trans	-63.3	-31.9	177.1	174.3	177.7	50.6	0	0	112.6	D40 R41 R42 S89 F90 Q95	D40-M93 HydrophobicContact CB-SD 3.87Å; R41-M93 PolarHBondContact N-SD 2.94Å; R41-M93 VanDerWaalsContact N-SD 3.45Å; R42-M93 HydrophobicContact CB-CE 4.46Å; R42-M93 HydrophobicContact CG-CE 3.61Å; R42-M93 HydrophobicContact CG-SD 4.26Å; S89-M93 WeakPolarHBondContact O-CB 3.49Å; S89-M93 PolarHBondContact O-N 3.04Å; F90-M93 HydrophobicContact CD1-CE 4.08Å; F90-M93 HydrophobicContact CE1-CE 4.1Å; F90-M93 HydrophobicContact CG-CE 4.35Å; F90-M93 HydrophobicContact CZ-CE 4.37Å; M93-Q95 VanDerWaalsContact C-N 3.33Å
94	N	93.4	Very high	95.5	Very high	70 Å²	70	79.9 Å²	79.9	37%	0.374	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	3.8	179.3	-74	-50.4	0	0	0	113.6	R42 F90 A91 E92 G96	R42-N94 WeakPolarHBondContact CD-OD1 3.26Å; R42-N94 PolarHBondContact NE-OD1 2.92Å; R42-N94 PolarHBondContact NH1-OD1 3.43Å; F90-N94 VanDerWaalsContact O-CB 3.25Å; F90-N94 WeakPolarHBondContact O-CB 3.39Å; F90-N94 VanDerWaalsContact O-CG 3.29Å; F90-N94 PolarHBondContact O-N 2.63Å; F90-N94 PolarHBondContact O-ND2 2.97Å; A91-N94 PolarHBondContact O-N 2.81Å; E92-N94 VanDerWaalsContact C-N 3.26Å; E92-N94 PolarHBondContact O-N 2.86Å; N94-G96 PolarHBondContact O-N 3.39Å
95	Q	94.3	Very high	95.6	Very high	155 Å²	155	81.4 Å²	81.4	72%	0.724	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-65.5	121.1	177.7	-172	174.9	-2.6	0	0	109.6	A91 E92 M93	A91-Q95 PolarHBondContact O-N 2.99Å; E92-Q95 VanDerWaalsContact O-CB 3.26Å; E92-Q95 WeakPolarHBondContact O-CB 3.48Å; E92-Q95 PolarHBondContact O-N 3.15Å; E92-Q95 VanDerWaalsContact O-N 3.16Å; M93-Q95 VanDerWaalsContact C-N 3.33Å
96	G	91.5	Very high	95.8	Very high	69 Å²	69	81.2 Å²	81.2	71%	0.711	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-66.3	145.3	178	0	0	0	0	0	112.1	N94	N94-G96 PolarHBondContact O-N 3.39Å
97	S	94	Very high	95.8	Very high	74 Å²	74	84.3 Å²	84.3	52%	0.517	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-93.6	151.2	173.9	79.2	0	0	0	0	111.7	E99	S97-E99 PolarHBondContact O-N 3.03Å; S97-E99 PolarHBondContact OG-OE2 3.14Å
98	E	96.1	Very high	96	Very high	131 Å²	131	87.7 Å²	87.7	61%	0.612	49%	0.493	S	S	*	.	S	Bend	trans	-88.3	11.4	173.3	-56.9	-155.8	141.7	0	0	113	W100 K101	E98-W100 PolarHBondContact O-N 2.77Å; E98-W100 VanDerWaalsContact O-N 3.14Å; E98-K101 HydrophobicContact CB-CD 4.29Å; E98-K101 WeakPolarHBondContact O-CB 3.48Å; E98-K101 PolarHBondContact O-N 2.79Å; E98-K101 IonicContact OE1-NZ 3.48Å; E98-K101 PolarHBondContact OE1-NZ 2.87Å; E98-K101 IonicContact OE2-NZ 3.58Å; E98-K101 PolarHBondContact OE2-NZ 2.98Å
99	E	96	Very high	96.2	Very high	137 Å²	137	91.8 Å²	91.8	64%	0.64	51%	0.508	S	S	*	.	H	α-helix	trans	-60.2	-28.7	-173.9	-68.2	177.9	158.6	0	0	112.9	S97 K101 S102 V103	S97-E99 PolarHBondContact O-N 3.03Å; S97-E99 PolarHBondContact OG-OE2 3.14Å; E99-K101 PolarHBondContact O-N 2.9Å; E99-K101 VanDerWaalsContact O-N 3.15Å; E99-S102 WeakPolarHBondContact O-CB 3.4Å; E99-S102 PolarHBondContact O-N 3.29Å; E99-V103 WeakPolarHBondContact O-CG2 3.3Å; E99-V103 PolarHBondContact O-N 3.47Å
100	W	96.9	Very high	96.3	Very high	161 Å²	161	96.8 Å²	96.8	61%	0.61	53%	0.527	S	S	*	.	H	α-helix	trans	-55.7	-32.8	176.1	77.2	-93.5	0	0	0	112.4	E98 V103 V104	E98-W100 PolarHBondContact O-N 2.77Å; E98-W100 VanDerWaalsContact O-N 3.14Å; W100-V103 PolarHBondContact O-N 2.87Å; W100-V104 HydrophobicContact CE3-CG2 4.06Å; W100-V104 HydrophobicContact CZ3-CG2 4.48Å; W100-V104 WeakPolarHBondContact O-CB 3.44Å; W100-V104 VanDerWaalsContact O-CG2 3.3Å; W100-V104 WeakPolarHBondContact O-CG2 3.39Å; W100-V104 PolarHBondContact O-N 3.48Å
101	K	96.6	Very high	96.4	Very high	94 Å²	94	97.6 Å²	97.6	41%	0.409	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-43.3	177	-60.5	180	-170.5	167.5	0	110.7	E98 E99 G105	E98-K101 HydrophobicContact CB-CD 4.29Å; E98-K101 WeakPolarHBondContact O-CB 3.48Å; E98-K101 PolarHBondContact O-N 2.79Å; E98-K101 IonicContact OE1-NZ 3.48Å; E98-K101 PolarHBondContact OE1-NZ 2.87Å; E98-K101 IonicContact OE2-NZ 3.58Å; E98-K101 PolarHBondContact OE2-NZ 2.98Å; E99-K101 PolarHBondContact O-N 2.9Å; E99-K101 VanDerWaalsContact O-N 3.15Å; K101-G105 PolarHBondContact O-N 3.46Å
102	S	97.6	Very high	96.5	Very high	94 Å²	94	96 Å²	96	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-66.5	-41.3	176.7	-60.1	0	0	0	0	111.7	E99 G105 G106	E99-S102 WeakPolarHBondContact O-CB 3.4Å; E99-S102 PolarHBondContact O-N 3.29Å; S102-G105 PolarHBondContact O-N 3.38Å; S102-G106 PolarHBondContact O-N 3.27Å
103	V	98	Very high	96.7	Very high	103 Å²	103	97.7 Å²	97.7	62%	0.624	53%	0.532	S	S	*	.	H	α-helix	trans	-61.8	-51.1	177	174.4	0	0	0	0	110.8	E99 W100 G106 L107	E99-V103 WeakPolarHBondContact O-CG2 3.3Å; E99-V103 PolarHBondContact O-N 3.47Å; W100-V103 PolarHBondContact O-N 2.87Å; V103-G106 PolarHBondContact O-N 3.21Å; V103-L107 WeakPolarHBondContact O-CB 3.32Å; V103-L107 PolarHBondContact O-N 2.89Å
104	V	98.4	Very high	96.9	Very high	69 Å²	69	98.8 Å²	98.8	42%	0.418	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-44	178.9	172	0	0	0	0	110.9	W100 G106 L107 M108	W100-V104 HydrophobicContact CE3-CG2 4.06Å; W100-V104 HydrophobicContact CZ3-CG2 4.48Å; W100-V104 WeakPolarHBondContact O-CB 3.44Å; W100-V104 VanDerWaalsContact O-CG2 3.3Å; W100-V104 WeakPolarHBondContact O-CG2 3.39Å; W100-V104 PolarHBondContact O-N 3.48Å; V104-G106 PolarHBondContact O-N 2.99Å; V104-L107 PolarHBondContact O-N 3.24Å; V104-M108 WeakPolarHBondContact O-CG 3.48Å; V104-M108 PolarHBondContact O-N 2.86Å
