X2JD41_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JD41, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG44815, Length 119 aa.

						>X2JD41_DROME|X2JD41|Dmel\CG44815
MREVSAIFCNLALLSGFPLSIWQLLGLQSAAVFGLRSPGVSVRLLESPVPGLWSVVPGHSHYRCMCREVTPHGCVRSSLFLVRAKIQQLQKLKLLPLAVVATHRNIERKLSDMKIVKIK
					

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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	42.7	Very low	44.4	Very low	196 Å²	196	100 Å²	100	97%	0.966	51%	0.508	S	S	*	.				0	-28.5	0	-68.9	-126.1	-137.5	0	0	114.3	P71	M1-P71 HydrophobicContact CE-CB 4.46Å
2	R	34.9	Very low	44.4	Very low	232 Å²	232	95.8 Å²	95.8	88%	0.875	50%	0.5	S	S	*	.	H	α-helix	trans	-69.1	-32.3	-178.5	-67.8	-175.2	-179.7	-166.8	-0.1	114.6	A6	R2-A6 PolarHBondContact O-N 3.36Å
3	E	38.6	Very low	44.6	Very low	139 Å²	139	99.2 Å²	99.2	65%	0.65	52%	0.518	S	S	*	.	H	α-helix	trans	-68.6	-38.7	-173.5	-64.9	-178	151.4	0	0	114.1	S5 A6 I7	E3-S5 PolarHBondContact O-N 3.42Å; E3-A6 PolarHBondContact O-N 3.19Å; E3-I7 VanDerWaalsContact O-CG1 3.29Å; E3-I7 WeakPolarHBondContact O-CG1 3.46Å; E3-I7 PolarHBondContact O-N 3.24Å; E3-I7 VanDerWaalsContact O-N 3.08Å
4	V	44	Very low	44.6	Very low	68 Å²	68	102.9 Å²	102.9	41%	0.412	54%	0.538	S	S	.	.	H	α-helix	trans	-68.4	-38.5	-177.8	-173.8	0	0	0	0	110.8	A6 I7 F8	V4-A6 VanDerWaalsContact C-N 3.33Å; V4-A6 PolarHBondContact O-N 3.14Å; V4-I7 PolarHBondContact O-N 3.5Å; V4-F8 HydrophobicContact CG1-CD2 4.2Å; V4-F8 HydrophobicContact CG1-CE2 4.19Å; V4-F8 WeakPolarHBondContact O-CD2 3.45Å; V4-F8 PolarHBondContact O-N 3.08Å
5	S	46.4	Very low	44.9	Very low	65 Å²	65	100.3 Å²	100.3	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-66.8	-36	176.8	-158.2	0	0	0	0	112	E3 F8 C9	E3-S5 PolarHBondContact O-N 3.42Å; S5-F8 PolarHBondContact O-N 3.41Å; S5-C9 PolarHBondContact O-N 2.93Å; S5-C9 VanDerWaalsContact O-N 3.1Å
6	A	43.4	Very low	44.4	Very low	49 Å²	49	98.3 Å²	98.3	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-66.4	-37.6	175.2	0	0	0	0	0	112.1	R2 E3 V4 C9 N10	R2-A6 PolarHBondContact O-N 3.36Å; E3-A6 PolarHBondContact O-N 3.19Å; V4-A6 VanDerWaalsContact C-N 3.33Å; V4-A6 PolarHBondContact O-N 3.14Å; A6-C9 PolarHBondContact O-N 3.47Å; A6-N10 WeakPolarHBondContact O-CB 3.44Å; A6-N10 PolarHBondContact O-N 3.41Å; A6-N10 PolarHBondContact O-ND2 2.95Å; A6-N10 VanDerWaalsContact O-ND2 3.1Å
7	I	49.9	Very low	44.2	Very low	61 Å²	61	100.7 Å²	100.7	31%	0.313	55%	0.546	S	S	.	.	H	α-helix	trans	-62.8	-44	176.4	-66.7	162.7	0	0	0	110.8	E3 V4 N10 L11 I106	E3-I7 VanDerWaalsContact O-CG1 3.29Å; E3-I7 WeakPolarHBondContact O-CG1 3.46Å; E3-I7 PolarHBondContact O-N 3.24Å; E3-I7 VanDerWaalsContact O-N 3.08Å; V4-I7 PolarHBondContact O-N 3.5Å; I7-N10 PolarHBondContact O-N 2.88Å; I7-L11 HydrophobicContact CG2-CD1 3.96Å; I7-L11 WeakPolarHBondContact O-CB 3.26Å; I7-L11 PolarHBondContact O-N 3.23Å; I7-I106 HydrophobicContact CG2-CD1 4.19Å
