A0A077Z8M7_TRITR Loading...

GTPaseactivator protein for Ras-like GTPase

AlphaFold DB , UniProt , Accession A0A077Z8M7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 136 aa.

						>A0A077Z8M7_TRITR|A0A077Z8M7
MSEHVSSDETPPPAESSATKPVTESKNSIYNPVVSLVERVTGIGVPLDSVAMYRLGWIDKTGAVLVPPNFVEMVEKDPSSIPLATTDPNVIFSLGGLKGIGKTHKEVQEKLECALSAEDEMFIDTEHTHEEEVKPT
					

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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	49.3	Very low	51	Low	242 Å²	242	147.7 Å²	147.7	100%	1.192	83%	0.83	S	S	*	*				0	147.7	0	-85.9	178.5	159.2	0	0	108.4
2	S	63.1	Low	51.5	Low	128 Å²	128	144.6 Å²	144.6	90%	0.895	82%	0.82	S	S	*	*			trans	88.4	87.9	179.2	-53.5	0	0	0	0	115.5
3	E	55.6	Low	50.5	Low	168 Å²	168	142.8 Å²	142.8	79%	0.785	82%	0.817	S	S	*	*			trans	-85.4	155.9	158.3	-48.8	176.6	112.6	0	0	109.8
4	H	44.9	Very low	50.2	Low	167 Å²	167	138.9 Å²	138.9	77%	0.773	81%	0.811	S	S	*	*			trans	64.2	133.9	158.8	-56.3	-62.9	0	0	0	117.5
5	V	49.7	Very low	49.2	Very low	143 Å²	143	142.7 Å²	142.7	87%	0.867	82%	0.818	S	S	*	*				-151.7	141.7	65.9	167.3	0	0	0	0	111.8
6	S	49.2	Very low	48.7	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	81%	0.814	S	S	*	*			trans	-80.1	146.2	172.7	174.7	0	0	0	0	112
7	S	51.7	Low	48.4	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	80%	0.802	S	S	*	*			trans	178.2	107.4	139.4	-71.8	0	0	0	0	105.9
8	D	46.6	Very low	48.3	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	81%	0.807	S	S	*	*				62.7	101.8	75.2	-154.5	-102.9	0	0	0	111.2
9	E	46.9	Very low	47.6	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	80%	0.801	S	S	*	*				173.7	122.2	122.1	-158.2	168	93.6	0	0	109.4
10	T	55.1	Low	47.2	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	80%	0.8	S	S	*	*			trans	-103.8	138.9	167.4	-56	0	0	0	0	105.2
11	P	48.7	Very low	46.9	Very low	109 Å²	109	135.4 Å²	135.4	71%	0.708	80%	0.795	S	S	*	*				-156.4	-179.8	84.2	40.6	-17.3	0	0	0	115.6
12	P	56.7	Low	46.5	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	78%	0.776	S	S	*	*			trans	-93.5	177.7	-163.5	39.6	-31.9	0	0	0	112
13	P	39.7	Very low	45.3	Very low	121 Å²	121	129.5 Å²	129.5	79%	0.786	77%	0.767	S	S	*	*				-151.2	149.4	103.4	34.1	-15.1	0	0	0	116.7
14	A	45.3	Very low	44.5	Very low	88 Å²	88	128 Å²	128	73%	0.727	76%	0.761	S	S	*	*			trans	39.9	111.4	132.2	0	0	0	0	0	119.9
15	E	35.2	Very low	44.3	Very low	196 Å²	196	124.5 Å²	124.5	92%	0.916	76%	0.755	S	S	*	*				2.9	124.3	124.1	-56.3	-178	104.3	0	0	115.9
16	S	41.7	Very low	43.7	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	75%	0.75	S	S	*	*				169.1	124.2	122.1	-175.2	0	0	0	0	109.2
17	S	44.2	Very low	43.4	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	75%	0.753	S	S	*	*			trans	55.4	84.1	150.5	-45	0	0	0	0	115.1	T19	S17-T19 PolarHBondContact O-N 3.23Å
18	A	45.1	Very low	42.8	Very low	107 Å²	107	127.1 Å²	127.1	88%	0.884	75%	0.745	S	S	*	*			trans	-63	68.1	142.9	0	0	0	0	0	108.6	K20	A18-K20 PolarHBondContact O-N 2.93Å
19	T	35.7	Very low	42.8	Very low	114 Å²	114	126.1 Å²	126.1	70%	0.699	74%	0.739	S	S	*	*			trans	-61.7	101.3	158.3	-47.3	0	0	0	0	103.4	S17 P21	S17-T19 PolarHBondContact O-N 3.23Å; T19-P21 WeakPolarHBondContact O-CD 3.08Å
20	K	39.2	Very low	42.4	Very low	178 Å²	178	125.7 Å²	125.7	77%	0.774	73%	0.731	S	S	*	*			trans	-37.2	119.2	170	-65.8	175.6	179.4	179.4	0	106.6	A18 V22	A18-K20 PolarHBondContact O-N 2.93Å; K20-V22 VanDerWaalsContact C-N 3.29Å; K20-V22 PolarHBondContact O-N 3.31Å
21	P	42.4	Very low	42	Very low	108 Å²	108	121.8 Å²	121.8	70%	0.701	71%	0.705	S	S	*	*			trans	-56.8	112.6	162.4	23.1	-28.3	0	0	0	104.1	T19 T23	T19-P21 WeakPolarHBondContact O-CD 3.08Å; P21-T23 PolarHBondContact O-N 2.97Å; P21-T23 PolarHBondContact O-OG1 3.14Å
22	V	39.1	Very low	41.7	Very low	131 Å²	131	120.4 Å²	120.4	79%	0.794	70%	0.696	S	S	*	*			trans	-58.4	87.1	151	173.3	0	0	0	0	102	K20 E24	K20-V22 VanDerWaalsContact C-N 3.29Å; K20-V22 PolarHBondContact O-N 3.31Å; V22-E24 HydrophobicContact CG1-CG 4.37Å; V22-E24 PolarHBondContact O-N 3.39Å
23	T	39.2	Very low	41	Very low	115 Å²	115	118.1 Å²	118.1	71%	0.706	68%	0.68	S	S	*	*			trans	-67.8	84.1	169.2	-39.6	0	0	0	0	102.8	P21 S25	P21-T23 PolarHBondContact O-N 2.97Å; P21-T23 PolarHBondContact O-OG1 3.14Å; T23-S25 VanDerWaalsContact C-N 3.31Å; T23-S25 PolarHBondContact O-N 3.48Å
24	E	38.6	Very low	41.2	Very low	138 Å²	138	113.8 Å²	113.8	65%	0.645	65%	0.651	S	S	*	*			trans	-42.3	110.6	154.1	-71.7	179.2	142	0	0	104.4	V22 K26	V22-E24 HydrophobicContact CG1-CG 4.37Å; V22-E24 PolarHBondContact O-N 3.39Å; E24-K26 PolarHBondContact O-N 3.46Å
25	S	40.2	Very low	41.3	Very low	93 Å²	93	111 Å²	111	65%	0.65	63%	0.626	S	S	*	*			trans	-64.6	83.7	178.4	48.1	0	0	0	0	107.2	T23 N27 S28	T23-S25 VanDerWaalsContact C-N 3.31Å; T23-S25 PolarHBondContact O-N 3.48Å; S25-N27 PolarHBondContact O-N 3.42Å; S25-S28 PolarHBondContact O-N 3.25Å; S25-S28 VanDerWaalsContact O-N 3.13Å
26	K	38	Very low	41.8	Very low	179 Å²	179	105.9 Å²	105.9	78%	0.778	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	6.8	174.9	-75.5	-178.5	177.5	176.2	0	113.1	E24	E24-K26 PolarHBondContact O-N 3.46Å
27	N	41.3	Very low	41.8	Very low	142 Å²	142	103.4 Å²	103.4	76%	0.759	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	24.8	173.9	-67.1	14	0	0	0	112.1	S25 I29	S25-N27 PolarHBondContact O-N 3.42Å; N27-I29 PolarHBondContact O-N 3.08Å
28	S	40.7	Very low	41.8	Very low	90 Å²	90	104 Å²	104	63%	0.629	58%	0.578	S	S	*	*			trans	-65	83.6	160.8	-173.4	0	0	0	0	107.8	S25 Y30	S25-S28 PolarHBondContact O-N 3.25Å; S25-S28 VanDerWaalsContact O-N 3.13Å; S28-Y30 PolarHBondContact O-N 3.05Å
29	I	45.3	Very low	41.7	Very low	128 Å²	128	107.8 Å²	107.8	66%	0.656	57%	0.569	S	S	*	*			trans	-62.1	96.9	167	-64.8	170.2	0	0	0	104.3	N27 N31	N27-I29 PolarHBondContact O-N 3.08Å; I29-N31 PolarHBondContact O-N 3.47Å
30	Y	39.9	Very low	41.9	Very low	167 Å²	167	107.6 Å²	107.6	66%	0.655	57%	0.568	S	S	*	*			trans	-61.3	104.7	172.8	177	-96.8	0	0	0	107.7	S28 P32	S28-Y30 PolarHBondContact O-N 3.05Å; Y30-P32 HydrophobicContact CE1-CB 4.19Å; Y30-P32 WeakPolarHBondContact O-CD 3.44Å
31	N	45.4	Very low	42	Very low	47 Å²	47	102.9 Å²	102.9	25%	0.251	55%	0.554	S	S	.	*			trans	-95.2	111.4	173.7	-171.9	-24.5	0	0	0	108.5	I29 V33 V34 S35	I29-N31 PolarHBondContact O-N 3.47Å; N31-V33 PolarHBondContact O-N 2.96Å; N31-V33 VanDerWaalsContact O-N 3.13Å; N31-V33 VanDerWaalsContact OD1-CB 3.29Å; N31-V33 WeakPolarHBondContact OD1-CB 3.49Å; N31-V33 PolarHBondContact OD1-N 3.48Å; N31-V34 HydrophobicContact CB-CB 4.11Å; N31-V34 HydrophobicContact CB-CG2 3.78Å; N31-V34 PolarHBondContact O-N 3.01Å; N31-S35 PolarHBondContact O-N 3.25Å
