G4VTF1_SCHMA Loading...

Mitochondrial import inner membrane translocase subunit Tim23

AlphaFold DB , UniProt , Accession G4VTF1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 185 aa.

Structure Viewer

Loading PAE data...

(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	37.3	Very low	45	Very low	245 Å²	245	145.7 Å²	145.7	100%	1.207	80%	0.796	S	S	*	*				0	91.2	0	-81.8	161.3	161.4	0	0	107.7	S3	M1-S3 PolarHBondContact O-N 3.14Å
2	T	35.8	Very low	45.9	Very low	144 Å²	144	149.7 Å²	149.7	88%	0.883	80%	0.801	S	S	*	*			trans	-83.2	99.6	-179.3	43.3	0	0	0	0	108.8	S4	T2-S4 PolarHBondContact O-N 3.05Å
3	S	39.5	Very low	46.9	Very low	127 Å²	127	144.8 Å²	144.8	89%	0.888	78%	0.78	S	S	*	*			trans	-74.5	109.9	169.2	-86.2	0	0	0	0	108.9	M1	M1-S3 PolarHBondContact O-N 3.14Å
4	S	38	Very low	47.9	Very low	109 Å²	109	137.7 Å²	137.7	76%	0.762	75%	0.746	S	S	*	*			trans	-76.2	121.3	176.9	64.2	0	0	0	0	111.3	T2	T2-S4 PolarHBondContact O-N 3.05Å
5	N	39.3	Very low	48.9	Very low	121 Å²	121	137 Å²	137	65%	0.647	75%	0.752	S	S	*	*				44.7	85.4	128.9	-138.2	31.2	0	0	0	117.1	D8	N5-D8 PolarHBondContact ND2-OD2 3.46Å
6	S	48.8	Very low	49.5	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	76%	0.757	S	S	*	*			trans	-100.6	12.2	171.8	43.2	0	0	0	0	114
7	D	50.2	Low	50.3	Low	120 Å²	120	136.9 Å²	136.9	64%	0.642	74%	0.738	S	S	*	*			trans	-102.3	-2.3	-168.7	-78	-25.7	0	0	0	116.3	R9	D7-R9 PolarHBondContact O-N 3.26Å
8	D	48.8	Very low	51.4	Low	134 Å²	134	137.4 Å²	137.4	72%	0.717	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	17.7	-177.6	-73.3	-35.5	0	0	0	115	N5	N5-D8 PolarHBondContact ND2-OD2 3.46Å
9	R	52.8	Low	52.1	Low	228 Å²	228	138.2 Å²	138.2	86%	0.86	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	12.3	176.7	-65.9	-140.9	-61	179.4	1	115.2	D7 I11	D7-R9 PolarHBondContact O-N 3.26Å; R9-I11 VanDerWaalsContact C-N 3.27Å; R9-I11 PolarHBondContact O-N 3.11Å; R9-I11 VanDerWaalsContact O-N 3.08Å
10	N	48.1	Very low	52.7	Low	142 Å²	142	136.1 Å²	136.1	76%	0.759	73%	0.725	S	S	*	*			trans	-86.4	61.4	176.4	-71.4	-45.1	0	0	0	112.1	F12	N10-F12 VanDerWaalsContact C-N 3.29Å; N10-F12 PolarHBondContact O-N 3.12Å
11	I	56.9	Low	53.2	Low	126 Å²	126	131.3 Å²	131.3	65%	0.646	70%	0.702	S	S	*	*	S	Bend	trans	-71.1	93.6	160.4	-62.8	165.5	0	0	0	106.2	R9 V13	R9-I11 VanDerWaalsContact C-N 3.27Å; R9-I11 PolarHBondContact O-N 3.11Å; R9-I11 VanDerWaalsContact O-N 3.08Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 VanDerWaalsContact O-CG2 3.29Å; I11-V13 WeakPolarHBondContact O-CG2 3.37Å; I11-V13 PolarHBondContact O-N 3.3Å
12	F	55.2	Low	54.4	Low	193 Å²	193	123.3 Å²	123.3	85%	0.846	67%	0.669	S	S	*	*			trans	15.8	67.7	163.1	-156.8	-97.1	0	0	0	115.4	N10 S14	N10-F12 VanDerWaalsContact C-N 3.29Å; N10-F12 PolarHBondContact O-N 3.12Å; F12-S14 PolarHBondContact O-N 3.36Å
13	V	58.7	Low	55.7	Low	87 Å²	87	122.2 Å²	122.2	53%	0.527	66%	0.657	S	S	.	*			trans	-81.1	98.6	175.1	-175.3	0	0	0	0	106.8	I11 P21	I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 VanDerWaalsContact O-CG2 3.29Å; I11-V13 WeakPolarHBondContact O-CG2 3.37Å; I11-V13 PolarHBondContact O-N 3.3Å; V13-P21 HydrophobicContact CG2-CG 4.03Å
14	S	61.8	Low	56.8	Low	45 Å²	45	122.9 Å²	122.9	32%	0.315	65%	0.65	S	S	.	*			trans	-68.8	138	175	68.4	0	0	0	0	110	F12 F16 L17	F12-S14 PolarHBondContact O-N 3.36Å; S14-F16 PolarHBondContact O-N 3.07Å; S14-L17 WeakPolarHBondContact O-CB 3.48Å; S14-L17 PolarHBondContact O-N 3.49Å
15	P	62	Low	57.7	Low	127 Å²	127	122.3 Å²	122.3	83%	0.825	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-4.1	-177.6	-25.4	33.8	0	0	0	116.2
16	F	59.5	Low	58.4	Low	193 Å²	193	119.8 Å²	119.8	85%	0.846	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-2.5	178.8	-59.1	-71.2	0	0	0	113.1	S14 N18	S14-F16 PolarHBondContact O-N 3.07Å; F16-N18 PolarHBondContact O-N 3.31Å
17	L	62.6	Low	58.7	Low	80 Å²	80	118.4 Å²	118.4	42%	0.419	62%	0.618	S	S	.	*			trans	-82.4	101.6	176.4	-154.5	73.9	0	0	0	108.6	S14 F19 P21	S14-L17 WeakPolarHBondContact O-CB 3.48Å; S14-L17 PolarHBondContact O-N 3.49Å; L17-F19 WeakPolarHBondContact CD2-O 3.13Å; L17-F19 WeakPolarHBondContact CG-O 3.37Å; L17-F19 PolarHBondContact O-N 3.16Å; L17-P21 HydrophobicContact CD2-CB 4.34Å; L17-P21 HydrophobicContact CD2-CG 4.45Å
18	N	69.6	Low	59.1	Low	146 Å²	146	117.9 Å²	117.9	78%	0.781	62%	0.621	S	S	*	*			trans	-79.9	9.5	-178.6	-143.7	13.2	0	0	0	113.3	F16	F16-N18 PolarHBondContact O-N 3.31Å
19	F	65.1	Low	59.4	Low	152 Å²	152	119 Å²	119	67%	0.667	62%	0.622	S	S	*	*	S	Bend	trans	-137.3	139.3	-178.9	-52.9	-71.3	0	0	0	109.4	L17 I23	L17-F19 WeakPolarHBondContact CD2-O 3.13Å; L17-F19 WeakPolarHBondContact CG-O 3.37Å; L17-F19 PolarHBondContact O-N 3.16Å; F19-I23 HydrophobicContact CB-CD1 4.25Å
20	D	64	Low	59.4	Low	96 Å²	96	114.1 Å²	114.1	51%	0.513	61%	0.609	S	S	.	*			trans	-61.7	124.8	-178.6	-172.8	-26.1	0	0	0	110.5	S22 I23	D20-S22 PolarHBondContact O-N 2.79Å; D20-S22 VanDerWaalsContact O-N 3.1Å; D20-S22 WeakPolarHBondContact OD1-CB 3.44Å; D20-S22 PolarHBondContact OD1-N 3.39Å; D20-S22 PolarHBondContact OD1-OG 2.96Å; D20-S22 PolarHBondContact OD2-OG 3.48Å; D20-I23 HydrophobicContact CB-CD1 4.45Å; D20-I23 HydrophobicContact CB-CG1 4.26Å; D20-I23 WeakPolarHBondContact O-CG1 3.28Å; D20-I23 PolarHBondContact O-N 2.83Å
21	P	62.3	Low	59.7	Low	36 Å²	36	115.1 Å²	115.1	23%	0.234	61%	0.609	C	S	.	*	G	3₁₀ helix	trans	-64.7	-14.5	-179.6	18.4	-24.2	0	0	0	113.9	V13 L17 I23 L24 V25	V13-P21 HydrophobicContact CG2-CG 4.03Å; L17-P21 HydrophobicContact CD2-CB 4.34Å; L17-P21 HydrophobicContact CD2-CG 4.45Å; P21-I23 VanDerWaalsContact C-N 3.28Å; P21-I23 PolarHBondContact O-N 3.13Å; P21-L24 PolarHBondContact O-N 3.37Å; P21-V25 PolarHBondContact O-N 3.46Å
22	S	64.2	Low	59.7	Low	76 Å²	76	116.5 Å²	116.5	53%	0.531	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-69.4	-18.1	175.7	64.8	0	0	0	0	114.7	D20	D20-S22 PolarHBondContact O-N 2.79Å; D20-S22 VanDerWaalsContact O-N 3.1Å; D20-S22 WeakPolarHBondContact OD1-CB 3.44Å; D20-S22 PolarHBondContact OD1-N 3.39Å; D20-S22 PolarHBondContact OD1-OG 2.96Å; D20-S22 PolarHBondContact OD2-OG 3.48Å
23	I	62.9	Low	59.7	Low	122 Å²	122	114.6 Å²	114.6	63%	0.626	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-82.4	-13.9	171.8	33.1	175.6	0	0	0	113.1	F19 D20 P21	F19-I23 HydrophobicContact CB-CD1 4.25Å; D20-I23 HydrophobicContact CB-CD1 4.45Å; D20-I23 HydrophobicContact CB-CG1 4.26Å; D20-I23 WeakPolarHBondContact O-CG1 3.28Å; D20-I23 PolarHBondContact O-N 2.83Å; P21-I23 VanDerWaalsContact C-N 3.28Å; P21-I23 PolarHBondContact O-N 3.13Å
24	L	61.6	Low	59.5	Low	140 Å²	140	117.7 Å²	117.7	73%	0.733	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-29.6	173.8	-66.9	172	0	0	0	112	P21 S26	P21-L24 PolarHBondContact O-N 3.37Å; L24-S26 PolarHBondContact O-N 2.92Å; L24-S26 VanDerWaalsContact O-N 3.11Å
25	V	58.1	Low	59.2	Low	98 Å²	98	118.5 Å²	118.5	59%	0.594	62%	0.619	S	S	*	*			trans	-85.4	59.6	168.2	-168.2	0	0	0	0	108.7	P21 N27	P21-V25 PolarHBondContact O-N 3.46Å; V25-N27 PolarHBondContact O-N 3.36Å
26	S	54	Low	58.7	Low	68 Å²	68	121.9 Å²	121.9	48%	0.476	62%	0.623	S	S	.	*			trans	-59.8	120.7	155.5	46.2	0	0	0	0	106.6	L24	L24-S26 PolarHBondContact O-N 2.92Å; L24-S26 VanDerWaalsContact O-N 3.11Å
27	N	55.4	Low	58.3	Low	78 Å²	78	115 Å²	115	42%	0.417	61%	0.607	S	S	.	*			trans	-29.9	133.6	177	-153.8	-7.7	0	0	0	111.8	V25 E29 E30	V25-N27 PolarHBondContact O-N 3.36Å; N27-E29 PolarHBondContact O-N 3.08Å; N27-E30 HydrophobicContact CB-CB 4.5Å; N27-E30 HydrophobicContact CB-CG 4.13Å; N27-E30 PolarHBondContact O-N 3.5Å
28	P	56.7	Low	58	Low	109 Å²	109	118.1 Å²	118.1	71%	0.708	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-16.2	178.5	-26	35.7	0	0	0	114.1
29	E	55.5	Low	57.2	Low	157 Å²	157	119.6 Å²	119.6	73%	0.734	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-16.7	176.1	-53.8	-171.6	-178.8	0	0	113.8	N27	N27-E29 PolarHBondContact O-N 3.08Å
30	E	54.4	Low	56.7	Low	125 Å²	125	119 Å²	119	58%	0.584	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-5.5	-177	-69.5	179.5	-176.3	0	0	113.7	N27 F32	N27-E30 HydrophobicContact CB-CB 4.5Å; N27-E30 HydrophobicContact CB-CG 4.13Å; N27-E30 PolarHBondContact O-N 3.5Å; E30-F32 PolarHBondContact O-N 3.45Å
31	Q	54.1	Low	56.4	Low	163 Å²	163	124.1 Å²	124.1	76%	0.762	62%	0.624	S	S	*	*	S	Bend	trans	-70.8	-12.8	177	-164.9	173	-4	0	0	113
32	F	56.4	Low	56.7	Low	156 Å²	156	124.2 Å²	124.2	68%	0.684	63%	0.632	S	S	*	*			trans	-106.1	92.6	165.5	-76.6	-88.4	0	0	0	109.3	E30 F34	E30-F32 PolarHBondContact O-N 3.45Å; F32-F34 HydrophobicContact CB-CE2 4.4Å; F32-F34 HydrophobicContact CB-CZ 4.41Å; F32-F34 PolarHBondContact O-N 2.82Å
33	I	54.3	Low	56.9	Low	153 Å²	153	123.2 Å²	123.2	79%	0.785	62%	0.616	S	S	*	*			trans	-63.2	94	153.8	-67.2	165.2	0	0	0	105.4	P35	I33-P35 VanDerWaalsContact O-CD 3.26Å; I33-P35 WeakPolarHBondContact O-CD 3.24Å; I33-P35 VanDerWaalsContact O-N 3.12Å
34	F	54.4	Low	57.4	Low	151 Å²	151	123.3 Å²	123.3	66%	0.662	61%	0.612	S	S	*	*			trans	-54.6	118.7	158.2	-64	-76.4	0	0	0	104.6	F32 E36	F32-F34 HydrophobicContact CB-CE2 4.4Å; F32-F34 HydrophobicContact CB-CZ 4.41Å; F32-F34 PolarHBondContact O-N 2.82Å; F34-E36 PolarHBondContact O-N 3.23Å
35	P	57.4	Low	58.1	Low	63 Å²	63	122.3 Å²	122.3	41%	0.409	60%	0.604	S	S	.	*			trans	-64.6	91.8	175.8	25.8	-30.6	0	0	0	106.8	I33 G37 K39	I33-P35 VanDerWaalsContact O-CD 3.26Å; I33-P35 WeakPolarHBondContact O-CD 3.24Å; I33-P35 VanDerWaalsContact O-N 3.12Å; P35-G37 PolarHBondContact O-N 3.18Å; P35-K39 HydrophobicContact CB-CD 4.34Å; P35-K39 HydrophobicContact CB-CG 4.07Å; P35-K39 HydrophobicContact CG-CD 3.71Å; P35-K39 HydrophobicContact CG-CG 3.86Å
36	E	51.1	Low	59.2	Low	197 Å²	197	125.7 Å²	125.7	92%	0.921	61%	0.606	S	S	*	*	S	Bend	trans	-72.3	26.6	168.7	-67.2	-146.1	161.3	0	0	111.7	F34	F34-E36 PolarHBondContact O-N 3.23Å
37	G	51.2	Low	60.6	Low	49 Å²	49	123.5 Å²	123.5	51%	0.505	59%	0.591	S	S	.	*	S	Bend	trans	-127.2	121.8	157.3	0	0	0	0	0	105.6	P35 K39	P35-G37 PolarHBondContact O-N 3.18Å; G37-K39 PolarHBondContact O-N 3.28Å
38	E	55	Low	62.1	Low	145 Å²	145	126.6 Å²	126.6	68%	0.678	60%	0.601	S	S	*	*			trans	-39.7	112.8	-177.7	-69.9	179.7	124.8	0	0	110.4	R40	E38-R40 HydrophobicContact CB-CG 3.81Å; E38-R40 VanDerWaalsContact CD-NE 3.34Å; E38-R40 VanDerWaalsContact CD-NH2 3.25Å; E38-R40 PolarHBondContact O-N 3.21Å; E38-R40 IonicContact OE1-CZ 2.66Å; E38-R40 IonicContact OE1-NE 3.18Å; E38-R40 IonicContact OE1-NH2 3.05Å; E38-R40 PolarHBondContact OE1-NH2 3.23Å; E38-R40 IonicContact OE2-CZ 3.89Å; E38-R40 IonicContact OE2-NE 3.51Å; E38-R40 PolarHBondContact OE2-NE 2.77Å; E38-R40 IonicContact OE2-NH2 3.57Å; E38-R40 PolarHBondContact OE2-NH2 2.86Å
39	K	52.9	Low	63.7	Low	178 Å²	178	125.8 Å²	125.8	77%	0.774	60%	0.597	S	S	*	*			trans	-66.2	68.5	166.3	-96.3	-175.4	179.1	168.6	0	108.3	P35 G37 R41	P35-K39 HydrophobicContact CB-CD 4.34Å; P35-K39 HydrophobicContact CB-CG 4.07Å; P35-K39 HydrophobicContact CG-CD 3.71Å; P35-K39 HydrophobicContact CG-CG 3.86Å; G37-K39 PolarHBondContact O-N 3.28Å; K39-R41 PolarHBondContact O-N 3Å; K39-R41 VanDerWaalsContact O-N 3.12Å
