A0A077YYT5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YYT5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 141 aa.

						>A0A077YYT5_TRITR|A0A077YYT5
MLLAAVRLSEEKEVLSSWALRKGDFADSSVGRAVPPTGFIGDVNMRAMADGWSSCKLQLEVAQLFQLLINQSFKRLLLRTAGCSELPSAIPSNKSRSPFQLLSDYMLSICMQLQQRLRLEDAFTLRSNCAPFHSPPDTLDS
					

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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	36.4	Very low	36.3	Very low	230 Å²	230	125.6 Å²	125.6	100%	1.133	67%	0.668	S	S	*	*				0	-22.6	0	-71.1	-163.6	-175.5	0	0	114.4
2	L	35.4	Very low	36.2	Very low	153 Å²	153	128.7 Å²	128.7	80%	0.801	67%	0.671	S	S	*	*	H	α-helix	trans	-73.3	-33.1	178.6	-92.6	139.7	0	0	0	115.4	A4 A5	L2-A4 PolarHBondContact O-N 3.12Å; L2-A5 PolarHBondContact O-N 2.88Å
3	L	37.7	Very low	36	Very low	150 Å²	150	129.8 Å²	129.8	79%	0.785	67%	0.671	S	S	*	*	H	α-helix	trans	-69.4	-28.2	-177.2	-83.6	155.6	0	0	0	114.4	V6 R7	L3-V6 PolarHBondContact O-N 2.95Å; L3-R7 PolarHBondContact O-N 3.38Å
4	A	36.2	Very low	36.1	Very low	66 Å²	66	126.7 Å²	126.7	55%	0.545	66%	0.66	S	S	.	*	H	α-helix	trans	-71.8	-31.2	177.9	0	0	0	0	0	112.4	L2 L8	L2-A4 PolarHBondContact O-N 3.12Å; A4-L8 PolarHBondContact O-N 3.17Å
5	A	34.3	Very low	35.9	Very low	62 Å²	62	125.9 Å²	125.9	51%	0.512	66%	0.657	S	S	.	*	H	α-helix	trans	-72.7	-31.2	177.3	0	0	0	0	0	112.4	L2	L2-A5 PolarHBondContact O-N 2.88Å
6	V	34.5	Very low	35.9	Very low	87 Å²	87	121.6 Å²	121.6	53%	0.527	64%	0.64	S	S	.	*	H	α-helix	trans	-73.6	-39.6	178.5	180	0	0	0	0	111.3	L3 L8 S9	L3-V6 PolarHBondContact O-N 2.95Å; V6-L8 VanDerWaalsContact C-N 3.3Å; V6-L8 PolarHBondContact O-N 3.45Å; V6-S9 VanDerWaalsContact O-CB 3.24Å; V6-S9 WeakPolarHBondContact O-CB 3.28Å; V6-S9 PolarHBondContact O-N 3.41Å
7	R	43.7	Very low	35.8	Very low	191 Å²	191	117.6 Å²	117.6	72%	0.721	63%	0.625	S	S	*	*	H	α-helix	trans	-63.2	-34.7	174.3	-83.2	-170.3	176.3	176.6	-0.8	113.4	L3 S9 E10 E11	L3-R7 PolarHBondContact O-N 3.38Å; R7-S9 PolarHBondContact O-N 2.7Å; R7-E10 PolarHBondContact O-N 3.5Å; R7-E11 PolarHBondContact O-N 3.11Å; R7-E11 VanDerWaalsContact O-N 3.16Å
8	L	34.7	Very low	35.8	Very low	113 Å²	113	119.1 Å²	119.1	59%	0.592	62%	0.621	S	S	*	*	H	α-helix	trans	-64.1	-21.8	174.4	-79.3	163.1	0	0	0	113.1	A4 V6 K12	A4-L8 PolarHBondContact O-N 3.17Å; V6-L8 VanDerWaalsContact C-N 3.3Å; V6-L8 PolarHBondContact O-N 3.45Å; L8-K12 WeakPolarHBondContact O-CB 3.44Å; L8-K12 PolarHBondContact O-N 3.1Å
9	S	37.6	Very low	35.7	Very low	81 Å²	81	116.4 Å²	116.4	57%	0.566	62%	0.617	S	S	*	*	H	α-helix	trans	-72.5	-46.9	175.2	-176.2	0	0	0	0	111.5	V6 R7 K12 E13	V6-S9 VanDerWaalsContact O-CB 3.24Å; V6-S9 WeakPolarHBondContact O-CB 3.28Å; V6-S9 PolarHBondContact O-N 3.41Å; R7-S9 PolarHBondContact O-N 2.7Å; S9-K12 WeakPolarHBondContact O-CB 3.46Å; S9-K12 PolarHBondContact O-N 2.92Å; S9-E13 PolarHBondContact O-N 3.47Å
10	E	35.5	Very low	35.5	Very low	130 Å²	130	117.6 Å²	117.6	61%	0.607	62%	0.623	S	S	*	*	H	α-helix	trans	-68.8	-39.6	-179.3	-67.5	179.2	165.6	0	0	111.4	R7 K12 E13 V14	R7-E10 PolarHBondContact O-N 3.5Å; E10-K12 VanDerWaalsContact C-N 3.27Å; E10-K12 PolarHBondContact O-N 2.76Å; E10-E13 WeakPolarHBondContact O-CB 3.3Å; E10-E13 PolarHBondContact O-N 2.74Å; E10-E13 VanDerWaalsContact O-N 3.15Å; E10-V14 PolarHBondContact O-N 3.23Å; E10-V14 VanDerWaalsContact O-N 3.17Å
11	E	33.3	Very low	35.5	Very low	119 Å²	119	118.7 Å²	118.7	56%	0.556	62%	0.619	S	S	*	*	H	α-helix	trans	-65.5	-29.8	175.7	-75.8	-175.8	161.3	0	0	113	R7 E13 V14 L15	R7-E11 PolarHBondContact O-N 3.11Å; R7-E11 VanDerWaalsContact O-N 3.16Å; E11-E13 VanDerWaalsContact C-N 3.28Å; E11-E13 PolarHBondContact O-N 3.44Å; E11-V14 PolarHBondContact O-N 3.19Å; E11-L15 WeakPolarHBondContact O-CB 3.28Å; E11-L15 WeakPolarHBondContact O-CG 3.43Å; E11-L15 PolarHBondContact O-N 2.79Å
12	K	34.7	Very low	35.6	Very low	162 Å²	162	116.1 Å²	116.1	70%	0.704	60%	0.601	S	S	*	*	H	α-helix	trans	-68.5	-30.6	176	-163.3	-179.1	-179	-171.6	0	111.7	L8 S9 E10 S16	L8-K12 WeakPolarHBondContact O-CB 3.44Å; L8-K12 PolarHBondContact O-N 3.1Å; S9-K12 WeakPolarHBondContact O-CB 3.46Å; S9-K12 PolarHBondContact O-N 2.92Å; E10-K12 VanDerWaalsContact C-N 3.27Å; E10-K12 PolarHBondContact O-N 2.76Å; K12-S16 WeakPolarHBondContact O-CB 3.35Å; K12-S16 PolarHBondContact O-N 3.3Å; K12-S16 PolarHBondContact O-OG 2.85Å
13	E	34	Very low	35.7	Very low	143 Å²	143	111.6 Å²	111.6	67%	0.668	59%	0.591	S	S	*	*	H	α-helix	trans	-74.8	-38.6	175.5	-158.7	170.9	-164.1	0	0	111.5	S9 E10 E11 L15 S16 S17	S9-E13 PolarHBondContact O-N 3.47Å; E10-E13 WeakPolarHBondContact O-CB 3.3Å; E10-E13 PolarHBondContact O-N 2.74Å; E10-E13 VanDerWaalsContact O-N 3.15Å; E11-E13 VanDerWaalsContact C-N 3.28Å; E11-E13 PolarHBondContact O-N 3.44Å; E13-L15 PolarHBondContact O-N 3.02Å; E13-S16 PolarHBondContact O-OG 3.48Å; E13-S16 VanDerWaalsContact O-OG 3.05Å; E13-S17 WeakPolarHBondContact O-CB 3.49Å; E13-S17 PolarHBondContact O-N 2.86Å
14	V	37.9	Very low	35.5	Very low	87 Å²	87	109.9 Å²	109.9	53%	0.527	58%	0.583	S	S	.	*	H	α-helix	trans	-64.4	-41.9	173.3	-179.5	0	0	0	0	110.9	E10 E11 S17 W18	E10-V14 PolarHBondContact O-N 3.23Å; E10-V14 VanDerWaalsContact O-N 3.17Å; E11-V14 PolarHBondContact O-N 3.19Å; V14-S17 PolarHBondContact O-N 3.23Å; V14-S17 PolarHBondContact O-OG 2.89Å; V14-W18 PolarHBondContact O-N 3.33Å; V14-W18 VanDerWaalsContact O-N 3.1Å
15	L	33.1	Very low	35.7	Very low	115 Å²	115	112 Å²	112	60%	0.602	58%	0.58	S	S	*	*	H	α-helix	trans	-77.5	-31.4	-179.3	-70.5	171.8	0	0	0	113.8	E11 E13 S17 W18 A19	E11-L15 WeakPolarHBondContact O-CB 3.28Å; E11-L15 WeakPolarHBondContact O-CG 3.43Å; E11-L15 PolarHBondContact O-N 2.79Å; E13-L15 PolarHBondContact O-N 3.02Å; L15-S17 VanDerWaalsContact C-N 3.3Å; L15-W18 PolarHBondContact O-N 2.78Å; L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.49Å
16	S	35.6	Very low	35.8	Very low	56 Å²	56	112 Å²	112	39%	0.392	58%	0.58	S	S	.	*	H	α-helix	trans	-66.7	-36.4	169.7	66.4	0	0	0	0	110.5	K12 E13 W18 L20	K12-S16 WeakPolarHBondContact O-CB 3.35Å; K12-S16 PolarHBondContact O-N 3.3Å; K12-S16 PolarHBondContact O-OG 2.85Å; E13-S16 PolarHBondContact O-OG 3.48Å; E13-S16 VanDerWaalsContact O-OG 3.05Å; S16-W18 VanDerWaalsContact C-N 3.31Å; S16-W18 PolarHBondContact O-N 2.8Å; S16-L20 WeakPolarHBondContact O-CB 3.44Å; S16-L20 WeakPolarHBondContact O-CD1 3.1Å; S16-L20 WeakPolarHBondContact O-CG 3.35Å; S16-L20 PolarHBondContact O-N 3.19Å
17	S	33.4	Very low	35.8	Very low	55 Å²	55	112.9 Å²	112.9	39%	0.385	58%	0.582	S	S	.	*	H	α-helix	trans	-64.6	-32.5	173.3	86	0	0	0	0	113	E13 V14 L15	E13-S17 WeakPolarHBondContact O-CB 3.49Å; E13-S17 PolarHBondContact O-N 2.86Å; V14-S17 PolarHBondContact O-N 3.23Å; V14-S17 PolarHBondContact O-OG 2.89Å; L15-S17 VanDerWaalsContact C-N 3.3Å
18	W	35.8	Very low	35.8	Very low	144 Å²	144	109.7 Å²	109.7	55%	0.545	59%	0.589	S	S	.	*	H	α-helix	trans	-81.7	-42.9	178	-92.8	55.7	0	0	0	113.3	V14 L15 S16 L20 R21	V14-W18 PolarHBondContact O-N 3.33Å; V14-W18 VanDerWaalsContact O-N 3.1Å; L15-W18 PolarHBondContact O-N 2.78Å; S16-W18 VanDerWaalsContact C-N 3.31Å; S16-W18 PolarHBondContact O-N 2.8Å; W18-L20 PolarHBondContact O-N 2.8Å; W18-R21 PolarHBondContact O-N 3.19Å
19	A	34.9	Very low	36.2	Very low	67 Å²	67	108.6 Å²	108.6	55%	0.554	59%	0.591	S	S	*	*	H	α-helix	trans	-68.8	-23.7	176.7	0	0	0	0	0	112.6	L15 K22	L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.49Å; A19-K22 WeakPolarHBondContact O-CG 3.46Å
20	L	32.2	Very low	36.1	Very low	140 Å²	140	108.3 Å²	108.3	73%	0.733	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-80.9	-11.5	173.7	-73.6	167.3	0	0	0	113.6	S16 W18 K22	S16-L20 WeakPolarHBondContact O-CB 3.44Å; S16-L20 WeakPolarHBondContact O-CD1 3.1Å; S16-L20 WeakPolarHBondContact O-CG 3.35Å; S16-L20 PolarHBondContact O-N 3.19Å; W18-L20 PolarHBondContact O-N 2.8Å; L20-K22 PolarHBondContact O-N 3.32Å
21	R	33.9	Very low	36.2	Very low	141 Å²	141	104 Å²	104	53%	0.532	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-78.6	29.8	164.6	-62.1	-166.5	-151.8	-168.9	5	113.1	W18 G23 D24	W18-R21 PolarHBondContact O-N 3.19Å; R21-G23 PolarHBondContact O-N 3.06Å; R21-D24 WeakPolarHBondContact CD-OD2 3.25Å; R21-D24 PolarHBondContact O-N 3.49Å