8	F	50	Low	44	Very low	97 Å²	97	101.9 Å²	101.9	43%	0.425	56%	0.56	S	S	.	*	H	α-helix	trans	-66.7	-40.4	178	-88.9	-83.5	0	0	0	113.1	V4 S5 L11 A12 V82	V4-F8 HydrophobicContact CG1-CD2 4.2Å; V4-F8 HydrophobicContact CG1-CE2 4.19Å; V4-F8 WeakPolarHBondContact O-CD2 3.45Å; V4-F8 PolarHBondContact O-N 3.08Å; S5-F8 PolarHBondContact O-N 3.41Å; F8-L11 PolarHBondContact O-N 3.41Å; F8-A12 PolarHBondContact O-N 2.96Å; F8-A12 VanDerWaalsContact O-N 3.14Å; F8-V82 HydrophobicContact CE1-CG2 4.05Å; F8-V82 HydrophobicContact CZ-CG1 4.33Å; F8-V82 HydrophobicContact CZ-CG2 3.7Å
9	C	43.9	Very low	44	Very low	45 Å²	45	101.4 Å²	101.4	30%	0.304	56%	0.556	S	S	.	*	H	α-helix	trans	-65.5	-40.3	174.8	-81.1	0	0	0	0	112.6	S5 A6 L11 A12 L13 H59	S5-C9 PolarHBondContact O-N 2.93Å; S5-C9 VanDerWaalsContact O-N 3.1Å; A6-C9 PolarHBondContact O-N 3.47Å; C9-L11 VanDerWaalsContact C-N 3.32Å; C9-L11 PolarHBondContact O-N 3.29Å; C9-A12 PolarHBondContact O-N 3.37Å; C9-L13 PolarHBondContact O-N 3.39Å; C9-L13 VanDerWaalsContact O-N 3.11Å; C9-H59 PolarHBondContact SG-CE1 3.27Å
10	N	47.3	Very low	44.2	Very low	94 Å²	94	98.7 Å²	98.7	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-33.8	175.6	-77.6	-38.5	0	0	0	112.4	A6 I7 L13 L14	A6-N10 WeakPolarHBondContact O-CB 3.44Å; A6-N10 PolarHBondContact O-N 3.41Å; A6-N10 PolarHBondContact O-ND2 2.95Å; A6-N10 VanDerWaalsContact O-ND2 3.1Å; I7-N10 PolarHBondContact O-N 2.88Å; N10-L13 PolarHBondContact O-N 2.91Å; N10-L14 WeakPolarHBondContact O-CB 3.38Å; N10-L14 WeakPolarHBondContact O-CD1 3.48Å; N10-L14 WeakPolarHBondContact O-CG 3.26Å; N10-L14 PolarHBondContact O-N 3.2Å
11	L	47.4	Very low	44.6	Very low	54 Å²	54	97.4 Å²	97.4	28%	0.283	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-40.1	174	-102.3	141.2	0	0	0	112.6	I7 F8 C9 L14 S15	I7-L11 HydrophobicContact CG2-CD1 3.96Å; I7-L11 WeakPolarHBondContact O-CB 3.26Å; I7-L11 PolarHBondContact O-N 3.23Å; F8-L11 PolarHBondContact O-N 3.41Å; C9-L11 VanDerWaalsContact C-N 3.32Å; C9-L11 PolarHBondContact O-N 3.29Å; L11-L14 PolarHBondContact O-N 2.89Å; L11-S15 WeakPolarHBondContact O-CB 3.36Å; L11-S15 PolarHBondContact O-N 3.39Å; L11-S15 VanDerWaalsContact O-N 3.14Å
12	A	44.3	Very low	44.7	Very low	50 Å²	50	97.6 Å²	97.6	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-44.4	174.9	0	0	0	0	0	111.2	F8 C9 S15	F8-A12 PolarHBondContact O-N 2.96Å; F8-A12 VanDerWaalsContact O-N 3.14Å; C9-A12 PolarHBondContact O-N 3.37Å; A12-S15 PolarHBondContact O-N 3.45Å; A12-S15 PolarHBondContact O-OG 3.11Å
13	L	47.7	Very low	45.3	Very low	140 Å²	140	92.4 Å²	92.4	73%	0.733	51%	0.512	S	S	*	.	H	α-helix	trans	-61.6	-44.2	175.2	-103.4	141.7	0	0	0	113.1	C9 N10 S15 G16	C9-L13 PolarHBondContact O-N 3.39Å; C9-L13 VanDerWaalsContact O-N 3.11Å; N10-L13 PolarHBondContact O-N 2.91Å; L13-S15 VanDerWaalsContact C-N 3.29Å; L13-S15 PolarHBondContact O-N 2.89Å; L13-G16 PolarHBondContact O-N 3.08Å
14	L	44.1	Very low	45.7	Very low	151 Å²	151	89.6 Å²	89.6	79%	0.791	50%	0.501	S	S	*	.	H	α-helix	trans	-67.7	-27.5	179.7	-86.7	157.7	0	0	0	113.4	N10 L11 G16	N10-L14 WeakPolarHBondContact O-CB 3.38Å; N10-L14 WeakPolarHBondContact O-CD1 3.48Å; N10-L14 WeakPolarHBondContact O-CG 3.26Å; N10-L14 PolarHBondContact O-N 3.2Å; L11-L14 PolarHBondContact O-N 2.89Å; L14-G16 VanDerWaalsContact C-N 3.26Å; L14-G16 PolarHBondContact O-N 3.46Å