40	R	55.6	Low	65.3	Low	139 Å²	139	122.1 Å²	122.1	53%	0.525	58%	0.58	S	S	.	*			trans	-72.5	102.9	166.7	-61.4	-155.8	-177.2	-153.3	-0.6	105.5	E38 G42 E126	E38-R40 HydrophobicContact CB-CG 3.81Å; E38-R40 VanDerWaalsContact CD-NE 3.34Å; E38-R40 VanDerWaalsContact CD-NH2 3.25Å; E38-R40 PolarHBondContact O-N 3.21Å; E38-R40 IonicContact OE1-CZ 2.66Å; E38-R40 IonicContact OE1-NE 3.18Å; E38-R40 IonicContact OE1-NH2 3.05Å; E38-R40 PolarHBondContact OE1-NH2 3.23Å; E38-R40 IonicContact OE2-CZ 3.89Å; E38-R40 IonicContact OE2-NE 3.51Å; E38-R40 PolarHBondContact OE2-NE 2.77Å; E38-R40 IonicContact OE2-NH2 3.57Å; E38-R40 PolarHBondContact OE2-NH2 2.86Å; R40-G42 PolarHBondContact O-N 2.94Å; R40-E126 IonicContact NH1-OE1 3.52Å; R40-E126 PolarHBondContact NH1-OE1 3.21Å
41	R	57.1	Low	67	Low	204 Å²	204	117.6 Å²	117.6	77%	0.77	56%	0.56	S	S	*	*			trans	-44.8	140.7	165.3	-70.9	176.7	88.3	144.7	2.2	107.8	K39 R43	K39-R41 PolarHBondContact O-N 3Å; K39-R41 VanDerWaalsContact O-N 3.12Å; R41-R43 PolarHBondContact O-N 3.5Å
42	G	67.6	Low	68.8	Low	38 Å²	38	111.2 Å²	111.2	39%	0.392	54%	0.538	S	S	.	.			trans	-49.6	128.8	-176	0	0	0	0	0	110	R40 F44 E45 R46	R40-G42 PolarHBondContact O-N 2.94Å; G42-F44 PolarHBondContact O-N 3.25Å; G42-F44 VanDerWaalsContact O-N 3.08Å; G42-E45 WeakPolarHBondContact O-CA 3.05Å; G42-E45 WeakPolarHBondContact O-CB 3.27Å; G42-E45 PolarHBondContact O-N 3.16Å; G42-R46 PolarHBondContact O-N 3.27Å; G42-R46 VanDerWaalsContact O-N 3.07Å
43	R	69.1	Low	70.6	Confident	55 Å²	55	106.7 Å²	106.7	21%	0.208	53%	0.529	C	S	.	.	H	α-helix	trans	-52.6	-35.6	-177	-89.1	174.3	152.6	-102.8	-2.3	111.9	R41 R46 S47 D115 E126	R41-R43 PolarHBondContact O-N 3.5Å; R43-R46 PolarHBondContact O-N 2.86Å; R43-S47 PolarHBondContact O-N 2.94Å; R43-S47 PolarHBondContact O-OG 3.17Å; R43-S47 VanDerWaalsContact O-OG 3.08Å; R43-D115 IonicContact NH1-OD2 2.7Å; R43-D115 PolarHBondContact NH1-OD2 2.95Å; R43-E126 IonicContact CZ-OE1 3.49Å; R43-E126 IonicContact NE-OE1 3.46Å; R43-E126 IonicContact NH2-OE1 3.42Å; R43-E126 PolarHBondContact NH2-OE1 2.93Å; R43-E126 IonicContact NH2-OE2 2.81Å
44	F	72.7	Confident	72.3	Confident	123 Å²	123	102.6 Å²	102.6	54%	0.539	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-43.2	171.9	-80.2	-74.4	0	0	0	113.7	G42 R46 S47 F48 F116	G42-F44 PolarHBondContact O-N 3.25Å; G42-F44 VanDerWaalsContact O-N 3.08Å; F44-R46 VanDerWaalsContact C-N 3.31Å; F44-R46 PolarHBondContact O-N 2.82Å; F44-S47 PolarHBondContact O-N 3.41Å; F44-F48 HydrophobicContact CB-CE2 4.31Å; F44-F48 WeakPolarHBondContact O-CD2 3.46Å; F44-F48 PolarHBondContact O-N 3.31Å; F44-F116 HydrophobicContact CE2-CD2 4.44Å; F44-F116 AromaticContact CE2-CE2 3.75Å; F44-F116 HydrophobicContact CE2-CE2 3.75Å; F44-F116 AromaticContact CE2-CZ 3.87Å; F44-F116 HydrophobicContact CE2-CZ 3.87Å; F44-F116 HydrophobicContact CZ-CD2 4.32Å; F44-F116 HydrophobicContact CZ-CE1 4.14Å; F44-F116 AromaticContact CZ-CE2 3.9Å; F44-F116 HydrophobicContact CZ-CE2 3.9Å; F44-F116 AromaticContact CZ-CZ 3.8Å; F44-F116 HydrophobicContact CZ-CZ 3.8Å
45	E	78.3	Confident	74.3	Confident	119 Å²	119	98.1 Å²	98.1	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-64.4	-38.1	176.7	-66.9	-177.5	149.4	0	0	111.6	G42 F48 S49	G42-E45 WeakPolarHBondContact O-CA 3.05Å; G42-E45 WeakPolarHBondContact O-CB 3.27Å; G42-E45 PolarHBondContact O-N 3.16Å; E45-F48 PolarHBondContact O-N 3.47Å; E45-S49 PolarHBondContact O-N 3.38Å
46	R	80.1	Confident	76.1	Confident	170 Å²	170	100.5 Å²	100.5	64%	0.642	50%	0.501	S	S	*	.	H	α-helix	trans	-62.7	-45.9	174.3	-172.6	178	177.2	177.2	-1.3	110.8	G42 R43 F44 F48 S49 E50	G42-R46 PolarHBondContact O-N 3.27Å; G42-R46 VanDerWaalsContact O-N 3.07Å; R43-R46 PolarHBondContact O-N 2.86Å; F44-R46 VanDerWaalsContact C-N 3.31Å; F44-R46 PolarHBondContact O-N 2.82Å; R46-F48 PolarHBondContact O-N 2.88Å; R46-S49 PolarHBondContact O-N 3.38Å; R46-E50 WeakPolarHBondContact O-CB 3.43Å; R46-E50 PolarHBondContact O-N 3.11Å
47	S	83.4	Confident	78.2	Confident	22 Å²	22	92.8 Å²	92.8	15%	0.154	47%	0.474	C	S	.	.	H	α-helix	trans	-62.8	-38.3	177.5	-59.8	0	0	0	0	112.9	R43 F44 E50 I51	R43-S47 PolarHBondContact O-N 2.94Å; R43-S47 PolarHBondContact O-OG 3.17Å; R43-S47 VanDerWaalsContact O-OG 3.08Å; F44-S47 PolarHBondContact O-N 3.41Å; S47-E50 PolarHBondContact O-N 2.91Å; S47-I51 WeakPolarHBondContact O-CB 3.5Å; S47-I51 WeakPolarHBondContact O-CD1 3.43Å; S47-I51 WeakPolarHBondContact O-CG1 3.45Å; S47-I51 PolarHBondContact O-N 3.35Å
48	F	87.4	Confident	80.2	Confident	143 Å²	143	90.9 Å²	90.9	63%	0.627	45%	0.454	S	S	*	.	H	α-helix	trans	-64.9	-42.4	177.1	-73.2	-56.5	0	0	0	112.7	F44 E45 R46 E50 I51 G52	F44-F48 HydrophobicContact CB-CE2 4.31Å; F44-F48 WeakPolarHBondContact O-CD2 3.46Å; F44-F48 PolarHBondContact O-N 3.31Å; E45-F48 PolarHBondContact O-N 3.47Å; R46-F48 PolarHBondContact O-N 2.88Å; F48-E50 VanDerWaalsContact C-N 3.3Å; F48-E50 PolarHBondContact O-N 3.44Å; F48-I51 PolarHBondContact O-N 3.29Å; F48-G52 PolarHBondContact O-N 3.15Å
49	S	89.6	Confident	82.1	Confident	91 Å²	91	85.8 Å²	85.8	64%	0.636	44%	0.437	S	S	*	.	H	α-helix	trans	-60.3	-43.2	173.9	-176.2	0	0	0	0	111.1	E45 R46 G52 A53	E45-S49 PolarHBondContact O-N 3.38Å; R46-S49 PolarHBondContact O-N 3.38Å; S49-G52 PolarHBondContact O-N 3.48Å; S49-A53 WeakPolarHBondContact O-CB 3.39Å; S49-A53 PolarHBondContact O-N 3.37Å
50	E	88.8	Confident	84.2	Confident	80 Å²	80	80.2 Å²	80.2	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-66.1	-45.1	179.7	-172.9	171.9	179.9	0	0	112.6	R46 S47 F48 G52 A53 M54 Y111	R46-E50 WeakPolarHBondContact O-CB 3.43Å; R46-E50 PolarHBondContact O-N 3.11Å; S47-E50 PolarHBondContact O-N 2.91Å; F48-E50 VanDerWaalsContact C-N 3.3Å; F48-E50 PolarHBondContact O-N 3.44Å; E50-G52 VanDerWaalsContact C-N 3.33Å; E50-G52 PolarHBondContact O-N 3.24Å; E50-A53 WeakPolarHBondContact O-CB 3.49Å; E50-A53 PolarHBondContact O-N 3.3Å; E50-M54 PolarHBondContact O-N 2.9Å; E50-Y111 WeakPolarHBondContact OE1-CE1 3.49Å
51	I	90.8	Very high	86.1	Confident	30 Å²	30	78.2 Å²	78.2	15%	0.154	42%	0.423	C	S	.	.	H	α-helix	trans	-61.5	-44.6	174.9	-65.8	160.8	0	0	0	109.8	S47 F48 A53 M54 V55 F109 A112	S47-I51 WeakPolarHBondContact O-CB 3.5Å; S47-I51 WeakPolarHBondContact O-CD1 3.43Å; S47-I51 WeakPolarHBondContact O-CG1 3.45Å; S47-I51 PolarHBondContact O-N 3.35Å; F48-I51 PolarHBondContact O-N 3.29Å; I51-A53 VanDerWaalsContact C-N 3.34Å; I51-A53 PolarHBondContact O-N 3.26Å; I51-M54 PolarHBondContact O-N 3.24Å; I51-V55 WeakPolarHBondContact O-CG2 3.48Å; I51-V55 PolarHBondContact O-N 3.39Å; I51-F109 HydrophobicContact CD1-CD2 4.13Å; I51-A112 HydrophobicContact CD1-CB 3.94Å; I51-A112 HydrophobicContact CG1-CB 4.22Å
52	G	92.1	Very high	87.8	Confident	29 Å²	29	68.5 Å²	68.5	30%	0.299	39%	0.387	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.7	0	0	0	0	0	112.4	F48 S49 E50 M54 V55 I56	F48-G52 PolarHBondContact O-N 3.15Å; S49-G52 PolarHBondContact O-N 3.48Å; E50-G52 VanDerWaalsContact C-N 3.33Å; E50-G52 PolarHBondContact O-N 3.24Å; G52-M54 VanDerWaalsContact C-N 3.32Å; G52-M54 PolarHBondContact O-N 3.01Å; G52-V55 PolarHBondContact O-N 2.97Å; G52-I56 WeakPolarHBondContact O-CG1 3.42Å; G52-I56 PolarHBondContact O-N 3.17Å
53	A	93.6	Very high	89.1	Confident	61 Å²	61	67.2 Å²	67.2	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-61.8	-39.6	175.3	0	0	0	0	0	111.8	S49 E50 I51 I56 G57	S49-A53 WeakPolarHBondContact O-CB 3.39Å; S49-A53 PolarHBondContact O-N 3.37Å; E50-A53 WeakPolarHBondContact O-CB 3.49Å; E50-A53 PolarHBondContact O-N 3.3Å; I51-A53 VanDerWaalsContact C-N 3.34Å; I51-A53 PolarHBondContact O-N 3.26Å; A53-I56 PolarHBondContact O-N 3.4Å; A53-G57 PolarHBondContact O-N 2.89Å
54	M	91.1	Very high	90.4	Very high	67 Å²	67	70.5 Å²	70.5	33%	0.33	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-39.9	175	-110.6	-175.9	105.1	0	0	112.8	E50 I51 G52 G58 A104 I107 G108	E50-M54 PolarHBondContact O-N 2.9Å; I51-M54 PolarHBondContact O-N 3.24Å; G52-M54 VanDerWaalsContact C-N 3.32Å; G52-M54 PolarHBondContact O-N 3.01Å; M54-G58 PolarHBondContact O-N 2.89Å; M54-A104 HydrophobicContact CE-CB 4.34Å; M54-A104 WeakPolarHBondContact CE-O 3.24Å; M54-A104 WeakPolarHBondContact O-CB 3.26Å; M54-I107 HydrophobicContact CE-CB 3.91Å; M54-I107 HydrophobicContact CE-CG2 3.83Å; M54-G108 WeakPolarHBondContact SD-CA 3.43Å
55	V	94.5	Very high	91.3	Very high	57 Å²	57	70.8 Å²	70.8	35%	0.345	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-47.2	176.2	173.4	0	0	0	0	110.6	I51 G52 G58 A59 A101	I51-V55 WeakPolarHBondContact O-CG2 3.48Å; I51-V55 PolarHBondContact O-N 3.39Å; G52-V55 PolarHBondContact O-N 2.97Å; V55-G58 PolarHBondContact O-N 2.66Å; V55-A59 WeakPolarHBondContact O-CB 3.23Å; V55-A59 PolarHBondContact O-N 3.38Å; V55-A101 HydrophobicContact CG1-CB 4.16Å
56	I	95.5	Very high	92	Very high	114 Å²	114	65.1 Å²	65.1	59%	0.585	37%	0.368	S	S	*	.	H	α-helix	trans	-64.9	-43.5	178.2	-66.1	168.1	0	0	0	110.4	G52 A53 A59 S60	G52-I56 WeakPolarHBondContact O-CG1 3.42Å; G52-I56 PolarHBondContact O-N 3.17Å; A53-I56 PolarHBondContact O-N 3.4Å; I56-A59 PolarHBondContact O-N 3.48Å; I56-S60 WeakPolarHBondContact O-CB 3.44Å; I56-S60 PolarHBondContact O-N 3.43Å; I56-S60 PolarHBondContact O-OG 3.42Å
57	G	95.6	Very high	92.5	Very high	34 Å²	34	60.1 Å²	60.1	35%	0.351	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-46.5	174.6	0	0	0	0	0	112.2	A53 S60 V61	A53-G57 PolarHBondContact O-N 2.89Å; G57-S60 PolarHBondContact O-N 3.41Å; G57-V61 WeakPolarHBondContact O-CG2 3.43Å; G57-V61 PolarHBondContact O-N 2.97Å
58	G	93.8	Very high	92.9	Very high	9 Å²	9	66.3 Å²	66.3	9%	0.093	38%	0.375	C	S	.	.	H	α-helix	trans	-62.1	-42.4	175.4	0	0	0	0	0	112.9	M54 V55 S60 G62 L100	M54-G58 PolarHBondContact O-N 2.89Å; V55-G58 PolarHBondContact O-N 2.66Å; G58-S60 VanDerWaalsContact C-N 3.31Å; G58-S60 PolarHBondContact O-N 3.3Å; G58-G62 WeakPolarHBondContact O-CA 3.43Å; G58-G62 PolarHBondContact O-N 2.92Å; G58-L100 WeakPolarHBondContact O-CB 3.27Å
59	A	95.1	Very high	93	Very high	38 Å²	38	61.4 Å²	61.4	31%	0.314	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-39.1	174.4	0	0	0	0	0	111.9	V55 I56 G63 A101	V55-A59 WeakPolarHBondContact O-CB 3.23Å; V55-A59 PolarHBondContact O-N 3.38Å; I56-A59 PolarHBondContact O-N 3.48Å; A59-G63 WeakPolarHBondContact O-CA 3.14Å; A59-G63 PolarHBondContact O-N 3.14Å; A59-A101 HydrophobicContact CB-CB 3.87Å
60	S	96.3	Very high	92.8	Very high	62 Å²	62	57.2 Å²	57.2	43%	0.434	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-51.9	-178.6	-56.1	0	0	0	0	110.9	I56 G57 G58 G62 G63 I64	I56-S60 WeakPolarHBondContact O-CB 3.44Å; I56-S60 PolarHBondContact O-N 3.43Å; I56-S60 PolarHBondContact O-OG 3.42Å; G57-S60 PolarHBondContact O-N 3.41Å; G58-S60 VanDerWaalsContact C-N 3.31Å; G58-S60 PolarHBondContact O-N 3.3Å; S60-G62 VanDerWaalsContact C-N 3.32Å; S60-G62 PolarHBondContact O-N 2.87Å; S60-G63 PolarHBondContact O-N 2.66Å; S60-I64 VanDerWaalsContact O-CG1 3.32Å; S60-I64 WeakPolarHBondContact O-CG1 3.34Å; S60-I64 PolarHBondContact O-N 3.31Å
61	V	95.4	Very high	92.6	Very high	97 Å²	97	58.8 Å²	58.8	59%	0.588	34%	0.335	S	S	*	.	H	α-helix	trans	-62.4	-41.6	176.4	175.7	0	0	0	0	110.6	G57 I64 K65	G57-V61 WeakPolarHBondContact O-CG2 3.43Å; G57-V61 PolarHBondContact O-N 2.97Å; V61-I64 PolarHBondContact O-N 3.45Å; V61-K65 WeakPolarHBondContact O-CB 3.4Å; V61-K65 PolarHBondContact O-N 3.29Å