105	G	98.3	Very high	97.1	Very high	40 Å²	40	97 Å²	97	41%	0.412	54%	0.54	S	S	.	.	H	α-helix	trans	-59.8	-45.4	177	0	0	0	0	0	112.6	K101 S102 M108 F109	K101-G105 PolarHBondContact O-N 3.46Å; S102-G105 PolarHBondContact O-N 3.38Å; G105-M108 PolarHBondContact O-N 2.94Å; G105-F109 WeakPolarHBondContact O-CB 3.25Å; G105-F109 PolarHBondContact O-N 2.92Å
106	G	98.2	Very high	97.3	Very high	29 Å²	29	94.9 Å²	94.9	30%	0.299	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-45	175.6	0	0	0	0	0	112.3	S102 V103 V104 F109 F110	S102-G106 PolarHBondContact O-N 3.27Å; V103-G106 PolarHBondContact O-N 3.21Å; V104-G106 PolarHBondContact O-N 2.99Å; G106-F109 WeakPolarHBondContact O-CB 3.36Å; G106-F109 PolarHBondContact O-N 3.45Å; G106-F110 WeakPolarHBondContact O-CD2 3.34Å; G106-F110 PolarHBondContact O-N 3.3Å
107	L	98.5	Very high	97.6	Very high	110 Å²	110	94.2 Å²	94.2	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-60.4	-48.1	178	-174.2	127.1	0	0	0	111.9	V103 V104 F109 F110 L111	V103-L107 WeakPolarHBondContact O-CB 3.32Å; V103-L107 PolarHBondContact O-N 2.89Å; V104-L107 PolarHBondContact O-N 3.24Å; L107-F109 VanDerWaalsContact C-N 3.32Å; L107-F109 PolarHBondContact O-N 2.79Å; L107-F110 PolarHBondContact O-N 2.74Å; L107-L111 HydrophobicContact CD2-CD1 3.66Å; L107-L111 HydrophobicContact CG-CD1 4.29Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 2.98Å
108	M	98.4	Very high	97.8	Very high	131 Å²	131	95.1 Å²	95.1	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-65.3	-35.8	178.4	-65.7	-161.5	91.7	0	0	112.5	V104 G105 L111 G112	V104-M108 WeakPolarHBondContact O-CG 3.48Å; V104-M108 PolarHBondContact O-N 2.86Å; G105-M108 PolarHBondContact O-N 2.94Å; M108-L111 PolarHBondContact O-N 3.48Å; M108-G112 PolarHBondContact O-N 3.36Å
109	F	98.3	Very high	97.8	Very high	134 Å²	134	94.5 Å²	94.5	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-60.6	-49.5	175	174.1	-96.9	0	0	0	111.6	G105 G106 L107 G112 F113	G105-F109 WeakPolarHBondContact O-CB 3.25Å; G105-F109 PolarHBondContact O-N 2.92Å; G106-F109 WeakPolarHBondContact O-CB 3.36Å; G106-F109 PolarHBondContact O-N 3.45Å; L107-F109 VanDerWaalsContact C-N 3.32Å; L107-F109 PolarHBondContact O-N 2.79Å; F109-G112 PolarHBondContact O-N 3.05Å; F109-F113 WeakPolarHBondContact O-CB 3.44Å; F109-F113 PolarHBondContact O-N 3.29Å
110	F	98.3	Very high	97.9	Very high	133 Å²	133	94.8 Å²	94.8	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-69.8	-33.1	-180	-73.8	-65.5	0	0	0	113	G106 L107 F113 T114	G106-F110 WeakPolarHBondContact O-CD2 3.34Å; G106-F110 PolarHBondContact O-N 3.3Å; L107-F110 PolarHBondContact O-N 2.74Å; F110-F113 PolarHBondContact O-N 3.49Å; F110-T114 WeakPolarHBondContact O-CB 3.44Å; F110-T114 PolarHBondContact O-N 3.09Å; F110-T114 PolarHBondContact O-OG1 3.32Å
111	L	98.3	Very high	98	Very high	111 Å²	111	90.2 Å²	90.2	58%	0.581	49%	0.494	S	S	*	.	H	α-helix	trans	-62.1	-46.7	170.3	-74.1	173.9	0	0	0	111.5	L107 M108 F113 T114 G115	L107-L111 HydrophobicContact CD2-CD1 3.66Å; L107-L111 HydrophobicContact CG-CD1 4.29Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 2.98Å; M108-L111 PolarHBondContact O-N 3.48Å; L111-F113 PolarHBondContact O-N 2.89Å; L111-T114 WeakPolarHBondContact O-CB 3.42Å; L111-T114 PolarHBondContact O-N 3.45Å; L111-G115 PolarHBondContact O-N 3.43Å; L111-G115 VanDerWaalsContact O-N 3.09Å
112	G	97.9	Very high	97.9	Very high	45 Å²	45	92.6 Å²	92.6	46%	0.464	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-44.2	175.6	0	0	0	0	0	112.3	M108 F109 T114 G115 L116	M108-G112 PolarHBondContact O-N 3.36Å; F109-G112 PolarHBondContact O-N 3.05Å; G112-T114 VanDerWaalsContact C-N 3.34Å; G112-T114 PolarHBondContact O-N 3.27Å; G112-G115 PolarHBondContact O-N 3.11Å; G112-G115 VanDerWaalsContact O-N 3.15Å; G112-L116 PolarHBondContact O-N 2.86Å
113	F	98.1	Very high	97.8	Very high	110 Å²	110	95.6 Å²	95.6	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-41.2	176.3	-177.1	-102.9	0	0	0	112.2	F109 F110 L111 G115 L116 V117	F109-F113 WeakPolarHBondContact O-CB 3.44Å; F109-F113 PolarHBondContact O-N 3.29Å; F110-F113 PolarHBondContact O-N 3.49Å; L111-F113 PolarHBondContact O-N 2.89Å; F113-G115 VanDerWaalsContact C-N 3.27Å; F113-G115 PolarHBondContact O-N 2.97Å; F113-L116 WeakPolarHBondContact O-CB 3.32Å; F113-L116 PolarHBondContact O-N 3.29Å; F113-V117 HydrophobicContact CD1-CG2 4.36Å; F113-V117 HydrophobicContact CE1-CG2 3.99Å; F113-V117 HydrophobicContact CZ-CG2 4.33Å; F113-V117 PolarHBondContact O-N 3.32Å; F113-V117 VanDerWaalsContact O-N 3.14Å
114	T	98.4	Very high	97.8	Very high	74 Å²	74	98.7 Å²	98.7	45%	0.454	50%	0.504	S	S	.	.	H	α-helix	trans	-59.8	-39.5	174.8	-56.9	0	0	0	0	111.3	F110 L111 G112 L116 V117 I118	F110-T114 WeakPolarHBondContact O-CB 3.44Å; F110-T114 PolarHBondContact O-N 3.09Å; F110-T114 PolarHBondContact O-OG1 3.32Å; L111-T114 WeakPolarHBondContact O-CB 3.42Å; L111-T114 PolarHBondContact O-N 3.45Å; G112-T114 VanDerWaalsContact C-N 3.34Å; G112-T114 PolarHBondContact O-N 3.27Å; T114-L116 VanDerWaalsContact C-N 3.31Å; T114-L116 PolarHBondContact O-N 3Å; T114-V117 WeakPolarHBondContact O-CB 3.41Å; T114-V117 PolarHBondContact O-N 3.45Å; T114-V117 VanDerWaalsContact O-N 3.17Å; T114-I118 HydrophobicContact CG2-CD1 4.3Å; T114-I118 WeakPolarHBondContact O-CG1 3.49Å; T114-I118 PolarHBondContact O-N 3.05Å