15	S	48.6	Very low	46.1	Very low	63 Å²	63	90.1 Å²	90.1	44%	0.441	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.2	-176.6	70.6	0	0	0	0	113.8	L11 A12 L13 F17	L11-S15 WeakPolarHBondContact O-CB 3.36Å; L11-S15 PolarHBondContact O-N 3.39Å; L11-S15 VanDerWaalsContact O-N 3.14Å; A12-S15 PolarHBondContact O-N 3.45Å; A12-S15 PolarHBondContact O-OG 3.11Å; L13-S15 VanDerWaalsContact C-N 3.29Å; L13-S15 PolarHBondContact O-N 2.89Å; S15-F17 WeakPolarHBondContact O-CD2 3.37Å; S15-F17 PolarHBondContact O-N 2.84Å
16	G	36.9	Very low	46	Very low	69 Å²	69	89.1 Å²	89.1	71%	0.711	50%	0.502	S	S	*	.			trans	60	3	-179.2	0	0	0	0	0	114.6	L13 L14	L13-G16 PolarHBondContact O-N 3.08Å; L14-G16 VanDerWaalsContact C-N 3.26Å; L14-G16 PolarHBondContact O-N 3.46Å
17	F	40.7	Very low	46.1	Very low	139 Å²	139	93.6 Å²	93.6	61%	0.61	52%	0.518	S	S	*	.			trans	-98.2	114.3	179.5	-95	-86.6	0	0	0	107.5	S15 L19	S15-F17 WeakPolarHBondContact O-CD2 3.37Å; S15-F17 PolarHBondContact O-N 2.84Å; F17-L19 HydrophobicContact CB-CB 4.47Å; F17-L19 HydrophobicContact CB-CD1 3.97Å; F17-L19 HydrophobicContact CB-CG 3.95Å; F17-L19 HydrophobicContact CD1-CD1 4.03Å; F17-L19 HydrophobicContact CD1-CG 3.97Å; F17-L19 HydrophobicContact CG-CD1 4.17Å; F17-L19 HydrophobicContact CG-CG 4.33Å; F17-L19 PolarHBondContact O-N 3.31Å
18	P	41.8	Very low	45.8	Very low	123 Å²	123	97.6 Å²	97.6	80%	0.799	54%	0.535	S	S	*	.			trans	-75.1	54.2	166.7	35.6	-33.5	0	0	0	107.8	S20	P18-S20 PolarHBondContact O-N 3.48Å
19	L	44.2	Very low	45.6	Very low	92 Å²	92	96.6 Å²	96.6	48%	0.482	54%	0.54	S	S	.	.			trans	-71.5	96	171.6	-80.3	168.3	0	0	0	105.2	F17 I21 L24	F17-L19 HydrophobicContact CB-CB 4.47Å; F17-L19 HydrophobicContact CB-CD1 3.97Å; F17-L19 HydrophobicContact CB-CG 3.95Å; F17-L19 HydrophobicContact CD1-CD1 4.03Å; F17-L19 HydrophobicContact CD1-CG 3.97Å; F17-L19 HydrophobicContact CG-CD1 4.17Å; F17-L19 HydrophobicContact CG-CG 4.33Å; F17-L19 PolarHBondContact O-N 3.31Å; L19-I21 PolarHBondContact O-N 3.46Å; L19-L24 HydrophobicContact CB-CD1 4.08Å; L19-L24 HydrophobicContact CD1-CD1 4.48Å
20	S	48	Very low	45.4	Very low	47 Å²	47	98.7 Å²	98.7	33%	0.329	56%	0.561	S	S	.	*			trans	-48	114.9	170.5	64.4	0	0	0	0	106.8	P18 W22 Q23 L24	P18-S20 PolarHBondContact O-N 3.48Å; S20-W22 CarbonylContact O-C 3.54Å; S20-W22 PolarHBondContact O-N 3.5Å; S20-Q23 PolarHBondContact O-N 3.11Å; S20-Q23 VanDerWaalsContact OG-CB 3.25Å; S20-Q23 WeakPolarHBondContact OG-CB 3.31Å; S20-Q23 WeakPolarHBondContact OG-CG 3.47Å; S20-Q23 PolarHBondContact OG-N 3.34Å; S20-Q23 PolarHBondContact OG-OE1 2.9Å; S20-L24 PolarHBondContact O-N 2.94Å
21	I	51	Low	45	Very low	71 Å²	71	98.1 Å²	98.1	36%	0.364	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-47.9	-27.5	175.2	-70.3	165.7	0	0	0	110.1	L19 L25 Y62	L19-I21 PolarHBondContact O-N 3.46Å; I21-L25 PolarHBondContact O-N 3.33Å; I21-Y62 HydrophobicContact CG2-CD2 4.45Å; I21-Y62 HydrophobicContact CG2-CE2 3.38Å; I21-Y62 VanDerWaalsContact CG2-OH 3.26Å; I21-Y62 WeakPolarHBondContact CG2-OH 3.33Å