22	K	39	Very low	36.4	Very low	176 Å²	176	107.4 Å²	107.4	77%	0.765	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-47.1	-20	161	-92.4	-175.6	178.9	-172.1	0	113	A19 L20	A19-K22 WeakPolarHBondContact O-CG 3.46Å; L20-K22 PolarHBondContact O-N 3.32Å
23	G	36.8	Very low	37	Very low	58 Å²	58	100.8 Å²	100.8	60%	0.598	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-70.7	-26.3	173	0	0	0	0	0	116.1	R21	R21-G23 PolarHBondContact O-N 3.06Å
24	D	34.4	Very low	37.3	Very low	114 Å²	114	98.3 Å²	98.3	61%	0.61	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-14.2	-173.6	-74.6	-17.8	0	0	0	113.6	R21	R21-D24 WeakPolarHBondContact CD-OD2 3.25Å; R21-D24 PolarHBondContact O-N 3.49Å
25	F	39.5	Very low	37.8	Very low	110 Å²	110	95.8 Å²	95.8	48%	0.482	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.1	178.2	-68.3	-79.3	0	0	0	113.5	P36	F25-P36 HydrophobicContact CZ-CG 4.39Å
26	A	36.3	Very low	38.9	Very low	63 Å²	63	92.9 Å²	92.9	52%	0.521	53%	0.527	S	S	.	.			trans	-124.6	71.3	-177.3	0	0	0	0	0	109.2	S28	A26-S28 PolarHBondContact O-N 3.37Å
27	D	36.4	Very low	39.7	Very low	106 Å²	106	97.4 Å²	97.4	57%	0.567	55%	0.553	S	S	*	*			trans	-62.6	95.5	145.7	-167	-17.9	0	0	0	105.8	S29 V30	D27-S29 PolarHBondContact O-N 2.88Å; D27-S29 PolarHBondContact OD1-N 2.88Å; D27-S29 PolarHBondContact OD1-OG 3.32Å; D27-V30 CarbonylContact O-C 3.51Å; D27-V30 PolarHBondContact O-N 3.35Å; D27-V30 VanDerWaalsContact O-N 3.15Å
28	S	43.2	Very low	40.7	Very low	124 Å²	124	96.8 Å²	96.8	87%	0.867	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-8.2	-174.2	51.9	0	0	0	0	112.6	A26	A26-S28 PolarHBondContact O-N 3.37Å
29	S	42.5	Very low	41.8	Very low	89 Å²	89	91.7 Å²	91.7	62%	0.622	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.5	177.9	71.1	0	0	0	0	113.9	D27	D27-S29 PolarHBondContact O-N 2.88Å; D27-S29 PolarHBondContact OD1-N 2.88Å; D27-S29 PolarHBondContact OD1-OG 3.32Å
30	V	35	Very low	42.9	Very low	76 Å²	76	94 Å²	94	46%	0.461	54%	0.539	S	S	.	.	S	Bend	trans	-145.9	96.7	-178	-170.1	0	0	0	0	108.4	D27 R32	D27-V30 CarbonylContact O-C 3.51Å; D27-V30 PolarHBondContact O-N 3.35Å; D27-V30 VanDerWaalsContact O-N 3.15Å; V30-R32 HydrophobicContact CG1-CG 4.14Å; V30-R32 PolarHBondContact O-N 3Å
31	G	38.1	Very low	44.5	Very low	40 Å²	40	88.9 Å²	88.9	41%	0.412	52%	0.52	S	S	.	.			trans	-65.2	53	178.6	0	0	0	0	0	115.6	R116	G31-R116 VanDerWaalsContact N-NH2 3.12Å; G31-R116 PolarHBondContact O-NH1 3.43Å; G31-R116 PolarHBondContact O-NH2 2.82Å
32	R	38.2	Very low	46.1	Very low	189 Å²	189	85.7 Å²	85.7	71%	0.713	51%	0.513	S	S	*	.			trans	-81.6	112.8	157	-69.2	178.7	-175.7	-149.5	0.8	105.4	V30 V34	V30-R32 HydrophobicContact CG1-CG 4.14Å; V30-R32 PolarHBondContact O-N 3Å; R32-V34 HydrophobicContact CB-CG2 3.5Å; R32-V34 VanDerWaalsContact CB-CG2 3.5Å; R32-V34 PolarHBondContact O-N 2.85Å
33	A	46	Very low	47.3	Very low	23 Å²	23	78.1 Å²	78.1	19%	0.19	48%	0.482	C	S	.	.			trans	-63.8	83.6	155.3	0	0	0	0	0	107.1	Y105 I109	A33-Y105 PolarHBondContact O-OH 3.45Å; A33-I109 HydrophobicContact CB-CG1 4.11Å
34	V	41.7	Very low	48.5	Very low	91 Å²	91	78.5 Å²	78.5	55%	0.552	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-81.2	125.3	168.6	-170.7	0	0	0	0	105.1	R32	R32-V34 HydrophobicContact CB-CG2 3.5Å; R32-V34 VanDerWaalsContact CB-CG2 3.5Å; R32-V34 PolarHBondContact O-N 2.85Å
35	P	48.4	Very low	50.2	Low	35 Å²	35	78.6 Å²	78.6	23%	0.227	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-63	148.4	172.1	19.2	-17.3	0	0	0	107.5	T37 F39 Y105	P35-T37 PolarHBondContact O-N 2.96Å; P35-F39 HydrophobicContact CB-CB 3.8Å; P35-F39 HydrophobicContact CB-CD1 4Å; P35-F39 HydrophobicContact CB-CG 4Å; P35-Y105 VanDerWaalsContact CA-OH 3.32Å; P35-Y105 WeakPolarHBondContact CA-OH 3.35Å; P35-Y105 HydrophobicContact CB-CE1 3.88Å; P35-Y105 HydrophobicContact CB-CE2 4.19Å; P35-Y105 WeakPolarHBondContact CB-OH 3.45Å; P35-Y105 WeakPolarHBondContact CD-OH 3.07Å; P35-Y105 HydrophobicContact CG-CE1 4.02Å; P35-Y105 WeakPolarHBondContact CG-OH 3.27Å
36	P	54.6	Low	51.7	Low	53 Å²	53	79.6 Å²	79.6	34%	0.344	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-52.6	140.2	176	22.2	-32	0	0	0	109.4	F25 G38 F39	F25-P36 HydrophobicContact CZ-CG 4.39Å; P36-G38 PolarHBondContact O-N 3.2Å; P36-F39 HydrophobicContact CG-CB 4.32Å; P36-F39 WeakPolarHBondContact O-CB 3.28Å; P36-F39 PolarHBondContact O-N 2.88Å
37	T	52.9	Low	53.2	Low	151 Å²	151	76.8 Å²	76.8	93%	0.926	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	119.3	174.1	38.4	0	0	0	0	109	P35	P35-T37 PolarHBondContact O-N 2.96Å
38	G	54.9	Low	54.5	Low	43 Å²	43	77.4 Å²	77.4	44%	0.443	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.8	-17.1	-177.2	0	0	0	0	0	115.4	P36 I40 G41 D42	P36-G38 PolarHBondContact O-N 3.2Å; G38-I40 VanDerWaalsContact C-N 3.32Å; G38-I40 PolarHBondContact O-N 2.91Å; G38-G41 CarbonylContact O-C 3.54Å; G38-G41 VanDerWaalsContact O-CA 3.26Å; G38-G41 WeakPolarHBondContact O-CA 3.42Å; G38-G41 PolarHBondContact O-N 3.47Å; G38-D42 PolarHBondContact O-N 3.03Å
39	F	59.6	Low	56	Low	37 Å²	37	75.6 Å²	75.6	16%	0.162	44%	0.439	C	S	.	.	H	α-helix	trans	-53	-45.9	-177.9	179.3	-100.4	0	0	0	113.6	P35 P36 G41 D42 V43 L102 Y105	P35-F39 HydrophobicContact CB-CB 3.8Å; P35-F39 HydrophobicContact CB-CD1 4Å; P35-F39 HydrophobicContact CB-CG 4Å; P36-F39 HydrophobicContact CG-CB 4.32Å; P36-F39 WeakPolarHBondContact O-CB 3.28Å; P36-F39 PolarHBondContact O-N 2.88Å; F39-G41 VanDerWaalsContact C-N 3.28Å; F39-G41 PolarHBondContact O-N 2.99Å; F39-D42 PolarHBondContact O-N 3.15Å; F39-V43 HydrophobicContact CD1-CG2 4.41Å; F39-V43 HydrophobicContact CE1-CG2 4.01Å; F39-V43 HydrophobicContact CE2-CG2 4.3Å; F39-V43 HydrophobicContact CZ-CG2 3.96Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 2.99Å; F39-L102 HydrophobicContact CE1-CD1 3.92Å; F39-L102 HydrophobicContact CZ-CD1 4.43Å; F39-Y105 HydrophobicContact CE1-CD1 4Å; F39-Y105 HydrophobicContact CE1-CG 4.37Å; F39-Y105 HydrophobicContact CZ-CD1 4.34Å; F39-Y105 HydrophobicContact CZ-CG 4.26Å
40	I	58.2	Low	57.5	Low	115 Å²	115	76 Å²	76	59%	0.59	43%	0.434	S	S	*	.	H	α-helix	trans	-63.4	-38.5	176.5	-63.9	172	0	0	0	110.5	G38 N44	G38-I40 VanDerWaalsContact C-N 3.32Å; G38-I40 PolarHBondContact O-N 2.91Å; I40-N44 VanDerWaalsContact O-CB 3.28Å; I40-N44 WeakPolarHBondContact O-CB 3.44Å; I40-N44 PolarHBondContact O-N 2.85Å; I40-N44 PolarHBondContact O-ND2 3.33Å; I40-N44 PolarHBondContact O-OD1 3.43Å
41	G	65.8	Low	59.5	Low	32 Å²	32	75.5 Å²	75.5	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-61.9	-45.1	175.3	0	0	0	0	0	112.1	G38 F39 N44 M45	G38-G41 CarbonylContact O-C 3.54Å; G38-G41 VanDerWaalsContact O-CA 3.26Å; G38-G41 WeakPolarHBondContact O-CA 3.42Å; G38-G41 PolarHBondContact O-N 3.47Å; F39-G41 VanDerWaalsContact C-N 3.28Å; F39-G41 PolarHBondContact O-N 2.99Å; G41-N44 PolarHBondContact O-N 3.44Å; G41-M45 WeakPolarHBondContact O-CB 3.42Å; G41-M45 WeakPolarHBondContact O-CG 3.43Å; G41-M45 PolarHBondContact O-N 2.83Å
42	D	65.6	Low	60.9	Low	74 Å²	74	76.8 Å²	76.8	40%	0.396	44%	0.437	S	S	.	.	H	α-helix	trans	-66.4	-43.3	179.7	-66.9	-23.4	0	0	0	112.1	G38 F39 N44 M45 R46	G38-D42 PolarHBondContact O-N 3.03Å; F39-D42 PolarHBondContact O-N 3.15Å; D42-N44 VanDerWaalsContact C-N 3.34Å; D42-M45 PolarHBondContact O-N 3.43Å; D42-M45 WeakPolarHBondContact OD1-CE 3.4Å; D42-R46 WeakPolarHBondContact O-CB 3.31Å; D42-R46 PolarHBondContact O-N 3.43Å
43	V	65.5	Low	62.6	Low	17 Å²	17	71 Å²	71	10%	0.103	43%	0.426	C	S	.	.	H	α-helix	trans	-62.4	-43.7	174.8	175.4	0	0	0	0	110.3	F39 R46 A47	F39-V43 HydrophobicContact CD1-CG2 4.41Å; F39-V43 HydrophobicContact CE1-CG2 4.01Å; F39-V43 HydrophobicContact CE2-CG2 4.3Å; F39-V43 HydrophobicContact CZ-CG2 3.96Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 2.99Å; V43-R46 PolarHBondContact O-N 3.34Å; V43-A47 VanDerWaalsContact O-CB 3.25Å; V43-A47 WeakPolarHBondContact O-CB 3.4Å; V43-A47 PolarHBondContact O-N 2.68Å