62	G	93.9	Very high	92.4	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-68.3	-36	177.9	0	0	0	0	0	114.1	G58 S60 K65 G66 S96	G58-G62 WeakPolarHBondContact O-CA 3.43Å; G58-G62 PolarHBondContact O-N 2.92Å; S60-G62 VanDerWaalsContact C-N 3.32Å; S60-G62 PolarHBondContact O-N 2.87Å; G62-K65 PolarHBondContact O-N 2.98Å; G62-G66 PolarHBondContact O-N 2.98Å; G62-S96 CarbonylContact O-C 3.53Å; G62-S96 WeakPolarHBondContact O-CB 3.33Å; G62-S96 PolarHBondContact O-OG 2.7Å
63	G	94.4	Very high	91.9	Very high	10 Å²	10	65.2 Å²	65.2	10%	0.103	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-48.1	173.3	0	0	0	0	0	111.3	A59 S60 K65 G66 L67	A59-G63 WeakPolarHBondContact O-CA 3.14Å; A59-G63 PolarHBondContact O-N 3.14Å; S60-G63 PolarHBondContact O-N 2.66Å; G63-K65 VanDerWaalsContact C-N 3.34Å; G63-K65 PolarHBondContact O-N 3.1Å; G63-G66 PolarHBondContact O-N 2.99Å; G63-L67 WeakPolarHBondContact O-CB 3.42Å; G63-L67 PolarHBondContact O-N 3.37Å
64	I	95.1	Very high	91	Very high	124 Å²	124	66 Å²	66	64%	0.636	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-46	176.3	-66.1	165.2	0	0	0	110.5	S60 V61 G66 L67 Y68	S60-I64 VanDerWaalsContact O-CG1 3.32Å; S60-I64 WeakPolarHBondContact O-CG1 3.34Å; S60-I64 PolarHBondContact O-N 3.31Å; V61-I64 PolarHBondContact O-N 3.45Å; I64-G66 PolarHBondContact O-N 3.44Å; I64-L67 PolarHBondContact O-N 2.83Å; I64-Y68 WeakPolarHBondContact O-CB 3.43Å; I64-Y68 PolarHBondContact O-N 3.26Å
65	K	93.5	Very high	90.4	Very high	130 Å²	130	69.1 Å²	69.1	57%	0.565	37%	0.372	S	S	*	.	H	α-helix	trans	-60.6	-44.9	177	-174.6	-170	174.8	-167.3	0	111.8	V61 G62 G63 L67 Y68 S69 L100	V61-K65 WeakPolarHBondContact O-CB 3.4Å; V61-K65 PolarHBondContact O-N 3.29Å; G62-K65 PolarHBondContact O-N 2.98Å; G63-K65 VanDerWaalsContact C-N 3.34Å; G63-K65 PolarHBondContact O-N 3.1Å; K65-L67 VanDerWaalsContact C-N 3.34Å; K65-Y68 PolarHBondContact O-N 3.36Å; K65-S69 PolarHBondContact O-N 3.36Å; K65-S69 PolarHBondContact O-OG 2.83Å; K65-L100 HydrophobicContact CD-CD1 4.06Å
66	G	91.5	Very high	89.6	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-34.9	179.5	0	0	0	0	0	113	G62 G63 I64 S69 G70 S96	G62-G66 PolarHBondContact O-N 2.98Å; G63-G66 PolarHBondContact O-N 2.99Å; I64-G66 PolarHBondContact O-N 3.44Å; G66-S69 WeakPolarHBondContact CA-OG 3.33Å; G66-S69 PolarHBondContact O-OG 2.87Å; G66-G70 PolarHBondContact O-N 3.4Å; G66-S96 VanDerWaalsContact CA-CB 3.47Å; G66-S96 PolarHBondContact N-OG 2.91Å
67	L	91.7	Very high	88.7	Confident	65 Å²	65	67 Å²	67	34%	0.34	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-46.3	173.4	-174.6	58.8	0	0	0	111	G63 I64 K65 G70 F71 M89 L93	G63-L67 WeakPolarHBondContact O-CB 3.42Å; G63-L67 PolarHBondContact O-N 3.37Å; I64-L67 PolarHBondContact O-N 2.83Å; K65-L67 VanDerWaalsContact C-N 3.34Å; L67-G70 PolarHBondContact O-N 3.11Å; L67-F71 HydrophobicContact CD1-CD2 4.05Å; L67-F71 HydrophobicContact CD1-CE2 3.47Å; L67-F71 VanDerWaalsContact CD1-CE2 3.47Å; L67-F71 HydrophobicContact CD1-CZ 3.93Å; L67-F71 HydrophobicContact CD2-CE2 4.14Å; L67-F71 HydrophobicContact CG-CD2 3.97Å; L67-F71 HydrophobicContact CG-CE2 3.55Å; L67-F71 HydrophobicContact CG-CZ 4.46Å; L67-F71 VanDerWaalsContact O-CD2 3.23Å; L67-F71 WeakPolarHBondContact O-CD2 3.5Å; L67-F71 PolarHBondContact O-N 3.45Å; L67-M89 HydrophobicContact CD1-SD 4.41Å; L67-L93 HydrophobicContact CB-CD1 4.05Å; L67-L93 HydrophobicContact CD1-CD1 4.19Å; L67-L93 HydrophobicContact CD2-CD1 4.42Å; L67-L93 HydrophobicContact CG-CD1 4.44Å
68	Y	91.6	Very high	88	Confident	152 Å²	152	71.7 Å²	71.7	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-62.7	-43.8	177.4	-176.5	-96.8	0	0	0	111.9	I64 K65 G70 F71 K72	I64-Y68 WeakPolarHBondContact O-CB 3.43Å; I64-Y68 PolarHBondContact O-N 3.26Å; K65-Y68 PolarHBondContact O-N 3.36Å; Y68-G70 VanDerWaalsContact C-N 3.35Å; Y68-F71 PolarHBondContact O-N 2.83Å; Y68-K72 HydrophobicContact CE1-CD 4.04Å; Y68-K72 PolarHBondContact O-N 3.37Å
69	S	88.5	Confident	87.4	Confident	40 Å²	40	72.8 Å²	72.8	28%	0.28	37%	0.374	S	S	.	.	H	α-helix	trans	-63.8	-42.2	174.2	63.8	0	0	0	0	111.2	K65 G66 F71 K72 D73	K65-S69 PolarHBondContact O-N 3.36Å; K65-S69 PolarHBondContact O-OG 2.83Å; G66-S69 WeakPolarHBondContact CA-OG 3.33Å; G66-S69 PolarHBondContact O-OG 2.87Å; S69-F71 VanDerWaalsContact C-N 3.32Å; S69-F71 PolarHBondContact O-N 2.88Å; S69-K72 PolarHBondContact O-N 3.41Å; S69-K72 VanDerWaalsContact O-N 3.08Å; S69-D73 WeakPolarHBondContact O-CB 3.46Å; S69-D73 PolarHBondContact O-N 2.85Å
70	G	85.1	Confident	86.5	Confident	3 Å²	3	76.5 Å²	76.5	3%	0.031	40%	0.395	C	S	.	.	H	α-helix	trans	-61.2	-34.7	177.9	0	0	0	0	0	114	G66 L67 Y68	G66-G70 PolarHBondContact O-N 3.4Å; L67-G70 PolarHBondContact O-N 3.11Å; Y68-G70 VanDerWaalsContact C-N 3.35Å
71	F	85.2	Confident	86	Confident	113 Å²	113	77 Å²	77	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-74.2	-28.6	173.8	-77.6	-55.1	0	0	0	113.8	L67 Y68 S69 K77 M89	L67-F71 HydrophobicContact CD1-CD2 4.05Å; L67-F71 HydrophobicContact CD1-CE2 3.47Å; L67-F71 VanDerWaalsContact CD1-CE2 3.47Å; L67-F71 HydrophobicContact CD1-CZ 3.93Å; L67-F71 HydrophobicContact CD2-CE2 4.14Å; L67-F71 HydrophobicContact CG-CD2 3.97Å; L67-F71 HydrophobicContact CG-CE2 3.55Å; L67-F71 HydrophobicContact CG-CZ 4.46Å; L67-F71 VanDerWaalsContact O-CD2 3.23Å; L67-F71 WeakPolarHBondContact O-CD2 3.5Å; L67-F71 PolarHBondContact O-N 3.45Å; Y68-F71 PolarHBondContact O-N 2.83Å; S69-F71 VanDerWaalsContact C-N 3.32Å; S69-F71 PolarHBondContact O-N 2.88Å; F71-K77 WeakPolarHBondContact O-CE 3.14Å; F71-K77 PolarHBondContact O-NZ 3.05Å; F71-M89 HydrophobicContact CD1-CE 4.12Å; F71-M89 HydrophobicContact CD1-SD 3.59Å; F71-M89 VanDerWaalsContact CD1-SD 3.59Å; F71-M89 HydrophobicContact CE1-CE 3.75Å; F71-M89 HydrophobicContact CE1-SD 3.44Å; F71-M89 WeakPolarHBondContact CE1-SD 3.18Å; F71-M89 HydrophobicContact CG-SD 4.21Å; F71-M89 HydrophobicContact CZ-SD 3.98Å
72	K	86.3	Confident	85.4	Confident	148 Å²	148	78.1 Å²	78.1	64%	0.643	40%	0.398	S	S	*	.	H	α-helix	trans	-85	-18.7	-179.7	-142	173.4	-178.9	176.5	0	112.2	Y68 S69 S74	Y68-K72 HydrophobicContact CE1-CD 4.04Å; Y68-K72 PolarHBondContact O-N 3.37Å; S69-K72 PolarHBondContact O-N 3.41Å; S69-K72 VanDerWaalsContact O-N 3.08Å; K72-S74 PolarHBondContact O-N 3.01Å
73	D	83.3	Confident	85.1	Confident	46 Å²	46	81 Å²	81	25%	0.246	42%	0.422	C	S	.	.			trans	-70.4	114.7	-178.1	-155.7	-28.8	0	0	0	111.9	S69 E75 I76 K77	S69-D73 WeakPolarHBondContact O-CB 3.46Å; S69-D73 PolarHBondContact O-N 2.85Å; D73-E75 VanDerWaalsContact C-N 3.26Å; D73-E75 PolarHBondContact O-N 2.83Å; D73-E75 PolarHBondContact OD1-N 3.45Å; D73-I76 HydrophobicContact CB-CB 4.45Å; D73-I76 HydrophobicContact CB-CD1 4.05Å; D73-I76 HydrophobicContact CB-CG1 4.04Å; D73-I76 PolarHBondContact O-N 3.25Å; D73-K77 PolarHBondContact O-N 2.69Å
74	S	73.8	Confident	84.8	Confident	78 Å²	78	84.4 Å²	84.4	55%	0.545	44%	0.437	S	S	.	.	H	α-helix	trans	-67.7	-27	177.9	43.8	0	0	0	0	112.3	K72 K77 N78	K72-S74 PolarHBondContact O-N 3.01Å; S74-K77 PolarHBondContact O-N 3.5Å; S74-N78 PolarHBondContact O-N 2.87Å; S74-N78 VanDerWaalsContact O-N 3.12Å; S74-N78 PolarHBondContact O-ND2 2.82Å; S74-N78 VanDerWaalsContact O-ND2 3.11Å
75	E	79.1	Confident	84.3	Confident	132 Å²	132	82.5 Å²	82.5	62%	0.617	42%	0.422	S	S	*	.	H	α-helix	trans	-66.1	-43.4	178.6	-66.3	-164.3	158.5	0	0	110.9	D73 K77 N78 L79	D73-E75 VanDerWaalsContact C-N 3.26Å; D73-E75 PolarHBondContact O-N 2.83Å; D73-E75 PolarHBondContact OD1-N 3.45Å; E75-K77 PolarHBondContact O-N 2.91Å; E75-N78 PolarHBondContact O-N 2.93Å; E75-N78 VanDerWaalsContact O-N 3.07Å; E75-L79 WeakPolarHBondContact O-CD1 3.48Å; E75-L79 PolarHBondContact O-N 2.91Å
76	I	77.2	Confident	84.1	Confident	5 Å²	5	84.9 Å²	84.9	3%	0.026	43%	0.427	C	S	.	.	H	α-helix	trans	-63.6	-33.8	176.9	-57.4	-177.6	0	0	0	110.9	D73 N78 R85 Q88 M89	D73-I76 HydrophobicContact CB-CB 4.45Å; D73-I76 HydrophobicContact CB-CD1 4.05Å; D73-I76 HydrophobicContact CB-CG1 4.04Å; D73-I76 PolarHBondContact O-N 3.25Å; I76-N78 VanDerWaalsContact C-N 3.32Å; I76-N78 PolarHBondContact O-N 3.34Å; I76-R85 HydrophobicContact CG2-CB 4.3Å; I76-R85 VanDerWaalsContact O-CD 3.28Å; I76-R85 WeakPolarHBondContact O-CD 3.36Å; I76-R85 VanDerWaalsContact O-CG 3.24Å; I76-R85 WeakPolarHBondContact O-CG 3.33Å; I76-Q88 HydrophobicContact CD1-CG 4.12Å; I76-Q88 HydrophobicContact CG1-CG 4.1Å; I76-M89 HydrophobicContact CD1-CG 4.38Å; I76-M89 HydrophobicContact CG2-CG 4.14Å
77	K	76.2	Confident	84.1	Confident	121 Å²	121	89.5 Å²	89.5	53%	0.526	46%	0.455	S	S	.	.	H	α-helix	trans	-72.9	-21.8	176.2	-70.2	-177.3	-176.1	173.4	0	113.9	F71 D73 S74 E75 R85	F71-K77 WeakPolarHBondContact O-CE 3.14Å; F71-K77 PolarHBondContact O-NZ 3.05Å; D73-K77 PolarHBondContact O-N 2.69Å; S74-K77 PolarHBondContact O-N 3.5Å; E75-K77 PolarHBondContact O-N 2.91Å; K77-R85 PolarHBondContact O-NH1 3.49Å; K77-R85 VanDerWaalsContact O-NH1 3.16Å; K77-R85 PolarHBondContact O-NH2 2.87Å
78	N	80.6	Confident	84	Confident	133 Å²	133	90 Å²	90	71%	0.711	46%	0.456	S	S	*	.	H	α-helix	trans	-91.9	-4.6	179.5	-72.5	-35.8	0	0	0	113.3	S74 E75 I76	S74-N78 PolarHBondContact O-N 2.87Å; S74-N78 VanDerWaalsContact O-N 3.12Å; S74-N78 PolarHBondContact O-ND2 2.82Å; S74-N78 VanDerWaalsContact O-ND2 3.11Å; E75-N78 PolarHBondContact O-N 2.93Å; E75-N78 VanDerWaalsContact O-N 3.07Å; I76-N78 VanDerWaalsContact C-N 3.32Å; I76-N78 PolarHBondContact O-N 3.34Å
79	L	82.6	Confident	83.9	Confident	31 Å²	31	84.9 Å²	84.9	16%	0.162	44%	0.438	C	S	.	.			trans	-62.8	141.1	178.6	-104.1	74.5	0	0	0	112	E75 T81 I84 R85	E75-L79 WeakPolarHBondContact O-CD1 3.48Å; E75-L79 PolarHBondContact O-N 2.91Å; L79-T81 VanDerWaalsContact C-N 3.33Å; L79-T81 PolarHBondContact O-N 3.32Å; L79-I84 HydrophobicContact CD2-CB 3.85Å; L79-I84 HydrophobicContact CD2-CG2 3.32Å; L79-R85 HydrophobicContact CB-CG 3.74Å; L79-R85 PolarHBondContact O-NE 2.83Å; L79-R85 PolarHBondContact O-NH2 2.93Å
80	P	76.1	Confident	84.1	Confident	117 Å²	117	88.1 Å²	88.1	76%	0.76	45%	0.452	S	S	*	.	S	Bend	trans	-70.4	-23.7	-167	24.6	-33.2	0	0	0	114.3
81	T	84.6	Confident	84.4	Confident	72 Å²	72	92.9 Å²	92.9	44%	0.442	48%	0.476	S	S	.	.			trans	-130.1	134.3	-174.2	-43.8	0	0	0	0	111.6	L79 A83 I84 R85	L79-T81 VanDerWaalsContact C-N 3.33Å; L79-T81 PolarHBondContact O-N 3.32Å; T81-A83 HydrophobicContact CG2-CB 4.28Å; T81-A83 PolarHBondContact O-N 2.85Å; T81-I84 PolarHBondContact O-N 3.44Å; T81-I84 VanDerWaalsContact O-N 3.11Å; T81-R85 PolarHBondContact O-N 3.48Å
82	L	83.7	Confident	84.6	Confident	121 Å²	121	90.6 Å²	90.6	63%	0.634	47%	0.467	S	S	*	.	H	α-helix	trans	-55.2	-35.5	178	-97.6	147.3	0	0	0	113.6	R85 R86	L82-R85 PolarHBondContact O-N 3Å; L82-R86 PolarHBondContact O-N 3.35Å
83	A	87.8	Confident	84.9	Confident	61 Å²	61	86.2 Å²	86.2	50%	0.504	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.7	0	0	0	0	0	112	T81 R85 R86 T87	T81-A83 HydrophobicContact CG2-CB 4.28Å; T81-A83 PolarHBondContact O-N 2.85Å; A83-R85 VanDerWaalsContact C-N 3.35Å; A83-R85 PolarHBondContact O-N 3.24Å; A83-R86 PolarHBondContact O-N 3.5Å; A83-T87 PolarHBondContact O-N 2.87Å; A83-T87 VanDerWaalsContact O-N 3.15Å; A83-T87 PolarHBondContact O-OG1 2.93Å