32	P	42.9	Very low	41.6	Very low	80 Å²	80	100.8 Å²	100.8	52%	0.519	55%	0.552	S	S	.	*	H	α-helix	trans	-61	-24.8	-178.3	25.5	-34.4	0	0	0	112.5	Y30 L36	Y30-P32 HydrophobicContact CE1-CB 4.19Å; Y30-P32 WeakPolarHBondContact O-CD 3.44Å; P32-L36 WeakPolarHBondContact O-CB 3.38Å; P32-L36 PolarHBondContact O-N 3.29Å
33	V	42.9	Very low	41.6	Very low	63 Å²	63	99.6 Å²	99.6	38%	0.382	54%	0.541	S	S	.	.	H	α-helix	trans	-70.5	-43.3	175.5	-176.3	0	0	0	0	110.8	N31 S35 L36 V37	N31-V33 PolarHBondContact O-N 2.96Å; N31-V33 VanDerWaalsContact O-N 3.13Å; N31-V33 VanDerWaalsContact OD1-CB 3.29Å; N31-V33 WeakPolarHBondContact OD1-CB 3.49Å; N31-V33 PolarHBondContact OD1-N 3.48Å; V33-S35 VanDerWaalsContact C-N 3.32Å; V33-S35 PolarHBondContact O-N 2.89Å; V33-L36 PolarHBondContact O-N 3.44Å; V33-V37 HydrophobicContact CG1-CG2 4.43Å; V33-V37 VanDerWaalsContact O-CG2 3.3Å; V33-V37 WeakPolarHBondContact O-CG2 3.28Å; V33-V37 PolarHBondContact O-N 3.18Å
34	V	43.5	Very low	41.1	Very low	30 Å²	30	96.4 Å²	96.4	18%	0.182	53%	0.53	C	S	.	.	H	α-helix	trans	-60.9	-43.6	176	173	0	0	0	0	110.5	N31 L36 V37 E38 V45 L47	N31-V34 HydrophobicContact CB-CB 4.11Å; N31-V34 HydrophobicContact CB-CG2 3.78Å; N31-V34 PolarHBondContact O-N 3.01Å; V34-L36 PolarHBondContact O-N 3Å; V34-V37 PolarHBondContact O-N 3.4Å; V34-E38 WeakPolarHBondContact O-CB 3.24Å; V34-E38 PolarHBondContact O-N 3.27Å; V34-V45 HydrophobicContact CG1-CB 3.91Å; V34-V45 HydrophobicContact CG1-CG2 4.36Å; V34-V45 HydrophobicContact CG2-CB 4.33Å; V34-L47 HydrophobicContact CG2-CD2 4.36Å
35	S	45.9	Very low	41.3	Very low	28 Å²	28	91.8 Å²	91.8	20%	0.196	51%	0.512	C	S	.	.	H	α-helix	trans	-66.3	-35.4	176.1	-177.5	0	0	0	0	112.9	N31 V33 R39	N31-S35 PolarHBondContact O-N 3.25Å; V33-S35 VanDerWaalsContact C-N 3.32Å; V33-S35 PolarHBondContact O-N 2.89Å; S35-R39 WeakPolarHBondContact O-CB 3.32Å; S35-R39 VanDerWaalsContact O-CG 3.28Å; S35-R39 WeakPolarHBondContact O-CG 3.45Å; S35-R39 PolarHBondContact O-N 2.85Å; S35-R39 PolarHBondContact O-NE 2.82Å
36	L	45.8	Very low	41.1	Very low	89 Å²	89	91.8 Å²	91.8	47%	0.466	51%	0.509	S	S	.	.	H	α-helix	trans	-67.9	-44.6	174.6	-177.8	64.8	0	0	0	111.2	P32 V33 V34 R39 V40	P32-L36 WeakPolarHBondContact O-CB 3.38Å; P32-L36 PolarHBondContact O-N 3.29Å; V33-L36 PolarHBondContact O-N 3.44Å; V34-L36 PolarHBondContact O-N 3Å; L36-R39 PolarHBondContact O-N 2.76Å; L36-V40 HydrophobicContact CD1-CG2 3.9Å; L36-V40 HydrophobicContact CG-CG2 4.26Å; L36-V40 WeakPolarHBondContact O-CB 3.45Å; L36-V40 VanDerWaalsContact O-CG2 3.24Å; L36-V40 WeakPolarHBondContact O-CG2 3.08Å; L36-V40 PolarHBondContact O-N 2.94Å
37	V	43	Very low	41.1	Very low	55 Å²	55	86.7 Å²	86.7	33%	0.333	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-48.2	176	170.7	0	0	0	0	110.1	V33 V34 R39 V40 T41 V45	V33-V37 HydrophobicContact CG1-CG2 4.43Å; V33-V37 VanDerWaalsContact O-CG2 3.3Å; V33-V37 WeakPolarHBondContact O-CG2 3.28Å; V33-V37 PolarHBondContact O-N 3.18Å; V34-V37 PolarHBondContact O-N 3.4Å; V37-R39 VanDerWaalsContact C-N 3.34Å; V37-R39 PolarHBondContact O-N 3.39Å; V37-V40 PolarHBondContact O-N 2.85Å; V37-T41 HydrophobicContact CG1-CG2 4.47Å; V37-T41 WeakPolarHBondContact O-CB 3.42Å; V37-T41 PolarHBondContact O-N 3.42Å; V37-T41 PolarHBondContact O-OG1 2.96Å; V37-V45 HydrophobicContact CG1-CG2 4.35Å
38	E	44.3	Very low	40.9	Very low	101 Å²	101	87.5 Å²	87.5	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-41.4	177	-171.5	178.7	-166.9	0	0	112.1	V34 G42 I43	V34-E38 WeakPolarHBondContact O-CB 3.24Å; V34-E38 PolarHBondContact O-N 3.27Å; E38-G42 WeakPolarHBondContact O-CA 3.38Å; E38-G42 PolarHBondContact O-N 2.97Å; E38-I43 VanDerWaalsContact CA-O 3.29Å; E38-I43 WeakPolarHBondContact CA-O 3.32Å; E38-I43 WeakPolarHBondContact CB-O 3.5Å
39	R	42	Very low	40.4	Very low	187 Å²	187	88.7 Å²	88.7	71%	0.706	50%	0.503	S	S	*	.	H	α-helix	trans	-69.2	-35.4	177.7	-75.2	-173.5	-61.8	149.7	0.2	114	S35 L36 V37	S35-R39 WeakPolarHBondContact O-CB 3.32Å; S35-R39 VanDerWaalsContact O-CG 3.28Å; S35-R39 WeakPolarHBondContact O-CG 3.45Å; S35-R39 PolarHBondContact O-N 2.85Å; S35-R39 PolarHBondContact O-NE 2.82Å; L36-R39 PolarHBondContact O-N 2.76Å; V37-R39 VanDerWaalsContact C-N 3.34Å; V37-R39 PolarHBondContact O-N 3.39Å
40	V	40.1	Very low	39.9	Very low	111 Å²	111	83.9 Å²	83.9	67%	0.673	48%	0.479	S	S	*	.	H	α-helix	trans	-84.5	-32.2	-176.6	174.1	0	0	0	0	111.5	L36 V37	L36-V40 HydrophobicContact CD1-CG2 3.9Å; L36-V40 HydrophobicContact CG-CG2 4.26Å; L36-V40 WeakPolarHBondContact O-CB 3.45Å; L36-V40 VanDerWaalsContact O-CG2 3.24Å; L36-V40 WeakPolarHBondContact O-CG2 3.08Å; L36-V40 PolarHBondContact O-N 2.94Å; V37-V40 PolarHBondContact O-N 2.85Å
41	T	41.4	Very low	40.1	Very low	78 Å²	78	78.4 Å²	78.4	48%	0.479	47%	0.468	S	S	.	.	H	α-helix	trans	-115.9	-18.6	-171.8	70.8	0	0	0	0	114.3	V37 I43	V37-T41 HydrophobicContact CG1-CG2 4.47Å; V37-T41 WeakPolarHBondContact O-CB 3.42Å; V37-T41 PolarHBondContact O-N 3.42Å; V37-T41 PolarHBondContact O-OG1 2.96Å; T41-I43 VanDerWaalsContact C-N 3.35Å; T41-I43 PolarHBondContact OG1-N 2.99Å
42	G	34.8	Very low	39.9	Very low	65 Å²	65	81.3 Å²	81.3	67%	0.67	48%	0.482	S	S	*	.			trans	80.1	8.9	-173.3	0	0	0	0	0	114.9	E38	E38-G42 WeakPolarHBondContact O-CA 3.38Å; E38-G42 PolarHBondContact O-N 2.97Å
43	I	37.7	Very low	40	Very low	106 Å²	106	79 Å²	79	54%	0.544	46%	0.463	S	S	.	.			trans	-107.1	122.1	-171.8	-56.2	171.7	0	0	0	110.8	E38 T41	E38-I43 VanDerWaalsContact CA-O 3.29Å; E38-I43 WeakPolarHBondContact CA-O 3.32Å; E38-I43 WeakPolarHBondContact CB-O 3.5Å; T41-I43 VanDerWaalsContact C-N 3.35Å; T41-I43 PolarHBondContact OG1-N 2.99Å
44	G	30	Very low	40	Very low	48 Å²	48	83.3 Å²	83.3	50%	0.495	47%	0.473	S	S	.	.			trans	-84.4	132	172.1	0	0	0	0	0	112.2
45	V	41.7	Very low	40.3	Very low	41 Å²	41	83.4 Å²	83.4	25%	0.248	47%	0.472	C	S	.	.			trans	-105.4	112.6	-176.1	-174.8	0	0	0	0	109.5	V34 V37 E72	V34-V45 HydrophobicContact CG1-CB 3.91Å; V34-V45 HydrophobicContact CG1-CG2 4.36Å; V34-V45 HydrophobicContact CG2-CB 4.33Å; V37-V45 HydrophobicContact CG1-CG2 4.35Å; V45-E72 HydrophobicContact CG1-CB 4.48Å; V45-E72 WeakPolarHBondContact CG1-OE2 3.29Å
46	P	36.8	Very low	40.3	Very low	93 Å²	93	83.1 Å²	83.1	60%	0.604	47%	0.474	S	S	*	.			trans	-81.9	114.7	-177.8	29.9	-30.7	0	0	0	112.7	D48 E72	P46-D48 VanDerWaalsContact C-N 3.26Å; P46-D48 PolarHBondContact O-N 3.13Å; P46-E72 VanDerWaalsContact O-OE1 3.1Å