44	N	61.2	Low	63.7	Low	66 Å²	66	73.7 Å²	73.7	35%	0.353	44%	0.443	S	S	.	.	H	α-helix	trans	-63.2	-47.8	177.2	-74.4	-7.5	0	0	0	111.8	I40 G41 D42 R46 A47 M48 L57	I40-N44 VanDerWaalsContact O-CB 3.28Å; I40-N44 WeakPolarHBondContact O-CB 3.44Å; I40-N44 PolarHBondContact O-N 2.85Å; I40-N44 PolarHBondContact O-ND2 3.33Å; I40-N44 PolarHBondContact O-OD1 3.43Å; G41-N44 PolarHBondContact O-N 3.44Å; D42-N44 VanDerWaalsContact C-N 3.34Å; N44-R46 VanDerWaalsContact C-N 3.32Å; N44-R46 PolarHBondContact O-N 2.78Å; N44-A47 PolarHBondContact O-N 3.19Å; N44-M48 WeakPolarHBondContact O-CB 3.24Å; N44-M48 WeakPolarHBondContact O-CG 3.34Å; N44-M48 PolarHBondContact O-N 3.27Å; N44-L57 HydrophobicContact CB-CD2 4.39Å; N44-L57 WeakPolarHBondContact OD1-CD2 3.37Å
45	M	69.9	Low	65	Low	117 Å²	117	73.7 Å²	73.7	58%	0.576	45%	0.446	S	S	*	.	H	α-helix	trans	-60.4	-43.5	179.3	-77.5	-166.5	-68.4	0	0	111.3	G41 D42 M48 A49	G41-M45 WeakPolarHBondContact O-CB 3.42Å; G41-M45 WeakPolarHBondContact O-CG 3.43Å; G41-M45 PolarHBondContact O-N 2.83Å; D42-M45 PolarHBondContact O-N 3.43Å; D42-M45 WeakPolarHBondContact OD1-CE 3.4Å; M45-M48 PolarHBondContact O-N 3.44Å; M45-A49 PolarHBondContact O-N 2.81Å
46	R	70.7	Confident	66	Low	131 Å²	131	76.5 Å²	76.5	49%	0.494	45%	0.454	S	S	.	.	H	α-helix	trans	-70.6	-40.8	179.9	-166.2	162.6	176.3	-169.9	3.7	112.6	D42 V43 N44 M48 A49 D50 P98	D42-R46 WeakPolarHBondContact O-CB 3.31Å; D42-R46 PolarHBondContact O-N 3.43Å; V43-R46 PolarHBondContact O-N 3.34Å; N44-R46 VanDerWaalsContact C-N 3.32Å; N44-R46 PolarHBondContact O-N 2.78Å; R46-M48 VanDerWaalsContact C-N 3.33Å; R46-M48 PolarHBondContact O-N 2.83Å; R46-A49 WeakPolarHBondContact O-CB 3.28Å; R46-A49 PolarHBondContact O-N 3.17Å; R46-D50 PolarHBondContact O-N 2.75Å; R46-P98 HydrophobicContact CB-CG 4.27Å; R46-P98 HydrophobicContact CG-CG 3.68Å
47	A	68.2	Low	66.5	Low	4 Å²	4	74.8 Å²	74.8	3%	0.033	44%	0.443	C	S	.	.	H	α-helix	trans	-62.5	-40.4	174.4	0	0	0	0	0	112	V43 N44 D50 G51 W52 L57	V43-A47 VanDerWaalsContact O-CB 3.25Å; V43-A47 WeakPolarHBondContact O-CB 3.4Å; V43-A47 PolarHBondContact O-N 2.68Å; N44-A47 PolarHBondContact O-N 3.19Å; A47-D50 CarbonylContact O-C 3.58Å; A47-D50 PolarHBondContact O-N 2.82Å; A47-G51 PolarHBondContact O-N 3.02Å; A47-W52 HydrophobicContact CB-CB 4.19Å; A47-W52 HydrophobicContact CB-CD2 4.48Å; A47-W52 HydrophobicContact CB-CE3 4.47Å; A47-W52 HydrophobicContact CB-CG 4.38Å; A47-W52 VanDerWaalsContact O-CB 3.24Å; A47-W52 WeakPolarHBondContact O-CB 3.44Å; A47-W52 PolarHBondContact O-N 3.38Å; A47-L57 HydrophobicContact CB-CD1 3.72Å; A47-L57 HydrophobicContact CB-CD2 3.77Å; A47-L57 HydrophobicContact CB-CG 4.27Å
48	M	65.3	Low	66.9	Low	118 Å²	118	73.6 Å²	73.6	58%	0.581	43%	0.427	S	S	*	.	H	α-helix	trans	-64.5	-39.4	174	-73.7	-168.2	-68.1	0	0	111.9	N44 M45 R46 D50 G51	N44-M48 WeakPolarHBondContact O-CB 3.24Å; N44-M48 WeakPolarHBondContact O-CG 3.34Å; N44-M48 PolarHBondContact O-N 3.27Å; M45-M48 PolarHBondContact O-N 3.44Å; R46-M48 VanDerWaalsContact C-N 3.33Å; R46-M48 PolarHBondContact O-N 2.83Å; M48-D50 PolarHBondContact O-N 2.89Å; M48-G51 PolarHBondContact O-N 2.91Å
49	A	73.1	Confident	67.5	Low	86 Å²	86	76.2 Å²	76.2	71%	0.711	43%	0.43	S	S	*	.	H	α-helix	trans	-61.7	-33.2	173.7	0	0	0	0	0	112.5	M45 R46 G51	M45-A49 PolarHBondContact O-N 2.81Å; R46-A49 WeakPolarHBondContact O-CB 3.28Å; R46-A49 PolarHBondContact O-N 3.17Å; A49-G51 PolarHBondContact O-N 3.22Å
50	D	75	Confident	67.7	Low	97 Å²	97	77.1 Å²	77.1	52%	0.519	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	7.3	174.1	-65.2	-26.4	0	0	0	113.1	R46 A47 M48	R46-D50 PolarHBondContact O-N 2.75Å; A47-D50 CarbonylContact O-C 3.58Å; A47-D50 PolarHBondContact O-N 2.82Å; M48-D50 PolarHBondContact O-N 2.89Å
51	G	76.5	Confident	68.1	Low	66 Å²	66	74.2 Å²	74.2	68%	0.68	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	19.4	176.6	0	0	0	0	0	114.8	A47 M48 A49	A47-G51 PolarHBondContact O-N 3.02Å; M48-G51 PolarHBondContact O-N 2.91Å; A49-G51 PolarHBondContact O-N 3.22Å
52	W	67.2	Low	67.9	Low	68 Å²	68	75.3 Å²	75.3	26%	0.258	43%	0.428	S	S	.	.			trans	-81.9	133.1	178.1	-66.8	34	0	0	0	110.6	A47 K56 L57 E60	A47-W52 HydrophobicContact CB-CB 4.19Å; A47-W52 HydrophobicContact CB-CD2 4.48Å; A47-W52 HydrophobicContact CB-CE3 4.47Å; A47-W52 HydrophobicContact CB-CG 4.38Å; A47-W52 VanDerWaalsContact O-CB 3.24Å; A47-W52 WeakPolarHBondContact O-CB 3.44Å; A47-W52 PolarHBondContact O-N 3.38Å; W52-K56 HydrophobicContact CD2-CD 4.29Å; W52-K56 HydrophobicContact CE3-CG 4.37Å; W52-K56 HydrophobicContact CG-CD 4.3Å; W52-L57 HydrophobicContact CE3-CB 4.17Å; W52-L57 HydrophobicContact CE3-CD1 3.81Å; W52-L57 HydrophobicContact CZ3-CD1 4Å; W52-E60 HydrophobicContact CE3-CG 4.49Å; W52-E60 HydrophobicContact CH2-CB 4.35Å; W52-E60 HydrophobicContact CH2-CG 4.02Å; W52-E60 HydrophobicContact CZ3-CB 3.79Å; W52-E60 HydrophobicContact CZ3-CG 3.65Å
53	S	73.4	Confident	68	Low	67 Å²	67	76.8 Å²	76.8	47%	0.469	43%	0.432	S	S	.	.			trans	-71.4	152.7	166.7	69.2	0	0	0	0	110.3	C55 K56 L57	S53-C55 PolarHBondContact O-N 3.47Å; S53-K56 PolarHBondContact O-N 2.86Å; S53-K56 WeakPolarHBondContact OG-CB 3.2Å; S53-K56 PolarHBondContact OG-N 3.38Å; S53-K56 VanDerWaalsContact OG-N 3.16Å; S53-L57 PolarHBondContact O-N 2.97Å
54	S	68.9	Low	67.6	Low	79 Å²	79	76.3 Å²	76.3	55%	0.552	43%	0.43	S	S	*	.	H	α-helix	trans	-53.4	-41.1	175	179.8	0	0	0	0	111.9	L57 Q58	S54-L57 PolarHBondContact O-N 3.49Å; S54-Q58 WeakPolarHBondContact O-CB 3.4Å; S54-Q58 VanDerWaalsContact O-CG 3.3Å; S54-Q58 WeakPolarHBondContact O-CG 3.39Å; S54-Q58 PolarHBondContact O-N 3.37Å
55	C	69.7	Low	67.7	Low	91 Å²	91	78.2 Å²	78.2	62%	0.615	44%	0.435	S	S	*	.	H	α-helix	trans	-62.4	-45.4	176	-178.8	0	0	0	0	112.4	S53 L57 Q58 L59	S53-C55 PolarHBondContact O-N 3.47Å; C55-L57 PolarHBondContact O-N 2.76Å; C55-Q58 PolarHBondContact O-N 2.66Å; C55-L59 WeakPolarHBondContact O-CB 3.38Å; C55-L59 PolarHBondContact O-N 2.84Å
56	K	68.7	Low	67.3	Low	94 Å²	94	77.4 Å²	77.4	41%	0.409	43%	0.43	S	S	.	.	H	α-helix	trans	-61.5	-45.6	177.2	-175.5	-179.1	-179.8	-175	0	111.2	W52 S53 Q58 L59 E60	W52-K56 HydrophobicContact CD2-CD 4.29Å; W52-K56 HydrophobicContact CE3-CG 4.37Å; W52-K56 HydrophobicContact CG-CD 4.3Å; S53-K56 PolarHBondContact O-N 2.86Å; S53-K56 WeakPolarHBondContact OG-CB 3.2Å; S53-K56 PolarHBondContact OG-N 3.38Å; S53-K56 VanDerWaalsContact OG-N 3.16Å; K56-Q58 PolarHBondContact O-N 2.86Å; K56-L59 PolarHBondContact O-N 3.49Å; K56-E60 HydrophobicContact CG-CG 4.45Å; K56-E60 VanDerWaalsContact O-CG 3.27Å; K56-E60 WeakPolarHBondContact O-CG 3.47Å; K56-E60 PolarHBondContact O-N 3.17Å
57	L	66	Low	66.9	Low	18 Å²	18	75.5 Å²	75.5	9%	0.094	43%	0.429	C	S	.	.	H	α-helix	trans	-60.6	-46.7	178.1	-177.9	61.7	0	0	0	111.6	N44 A47 W52 S53 S54 C55 L59 E60 V61	N44-L57 HydrophobicContact CB-CD2 4.39Å; N44-L57 WeakPolarHBondContact OD1-CD2 3.37Å; A47-L57 HydrophobicContact CB-CD1 3.72Å; A47-L57 HydrophobicContact CB-CD2 3.77Å; A47-L57 HydrophobicContact CB-CG 4.27Å; W52-L57 HydrophobicContact CE3-CB 4.17Å; W52-L57 HydrophobicContact CE3-CD1 3.81Å; W52-L57 HydrophobicContact CZ3-CD1 4Å; S53-L57 PolarHBondContact O-N 2.97Å; S54-L57 PolarHBondContact O-N 3.49Å; C55-L57 PolarHBondContact O-N 2.76Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.46Å; L57-E60 PolarHBondContact O-N 2.85Å; L57-V61 HydrophobicContact CD1-CG2 4.16Å; L57-V61 HydrophobicContact CG-CG2 4.31Å; L57-V61 WeakPolarHBondContact O-CB 3.49Å; L57-V61 WeakPolarHBondContact O-CG2 3.41Å; L57-V61 PolarHBondContact O-N 2.84Å
58	Q	62.3	Low	66.5	Low	126 Å²	126	75.5 Å²	75.5	59%	0.589	43%	0.428	S	S	*	.	H	α-helix	trans	-60.5	-41.2	177.2	-74.3	174.5	-13	0	0	112.4	S54 C55 K56 V61 A62	S54-Q58 WeakPolarHBondContact O-CB 3.4Å; S54-Q58 VanDerWaalsContact O-CG 3.3Å; S54-Q58 WeakPolarHBondContact O-CG 3.39Å; S54-Q58 PolarHBondContact O-N 3.37Å; C55-Q58 PolarHBondContact O-N 2.66Å; K56-Q58 PolarHBondContact O-N 2.86Å; Q58-V61 PolarHBondContact O-N 3.35Å; Q58-A62 VanDerWaalsContact O-CB 3.32Å; Q58-A62 WeakPolarHBondContact O-CB 3.37Å; Q58-A62 PolarHBondContact O-N 3.42Å
59	L	66.6	Low	66.2	Low	97 Å²	97	73.4 Å²	73.4	51%	0.508	42%	0.418	S	S	.	.	H	α-helix	trans	-63	-47.3	177.9	-175.6	66.4	0	0	0	111.6	C55 K56 L57 A62 Q63	C55-L59 WeakPolarHBondContact O-CB 3.38Å; C55-L59 PolarHBondContact O-N 2.84Å; K56-L59 PolarHBondContact O-N 3.49Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.46Å; L59-A62 PolarHBondContact O-N 2.89Å; L59-Q63 WeakPolarHBondContact O-CG 3.49Å; L59-Q63 PolarHBondContact O-N 3.45Å