84	I	86.8	Confident	85.4	Confident	80 Å²	80	87.7 Å²	87.7	41%	0.41	46%	0.461	S	S	.	.	H	α-helix	trans	-69.1	-36.6	-179.4	-47.7	172.8	0	0	0	110.3	L79 T81 R86 T87 Q88	L79-I84 HydrophobicContact CD2-CB 3.85Å; L79-I84 HydrophobicContact CD2-CG2 3.32Å; T81-I84 PolarHBondContact O-N 3.44Å; T81-I84 VanDerWaalsContact O-N 3.11Å; I84-R86 VanDerWaalsContact C-N 3.32Å; I84-R86 PolarHBondContact O-N 3.47Å; I84-T87 PolarHBondContact O-N 3.36Å; I84-Q88 WeakPolarHBondContact O-CB 3.39Å; I84-Q88 PolarHBondContact O-N 2.83Å
85	R	86	Confident	86.4	Confident	85 Å²	85	90.8 Å²	90.8	32%	0.321	47%	0.465	S	S	.	.	H	α-helix	trans	-57.6	-43.5	174.3	-61.8	-169.7	-173.1	-179	-0.7	112.3	I76 K77 L79 T81 L82 A83 M89	I76-R85 HydrophobicContact CG2-CB 4.3Å; I76-R85 VanDerWaalsContact O-CD 3.28Å; I76-R85 WeakPolarHBondContact O-CD 3.36Å; I76-R85 VanDerWaalsContact O-CG 3.24Å; I76-R85 WeakPolarHBondContact O-CG 3.33Å; K77-R85 PolarHBondContact O-NH1 3.49Å; K77-R85 VanDerWaalsContact O-NH1 3.16Å; K77-R85 PolarHBondContact O-NH2 2.87Å; L79-R85 HydrophobicContact CB-CG 3.74Å; L79-R85 PolarHBondContact O-NE 2.83Å; L79-R85 PolarHBondContact O-NH2 2.93Å; T81-R85 PolarHBondContact O-N 3.48Å; L82-R85 PolarHBondContact O-N 3Å; A83-R85 VanDerWaalsContact C-N 3.35Å; A83-R85 PolarHBondContact O-N 3.24Å; R85-M89 WeakPolarHBondContact O-CB 3.22Å; R85-M89 PolarHBondContact O-N 3.38Å
86	R	88.7	Confident	87.1	Confident	180 Å²	180	85.2 Å²	85.2	68%	0.679	44%	0.441	S	S	*	.	H	α-helix	trans	-65.3	-46.6	178.1	-71	178.5	179.9	178.7	0.1	111.4	L82 A83 I84 Q88 M89 L90	L82-R86 PolarHBondContact O-N 3.35Å; A83-R86 PolarHBondContact O-N 3.5Å; I84-R86 VanDerWaalsContact C-N 3.32Å; I84-R86 PolarHBondContact O-N 3.47Å; R86-Q88 VanDerWaalsContact C-N 3.33Å; R86-Q88 PolarHBondContact O-N 2.85Å; R86-M89 PolarHBondContact O-N 3.47Å; R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 PolarHBondContact O-N 2.98Å
87	T	91.6	Very high	87.9	Confident	96 Å²	96	85.3 Å²	85.3	59%	0.589	44%	0.442	S	S	*	.	H	α-helix	trans	-62.2	-40.7	178.2	-55.8	0	0	0	0	111.7	A83 I84 L90 N91	A83-T87 PolarHBondContact O-N 2.87Å; A83-T87 VanDerWaalsContact O-N 3.15Å; A83-T87 PolarHBondContact O-OG1 2.93Å; I84-T87 PolarHBondContact O-N 3.36Å; T87-L90 PolarHBondContact O-N 2.84Å; T87-N91 WeakPolarHBondContact O-CB 3.43Å; T87-N91 PolarHBondContact O-N 3.09Å
88	Q	89.6	Confident	88.8	Confident	77 Å²	77	81.6 Å²	81.6	36%	0.36	43%	0.434	S	S	.	.	H	α-helix	trans	-71.4	-39.5	179.3	-168.9	146	-16.9	0	0	112.5	I76 I84 R86 L90 N91 H92	I76-Q88 HydrophobicContact CD1-CG 4.12Å; I76-Q88 HydrophobicContact CG1-CG 4.1Å; I84-Q88 WeakPolarHBondContact O-CB 3.39Å; I84-Q88 PolarHBondContact O-N 2.83Å; R86-Q88 VanDerWaalsContact C-N 3.33Å; R86-Q88 PolarHBondContact O-N 2.85Å; Q88-L90 VanDerWaalsContact C-N 3.31Å; Q88-L90 PolarHBondContact O-N 3.39Å; Q88-N91 PolarHBondContact O-N 3.17Å; Q88-H92 WeakPolarHBondContact O-CB 3.42Å; Q88-H92 PolarHBondContact O-N 2.96Å
89	M	89.8	Confident	89.4	Confident	44 Å²	44	78.5 Å²	78.5	22%	0.217	42%	0.42	C	S	.	.	H	α-helix	trans	-58.1	-45.1	169.8	-99.6	-157.3	-84.2	0	0	111.6	L67 F71 I76 R85 R86 N91 H92 L93	L67-M89 HydrophobicContact CD1-SD 4.41Å; F71-M89 HydrophobicContact CD1-CE 4.12Å; F71-M89 HydrophobicContact CD1-SD 3.59Å; F71-M89 VanDerWaalsContact CD1-SD 3.59Å; F71-M89 HydrophobicContact CE1-CE 3.75Å; F71-M89 HydrophobicContact CE1-SD 3.44Å; F71-M89 WeakPolarHBondContact CE1-SD 3.18Å; F71-M89 HydrophobicContact CG-SD 4.21Å; F71-M89 HydrophobicContact CZ-SD 3.98Å; I76-M89 HydrophobicContact CD1-CG 4.38Å; I76-M89 HydrophobicContact CG2-CG 4.14Å; R85-M89 WeakPolarHBondContact O-CB 3.22Å; R85-M89 PolarHBondContact O-N 3.38Å; R86-M89 PolarHBondContact O-N 3.47Å; M89-N91 PolarHBondContact O-N 3.33Å; M89-H92 WeakPolarHBondContact O-CB 3.33Å; M89-H92 PolarHBondContact O-N 2.82Å; M89-H92 VanDerWaalsContact O-N 3.17Å; M89-L93 PolarHBondContact O-N 2.99Å
90	L	91.5	Very high	89.9	Confident	108 Å²	108	79.4 Å²	79.4	57%	0.565	43%	0.425	S	S	*	.	H	α-helix	trans	-62.7	-43.5	178.2	-173.2	65.4	0	0	0	111.3	R86 T87 Q88 H92 L93 T94	R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 PolarHBondContact O-N 2.98Å; T87-L90 PolarHBondContact O-N 2.84Å; Q88-L90 VanDerWaalsContact C-N 3.31Å; Q88-L90 PolarHBondContact O-N 3.39Å; L90-H92 VanDerWaalsContact C-N 3.26Å; L90-H92 PolarHBondContact O-N 3.45Å; L90-L93 PolarHBondContact O-N 2.84Å; L90-T94 WeakPolarHBondContact O-CB 3.33Å; L90-T94 PolarHBondContact O-N 3.33Å; L90-T94 PolarHBondContact O-OG1 3.37Å; L90-T94 VanDerWaalsContact O-OG1 3.05Å
91	N	92.1	Very high	90.8	Very high	103 Å²	103	74.4 Å²	74.4	55%	0.551	39%	0.393	S	S	*	.	H	α-helix	trans	-60.9	-38.3	175.5	-165.4	30.4	0	0	0	111.5	T87 Q88 M89 K95	T87-N91 WeakPolarHBondContact O-CB 3.43Å; T87-N91 PolarHBondContact O-N 3.09Å; Q88-N91 PolarHBondContact O-N 3.17Å; M89-N91 PolarHBondContact O-N 3.33Å; N91-K95 WeakPolarHBondContact O-CB 3.47Å; N91-K95 PolarHBondContact O-N 2.97Å
92	H	90.1	Very high	91.3	Very high	65 Å²	65	77.6 Å²	77.6	30%	0.301	40%	0.404	S	S	.	.	H	α-helix	trans	-67	-42.5	177.5	-143.3	-28.5	0	0	0	112.2	Q88 M89 L90 S96	Q88-H92 WeakPolarHBondContact O-CB 3.42Å; Q88-H92 PolarHBondContact O-N 2.96Å; M89-H92 WeakPolarHBondContact O-CB 3.33Å; M89-H92 PolarHBondContact O-N 2.82Å; M89-H92 VanDerWaalsContact O-N 3.17Å; L90-H92 VanDerWaalsContact C-N 3.26Å; L90-H92 PolarHBondContact O-N 3.45Å; H92-S96 WeakPolarHBondContact O-CB 3.24Å; H92-S96 PolarHBondContact O-N 3.44Å
93	L	92.9	Very high	91.7	Very high	55 Å²	55	74.2 Å²	74.2	29%	0.288	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-52.8	173.7	-176.6	158.9	0	0	0	110.8	L67 M89 L90 K95 S96 G97	L67-L93 HydrophobicContact CB-CD1 4.05Å; L67-L93 HydrophobicContact CD1-CD1 4.19Å; L67-L93 HydrophobicContact CD2-CD1 4.42Å; L67-L93 HydrophobicContact CG-CD1 4.44Å; M89-L93 PolarHBondContact O-N 2.99Å; L90-L93 PolarHBondContact O-N 2.84Å; L93-K95 PolarHBondContact O-N 2.81Å; L93-S96 PolarHBondContact O-N 3.37Å; L93-G97 PolarHBondContact O-N 2.87Å
94	T	93.8	Very high	92	Very high	78 Å²	78	72 Å²	72	48%	0.479	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-43	-177.7	-59.1	0	0	0	0	111.6	L90 G97 A98	L90-T94 WeakPolarHBondContact O-CB 3.33Å; L90-T94 PolarHBondContact O-N 3.33Å; L90-T94 PolarHBondContact O-OG1 3.37Å; L90-T94 VanDerWaalsContact O-OG1 3.05Å; T94-G97 PolarHBondContact O-N 3.4Å; T94-A98 VanDerWaalsContact O-CB 3.24Å; T94-A98 WeakPolarHBondContact O-CB 3.39Å; T94-A98 PolarHBondContact O-N 3.48Å
95	K	94.2	Very high	92.3	Very high	142 Å²	142	68.7 Å²	68.7	62%	0.617	36%	0.355	S	S	*	.	H	α-helix	trans	-67.5	-42.5	179.2	-170.7	172.5	-175.7	179.5	0	112	N91 L93 T99	N91-K95 WeakPolarHBondContact O-CB 3.47Å; N91-K95 PolarHBondContact O-N 2.97Å; L93-K95 PolarHBondContact O-N 2.81Å; K95-T99 WeakPolarHBondContact O-CB 3.24Å; K95-T99 WeakPolarHBondContact O-CG2 3.43Å; K95-T99 PolarHBondContact O-N 2.85Å; K95-T99 PolarHBondContact O-OG1 2.85Å
96	S	93.3	Very high	92.5	Very high	16 Å²	16	66.8 Å²	66.8	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-66.7	-41.2	175.8	-177.6	0	0	0	0	111.7	G62 G66 H92 L93 T99 L100	G62-S96 CarbonylContact O-C 3.53Å; G62-S96 WeakPolarHBondContact O-CB 3.33Å; G62-S96 PolarHBondContact O-OG 2.7Å; G66-S96 VanDerWaalsContact CA-CB 3.47Å; G66-S96 PolarHBondContact N-OG 2.91Å; H92-S96 WeakPolarHBondContact O-CB 3.24Å; H92-S96 PolarHBondContact O-N 3.44Å; L93-S96 PolarHBondContact O-N 3.37Å; S96-T99 WeakPolarHBondContact CA-OG1 3.3Å; S96-T99 PolarHBondContact O-OG1 2.82Å; S96-L100 PolarHBondContact O-N 3.29Å; S96-L100 VanDerWaalsContact O-N 3.11Å
97	G	94	Very high	92.7	Very high	6 Å²	6	61 Å²	61	6%	0.062	34%	0.337	C	S	.	.	H	α-helix	trans	-59.7	-51.5	173	0	0	0	0	0	111.9	L93 T94 T99 L100 A101	L93-G97 PolarHBondContact O-N 2.87Å; T94-G97 PolarHBondContact O-N 3.4Å; G97-T99 PolarHBondContact O-N 3.47Å; G97-L100 PolarHBondContact O-N 3.18Å; G97-A101 WeakPolarHBondContact O-CB 3.31Å; G97-A101 PolarHBondContact O-N 3.47Å
98	A	94.7	Very high	92.6	Very high	43 Å²	43	56.6 Å²	56.6	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-61.9	-43	-179.1	0	0	0	0	0	112.6	T94 A101 Q102	T94-A98 VanDerWaalsContact O-CB 3.24Å; T94-A98 WeakPolarHBondContact O-CB 3.39Å; T94-A98 PolarHBondContact O-N 3.48Å; A98-A101 PolarHBondContact O-N 2.85Å; A98-Q102 WeakPolarHBondContact O-CB 3.45Å; A98-Q102 VanDerWaalsContact O-CG 3.26Å; A98-Q102 WeakPolarHBondContact O-CG 3.49Å; A98-Q102 PolarHBondContact O-N 2.87Å
99	T	94.4	Very high	92.7	Very high	68 Å²	68	58.6 Å²	58.6	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-47.2	178.5	46.5	0	0	0	0	111.8	K95 S96 G97 Q102 T103	K95-T99 WeakPolarHBondContact O-CB 3.24Å; K95-T99 WeakPolarHBondContact O-CG2 3.43Å; K95-T99 PolarHBondContact O-N 2.85Å; K95-T99 PolarHBondContact O-OG1 2.85Å; S96-T99 WeakPolarHBondContact CA-OG1 3.3Å; S96-T99 PolarHBondContact O-OG1 2.82Å; G97-T99 PolarHBondContact O-N 3.47Å; T99-Q102 PolarHBondContact O-N 3.37Å; T99-T103 PolarHBondContact O-N 2.83Å; T99-T103 VanDerWaalsContact O-N 3.1Å; T99-T103 PolarHBondContact O-OG1 3.33Å
100	L	93.4	Very high	92.8	Very high	50 Å²	50	58.1 Å²	58.1	26%	0.262	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-35.1	177.6	-77.2	179.3	0	0	0	112.8	G58 K65 S96 G97 Q102 T103 A104	G58-L100 WeakPolarHBondContact O-CB 3.27Å; K65-L100 HydrophobicContact CD-CD1 4.06Å; S96-L100 PolarHBondContact O-N 3.29Å; S96-L100 VanDerWaalsContact O-N 3.11Å; G97-L100 PolarHBondContact O-N 3.18Å; L100-Q102 PolarHBondContact O-N 2.95Å; L100-T103 WeakPolarHBondContact CA-OG1 3.42Å; L100-T103 PolarHBondContact O-N 3.21Å; L100-T103 PolarHBondContact O-OG1 3.33Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 2.77Å
101	A	94.4	Very high	92.6	Very high	12 Å²	12	55.2 Å²	55.2	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-42.4	173.4	0	0	0	0	0	112.2	V55 A59 G97 A98 G105	V55-A101 HydrophobicContact CG1-CB 4.16Å; A59-A101 HydrophobicContact CB-CB 3.87Å; G97-A101 WeakPolarHBondContact O-CB 3.31Å; G97-A101 PolarHBondContact O-N 3.47Å; A98-A101 PolarHBondContact O-N 2.85Å; A101-G105 PolarHBondContact O-N 3.11Å
102	Q	95.1	Very high	92.4	Very high	140 Å²	140	50.8 Å²	50.8	65%	0.654	28%	0.276	S	S	*	.	H	α-helix	trans	-65.5	-43.2	176.3	-73.8	171.5	2.7	0	0	111.8	A98 T99 L100 S106	A98-Q102 WeakPolarHBondContact O-CB 3.45Å; A98-Q102 VanDerWaalsContact O-CG 3.26Å; A98-Q102 WeakPolarHBondContact O-CG 3.49Å; A98-Q102 PolarHBondContact O-N 2.87Å; T99-Q102 PolarHBondContact O-N 3.37Å; L100-Q102 PolarHBondContact O-N 2.95Å; Q102-S106 WeakPolarHBondContact O-CB 3.32Å; Q102-S106 PolarHBondContact O-N 3.44Å; Q102-S106 PolarHBondContact O-OG 2.95Å
103	T	92.4	Very high	92.3	Very high	49 Å²	49	50.7 Å²	50.7	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-66.6	-43	176.8	55.6	0	0	0	0	112.1	T99 L100 S106 I107 Y142	T99-T103 PolarHBondContact O-N 2.83Å; T99-T103 VanDerWaalsContact O-N 3.1Å; T99-T103 PolarHBondContact O-OG1 3.33Å; L100-T103 WeakPolarHBondContact CA-OG1 3.42Å; L100-T103 PolarHBondContact O-N 3.21Å; L100-T103 PolarHBondContact O-OG1 3.33Å; T103-S106 PolarHBondContact O-OG 3.25Å; T103-I107 WeakPolarHBondContact O-CD1 3.22Å; T103-I107 VanDerWaalsContact O-CG1 3.22Å; T103-I107 WeakPolarHBondContact O-CG1 3.29Å; T103-I107 PolarHBondContact O-N 3.38Å; T103-I107 VanDerWaalsContact O-N 3.09Å; T103-Y142 WeakPolarHBondContact CG2-OH 3.37Å