47	L	38.3	Very low	40.5	Very low	71 Å²	71	81.5 Å²	81.5	37%	0.372	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.7	-170.9	-66	168.2	0	0	0	117.1	V34	V34-L47 HydrophobicContact CG2-CD2 4.36Å
48	D	36.4	Very low	40.8	Very low	160 Å²	160	82.6 Å²	82.6	86%	0.856	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	5.4	-154.4	-78.5	-13.3	0	0	0	116.9	P46	P46-D48 VanDerWaalsContact C-N 3.26Å; P46-D48 PolarHBondContact O-N 3.13Å
49	S	31	Very low	40.9	Very low	114 Å²	114	79.9 Å²	79.9	80%	0.797	45%	0.453	S	S	*	.	S	Bend	trans	-153.3	26.1	177.1	33.2	0	0	0	0	116.4
50	V	34.1	Very low	41.8	Very low	27 Å²	27	81.1 Å²	81.1	16%	0.164	46%	0.464	C	S	.	.			trans	-130	126.2	-170.3	-164.1	0	0	0	0	115.1	M52 E72 M73 V74	V50-M52 PolarHBondContact O-N 2.81Å; V50-E72 HydrophobicContact CB-CG 3.2Å; V50-E72 VanDerWaalsContact CB-OE1 3.23Å; V50-E72 WeakPolarHBondContact CB-OE1 3.42Å; V50-E72 HydrophobicContact CG1-CB 4.05Å; V50-E72 HydrophobicContact CG1-CG 3Å; V50-E72 HydrophobicContact CG2-CG 3.48Å; V50-E72 VanDerWaalsContact CG2-CG 3.48Å; V50-E72 WeakPolarHBondContact CG2-OE1 3.45Å; V50-M73 WeakPolarHBondContact CG1-O 2.85Å; V50-V74 HydrophobicContact CG2-CG2 4.23Å
51	A	44	Very low	43	Very low	52 Å²	52	80.9 Å²	80.9	43%	0.43	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	115.2	165.8	0	0	0	0	0	108.8	Y53 M73	A51-Y53 HydrophobicContact CB-CD2 4.24Å; A51-Y53 HydrophobicContact CB-CE2 3.6Å; A51-Y53 WeakPolarHBondContact O-CD2 3.38Å; A51-Y53 PolarHBondContact O-N 2.74Å; A51-M73 PolarHBondContact O-N 2.81Å
52	M	41.4	Very low	44	Very low	108 Å²	108	79.8 Å²	79.8	53%	0.532	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	114	173.9	-62.2	-173	-142.1	0	0	109.1	V50 F70	V50-M52 PolarHBondContact O-N 2.81Å; M52-F70 HydrophobicContact CB-CB 4.41Å; M52-F70 HydrophobicContact CB-CD1 4.13Å
53	Y	44.5	Very low	45.1	Very low	32 Å²	32	78.7 Å²	78.7	13%	0.125	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.4	174.3	-74.6	-88.7	0	0	0	110.3	A51 L55 F70 V71 M73 P78 I81	A51-Y53 HydrophobicContact CB-CD2 4.24Å; A51-Y53 HydrophobicContact CB-CE2 3.6Å; A51-Y53 WeakPolarHBondContact O-CD2 3.38Å; A51-Y53 PolarHBondContact O-N 2.74Å; Y53-L55 PolarHBondContact O-N 3.19Å; Y53-F70 CarbonylContact O-C 3.51Å; Y53-F70 WeakPolarHBondContact O-CA 3.14Å; Y53-V71 PolarHBondContact N-O 2.82Å; Y53-V71 PolarHBondContact O-N 2.93Å; Y53-M73 HydrophobicContact CD2-CB 3.8Å; Y53-M73 HydrophobicContact CD2-CE 4.32Å; Y53-M73 HydrophobicContact CD2-CG 3.83Å; Y53-M73 HydrophobicContact CD2-SD 3.75Å; Y53-M73 HydrophobicContact CE2-CB 4.11Å; Y53-M73 HydrophobicContact CE2-SD 4.26Å; Y53-M73 HydrophobicContact CG-CE 4.14Å; Y53-M73 HydrophobicContact CG-CG 4.5Å; Y53-M73 HydrophobicContact CG-SD 4.1Å; Y53-P78 WeakPolarHBondContact OH-CA 3.35Å; Y53-P78 WeakPolarHBondContact OH-CB 3.37Å; Y53-P78 PolarHBondContact OH-O 2.74Å; Y53-I81 HydrophobicContact CD1-CG2 4.11Å; Y53-I81 HydrophobicContact CD2-CD1 4.11Å; Y53-I81 HydrophobicContact CE1-CB 4.07Å; Y53-I81 HydrophobicContact CE1-CD1 3.9Å; Y53-I81 HydrophobicContact CE1-CG2 3.95Å; Y53-I81 HydrophobicContact CE2-CD1 3.43Å; Y53-I81 VanDerWaalsContact CE2-CD1 3.43Å; Y53-I81 WeakPolarHBondContact OH-CD1 3.25Å
54	R	44.1	Very low	46.1	Very low	154 Å²	154	77.5 Å²	77.5	58%	0.581	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	97.8	174.2	-159.5	-172.8	178	-174.4	-1.2	109.7	P68 N69 F70	R54-P68 HydrophobicContact CG-CB 3.89Å; R54-P68 PolarHBondContact NE-O 3.43Å; R54-P68 PolarHBondContact NH2-O 3.05Å; R54-N69 CarbonylContact C-O 3.44Å; R54-N69 VanDerWaalsContact CA-O 3.31Å; R54-N69 WeakPolarHBondContact CA-O 3.44Å; R54-F70 HydrophobicContact CB-CD1 3.9Å; R54-F70 HydrophobicContact CB-CE1 3.82Å; R54-F70 HydrophobicContact CB-CZ 4.36Å; R54-F70 HydrophobicContact CG-CD1 4.29Å; R54-F70 HydrophobicContact CG-CE1 4.2Å; R54-F70 HydrophobicContact CG-CE2 4.47Å; R54-F70 HydrophobicContact CG-CG 4.49Å; R54-F70 HydrophobicContact CG-CZ 4.29Å
55	L	48.3	Very low	47	Very low	31 Å²	31	77.1 Å²	77.1	16%	0.162	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	176.7	-69.6	-178.6	0	0	0	111.2	Y53 P68 N69 V71 M73 I91	Y53-L55 PolarHBondContact O-N 3.19Å; L55-P68 CarbonylContact O-C 3.51Å; L55-P68 VanDerWaalsContact O-CA 3.31Å; L55-P68 WeakPolarHBondContact O-CA 3.42Å; L55-N69 PolarHBondContact N-O 2.82Å; L55-N69 PolarHBondContact O-N 3.36Å; L55-V71 HydrophobicContact CB-CG2 4.02Å; L55-V71 HydrophobicContact CD1-CB 4.12Å; L55-V71 HydrophobicContact CD1-CG1 4.48Å; L55-V71 HydrophobicContact CD1-CG2 4.06Å; L55-V71 HydrophobicContact CG-CB 4.46Å; L55-V71 HydrophobicContact CG-CG2 4.33Å; L55-M73 HydrophobicContact CD1-CE 3.31Å; L55-M73 HydrophobicContact CD2-CE 3.88Å; L55-M73 HydrophobicContact CG-CE 3.72Å; L55-I91 HydrophobicContact CD1-CG2 4.28Å
56	G	47.6	Very low	47.4	Very low	23 Å²	23	77.8 Å²	77.8	24%	0.237	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	168.4	168.9	0	0	0	0	0	109.7	V66	G56-V66 CarbonylContact C-O 3.54Å; G56-V66 WeakPolarHBondContact CA-O 3.3Å
57	W	49.8	Very low	48.3	Very low	55 Å²	55	77.9 Å²	77.9	21%	0.208	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.6	178.7	-172	-1.4	0	0	0	109.1	V64 L65 V66 P88 L111	W57-V64 CarbonylContact O-C 3.52Å; W57-V64 WeakPolarHBondContact O-CA 3.49Å; W57-L65 HydrophobicContact CB-CB 4.33Å; W57-L65 HydrophobicContact CD2-CB 4.48Å; W57-L65 HydrophobicContact CD2-CD1 4.08Å; W57-L65 HydrophobicContact CG-CB 4.26Å; W57-L65 HydrophobicContact CG-CD1 4.33Å; W57-L65 HydrophobicContact CZ2-CD1 4.3Å; W57-L65 PolarHBondContact O-N 2.92Å; W57-V66 HydrophobicContact CB-CB 3.86Å; W57-V66 HydrophobicContact CB-CG2 3.95Å; W57-V66 PolarHBondContact N-O 3.12Å; W57-V66 PolarHBondContact O-N 3.41Å; W57-V66 VanDerWaalsContact O-N 3.09Å; W57-P88 HydrophobicContact CH2-CB 4.3Å; W57-L111 HydrophobicContact CE3-CD1 3.9Å; W57-L111 HydrophobicContact CZ3-CD1 3.45Å; W57-L111 VanDerWaalsContact CZ3-CD1 3.45Å
58	I	48.5	Very low	48.9	Very low	78 Å²	78	77 Å²	77	40%	0.4	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.4	167.1	-52.6	-179.2	0	0	0	108.3	G62 A63 V64	I58-G62 WeakPolarHBondContact CG2-O 3.34Å; I58-A63 CarbonylContact C-O 3.44Å; I58-A63 VanDerWaalsContact CA-O 3.25Å; I58-A63 WeakPolarHBondContact CA-O 3.26Å; I58-V64 HydrophobicContact CD1-CG2 4.5Å; I58-V64 HydrophobicContact CG1-CG2 4.17Å