60	E	64.9	Low	65.7	Low	56 Å²	56	73.4 Å²	73.4	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-64.9	-41.2	179.1	-68.3	-72.7	166.6	0	0	111.5	W52 K56 L57 Q63 L64 F99	W52-E60 HydrophobicContact CE3-CG 4.49Å; W52-E60 HydrophobicContact CH2-CB 4.35Å; W52-E60 HydrophobicContact CH2-CG 4.02Å; W52-E60 HydrophobicContact CZ3-CB 3.79Å; W52-E60 HydrophobicContact CZ3-CG 3.65Å; K56-E60 HydrophobicContact CG-CG 4.45Å; K56-E60 VanDerWaalsContact O-CG 3.27Å; K56-E60 WeakPolarHBondContact O-CG 3.47Å; K56-E60 PolarHBondContact O-N 3.17Å; L57-E60 PolarHBondContact O-N 2.85Å; E60-Q63 PolarHBondContact O-N 2.89Å; E60-L64 WeakPolarHBondContact O-CB 3.09Å; E60-L64 PolarHBondContact O-N 2.73Å; E60-F99 HydrophobicContact CB-CE2 4.25Å
61	V	66.1	Low	65.1	Low	54 Å²	54	72.7 Å²	72.7	33%	0.327	40%	0.4	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.2	172.5	0	0	0	0	110.7	L57 Q58 L64 F65 L102	L57-V61 HydrophobicContact CD1-CG2 4.16Å; L57-V61 HydrophobicContact CG-CG2 4.31Å; L57-V61 WeakPolarHBondContact O-CB 3.49Å; L57-V61 WeakPolarHBondContact O-CG2 3.41Å; L57-V61 PolarHBondContact O-N 2.84Å; Q58-V61 PolarHBondContact O-N 3.35Å; V61-L64 PolarHBondContact O-N 3.22Å; V61-F65 WeakPolarHBondContact O-CB 3.44Å; V61-F65 PolarHBondContact O-N 3.4Å; V61-L102 HydrophobicContact CB-CD2 4.36Å; V61-L102 HydrophobicContact CG1-CD2 4.28Å; V61-L102 HydrophobicContact CG2-CD2 3.66Å
62	A	61.7	Low	64.3	Low	56 Å²	56	70.9 Å²	70.9	46%	0.463	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-42.1	178.5	0	0	0	0	0	112.1	Q58 L59 F65 Q66	Q58-A62 VanDerWaalsContact O-CB 3.32Å; Q58-A62 WeakPolarHBondContact O-CB 3.37Å; Q58-A62 PolarHBondContact O-N 3.42Å; L59-A62 PolarHBondContact O-N 2.89Å; A62-F65 PolarHBondContact O-N 2.91Å; A62-Q66 WeakPolarHBondContact O-CB 3.31Å; A62-Q66 PolarHBondContact O-N 3.3Å
63	Q	66.6	Low	63.6	Low	104 Å²	104	73.3 Å²	73.3	49%	0.486	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-41.9	176.1	-74.3	177.6	-4.6	0	0	112	L59 E60 Q66 L67	L59-Q63 WeakPolarHBondContact O-CG 3.49Å; L59-Q63 PolarHBondContact O-N 3.45Å; E60-Q63 PolarHBondContact O-N 2.89Å; Q63-Q66 PolarHBondContact O-N 3.33Å; Q63-L67 WeakPolarHBondContact O-CB 3.37Å; Q63-L67 PolarHBondContact O-N 3.17Å
64	L	58.5	Low	62.8	Low	8 Å²	8	76 Å²	76	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-61.9	-45.9	174.3	-176.1	99.5	0	0	0	111.1	E60 V61 Q66 L67 L68 F99 L102 M106	E60-L64 WeakPolarHBondContact O-CB 3.09Å; E60-L64 PolarHBondContact O-N 2.73Å; V61-L64 PolarHBondContact O-N 3.22Å; L64-Q66 VanDerWaalsContact C-N 3.33Å; L64-Q66 PolarHBondContact O-N 2.98Å; L64-L67 PolarHBondContact O-N 2.96Å; L64-L68 HydrophobicContact CD2-CD1 4.09Å; L64-L68 HydrophobicContact CG-CD1 4.04Å; L64-L68 WeakPolarHBondContact O-CB 3.29Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 3.34Å; L64-F99 HydrophobicContact CB-CE2 4Å; L64-F99 HydrophobicContact CB-CZ 4.01Å; L64-F99 HydrophobicContact CD1-CD1 4.3Å; L64-F99 HydrophobicContact CD1-CE1 3.52Å; L64-F99 HydrophobicContact CD1-CE2 3.81Å; L64-F99 HydrophobicContact CD1-CZ 3.24Å; L64-F99 HydrophobicContact CG-CE2 4.42Å; L64-F99 HydrophobicContact CG-CZ 4.21Å; L64-L102 HydrophobicContact CD2-CB 4.49Å; L64-L102 HydrophobicContact CD2-CD2 3.97Å; L64-L102 HydrophobicContact CD2-CG 3.83Å; L64-M106 HydrophobicContact CD2-CB 4.23Å; L64-M106 HydrophobicContact CD2-CG 3.96Å
65	F	61.9	Low	62.4	Low	105 Å²	105	74.9 Å²	74.9	46%	0.461	38%	0.377	S	S	.	.	H	α-helix	trans	-59.7	-45	177.4	-162.2	-95	0	0	0	111.1	V61 A62 L67 L68 I69 M106	V61-F65 WeakPolarHBondContact O-CB 3.44Å; V61-F65 PolarHBondContact O-N 3.4Å; A62-F65 PolarHBondContact O-N 2.91Å; F65-L67 PolarHBondContact O-N 2.98Å; F65-L68 PolarHBondContact O-N 3.38Å; F65-I69 HydrophobicContact CD1-CD1 3.45Å; F65-I69 VanDerWaalsContact CD1-CD1 3.45Å; F65-I69 HydrophobicContact CD1-CG1 4.2Å; F65-I69 HydrophobicContact CE1-CD1 3.29Å; F65-I69 HydrophobicContact CE1-CG1 4.16Å; F65-I69 HydrophobicContact CZ-CD1 4.27Å; F65-I69 WeakPolarHBondContact O-CG1 3.41Å; F65-I69 PolarHBondContact O-N 3.38Å; F65-M106 HydrophobicContact CD2-CE 3.22Å; F65-M106 HydrophobicContact CD2-SD 4.25Å; F65-M106 HydrophobicContact CE2-CE 3.31Å; F65-M106 HydrophobicContact CE2-SD 4.47Å; F65-M106 HydrophobicContact CG-CE 4.39Å
66	Q	62.7	Low	61.7	Low	101 Å²	101	73.6 Å²	73.6	47%	0.472	36%	0.363	S	S	.	.	H	α-helix	trans	-61.7	-43.3	175.6	-173.6	63.4	56.8	0	0	112.1	A62 Q63 L64 L68 I69 N70	A62-Q66 WeakPolarHBondContact O-CB 3.31Å; A62-Q66 PolarHBondContact O-N 3.3Å; Q63-Q66 PolarHBondContact O-N 3.33Å; L64-Q66 VanDerWaalsContact C-N 3.33Å; L64-Q66 PolarHBondContact O-N 2.98Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; Q66-L68 PolarHBondContact O-N 3.21Å; Q66-I69 PolarHBondContact O-N 3.5Å; Q66-N70 PolarHBondContact NE2-OD1 3.35Å; Q66-N70 VanDerWaalsContact O-CB 3.31Å; Q66-N70 WeakPolarHBondContact O-CB 3.47Å; Q66-N70 PolarHBondContact O-N 2.89Å; Q66-N70 PolarHBondContact O-ND2 2.92Å; Q66-N70 PolarHBondContact O-OD1 3.23Å
67	L	62	Low	60.7	Low	91 Å²	91	73.3 Å²	73.3	48%	0.476	37%	0.366	S	S	.	.	H	α-helix	trans	-64.2	-40.1	178.5	-175.5	135.4	0	0	0	111.5	Q63 L64 F65 N70 Q71	Q63-L67 WeakPolarHBondContact O-CB 3.37Å; Q63-L67 PolarHBondContact O-N 3.17Å; L64-L67 PolarHBondContact O-N 2.96Å; F65-L67 PolarHBondContact O-N 2.98Å; L67-N70 PolarHBondContact O-N 3.4Å; L67-Q71 HydrophobicContact CD2-CG 4.41Å; L67-Q71 WeakPolarHBondContact O-CB 3.34Å; L67-Q71 WeakPolarHBondContact O-CG 3.44Å; L67-Q71 PolarHBondContact O-N 3.02Å
68	L	58.9	Low	60	Low	4 Å²	4	74.7 Å²	74.7	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-71.4	-39.4	178.2	-72.4	171.7	0	0	0	112.6	L64 F65 Q66 Q71 S72 M106 L107	L64-L68 HydrophobicContact CD2-CD1 4.09Å; L64-L68 HydrophobicContact CG-CD1 4.04Å; L64-L68 WeakPolarHBondContact O-CB 3.29Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 3.34Å; F65-L68 PolarHBondContact O-N 3.38Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; Q66-L68 PolarHBondContact O-N 3.21Å; L68-Q71 PolarHBondContact O-N 3.49Å; L68-S72 VanDerWaalsContact O-CB 3.26Å; L68-S72 WeakPolarHBondContact O-CB 3.31Å; L68-S72 PolarHBondContact O-N 2.9Å; L68-S72 PolarHBondContact O-OG 3.43Å; L68-M106 HydrophobicContact CD1-CB 3.14Å; L68-M106 HydrophobicContact CD1-CG 4.22Å; L68-L107 HydrophobicContact CD2-CB 4.09Å; L68-L107 HydrophobicContact CD2-CD1 3.93Å
69	I	59.8	Low	59.5	Low	73 Å²	73	73.7 Å²	73.7	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-58.6	-50.2	168.9	-73.4	174.8	0	0	0	109.6	F65 Q66 Q71 S72 F73	F65-I69 HydrophobicContact CD1-CD1 3.45Å; F65-I69 VanDerWaalsContact CD1-CD1 3.45Å; F65-I69 HydrophobicContact CD1-CG1 4.2Å; F65-I69 HydrophobicContact CE1-CD1 3.29Å; F65-I69 HydrophobicContact CE1-CG1 4.16Å; F65-I69 HydrophobicContact CZ-CD1 4.27Å; F65-I69 WeakPolarHBondContact O-CG1 3.41Å; F65-I69 PolarHBondContact O-N 3.38Å; Q66-I69 PolarHBondContact O-N 3.5Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 3.46Å; I69-S72 PolarHBondContact O-N 3.48Å; I69-S72 VanDerWaalsContact O-N 3.17Å; I69-F73 WeakPolarHBondContact O-CB 3.32Å; I69-F73 PolarHBondContact O-N 3.29Å
70	N	61.8	Low	58.8	Low	87 Å²	87	74.2 Å²	74.2	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-40.7	-179.1	-73.1	-12.5	0	0	0	111.8	Q66 L67 K74	Q66-N70 PolarHBondContact NE2-OD1 3.35Å; Q66-N70 VanDerWaalsContact O-CB 3.31Å; Q66-N70 WeakPolarHBondContact O-CB 3.47Å; Q66-N70 PolarHBondContact O-N 2.89Å; Q66-N70 PolarHBondContact O-ND2 2.92Å; Q66-N70 PolarHBondContact O-OD1 3.23Å; L67-N70 PolarHBondContact O-N 3.4Å; N70-K74 WeakPolarHBondContact O-CB 3.32Å; N70-K74 PolarHBondContact O-N 3.39Å
71	Q	63	Low	58.5	Low	82 Å²	82	74.9 Å²	74.9	38%	0.383	39%	0.387	S	S	.	.	H	α-helix	trans	-67.6	-41.5	175.5	-76.6	-172.3	4.5	0	0	112.3	L67 L68 I69 K74 R75	L67-Q71 HydrophobicContact CD2-CG 4.41Å; L67-Q71 WeakPolarHBondContact O-CB 3.34Å; L67-Q71 WeakPolarHBondContact O-CG 3.44Å; L67-Q71 PolarHBondContact O-N 3.02Å; L68-Q71 PolarHBondContact O-N 3.49Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 3.46Å; Q71-K74 PolarHBondContact O-N 2.94Å; Q71-R75 WeakPolarHBondContact O-CB 3.35Å; Q71-R75 VanDerWaalsContact O-CG 3.29Å; Q71-R75 WeakPolarHBondContact O-CG 3.26Å; Q71-R75 PolarHBondContact O-N 3.29Å