22	W	46.4	Very low	44.8	Very low	201 Å²	201	101 Å²	101	76%	0.761	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-42	169.6	-80.9	82	0	0	0	116	S20 L24 L25 G26	S20-W22 CarbonylContact O-C 3.54Å; S20-W22 PolarHBondContact O-N 3.5Å; W22-L24 VanDerWaalsContact C-N 3.25Å; W22-L24 PolarHBondContact O-N 3.4Å; W22-L25 PolarHBondContact O-N 3.45Å; W22-G26 WeakPolarHBondContact O-CA 3.49Å; W22-G26 PolarHBondContact O-N 2.97Å
23	Q	47.7	Very low	44.4	Very low	122 Å²	122	107.3 Å²	107.3	57%	0.57	61%	0.607	S	S	*	*	H	α-helix	trans	-66.2	-29.1	173.9	-83	166.3	-38.6	0	0	112.3	S20	S20-Q23 PolarHBondContact O-N 3.11Å; S20-Q23 VanDerWaalsContact OG-CB 3.25Å; S20-Q23 WeakPolarHBondContact OG-CB 3.31Å; S20-Q23 WeakPolarHBondContact OG-CG 3.47Å; S20-Q23 PolarHBondContact OG-N 3.34Å; S20-Q23 PolarHBondContact OG-OE1 2.9Å
24	L	46.7	Very low	43.5	Very low	81 Å²	81	103.5 Å²	103.5	42%	0.424	60%	0.602	S	S	.	*	H	α-helix	trans	-79.1	-14.9	178.2	-82.9	159	0	0	0	114.4	L19 S20 W22 K85	L19-L24 HydrophobicContact CB-CD1 4.08Å; L19-L24 HydrophobicContact CD1-CD1 4.48Å; S20-L24 PolarHBondContact O-N 2.94Å; W22-L24 VanDerWaalsContact C-N 3.25Å; W22-L24 PolarHBondContact O-N 3.4Å; L24-K85 PolarHBondContact O-NZ 2.75Å
25	L	51.1	Low	43.2	Very low	78 Å²	78	104.1 Å²	104.1	41%	0.408	61%	0.605	S	S	.	*	H	α-helix	trans	-118.6	-21.7	177.7	-90.6	91	0	0	0	114.8	I21 W22 L27 S29 Y62	I21-L25 PolarHBondContact O-N 3.33Å; W22-L25 PolarHBondContact O-N 3.45Å; L25-L27 PolarHBondContact O-N 3.4Å; L25-S29 PolarHBondContact O-OG 2.84Å; L25-Y62 HydrophobicContact CD1-CE1 4.06Å; L25-Y62 WeakPolarHBondContact CD1-OH 3.23Å; L25-Y62 HydrophobicContact CD2-CE1 3.76Å
26	G	44	Very low	42.3	Very low	45 Å²	45	112 Å²	112	46%	0.464	63%	0.625	S	S	.	*	H	α-helix	trans	-75.1	-19.7	-177.3	0	0	0	0	0	114.7	W22	W22-G26 WeakPolarHBondContact O-CA 3.49Å; W22-G26 PolarHBondContact O-N 2.97Å
27	L	46	Very low	42.3	Very low	143 Å²	143	114.3 Å²	114.3	75%	0.749	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-11.2	-178.7	-88.3	147.6	0	0	0	114.7	L25	L25-L27 PolarHBondContact O-N 3.4Å
28	Q	43.9	Very low	41.9	Very low	145 Å²	145	114 Å²	114	68%	0.678	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-14.9	173.8	-77.5	-160.5	1.4	0	0	114.3	A30 V32	Q28-A30 VanDerWaalsContact C-N 3.32Å; Q28-A30 PolarHBondContact O-N 2.9Å; Q28-V32 WeakPolarHBondContact O-CG2 3.38Å
29	S	44.9	Very low	41.4	Very low	75 Å²	75	111.5 Å²	111.5	52%	0.524	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-15.4	179.2	-55.8	0	0	0	0	113.4	L25	L25-S29 PolarHBondContact O-OG 2.84Å
30	A	39.7	Very low	40.8	Very low	89 Å²	89	114.1 Å²	114.1	74%	0.736	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-19.8	177	0	0	0	0	0	113.8	Q28	Q28-A30 VanDerWaalsContact C-N 3.32Å; Q28-A30 PolarHBondContact O-N 2.9Å
31	A	40.4	Very low	39.9	Very low	82 Å²	82	117 Å²	117	68%	0.678	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-13.6	-172.7	0	0	0	0	0	114.2
32	V	41.8	Very low	38.9	Very low	116 Å²	116	120.6 Å²	120.6	70%	0.703	70%	0.703	S	S	*	*	S	Bend	trans	-97.3	-9.6	178.5	-176	0	0	0	0	112.3	Q28 G34	Q28-V32 WeakPolarHBondContact O-CG2 3.38Å; V32-G34 VanDerWaalsContact C-N 3.26Å; V32-G34 PolarHBondContact O-N 3.45Å