115	G	97.8	Very high	97.7	Very high	32 Å²	32	99.4 Å²	99.4	33%	0.33	51%	0.508	S	S	.	.	H	α-helix	trans	-57.2	-40.9	172.7	0	0	0	0	0	113.2	L111 G112 F113 I118 L119	L111-G115 PolarHBondContact O-N 3.43Å; L111-G115 VanDerWaalsContact O-N 3.09Å; G112-G115 PolarHBondContact O-N 3.11Å; G112-G115 VanDerWaalsContact O-N 3.15Å; F113-G115 VanDerWaalsContact C-N 3.27Å; F113-G115 PolarHBondContact O-N 2.97Å; G115-I118 PolarHBondContact O-N 2.66Å; G115-L119 WeakPolarHBondContact O-CG 3.41Å; G115-L119 PolarHBondContact O-N 3.19Å
116	L	97.6	Very high	97.6	Very high	111 Å²	111	103.7 Å²	103.7	58%	0.581	51%	0.512	S	S	*	.	H	α-helix	trans	-64.5	-39.6	175.8	-61.4	176.8	0	0	0	112.2	G112 F113 T114 L119 W120	G112-L116 PolarHBondContact O-N 2.86Å; F113-L116 WeakPolarHBondContact O-CB 3.32Å; F113-L116 PolarHBondContact O-N 3.29Å; T114-L116 VanDerWaalsContact C-N 3.31Å; T114-L116 PolarHBondContact O-N 3Å; L116-L119 PolarHBondContact O-N 3.07Å; L116-W120 PolarHBondContact O-N 3.06Å
117	V	97.8	Very high	97.4	Very high	55 Å²	55	104.9 Å²	104.9	33%	0.333	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-43.2	176	176.7	0	0	0	0	110.9	F113 T114 L119 W120 Q121	F113-V117 HydrophobicContact CD1-CG2 4.36Å; F113-V117 HydrophobicContact CE1-CG2 3.99Å; F113-V117 HydrophobicContact CZ-CG2 4.33Å; F113-V117 PolarHBondContact O-N 3.32Å; F113-V117 VanDerWaalsContact O-N 3.14Å; T114-V117 WeakPolarHBondContact O-CB 3.41Å; T114-V117 PolarHBondContact O-N 3.45Å; T114-V117 VanDerWaalsContact O-N 3.17Å; V117-L119 PolarHBondContact O-N 3.13Å; V117-W120 WeakPolarHBondContact O-CB 3.14Å; V117-W120 PolarHBondContact O-N 2.98Å; V117-Q121 WeakPolarHBondContact O-CG 3.49Å; V117-Q121 PolarHBondContact O-N 2.82Å
118	I	97.9	Very high	97.2	Very high	93 Å²	93	105.8 Å²	105.8	48%	0.477	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-41.9	177.3	-66.9	169.2	0	0	0	111.1	T114 G115 W120 Q121 R122	T114-I118 HydrophobicContact CG2-CD1 4.3Å; T114-I118 WeakPolarHBondContact O-CG1 3.49Å; T114-I118 PolarHBondContact O-N 3.05Å; G115-I118 PolarHBondContact O-N 2.66Å; I118-W120 VanDerWaalsContact C-N 3.32Å; I118-W120 PolarHBondContact O-N 3.1Å; I118-Q121 PolarHBondContact O-N 2.77Å; I118-R122 WeakPolarHBondContact O-CB 3.34Å; I118-R122 PolarHBondContact O-N 2.96Å
119	L	97.6	Very high	97	Very high	118 Å²	118	102.9 Å²	102.9	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-42.1	175.6	-71.6	174.6	0	0	0	111.7	G115 L116 V117 R122 K123	G115-L119 WeakPolarHBondContact O-CG 3.41Å; G115-L119 PolarHBondContact O-N 3.19Å; L116-L119 PolarHBondContact O-N 3.07Å; V117-L119 PolarHBondContact O-N 3.13Å; L119-R122 PolarHBondContact O-N 3.37Å; L119-K123 PolarHBondContact O-N 3.17Å; L119-K123 VanDerWaalsContact O-N 3.08Å
120	W	97.9	Very high	96.9	Very high	144 Å²	144	100.2 Å²	100.2	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-47.3	174.9	175	85.6	0	0	0	111.8	L116 V117 I118 R122 K123 Y124 V125	L116-W120 PolarHBondContact O-N 3.06Å; V117-W120 WeakPolarHBondContact O-CB 3.14Å; V117-W120 PolarHBondContact O-N 2.98Å; I118-W120 VanDerWaalsContact C-N 3.32Å; I118-W120 PolarHBondContact O-N 3.1Å; W120-R122 VanDerWaalsContact C-N 3.32Å; W120-R122 PolarHBondContact O-N 3.15Å; W120-K123 PolarHBondContact O-N 2.79Å; W120-K123 VanDerWaalsContact O-N 3.14Å; W120-Y124 AromaticContact CD1-CD2 3.39Å; W120-Y124 AromaticContact CD1-CE2 3.8Å; W120-Y124 HydrophobicContact CG-CD2 4.08Å; W120-Y124 AromaticContact NE1-CD2 3.55Å; W120-Y124 WeakPolarHBondContact O-CD2 3.42Å; W120-Y124 PolarHBondContact O-N 3.39Å; W120-V125 HydrophobicContact CE3-CG2 4.33Å; W120-V125 HydrophobicContact CH2-CG2 3.79Å; W120-V125 HydrophobicContact CZ2-CG2 4.47Å; W120-V125 HydrophobicContact CZ3-CG2 3.71Å
121	Q	97.8	Very high	96.8	Very high	64 Å²	64	99.4 Å²	99.4	30%	0.299	52%	0.521	S	S	.	.	H	α-helix	trans	-57.9	-44.3	175.6	-72.9	177	-28.8	0	0	111.6	V117 I118 K123 V125 Y126	V117-Q121 WeakPolarHBondContact O-CG 3.49Å; V117-Q121 PolarHBondContact O-N 2.82Å; I118-Q121 PolarHBondContact O-N 2.77Å; Q121-K123 VanDerWaalsContact C-N 3.26Å; Q121-K123 PolarHBondContact O-N 3.19Å; Q121-V125 HydrophobicContact CB-CB 4.49Å; Q121-V125 WeakPolarHBondContact O-CA 3.4Å; Q121-V125 WeakPolarHBondContact O-CB 3.18Å; Q121-V125 PolarHBondContact O-N 3.46Å; Q121-Y126 HydrophobicContact CB-CE2 4.4Å; Q121-Y126 PolarHBondContact O-N 3.14Å
122	R	95.9	Very high	96.6	Very high	144 Å²	144	96.2 Å²	96.2	54%	0.543	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-32.1	178.6	-175.2	60.3	172.1	165.4	-0.4	112.8	I118 L119 W120 Y126	I118-R122 WeakPolarHBondContact O-CB 3.34Å; I118-R122 PolarHBondContact O-N 2.96Å; L119-R122 PolarHBondContact O-N 3.37Å; W120-R122 VanDerWaalsContact C-N 3.32Å; W120-R122 PolarHBondContact O-N 3.15Å; R122-Y126 HydrophobicContact CB-CD2 4.36Å
123	K	95.8	Very high	96.5	Very high	158 Å²	158	99.5 Å²	99.5	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-85.1	-37.8	-177.8	-176.3	62.8	-179.6	179.8	0	113.5	L119 W120 Q121	L119-K123 PolarHBondContact O-N 3.17Å; L119-K123 VanDerWaalsContact O-N 3.08Å; W120-K123 PolarHBondContact O-N 2.79Å; W120-K123 VanDerWaalsContact O-N 3.14Å; Q121-K123 VanDerWaalsContact C-N 3.26Å; Q121-K123 PolarHBondContact O-N 3.19Å
124	Y	96.9	Very high	96.4	Very high	168 Å²	168	99.9 Å²	99.9	66%	0.659	51%	0.511	S	S	*	.	H	α-helix	trans	-118.1	-18.4	-167.9	-62.7	-75.1	0	0	0	114.9	W120	W120-Y124 AromaticContact CD1-CD2 3.39Å; W120-Y124 AromaticContact CD1-CE2 3.8Å; W120-Y124 HydrophobicContact CG-CD2 4.08Å; W120-Y124 AromaticContact NE1-CD2 3.55Å; W120-Y124 WeakPolarHBondContact O-CD2 3.42Å; W120-Y124 PolarHBondContact O-N 3.39Å