72	S	59.3	Low	57.8	Low	28 Å²	28	75.3 Å²	75.3	20%	0.196	40%	0.401	C	S	.	.	H	α-helix	trans	-68.5	-43.4	179.7	-57.8	0	0	0	0	111	L68 I69 R75 L76 C110	L68-S72 VanDerWaalsContact O-CB 3.26Å; L68-S72 WeakPolarHBondContact O-CB 3.31Å; L68-S72 PolarHBondContact O-N 2.9Å; L68-S72 PolarHBondContact O-OG 3.43Å; I69-S72 PolarHBondContact O-N 3.48Å; I69-S72 VanDerWaalsContact O-N 3.17Å; S72-R75 PolarHBondContact O-N 2.92Å; S72-L76 WeakPolarHBondContact O-CB 3.39Å; S72-L76 PolarHBondContact O-N 3.33Å; S72-C110 WeakPolarHBondContact OG-CB 3.48Å
73	F	53.7	Low	56.7	Low	119 Å²	119	75.7 Å²	75.7	52%	0.522	40%	0.4	S	S	.	.	H	α-helix	trans	-64	-43.2	173.6	-167.1	-108.5	0	0	0	110.8	I69 R75 L76 L77	I69-F73 WeakPolarHBondContact O-CB 3.32Å; I69-F73 PolarHBondContact O-N 3.29Å; F73-R75 VanDerWaalsContact C-N 3.35Å; F73-R75 PolarHBondContact O-N 2.95Å; F73-L76 WeakPolarHBondContact O-CB 2.99Å; F73-L76 PolarHBondContact O-N 3.32Å; F73-L77 HydrophobicContact CD1-CD1 3.63Å; F73-L77 HydrophobicContact CD1-CG 4.03Å; F73-L77 HydrophobicContact CE1-CD1 3.46Å; F73-L77 VanDerWaalsContact CE1-CD1 3.46Å; F73-L77 HydrophobicContact CE1-CD2 4.17Å; F73-L77 HydrophobicContact CE1-CG 3.86Å; F73-L77 HydrophobicContact CZ-CD1 4.28Å; F73-L77 HydrophobicContact CZ-CD2 4.17Å; F73-L77 HydrophobicContact CZ-CG 4.24Å; F73-L77 WeakPolarHBondContact O-CB 3.32Å; F73-L77 VanDerWaalsContact O-CG 3.31Å; F73-L77 WeakPolarHBondContact O-CG 3.35Å; F73-L77 PolarHBondContact O-N 2.91Å
74	K	55.6	Low	55.6	Low	123 Å²	123	76.7 Å²	76.7	54%	0.535	42%	0.418	S	S	.	.	H	α-helix	trans	-59.8	-43.4	172.6	-175.5	177.9	-177.3	179.1	0	111.8	N70 Q71 L76 L77 L78	N70-K74 WeakPolarHBondContact O-CB 3.32Å; N70-K74 PolarHBondContact O-N 3.39Å; Q71-K74 PolarHBondContact O-N 2.94Å; K74-L76 VanDerWaalsContact C-N 3.34Å; K74-L77 PolarHBondContact O-N 2.92Å; K74-L78 HydrophobicContact CG-CD1 3.92Å; K74-L78 HydrophobicContact CG-CG 4.41Å; K74-L78 WeakPolarHBondContact O-CB 3.37Å; K74-L78 VanDerWaalsContact O-CG 3.24Å; K74-L78 WeakPolarHBondContact O-CG 3.31Å; K74-L78 PolarHBondContact O-N 3.49Å
75	R	60.6	Low	54.6	Low	55 Å²	55	85 Å²	85	21%	0.208	46%	0.457	C	S	.	.	H	α-helix	trans	-64.8	-38.2	175.3	-75.7	177.4	-173.8	-170.5	3.6	111.9	Q71 S72 F73 R79 M111	Q71-R75 WeakPolarHBondContact O-CB 3.35Å; Q71-R75 VanDerWaalsContact O-CG 3.29Å; Q71-R75 WeakPolarHBondContact O-CG 3.26Å; Q71-R75 PolarHBondContact O-N 3.29Å; S72-R75 PolarHBondContact O-N 2.92Å; F73-R75 VanDerWaalsContact C-N 3.35Å; F73-R75 PolarHBondContact O-N 2.95Å; R75-R79 WeakPolarHBondContact O-CB 3.49Å; R75-R79 WeakPolarHBondContact O-CG 3.33Å; R75-R79 PolarHBondContact O-N 2.83Å; R75-M111 PolarHBondContact NH1-SD 3.48Å
76	L	55	Low	53.7	Low	65 Å²	65	83.9 Å²	83.9	34%	0.34	46%	0.456	S	S	.	.	H	α-helix	trans	-63.9	-50.8	174.8	-176.5	64.8	0	0	0	110.3	S72 F73 K74 L78 R79 T80	S72-L76 WeakPolarHBondContact O-CB 3.39Å; S72-L76 PolarHBondContact O-N 3.33Å; F73-L76 WeakPolarHBondContact O-CB 2.99Å; F73-L76 PolarHBondContact O-N 3.32Å; K74-L76 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.86Å; L76-R79 WeakPolarHBondContact O-CB 3.48Å; L76-R79 PolarHBondContact O-N 2.9Å; L76-T80 PolarHBondContact O-N 3.46Å; L76-T80 PolarHBondContact O-OG1 2.62Å
77	L	47.3	Very low	52.6	Low	88 Å²	88	84.5 Å²	84.5	46%	0.461	47%	0.468	S	S	.	.	H	α-helix	trans	-58	-45.4	176.9	-74	178.5	0	0	0	112.5	F73 K74 R79 T80 A81	F73-L77 HydrophobicContact CD1-CD1 3.63Å; F73-L77 HydrophobicContact CD1-CG 4.03Å; F73-L77 HydrophobicContact CE1-CD1 3.46Å; F73-L77 VanDerWaalsContact CE1-CD1 3.46Å; F73-L77 HydrophobicContact CE1-CD2 4.17Å; F73-L77 HydrophobicContact CE1-CG 3.86Å; F73-L77 HydrophobicContact CZ-CD1 4.28Å; F73-L77 HydrophobicContact CZ-CD2 4.17Å; F73-L77 HydrophobicContact CZ-CG 4.24Å; F73-L77 WeakPolarHBondContact O-CB 3.32Å; F73-L77 VanDerWaalsContact O-CG 3.31Å; F73-L77 WeakPolarHBondContact O-CG 3.35Å; F73-L77 PolarHBondContact O-N 2.91Å; K74-L77 PolarHBondContact O-N 2.92Å; L77-R79 VanDerWaalsContact C-N 3.34Å; L77-T80 VanDerWaalsContact CA-OG1 3.28Å; L77-T80 WeakPolarHBondContact CA-OG1 3.3Å; L77-T80 PolarHBondContact O-N 3.08Å; L77-T80 PolarHBondContact O-OG1 2.99Å; L77-A81 VanDerWaalsContact O-CB 3.28Å; L77-A81 WeakPolarHBondContact O-CB 3.37Å; L77-A81 PolarHBondContact O-N 3.44Å
78	L	52.1	Low	51.6	Low	47 Å²	47	85.6 Å²	85.6	25%	0.246	48%	0.484	C	S	.	.	H	α-helix	trans	-66	-38.2	178.4	-73.8	170.5	0	0	0	111.5	K74 L76 A81 G82 C83 L86	K74-L78 HydrophobicContact CG-CD1 3.92Å; K74-L78 HydrophobicContact CG-CG 4.41Å; K74-L78 WeakPolarHBondContact O-CB 3.37Å; K74-L78 VanDerWaalsContact O-CG 3.24Å; K74-L78 WeakPolarHBondContact O-CG 3.31Å; K74-L78 PolarHBondContact O-N 3.49Å; L76-L78 PolarHBondContact O-N 2.86Å; L78-A81 CarbonylContact O-C 3.55Å; L78-A81 PolarHBondContact O-N 2.83Å; L78-G82 PolarHBondContact O-N 3.06Å; L78-C83 HydrophobicContact CB-CB 4.23Å; L78-C83 HydrophobicContact CD2-CB 3.86Å; L78-C83 PolarHBondContact O-N 3.43Å; L78-L86 HydrophobicContact CD1-CD1 3.09Å
79	R	52.4	Low	50.6	Low	105 Å²	105	89.6 Å²	89.6	40%	0.396	52%	0.517	S	S	.	.	H	α-helix	trans	-64.3	-45.1	172.6	-81.2	-179.4	-179.9	168.4	2.9	112.4	R75 L76 L77 A81 G82 R118	R75-R79 WeakPolarHBondContact O-CB 3.49Å; R75-R79 WeakPolarHBondContact O-CG 3.33Å; R75-R79 PolarHBondContact O-N 2.83Å; L76-R79 WeakPolarHBondContact O-CB 3.48Å; L76-R79 PolarHBondContact O-N 2.9Å; L77-R79 VanDerWaalsContact C-N 3.34Å; R79-A81 PolarHBondContact O-N 3.2Å; R79-G82 PolarHBondContact O-N 2.92Å; R79-R118 VanDerWaalsContact NE-NH2 3.18Å
80	T	50	Low	49.6	Very low	107 Å²	107	92.2 Å²	92.2	66%	0.656	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-29	176.4	50.5	0	0	0	0	112.3	L76 L77 G82	L76-T80 PolarHBondContact O-N 3.46Å; L76-T80 PolarHBondContact O-OG1 2.62Å; L77-T80 VanDerWaalsContact CA-OG1 3.28Å; L77-T80 WeakPolarHBondContact CA-OG1 3.3Å; L77-T80 PolarHBondContact O-N 3.08Å; L77-T80 PolarHBondContact O-OG1 2.99Å; T80-G82 VanDerWaalsContact C-N 3.28Å; T80-G82 PolarHBondContact O-N 2.91Å
81	A	60.6	Low	48.4	Very low	71 Å²	71	92 Å²	92	59%	0.587	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-2.1	174.1	0	0	0	0	0	113.8	L77 L78 R79 C83	L77-A81 VanDerWaalsContact O-CB 3.28Å; L77-A81 WeakPolarHBondContact O-CB 3.37Å; L77-A81 PolarHBondContact O-N 3.44Å; L78-A81 CarbonylContact O-C 3.55Å; L78-A81 PolarHBondContact O-N 2.83Å; R79-A81 PolarHBondContact O-N 3.2Å; A81-C83 VanDerWaalsContact C-N 3.32Å; A81-C83 PolarHBondContact O-N 2.98Å
82	G	51.3	Low	47.5	Very low	62 Å²	62	93.4 Å²	93.4	64%	0.639	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.5	12	-177.5	0	0	0	0	0	115.1	L78 R79 T80	L78-G82 PolarHBondContact O-N 3.06Å; R79-G82 PolarHBondContact O-N 2.92Å; T80-G82 VanDerWaalsContact C-N 3.28Å; T80-G82 PolarHBondContact O-N 2.91Å
83	C	36.7	Very low	46.8	Very low	65 Å²	65	97 Å²	97	44%	0.439	57%	0.57	S	S	.	*			trans	-90	113.7	179.7	-56.6	0	0	0	0	110.9	L78 A81	L78-C83 HydrophobicContact CB-CB 4.23Å; L78-C83 HydrophobicContact CD2-CB 3.86Å; L78-C83 PolarHBondContact O-N 3.43Å; A81-C83 VanDerWaalsContact C-N 3.32Å; A81-C83 PolarHBondContact O-N 2.98Å
84	S	45.1	Very low	46.5	Very low	124 Å²	124	101 Å²	101	87%	0.867	59%	0.587	S	S	*	*			trans	-92.5	2.5	-171.5	-68.7	0	0	0	0	116.3
85	E	36	Very low	46.3	Very low	182 Å²	182	100.5 Å²	100.5	85%	0.85	60%	0.599	S	S	*	*			trans	-108.3	106.5	-172	-64.8	-173.4	178	0	0	112.6
86	L	42.8	Very low	45.9	Very low	83 Å²	83	99.9 Å²	99.9	44%	0.435	60%	0.597	S	S	.	*			trans	-140.3	130.9	152.9	-119.6	120.9	0	0	0	110.7	L78	L78-L86 HydrophobicContact CD1-CD1 3.09Å
87	P	40.9	Very low	46.2	Very low	113 Å²	113	99.3 Å²	99.3	73%	0.734	60%	0.598	S	S	*	*			trans	-70.9	131.6	-172.7	24.8	-31.9	0	0	0	112.9	A89	P87-A89 PolarHBondContact O-N 3.04Å
88	S	41.6	Very low	46.3	Very low	115 Å²	115	96 Å²	96	80%	0.804	58%	0.581	S	S	*	*			trans	-91.5	80.3	172.2	59.5	0	0	0	0	110.5
89	A	37.1	Very low	46.3	Very low	88 Å²	88	97.1 Å²	97.1	73%	0.727	59%	0.585	S	S	*	*			trans	-103.2	100.8	169.3	0	0	0	0	0	109.1	P87 P91	P87-A89 PolarHBondContact O-N 3.04Å; A89-P91 WeakPolarHBondContact O-CD 3.2Å
90	I	37.8	Very low	46.6	Very low	127 Å²	127	95.7 Å²	95.7	65%	0.651	58%	0.582	S	S	*	*			trans	-97.3	107.5	167.4	-60.1	172.3	0	0	0	106.8