33	F	37.2	Very low	38.3	Very low	182 Å²	182	122.1 Å²	122.1	80%	0.798	71%	0.709	S	S	*	*			trans	-92.1	50.5	167.4	-80.9	-85.8	0	0	0	111.7	L35	F33-L35 PolarHBondContact O-N 3.41Å
34	G	28.8	Very low	37.5	Very low	60 Å²	60	124.4 Å²	124.4	62%	0.619	72%	0.724	S	S	*	*			trans	-83.4	92.3	160.6	0	0	0	0	0	108.9	V32	V32-G34 VanDerWaalsContact C-N 3.26Å; V32-G34 PolarHBondContact O-N 3.45Å
35	L	36.6	Very low	36.7	Very low	163 Å²	163	128 Å²	128	85%	0.853	74%	0.743	S	S	*	*	S	Bend	trans	176.9	95.8	147.4	-93.8	152.3	0	0	0	110	F33	F33-L35 PolarHBondContact O-N 3.41Å
36	R	30.8	Very low	35.8	Very low	229 Å²	229	132.9 Å²	132.9	86%	0.864	76%	0.764	S	S	*	*			trans	69.1	91.2	137.8	-157.3	-178.1	-164.2	-167.4	4.2	117.1
37	S	36	Very low	35.3	Very low	118 Å²	118	136 Å²	136	83%	0.825	78%	0.778	S	S	*	*			trans	-161.7	118.1	136.4	-81.2	0	0	0	0	110.5
38	P	32.8	Very low	34.9	Very low	131 Å²	131	134.8 Å²	134.8	85%	0.851	78%	0.779	S	S	*	*			trans	-80.5	126.6	174.1	32.3	-27.9	0	0	0	109.2
39	G	32.4	Very low	34.5	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	79%	0.786	S	S	*	*			trans	84.6	91.5	161	0	0	0	0	0	116.5
40	V	30.5	Very low	33.9	Very low	148 Å²	148	136.9 Å²	136.9	90%	0.897	80%	0.8	S	S	*	*			trans	-144	109.9	142.3	-172.9	0	0	0	0	108.2
41	S	29.9	Very low	33.6	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	79%	0.789	S	S	*	*			trans	-59	135.8	172.4	-68.9	0	0	0	0	111.6	R43	S41-R43 PolarHBondContact O-N 3.08Å; S41-R43 VanDerWaalsContact O-N 3.15Å
42	V	30.3	Very low	33.2	Very low	145 Å²	145	139.6 Å²	139.6	88%	0.879	80%	0.802	S	S	*	*			trans	-64.8	107.7	167.3	179.7	0	0	0	0	108.6
43	R	33.2	Very low	32.9	Very low	234 Å²	234	143.5 Å²	143.5	88%	0.883	80%	0.804	S	S	*	*			trans	-122.1	117.5	158.5	-77.9	-166.8	172.8	-179.2	-0.6	108.9	S41	S41-R43 PolarHBondContact O-N 3.08Å; S41-R43 VanDerWaalsContact O-N 3.15Å
44	L	29.5	Very low	32.6	Very low	169 Å²	169	140.2 Å²	140.2	89%	0.885	80%	0.803	S	S	*	*			trans	-34.3	127.2	158.9	-80.3	132.9	0	0	0	112.3
45	L	31.5	Very low	32.8	Very low	157 Å²	157	143.6 Å²	143.6	82%	0.822	81%	0.812	S	S	*	*			trans	-162.8	96	149.7	-147.7	71.4	0	0	0	107.4
46	E	32.5	Very low	32.7	Very low	181 Å²	181	140.3 Å²	140.3	85%	0.846	80%	0.798	S	S	*	*				61.8	97.2	84.6	-133.7	-176.3	131.3	0	0	113.3
47	S	32.3	Very low	32.8	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	80%	0.795	S	S	*	*			trans	-168.1	122.1	144.2	-174.8	0	0	0	0	110
48	P	36.9	Very low	32.9	Very low	117 Å²	117	133.2 Å²	133.2	76%	0.76	79%	0.793	S	S	*	*			trans	-95.1	130.7	-177.6	35.1	-28.2	0	0	0	111.2
49	V	36.7	Very low	33.3	Very low	135 Å²	135	132.2 Å²	132.2	82%	0.818	78%	0.776	S	S	*	*			trans	-105.6	126	167	178.8	0	0	0	0	108.3	G51	V49-G51 PolarHBondContact O-N 3.24Å
50	P	32.4	Very low	33.6	Very low	129 Å²	129	131.2 Å²	131.2	84%	0.838	76%	0.758	S	S	*	*			trans	-83.4	120.3	-172.5	33.1	-31.2	0	0	0	110
51	G	32.2	Very low	34.2	Very low	47 Å²	47	130.6 Å²	130.6	49%	0.485	75%	0.745	S	S	.	*			trans	-158.8	76.9	178.4	0	0	0	0	0	110.2	V49 W53	V49-G51 PolarHBondContact O-N 3.24Å; G51-W53 VanDerWaalsContact C-N 3.29Å; G51-W53 PolarHBondContact O-N 3.37Å; G51-W53 PolarHBondContact O-NE1 2.84Å