125	V	97.1	Very high	96.3	Very high	84 Å²	84	101 Å²	101	51%	0.509	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-45.3	-174.5	-177	0	0	0	0	111.6	W120 Q121	W120-V125 HydrophobicContact CE3-CG2 4.33Å; W120-V125 HydrophobicContact CH2-CG2 3.79Å; W120-V125 HydrophobicContact CZ2-CG2 4.47Å; W120-V125 HydrophobicContact CZ3-CG2 3.71Å; Q121-V125 HydrophobicContact CB-CB 4.49Å; Q121-V125 WeakPolarHBondContact O-CA 3.4Å; Q121-V125 WeakPolarHBondContact O-CB 3.18Å; Q121-V125 PolarHBondContact O-N 3.46Å
126	Y	95.6	Very high	96.2	Very high	129 Å²	129	105.3 Å²	105.3	51%	0.506	53%	0.532	S	S	.	.			trans	-75.6	129	-177.6	-65.3	-25.7	0	0	0	112.4	Q121 R122	Q121-Y126 HydrophobicContact CB-CE2 4.4Å; Q121-Y126 PolarHBondContact O-N 3.14Å; R122-Y126 HydrophobicContact CB-CD2 4.36Å
127	G	93.7	Very high	96.2	Very high	54 Å²	54	104.2 Å²	104.2	56%	0.557	52%	0.521	S	S	*	.			trans	-72.7	-179.2	173	0	0	0	0	0	113.5
128	P	94.5	Very high	96.1	Very high	130 Å²	130	106.5 Å²	106.5	84%	0.844	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-61.3	143.6	176.6	27.6	-34.2	0	0	0	110.6
129	V	94.6	Very high	96	Very high	69 Å²	69	107.2 Å²	107.2	42%	0.418	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-67.5	145.1	172.5	-168.4	0	0	0	0	108.1	F133	V129-F133 HydrophobicContact CG1-CB 3.71Å; V129-F133 HydrophobicContact CG1-CD1 4.26Å; V129-F133 HydrophobicContact CG1-CD2 3.4Å; V129-F133 VanDerWaalsContact CG1-CD2 3.4Å; V129-F133 HydrophobicContact CG1-CE2 4.03Å; V129-F133 HydrophobicContact CG1-CG 3.53Å
130	P	95.9	Very high	96	Very high	78 Å²	78	108 Å²	108	51%	0.506	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-54.7	148.6	179	-27.2	34.7	0	0	0	113.1	T132 F133	P130-T132 PolarHBondContact O-N 2.88Å; P130-F133 HydrophobicContact CB-CD2 4.32Å; P130-F133 HydrophobicContact CG-CD2 4.48Å; P130-F133 WeakPolarHBondContact O-CB 3.2Å; P130-F133 PolarHBondContact O-N 3.39Å
131	H	95.2	Very high	95.9	Very high	116 Å²	116	104.4 Å²	104.4	54%	0.537	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-54.4	-24.5	178.7	73.4	-69.2	0	0	0	113.7	F133 E134	H131-F133 PolarHBondContact O-N 3.06Å; H131-F133 VanDerWaalsContact O-N 3.08Å; H131-E134 WeakPolarHBondContact O-CB 3.48Å; H131-E134 WeakPolarHBondContact O-CG 3.37Å; H131-E134 PolarHBondContact O-N 3.24Å
132	T	95.6	Very high	95.9	Very high	44 Å²	44	104 Å²	104	27%	0.27	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-61.6	-17.6	175.3	60.8	0	0	0	0	113.4	P130 Y137	P130-T132 PolarHBondContact O-N 2.88Å; T132-Y137 VanDerWaalsContact CA-CD1 3.47Å; T132-Y137 HydrophobicContact CG2-CD1 4.15Å; T132-Y137 HydrophobicContact CG2-CE1 3.67Å; T132-Y137 HydrophobicContact CG2-CE2 4.42Å; T132-Y137 WeakPolarHBondContact O-CD1 3.49Å
133	F	95.8	Very high	95.9	Very high	115 Å²	115	101.6 Å²	101.6	50%	0.504	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-87.7	-1.8	175	-73.6	-92.2	0	0	0	114.2	V129 P130 H131 K138	V129-F133 HydrophobicContact CG1-CB 3.71Å; V129-F133 HydrophobicContact CG1-CD1 4.26Å; V129-F133 HydrophobicContact CG1-CD2 3.4Å; V129-F133 VanDerWaalsContact CG1-CD2 3.4Å; V129-F133 HydrophobicContact CG1-CE2 4.03Å; V129-F133 HydrophobicContact CG1-CG 3.53Å; P130-F133 HydrophobicContact CB-CD2 4.32Å; P130-F133 HydrophobicContact CG-CD2 4.48Å; P130-F133 WeakPolarHBondContact O-CB 3.2Å; P130-F133 PolarHBondContact O-N 3.39Å; H131-F133 PolarHBondContact O-N 3.06Å; H131-F133 VanDerWaalsContact O-N 3.08Å; F133-K138 WeakPolarHBondContact O-CE 3.47Å; F133-K138 PolarHBondContact O-NZ 2.84Å
134	E	95.2	Very high	95.9	Very high	117 Å²	117	99.9 Å²	99.9	55%	0.547	50%	0.502	S	S	.	.	S	Bend	trans	-62.3	148.9	170.8	-68.6	172.6	-165	0	0	110.9	H131 L136 Y137 K138	H131-E134 WeakPolarHBondContact O-CB 3.48Å; H131-E134 WeakPolarHBondContact O-CG 3.37Å; H131-E134 PolarHBondContact O-N 3.24Å; E134-L136 PolarHBondContact O-N 3.46Å; E134-Y137 PolarHBondContact O-N 3.37Å; E134-K138 WeakPolarHBondContact O-CG 3.35Å; E134-K138 PolarHBondContact O-N 3.36Å
135	T	96	Very high	96	Very high	99 Å²	99	94.1 Å²	94.1	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-60.8	-45.8	-173.6	-48.8	0	0	0	0	112.2	Y137 K138 E139	T135-Y137 PolarHBondContact O-N 2.82Å; T135-K138 PolarHBondContact O-N 3.48Å; T135-E139 WeakPolarHBondContact O-CG 3.47Å; T135-E139 PolarHBondContact O-N 3.14Å
136	L	96.1	Very high	95.9	Very high	121 Å²	121	90.2 Å²	90.2	63%	0.634	46%	0.458	S	S	*	.	H	α-helix	trans	-62.8	-43.2	179	-73.1	174.5	0	0	0	112.1	E134 E139 Q140	E134-L136 PolarHBondContact O-N 3.46Å; L136-E139 PolarHBondContact O-N 2.96Å; L136-Q140 VanDerWaalsContact O-CG 3.3Å; L136-Q140 WeakPolarHBondContact O-CG 3.26Å; L136-Q140 PolarHBondContact O-N 2.99Å
137	Y	96.8	Very high	96	Very high	89 Å²	89	89 Å²	89	35%	0.349	46%	0.46	S	S	.	.	H	α-helix	trans	-64.5	-42.8	178.1	-164.9	-79.3	0	0	0	110.9	T132 E134 T135 E139 Q140 E141	T132-Y137 VanDerWaalsContact CA-CD1 3.47Å; T132-Y137 HydrophobicContact CG2-CD1 4.15Å; T132-Y137 HydrophobicContact CG2-CE1 3.67Å; T132-Y137 HydrophobicContact CG2-CE2 4.42Å; T132-Y137 WeakPolarHBondContact O-CD1 3.49Å; E134-Y137 PolarHBondContact O-N 3.37Å; T135-Y137 PolarHBondContact O-N 2.82Å; Y137-E139 VanDerWaalsContact C-N 3.33Å; Y137-E139 PolarHBondContact O-N 3.21Å; Y137-Q140 PolarHBondContact O-N 3.48Å; Y137-E141 HydrophobicContact CD1-CB 4.39Å; Y137-E141 HydrophobicContact CE1-CB 4.38Å; Y137-E141 VanDerWaalsContact O-CB 3.24Å; Y137-E141 WeakPolarHBondContact O-CB 3.45Å; Y137-E141 PolarHBondContact O-N 3.26Å