91	P	37.3	Very low	47.1	Very low	84 Å²	84	94.1 Å²	94.1	55%	0.545	57%	0.569	S	S	.	*			trans	-73.7	147.4	-177.6	25.2	-30.8	0	0	0	113.3	A89 R96	A89-P91 WeakPolarHBondContact O-CD 3.2Å; P91-R96 PolarHBondContact O-NH2 3.36Å
92	S	44.4	Very low	46.9	Very low	110 Å²	110	91.6 Å²	91.6	77%	0.769	55%	0.546	S	S	*	.			trans	-51.3	151.2	-176.4	178.6	0	0	0	0	115.5
93	N	45.4	Very low	47.1	Very low	103 Å²	103	90.1 Å²	90.1	55%	0.551	53%	0.526	S	S	*	.	S	Bend	trans	-101.7	14.7	-147.6	-147.8	-1.3	0	0	0	116.1	R96	N93-R96 WeakPolarHBondContact OD1-CD 3.26Å; N93-R96 PolarHBondContact OD1-NE 3.16Å; N93-R96 PolarHBondContact OD1-NH1 3.07Å; N93-R96 VanDerWaalsContact OD1-NH1 3.1Å
94	K	46.7	Very low	48.2	Very low	205 Å²	205	89 Å²	89	89%	0.891	52%	0.515	S	S	*	.	S	Bend	trans	-99.1	5.1	-167	-74	-171.4	177.4	-178.8	0	116.9
95	S	50.6	Low	48.9	Very low	111 Å²	111	84.6 Å²	84.6	78%	0.776	48%	0.48	S	S	*	.	S	Bend	trans	-150.4	36.6	179.3	63	0	0	0	0	113.6
96	R	53.5	Low	49.9	Very low	43 Å²	43	77.1 Å²	77.1	16%	0.162	45%	0.446	C	S	.	.			trans	-77.1	129.6	-172.1	-72.3	-166.9	-176.7	167.2	3.4	112.2	P91 N93 Q100 D104	P91-R96 PolarHBondContact O-NH2 3.36Å; N93-R96 WeakPolarHBondContact OD1-CD 3.26Å; N93-R96 PolarHBondContact OD1-NE 3.16Å; N93-R96 PolarHBondContact OD1-NH1 3.07Å; N93-R96 VanDerWaalsContact OD1-NH1 3.1Å; R96-Q100 HydrophobicContact CB-CB 4.03Å; R96-Q100 HydrophobicContact CB-CG 4.42Å; R96-Q100 HydrophobicContact CG-CB 4.25Å; R96-Q100 HydrophobicContact CG-CG 4.09Å; R96-D104 VanDerWaalsContact CD-OD2 3.3Å; R96-D104 WeakPolarHBondContact CD-OD2 3.44Å; R96-D104 IonicContact CZ-OD1 3.89Å; R96-D104 IonicContact CZ-OD2 3.22Å; R96-D104 IonicContact NE-OD2 3.48Å; R96-D104 PolarHBondContact NE-OD2 3.45Å; R96-D104 IonicContact NH1-OD1 3.45Å; R96-D104 PolarHBondContact NH1-OD1 2.86Å; R96-D104 IonicContact NH1-OD2 2.58Å; R96-D104 PolarHBondContact NH1-OD2 3.48Å
97	S	59.9	Low	50.8	Low	52 Å²	52	75 Å²	75	36%	0.364	44%	0.435	S	S	.	.			trans	-72.1	162.7	171.4	69.5	0	0	0	0	110.9	F99 Q100 L101	S97-F99 PolarHBondContact O-N 3.25Å; S97-Q100 WeakPolarHBondContact O-CB 3.2Å; S97-Q100 PolarHBondContact O-N 3.36Å; S97-Q100 PolarHBondContact OG-N 3.02Å; S97-L101 PolarHBondContact O-N 2.96Å; S97-L101 VanDerWaalsContact O-N 3.09Å
98	P	51	Low	51.8	Low	18 Å²	18	71.8 Å²	71.8	12%	0.117	42%	0.415	C	S	.	.	H	α-helix	trans	-52.8	-37.1	174.4	-24.8	33.6	0	0	0	113	R46 Q100 L101 L102	R46-P98 HydrophobicContact CB-CG 4.27Å; R46-P98 HydrophobicContact CG-CG 3.68Å; P98-Q100 VanDerWaalsContact C-N 3.31Å; P98-Q100 PolarHBondContact O-N 3.48Å; P98-L101 PolarHBondContact O-N 3.39Å; P98-L102 PolarHBondContact O-N 2.97Å
99	F	50.4	Low	52.5	Low	72 Å²	72	68.2 Å²	68.2	32%	0.316	39%	0.386	S	S	.	.	H	α-helix	trans	-62.6	-38.3	175.3	-176.2	-95.5	0	0	0	112.5	E60 L64 S97 L102 S103	E60-F99 HydrophobicContact CB-CE2 4.25Å; L64-F99 HydrophobicContact CB-CE2 4Å; L64-F99 HydrophobicContact CB-CZ 4.01Å; L64-F99 HydrophobicContact CD1-CD1 4.3Å; L64-F99 HydrophobicContact CD1-CE1 3.52Å; L64-F99 HydrophobicContact CD1-CE2 3.81Å; L64-F99 HydrophobicContact CD1-CZ 3.24Å; L64-F99 HydrophobicContact CG-CE2 4.42Å; L64-F99 HydrophobicContact CG-CZ 4.21Å; S97-F99 PolarHBondContact O-N 3.25Å; F99-L102 PolarHBondContact O-N 3.17Å; F99-S103 WeakPolarHBondContact O-CB 3.44Å; F99-S103 PolarHBondContact O-N 2.99Å
100	Q	59.5	Low	53.4	Low	74 Å²	74	64.8 Å²	64.8	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-72.8	-39.5	-179.2	-148.5	152.8	10.9	0	0	110.9	R96 S97 P98 L102 S103 D104	R96-Q100 HydrophobicContact CB-CB 4.03Å; R96-Q100 HydrophobicContact CB-CG 4.42Å; R96-Q100 HydrophobicContact CG-CB 4.25Å; R96-Q100 HydrophobicContact CG-CG 4.09Å; S97-Q100 WeakPolarHBondContact O-CB 3.2Å; S97-Q100 PolarHBondContact O-N 3.36Å; S97-Q100 PolarHBondContact OG-N 3.02Å; P98-Q100 VanDerWaalsContact C-N 3.31Å; P98-Q100 PolarHBondContact O-N 3.48Å; Q100-L102 VanDerWaalsContact C-N 3.32Å; Q100-L102 PolarHBondContact O-N 2.8Å; Q100-S103 WeakPolarHBondContact O-CB 3.37Å; Q100-S103 PolarHBondContact O-N 3.42Å; Q100-D104 PolarHBondContact O-N 3.49Å
101	L	59.8	Low	54.2	Low	74 Å²	74	62 Å²	62	39%	0.387	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-44.6	170	-67.4	172.1	0	0	0	111.5	S97 P98 D104 Y105	S97-L101 PolarHBondContact O-N 2.96Å; S97-L101 VanDerWaalsContact O-N 3.09Å; P98-L101 PolarHBondContact O-N 3.39Å; L101-D104 PolarHBondContact O-N 3.09Å; L101-Y105 WeakPolarHBondContact O-CB 3.46Å; L101-Y105 PolarHBondContact O-N 2.58Å
102	L	56.5	Low	55.1	Low	19 Å²	19	62 Å²	62	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-43.2	174.9	-176.8	67.6	0	0	0	111.5	F39 V61 L64 P98 F99 Q100 D104 Y105 M106	F39-L102 HydrophobicContact CE1-CD1 3.92Å; F39-L102 HydrophobicContact CZ-CD1 4.43Å; V61-L102 HydrophobicContact CB-CD2 4.36Å; V61-L102 HydrophobicContact CG1-CD2 4.28Å; V61-L102 HydrophobicContact CG2-CD2 3.66Å; L64-L102 HydrophobicContact CD2-CB 4.49Å; L64-L102 HydrophobicContact CD2-CD2 3.97Å; L64-L102 HydrophobicContact CD2-CG 3.83Å; P98-L102 PolarHBondContact O-N 2.97Å; F99-L102 PolarHBondContact O-N 3.17Å; Q100-L102 VanDerWaalsContact C-N 3.32Å; Q100-L102 PolarHBondContact O-N 2.8Å; L102-D104 PolarHBondContact O-N 3.44Å; L102-Y105 PolarHBondContact O-N 3.37Å; L102-M106 HydrophobicContact CD1-CG 4.07Å; L102-M106 HydrophobicContact CG-CG 4.17Å; L102-M106 VanDerWaalsContact O-CB 3.26Å; L102-M106 WeakPolarHBondContact O-CB 3.4Å; L102-M106 WeakPolarHBondContact O-CG 3.41Å; L102-M106 PolarHBondContact O-N 3.43Å
103	S	55.6	Low	55.4	Low	31 Å²	31	61.3 Å²	61.3	22%	0.217	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-47.5	175.3	-174.7	0	0	0	0	112.2	F99 Q100 L107	F99-S103 WeakPolarHBondContact O-CB 3.44Å; F99-S103 PolarHBondContact O-N 2.99Å; Q100-S103 WeakPolarHBondContact O-CB 3.37Å; Q100-S103 PolarHBondContact O-N 3.42Å; S103-L107 WeakPolarHBondContact O-CB 3.07Å; S103-L107 PolarHBondContact O-N 3.32Å
104	D	61.2	Low	55.8	Low	40 Å²	40	57.1 Å²	57.1	21%	0.214	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-41.6	179.8	-64.5	-50.8	0	0	0	111.3	R96 Q100 L101 L102 L107 S108	R96-D104 VanDerWaalsContact CD-OD2 3.3Å; R96-D104 WeakPolarHBondContact CD-OD2 3.44Å; R96-D104 IonicContact CZ-OD1 3.89Å; R96-D104 IonicContact CZ-OD2 3.22Å; R96-D104 IonicContact NE-OD2 3.48Å; R96-D104 PolarHBondContact NE-OD2 3.45Å; R96-D104 IonicContact NH1-OD1 3.45Å; R96-D104 PolarHBondContact NH1-OD1 2.86Å; R96-D104 IonicContact NH1-OD2 2.58Å; R96-D104 PolarHBondContact NH1-OD2 3.48Å; Q100-D104 PolarHBondContact O-N 3.49Å; L101-D104 PolarHBondContact O-N 3.09Å; L102-D104 PolarHBondContact O-N 3.44Å; D104-L107 PolarHBondContact O-N 2.91Å; D104-S108 WeakPolarHBondContact O-CB 3.38Å; D104-S108 PolarHBondContact O-N 3.01Å
105	Y	59.8	Low	56.2	Low	32 Å²	32	52.9 Å²	52.9	13%	0.125	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-49.3	176.9	-179.2	-107	0	0	0	111.6	A33 P35 F39 L101 L102 L107 S108 I109	A33-Y105 PolarHBondContact O-OH 3.45Å; P35-Y105 VanDerWaalsContact CA-OH 3.32Å; P35-Y105 WeakPolarHBondContact CA-OH 3.35Å; P35-Y105 HydrophobicContact CB-CE1 3.88Å; P35-Y105 HydrophobicContact CB-CE2 4.19Å; P35-Y105 WeakPolarHBondContact CB-OH 3.45Å; P35-Y105 WeakPolarHBondContact CD-OH 3.07Å; P35-Y105 HydrophobicContact CG-CE1 4.02Å; P35-Y105 WeakPolarHBondContact CG-OH 3.27Å; F39-Y105 HydrophobicContact CE1-CD1 4Å; F39-Y105 HydrophobicContact CE1-CG 4.37Å; F39-Y105 HydrophobicContact CZ-CD1 4.34Å; F39-Y105 HydrophobicContact CZ-CG 4.26Å; L101-Y105 WeakPolarHBondContact O-CB 3.46Å; L101-Y105 PolarHBondContact O-N 2.58Å; L102-Y105 PolarHBondContact O-N 3.37Å; Y105-L107 VanDerWaalsContact C-N 3.34Å; Y105-L107 PolarHBondContact O-N 3.49Å; Y105-S108 WeakPolarHBondContact O-CA 3.3Å; Y105-S108 WeakPolarHBondContact O-CB 3.28Å; Y105-S108 PolarHBondContact O-N 3.3Å; Y105-S108 VanDerWaalsContact O-N 3.08Å; Y105-S108 PolarHBondContact O-OG 2.87Å; Y105-I109 HydrophobicContact CD1-CD1 3.99Å; Y105-I109 HydrophobicContact CE1-CD1 3.34Å; Y105-I109 HydrophobicContact CE1-CG1 4.2Å; Y105-I109 PolarHBondContact O-N 2.88Å