59	D	46.4	Very low	49.4	Very low	44 Å²	44	73.5 Å²	73.5	24%	0.235	42%	0.42	C	S	.	.			trans	-74.8	-179.1	176.1	79.5	-6.4	0	0	0	112.4	T61 G62 A63 L65	D59-T61 PolarHBondContact O-N 2.86Å; D59-T61 VanDerWaalsContact OD1-CA 3.31Å; D59-T61 WeakPolarHBondContact OD1-CA 3.46Å; D59-T61 WeakPolarHBondContact OD1-CB 3.29Å; D59-T61 PolarHBondContact OD1-N 3.09Å; D59-T61 PolarHBondContact OD1-OG1 2.75Å; D59-T61 WeakPolarHBondContact OD2-CG2 3.47Å; D59-T61 PolarHBondContact OD2-OG1 2.91Å; D59-G62 PolarHBondContact O-N 3.36Å; D59-G62 PolarHBondContact OD1-N 2.62Å; D59-A63 PolarHBondContact N-O 3.43Å; D59-A63 PolarHBondContact OD1-N 2.83Å; D59-L65 HydrophobicContact CB-CD1 3.71Å; D59-L65 HydrophobicContact CB-CD2 4.01Å; D59-L65 HydrophobicContact CB-CG 3.82Å
60	K	61.9	Low	50.1	Low	213 Å²	213	74.2 Å²	74.2	93%	0.926	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.3	176.6	67.7	-179.9	179.1	-177.5	0	114.2
61	T	65.1	Low	50.6	Low	106 Å²	106	75.4 Å²	75.4	65%	0.65	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.5	178.8	77.7	0	0	0	0	111.8	D59	D59-T61 PolarHBondContact O-N 2.86Å; D59-T61 VanDerWaalsContact OD1-CA 3.31Å; D59-T61 WeakPolarHBondContact OD1-CA 3.46Å; D59-T61 WeakPolarHBondContact OD1-CB 3.29Å; D59-T61 PolarHBondContact OD1-N 3.09Å; D59-T61 PolarHBondContact OD1-OG1 2.75Å; D59-T61 WeakPolarHBondContact OD2-CG2 3.47Å; D59-T61 PolarHBondContact OD2-OG1 2.91Å
62	G	60.7	Low	50.4	Low	54 Å²	54	75.8 Å²	75.8	56%	0.557	41%	0.409	S	S	*	.	S	Bend	trans	96.7	3.8	-174	0	0	0	0	0	113.2	I58 D59	I58-G62 WeakPolarHBondContact CG2-O 3.34Å; D59-G62 PolarHBondContact O-N 3.36Å; D59-G62 PolarHBondContact OD1-N 2.62Å
63	A	58.5	Low	50.4	Low	43 Å²	43	70.9 Å²	70.9	36%	0.355	39%	0.385	S	S	.	.			trans	-77.6	133	177	0	0	0	0	0	111	I58 D59 L65	I58-A63 CarbonylContact C-O 3.44Å; I58-A63 VanDerWaalsContact CA-O 3.25Å; I58-A63 WeakPolarHBondContact CA-O 3.26Å; D59-A63 PolarHBondContact N-O 3.43Å; D59-A63 PolarHBondContact OD1-N 2.83Å; A63-L65 PolarHBondContact O-N 3.37Å
64	V	58.4	Low	50.2	Low	81 Å²	81	76 Å²	76	49%	0.491	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	102.1	176.1	-179.3	0	0	0	0	108.8	W57 I58 V66	W57-V64 CarbonylContact O-C 3.52Å; W57-V64 WeakPolarHBondContact O-CA 3.49Å; I58-V64 HydrophobicContact CD1-CG2 4.5Å; I58-V64 HydrophobicContact CG1-CG2 4.17Å; V64-V66 WeakPolarHBondContact CG1-O 3.24Å
65	L	49	Very low	50.2	Low	40 Å²	40	73 Å²	73	21%	0.209	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-32.2	176.2	-54.4	-173.5	0	0	0	112.4	W57 D59 A63 L115	W57-L65 HydrophobicContact CB-CB 4.33Å; W57-L65 HydrophobicContact CD2-CB 4.48Å; W57-L65 HydrophobicContact CD2-CD1 4.08Å; W57-L65 HydrophobicContact CG-CB 4.26Å; W57-L65 HydrophobicContact CG-CD1 4.33Å; W57-L65 HydrophobicContact CZ2-CD1 4.3Å; W57-L65 PolarHBondContact O-N 2.92Å; D59-L65 HydrophobicContact CB-CD1 3.71Å; D59-L65 HydrophobicContact CB-CD2 4.01Å; D59-L65 HydrophobicContact CB-CG 3.82Å; A63-L65 PolarHBondContact O-N 3.37Å; L65-L115 HydrophobicContact CB-CD1 4.44Å; L65-L115 HydrophobicContact CD1-CD1 3.92Å; L65-L115 HydrophobicContact CD2-CD1 3.72Å; L65-L115 HydrophobicContact CD2-CD2 3.68Å; L65-L115 HydrophobicContact CD2-CG 4.36Å; L65-L115 HydrophobicContact CG-CD1 4.23Å
66	V	51.5	Low	50.1	Low	55 Å²	55	81 Å²	81	33%	0.333	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	115.4	173.7	-179.1	0	0	0	0	107.9	G56 W57 V64 L111	G56-V66 CarbonylContact C-O 3.54Å; G56-V66 WeakPolarHBondContact CA-O 3.3Å; W57-V66 HydrophobicContact CB-CB 3.86Å; W57-V66 HydrophobicContact CB-CG2 3.95Å; W57-V66 PolarHBondContact N-O 3.12Å; W57-V66 PolarHBondContact O-N 3.41Å; W57-V66 VanDerWaalsContact O-N 3.09Å; V64-V66 WeakPolarHBondContact CG1-O 3.24Å; V66-L111 HydrophobicContact CG2-CD2 4.27Å
67	P	55.2	Low	50.1	Low	94 Å²	94	84.6 Å²	84.6	61%	0.61	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55	134.6	177.9	-27.4	35.1	0	0	0	111.5	N69	P67-N69 PolarHBondContact O-N 3.36Å
68	P	51.1	Low	50	Low	53 Å²	53	85.8 Å²	85.8	34%	0.344	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	113.1	-177.7	24.3	-32.5	0	0	0	110.8	R54 L55	R54-P68 HydrophobicContact CG-CB 3.89Å; R54-P68 PolarHBondContact NE-O 3.43Å; R54-P68 PolarHBondContact NH2-O 3.05Å; L55-P68 CarbonylContact O-C 3.51Å; L55-P68 VanDerWaalsContact O-CA 3.31Å; L55-P68 WeakPolarHBondContact O-CA 3.42Å
69	N	46.9	Very low	50	Low	87 Å²	87	87.3 Å²	87.3	47%	0.465	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.1	-178.1	-157.3	-7.3	0	0	0	111	R54 L55 P67 V71	R54-N69 CarbonylContact C-O 3.44Å; R54-N69 VanDerWaalsContact CA-O 3.31Å; R54-N69 WeakPolarHBondContact CA-O 3.44Å; L55-N69 PolarHBondContact N-O 2.82Å; L55-N69 PolarHBondContact O-N 3.36Å; P67-N69 PolarHBondContact O-N 3.36Å; N69-V71 PolarHBondContact O-N 3.36Å
70	F	44.2	Very low	50.1	Low	129 Å²	129	89.2 Å²	89.2	57%	0.566	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	116.3	179.7	-67.1	-80.6	0	0	0	110	M52 Y53 R54	M52-F70 HydrophobicContact CB-CB 4.41Å; M52-F70 HydrophobicContact CB-CD1 4.13Å; Y53-F70 CarbonylContact O-C 3.51Å; Y53-F70 WeakPolarHBondContact O-CA 3.14Å; R54-F70 HydrophobicContact CB-CD1 3.9Å; R54-F70 HydrophobicContact CB-CE1 3.82Å; R54-F70 HydrophobicContact CB-CZ 4.36Å; R54-F70 HydrophobicContact CG-CD1 4.29Å; R54-F70 HydrophobicContact CG-CE1 4.2Å; R54-F70 HydrophobicContact CG-CE2 4.47Å; R54-F70 HydrophobicContact CG-CG 4.49Å; R54-F70 HydrophobicContact CG-CZ 4.29Å
71	V	45.3	Very low	49.5	Very low	52 Å²	52	79.5 Å²	79.5	32%	0.315	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.8	173	-174.9	0	0	0	0	108.4	Y53 L55 N69	Y53-V71 PolarHBondContact N-O 2.82Å; Y53-V71 PolarHBondContact O-N 2.93Å; L55-V71 HydrophobicContact CB-CG2 4.02Å; L55-V71 HydrophobicContact CD1-CB 4.12Å; L55-V71 HydrophobicContact CD1-CG1 4.48Å; L55-V71 HydrophobicContact CD1-CG2 4.06Å; L55-V71 HydrophobicContact CG-CB 4.46Å; L55-V71 HydrophobicContact CG-CG2 4.33Å; N69-V71 PolarHBondContact O-N 3.36Å
72	E	39.2	Very low	48.4	Very low	59 Å²	59	77.4 Å²	77.4	28%	0.276	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	115.2	176.5	-168.7	173.9	-131	0	0	109.3	V45 P46 V50	V45-E72 HydrophobicContact CG1-CB 4.48Å; V45-E72 WeakPolarHBondContact CG1-OE2 3.29Å; P46-E72 VanDerWaalsContact O-OE1 3.1Å; V50-E72 HydrophobicContact CB-CG 3.2Å; V50-E72 VanDerWaalsContact CB-OE1 3.23Å; V50-E72 WeakPolarHBondContact CB-OE1 3.42Å; V50-E72 HydrophobicContact CG1-CB 4.05Å; V50-E72 HydrophobicContact CG1-CG 3Å; V50-E72 HydrophobicContact CG2-CG 3.48Å; V50-E72 VanDerWaalsContact CG2-CG 3.48Å; V50-E72 WeakPolarHBondContact CG2-OE1 3.45Å