138	K	97	Very high	96.1	Very high	103 Å²	103	91.1 Å²	91.1	45%	0.448	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-39.8	174.8	-77.2	174.4	170.3	152.6	0	112.8	F133 E134 T135 L142	F133-K138 WeakPolarHBondContact O-CE 3.47Å; F133-K138 PolarHBondContact O-NZ 2.84Å; E134-K138 WeakPolarHBondContact O-CG 3.35Å; E134-K138 PolarHBondContact O-N 3.36Å; T135-K138 PolarHBondContact O-N 3.48Å; K138-L142 WeakPolarHBondContact O-CB 3.46Å; K138-L142 PolarHBondContact O-N 2.91Å
139	E	96.1	Very high	96.1	Very high	108 Å²	108	92.5 Å²	92.5	51%	0.505	45%	0.445	S	S	.	.	H	α-helix	trans	-68.1	-43.6	177.6	-73.8	170.7	-175.8	0	0	111.7	T135 L136 Y137 L142 Q143	T135-E139 WeakPolarHBondContact O-CG 3.47Å; T135-E139 PolarHBondContact O-N 3.14Å; L136-E139 PolarHBondContact O-N 2.96Å; Y137-E139 VanDerWaalsContact C-N 3.33Å; Y137-E139 PolarHBondContact O-N 3.21Å; E139-L142 WeakPolarHBondContact O-CB 3.45Å; E139-L142 PolarHBondContact O-N 3.32Å; E139-Q143 WeakPolarHBondContact O-CB 3.38Å; E139-Q143 PolarHBondContact O-N 3.33Å
140	Q	96.6	Very high	96.3	Very high	134 Å²	134	91.6 Å²	91.6	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-64.1	-42.5	174.8	-71.2	174.7	-12.1	0	0	111.7	L136 Y137 Q143 R144	L136-Q140 VanDerWaalsContact O-CG 3.3Å; L136-Q140 WeakPolarHBondContact O-CG 3.26Å; L136-Q140 PolarHBondContact O-N 2.99Å; Y137-Q140 PolarHBondContact O-N 3.48Å; Q140-Q143 PolarHBondContact O-N 3.29Å; Q140-R144 WeakPolarHBondContact O-CB 3.27Å; Q140-R144 PolarHBondContact O-N 3.03Å
141	E	96.6	Very high	96.3	Very high	69 Å²	69	93 Å²	93	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-64.6	-44.9	175.8	-177.6	163.8	-147.4	0	0	110.8	Y137 Q143 R144 M145	Y137-E141 HydrophobicContact CD1-CB 4.39Å; Y137-E141 HydrophobicContact CE1-CB 4.38Å; Y137-E141 VanDerWaalsContact O-CB 3.24Å; Y137-E141 WeakPolarHBondContact O-CB 3.45Å; Y137-E141 PolarHBondContact O-N 3.26Å; E141-Q143 VanDerWaalsContact C-N 3.35Å; E141-Q143 PolarHBondContact O-N 2.92Å; E141-R144 WeakPolarHBondContact O-CB 3.42Å; E141-R144 PolarHBondContact O-N 3.26Å; E141-R144 IonicContact OE1-NH2 3.27Å; E141-M145 HydrophobicContact CG-CG 4.31Å; E141-M145 HydrophobicContact CG-SD 4.24Å; E141-M145 WeakPolarHBondContact O-CB 3.2Å; E141-M145 WeakPolarHBondContact O-CG 3.49Å; E141-M145 PolarHBondContact O-N 3.03Å
142	L	96.6	Very high	96.3	Very high	55 Å²	55	91 Å²	91	29%	0.288	44%	0.438	S	S	.	.	H	α-helix	trans	-54.5	-50.3	173.3	167.7	63.7	0	0	0	111.1	K138 E139 R144 M145 L146 F156 W167	K138-L142 WeakPolarHBondContact O-CB 3.46Å; K138-L142 PolarHBondContact O-N 2.91Å; E139-L142 WeakPolarHBondContact O-CB 3.45Å; E139-L142 PolarHBondContact O-N 3.32Å; L142-R144 PolarHBondContact O-N 3.49Å; L142-M145 WeakPolarHBondContact O-CB 3.48Å; L142-M145 PolarHBondContact O-N 2.99Å; L142-L146 HydrophobicContact CD1-CD1 4.08Å; L142-L146 HydrophobicContact CD1-CG 4.22Å; L142-L146 HydrophobicContact CG-CD1 4.31Å; L142-L146 WeakPolarHBondContact O-CG 3.36Å; L142-L146 PolarHBondContact O-N 3.46Å; L142-F156 HydrophobicContact CD1-CE1 3.68Å; L142-F156 HydrophobicContact CD1-CE2 4.49Å; L142-F156 HydrophobicContact CD1-CZ 3.33Å; L142-W167 HydrophobicContact CD1-CH2 4.07Å; L142-W167 HydrophobicContact CD1-CZ2 3.67Å; L142-W167 HydrophobicContact CD2-CZ2 4.45Å
143	Q	95.9	Very high	96.2	Very high	93 Å²	93	95 Å²	95	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-59.1	-47.6	178.1	-176.2	60.7	40.5	0	0	111	E139 Q140 E141 M145 L146 D147	E139-Q143 WeakPolarHBondContact O-CB 3.38Å; E139-Q143 PolarHBondContact O-N 3.33Å; Q140-Q143 PolarHBondContact O-N 3.29Å; E141-Q143 VanDerWaalsContact C-N 3.35Å; E141-Q143 PolarHBondContact O-N 2.92Å; Q143-M145 VanDerWaalsContact C-N 3.32Å; Q143-M145 PolarHBondContact O-N 2.92Å; Q143-L146 WeakPolarHBondContact O-CB 3.33Å; Q143-L146 PolarHBondContact O-N 3.22Å; Q143-L146 VanDerWaalsContact O-N 3.14Å; Q143-D147 PolarHBondContact NE2-OD1 2.81Å; Q143-D147 PolarHBondContact NE2-OD2 3.39Å; Q143-D147 WeakPolarHBondContact O-CB 3.49Å; Q143-D147 PolarHBondContact O-N 3.4Å
144	R	97.2	Very high	96.1	Very high	123 Å²	123	97.9 Å²	97.9	46%	0.464	48%	0.477	S	S	.	.	H	α-helix	trans	-58.3	-42.7	176.2	-172.8	-170.4	71.7	100.3	-2.6	112.1	Q140 E141 L142 L146 D147 M148	Q140-R144 WeakPolarHBondContact O-CB 3.27Å; Q140-R144 PolarHBondContact O-N 3.03Å; E141-R144 WeakPolarHBondContact O-CB 3.42Å; E141-R144 PolarHBondContact O-N 3.26Å; E141-R144 IonicContact OE1-NH2 3.27Å; L142-R144 PolarHBondContact O-N 3.49Å; R144-L146 VanDerWaalsContact C-N 3.31Å; R144-L146 PolarHBondContact O-N 3.47Å; R144-D147 PolarHBondContact O-N 3.34Å; R144-M148 HydrophobicContact CG-CE 4.07Å; R144-M148 HydrophobicContact CG-SD 4.16Å; R144-M148 WeakPolarHBondContact O-CB 3.35Å; R144-M148 VanDerWaalsContact O-CG 3.27Å; R144-M148 WeakPolarHBondContact O-CG 3.13Å; R144-M148 PolarHBondContact O-N 3.43Å
145	M	97	Very high	96.1	Very high	47 Å²	47	93.5 Å²	93.5	23%	0.232	46%	0.463	C	S	.	.	H	α-helix	trans	-62.9	-38.8	177.8	-69.9	-179.9	67.3	0	0	111.7	E141 L142 Q143 R149 I150 F156	E141-M145 HydrophobicContact CG-CG 4.31Å; E141-M145 HydrophobicContact CG-SD 4.24Å; E141-M145 WeakPolarHBondContact O-CB 3.2Å; E141-M145 WeakPolarHBondContact O-CG 3.49Å; E141-M145 PolarHBondContact O-N 3.03Å; L142-M145 WeakPolarHBondContact O-CB 3.48Å; L142-M145 PolarHBondContact O-N 2.99Å; Q143-M145 VanDerWaalsContact C-N 3.32Å; Q143-M145 PolarHBondContact O-N 2.92Å; M145-R149 PolarHBondContact O-N 3.41Å; M145-I150 HydrophobicContact CB-CD1 3.79Å; M145-I150 HydrophobicContact CB-CG1 4.39Å; M145-I150 HydrophobicContact CE-CD1 3.92Å; M145-I150 HydrophobicContact CE-CG2 4.31Å; M145-I150 HydrophobicContact CG-CD1 3.61Å; M145-I150 PolarHBondContact O-N 2.94Å; M145-F156 HydrophobicContact CB-CD1 4.44Å; M145-F156 HydrophobicContact CB-CE1 3.98Å; M145-F156 HydrophobicContact CE-CD1 4.17Å; M145-F156 HydrophobicContact CE-CE1 4.08Å; M145-F156 HydrophobicContact CE-CG 4.43Å; M145-F156 HydrophobicContact CE-CZ 4.26Å; M145-F156 HydrophobicContact SD-CE1 4.48Å