104	A	92.7	Very high	92	Very high	16 Å²	16	48.7 Å²	48.7	13%	0.132	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-43.4	177.7	0	0	0	0	0	111.3	M54 L100 S106 I107 G108	M54-A104 HydrophobicContact CE-CB 4.34Å; M54-A104 WeakPolarHBondContact CE-O 3.24Å; M54-A104 WeakPolarHBondContact O-CB 3.26Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 2.77Å; A104-S106 PolarHBondContact O-N 2.86Å; A104-I107 PolarHBondContact O-N 2.69Å; A104-G108 PolarHBondContact O-N 2.7Å
105	G	92.7	Very high	91.5	Very high	10 Å²	10	46.6 Å²	46.6	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-42.1	177.5	0	0	0	0	0	113.1	A101 G108 F109	A101-G105 PolarHBondContact O-N 3.11Å; G105-G108 PolarHBondContact O-N 3.41Å; G105-F109 WeakPolarHBondContact O-CB 3.32Å; G105-F109 PolarHBondContact O-N 2.9Å
106	S	91.9	Very high	90.9	Very high	45 Å²	45	43 Å²	43	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-41.7	176.4	50.5	0	0	0	0	112.5	Q102 T103 A104 F109 I110	Q102-S106 WeakPolarHBondContact O-CB 3.32Å; Q102-S106 PolarHBondContact O-N 3.44Å; Q102-S106 PolarHBondContact O-OG 2.95Å; T103-S106 PolarHBondContact O-OG 3.25Å; A104-S106 PolarHBondContact O-N 2.86Å; S106-F109 PolarHBondContact O-N 3.28Å; S106-I110 VanDerWaalsContact O-CG1 3.24Å; S106-I110 WeakPolarHBondContact O-CG1 3.17Å; S106-I110 PolarHBondContact O-N 3.4Å
107	I	92.1	Very high	90.5	Very high	57 Å²	57	46.9 Å²	46.9	29%	0.292	26%	0.261	S	S	.	.	H	α-helix	trans	-62	-45.4	173.9	-65.9	165.8	0	0	0	110.6	M54 T103 A104 F109 I110 Y111 T138 Y142	M54-I107 HydrophobicContact CE-CB 3.91Å; M54-I107 HydrophobicContact CE-CG2 3.83Å; T103-I107 WeakPolarHBondContact O-CD1 3.22Å; T103-I107 VanDerWaalsContact O-CG1 3.22Å; T103-I107 WeakPolarHBondContact O-CG1 3.29Å; T103-I107 PolarHBondContact O-N 3.38Å; T103-I107 VanDerWaalsContact O-N 3.09Å; A104-I107 PolarHBondContact O-N 2.69Å; I107-F109 VanDerWaalsContact C-N 3.33Å; I107-F109 PolarHBondContact O-N 3.47Å; I107-I110 PolarHBondContact O-N 2.88Å; I107-Y111 WeakPolarHBondContact O-CB 3.36Å; I107-Y111 PolarHBondContact O-N 3.43Å; I107-T138 HydrophobicContact CG2-CG2 3.91Å; I107-T138 WeakPolarHBondContact O-CG2 3.26Å; I107-Y142 HydrophobicContact CD1-CD1 4.3Å; I107-Y142 HydrophobicContact CD1-CE1 4.07Å; I107-Y142 HydrophobicContact CD1-CE2 4.47Å; I107-Y142 HydrophobicContact CG1-CD1 4.09Å; I107-Y142 HydrophobicContact CG1-CD2 3.78Å; I107-Y142 HydrophobicContact CG1-CE1 4.15Å; I107-Y142 HydrophobicContact CG1-CE2 3.84Å; I107-Y142 HydrophobicContact CG1-CG 3.9Å
108	G	90.1	Very high	89.9	Confident	4 Å²	4	47.8 Å²	47.8	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-38.8	178.4	0	0	0	0	0	113.2	M54 A104 G105 Y111 A112	M54-G108 WeakPolarHBondContact SD-CA 3.43Å; A104-G108 PolarHBondContact O-N 2.7Å; G105-G108 PolarHBondContact O-N 3.41Å; G108-Y111 PolarHBondContact O-N 2.85Å; G108-A112 WeakPolarHBondContact O-CB 3.38Å; G108-A112 PolarHBondContact O-N 3.41Å
109	F	91.3	Very high	89.2	Confident	119 Å²	119	47.7 Å²	47.7	52%	0.522	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-47.1	173.7	177.5	-100.6	0	0	0	111.9	I51 G105 S106 I107 Y111 A112 V113	I51-F109 HydrophobicContact CD1-CD2 4.13Å; G105-F109 WeakPolarHBondContact O-CB 3.32Å; G105-F109 PolarHBondContact O-N 2.9Å; S106-F109 PolarHBondContact O-N 3.28Å; I107-F109 VanDerWaalsContact C-N 3.33Å; I107-F109 PolarHBondContact O-N 3.47Å; F109-Y111 VanDerWaalsContact C-N 3.26Å; F109-Y111 PolarHBondContact O-N 2.97Å; F109-A112 PolarHBondContact O-N 2.89Å; F109-V113 HydrophobicContact CD1-CG2 4.36Å; F109-V113 HydrophobicContact CD2-CG2 4.42Å; F109-V113 HydrophobicContact CE1-CG2 3.88Å; F109-V113 HydrophobicContact CE2-CG2 3.95Å; F109-V113 HydrophobicContact CZ-CG2 3.66Å; F109-V113 WeakPolarHBondContact O-CG2 3.49Å; F109-V113 PolarHBondContact O-N 3.45Å
110	I	90.8	Very high	88.4	Confident	35 Å²	35	51.8 Å²	51.8	18%	0.179	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-40.6	177.6	-65.4	163.7	0	0	0	110.1	S106 I107 V113 A114 T138 V141 Y142	S106-I110 VanDerWaalsContact O-CG1 3.24Å; S106-I110 WeakPolarHBondContact O-CG1 3.17Å; S106-I110 PolarHBondContact O-N 3.4Å; I107-I110 PolarHBondContact O-N 2.88Å; I110-V113 PolarHBondContact O-N 2.85Å; I110-A114 VanDerWaalsContact O-CB 3.25Å; I110-A114 WeakPolarHBondContact O-CB 3.4Å; I110-A114 PolarHBondContact O-N 3.39Å; I110-T138 HydrophobicContact CB-CG2 3.94Å; I110-T138 HydrophobicContact CG2-CG2 3.73Å; I110-V141 HydrophobicContact CD1-CG1 4.46Å; I110-V141 HydrophobicContact CG2-CB 4.04Å; I110-V141 HydrophobicContact CG2-CG1 3.94Å; I110-Y142 HydrophobicContact CD1-CD2 3.84Å; I110-Y142 HydrophobicContact CD1-CG 4.42Å
111	Y	88.6	Confident	87.9	Confident	47 Å²	47	56.1 Å²	56.1	18%	0.184	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-49	174.6	175.9	-101.2	0	0	0	112.4	E50 I107 G108 F109 V113 A114 D115 A134 A135 T138	E50-Y111 WeakPolarHBondContact OE1-CE1 3.49Å; I107-Y111 WeakPolarHBondContact O-CB 3.36Å; I107-Y111 PolarHBondContact O-N 3.43Å; G108-Y111 PolarHBondContact O-N 2.85Å; F109-Y111 VanDerWaalsContact C-N 3.26Å; F109-Y111 PolarHBondContact O-N 2.97Å; Y111-V113 VanDerWaalsContact C-N 3.31Å; Y111-V113 PolarHBondContact O-N 3.39Å; Y111-A114 PolarHBondContact O-N 3.17Å; Y111-D115 WeakPolarHBondContact O-CB 3.21Å; Y111-D115 PolarHBondContact O-N 2.91Å; Y111-A134 HydrophobicContact CD2-CB 4.05Å; Y111-A134 HydrophobicContact CE2-CB 3.75Å; Y111-A135 HydrophobicContact CE2-CB 4.47Å; Y111-T138 WeakPolarHBondContact CA-OG1 3.42Å; Y111-T138 PolarHBondContact N-OG1 3.25Å
112	A	87	Confident	86.8	Confident	9 Å²	9	61.6 Å²	61.6	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-41.2	178.4	0	0	0	0	0	112.3	I51 G108 F109 F116	I51-A112 HydrophobicContact CD1-CB 3.94Å; I51-A112 HydrophobicContact CG1-CB 4.22Å; G108-A112 WeakPolarHBondContact O-CB 3.38Å; G108-A112 PolarHBondContact O-N 3.41Å; F109-A112 PolarHBondContact O-N 2.89Å; A112-F116 WeakPolarHBondContact O-CB 3.41Å; A112-F116 PolarHBondContact O-N 3.25Å
113	V	87.8	Confident	85.7	Confident	64 Å²	64	57.8 Å²	57.8	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-67	-44.2	175.7	173.4	0	0	0	0	110.9	F109 I110 Y111 F116 L117	F109-V113 HydrophobicContact CD1-CG2 4.36Å; F109-V113 HydrophobicContact CD2-CG2 4.42Å; F109-V113 HydrophobicContact CE1-CG2 3.88Å; F109-V113 HydrophobicContact CE2-CG2 3.95Å; F109-V113 HydrophobicContact CZ-CG2 3.66Å; F109-V113 WeakPolarHBondContact O-CG2 3.49Å; F109-V113 PolarHBondContact O-N 3.45Å; I110-V113 PolarHBondContact O-N 2.85Å; Y111-V113 VanDerWaalsContact C-N 3.31Å; Y111-V113 PolarHBondContact O-N 3.39Å; V113-F116 PolarHBondContact O-N 2.78Å; V113-L117 HydrophobicContact CG1-CD1 4.41Å; V113-L117 WeakPolarHBondContact O-CB 3.32Å; V113-L117 PolarHBondContact O-N 2.94Å
114	A	87.2	Confident	84.5	Confident	12 Å²	12	60.2 Å²	60.2	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-43.7	178.4	0	0	0	0	0	111.8	I110 Y111 L117 I118 A134 T137	I110-A114 VanDerWaalsContact O-CB 3.25Å; I110-A114 WeakPolarHBondContact O-CB 3.4Å; I110-A114 PolarHBondContact O-N 3.39Å; Y111-A114 PolarHBondContact O-N 3.17Å; A114-L117 PolarHBondContact O-N 3.44Å; A114-I118 WeakPolarHBondContact O-CB 3.4Å; A114-I118 VanDerWaalsContact O-CG1 3.28Å; A114-I118 WeakPolarHBondContact O-CG1 3.34Å; A114-I118 PolarHBondContact O-N 3.39Å; A114-A134 HydrophobicContact CB-CB 4.26Å; A114-T137 HydrophobicContact CB-CG2 4.49Å
115	D	82.6	Confident	83.1	Confident	35 Å²	35	61.2 Å²	61.2	19%	0.187	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-47.6	175.5	-175.1	74	0	0	0	111	R43 Y111 L117 I118 Y119 A134	R43-D115 IonicContact NH1-OD2 2.7Å; R43-D115 PolarHBondContact NH1-OD2 2.95Å; Y111-D115 WeakPolarHBondContact O-CB 3.21Å; Y111-D115 PolarHBondContact O-N 2.91Å; D115-L117 PolarHBondContact O-N 3.18Å; D115-I118 PolarHBondContact O-N 2.86Å; D115-Y119 VanDerWaalsContact O-CB 3.22Å; D115-Y119 WeakPolarHBondContact O-CB 3.46Å; D115-Y119 PolarHBondContact O-N 3.49Å; D115-A134 HydrophobicContact CB-CB 4.33Å
116	F	81.7	Confident	81.8	Confident	66 Å²	66	65.3 Å²	65.3	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-41.8	176.9	-177.6	-100.1	0	0	0	112.4	F44 A112 V113 K120	F44-F116 HydrophobicContact CE2-CD2 4.44Å; F44-F116 AromaticContact CE2-CE2 3.75Å; F44-F116 HydrophobicContact CE2-CE2 3.75Å; F44-F116 AromaticContact CE2-CZ 3.87Å; F44-F116 HydrophobicContact CE2-CZ 3.87Å; F44-F116 HydrophobicContact CZ-CD2 4.32Å; F44-F116 HydrophobicContact CZ-CE1 4.14Å; F44-F116 AromaticContact CZ-CE2 3.9Å; F44-F116 HydrophobicContact CZ-CE2 3.9Å; F44-F116 AromaticContact CZ-CZ 3.8Å; F44-F116 HydrophobicContact CZ-CZ 3.8Å; A112-F116 WeakPolarHBondContact O-CB 3.41Å; A112-F116 PolarHBondContact O-N 3.25Å; V113-F116 PolarHBondContact O-N 2.78Å; F116-K120 HydrophobicContact CZ-CG 4.45Å; F116-K120 PolarHBondContact O-N 2.68Å
117	L	84.8	Confident	80.7	Confident	98 Å²	98	67.4 Å²	67.4	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-47.9	178.6	-129.2	99.9	0	0	0	111.3	V113 A114 D115 Y119 K120 L121	V113-L117 HydrophobicContact CG1-CD1 4.41Å; V113-L117 WeakPolarHBondContact O-CB 3.32Å; V113-L117 PolarHBondContact O-N 2.94Å; A114-L117 PolarHBondContact O-N 3.44Å; D115-L117 PolarHBondContact O-N 3.18Å; L117-Y119 VanDerWaalsContact C-N 3.33Å; L117-Y119 PolarHBondContact O-N 2.91Å; L117-K120 PolarHBondContact O-N 2.81Å; L117-L121 HydrophobicContact CD2-CD1 4.22Å; L117-L121 WeakPolarHBondContact O-CB 3.19Å; L117-L121 VanDerWaalsContact O-CG 3.26Å; L117-L121 WeakPolarHBondContact O-CG 3.15Å; L117-L121 PolarHBondContact O-N 2.93Å
118	I	82.2	Confident	79.8	Confident	24 Å²	24	68.2 Å²	68.2	12%	0.123	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-41.9	-180	-69.5	170.9	0	0	0	110.2	A114 D115 K120 L121 R122 N130 A133 A134	A114-I118 WeakPolarHBondContact O-CB 3.4Å; A114-I118 VanDerWaalsContact O-CG1 3.28Å; A114-I118 WeakPolarHBondContact O-CG1 3.34Å; A114-I118 PolarHBondContact O-N 3.39Å; D115-I118 PolarHBondContact O-N 2.86Å; I118-K120 VanDerWaalsContact C-N 3.33Å; I118-K120 PolarHBondContact O-N 2.89Å; I118-L121 PolarHBondContact O-N 3.26Å; I118-R122 WeakPolarHBondContact O-CB 3.25Å; I118-R122 PolarHBondContact O-N 3.08Å; I118-N130 HydrophobicContact CG2-CB 3.94Å; I118-A133 HydrophobicContact CD1-CB 3.96Å; I118-A134 HydrophobicContact CD1-CB 3.96Å
119	Y	79.3	Confident	79	Confident	41 Å²	41	73.3 Å²	73.3	16%	0.161	38%	0.376	C	S	.	.	H	α-helix	trans	-57.8	-45.3	174.5	173.9	-102.1	0	0	0	112.1	D115 L117 R122 G123 N124 E126	D115-Y119 VanDerWaalsContact O-CB 3.22Å; D115-Y119 WeakPolarHBondContact O-CB 3.46Å; D115-Y119 PolarHBondContact O-N 3.49Å; L117-Y119 VanDerWaalsContact C-N 3.33Å; L117-Y119 PolarHBondContact O-N 2.91Å; Y119-R122 PolarHBondContact O-N 3.38Å; Y119-G123 PolarHBondContact O-N 3.33Å; Y119-N124 HydrophobicContact CE1-CB 4.42Å; Y119-N124 WeakPolarHBondContact CE1-OD1 3.17Å; Y119-N124 HydrophobicContact CE2-CB 3.78Å; Y119-N124 WeakPolarHBondContact CE2-O 3.25Å; Y119-N124 PolarHBondContact O-N 3.37Å; Y119-N124 WeakPolarHBondContact OH-CB 3.43Å; Y119-N124 PolarHBondContact OH-OD1 3.26Å; Y119-N124 VanDerWaalsContact OH-OD1 3.1Å; Y119-E126 HydrophobicContact CD2-CG 4.36Å; Y119-E126 HydrophobicContact CE2-CG 4.29Å