73	M	41.7	Very low	47.7	Very low	6 Å²	6	82.5 Å²	82.5	3%	0.03	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.3	174.2	-66	-170.5	-164.3	0	0	112.4	V50 A51 Y53 L55 E75 I81 L94	V50-M73 WeakPolarHBondContact CG1-O 2.85Å; A51-M73 PolarHBondContact O-N 2.81Å; Y53-M73 HydrophobicContact CD2-CB 3.8Å; Y53-M73 HydrophobicContact CD2-CE 4.32Å; Y53-M73 HydrophobicContact CD2-CG 3.83Å; Y53-M73 HydrophobicContact CD2-SD 3.75Å; Y53-M73 HydrophobicContact CE2-CB 4.11Å; Y53-M73 HydrophobicContact CE2-SD 4.26Å; Y53-M73 HydrophobicContact CG-CE 4.14Å; Y53-M73 HydrophobicContact CG-CG 4.5Å; Y53-M73 HydrophobicContact CG-SD 4.1Å; L55-M73 HydrophobicContact CD1-CE 3.31Å; L55-M73 HydrophobicContact CD2-CE 3.88Å; L55-M73 HydrophobicContact CG-CE 3.72Å; M73-E75 PolarHBondContact O-N 3.23Å; M73-I81 HydrophobicContact SD-CD1 3.54Å; M73-I81 VanDerWaalsContact SD-CD1 3.54Å; M73-I81 HydrophobicContact SD-CG1 4.5Å; M73-I81 HydrophobicContact SD-CG2 4.49Å; M73-L94 HydrophobicContact CE-CB 3.49Å; M73-L94 VanDerWaalsContact CE-CB 3.49Å; M73-L94 HydrophobicContact CE-CD1 4.15Å; M73-L94 HydrophobicContact CE-CD2 4.22Å; M73-L94 HydrophobicContact CE-CG 4.16Å; M73-L94 WeakPolarHBondContact CG-O 3.34Å; M73-L94 HydrophobicContact SD-CB 3.77Å; M73-L94 HydrophobicContact SD-CD2 3.7Å; M73-L94 HydrophobicContact SD-CG 4.23Å
74	V	40.1	Very low	47	Very low	138 Å²	138	85 Å²	85	84%	0.836	49%	0.489	S	S	*	.			trans	-79.2	67.6	165.2	-170.4	0	0	0	0	108.4	V50	V50-V74 HydrophobicContact CG2-CG2 4.23Å
75	E	45.3	Very low	46.1	Very low	93 Å²	93	82.6 Å²	82.6	44%	0.435	47%	0.474	S	S	.	.			trans	-107.3	132.7	168.1	-152.7	171.1	-166.6	0	0	110.4	M73 D77 I81	M73-E75 PolarHBondContact O-N 3.23Å; E75-D77 PolarHBondContact O-N 3.49Å; E75-I81 HydrophobicContact CB-CD1 4.11Å; E75-I81 WeakPolarHBondContact OE2-CD1 3.43Å; E75-I81 WeakPolarHBondContact OE2-CG1 3.31Å
76	K	45.8	Very low	45.8	Very low	197 Å²	197	85.3 Å²	85.3	86%	0.857	49%	0.492	S	S	*	.	S	Bend	trans	-71	-20.5	-171.1	-158.4	177.8	178.7	-172.8	0	112.7
77	D	47.5	Very low	45.5	Very low	100 Å²	100	86 Å²	86	54%	0.535	49%	0.494	S	S	.	.			trans	-135.1	97.9	-177.2	-70.9	-51.3	0	0	0	111.4	E75 S79 S80	E75-D77 PolarHBondContact O-N 3.49Å; D77-S79 PolarHBondContact O-N 2.7Å; D77-S80 PolarHBondContact O-N 2.9Å
78	P	47	Very low	45	Very low	80 Å²	80	83.1 Å²	83.1	52%	0.519	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-66.5	-11.7	-173.9	26.8	-36	0	0	0	114.8	Y53	Y53-P78 WeakPolarHBondContact OH-CA 3.35Å; Y53-P78 WeakPolarHBondContact OH-CB 3.37Å; Y53-P78 PolarHBondContact OH-O 2.74Å
79	S	50	Low	44.8	Very low	110 Å²	110	85 Å²	85	77%	0.769	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-78.8	-15.9	-179.6	55.5	0	0	0	0	114.4	D77 I81	D77-S79 PolarHBondContact O-N 2.7Å; S79-I81 VanDerWaalsContact C-N 3.32Å
80	S	47.9	Very low	44.8	Very low	83 Å²	83	82.9 Å²	82.9	58%	0.58	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-84.8	-9.2	179.9	-62	0	0	0	0	113	D77 P82	D77-S80 PolarHBondContact O-N 2.9Å; S80-P82 VanDerWaalsContact O-CD 3.27Å; S80-P82 WeakPolarHBondContact O-CD 3.46Å
81	I	48.7	Very low	44.9	Very low	10 Å²	10	78.4 Å²	78.4	5%	0.051	45%	0.454	C	S	.	.	S	Bend	trans	-89.9	111.9	-177.3	-55.4	176.6	0	0	0	108.9	Y53 M73 E75 S79 L83 L94	Y53-I81 HydrophobicContact CD1-CG2 4.11Å; Y53-I81 HydrophobicContact CD2-CD1 4.11Å; Y53-I81 HydrophobicContact CE1-CB 4.07Å; Y53-I81 HydrophobicContact CE1-CD1 3.9Å; Y53-I81 HydrophobicContact CE1-CG2 3.95Å; Y53-I81 HydrophobicContact CE2-CD1 3.43Å; Y53-I81 VanDerWaalsContact CE2-CD1 3.43Å; Y53-I81 WeakPolarHBondContact OH-CD1 3.25Å; M73-I81 HydrophobicContact SD-CD1 3.54Å; M73-I81 VanDerWaalsContact SD-CD1 3.54Å; M73-I81 HydrophobicContact SD-CG1 4.5Å; M73-I81 HydrophobicContact SD-CG2 4.49Å; E75-I81 HydrophobicContact CB-CD1 4.11Å; E75-I81 WeakPolarHBondContact OE2-CD1 3.43Å; E75-I81 WeakPolarHBondContact OE2-CG1 3.31Å; S79-I81 VanDerWaalsContact C-N 3.32Å; I81-L83 PolarHBondContact O-N 3.13Å; I81-L94 HydrophobicContact CB-CD2 3.99Å; I81-L94 HydrophobicContact CD1-CD2 3.94Å; I81-L94 HydrophobicContact CG1-CD2 3.5Å; I81-L94 HydrophobicContact CG2-CD1 3.84Å; I81-L94 HydrophobicContact CG2-CD2 3.56Å; I81-L94 HydrophobicContact CG2-CG 4.38Å
82	P	43.3	Very low	44.7	Very low	62 Å²	62	79.7 Å²	79.7	40%	0.403	46%	0.456	S	S	.	.			trans	-62.4	114.6	170.1	24.1	-30.5	0	0	0	109.3	S80 A84 T85 V90	S80-P82 VanDerWaalsContact O-CD 3.27Å; S80-P82 WeakPolarHBondContact O-CD 3.46Å; P82-A84 PolarHBondContact O-N 2.92Å; P82-T85 HydrophobicContact CG-CG2 4.38Å; P82-V90 HydrophobicContact CG-CG1 3.92Å
83	L	45.6	Very low	44.6	Very low	161 Å²	161	81.5 Å²	81.5	84%	0.843	48%	0.475	S	S	*	.	S	Bend	trans	-52.9	-23.9	-178.2	-76.7	160.2	0	0	0	114.1	I81	I81-L83 PolarHBondContact O-N 3.13Å
84	A	42.8	Very low	44.5	Very low	96 Å²	96	82.1 Å²	82.1	79%	0.793	48%	0.478	S	S	*	.	S	Bend	trans	-139.1	115	170.5	0	0	0	0	0	107.6	P82	P82-A84 PolarHBondContact O-N 2.92Å
85	T	41	Very low	44.4	Very low	29 Å²	29	76.9 Å²	76.9	18%	0.178	45%	0.452	C	S	.	.			trans	-128.8	133.2	169.3	-178.9	0	0	0	0	108.8	P82 D87 V90 I91 L94	P82-T85 HydrophobicContact CG-CG2 4.38Å; T85-D87 WeakPolarHBondContact OG1-CB 3.43Å; T85-D87 PolarHBondContact OG1-N 2.92Å; T85-V90 HydrophobicContact CG2-CB 4.07Å; T85-V90 HydrophobicContact CG2-CG1 3.9Å; T85-I91 HydrophobicContact CG2-CG1 3.78Å; T85-L94 HydrophobicContact CG2-CD1 4.41Å
86	T	42.3	Very low	43.8	Very low	97 Å²	97	75.7 Å²	75.7	60%	0.595	47%	0.465	S	S	*	.			trans	-96.9	0.5	166.9	57.6	0	0	0	0	111.2	P88	T86-P88 VanDerWaalsContact O-CD 3.28Å; T86-P88 WeakPolarHBondContact O-CD 3.31Å
87	D	44.4	Very low	43.2	Very low	71 Å²	71	72.5 Å²	72.5	38%	0.38	46%	0.456	S	S	.	.			trans	-79.2	111.8	177.1	-173.6	-22	0	0	0	109.4	T85 N89 V90 I91	T85-D87 WeakPolarHBondContact OG1-CB 3.43Å; T85-D87 PolarHBondContact OG1-N 2.92Å; D87-N89 PolarHBondContact O-N 2.87Å; D87-N89 WeakPolarHBondContact OD1-CB 3.19Å; D87-N89 PolarHBondContact OD1-N 3.19Å; D87-N89 PolarHBondContact OD1-ND2 2.74Å; D87-V90 HydrophobicContact CB-CB 4.4Å; D87-V90 HydrophobicContact CB-CG2 3.94Å; D87-V90 PolarHBondContact O-N 2.88Å; D87-I91 PolarHBondContact O-N 2.81Å
88	P	46	Very low	42.5	Very low	32 Å²	32	77.3 Å²	77.3	21%	0.208	47%	0.473	C	S	.	.	H	α-helix	trans	-59.7	-33.1	-178	24	-33	0	0	0	112.3	W57 T86 V90 I91 F92	W57-P88 HydrophobicContact CH2-CB 4.3Å; T86-P88 VanDerWaalsContact O-CD 3.28Å; T86-P88 WeakPolarHBondContact O-CD 3.31Å; P88-V90 VanDerWaalsContact C-N 3.28Å; P88-V90 PolarHBondContact O-N 2.83Å; P88-I91 PolarHBondContact O-N 3.06Å; P88-F92 HydrophobicContact CB-CD2 4.3Å; P88-F92 HydrophobicContact CB-CE2 4.02Å; P88-F92 WeakPolarHBondContact O-CD2 3.03Å; P88-F92 PolarHBondContact O-N 2.79Å