146	L	96.7	Very high	96.1	Very high	2 Å²	2	91.9 Å²	91.9	1%	0.01	45%	0.448	C	S	.	.	H	α-helix	trans	-69.6	-42.8	175.2	-67.3	175.3	0	0	0	111.8	L142 Q143 R144 M148 R149 F156 W160 Y162 W167	L142-L146 HydrophobicContact CD1-CD1 4.08Å; L142-L146 HydrophobicContact CD1-CG 4.22Å; L142-L146 HydrophobicContact CG-CD1 4.31Å; L142-L146 WeakPolarHBondContact O-CG 3.36Å; L142-L146 PolarHBondContact O-N 3.46Å; Q143-L146 WeakPolarHBondContact O-CB 3.33Å; Q143-L146 PolarHBondContact O-N 3.22Å; Q143-L146 VanDerWaalsContact O-N 3.14Å; R144-L146 VanDerWaalsContact C-N 3.31Å; R144-L146 PolarHBondContact O-N 3.47Å; L146-M148 VanDerWaalsContact C-N 3.33Å; L146-M148 PolarHBondContact O-N 2.79Å; L146-R149 WeakPolarHBondContact O-CA 3.25Å; L146-R149 PolarHBondContact O-N 2.84Å; L146-F156 HydrophobicContact CD2-CD1 4.13Å; L146-F156 HydrophobicContact CD2-CE1 3.91Å; L146-F156 HydrophobicContact CG-CE1 4.28Å; L146-W160 HydrophobicContact CD1-CD2 3.65Å; L146-W160 HydrophobicContact CD1-CE3 4.02Å; L146-W160 HydrophobicContact CD1-CG 3.91Å; L146-W160 HydrophobicContact CD1-CZ2 4.21Å; L146-W160 HydrophobicContact CD1-CZ3 4.45Å; L146-W160 HydrophobicContact CD2-CB 3.52Å; L146-W160 HydrophobicContact CD2-CD2 4.23Å; L146-W160 HydrophobicContact CD2-CG 3.65Å; L146-W160 HydrophobicContact CG-CG 4.34Å; L146-Y162 HydrophobicContact CB-CE1 4.48Å; L146-Y162 WeakPolarHBondContact O-CE1 3.41Å; L146-Y162 PolarHBondContact O-OH 3.3Å; L146-W167 HydrophobicContact CD2-CH2 4.33Å
147	D	96.4	Very high	96.1	Very high	104 Å²	104	86.2 Å²	86.2	56%	0.556	42%	0.418	S	S	*	.	H	α-helix	trans	-63.5	-40.3	179.2	-67.5	-22.2	0	0	0	111.6	Q143 R144 R149	Q143-D147 PolarHBondContact NE2-OD1 2.81Å; Q143-D147 PolarHBondContact NE2-OD2 3.39Å; Q143-D147 WeakPolarHBondContact O-CB 3.49Å; Q143-D147 PolarHBondContact O-N 3.4Å; R144-D147 PolarHBondContact O-N 3.34Å; D147-R149 PolarHBondContact O-N 2.9Å
148	M	96.9	Very high	96.1	Very high	98 Å²	98	82.8 Å²	82.8	48%	0.483	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-1.9	174	-65	-175.2	-45.7	0	0	113.8	R144 L146 I150	R144-M148 HydrophobicContact CG-CE 4.07Å; R144-M148 HydrophobicContact CG-SD 4.16Å; R144-M148 WeakPolarHBondContact O-CB 3.35Å; R144-M148 VanDerWaalsContact O-CG 3.27Å; R144-M148 WeakPolarHBondContact O-CG 3.13Å; R144-M148 PolarHBondContact O-N 3.43Å; L146-M148 VanDerWaalsContact C-N 3.33Å; L146-M148 PolarHBondContact O-N 2.79Å; M148-I150 HydrophobicContact CB-CG1 4.42Å; M148-I150 HydrophobicContact CE-CD1 3.79Å; M148-I150 HydrophobicContact CE-CG1 4.17Å; M148-I150 PolarHBondContact O-N 2.83Å
149	R	94.9	Very high	96.1	Very high	158 Å²	158	84 Å²	84	60%	0.596	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	51.3	-178.8	-58.9	-168.4	177.2	-156.2	-1	113.4	M145 L146 D147 N151 P152 S157	M145-R149 PolarHBondContact O-N 3.41Å; L146-R149 WeakPolarHBondContact O-CA 3.25Å; L146-R149 PolarHBondContact O-N 2.84Å; D147-R149 PolarHBondContact O-N 2.9Å; R149-N151 PolarHBondContact O-N 2.88Å; R149-P152 HydrophobicContact CB-CB 4.24Å; R149-P152 VanDerWaalsContact O-CD 3.25Å; R149-P152 WeakPolarHBondContact O-CD 3.4Å; R149-S157 WeakPolarHBondContact CA-OG 3.4Å
150	I	97	Very high	96.1	Very high	50 Å²	50	80.7 Å²	80.7	26%	0.256	40%	0.397	S	S	.	.	S	Bend	trans	-62.3	126.3	178.1	-68.6	-176.3	0	0	0	111.3	M145 M148 S157	M145-I150 HydrophobicContact CB-CD1 3.79Å; M145-I150 HydrophobicContact CB-CG1 4.39Å; M145-I150 HydrophobicContact CE-CD1 3.92Å; M145-I150 HydrophobicContact CE-CG2 4.31Å; M145-I150 HydrophobicContact CG-CD1 3.61Å; M145-I150 PolarHBondContact O-N 2.94Å; M148-I150 HydrophobicContact CB-CG1 4.42Å; M148-I150 HydrophobicContact CE-CD1 3.79Å; M148-I150 HydrophobicContact CE-CG1 4.17Å; M148-I150 PolarHBondContact O-N 2.83Å; I150-S157 PolarHBondContact N-OG 2.89Å; I150-S157 VanDerWaalsContact N-OG 3.13Å; I150-S157 WeakPolarHBondContact O-CB 3.5Å; I150-S157 PolarHBondContact O-N 2.96Å; I150-S157 PolarHBondContact O-OG 3.39Å; I150-S157 VanDerWaalsContact O-OG 3.11Å
151	N	95.8	Very high	96.1	Very high	108 Å²	108	75.8 Å²	75.8	58%	0.578	38%	0.375	S	S	*	.	S	Bend	trans	49.1	64.1	179.8	-62.6	-35	0	0	0	112.7	R149 V153 G155 F156	R149-N151 PolarHBondContact O-N 2.88Å; N151-V153 PolarHBondContact O-N 3.39Å; N151-G155 CarbonylContact O-C 3.48Å; N151-G155 WeakPolarHBondContact O-CA 3.49Å; N151-G155 PolarHBondContact O-N 3.32Å; N151-F156 PolarHBondContact O-N 3.14Å
152	P	95.6	Very high	96	Very high	75 Å²	75	76.5 Å²	76.5	49%	0.487	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.1	-165.9	32.7	-33.4	0	0	0	114.9	R149 A158	R149-P152 HydrophobicContact CB-CB 4.24Å; R149-P152 VanDerWaalsContact O-CD 3.25Å; R149-P152 WeakPolarHBondContact O-CD 3.4Å; P152-A158 WeakPolarHBondContact O-CA 3.24Å; P152-A158 WeakPolarHBondContact O-CB 3.4Å
153	V	93.6	Very high	96	Very high	127 Å²	127	82.3 Å²	82.3	77%	0.77	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-57.4	-176	-170.5	0	0	0	0	111.3	N151 A158	N151-V153 PolarHBondContact O-N 3.39Å; V153-A158 WeakPolarHBondContact O-CB 3.5Å
154	E	94.8	Very high	95.9	Very high	175 Å²	175	82.7 Å²	82.7	82%	0.818	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-13.2	-175.4	-63	178.4	173.2	0	0	113.3