106	M	56	Low	56	Low	26 Å²	26	52.8 Å²	52.8	13%	0.128	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-38.5	178.4	-72.7	-61	-41.9	0	0	112.1	L64 F65 L68 L102 S108 I109 C110	L64-M106 HydrophobicContact CD2-CB 4.23Å; L64-M106 HydrophobicContact CD2-CG 3.96Å; F65-M106 HydrophobicContact CD2-CE 3.22Å; F65-M106 HydrophobicContact CD2-SD 4.25Å; F65-M106 HydrophobicContact CE2-CE 3.31Å; F65-M106 HydrophobicContact CE2-SD 4.47Å; F65-M106 HydrophobicContact CG-CE 4.39Å; L68-M106 HydrophobicContact CD1-CB 3.14Å; L68-M106 HydrophobicContact CD1-CG 4.22Å; L102-M106 HydrophobicContact CD1-CG 4.07Å; L102-M106 HydrophobicContact CG-CG 4.17Å; L102-M106 VanDerWaalsContact O-CB 3.26Å; L102-M106 WeakPolarHBondContact O-CB 3.4Å; L102-M106 WeakPolarHBondContact O-CG 3.41Å; L102-M106 PolarHBondContact O-N 3.43Å; M106-S108 VanDerWaalsContact C-N 3.32Å; M106-S108 PolarHBondContact O-N 3.45Å; M106-I109 PolarHBondContact O-N 2.95Å; M106-I109 HydrophobicContact SD-CD1 4.33Å; M106-C110 PolarHBondContact O-N 3.38Å; M106-C110 PolarHBondContact O-SG 3.21Å
107	L	62.4	Low	55.8	Low	39 Å²	39	54.6 Å²	54.6	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-39	171.9	-177	66.9	0	0	0	111.4	L68 S103 D104 Y105 C110 M111	L68-L107 HydrophobicContact CD2-CB 4.09Å; L68-L107 HydrophobicContact CD2-CD1 3.93Å; S103-L107 WeakPolarHBondContact O-CB 3.07Å; S103-L107 PolarHBondContact O-N 3.32Å; D104-L107 PolarHBondContact O-N 2.91Å; Y105-L107 VanDerWaalsContact C-N 3.34Å; Y105-L107 PolarHBondContact O-N 3.49Å; L107-C110 PolarHBondContact O-N 3.01Å; L107-M111 WeakPolarHBondContact O-CB 3.34Å; L107-M111 VanDerWaalsContact O-CG 3.31Å; L107-M111 WeakPolarHBondContact O-CG 3.39Å; L107-M111 PolarHBondContact O-N 3.34Å
108	S	61.8	Low	55.4	Low	45 Å²	45	58.5 Å²	58.5	32%	0.315	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-42.8	176	82.9	0	0	0	0	111.9	D104 Y105 M106 M111 Q112	D104-S108 WeakPolarHBondContact O-CB 3.38Å; D104-S108 PolarHBondContact O-N 3.01Å; Y105-S108 WeakPolarHBondContact O-CA 3.3Å; Y105-S108 WeakPolarHBondContact O-CB 3.28Å; Y105-S108 PolarHBondContact O-N 3.3Å; Y105-S108 VanDerWaalsContact O-N 3.08Å; Y105-S108 PolarHBondContact O-OG 2.87Å; M106-S108 VanDerWaalsContact C-N 3.32Å; M106-S108 PolarHBondContact O-N 3.45Å; S108-M111 PolarHBondContact O-N 3.19Å; S108-Q112 WeakPolarHBondContact O-CB 3.26Å; S108-Q112 VanDerWaalsContact O-CG 3.31Å; S108-Q112 WeakPolarHBondContact O-CG 3.38Å; S108-Q112 PolarHBondContact O-N 2.92Å
109	I	56	Low	55.1	Low	39 Å²	39	62.9 Å²	62.9	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-47.7	173.7	-66.9	172.4	0	0	0	110.1	A33 Y105 M106 M111 Q112 L113	A33-I109 HydrophobicContact CB-CG1 4.11Å; Y105-I109 HydrophobicContact CD1-CD1 3.99Å; Y105-I109 HydrophobicContact CE1-CD1 3.34Å; Y105-I109 HydrophobicContact CE1-CG1 4.2Å; Y105-I109 PolarHBondContact O-N 2.88Å; M106-I109 PolarHBondContact O-N 2.95Å; M106-I109 HydrophobicContact SD-CD1 4.33Å; I109-M111 VanDerWaalsContact C-N 3.33Å; I109-M111 PolarHBondContact O-N 3.38Å; I109-Q112 PolarHBondContact O-N 3.18Å; I109-L113 HydrophobicContact CG2-CD1 3.84Å; I109-L113 HydrophobicContact CG2-CG 4.21Å; I109-L113 WeakPolarHBondContact O-CB 3.46Å; I109-L113 WeakPolarHBondContact O-CG 3.17Å; I109-L113 PolarHBondContact O-N 3.02Å
110	C	54.9	Low	54.9	Low	17 Å²	17	65.2 Å²	65.2	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-42.3	-179.5	-67.9	0	0	0	0	112.2	S72 M106 L107 L113 Q114	S72-C110 WeakPolarHBondContact OG-CB 3.48Å; M106-C110 PolarHBondContact O-N 3.38Å; M106-C110 PolarHBondContact O-SG 3.21Å; L107-C110 PolarHBondContact O-N 3.01Å; C110-L113 PolarHBondContact O-N 2.7Å; C110-Q114 WeakPolarHBondContact O-CB 3.34Å; C110-Q114 PolarHBondContact O-N 2.94Å
111	M	56.2	Low	54.1	Low	67 Å²	67	66.2 Å²	66.2	33%	0.33	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-39.3	176.7	-72.4	-67.3	-69.4	0	0	111.9	R75 L107 S108 I109 Q114 Q115	R75-M111 PolarHBondContact NH1-SD 3.48Å; L107-M111 WeakPolarHBondContact O-CB 3.34Å; L107-M111 VanDerWaalsContact O-CG 3.31Å; L107-M111 WeakPolarHBondContact O-CG 3.39Å; L107-M111 PolarHBondContact O-N 3.34Å; S108-M111 PolarHBondContact O-N 3.19Å; I109-M111 VanDerWaalsContact C-N 3.33Å; I109-M111 PolarHBondContact O-N 3.38Å; M111-Q114 PolarHBondContact O-N 3.45Å; M111-Q115 WeakPolarHBondContact O-CG 3.43Å; M111-Q115 PolarHBondContact O-N 3.41Å
112	Q	54.9	Low	53.3	Low	84 Å²	84	65 Å²	65	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-67.3	-42.3	175.1	-73.6	178.9	3	0	0	112.2	S108 I109 Q114 Q115 R116	S108-Q112 WeakPolarHBondContact O-CB 3.26Å; S108-Q112 VanDerWaalsContact O-CG 3.31Å; S108-Q112 WeakPolarHBondContact O-CG 3.38Å; S108-Q112 PolarHBondContact O-N 2.92Å; I109-Q112 PolarHBondContact O-N 3.18Å; Q112-Q114 VanDerWaalsContact C-N 3.31Å; Q112-Q114 PolarHBondContact O-N 2.93Å; Q112-Q115 PolarHBondContact O-N 3.01Å; Q112-R116 PolarHBondContact O-N 3.43Å
113	L	51.3	Low	52.3	Low	96 Å²	96	71 Å²	71	50%	0.503	35%	0.352	S	S	.	.	H	α-helix	trans	-60.4	-42.4	172.7	-73.6	173.7	0	0	0	110.8	I109 C110 Q115 R116 L117	I109-L113 HydrophobicContact CG2-CD1 3.84Å; I109-L113 HydrophobicContact CG2-CG 4.21Å; I109-L113 WeakPolarHBondContact O-CB 3.46Å; I109-L113 WeakPolarHBondContact O-CG 3.17Å; I109-L113 PolarHBondContact O-N 3.02Å; C110-L113 PolarHBondContact O-N 2.7Å; L113-Q115 PolarHBondContact O-N 3.46Å; L113-R116 PolarHBondContact O-N 2.96Å; L113-L117 WeakPolarHBondContact O-CG 3.42Å; L113-L117 PolarHBondContact O-N 3.1Å
114	Q	54.4	Low	51.5	Low	16 Å²	16	73.2 Å²	73.2	8%	0.075	36%	0.364	C	S	.	.	H	α-helix	trans	-65.3	-36.8	175.9	-166.5	178.9	32.3	0	0	112.6	C110 M111 Q112 R118	C110-Q114 WeakPolarHBondContact O-CB 3.34Å; C110-Q114 PolarHBondContact O-N 2.94Å; M111-Q114 PolarHBondContact O-N 3.45Å; Q112-Q114 VanDerWaalsContact C-N 3.31Å; Q112-Q114 PolarHBondContact O-N 2.93Å; Q114-R118 WeakPolarHBondContact O-CG 3.15Å; Q114-R118 PolarHBondContact O-N 2.91Å
115	Q	55.5	Low	50.2	Low	115 Å²	115	76.9 Å²	76.9	54%	0.537	38%	0.383	S	S	.	.	H	α-helix	trans	-66.1	-38.1	172.7	-76.3	177.4	-4.7	0	0	111.7	M111 Q112 L113 R118 L119	M111-Q115 WeakPolarHBondContact O-CG 3.43Å; M111-Q115 PolarHBondContact O-N 3.41Å; Q112-Q115 PolarHBondContact O-N 3.01Å; L113-Q115 PolarHBondContact O-N 3.46Å; Q115-R118 WeakPolarHBondContact O-CB 3.19Å; Q115-R118 PolarHBondContact O-N 3.31Å; Q115-L119 WeakPolarHBondContact O-CG 3.38Å; Q115-L119 PolarHBondContact O-N 3.21Å
116	R	46.2	Very low	48.9	Very low	109 Å²	109	84.8 Å²	84.8	41%	0.411	41%	0.412	S	S	.	.	H	α-helix	trans	-66.4	-45.8	174.1	-81	-173.1	162.8	-175.6	-9.3	112.8	G31 Q112 L113 R118 L119 E120	G31-R116 VanDerWaalsContact N-NH2 3.12Å; G31-R116 PolarHBondContact O-NH1 3.43Å; G31-R116 PolarHBondContact O-NH2 2.82Å; Q112-R116 PolarHBondContact O-N 3.43Å; L113-R116 PolarHBondContact O-N 2.96Å; R116-R118 PolarHBondContact O-N 3.1Å; R116-L119 CarbonylContact O-C 3.59Å; R116-L119 WeakPolarHBondContact O-CA 3.24Å; R116-L119 WeakPolarHBondContact O-CB 3.25Å; R116-L119 PolarHBondContact O-N 2.97Å; R116-E120 PolarHBondContact O-N 2.67Å
117	L	48.5	Very low	48.1	Very low	82 Å²	82	87.2 Å²	87.2	43%	0.429	43%	0.432	S	S	.	.	H	α-helix	trans	-58.5	-38.4	173.5	-72.3	170.1	0	0	0	111.1	L113 E120 D121	L113-L117 WeakPolarHBondContact O-CG 3.42Å; L113-L117 PolarHBondContact O-N 3.1Å; L117-E120 PolarHBondContact O-N 3.38Å; L117-D121 WeakPolarHBondContact O-CB 3.44Å; L117-D121 PolarHBondContact O-N 3.41Å
118	R	50.6	Low	46.9	Very low	134 Å²	134	91.7 Å²	91.7	51%	0.506	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-39.2	170.9	-82.6	-179.2	160.8	-171.5	-7	113.4	R79 Q114 Q115 R116 E120 A122	R79-R118 VanDerWaalsContact NE-NH2 3.18Å; Q114-R118 WeakPolarHBondContact O-CG 3.15Å; Q114-R118 PolarHBondContact O-N 2.91Å; Q115-R118 WeakPolarHBondContact O-CB 3.19Å; Q115-R118 PolarHBondContact O-N 3.31Å; R116-R118 PolarHBondContact O-N 3.1Å; R118-E120 VanDerWaalsContact C-N 3.35Å; R118-A122 WeakPolarHBondContact O-CB 3.35Å; R118-A122 PolarHBondContact O-N 3.01Å