52	L	31.9	Very low	34.9	Very low	182 Å²	182	132.7 Å²	132.7	95%	0.953	74%	0.738	S	S	*	*			trans	30.7	39.6	139.2	-127	127.8	0	0	0	120.2
53	W	35.7	Very low	35.5	Very low	197 Å²	197	136.6 Å²	136.6	75%	0.746	74%	0.737	S	S	*	*			trans	-108.4	100.8	178	-61.8	16.7	0	0	0	107	G51 V55 H61	G51-W53 VanDerWaalsContact C-N 3.29Å; G51-W53 PolarHBondContact O-N 3.37Å; G51-W53 PolarHBondContact O-NE1 2.84Å; W53-V55 PolarHBondContact O-N 3.43Å; W53-H61 AromaticContact CE3-CE1 3.7Å; W53-H61 AromaticContact CZ3-CE1 3.33Å; W53-H61 WeakPolarHBondContact CZ3-CE1 3.38Å; W53-H61 AromaticContact CZ3-ND1 3.95Å
54	S	30.8	Very low	36.1	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	72%	0.715	S	S	*	*			trans	-43.9	119.9	178.2	178.1	0	0	0	0	110.9	V56	S54-V56 PolarHBondContact O-N 3Å
55	V	33.8	Very low	36.9	Very low	131 Å²	131	129.1 Å²	129.1	79%	0.794	72%	0.716	S	S	*	*			trans	-69.5	91.7	-179.8	-179.2	0	0	0	0	108.2	W53	W53-V55 PolarHBondContact O-N 3.43Å
56	V	34.6	Very low	37.3	Very low	94 Å²	94	123 Å²	123	57%	0.57	69%	0.686	S	S	*	*			trans	-88.9	111.5	157.1	179.9	0	0	0	0	106.4	S54 G58	S54-V56 PolarHBondContact O-N 3Å; V56-G58 PolarHBondContact O-N 2.94Å
57	P	33.1	Very low	37.8	Very low	124 Å²	124	126.5 Å²	126.5	81%	0.805	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	100.8	179.4	27.9	-30.2	0	0	0	108
58	G	38.8	Very low	38.1	Very low	75 Å²	75	129 Å²	129	77%	0.773	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.7	-9.7	176.3	0	0	0	0	0	117.3	V56 S60	V56-G58 PolarHBondContact O-N 2.94Å; G58-S60 PolarHBondContact O-N 3.32Å
59	H	40.3	Very low	38.4	Very low	109 Å²	109	129.2 Å²	129.2	51%	0.505	69%	0.69	S	S	.	*			trans	-96.8	93.8	179.5	-98.2	-76.1	0	0	0	112.2	C9 H61	C9-H59 PolarHBondContact SG-CE1 3.27Å; H59-H61 PolarHBondContact O-N 3.24Å
60	S	38.8	Very low	38.6	Very low	50 Å²	50	126.5 Å²	126.5	35%	0.35	67%	0.674	S	S	.	*			trans	-70.6	113.6	169.1	69.1	0	0	0	0	110	G58 Y62	G58-S60 PolarHBondContact O-N 3.32Å; S60-Y62 PolarHBondContact O-N 3.08Å
61	H	43.6	Very low	39.4	Very low	135 Å²	135	124.3 Å²	124.3	63%	0.625	66%	0.659	S	S	*	*			trans	-60.3	103.2	168.4	-86.7	-126.8	0	0	0	109.7	W53 H59 R63	W53-H61 AromaticContact CE3-CE1 3.7Å; W53-H61 AromaticContact CZ3-CE1 3.33Å; W53-H61 WeakPolarHBondContact CZ3-CE1 3.38Å; W53-H61 AromaticContact CZ3-ND1 3.95Å; H59-H61 PolarHBondContact O-N 3.24Å; H61-R63 VanDerWaalsContact C-N 3.31Å; H61-R63 PolarHBondContact O-N 3.02Å
62	Y	43.3	Very low	40.3	Very low	153 Å²	153	127.7 Å²	127.7	60%	0.6	66%	0.662	S	S	*	*			trans	-64.3	94.3	162	-98	-86.7	0	0	0	108.2	I21 L25 S60 C64	I21-Y62 HydrophobicContact CG2-CD2 4.45Å; I21-Y62 HydrophobicContact CG2-CE2 3.38Å; I21-Y62 VanDerWaalsContact CG2-OH 3.26Å; I21-Y62 WeakPolarHBondContact CG2-OH 3.33Å; L25-Y62 HydrophobicContact CD1-CE1 4.06Å; L25-Y62 WeakPolarHBondContact CD1-OH 3.23Å; L25-Y62 HydrophobicContact CD2-CE1 3.76Å; S60-Y62 PolarHBondContact O-N 3.08Å; Y62-C64 PolarHBondContact O-N 3.49Å