155	G	94.5	Very high	95.8	Very high	26 Å²	26	84.8 Å²	84.8	27%	0.268	42%	0.418	S	S	.	.	S	Bend	trans	-96.7	-128	-166.6	0	0	0	0	0	113.7	N151 K159	N151-G155 CarbonylContact O-C 3.48Å; N151-G155 WeakPolarHBondContact O-CA 3.49Å; N151-G155 PolarHBondContact O-N 3.32Å; G155-K159 WeakPolarHBondContact O-CG 3.39Å
156	F	96.1	Very high	95.7	Very high	64 Å²	64	87.4 Å²	87.4	28%	0.281	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-63.7	-167.9	-172.2	-100.4	0	0	0	112.3	L142 M145 L146 N151 A158 K159 W167	L142-F156 HydrophobicContact CD1-CE1 3.68Å; L142-F156 HydrophobicContact CD1-CE2 4.49Å; L142-F156 HydrophobicContact CD1-CZ 3.33Å; M145-F156 HydrophobicContact CB-CD1 4.44Å; M145-F156 HydrophobicContact CB-CE1 3.98Å; M145-F156 HydrophobicContact CE-CD1 4.17Å; M145-F156 HydrophobicContact CE-CE1 4.08Å; M145-F156 HydrophobicContact CE-CG 4.43Å; M145-F156 HydrophobicContact CE-CZ 4.26Å; M145-F156 HydrophobicContact SD-CE1 4.48Å; L146-F156 HydrophobicContact CD2-CD1 4.13Å; L146-F156 HydrophobicContact CD2-CE1 3.91Å; L146-F156 HydrophobicContact CG-CE1 4.28Å; N151-F156 PolarHBondContact O-N 3.14Å; F156-A158 PolarHBondContact O-N 2.94Å; F156-K159 WeakPolarHBondContact O-CB 3.47Å; F156-K159 PolarHBondContact O-N 3.02Å; F156-W167 HydrophobicContact CD1-CH2 4.49Å; F156-W167 HydrophobicContact CD2-CH2 4.41Å; F156-W167 AromaticContact CE1-CH2 3.98Å; F156-W167 HydrophobicContact CE1-CH2 3.98Å; F156-W167 AromaticContact CE2-CH2 3.9Å; F156-W167 HydrophobicContact CE2-CH2 3.9Å; F156-W167 AromaticContact CZ-CH2 3.7Å; F156-W167 HydrophobicContact CZ-CH2 3.7Å; F156-W167 HydrophobicContact CZ-CZ2 4.31Å
157	S	96.3	Very high	95.7	Very high	2 Å²	2	92.7 Å²	92.7	1%	0.014	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-64.4	-24.4	179.4	-73.8	0	0	0	0	113.3	R149 I150 K159 W160 Y162	R149-S157 WeakPolarHBondContact CA-OG 3.4Å; I150-S157 PolarHBondContact N-OG 2.89Å; I150-S157 VanDerWaalsContact N-OG 3.13Å; I150-S157 WeakPolarHBondContact O-CB 3.5Å; I150-S157 PolarHBondContact O-N 2.96Å; I150-S157 PolarHBondContact O-OG 3.39Å; I150-S157 VanDerWaalsContact O-OG 3.11Å; S157-K159 PolarHBondContact O-N 2.96Å; S157-W160 PolarHBondContact O-N 3.08Å; S157-W160 VanDerWaalsContact O-N 3.1Å; S157-Y162 WeakPolarHBondContact CB-OH 3.2Å; S157-Y162 PolarHBondContact OG-OH 2.94Å; S157-Y162 VanDerWaalsContact OG-OH 3.05Å
158	A	96.4	Very high	95.6	Very high	18 Å²	18	93.5 Å²	93.5	15%	0.149	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-57.2	-30.5	173.3	0	0	0	0	0	112.6	P152 V153 F156 K168	P152-A158 WeakPolarHBondContact O-CA 3.24Å; P152-A158 WeakPolarHBondContact O-CB 3.4Å; V153-A158 WeakPolarHBondContact O-CB 3.5Å; F156-A158 PolarHBondContact O-N 2.94Å; A158-K168 WeakPolarHBondContact O-CD 3.14Å; A158-K168 WeakPolarHBondContact O-CE 3.3Å; A158-K168 PolarHBondContact O-NZ 2.95Å
159	K	96.7	Very high	95.3	Very high	129 Å²	129	101.9 Å²	101.9	56%	0.561	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-88.1	-4.1	-178.7	-62.7	173.6	-174.3	-175.7	0	113.5	G155 F156 S157 W167 K168	G155-K159 WeakPolarHBondContact O-CG 3.39Å; F156-K159 WeakPolarHBondContact O-CB 3.47Å; F156-K159 PolarHBondContact O-N 3.02Å; S157-K159 PolarHBondContact O-N 2.96Å; K159-W167 HydrophobicContact CB-CE3 4.13Å; K159-W167 HydrophobicContact CB-CZ3 4.15Å; K159-K168 WeakPolarHBondContact O-CB 3.41Å; K159-K168 WeakPolarHBondContact O-CG 3.19Å; K159-K168 PolarHBondContact O-N 3.08Å
160	W	97.3	Very high	95.3	Very high	38 Å²	38	99.1 Å²	99.1	14%	0.144	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.1	176.3	-178.1	-105.5	0	0	0	110.7	L146 S157 Y162 K165 W167 K168	L146-W160 HydrophobicContact CD1-CD2 3.65Å; L146-W160 HydrophobicContact CD1-CE3 4.02Å; L146-W160 HydrophobicContact CD1-CG 3.91Å; L146-W160 HydrophobicContact CD1-CZ2 4.21Å; L146-W160 HydrophobicContact CD1-CZ3 4.45Å; L146-W160 HydrophobicContact CD2-CB 3.52Å; L146-W160 HydrophobicContact CD2-CD2 4.23Å; L146-W160 HydrophobicContact CD2-CG 3.65Å; L146-W160 HydrophobicContact CG-CG 4.34Å; S157-W160 PolarHBondContact O-N 3.08Å; S157-W160 VanDerWaalsContact O-N 3.1Å; W160-Y162 HydrophobicContact CB-CE2 4.3Å; W160-Y162 AromaticContact CD1-CD1 3.69Å; W160-Y162 AromaticContact CD1-CD2 3.77Å; W160-Y162 AromaticContact CD1-CE1 3.74Å; W160-Y162 AromaticContact CD1-CE2 3.81Å; W160-Y162 AromaticContact CD1-CG 3.71Å; W160-Y162 AromaticContact CD1-CZ 3.8Å; W160-Y162 HydrophobicContact CG-CE2 4.49Å; W160-K165 WeakPolarHBondContact CH2-O 3.48Å; W160-K165 VanDerWaalsContact CZ2-CA 3.48Å; W160-K165 HydrophobicContact CZ2-CB 4.04Å; W160-K165 WeakPolarHBondContact CZ2-O 3.47Å; W160-W167 HydrophobicContact CB-CE3 4.34Å; W160-W167 HydrophobicContact CB-CZ3 4.2Å; W160-W167 AromaticContact CE3-CD2 3.66Å; W160-W167 HydrophobicContact CE3-CD2 3.66Å; W160-W167 AromaticContact CE3-CE2 3.84Å; W160-W167 AromaticContact CE3-CE3 4Å; W160-W167 HydrophobicContact CE3-CE3 4Å; W160-W167 AromaticContact CE3-CG 3.91Å; W160-W167 HydrophobicContact CE3-CG 3.91Å; W160-W167 HydrophobicContact CE3-CZ2 4.34Å; W160-W167 HydrophobicContact CE3-CZ3 4.44Å; W160-W167 AromaticContact CZ3-CD1 3.84Å; W160-W167 HydrophobicContact CZ3-CD2 4.11Å; W160-W167 HydrophobicContact CZ3-CG 4Å; W160-W167 AromaticContact CZ3-NE1 3.85Å; W160-K168 VanDerWaalsContact O-CE 3.32Å; W160-K168 WeakPolarHBondContact O-CE 3.35Å