89	N	45.8	Very low	41.9	Very low	92 Å²	92	75.8 Å²	75.8	49%	0.492	47%	0.472	S	S	.	.	H	α-helix	trans	-63	-37	-178.8	-61.5	-68.2	0	0	0	112.2	D87 S93	D87-N89 PolarHBondContact O-N 2.87Å; D87-N89 WeakPolarHBondContact OD1-CB 3.19Å; D87-N89 PolarHBondContact OD1-N 3.19Å; D87-N89 PolarHBondContact OD1-ND2 2.74Å; N89-S93 WeakPolarHBondContact O-CB 3.39Å; N89-S93 PolarHBondContact O-N 2.93Å; N89-S93 VanDerWaalsContact O-N 3.12Å; N89-S93 PolarHBondContact O-OG 3.41Å
90	V	46.8	Very low	41	Very low	44 Å²	44	78.3 Å²	78.3	27%	0.267	48%	0.475	S	S	.	.	H	α-helix	trans	-69.7	-43.6	177.4	-177.3	0	0	0	0	109.4	P82 T85 D87 P88 F92 S93 L94	P82-V90 HydrophobicContact CG-CG1 3.92Å; T85-V90 HydrophobicContact CG2-CB 4.07Å; T85-V90 HydrophobicContact CG2-CG1 3.9Å; D87-V90 HydrophobicContact CB-CB 4.4Å; D87-V90 HydrophobicContact CB-CG2 3.94Å; D87-V90 PolarHBondContact O-N 2.88Å; P88-V90 VanDerWaalsContact C-N 3.28Å; P88-V90 PolarHBondContact O-N 2.83Å; V90-F92 PolarHBondContact O-N 2.91Å; V90-S93 PolarHBondContact O-N 3.23Å; V90-L94 HydrophobicContact CG1-CD1 3.73Å; V90-L94 HydrophobicContact CG1-CG 4.15Å; V90-L94 VanDerWaalsContact O-CB 3.27Å; V90-L94 WeakPolarHBondContact O-CB 3.39Å; V90-L94 WeakPolarHBondContact O-CD1 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.48Å; V90-L94 PolarHBondContact O-N 3.16Å
91	I	45.5	Very low	40.4	Very low	35 Å²	35	77.7 Å²	77.7	18%	0.179	48%	0.481	C	S	.	.	H	α-helix	trans	-59.7	-44.8	176.6	-58.7	172.2	0	0	0	111.5	L55 T85 D87 P88 S93 L94 G95	L55-I91 HydrophobicContact CD1-CG2 4.28Å; T85-I91 HydrophobicContact CG2-CG1 3.78Å; D87-I91 PolarHBondContact O-N 2.81Å; P88-I91 PolarHBondContact O-N 3.06Å; I91-S93 VanDerWaalsContact C-N 3.34Å; I91-S93 PolarHBondContact O-N 3.25Å; I91-L94 PolarHBondContact O-N 3.3Å; I91-G95 PolarHBondContact O-N 3.01Å; I91-G95 VanDerWaalsContact O-N 3.08Å
92	F	41.7	Very low	40.1	Very low	79 Å²	79	82.9 Å²	82.9	35%	0.346	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-37.7	177.4	-76.5	-67	0	0	0	112.9	P88 V90 H104 V107	P88-F92 HydrophobicContact CB-CD2 4.3Å; P88-F92 HydrophobicContact CB-CE2 4.02Å; P88-F92 WeakPolarHBondContact O-CD2 3.03Å; P88-F92 PolarHBondContact O-N 2.79Å; V90-F92 PolarHBondContact O-N 2.91Å; F92-H104 AromaticContact CD2-CD2 3.78Å; F92-H104 AromaticContact CE2-CD2 3.52Å; F92-V107 HydrophobicContact CE1-CB 4.05Å; F92-V107 HydrophobicContact CE1-CG1 3.85Å; F92-V107 HydrophobicContact CE1-CG2 4.2Å; F92-V107 HydrophobicContact CZ-CB 3.91Å; F92-V107 HydrophobicContact CZ-CG1 3.68Å
93	S	37.9	Very low	40.3	Very low	96 Å²	96	83.7 Å²	83.7	67%	0.671	51%	0.507	S	S	*	.	H	α-helix	trans	-70.7	-41.8	178.4	-56.5	0	0	0	0	111.5	N89 V90 I91 G95 G96	N89-S93 WeakPolarHBondContact O-CB 3.39Å; N89-S93 PolarHBondContact O-N 2.93Å; N89-S93 VanDerWaalsContact O-N 3.12Å; N89-S93 PolarHBondContact O-OG 3.41Å; V90-S93 PolarHBondContact O-N 3.23Å; I91-S93 VanDerWaalsContact C-N 3.34Å; I91-S93 PolarHBondContact O-N 3.25Å; S93-G95 VanDerWaalsContact C-N 3.3Å; S93-G95 PolarHBondContact O-N 3.3Å; S93-G96 PolarHBondContact O-N 3.28Å
94	L	39.7	Very low	40.3	Very low	19 Å²	19	80 Å²	80	10%	0.099	49%	0.485	C	S	.	.	H	α-helix	trans	-64.8	-30.5	178.2	-76.7	172.9	0	0	0	113.4	M73 I81 T85 V90 I91 G96	M73-L94 HydrophobicContact CE-CB 3.49Å; M73-L94 VanDerWaalsContact CE-CB 3.49Å; M73-L94 HydrophobicContact CE-CD1 4.15Å; M73-L94 HydrophobicContact CE-CD2 4.22Å; M73-L94 HydrophobicContact CE-CG 4.16Å; M73-L94 WeakPolarHBondContact CG-O 3.34Å; M73-L94 HydrophobicContact SD-CB 3.77Å; M73-L94 HydrophobicContact SD-CD2 3.7Å; M73-L94 HydrophobicContact SD-CG 4.23Å; I81-L94 HydrophobicContact CB-CD2 3.99Å; I81-L94 HydrophobicContact CD1-CD2 3.94Å; I81-L94 HydrophobicContact CG1-CD2 3.5Å; I81-L94 HydrophobicContact CG2-CD1 3.84Å; I81-L94 HydrophobicContact CG2-CD2 3.56Å; I81-L94 HydrophobicContact CG2-CG 4.38Å; T85-L94 HydrophobicContact CG2-CD1 4.41Å; V90-L94 HydrophobicContact CG1-CD1 3.73Å; V90-L94 HydrophobicContact CG1-CG 4.15Å; V90-L94 VanDerWaalsContact O-CB 3.27Å; V90-L94 WeakPolarHBondContact O-CB 3.39Å; V90-L94 WeakPolarHBondContact O-CD1 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.48Å; V90-L94 PolarHBondContact O-N 3.16Å; I91-L94 PolarHBondContact O-N 3.3Å; L94-G96 PolarHBondContact O-N 2.82Å
95	G	36.5	Very low	40.8	Very low	28 Å²	28	81.6 Å²	81.6	29%	0.289	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-4.4	176.7	0	0	0	0	0	115.1	I91 S93 L97	I91-G95 PolarHBondContact O-N 3.01Å; I91-G95 VanDerWaalsContact O-N 3.08Å; S93-G95 VanDerWaalsContact C-N 3.3Å; S93-G95 PolarHBondContact O-N 3.3Å; G95-L97 PolarHBondContact O-N 2.94Å
96	G	32.7	Very low	41.4	Very low	69 Å²	69	84.1 Å²	84.1	71%	0.711	48%	0.484	S	S	*	.			trans	62.3	-17.5	177.2	0	0	0	0	0	115.6	S93 L94 K98	S93-G96 PolarHBondContact O-N 3.28Å; L94-G96 PolarHBondContact O-N 2.82Å; G96-K98 PolarHBondContact O-N 3.43Å
97	L	34.1	Very low	41.7	Very low	129 Å²	129	81.5 Å²	81.5	68%	0.675	47%	0.468	S	S	*	.			trans	-91.5	93.8	177	-68.2	165.8	0	0	0	106.2	G95 G99	G95-L97 PolarHBondContact O-N 2.94Å; L97-G99 PolarHBondContact O-N 3.41Å
98	K	33.2	Very low	42.1	Very low	202 Å²	202	81.7 Å²	81.7	88%	0.878	47%	0.467	S	S	*	.			trans	-52.9	90	147.6	-169	176.6	-173.2	-177.5	0	105.5	G96 I100	G96-K98 PolarHBondContact O-N 3.43Å; K98-I100 PolarHBondContact O-N 3.33Å
99	G	33.5	Very low	42.7	Very low	48 Å²	48	84.5 Å²	84.5	50%	0.495	48%	0.477	S	S	.	.			trans	-47.1	115.3	-162.2	0	0	0	0	0	110.1	L97 G101	L97-G99 PolarHBondContact O-N 3.41Å; G99-G101 VanDerWaalsContact C-N 3.29Å; G99-G101 PolarHBondContact O-N 3.11Å
100	I	32.4	Very low	43.1	Very low	163 Å²	163	87 Å²	87	84%	0.836	48%	0.484	S	S	*	.	S	Bend	trans	-59.7	99.8	170	-65.4	166.1	0	0	0	105.6	K98	K98-I100 PolarHBondContact O-N 3.33Å
101	G	35.4	Very low	43.2	Very low	69 Å²	69	87 Å²	87	71%	0.711	48%	0.482	S	S	*	.	S	Bend	trans	90.8	0.2	162.8	0	0	0	0	0	118.5	G99	G99-G101 VanDerWaalsContact C-N 3.29Å; G99-G101 PolarHBondContact O-N 3.11Å
102	K	41	Very low	43.6	Very low	120 Å²	120	90.1 Å²	90.1	52%	0.522	50%	0.496	S	S	.	.			trans	-122.9	119.2	172.7	-61.3	-173.3	-176.4	170.4	0	111.3	E106 V107	K102-E106 VanDerWaalsContact CA-OE2 3.3Å; K102-E106 WeakPolarHBondContact CA-OE2 3.31Å; K102-E106 HydrophobicContact CB-CB 4.37Å; K102-E106 WeakPolarHBondContact CB-OE2 3.03Å; K102-E106 WeakPolarHBondContact CG-OE2 3.23Å; K102-V107 HydrophobicContact CB-CG2 4.18Å
103	T	47.8	Very low	44.2	Very low	79 Å²	79	90.6 Å²	90.6	49%	0.485	51%	0.508	S	S	.	.			trans	-65.2	154	174.7	61.8	0	0	0	0	110.2	K105 E106 V107	T103-K105 PolarHBondContact O-N 2.83Å; T103-K105 VanDerWaalsContact O-N 3.11Å; T103-E106 PolarHBondContact O-N 3.43Å; T103-E106 PolarHBondContact OG1-N 2.74Å; T103-E106 PolarHBondContact OG1-OE1 2.93Å; T103-V107 PolarHBondContact O-N 2.75Å