63	R	44.3	Very low	40.7	Very low	227 Å²	227	120.2 Å²	120.2	86%	0.857	63%	0.63	S	S	*	*			trans	-69.7	115.9	166.4	-77.3	-172.1	174	-165.9	-0.8	107.7	H61 M65	H61-R63 VanDerWaalsContact C-N 3.31Å; H61-R63 PolarHBondContact O-N 3.02Å; R63-M65 PolarHBondContact O-N 2.89Å
64	C	44.6	Very low	41.2	Very low	63 Å²	63	112.8 Å²	112.8	43%	0.426	61%	0.607	S	S	.	*			trans	-65	127.9	163.2	-168.2	0	0	0	0	108.3	Y62 C66 C74	Y62-C64 PolarHBondContact O-N 3.49Å; C64-C66 HydrophobicContact CB-CB 4.02Å; C64-C66 WeakPolarHBondContact CB-SG 3.37Å; C64-C66 PolarHBondContact O-N 3.35Å; C64-C66 VanDerWaalsContact O-N 3.11Å; C64-C66 WeakPolarHBondContact SG-CB 3.33Å; C64-C66 PolarHBondContact SG-N 3.43Å; C64-C66 CovalentContact SG-SG 2.07Å; C64-C66 PolarHBondContact SG-SG 3.02Å; C64-C74 HydrophobicContact CB-CB 3.45Å; C64-C74 VanDerWaalsContact CB-CB 3.45Å; C64-C74 VanDerWaalsContact SG-CB 3.54Å
65	M	46.4	Very low	42	Very low	182 Å²	182	110.2 Å²	110.2	90%	0.897	59%	0.586	S	S	*	*			trans	-75.3	19.7	167.2	-65.2	-159.8	172.2	0	0	113.2	R63 R67	R63-M65 PolarHBondContact O-N 2.89Å; M65-R67 PolarHBondContact O-N 3.08Å; M65-R67 VanDerWaalsContact O-N 3.09Å
66	C	40.3	Very low	42.7	Very low	30 Å²	30	113 Å²	113	20%	0.203	58%	0.583	C	S	.	*			trans	-67.8	107.1	177.9	-58.3	0	0	0	0	108.6	C64 E68 C74	C64-C66 HydrophobicContact CB-CB 4.02Å; C64-C66 WeakPolarHBondContact CB-SG 3.37Å; C64-C66 PolarHBondContact O-N 3.35Å; C64-C66 VanDerWaalsContact O-N 3.11Å; C64-C66 WeakPolarHBondContact SG-CB 3.33Å; C64-C66 PolarHBondContact SG-N 3.43Å; C64-C66 CovalentContact SG-SG 2.07Å; C64-C66 PolarHBondContact SG-SG 3.02Å; C66-E68 PolarHBondContact O-N 3.49Å; C66-C74 HydrophobicContact CB-CB 4.14Å; C66-C74 VanDerWaalsContact SG-CA 3.57Å; C66-C74 WeakPolarHBondContact SG-CB 3.1Å
67	R	43.9	Very low	43.6	Very low	254 Å²	254	111.2 Å²	111.2	96%	0.958	57%	0.574	S	S	*	*	S	Bend	trans	-64.2	-3.2	176.1	-88.2	-175.5	170.6	173.2	-2.8	114.2	M65	M65-R67 PolarHBondContact O-N 3.08Å; M65-R67 VanDerWaalsContact O-N 3.09Å
68	E	37.1	Very low	44.8	Very low	162 Å²	162	108.1 Å²	108.1	76%	0.757	56%	0.555	S	S	*	*	S	Bend	trans	-132.5	102.4	169.8	-72.8	173.9	173.4	0	0	109	C66 T70	C66-E68 PolarHBondContact O-N 3.49Å; E68-T70 VanDerWaalsContact C-N 3.27Å; E68-T70 PolarHBondContact O-N 2.76Å
69	V	44.6	Very low	45.9	Very low	121 Å²	121	107.5 Å²	107.5	73%	0.733	53%	0.534	S	S	*	.			trans	-85.2	72.5	179.7	-166.6	0	0	0	0	109.1
70	T	39.9	Very low	46.9	Very low	79 Å²	79	109.6 Å²	109.6	49%	0.485	54%	0.542	S	S	.	.			trans	-79.3	138.7	153.9	55.7	0	0	0	0	107.7	E68 H72 G73	E68-T70 VanDerWaalsContact C-N 3.27Å; E68-T70 PolarHBondContact O-N 2.76Å; T70-H72 PolarHBondContact O-N 3.4Å; T70-G73 PolarHBondContact O-N 3.33Å; T70-G73 PolarHBondContact OG1-N 3.24Å
71	P	50.6	Low	48	Very low	82 Å²	82	112.9 Å²	112.9	53%	0.532	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.6	-15.6	-178.7	21.6	-32.4	0	0	0	113.2	M1 V75	M1-P71 HydrophobicContact CE-CB 4.46Å; P71-V75 VanDerWaalsContact O-CG2 3.25Å; P71-V75 WeakPolarHBondContact O-CG2 3.26Å