120	K	79.1	Confident	78.4	Confident	155 Å²	155	68 Å²	68	67%	0.674	35%	0.353	S	S	*	.	H	α-helix	trans	-66.7	-39.8	176.8	-110.9	-135.4	175.9	-172.3	0	112.7	F116 L117 I118 R122	F116-K120 HydrophobicContact CZ-CG 4.45Å; F116-K120 PolarHBondContact O-N 2.68Å; L117-K120 PolarHBondContact O-N 2.81Å; I118-K120 VanDerWaalsContact C-N 3.33Å; I118-K120 PolarHBondContact O-N 2.89Å; K120-R122 VanDerWaalsContact C-N 3.32Å
121	L	80.9	Confident	77.8	Confident	140 Å²	140	68 Å²	68	73%	0.733	36%	0.355	S	S	*	.	H	α-helix	trans	-70.1	-28.5	-179.6	-73.1	170.5	0	0	0	112.7	L117 I118	L117-L121 HydrophobicContact CD2-CD1 4.22Å; L117-L121 WeakPolarHBondContact O-CB 3.19Å; L117-L121 VanDerWaalsContact O-CG 3.26Å; L117-L121 WeakPolarHBondContact O-CG 3.15Å; L117-L121 PolarHBondContact O-N 2.93Å; I118-L121 PolarHBondContact O-N 3.26Å
122	R	72.7	Confident	77.4	Confident	127 Å²	127	67.7 Å²	67.7	48%	0.479	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	20.8	-174.9	-157.3	168.1	-79.1	-177.7	-9.9	113.9	I118 Y119 K120 N124 N130	I118-R122 WeakPolarHBondContact O-CB 3.25Å; I118-R122 PolarHBondContact O-N 3.08Å; Y119-R122 PolarHBondContact O-N 3.38Å; K120-R122 VanDerWaalsContact C-N 3.32Å; R122-N124 PolarHBondContact O-N 2.95Å; R122-N130 WeakPolarHBondContact CD-OD1 3.48Å; R122-N130 PolarHBondContact NH1-OD1 3.34Å
123	G	70.6	Confident	77.3	Confident	60 Å²	60	68.9 Å²	68.9	62%	0.619	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	38.6	168.5	0	0	0	0	0	114.8	Y119 A125	Y119-G123 PolarHBondContact O-N 3.33Å; G123-A125 VanDerWaalsContact C-N 3.34Å; G123-A125 PolarHBondContact O-N 2.82Å
124	N	69	Low	77	Confident	101 Å²	101	65.8 Å²	65.8	54%	0.54	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	12.7	177.2	-51	-46.9	0	0	0	117	Y119 R122	Y119-N124 HydrophobicContact CE1-CB 4.42Å; Y119-N124 WeakPolarHBondContact CE1-OD1 3.17Å; Y119-N124 HydrophobicContact CE2-CB 3.78Å; Y119-N124 WeakPolarHBondContact CE2-O 3.25Å; Y119-N124 PolarHBondContact O-N 3.37Å; Y119-N124 WeakPolarHBondContact OH-CB 3.43Å; Y119-N124 PolarHBondContact OH-OD1 3.26Å; Y119-N124 VanDerWaalsContact OH-OD1 3.1Å; R122-N124 PolarHBondContact O-N 2.95Å
125	A	63.2	Low	76.8	Confident	37 Å²	37	65.8 Å²	65.8	31%	0.306	35%	0.347	S	S	.	.			trans	-75.6	133.3	171.8	0	0	0	0	0	111.2	G123 N130	G123-A125 VanDerWaalsContact C-N 3.34Å; G123-A125 PolarHBondContact O-N 2.82Å; A125-N130 PolarHBondContact O-ND2 3.42Å
126	E	63.9	Low	77	Confident	95 Å²	95	65.7 Å²	65.7	44%	0.444	35%	0.348	S	S	.	.			trans	-107.6	97.6	172.8	-72.4	-173.3	-152	0	0	109.4	R40 R43 Y119	R40-E126 IonicContact NH1-OE1 3.52Å; R40-E126 PolarHBondContact NH1-OE1 3.21Å; R43-E126 IonicContact CZ-OE1 3.49Å; R43-E126 IonicContact NE-OE1 3.46Å; R43-E126 IonicContact NH2-OE1 3.42Å; R43-E126 PolarHBondContact NH2-OE1 2.93Å; R43-E126 IonicContact NH2-OE2 2.81Å; Y119-E126 HydrophobicContact CD2-CG 4.36Å; Y119-E126 HydrophobicContact CE2-CG 4.29Å
127	D	69.1	Low	77.2	Confident	90 Å²	90	65.3 Å²	65.3	48%	0.481	35%	0.351	S	S	.	.			trans	-117.9	153.5	175.8	-66.2	-43.9	0	0	0	111.2	I129 N130	D127-I129 PolarHBondContact O-N 3.39Å; D127-I129 VanDerWaalsContact O-N 3.1Å; D127-N130 WeakPolarHBondContact O-CA 3.38Å; D127-N130 VanDerWaalsContact O-CB 3.27Å; D127-N130 WeakPolarHBondContact O-CB 3.23Å; D127-N130 PolarHBondContact O-N 3.48Å
128	E	73.9	Confident	77.3	Confident	74 Å²	74	61 Å²	61	35%	0.346	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-27.2	177.1	-67.4	166.8	-176.9	0	0	112	N130 T131 M132 V171 R178	E128-N130 VanDerWaalsContact C-N 3.28Å; E128-N130 PolarHBondContact O-N 2.89Å; E128-T131 PolarHBondContact O-N 3.18Å; E128-M132 PolarHBondContact O-N 3.39Å; E128-M132 VanDerWaalsContact O-N 3.17Å; E128-V171 HydrophobicContact CB-CG1 3.78Å; E128-V171 HydrophobicContact CB-CG2 4.06Å; E128-V171 HydrophobicContact CG-CG1 3.91Å; E128-R178 IonicContact OE1-CZ 3.58Å; E128-R178 IonicContact OE1-NE 2.84Å; E128-R178 PolarHBondContact OE1-NE 3.4Å; E128-R178 IonicContact OE1-NH2 2.85Å; E128-R178 PolarHBondContact OE1-NH2 2.92Å
129	I	73.5	Confident	77.3	Confident	110 Å²	110	60.4 Å²	60.4	56%	0.564	33%	0.329	S	S	*	.	H	α-helix	trans	-63.3	-34.3	173.1	-62.1	170.9	0	0	0	111.3	D127 M132 A133	D127-I129 PolarHBondContact O-N 3.39Å; D127-I129 VanDerWaalsContact O-N 3.1Å; I129-M132 PolarHBondContact O-N 2.87Å; I129-A133 VanDerWaalsContact O-CB 3.23Å; I129-A133 WeakPolarHBondContact O-CB 3.05Å; I129-A133 PolarHBondContact O-N 3.23Å
130	N	78.2	Confident	77.6	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-39.7	178.3	-66.8	-8.5	0	0	0	110.7	I118 R122 A125 D127 E128 A133 A134	I118-N130 HydrophobicContact CG2-CB 3.94Å; R122-N130 WeakPolarHBondContact CD-OD1 3.48Å; R122-N130 PolarHBondContact NH1-OD1 3.34Å; A125-N130 PolarHBondContact O-ND2 3.42Å; D127-N130 WeakPolarHBondContact O-CA 3.38Å; D127-N130 VanDerWaalsContact O-CB 3.27Å; D127-N130 WeakPolarHBondContact O-CB 3.23Å; D127-N130 PolarHBondContact O-N 3.48Å; E128-N130 VanDerWaalsContact C-N 3.28Å; E128-N130 PolarHBondContact O-N 2.89Å; N130-A133 PolarHBondContact O-N 3.36Å; N130-A134 WeakPolarHBondContact O-CB 3.36Å; N130-A134 PolarHBondContact O-N 2.99Å
131	T	78.4	Confident	78.1	Confident	35 Å²	35	57.7 Å²	57.7	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-44.2	174.9	-55	0	0	0	0	111.2	E128 A135 V171	E128-T131 PolarHBondContact O-N 3.18Å; T131-A135 VanDerWaalsContact O-CB 3.22Å; T131-A135 WeakPolarHBondContact O-CB 3.22Å; T131-A135 PolarHBondContact O-N 2.85Å; T131-V171 HydrophobicContact CG2-CG2 4.08Å
132	M	80.7	Confident	78.3	Confident	42 Å²	42	55.1 Å²	55.1	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-41.9	177.2	-66.5	179.6	60.6	0	0	112.4	E128 I129 T136 F164 T168 V171	E128-M132 PolarHBondContact O-N 3.39Å; E128-M132 VanDerWaalsContact O-N 3.17Å; I129-M132 PolarHBondContact O-N 2.87Å; M132-T136 VanDerWaalsContact O-CB 3.32Å; M132-T136 WeakPolarHBondContact O-CB 3.36Å; M132-T136 PolarHBondContact O-N 2.88Å; M132-T136 PolarHBondContact O-OG1 2.84Å; M132-F164 HydrophobicContact CE-CD2 3.91Å; M132-F164 HydrophobicContact CE-CE1 4.2Å; M132-F164 HydrophobicContact CE-CE2 3.14Å; M132-F164 HydrophobicContact CE-CZ 3.31Å; M132-T168 HydrophobicContact CE-CG2 3.33Å; M132-T168 HydrophobicContact SD-CG2 4.21Å; M132-V171 HydrophobicContact CG-CG2 3.95Å
133	A	83.7	Confident	78.9	Confident	33 Å²	33	50.9 Å²	50.9	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-42.3	177.7	0	0	0	0	0	111.7	I118 I129 N130 T136 T137	I118-A133 HydrophobicContact CD1-CB 3.96Å; I129-A133 VanDerWaalsContact O-CB 3.23Å; I129-A133 WeakPolarHBondContact O-CB 3.05Å; I129-A133 PolarHBondContact O-N 3.23Å; N130-A133 PolarHBondContact O-N 3.36Å; A133-T136 PolarHBondContact O-N 3.44Å; A133-T137 VanDerWaalsContact O-CB 3.25Å; A133-T137 WeakPolarHBondContact O-CB 3.36Å; A133-T137 PolarHBondContact O-N 2.74Å; A133-T137 PolarHBondContact O-OG1 2.82Å
134	A	82.2	Confident	79.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-45.8	175.3	0	0	0	0	0	111	Y111 A114 D115 I118 N130 T137 T138	Y111-A134 HydrophobicContact CD2-CB 4.05Å; Y111-A134 HydrophobicContact CE2-CB 3.75Å; A114-A134 HydrophobicContact CB-CB 4.26Å; D115-A134 HydrophobicContact CB-CB 4.33Å; I118-A134 HydrophobicContact CD1-CB 3.96Å; N130-A134 WeakPolarHBondContact O-CB 3.36Å; N130-A134 PolarHBondContact O-N 2.99Å; A134-T137 PolarHBondContact O-N 3.29Å; A134-T138 VanDerWaalsContact O-CB 3.31Å; A134-T138 WeakPolarHBondContact O-CB 3.33Å; A134-T138 PolarHBondContact O-N 3.41Å; A134-T138 PolarHBondContact O-OG1 3.46Å
135	A	83.7	Confident	80	Confident	12 Å²	12	50.7 Å²	50.7	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-42	177.7	0	0	0	0	0	112.3	Y111 T131 T138 G139 G163	Y111-A135 HydrophobicContact CE2-CB 4.47Å; T131-A135 VanDerWaalsContact O-CB 3.22Å; T131-A135 WeakPolarHBondContact O-CB 3.22Å; T131-A135 PolarHBondContact O-N 2.85Å; A135-T138 WeakPolarHBondContact O-CB 3.42Å; A135-T138 PolarHBondContact O-N 3.1Å; A135-G139 PolarHBondContact O-N 3.46Å; A135-G163 VanDerWaalsContact CB-O 3.29Å; A135-G163 WeakPolarHBondContact CB-O 3.32Å; A135-G163 WeakPolarHBondContact O-CA 3.35Å
136	T	86.1	Confident	80.4	Confident	33 Å²	33	50.5 Å²	50.5	20%	0.202	29%	0.292	C	S	.	.	H	α-helix	trans	-64.7	-46.4	175.9	-55.3	0	0	0	0	111.1	M132 A133 T138 G139 L140	M132-T136 VanDerWaalsContact O-CB 3.32Å; M132-T136 WeakPolarHBondContact O-CB 3.36Å; M132-T136 PolarHBondContact O-N 2.88Å; M132-T136 PolarHBondContact O-OG1 2.84Å; A133-T136 PolarHBondContact O-N 3.44Å; T136-T138 VanDerWaalsContact C-N 3.27Å; T136-T138 PolarHBondContact O-N 2.79Å; T136-G139 PolarHBondContact O-N 3.28Å; T136-G139 VanDerWaalsContact O-N 3.17Å; T136-L140 HydrophobicContact CG2-CD1 4.31Å; T136-L140 WeakPolarHBondContact O-CG 3.28Å; T136-L140 PolarHBondContact O-N 3.37Å
137	T	86.4	Confident	80.8	Confident	58 Å²	58	49.9 Å²	49.9	36%	0.356	29%	0.29	S	S	.	.	H	α-helix	trans	-60	-41.7	177.2	-57.8	0	0	0	0	110.5	A114 A133 A134 G139 L140 V141	A114-T137 HydrophobicContact CB-CG2 4.49Å; A133-T137 VanDerWaalsContact O-CB 3.25Å; A133-T137 WeakPolarHBondContact O-CB 3.36Å; A133-T137 PolarHBondContact O-N 2.74Å; A133-T137 PolarHBondContact O-OG1 2.82Å; A134-T137 PolarHBondContact O-N 3.29Å; T137-G139 PolarHBondContact O-N 2.85Å; T137-L140 PolarHBondContact O-N 2.89Å; T137-V141 HydrophobicContact CG2-CG2 4.11Å; T137-V141 WeakPolarHBondContact O-CB 3.43Å; T137-V141 VanDerWaalsContact O-CG2 3.24Å; T137-V141 WeakPolarHBondContact O-CG2 3.22Å; T137-V141 PolarHBondContact O-N 2.81Å
138	T	86.8	Confident	81	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-46	175.8	-60.5	0	0	0	0	111.7	I107 I110 Y111 A134 A135 T136 L140 V141 Y142	I107-T138 HydrophobicContact CG2-CG2 3.91Å; I107-T138 WeakPolarHBondContact O-CG2 3.26Å; I110-T138 HydrophobicContact CB-CG2 3.94Å; I110-T138 HydrophobicContact CG2-CG2 3.73Å; Y111-T138 WeakPolarHBondContact CA-OG1 3.42Å; Y111-T138 PolarHBondContact N-OG1 3.25Å; A134-T138 VanDerWaalsContact O-CB 3.31Å; A134-T138 WeakPolarHBondContact O-CB 3.33Å; A134-T138 PolarHBondContact O-N 3.41Å; A134-T138 PolarHBondContact O-OG1 3.46Å; A135-T138 WeakPolarHBondContact O-CB 3.42Å; A135-T138 PolarHBondContact O-N 3.1Å; T136-T138 VanDerWaalsContact C-N 3.27Å; T136-T138 PolarHBondContact O-N 2.79Å; T138-L140 VanDerWaalsContact C-N 3.34Å; T138-L140 PolarHBondContact O-N 2.77Å; T138-V141 PolarHBondContact O-N 3.42Å; T138-Y142 VanDerWaalsContact O-CB 3.27Å; T138-Y142 WeakPolarHBondContact O-CB 3.33Å; T138-Y142 PolarHBondContact O-N 2.99Å
139	G	82	Confident	81.2	Confident	12 Å²	12	58.6 Å²	58.6	12%	0.124	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-42.2	176.9	0	0	0	0	0	112.9	A135 T136 T137 T143 G159	A135-G139 PolarHBondContact O-N 3.46Å; T136-G139 PolarHBondContact O-N 3.28Å; T136-G139 VanDerWaalsContact O-N 3.17Å; T137-G139 PolarHBondContact O-N 2.85Å; G139-T143 PolarHBondContact O-N 2.79Å; G139-T143 PolarHBondContact O-OG1 3.48Å; G139-G159 VanDerWaalsContact CA-O 3.3Å; G139-G159 WeakPolarHBondContact CA-O 3.43Å