104	H	45.9	Very low	44.8	Very low	82 Å²	82	88.1 Å²	88.1	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-45.2	-43.1	171.5	167.8	-89.1	0	0	0	111.6	F92 E106 V107 Q108	F92-H104 AromaticContact CD2-CD2 3.78Å; F92-H104 AromaticContact CE2-CD2 3.52Å; H104-E106 PolarHBondContact O-N 2.84Å; H104-V107 PolarHBondContact O-N 3.05Å; H104-Q108 PolarHBondContact CE1-OE1 3.08Å; H104-Q108 WeakPolarHBondContact O-CB 3.28Å; H104-Q108 PolarHBondContact O-N 3.2Å
105	K	53.5	Low	45.2	Very low	130 Å²	130	90.2 Å²	90.2	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-57.6	-43.8	177.7	-176.2	176.5	171.9	-178.5	0	112.6	T103 Q108 E109	T103-K105 PolarHBondContact O-N 2.83Å; T103-K105 VanDerWaalsContact O-N 3.11Å; K105-Q108 PolarHBondContact O-N 3.42Å; K105-E109 WeakPolarHBondContact CE-OE1 3.41Å; K105-E109 HydrophobicContact CG-CG 4.38Å; K105-E109 IonicContact NZ-OE1 3.73Å; K105-E109 WeakPolarHBondContact O-CB 3.09Å; K105-E109 WeakPolarHBondContact O-CG 3.39Å; K105-E109 PolarHBondContact O-N 3.43Å
106	E	54.2	Low	46	Very low	82 Å²	82	92.9 Å²	92.9	38%	0.383	52%	0.518	S	S	.	.	H	α-helix	trans	-68.4	-36.9	179.5	-76	164	-136.9	0	0	113.1	K102 T103 H104 K110	K102-E106 VanDerWaalsContact CA-OE2 3.3Å; K102-E106 WeakPolarHBondContact CA-OE2 3.31Å; K102-E106 HydrophobicContact CB-CB 4.37Å; K102-E106 WeakPolarHBondContact CB-OE2 3.03Å; K102-E106 WeakPolarHBondContact CG-OE2 3.23Å; T103-E106 PolarHBondContact O-N 3.43Å; T103-E106 PolarHBondContact OG1-N 2.74Å; T103-E106 PolarHBondContact OG1-OE1 2.93Å; H104-E106 PolarHBondContact O-N 2.84Å; E106-K110 WeakPolarHBondContact O-CB 3.48Å; E106-K110 PolarHBondContact O-N 2.92Å
107	V	48.6	Very low	46.9	Very low	43 Å²	43	92.9 Å²	92.9	26%	0.261	51%	0.512	S	S	.	.	H	α-helix	trans	-69.4	-43.2	176.1	-179.5	0	0	0	0	109.7	F92 K102 T103 H104 K110 L111	F92-V107 HydrophobicContact CE1-CB 4.05Å; F92-V107 HydrophobicContact CE1-CG1 3.85Å; F92-V107 HydrophobicContact CE1-CG2 4.2Å; F92-V107 HydrophobicContact CZ-CB 3.91Å; F92-V107 HydrophobicContact CZ-CG1 3.68Å; K102-V107 HydrophobicContact CB-CG2 4.18Å; T103-V107 PolarHBondContact O-N 2.75Å; H104-V107 PolarHBondContact O-N 3.05Å; V107-K110 PolarHBondContact O-N 2.72Å; V107-L111 HydrophobicContact CG1-CD1 3.87Å; V107-L111 HydrophobicContact CG1-CG 4.43Å; V107-L111 WeakPolarHBondContact O-CB 3.46Å; V107-L111 VanDerWaalsContact O-CG 3.26Å; V107-L111 WeakPolarHBondContact O-CG 3.12Å; V107-L111 PolarHBondContact O-N 3.46Å
108	Q	51.5	Low	47.5	Very low	75 Å²	75	92.7 Å²	92.7	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-59.5	-52.3	175	-177.4	-178.7	-13	0	0	111.4	H104 K105 K110 L111 E112	H104-Q108 PolarHBondContact CE1-OE1 3.08Å; H104-Q108 WeakPolarHBondContact O-CB 3.28Å; H104-Q108 PolarHBondContact O-N 3.2Å; K105-Q108 PolarHBondContact O-N 3.42Å; Q108-K110 VanDerWaalsContact C-N 3.3Å; Q108-K110 PolarHBondContact O-N 3.42Å; Q108-L111 PolarHBondContact O-N 3.17Å; Q108-L111 VanDerWaalsContact O-N 3.12Å; Q108-E112 HydrophobicContact CG-CG 4.43Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.44Å; Q108-E112 PolarHBondContact NE2-OE1 3.05Å; Q108-E112 WeakPolarHBondContact O-CG 2.95Å; Q108-E112 PolarHBondContact O-N 2.67Å
109	E	59.9	Low	48	Very low	91 Å²	91	89.2 Å²	89.2	43%	0.425	50%	0.499	S	S	.	.	H	α-helix	trans	-59.1	-41.8	177.5	-78.1	177.3	174.1	0	0	111.3	K105 L111 E112 C113	K105-E109 WeakPolarHBondContact CE-OE1 3.41Å; K105-E109 HydrophobicContact CG-CG 4.38Å; K105-E109 IonicContact NZ-OE1 3.73Å; K105-E109 WeakPolarHBondContact O-CB 3.09Å; K105-E109 WeakPolarHBondContact O-CG 3.39Å; K105-E109 PolarHBondContact O-N 3.43Å; E109-L111 VanDerWaalsContact C-N 3.3Å; E109-L111 PolarHBondContact O-N 3.33Å; E109-E112 PolarHBondContact O-N 2.85Å; E109-C113 VanDerWaalsContact O-CB 3.32Å; E109-C113 WeakPolarHBondContact O-CB 3.35Å; E109-C113 PolarHBondContact O-N 3Å; E109-C113 PolarHBondContact O-SG 2.95Å; E109-C113 VanDerWaalsContact O-SG 3.39Å
110	K	53.1	Low	48.7	Very low	144 Å²	144	94.8 Å²	94.8	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-67.3	-32.2	178.7	-166.9	164.3	-175	168.2	0	112.5	E106 V107 Q108 A114	E106-K110 WeakPolarHBondContact O-CB 3.48Å; E106-K110 PolarHBondContact O-N 2.92Å; V107-K110 PolarHBondContact O-N 2.72Å; Q108-K110 VanDerWaalsContact C-N 3.3Å; Q108-K110 PolarHBondContact O-N 3.42Å; K110-A114 VanDerWaalsContact O-CB 3.32Å; K110-A114 WeakPolarHBondContact O-CB 3.47Å; K110-A114 PolarHBondContact O-N 3.36Å
111	L	48.4	Very low	49.3	Very low	45 Å²	45	94.3 Å²	94.3	24%	0.236	51%	0.508	C	S	.	.	H	α-helix	trans	-73.8	-43.4	173.6	-73.3	168.3	0	0	0	111.5	W57 V66 V107 Q108 E109 C113 A114 L115	W57-L111 HydrophobicContact CE3-CD1 3.9Å; W57-L111 HydrophobicContact CZ3-CD1 3.45Å; W57-L111 VanDerWaalsContact CZ3-CD1 3.45Å; V66-L111 HydrophobicContact CG2-CD2 4.27Å; V107-L111 HydrophobicContact CG1-CD1 3.87Å; V107-L111 HydrophobicContact CG1-CG 4.43Å; V107-L111 WeakPolarHBondContact O-CB 3.46Å; V107-L111 VanDerWaalsContact O-CG 3.26Å; V107-L111 WeakPolarHBondContact O-CG 3.12Å; V107-L111 PolarHBondContact O-N 3.46Å; Q108-L111 PolarHBondContact O-N 3.17Å; Q108-L111 VanDerWaalsContact O-N 3.12Å; E109-L111 VanDerWaalsContact C-N 3.3Å; E109-L111 PolarHBondContact O-N 3.33Å; L111-C113 VanDerWaalsContact C-N 3.31Å; L111-C113 PolarHBondContact O-N 2.7Å; L111-A114 PolarHBondContact O-N 3.06Å; L111-L115 WeakPolarHBondContact O-CB 3Å; L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 VanDerWaalsContact O-CG 3.24Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 3.06Å
112	E	55.5	Low	49.5	Very low	100 Å²	100	99.6 Å²	99.6	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-40.4	173.6	-72.3	176.8	-169.8	0	0	111.6	Q108 E109 S116	Q108-E112 HydrophobicContact CG-CG 4.43Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.44Å; Q108-E112 PolarHBondContact NE2-OE1 3.05Å; Q108-E112 WeakPolarHBondContact O-CG 2.95Å; Q108-E112 PolarHBondContact O-N 2.67Å; E109-E112 PolarHBondContact O-N 2.85Å; E112-S116 WeakPolarHBondContact O-CB 3.27Å; E112-S116 PolarHBondContact O-N 2.9Å; E112-S116 PolarHBondContact O-OG 3.21Å
113	C	54.6	Low	49.6	Very low	89 Å²	89	99.9 Å²	99.9	60%	0.601	52%	0.517	S	S	*	.	H	α-helix	trans	-68	-42.4	174.3	-77.8	0	0	0	0	112.8	E109 L111 S116 A117	E109-C113 VanDerWaalsContact O-CB 3.32Å; E109-C113 WeakPolarHBondContact O-CB 3.35Å; E109-C113 PolarHBondContact O-N 3Å; E109-C113 PolarHBondContact O-SG 2.95Å; E109-C113 VanDerWaalsContact O-SG 3.39Å; L111-C113 VanDerWaalsContact C-N 3.31Å; L111-C113 PolarHBondContact O-N 2.7Å; C113-S116 PolarHBondContact O-N 3.22Å; C113-A117 WeakPolarHBondContact O-CB 3.02Å; C113-A117 PolarHBondContact O-N 3.2Å