161	D	96.3	Very high	95.2	Very high	31 Å²	31	101.6 Å²	101.6	17%	0.166	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	104.5	170.8	-173.7	-14.2	0	0	0	108.9	E163 N164 K165 Q166 K168	D161-E163 VanDerWaalsContact C-N 3.29Å; D161-E163 PolarHBondContact O-N 3.29Å; D161-E163 WeakPolarHBondContact OD1-CB 3.2Å; D161-E163 PolarHBondContact OD1-N 3.34Å; D161-N164 PolarHBondContact OD1-N 2.96Å; D161-N164 WeakPolarHBondContact OD2-CB 3.45Å; D161-N164 PolarHBondContact OD2-ND2 3.42Å; D161-K165 VanDerWaalsContact O-CA 3.25Å; D161-K165 WeakPolarHBondContact O-CA 3.49Å; D161-K165 PolarHBondContact O-N 3.3Å; D161-Q166 WeakPolarHBondContact CA-O 3.34Å; D161-Q166 HydrophobicContact CB-CG 4.29Å; D161-Q166 VanDerWaalsContact CB-O 3.26Å; D161-Q166 WeakPolarHBondContact CB-O 3.4Å; D161-Q166 PolarHBondContact N-O 3.36Å; D161-Q166 PolarHBondContact O-N 3.47Å; D161-K168 HydrophobicContact CB-CG 3.95Å
162	Y	94.8	Very high	95.2	Very high	84 Å²	84	101.3 Å²	101.3	33%	0.329	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.7	-179.5	-72	-90.3	0	0	0	113.1	L146 S157 W160	L146-Y162 HydrophobicContact CB-CE1 4.48Å; L146-Y162 WeakPolarHBondContact O-CE1 3.41Å; L146-Y162 PolarHBondContact O-OH 3.3Å; S157-Y162 WeakPolarHBondContact CB-OH 3.2Å; S157-Y162 PolarHBondContact OG-OH 2.94Å; S157-Y162 VanDerWaalsContact OG-OH 3.05Å; W160-Y162 HydrophobicContact CB-CE2 4.3Å; W160-Y162 AromaticContact CD1-CD1 3.69Å; W160-Y162 AromaticContact CD1-CD2 3.77Å; W160-Y162 AromaticContact CD1-CE1 3.74Å; W160-Y162 AromaticContact CD1-CE2 3.81Å; W160-Y162 AromaticContact CD1-CG 3.71Å; W160-Y162 AromaticContact CD1-CZ 3.8Å; W160-Y162 HydrophobicContact CG-CE2 4.49Å
163	E	95.1	Very high	95.2	Very high	176 Å²	176	102.8 Å²	102.8	82%	0.822	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-48.4	178.8	-62.9	-176.3	175.4	0	0	110.1	D161	D161-E163 VanDerWaalsContact C-N 3.29Å; D161-E163 PolarHBondContact O-N 3.29Å; D161-E163 WeakPolarHBondContact OD1-CB 3.2Å; D161-E163 PolarHBondContact OD1-N 3.34Å
164	N	95.1	Very high	95.3	Very high	101 Å²	101	101.3 Å²	101.3	54%	0.54	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	1.4	-176.9	-62.2	-57.8	0	0	0	113.8	D161 Q166	D161-N164 PolarHBondContact OD1-N 2.96Å; D161-N164 WeakPolarHBondContact OD2-CB 3.45Å; D161-N164 PolarHBondContact OD2-ND2 3.42Å; N164-Q166 VanDerWaalsContact C-N 3.29Å; N164-Q166 HydrophobicContact CB-CG 3.84Å; N164-Q166 PolarHBondContact O-N 3.42Å
165	K	93.8	Very high	95.3	Very high	167 Å²	167	96.4 Å²	96.4	73%	0.726	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	48.8	-177.4	-61.7	-176.2	179.8	-178.3	0	112.8	W160 D161	W160-K165 WeakPolarHBondContact CH2-O 3.48Å; W160-K165 VanDerWaalsContact CZ2-CA 3.48Å; W160-K165 HydrophobicContact CZ2-CB 4.04Å; W160-K165 WeakPolarHBondContact CZ2-O 3.47Å; D161-K165 VanDerWaalsContact O-CA 3.25Å; D161-K165 WeakPolarHBondContact O-CA 3.49Å; D161-K165 PolarHBondContact O-N 3.3Å
166	Q	95.7	Very high	95.3	Very high	103 Å²	103	101.4 Å²	101.4	48%	0.481	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	161.6	-179.9	62.9	-175.9	-10	0	0	111.4	D161 N164	D161-Q166 WeakPolarHBondContact CA-O 3.34Å; D161-Q166 HydrophobicContact CB-CG 4.29Å; D161-Q166 VanDerWaalsContact CB-O 3.26Å; D161-Q166 WeakPolarHBondContact CB-O 3.4Å; D161-Q166 PolarHBondContact N-O 3.36Å; D161-Q166 PolarHBondContact O-N 3.47Å; N164-Q166 VanDerWaalsContact C-N 3.29Å; N164-Q166 HydrophobicContact CB-CG 3.84Å; N164-Q166 PolarHBondContact O-N 3.42Å
167	W	96.8	Very high	95.3	Very high	113 Å²	113	104.3 Å²	104.3	43%	0.428	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.9	170.7	-68.1	105.2	0	0	0	110.1	L142 L146 F156 K159 W160	L142-W167 HydrophobicContact CD1-CH2 4.07Å; L142-W167 HydrophobicContact CD1-CZ2 3.67Å; L142-W167 HydrophobicContact CD2-CZ2 4.45Å; L146-W167 HydrophobicContact CD2-CH2 4.33Å; F156-W167 HydrophobicContact CD1-CH2 4.49Å; F156-W167 HydrophobicContact CD2-CH2 4.41Å; F156-W167 AromaticContact CE1-CH2 3.98Å; F156-W167 HydrophobicContact CE1-CH2 3.98Å; F156-W167 AromaticContact CE2-CH2 3.9Å; F156-W167 HydrophobicContact CE2-CH2 3.9Å; F156-W167 AromaticContact CZ-CH2 3.7Å; F156-W167 HydrophobicContact CZ-CH2 3.7Å; F156-W167 HydrophobicContact CZ-CZ2 4.31Å; K159-W167 HydrophobicContact CB-CE3 4.13Å; K159-W167 HydrophobicContact CB-CZ3 4.15Å; W160-W167 HydrophobicContact CB-CE3 4.34Å; W160-W167 HydrophobicContact CB-CZ3 4.2Å; W160-W167 AromaticContact CE3-CD2 3.66Å; W160-W167 HydrophobicContact CE3-CD2 3.66Å; W160-W167 AromaticContact CE3-CE2 3.84Å; W160-W167 AromaticContact CE3-CE3 4Å; W160-W167 HydrophobicContact CE3-CE3 4Å; W160-W167 AromaticContact CE3-CG 3.91Å; W160-W167 HydrophobicContact CE3-CG 3.91Å; W160-W167 HydrophobicContact CE3-CZ2 4.34Å; W160-W167 HydrophobicContact CE3-CZ3 4.44Å; W160-W167 AromaticContact CZ3-CD1 3.84Å; W160-W167 HydrophobicContact CZ3-CD2 4.11Å; W160-W167 HydrophobicContact CZ3-CG 4Å; W160-W167 AromaticContact CZ3-NE1 3.85Å
168	K	95.4	Very high	95.2	Very high	121 Å²	121	112.8 Å²	112.8	53%	0.526	51%	0.505	S	S	.	.			trans	-60.6	137.8	172.4	-65.7	178.1	-176.2	171.2	0	108.8	A158 K159 W160 D161	A158-K168 WeakPolarHBondContact O-CD 3.14Å; A158-K168 WeakPolarHBondContact O-CE 3.3Å; A158-K168 PolarHBondContact O-NZ 2.95Å; K159-K168 WeakPolarHBondContact O-CB 3.41Å; K159-K168 WeakPolarHBondContact O-CG 3.19Å; K159-K168 PolarHBondContact O-N 3.08Å; W160-K168 VanDerWaalsContact O-CE 3.32Å; W160-K168 WeakPolarHBondContact O-CE 3.35Å; D161-K168 HydrophobicContact CB-CG 3.95Å
169	K	89.2	Confident	95.1	Very high	273 Å²	273	121.5 Å²	121.5	100%	1.187	54%	0.537	S	S	*	.			trans	-80.1	0	175	-70.3	-178.5	-179.4	176.1	0	111.2

Retrieved 169 of 169 residues in 39.7 ms (Link to these results)

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