140	L	86.2	Confident	81.2	Confident	68 Å²	68	60 Å²	60	36%	0.356	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-47.6	175.7	-67.7	171.4	0	0	0	111.8	T136 T137 T138 T143 S144 C156	T136-L140 HydrophobicContact CG2-CD1 4.31Å; T136-L140 WeakPolarHBondContact O-CG 3.28Å; T136-L140 PolarHBondContact O-N 3.37Å; T137-L140 PolarHBondContact O-N 2.89Å; T138-L140 VanDerWaalsContact C-N 3.34Å; T138-L140 PolarHBondContact O-N 2.77Å; L140-T143 PolarHBondContact O-N 2.86Å; L140-T143 PolarHBondContact O-OG1 3.08Å; L140-S144 WeakPolarHBondContact O-CB 3.41Å; L140-S144 PolarHBondContact O-N 2.84Å; L140-C156 WeakPolarHBondContact CD2-O 3.4Å
141	V	88	Confident	81.1	Confident	70 Å²	70	61.8 Å²	61.8	42%	0.424	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-43.4	-177.2	171.6	0	0	0	0	111.1	I110 T137 T138 T143 S144	I110-V141 HydrophobicContact CD1-CG1 4.46Å; I110-V141 HydrophobicContact CG2-CB 4.04Å; I110-V141 HydrophobicContact CG2-CG1 3.94Å; T137-V141 HydrophobicContact CG2-CG2 4.11Å; T137-V141 WeakPolarHBondContact O-CB 3.43Å; T137-V141 VanDerWaalsContact O-CG2 3.24Å; T137-V141 WeakPolarHBondContact O-CG2 3.22Å; T137-V141 PolarHBondContact O-N 2.81Å; T138-V141 PolarHBondContact O-N 3.42Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 2.93Å; V141-S144 WeakPolarHBondContact O-CB 3.18Å; V141-S144 PolarHBondContact O-N 3.13Å; V141-S144 PolarHBondContact O-OG 3.02Å
142	Y	85.6	Confident	80.9	Confident	86 Å²	86	60.3 Å²	60.3	34%	0.337	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-31.7	179.9	-177.2	-102.3	0	0	0	113	T103 I107 I110 T138 P145	T103-Y142 WeakPolarHBondContact CG2-OH 3.37Å; I107-Y142 HydrophobicContact CD1-CD1 4.3Å; I107-Y142 HydrophobicContact CD1-CE1 4.07Å; I107-Y142 HydrophobicContact CD1-CE2 4.47Å; I107-Y142 HydrophobicContact CG1-CD1 4.09Å; I107-Y142 HydrophobicContact CG1-CD2 3.78Å; I107-Y142 HydrophobicContact CG1-CE1 4.15Å; I107-Y142 HydrophobicContact CG1-CE2 3.84Å; I107-Y142 HydrophobicContact CG1-CG 3.9Å; I110-Y142 HydrophobicContact CD1-CD2 3.84Å; I110-Y142 HydrophobicContact CD1-CG 4.42Å; T138-Y142 VanDerWaalsContact O-CB 3.27Å; T138-Y142 WeakPolarHBondContact O-CB 3.33Å; T138-Y142 PolarHBondContact O-N 2.99Å; Y142-P145 WeakPolarHBondContact O-CD 3.46Å
143	T	84.7	Confident	80.8	Confident	39 Å²	39	68.4 Å²	68.4	24%	0.239	38%	0.379	C	S	.	.	H	α-helix	trans	-96	-3	178.4	55.5	0	0	0	0	114.1	G139 L140 V141 P145 C156	G139-T143 PolarHBondContact O-N 2.79Å; G139-T143 PolarHBondContact O-OG1 3.48Å; L140-T143 PolarHBondContact O-N 2.86Å; L140-T143 PolarHBondContact O-OG1 3.08Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 2.93Å; T143-P145 VanDerWaalsContact C-N 3.3Å; T143-C156 WeakPolarHBondContact OG1-CA 3.36Å
144	S	83.5	Confident	80.8	Confident	50 Å²	50	74.1 Å²	74.1	35%	0.35	40%	0.398	S	S	.	.			trans	-58.3	-28.5	172.9	75.2	0	0	0	0	115.1	L140 V141 G146 M147	L140-S144 WeakPolarHBondContact O-CB 3.41Å; L140-S144 PolarHBondContact O-N 2.84Å; V141-S144 WeakPolarHBondContact O-CB 3.18Å; V141-S144 PolarHBondContact O-N 3.13Å; V141-S144 PolarHBondContact O-OG 3.02Å; S144-G146 PolarHBondContact O-N 3.42Å; S144-M147 VanDerWaalsContact O-CB 3.27Å; S144-M147 WeakPolarHBondContact O-CB 3.27Å; S144-M147 PolarHBondContact O-N 2.89Å
145	P	80.5	Confident	80.6	Confident	106 Å²	106	83.2 Å²	83.2	69%	0.688	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	112.2	176.3	-22.7	35.1	0	0	0	110.8	Y142 T143	Y142-P145 WeakPolarHBondContact O-CD 3.46Å; T143-P145 VanDerWaalsContact C-N 3.3Å
146	G	70.4	Confident	80.6	Confident	33 Å²	33	83.4 Å²	83.4	34%	0.34	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	14.8	-174.2	0	0	0	0	0	114.6	S144 F148 K149 G152	S144-G146 PolarHBondContact O-N 3.42Å; G146-F148 PolarHBondContact O-N 3.45Å; G146-K149 WeakPolarHBondContact O-CB 3.49Å; G146-K149 PolarHBondContact O-N 3.14Å; G146-G152 WeakPolarHBondContact O-CA 3.47Å
147	M	72.2	Confident	80.4	Confident	83 Å²	83	83.8 Å²	83.8	41%	0.409	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-38.5	171.6	-175.4	177.9	86.2	0	0	112.1	S144 K149	S144-M147 VanDerWaalsContact O-CB 3.27Å; S144-M147 WeakPolarHBondContact O-CB 3.27Å; S144-M147 PolarHBondContact O-N 2.89Å; M147-K149 VanDerWaalsContact C-N 3.27Å; M147-K149 PolarHBondContact O-N 3.26Å
148	F	75.2	Confident	80.4	Confident	195 Å²	195	88.4 Å²	88.4	86%	0.855	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.9	179	-57.1	-73.1	0	0	0	114.4	G146	G146-F148 PolarHBondContact O-N 3.45Å
149	K	78	Confident	80.3	Confident	152 Å²	152	88.5 Å²	88.5	66%	0.661	46%	0.461	S	S	*	.	S	Bend	trans	-83.9	153.9	172.2	-69.4	-172.5	176.9	179.9	0	110.4	G146 M147 G151 G152	G146-K149 WeakPolarHBondContact O-CB 3.49Å; G146-K149 PolarHBondContact O-N 3.14Å; M147-K149 VanDerWaalsContact C-N 3.27Å; M147-K149 PolarHBondContact O-N 3.26Å; K149-G151 PolarHBondContact O-N 3.45Å; K149-G151 VanDerWaalsContact O-N 3.14Å; K149-G152 WeakPolarHBondContact O-CA 3.5Å; K149-G152 PolarHBondContact O-N 2.93Å
150	P	73.6	Confident	80.4	Confident	140 Å²	140	88.2 Å²	88.2	91%	0.909	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	122.2	175.3	20.1	-30.5	0	0	0	110.6
151	G	76.1	Confident	80.5	Confident	44 Å²	44	90.6 Å²	90.6	45%	0.454	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	-1.1	-174.9	0	0	0	0	0	115.7	K149 W153 K154 R155	K149-G151 PolarHBondContact O-N 3.45Å; K149-G151 VanDerWaalsContact O-N 3.14Å; G151-W153 PolarHBondContact O-N 3Å; G151-K154 PolarHBondContact O-N 3.47Å; G151-K154 VanDerWaalsContact O-N 3.13Å; G151-R155 PolarHBondContact O-N 3.21Å
152	G	73.3	Confident	80.4	Confident	4 Å²	4	89.9 Å²	89.9	4%	0.041	47%	0.472	C	S	.	.	H	α-helix	trans	-61.1	-41.6	178.9	0	0	0	0	0	113.4	G146 K149 K154 R155 C156	G146-G152 WeakPolarHBondContact O-CA 3.47Å; K149-G152 WeakPolarHBondContact O-CA 3.5Å; K149-G152 PolarHBondContact O-N 2.93Å; G152-K154 VanDerWaalsContact C-N 3.26Å; G152-K154 PolarHBondContact O-N 3.48Å; G152-R155 PolarHBondContact O-N 2.95Å; G152-R155 VanDerWaalsContact O-N 3.16Å; G152-C156 PolarHBondContact O-N 3.26Å
153	W	79	Confident	80.4	Confident	211 Å²	211	86.3 Å²	86.3	80%	0.799	46%	0.461	S	S	*	.	H	α-helix	trans	-51.1	-43.8	171.1	154.8	-75.9	0	0	0	112.5	G151 R155 C156 G157	G151-W153 PolarHBondContact O-N 3Å; W153-R155 VanDerWaalsContact C-N 3.33Å; W153-R155 PolarHBondContact O-N 3.46Å; W153-C156 PolarHBondContact O-N 3.44Å; W153-G157 PolarHBondContact O-N 2.96Å
154	K	83	Confident	80.6	Confident	153 Å²	153	89.2 Å²	89.2	67%	0.665	47%	0.47	S	S	*	.	H	α-helix	trans	-68.2	-37.4	-176.4	-66.5	-171.2	178.9	-176	0	110.8	G151 G152 G157 F158	G151-K154 PolarHBondContact O-N 3.47Å; G151-K154 VanDerWaalsContact O-N 3.13Å; G152-K154 VanDerWaalsContact C-N 3.26Å; G152-K154 PolarHBondContact O-N 3.48Å; K154-G157 PolarHBondContact O-N 3.46Å; K154-F158 WeakPolarHBondContact O-CB 3.46Å; K154-F158 PolarHBondContact O-N 3.45Å
155	R	79.3	Confident	80.9	Confident	192 Å²	192	88.8 Å²	88.8	73%	0.725	47%	0.47	S	S	*	.	H	α-helix	trans	-66.1	-41.3	174.1	-67.6	-177.3	-179.2	170.8	0.7	111.6	G151 G152 W153 F158 G159	G151-R155 PolarHBondContact O-N 3.21Å; G152-R155 PolarHBondContact O-N 2.95Å; G152-R155 VanDerWaalsContact O-N 3.16Å; W153-R155 VanDerWaalsContact C-N 3.33Å; W153-R155 PolarHBondContact O-N 3.46Å; R155-F158 PolarHBondContact O-N 3.08Å; R155-G159 PolarHBondContact O-N 2.99Å
156	C	82.4	Confident	81.2	Confident	16 Å²	16	88.3 Å²	88.3	11%	0.108	47%	0.465	C	S	.	.	H	α-helix	trans	-61.5	-48.6	175.3	-159.4	0	0	0	0	110.9	L140 T143 G152 W153 F158 G159 G160	L140-C156 WeakPolarHBondContact CD2-O 3.4Å; T143-C156 WeakPolarHBondContact OG1-CA 3.36Å; G152-C156 PolarHBondContact O-N 3.26Å; W153-C156 PolarHBondContact O-N 3.44Å; C156-F158 PolarHBondContact O-N 3.27Å; C156-G159 PolarHBondContact O-N 3.34Å; C156-G159 VanDerWaalsContact O-N 3.14Å; C156-G160 PolarHBondContact O-N 3.43Å
157	G	83	Confident	81.8	Confident	40 Å²	40	86.8 Å²	86.8	41%	0.412	45%	0.449	S	S	.	.	H	α-helix	trans	-58	-45.4	175.1	0	0	0	0	0	113.1	W153 K154 G160 L161	W153-G157 PolarHBondContact O-N 2.96Å; K154-G157 PolarHBondContact O-N 3.46Å; G157-G160 PolarHBondContact O-N 3.21Å; G157-L161 WeakPolarHBondContact O-CB 3.5Å; G157-L161 PolarHBondContact O-N 3.46Å
158	F	86.3	Confident	82.4	Confident	155 Å²	155	85 Å²	85	68%	0.68	44%	0.443	S	S	*	.	H	α-helix	trans	-65	-37.5	175	-105.8	-79	0	0	0	112.9	K154 R155 C156 L161 A162	K154-F158 WeakPolarHBondContact O-CB 3.46Å; K154-F158 PolarHBondContact O-N 3.45Å; R155-F158 PolarHBondContact O-N 3.08Å; C156-F158 PolarHBondContact O-N 3.27Å; F158-L161 PolarHBondContact O-N 3.49Å; F158-A162 WeakPolarHBondContact O-CB 3.38Å; F158-A162 PolarHBondContact O-N 2.66Å
159	G	83.3	Confident	83	Confident	10 Å²	10	80.7 Å²	80.7	10%	0.103	43%	0.428	C	S	.	.	H	α-helix	trans	-63.4	-45.4	175.5	0	0	0	0	0	111.9	G139 R155 C156 A162 G163	G139-G159 VanDerWaalsContact CA-O 3.3Å; G139-G159 WeakPolarHBondContact CA-O 3.43Å; R155-G159 PolarHBondContact O-N 2.99Å; C156-G159 PolarHBondContact O-N 3.34Å; C156-G159 VanDerWaalsContact O-N 3.14Å; G159-A162 PolarHBondContact O-N 3.03Å; G159-G163 PolarHBondContact O-N 3.42Å
160	G	84.6	Confident	83.2	Confident	5 Å²	5	75.4 Å²	75.4	5%	0.052	41%	0.413	C	S	.	.	H	α-helix	trans	-61	-43.3	173	0	0	0	0	0	112.4	C156 G157 G163 F164	C156-G160 PolarHBondContact O-N 3.43Å; G157-G160 PolarHBondContact O-N 3.21Å; G160-G163 PolarHBondContact O-N 2.93Å; G160-F164 WeakPolarHBondContact O-CB 3.45Å; G160-F164 PolarHBondContact O-N 3.48Å
161	L	87.7	Confident	83.7	Confident	119 Å²	119	69.4 Å²	69.4	62%	0.623	37%	0.373	S	S	*	.	H	α-helix	trans	-65.2	-41.4	178	-157.9	111.7	0	0	0	112.2	G157 F158 F164 A165	G157-L161 WeakPolarHBondContact O-CB 3.5Å; G157-L161 PolarHBondContact O-N 3.46Å; F158-L161 PolarHBondContact O-N 3.49Å; L161-F164 PolarHBondContact O-N 3.32Å; L161-A165 WeakPolarHBondContact O-CB 3.42Å; L161-A165 PolarHBondContact O-N 2.85Å
162	A	87.4	Confident	84	Confident	55 Å²	55	70.3 Å²	70.3	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-42.6	173.7	0	0	0	0	0	111.2	F158 G159 A165 V166	F158-A162 WeakPolarHBondContact O-CB 3.38Å; F158-A162 PolarHBondContact O-N 2.66Å; G159-A162 PolarHBondContact O-N 3.03Å; A162-A165 PolarHBondContact O-N 3.36Å; A162-V166 WeakPolarHBondContact O-CG2 3.32Å; A162-V166 PolarHBondContact O-N 2.98Å
163	G	85.6	Confident	84.5	Confident	11 Å²	11	74.9 Å²	74.9	11%	0.113	40%	0.397	C	S	.	.	H	α-helix	trans	-60.2	-43.9	174	0	0	0	0	0	112.4	A135 G159 G160 V166 G167	A135-G163 VanDerWaalsContact CB-O 3.29Å; A135-G163 WeakPolarHBondContact CB-O 3.32Å; A135-G163 WeakPolarHBondContact O-CA 3.35Å; G159-G163 PolarHBondContact O-N 3.42Å; G160-G163 PolarHBondContact O-N 2.93Å; G163-V166 PolarHBondContact O-N 3.29Å; G163-G167 PolarHBondContact O-N 3.17Å
164	F	87.7	Confident	84.5	Confident	99 Å²	99	70 Å²	70	43%	0.434	39%	0.391	S	S	.	.	H	α-helix	trans	-62	-45.8	175.2	-177.1	-94.2	0	0	0	111.8	M132 G160 L161 V166 G167 T168	M132-F164 HydrophobicContact CE-CD2 3.91Å; M132-F164 HydrophobicContact CE-CE1 4.2Å; M132-F164 HydrophobicContact CE-CE2 3.14Å; M132-F164 HydrophobicContact CE-CZ 3.31Å; G160-F164 WeakPolarHBondContact O-CB 3.45Å; G160-F164 PolarHBondContact O-N 3.48Å; L161-F164 PolarHBondContact O-N 3.32Å; F164-V166 PolarHBondContact O-N 3.5Å; F164-G167 PolarHBondContact O-N 3.42Å; F164-T168 HydrophobicContact CD1-CG2 4.02Å; F164-T168 HydrophobicContact CE1-CG2 3.6Å; F164-T168 HydrophobicContact CZ-CG2 3.9Å; F164-T168 WeakPolarHBondContact O-CG2 3.34Å; F164-T168 PolarHBondContact O-N 3.1Å; F164-T168 PolarHBondContact O-OG1 3.08Å