114	A	49.9	Very low	49.6	Very low	44 Å²	44	102.6 Å²	102.6	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-60.6	-47.9	177.6	0	0	0	0	0	110.3	K110 L111 S116 A117 E118	K110-A114 VanDerWaalsContact O-CB 3.32Å; K110-A114 WeakPolarHBondContact O-CB 3.47Å; K110-A114 PolarHBondContact O-N 3.36Å; L111-A114 PolarHBondContact O-N 3.06Å; A114-S116 PolarHBondContact O-N 3.32Å; A114-A117 WeakPolarHBondContact O-CB 3.21Å; A114-A117 PolarHBondContact O-N 3.24Å; A114-A117 VanDerWaalsContact O-N 3.08Å; A114-E118 WeakPolarHBondContact O-CG 3.27Å; A114-E118 PolarHBondContact O-N 3.02Å
115	L	47.8	Very low	49.6	Very low	62 Å²	62	105.2 Å²	105.2	33%	0.325	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-36.6	179	-66.7	167.1	0	0	0	113.2	L65 L111 A117 E118	L65-L115 HydrophobicContact CB-CD1 4.44Å; L65-L115 HydrophobicContact CD1-CD1 3.92Å; L65-L115 HydrophobicContact CD2-CD1 3.72Å; L65-L115 HydrophobicContact CD2-CD2 3.68Å; L65-L115 HydrophobicContact CD2-CG 4.36Å; L65-L115 HydrophobicContact CG-CD1 4.23Å; L111-L115 WeakPolarHBondContact O-CB 3Å; L111-L115 WeakPolarHBondContact O-CD1 3.18Å; L111-L115 VanDerWaalsContact O-CG 3.24Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 3.06Å; L115-A117 VanDerWaalsContact C-N 3.28Å; L115-A117 PolarHBondContact O-N 2.93Å; L115-E118 PolarHBondContact O-N 3.33Å
116	S	52.3	Low	49.1	Very low	84 Å²	84	107.5 Å²	107.5	59%	0.587	56%	0.563	S	S	*	*	H	α-helix	trans	-67.2	-30.7	173.6	-58.6	0	0	0	0	112.3	E112 C113 A114	E112-S116 WeakPolarHBondContact O-CB 3.27Å; E112-S116 PolarHBondContact O-N 2.9Å; E112-S116 PolarHBondContact O-OG 3.21Å; C113-S116 PolarHBondContact O-N 3.22Å; A114-S116 PolarHBondContact O-N 3.32Å
117	A	51.7	Low	48.6	Very low	70 Å²	70	111.9 Å²	111.9	58%	0.579	58%	0.584	S	S	*	*	H	α-helix	trans	-74.9	-26	179.1	0	0	0	0	0	112.9	C113 A114 L115	C113-A117 WeakPolarHBondContact O-CB 3.02Å; C113-A117 PolarHBondContact O-N 3.2Å; A114-A117 WeakPolarHBondContact O-CB 3.21Å; A114-A117 PolarHBondContact O-N 3.24Å; A114-A117 VanDerWaalsContact O-N 3.08Å; L115-A117 VanDerWaalsContact C-N 3.28Å; L115-A117 PolarHBondContact O-N 2.93Å
118	E	47.1	Very low	48.5	Very low	125 Å²	125	114.8 Å²	114.8	58%	0.584	60%	0.602	S	S	*	*	H	α-helix	trans	-78.8	-24.3	178.9	-32	-159.9	165.1	0	0	112.1	A114 L115 E120 M121	A114-E118 WeakPolarHBondContact O-CG 3.27Å; A114-E118 PolarHBondContact O-N 3.02Å; L115-E118 PolarHBondContact O-N 3.33Å; E118-E120 VanDerWaalsContact C-N 3.33Å; E118-E120 PolarHBondContact O-N 3.32Å; E118-M121 PolarHBondContact O-N 2.78Å
119	D	44.4	Very low	48.1	Very low	129 Å²	129	118 Å²	118	69%	0.69	62%	0.616	S	S	*	*	H	α-helix	trans	-75.6	-19.7	-178.8	-142.1	13.2	0	0	0	112.9
120	E	48.6	Very low	47.4	Very low	164 Å²	164	122.4 Å²	122.4	77%	0.766	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-7.5	174.4	-64.1	-142.9	157.4	0	0	114	E118 F122	E118-E120 VanDerWaalsContact C-N 3.33Å; E118-E120 PolarHBondContact O-N 3.32Å; E120-F122 VanDerWaalsContact C-N 3.34Å
121	M	43.5	Very low	46.9	Very low	153 Å²	153	122.1 Å²	122.1	75%	0.754	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-9.5	177	-162	178.7	69.9	0	0	113.2	E118	E118-M121 PolarHBondContact O-N 2.78Å
122	F	40.4	Very low	46.5	Very low	180 Å²	180	126.5 Å²	126.5	79%	0.789	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	11.7	179.5	-89.6	-80.1	0	0	0	115	E120	E120-F122 VanDerWaalsContact C-N 3.34Å
123	I	43.5	Very low	46.4	Very low	126 Å²	126	129.2 Å²	129.2	65%	0.646	68%	0.68	S	S	*	*	S	Bend	trans	-117	86.6	168.3	-25.3	174.8	0	0	0	107.8
124	D	46.4	Very low	46.3	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	68%	0.684	S	S	*	*	S	Bend	trans	156.3	66.4	145.6	-81	-21.5	0	0	0	110.7
125	T	46.3	Very low	46.3	Very low	137 Å²	137	136 Å²	136	84%	0.84	70%	0.704	S	S	*	*	S	Bend	trans	-150.4	34.1	151.3	-28.7	0	0	0	0	114.8
126	E	44	Very low	46.8	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	75%	0.752	S	S	*	*			trans	-138.1	52.1	157.8	-65.7	-157.3	172.7	0	0	111.4	T128	E126-T128 PolarHBondContact O-N 3.12Å; E126-T128 VanDerWaalsContact O-N 3.14Å
127	H	42.5	Very low	46.5	Very low	175 Å²	175	146.5 Å²	146.5	81%	0.81	76%	0.76	S	S	*	*			trans	-76.9	71	148.1	-99.4	7.7	0	0	0	108.4	H129	H127-H129 PolarHBondContact O-N 3.28Å
128	T	47.3	Very low	46.3	Very low	104 Å²	104	150.5 Å²	150.5	64%	0.638	77%	0.77	S	S	*	*			trans	-74.4	89.4	161.3	-48.1	0	0	0	0	106.5	E126 E130	E126-T128 PolarHBondContact O-N 3.12Å; E126-T128 VanDerWaalsContact O-N 3.14Å; T128-E130 HydrophobicContact CG2-CG 4.09Å; T128-E130 PolarHBondContact O-N 3.34Å
129	H	42	Very low	46.2	Very low	141 Å²	141	151.9 Å²	151.9	65%	0.653	78%	0.78	S	S	*	*			trans	-63.8	82.5	170.1	-134.3	-87	0	0	0	108.2	H127 E131	H127-H129 PolarHBondContact O-N 3.28Å; H129-E131 IonicContact CE1-OE2 3.23Å; H129-E131 PolarHBondContact CE1-OE2 3.33Å; H129-E131 VanDerWaalsContact CE1-OE2 3.23Å; H129-E131 IonicContact ND1-OE2 3.79Å; H129-E131 PolarHBondContact O-N 3.06Å
130	E	46.4	Very low	46.3	Very low	185 Å²	185	153.2 Å²	153.2	86%	0.864	79%	0.785	S	S	*	*			trans	-90.1	70.2	159.5	-62.7	-164.7	114.2	0	0	107.7	T128	T128-E130 HydrophobicContact CG2-CG 4.09Å; T128-E130 PolarHBondContact O-N 3.34Å
131	E	42.2	Very low	46.2	Very low	137 Å²	137	152.6 Å²	152.6	64%	0.64	79%	0.786	S	S	*	*			trans	-80.8	138.1	163.3	-170.3	177.2	112.7	0	0	108.8	H129	H129-E131 IonicContact CE1-OE2 3.23Å; H129-E131 PolarHBondContact CE1-OE2 3.33Å; H129-E131 VanDerWaalsContact CE1-OE2 3.23Å; H129-E131 IonicContact ND1-OE2 3.79Å; H129-E131 PolarHBondContact O-N 3.06Å
132	E	40	Very low	46.3	Very low	138 Å²	138	152.5 Å²	152.5	65%	0.645	79%	0.789	S	S	*	*			trans	86.1	87.6	157	-129.6	-176.8	128.2	0	0	119.2
133	V	54.1	Low	46.8	Very low	157 Å²	157	150.6 Å²	150.6	95%	0.952	79%	0.788	S	S	*	*				-124.1	109.5	127.6	-175.3	0	0	0	0	109.2
134	K	51.2	Low	47	Very low	158 Å²	158	152.5 Å²	152.5	69%	0.687	80%	0.799	S	S	*	*			trans	-65.6	152.5	-172.6	-167.5	174.3	-172.8	168.7	0	113.8
135	P	49.7	Very low	47.1	Very low	118 Å²	118	153.8 Å²	153.8	77%	0.766	81%	0.805	S	S	*	*			trans	-83.3	143.5	-177.5	33.4	-33.8	0	0	0	112.5
136	T	59.3	Low	47.2	Very low	218 Å²	218	155.4 Å²	155.4	100%	1.337	80%	0.802	S	S	*	*			trans	-147.4	0	151.5	-49.3	0	0	0	0	108.7

Retrieved 136 of 136 residues in 50.9 ms (Link to these results)

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