119	L	46.1	Very low	45.5	Very low	110 Å²	110	93.9 Å²	93.9	58%	0.576	47%	0.47	S	S	*	.	H	α-helix	trans	-67.8	-38.4	176.3	-73.8	171.2	0	0	0	110.7	Q115 R116 A122 F123	Q115-L119 WeakPolarHBondContact O-CG 3.38Å; Q115-L119 PolarHBondContact O-N 3.21Å; R116-L119 CarbonylContact O-C 3.59Å; R116-L119 WeakPolarHBondContact O-CA 3.24Å; R116-L119 WeakPolarHBondContact O-CB 3.25Å; R116-L119 PolarHBondContact O-N 2.97Å; L119-A122 PolarHBondContact O-N 3.05Å; L119-F123 VanDerWaalsContact O-CB 3.25Å; L119-F123 WeakPolarHBondContact O-CB 3.32Å; L119-F123 WeakPolarHBondContact O-CD2 3.44Å; L119-F123 PolarHBondContact O-N 3.32Å
120	E	44.7	Very low	44.7	Very low	120 Å²	120	95.4 Å²	95.4	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-65.3	-50.9	173.6	-73.3	178.4	176.2	0	0	110.8	R116 L117 R118 A122 F123 T124	R116-E120 PolarHBondContact O-N 2.67Å; L117-E120 PolarHBondContact O-N 3.38Å; R118-E120 VanDerWaalsContact C-N 3.35Å; E120-A122 VanDerWaalsContact C-N 3.29Å; E120-A122 PolarHBondContact O-N 2.99Å; E120-F123 CarbonylContact O-C 3.52Å; E120-F123 WeakPolarHBondContact O-CA 3.33Å; E120-F123 PolarHBondContact O-N 3.37Å; E120-T124 PolarHBondContact O-N 3.49Å; E120-T124 PolarHBondContact O-OG1 3.34Å
121	D	44.1	Very low	44.1	Very low	95 Å²	95	99 Å²	99	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-57.4	-41.8	174.7	-73	-23.9	0	0	0	111.5	L117 T124 L125	L117-D121 WeakPolarHBondContact O-CB 3.44Å; L117-D121 PolarHBondContact O-N 3.41Å; D121-T124 PolarHBondContact O-N 3.16Å; D121-L125 VanDerWaalsContact O-CB 3.28Å; D121-L125 WeakPolarHBondContact O-CB 3.38Å; D121-L125 WeakPolarHBondContact O-CD1 3.44Å; D121-L125 PolarHBondContact O-N 3.32Å
122	A	43.5	Very low	43.3	Very low	48 Å²	48	105.5 Å²	105.5	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-32.6	176	0	0	0	0	0	112.7	R118 L119 E120 R126	R118-A122 WeakPolarHBondContact O-CB 3.35Å; R118-A122 PolarHBondContact O-N 3.01Å; L119-A122 PolarHBondContact O-N 3.05Å; E120-A122 VanDerWaalsContact C-N 3.29Å; E120-A122 PolarHBondContact O-N 2.99Å; A122-R126 WeakPolarHBondContact O-CB 3.35Å; A122-R126 WeakPolarHBondContact O-CG 3.4Å; A122-R126 PolarHBondContact O-N 3.34Å
123	F	35.2	Very low	42.4	Very low	147 Å²	147	109.5 Å²	109.5	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-73.6	-39	173.8	-107.3	-89.1	0	0	0	111.7	L119 E120 R126 S127	L119-F123 VanDerWaalsContact O-CB 3.25Å; L119-F123 WeakPolarHBondContact O-CB 3.32Å; L119-F123 WeakPolarHBondContact O-CD2 3.44Å; L119-F123 PolarHBondContact O-N 3.32Å; E120-F123 CarbonylContact O-C 3.52Å; E120-F123 WeakPolarHBondContact O-CA 3.33Å; E120-F123 PolarHBondContact O-N 3.37Å; F123-R126 CarbonylContact O-C 3.37Å; F123-R126 PolarHBondContact O-N 2.96Å; F123-S127 WeakPolarHBondContact O-CB 3.32Å; F123-S127 PolarHBondContact O-N 3.4Å; F123-S127 PolarHBondContact O-OG 3.17Å
124	T	38.7	Very low	41.7	Very low	76 Å²	76	109.3 Å²	109.3	47%	0.466	56%	0.564	S	S	.	*	H	α-helix	trans	-68	-37.6	174.1	-47.8	0	0	0	0	110.8	E120 D121 S127 N128	E120-T124 PolarHBondContact O-N 3.49Å; E120-T124 PolarHBondContact O-OG1 3.34Å; D121-T124 PolarHBondContact O-N 3.16Å; T124-S127 PolarHBondContact O-OG 3.15Å; T124-N128 WeakPolarHBondContact O-CB 3.39Å; T124-N128 PolarHBondContact O-N 3.4Å; T124-N128 VanDerWaalsContact O-N 3.11Å; T124-N128 PolarHBondContact O-ND2 3.31Å
125	L	34	Very low	41.2	Very low	117 Å²	117	113.2 Å²	113.2	61%	0.613	59%	0.59	S	S	*	*	H	α-helix	trans	-64.5	-39.6	169	-93.8	147.5	0	0	0	111.9	D121 C129	D121-L125 VanDerWaalsContact O-CB 3.28Å; D121-L125 WeakPolarHBondContact O-CB 3.38Å; D121-L125 WeakPolarHBondContact O-CD1 3.44Å; D121-L125 PolarHBondContact O-N 3.32Å; L125-C129 WeakPolarHBondContact O-CB 3.5Å; L125-C129 PolarHBondContact O-N 3.16Å; L125-C129 VanDerWaalsContact O-N 3.1Å; L125-C129 PolarHBondContact O-SG 3.05Å
126	R	32.3	Very low	41.1	Very low	199 Å²	199	113.3 Å²	113.3	75%	0.751	60%	0.601	S	S	*	*	H	α-helix	trans	-72.2	-36	176.4	-85.7	-173.6	172	-165.4	-1.9	113.6	A122 F123 N128 C129 A130	A122-R126 WeakPolarHBondContact O-CB 3.35Å; A122-R126 WeakPolarHBondContact O-CG 3.4Å; A122-R126 PolarHBondContact O-N 3.34Å; F123-R126 CarbonylContact O-C 3.37Å; F123-R126 PolarHBondContact O-N 2.96Å; R126-N128 VanDerWaalsContact C-N 3.34Å; R126-C129 CarbonylContact O-C 3.51Å; R126-C129 PolarHBondContact O-N 3.26Å; R126-A130 PolarHBondContact O-N 3.38Å
127	S	39.4	Very low	41.4	Very low	76 Å²	76	115.4 Å²	115.4	53%	0.531	62%	0.62	S	S	.	*	H	α-helix	trans	-70	-33.7	177.4	70.8	0	0	0	0	111.7	F123 T124 C129 A130	F123-S127 WeakPolarHBondContact O-CB 3.32Å; F123-S127 PolarHBondContact O-N 3.4Å; F123-S127 PolarHBondContact O-OG 3.17Å; T124-S127 PolarHBondContact O-OG 3.15Å; S127-C129 VanDerWaalsContact C-N 3.28Å; S127-A130 PolarHBondContact O-N 3.47Å
128	N	36.1	Very low	41.4	Very low	134 Å²	134	117.3 Å²	117.3	72%	0.717	64%	0.635	S	S	*	*	H	α-helix	trans	-77.5	-15.1	172.3	-70.5	-14.2	0	0	0	113	T124 R126 A130	T124-N128 WeakPolarHBondContact O-CB 3.39Å; T124-N128 PolarHBondContact O-N 3.4Å; T124-N128 VanDerWaalsContact O-N 3.11Å; T124-N128 PolarHBondContact O-ND2 3.31Å; R126-N128 VanDerWaalsContact C-N 3.34Å; N128-A130 VanDerWaalsContact C-N 3.35Å
129	C	33.2	Very low	41.4	Very low	90 Å²	90	118.6 Å²	118.6	61%	0.608	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	26.6	170	-70.8	0	0	0	0	112.5	L125 R126 S127 P131	L125-C129 WeakPolarHBondContact O-CB 3.5Å; L125-C129 PolarHBondContact O-N 3.16Å; L125-C129 VanDerWaalsContact O-N 3.1Å; L125-C129 PolarHBondContact O-SG 3.05Å; R126-C129 CarbonylContact O-C 3.51Å; R126-C129 PolarHBondContact O-N 3.26Å; S127-C129 VanDerWaalsContact C-N 3.28Å; C129-P131 VanDerWaalsContact O-CD 3.3Å; C129-P131 WeakPolarHBondContact O-CD 3.49Å; C129-P131 VanDerWaalsContact O-N 3.08Å
130	A	38.5	Very low	41.6	Very low	71 Å²	71	120.4 Å²	120.4	59%	0.587	66%	0.662	S	S	*	*			trans	-58.7	115.7	161.8	0	0	0	0	0	107.1	R126 S127 N128 F132	R126-A130 PolarHBondContact O-N 3.38Å; S127-A130 PolarHBondContact O-N 3.47Å; N128-A130 VanDerWaalsContact C-N 3.35Å; A130-F132 PolarHBondContact O-N 3.41Å
131	P	42.9	Very low	42.4	Very low	94 Å²	94	124.2 Å²	124.2	61%	0.61	70%	0.702	S	S	*	*			trans	-62.3	136.7	-172.3	24.6	-31.9	0	0	0	108.4	C129 H133	C129-P131 VanDerWaalsContact O-CD 3.3Å; C129-P131 WeakPolarHBondContact O-CD 3.49Å; C129-P131 VanDerWaalsContact O-N 3.08Å; P131-H133 PolarHBondContact O-N 3.37Å
132	F	38.6	Very low	42.3	Very low	203 Å²	203	125.7 Å²	125.7	89%	0.89	71%	0.711	S	S	*	*			trans	-53	90.4	159.6	-85.4	-98.3	0	0	0	107.5	A130 S134	A130-F132 PolarHBondContact O-N 3.41Å; F132-S134 PolarHBondContact O-N 3.49Å
133	H	37	Very low	42.2	Very low	168 Å²	168	129.7 Å²	129.7	78%	0.778	73%	0.728	S	S	*	*			trans	-69.4	83.2	155	-83.5	-70.7	0	0	0	105.3	P131 P135	P131-H133 PolarHBondContact O-N 3.37Å; H133-P135 VanDerWaalsContact O-CD 3.28Å; H133-P135 WeakPolarHBondContact O-CD 3.24Å
134	S	36.5	Very low	42.6	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	73%	0.732	S	S	*	*			trans	-71.2	112.1	151.5	-59.5	0	0	0	0	105.2	F132	F132-S134 PolarHBondContact O-N 3.49Å
135	P	44.6	Very low	42.9	Very low	97 Å²	97	131.9 Å²	131.9	63%	0.63	75%	0.748	S	S	*	*			trans	-62.2	142.9	174.6	27	-31.6	0	0	0	108.6	H133 D137	H133-P135 VanDerWaalsContact O-CD 3.28Å; H133-P135 WeakPolarHBondContact O-CD 3.24Å; P135-D137 PolarHBondContact O-N 3.41Å; P135-D137 VanDerWaalsContact O-N 3.12Å
136	P	51.6	Low	43.4	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	76%	0.757	S	S	*	*			trans	-66.1	114.1	169.5	26.6	-30.4	0	0	0	108	T138	P136-T138 PolarHBondContact O-N 3.37Å
137	D	52.4	Low	44.2	Very low	154 Å²	154	128.4 Å²	128.4	82%	0.824	76%	0.757	S	S	*	*			trans	-65.3	89.2	165.5	-78	-40	0	0	0	108.5	P135	P135-D137 PolarHBondContact O-N 3.41Å; P135-D137 VanDerWaalsContact O-N 3.12Å
138	T	48.6	Very low	44.5	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	77%	0.773	S	S	*	*			trans	-78.9	103.4	150.6	27.4	0	0	0	0	107.6	P136	P136-T138 PolarHBondContact O-N 3.37Å
139	L	52.4	Low	45.1	Very low	161 Å²	161	132 Å²	132	84%	0.843	78%	0.777	S	S	*	*			trans	-129.6	91.1	155.4	-92.9	163.2	0	0	0	107.8
140	D	50.3	Low	46.1	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	79%	0.791	S	S	*	*			trans	-52.2	125.5	154.6	-77.2	-56.3	0	0	0	110
141	S	60.4	Low	46.8	Very low	200 Å²	200	141.4 Å²	141.4	100%	1.399	81%	0.81	S	S	*	*			trans	176.2	0	137	-74.7	0	0	0	0	110.5

Retrieved 141 of 141 residues in 47.2 ms (Link to these results)

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