165	A	89.7	Confident	84.2	Confident	41 Å²	41	63.1 Å²	63.1	34%	0.339	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-40.2	178.2	0	0	0	0	0	112.4	L161 A162 T168 I169	L161-A165 WeakPolarHBondContact O-CB 3.42Å; L161-A165 PolarHBondContact O-N 2.85Å; A162-A165 PolarHBondContact O-N 3.36Å; A165-T168 WeakPolarHBondContact CA-OG1 3.44Å; A165-T168 PolarHBondContact O-OG1 3.18Å; A165-I169 WeakPolarHBondContact O-CD1 3.42Å; A165-I169 WeakPolarHBondContact O-CG1 3.41Å; A165-I169 PolarHBondContact O-N 3.07Å; A165-I169 VanDerWaalsContact O-N 3.11Å
166	V	87.7	Confident	83.9	Confident	96 Å²	96	61 Å²	61	58%	0.582	35%	0.354	S	S	*	.	H	α-helix	trans	-66.8	-41	173.9	173.3	0	0	0	0	110.5	A162 G163 F164 I169 A170	A162-V166 WeakPolarHBondContact O-CG2 3.32Å; A162-V166 PolarHBondContact O-N 2.98Å; G163-V166 PolarHBondContact O-N 3.29Å; F164-V166 PolarHBondContact O-N 3.5Å; V166-I169 PolarHBondContact O-N 2.82Å; V166-A170 WeakPolarHBondContact O-CB 3.48Å; V166-A170 PolarHBondContact O-N 3.05Å
167	G	82.4	Confident	83.3	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-62.3	-43.5	176.7	0	0	0	0	0	113.2	G163 F164 A170 V171	G163-G167 PolarHBondContact O-N 3.17Å; F164-G167 PolarHBondContact O-N 3.42Å; G167-A170 PolarHBondContact O-N 3.44Å; G167-V171 WeakPolarHBondContact O-CG2 3.47Å; G167-V171 PolarHBondContact O-N 2.85Å
168	T	85.3	Confident	82.3	Confident	46 Å²	46	70.1 Å²	70.1	28%	0.282	39%	0.388	S	S	.	.	H	α-helix	trans	-63.9	-44	175.5	50.9	0	0	0	0	111.3	M132 F164 A165 V171 T172	M132-T168 HydrophobicContact CE-CG2 3.33Å; M132-T168 HydrophobicContact SD-CG2 4.21Å; F164-T168 HydrophobicContact CD1-CG2 4.02Å; F164-T168 HydrophobicContact CE1-CG2 3.6Å; F164-T168 HydrophobicContact CZ-CG2 3.9Å; F164-T168 WeakPolarHBondContact O-CG2 3.34Å; F164-T168 PolarHBondContact O-N 3.1Å; F164-T168 PolarHBondContact O-OG1 3.08Å; A165-T168 WeakPolarHBondContact CA-OG1 3.44Å; A165-T168 PolarHBondContact O-OG1 3.18Å; T168-V171 PolarHBondContact O-N 2.84Å; T168-T172 WeakPolarHBondContact O-CG2 3.45Å; T168-T172 PolarHBondContact O-N 2.7Å; T168-T172 PolarHBondContact O-OG1 2.7Å; T168-T172 VanDerWaalsContact O-OG1 3.08Å
169	I	86.7	Confident	81.2	Confident	105 Å²	105	65.4 Å²	65.4	54%	0.538	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-48.7	176.3	-67.9	166.2	0	0	0	109.9	A165 V166 V171 T172 V173	A165-I169 WeakPolarHBondContact O-CD1 3.42Å; A165-I169 WeakPolarHBondContact O-CG1 3.41Å; A165-I169 PolarHBondContact O-N 3.07Å; A165-I169 VanDerWaalsContact O-N 3.11Å; V166-I169 PolarHBondContact O-N 2.82Å; I169-V171 VanDerWaalsContact C-N 3.35Å; I169-V171 PolarHBondContact O-N 3.12Å; I169-T172 WeakPolarHBondContact CA-OG1 3.46Å; I169-T172 PolarHBondContact O-N 2.83Å; I169-T172 PolarHBondContact O-OG1 3.25Å; I169-V173 HydrophobicContact CG2-CG2 4.33Å; I169-V173 WeakPolarHBondContact O-CG2 3.03Å; I169-V173 PolarHBondContact O-N 2.82Å
170	A	83.3	Confident	80.3	Confident	41 Å²	41	71 Å²	71	34%	0.339	39%	0.391	S	S	.	.	H	α-helix	trans	-56.9	-48.4	178.8	0	0	0	0	0	111.7	V166 G167 V173 T174	V166-A170 WeakPolarHBondContact O-CB 3.48Å; V166-A170 PolarHBondContact O-N 3.05Å; G167-A170 PolarHBondContact O-N 3.44Å; A170-V173 PolarHBondContact O-N 2.86Å; A170-T174 PolarHBondContact O-N 3.18Å; A170-T174 PolarHBondContact O-OG1 3.27Å
171	V	83.2	Confident	79.4	Confident	13 Å²	13	78 Å²	78	8%	0.079	42%	0.422	C	S	.	.	H	α-helix	trans	-58.4	-52.8	176.6	167.3	0	0	0	0	110.6	E128 T131 M132 G167 T168 I169 V173 T174 S175	E128-V171 HydrophobicContact CB-CG1 3.78Å; E128-V171 HydrophobicContact CB-CG2 4.06Å; E128-V171 HydrophobicContact CG-CG1 3.91Å; T131-V171 HydrophobicContact CG2-CG2 4.08Å; M132-V171 HydrophobicContact CG-CG2 3.95Å; G167-V171 WeakPolarHBondContact O-CG2 3.47Å; G167-V171 PolarHBondContact O-N 2.85Å; T168-V171 PolarHBondContact O-N 2.84Å; I169-V171 VanDerWaalsContact C-N 3.35Å; I169-V171 PolarHBondContact O-N 3.12Å; V171-V173 VanDerWaalsContact C-N 3.27Å; V171-V173 PolarHBondContact O-N 3.11Å; V171-T174 WeakPolarHBondContact CA-OG1 3.35Å; V171-T174 PolarHBondContact O-N 2.68Å; V171-T174 VanDerWaalsContact O-N 3.08Å; V171-T174 PolarHBondContact O-OG1 2.93Å; V171-S175 WeakPolarHBondContact O-CB 3.1Å; V171-S175 PolarHBondContact O-N 2.97Å; V171-S175 PolarHBondContact O-OG 3.06Å
172	T	82.7	Confident	78.1	Confident	63 Å²	63	80 Å²	80	39%	0.387	43%	0.43	S	S	.	.	H	α-helix	trans	-60.4	-33.4	-178.6	55.3	0	0	0	0	113.7	T168 I169 W176	T168-T172 WeakPolarHBondContact O-CG2 3.45Å; T168-T172 PolarHBondContact O-N 2.7Å; T168-T172 PolarHBondContact O-OG1 2.7Å; T168-T172 VanDerWaalsContact O-OG1 3.08Å; I169-T172 WeakPolarHBondContact CA-OG1 3.46Å; I169-T172 PolarHBondContact O-N 2.83Å; I169-T172 PolarHBondContact O-OG1 3.25Å; T172-W176 WeakPolarHBondContact O-CA 3.44Å; T172-W176 WeakPolarHBondContact O-CB 3.26Å; T172-W176 PolarHBondContact O-N 3.23Å
173	V	83.2	Confident	77.4	Confident	100 Å²	100	84.1 Å²	84.1	61%	0.606	44%	0.444	S	S	*	.	H	α-helix	trans	-69.9	-44.9	174.6	171.8	0	0	0	0	110.5	I169 A170 V171 W176	I169-V173 HydrophobicContact CG2-CG2 4.33Å; I169-V173 WeakPolarHBondContact O-CG2 3.03Å; I169-V173 PolarHBondContact O-N 2.82Å; A170-V173 PolarHBondContact O-N 2.86Å; V171-V173 VanDerWaalsContact C-N 3.27Å; V171-V173 PolarHBondContact O-N 3.11Å; V173-W176 VanDerWaalsContact O-CB 3.32Å; V173-W176 WeakPolarHBondContact O-CB 2.79Å; V173-W176 PolarHBondContact O-N 3.19Å
174	T	80.7	Confident	76.2	Confident	110 Å²	110	87 Å²	87	68%	0.675	47%	0.473	S	S	*	.	H	α-helix	trans	-70.7	-34.2	178.8	45.4	0	0	0	0	113.7	A170 V171 W176	A170-T174 PolarHBondContact O-N 3.18Å; A170-T174 PolarHBondContact O-OG1 3.27Å; V171-T174 WeakPolarHBondContact CA-OG1 3.35Å; V171-T174 PolarHBondContact O-N 2.68Å; V171-T174 VanDerWaalsContact O-N 3.08Å; V171-T174 PolarHBondContact O-OG1 2.93Å; T174-W176 VanDerWaalsContact C-N 3.33Å
175	S	76.6	Confident	74.4	Confident	8 Å²	8	88.1 Å²	88.1	6%	0.056	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	5.8	177.7	65.6	0	0	0	0	112.7	V171 S177 R178 I179	V171-S175 WeakPolarHBondContact O-CB 3.1Å; V171-S175 PolarHBondContact O-N 2.97Å; V171-S175 PolarHBondContact O-OG 3.06Å; S175-S177 PolarHBondContact O-N 3.38Å; S175-S177 VanDerWaalsContact O-N 3.13Å; S175-R178 CarbonylContact O-C 3.57Å; S175-R178 WeakPolarHBondContact O-CA 3.39Å; S175-R178 VanDerWaalsContact O-CB 3.32Å; S175-R178 WeakPolarHBondContact O-CB 3.44Å; S175-R178 PolarHBondContact O-N 3.25Å; S175-I179 WeakPolarHBondContact O-CG1 3.47Å; S175-I179 PolarHBondContact O-N 2.68Å; S175-I179 WeakPolarHBondContact OG-CD1 3.38Å
176	W	72.9	Confident	73.6	Confident	146 Å²	146	90.5 Å²	90.5	55%	0.553	52%	0.521	S	S	*	.	H	α-helix	trans	-54.3	-37.5	-179.8	-167.3	-103.6	0	0	0	112.5	T172 V173 T174 I179 K180	T172-W176 WeakPolarHBondContact O-CA 3.44Å; T172-W176 WeakPolarHBondContact O-CB 3.26Å; T172-W176 PolarHBondContact O-N 3.23Å; V173-W176 VanDerWaalsContact O-CB 3.32Å; V173-W176 WeakPolarHBondContact O-CB 2.79Å; V173-W176 PolarHBondContact O-N 3.19Å; T174-W176 VanDerWaalsContact C-N 3.33Å; W176-I179 PolarHBondContact O-N 3.1Å; W176-K180 WeakPolarHBondContact O-CB 3.34Å; W176-K180 WeakPolarHBondContact O-CG 3.44Å; W176-K180 PolarHBondContact O-N 2.87Å
177	S	68.3	Low	72.9	Confident	95 Å²	95	90.2 Å²	90.2	66%	0.664	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-41.2	174.1	-42.3	0	0	0	0	112.2	S175 H181	S175-S177 PolarHBondContact O-N 3.38Å; S175-S177 VanDerWaalsContact O-N 3.13Å; S177-H181 PolarHBondContact O-N 3.08Å; S177-H181 VanDerWaalsContact O-N 3.17Å
178	R	63	Low	72.3	Confident	153 Å²	153	95.1 Å²	95.1	58%	0.577	55%	0.546	S	S	*	.	H	α-helix	trans	-69.5	-40.8	176.9	-119.3	-165.6	-62.2	-110.2	8	111.6	E128 S175 H181 M182	E128-R178 IonicContact OE1-CZ 3.58Å; E128-R178 IonicContact OE1-NE 2.84Å; E128-R178 PolarHBondContact OE1-NE 3.4Å; E128-R178 IonicContact OE1-NH2 2.85Å; E128-R178 PolarHBondContact OE1-NH2 2.92Å; S175-R178 CarbonylContact O-C 3.57Å; S175-R178 WeakPolarHBondContact O-CA 3.39Å; S175-R178 VanDerWaalsContact O-CB 3.32Å; S175-R178 WeakPolarHBondContact O-CB 3.44Å; S175-R178 PolarHBondContact O-N 3.25Å; R178-H181 PolarHBondContact O-N 2.97Å; R178-M182 WeakPolarHBondContact O-CG 3.29Å; R178-M182 PolarHBondContact O-N 3.43Å
179	I	63.8	Low	71.6	Confident	56 Å²	56	98 Å²	98	29%	0.287	56%	0.562	S	S	.	*	H	α-helix	trans	-64.4	-43.4	177.3	-68.1	168.3	0	0	0	109.9	S175 W176 H181 M182 L183	S175-I179 WeakPolarHBondContact O-CG1 3.47Å; S175-I179 PolarHBondContact O-N 2.68Å; S175-I179 WeakPolarHBondContact OG-CD1 3.38Å; W176-I179 PolarHBondContact O-N 3.1Å; I179-H181 VanDerWaalsContact C-N 3.33Å; I179-H181 PolarHBondContact O-N 3.25Å; I179-M182 PolarHBondContact O-N 2.97Å; I179-M182 VanDerWaalsContact O-N 3.14Å; I179-L183 HydrophobicContact CG2-CD1 3.75Å; I179-L183 WeakPolarHBondContact O-CB 3.42Å; I179-L183 PolarHBondContact O-N 3.3Å
180	K	64.3	Low	70.6	Confident	127 Å²	127	97.6 Å²	97.6	55%	0.552	56%	0.563	S	S	*	*	H	α-helix	trans	-59.2	-43.2	173.6	-83.9	-176.2	168.4	-175.6	0	112.5	W176 M182 L183 G184 G185	W176-K180 WeakPolarHBondContact O-CB 3.34Å; W176-K180 WeakPolarHBondContact O-CG 3.44Å; W176-K180 PolarHBondContact O-N 2.87Å; K180-M182 VanDerWaalsContact C-N 3.29Å; K180-M182 PolarHBondContact O-N 3Å; K180-L183 PolarHBondContact O-N 3.41Å; K180-G184 PolarHBondContact O-N 3.19Å; K180-G185 PolarHBondContact O-N 2.83Å
181	H	64.2	Low	69.8	Low	154 Å²	154	101.3 Å²	101.3	71%	0.713	58%	0.578	S	S	*	*	H	α-helix	trans	-65.9	-29.8	176	-171.7	-78	0	0	0	112.8	S177 R178 I179	S177-H181 PolarHBondContact O-N 3.08Å; S177-H181 VanDerWaalsContact O-N 3.17Å; R178-H181 PolarHBondContact O-N 2.97Å; I179-H181 VanDerWaalsContact C-N 3.33Å; I179-H181 PolarHBondContact O-N 3.25Å
182	M	62	Low	68.8	Low	160 Å²	160	107.6 Å²	107.6	79%	0.788	61%	0.614	S	S	*	*	H	α-helix	trans	-80.7	-25.2	174.2	-72.3	-169	173	0	0	113.8	R178 I179 K180 G184	R178-M182 WeakPolarHBondContact O-CG 3.29Å; R178-M182 PolarHBondContact O-N 3.43Å; I179-M182 PolarHBondContact O-N 2.97Å; I179-M182 VanDerWaalsContact O-N 3.14Å; K180-M182 VanDerWaalsContact C-N 3.29Å; K180-M182 PolarHBondContact O-N 3Å; M182-G184 VanDerWaalsContact C-N 3.26Å; M182-G184 PolarHBondContact O-N 3.24Å
183	L	71.3	Confident	67.8	Low	141 Å²	141	111.1 Å²	111.1	74%	0.738	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	8.9	178.1	-99.8	146.8	0	0	0	113.8	I179 K180	I179-L183 HydrophobicContact CG2-CD1 3.75Å; I179-L183 WeakPolarHBondContact O-CB 3.42Å; I179-L183 PolarHBondContact O-N 3.3Å; K180-L183 PolarHBondContact O-N 3.41Å
184	G	60.5	Low	66.5	Low	72 Å²	72	112 Å²	112	74%	0.742	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.2	32.1	172.5	0	0	0	0	0	114.6	K180 M182	K180-G184 PolarHBondContact O-N 3.19Å; M182-G184 VanDerWaalsContact C-N 3.26Å; M182-G184 PolarHBondContact O-N 3.24Å
185	G	50.3	Low	65.2	Low	122 Å²	122	112.2 Å²	112.2	100%	1.258	63%	0.63	S	S	*	*			trans	-91.1	0	168.7	0	0	0	0	0	113.2	K180	K180-G185 PolarHBondContact O-N 2.83Å

Retrieved 185 of 185 residues in 37.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).