72	H	49.5	Very low	49.1	Very low	118 Å²	118	108.4 Å²	108.4	55%	0.546	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-28	175	-66.5	-70.1	0	0	0	114	T70 R76	T70-H72 PolarHBondContact O-N 3.4Å; H72-R76 PolarHBondContact O-N 3.41Å
73	G	40.7	Very low	50.3	Low	26 Å²	26	107.6 Å²	107.6	27%	0.268	53%	0.533	S	S	.	.	H	α-helix	trans	-65.3	-48.5	-174.5	0	0	0	0	0	112.3	T70 R76 S77	T70-G73 PolarHBondContact O-N 3.33Å; T70-G73 PolarHBondContact OG1-N 3.24Å; G73-R76 PolarHBondContact O-N 2.76Å; G73-S77 PolarHBondContact O-N 2.88Å; G73-S77 PolarHBondContact O-OG 3.41Å
74	C	45.7	Very low	51.5	Low	40 Å²	40	98.3 Å²	98.3	27%	0.27	51%	0.505	S	S	.	.	H	α-helix	trans	-80.5	-18.8	-177.7	87.4	0	0	0	0	114.7	C64 C66 S78	C64-C74 HydrophobicContact CB-CB 3.45Å; C64-C74 VanDerWaalsContact CB-CB 3.45Å; C64-C74 VanDerWaalsContact SG-CB 3.54Å; C66-C74 HydrophobicContact CB-CB 4.14Å; C66-C74 VanDerWaalsContact SG-CA 3.57Å; C66-C74 WeakPolarHBondContact SG-CB 3.1Å; C74-S78 PolarHBondContact O-N 3.46Å; C74-S78 PolarHBondContact O-OG 3.39Å
75	V	48.2	Very low	52.4	Low	59 Å²	59	99.3 Å²	99.3	36%	0.358	50%	0.502	S	S	.	.	H	α-helix	trans	-70.8	-35.8	170.1	179.5	0	0	0	0	111.2	P71 S78 L79	P71-V75 VanDerWaalsContact O-CG2 3.25Å; P71-V75 WeakPolarHBondContact O-CG2 3.26Å; V75-S78 PolarHBondContact O-OG 2.95Å; V75-S78 VanDerWaalsContact O-OG 3.04Å; V75-L79 HydrophobicContact CG1-CD1 3.86Å; V75-L79 HydrophobicContact CG1-CG 4.36Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 VanDerWaalsContact O-CG 3.22Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.5Å
76	R	49	Very low	53.4	Low	190 Å²	190	91.6 Å²	91.6	72%	0.717	47%	0.465	S	S	*	.	H	α-helix	trans	-66.7	-42.1	175.3	-88	-172.1	160.2	157.9	-3.3	112.4	H72 G73 L79 F80	H72-R76 PolarHBondContact O-N 3.41Å; G73-R76 PolarHBondContact O-N 2.76Å; R76-L79 PolarHBondContact O-N 2.71Å; R76-F80 WeakPolarHBondContact O-CB 3.4Å; R76-F80 PolarHBondContact O-N 2.91Å
77	S	52.6	Low	54.7	Low	57 Å²	57	95 Å²	95	40%	0.399	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-41.8	179.1	-51.2	0	0	0	0	112.1	G73 F80 L81	G73-S77 PolarHBondContact O-N 2.88Å; G73-S77 PolarHBondContact O-OG 3.41Å; S77-F80 PolarHBondContact O-N 2.78Å; S77-L81 WeakPolarHBondContact O-CG 3.44Å; S77-L81 PolarHBondContact O-N 3.32Å; S77-L81 VanDerWaalsContact O-N 3.11Å
78	S	60.1	Low	55.7	Low	58 Å²	58	88 Å²	88	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-68.7	-40.9	177.7	59.9	0	0	0	0	112.3	C74 V75 L81 V82	C74-S78 PolarHBondContact O-N 3.46Å; C74-S78 PolarHBondContact O-OG 3.39Å; V75-S78 PolarHBondContact O-OG 2.95Å; V75-S78 VanDerWaalsContact O-OG 3.04Å; S78-L81 PolarHBondContact O-N 3.14Å; S78-V82 WeakPolarHBondContact O-CB 3.47Å; S78-V82 WeakPolarHBondContact O-CG2 3.5Å; S78-V82 PolarHBondContact O-N 3.49Å
79	L	60.8	Low	57	Low	63 Å²	63	83.2 Å²	83.2	33%	0.33	44%	0.435	S	S	.	.	H	α-helix	trans	-66.2	-37.6	175.9	-71.4	172.4	0	0	0	112.8	V75 R76 V82 R83 L110	V75-L79 HydrophobicContact CG1-CD1 3.86Å; V75-L79 HydrophobicContact CG1-CG 4.36Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 VanDerWaalsContact O-CG 3.22Å; V75-L79 WeakPolarHBondContact O-CG 3.32Å; V75-L79 PolarHBondContact O-N 3.5Å; R76-L79 PolarHBondContact O-N 2.71Å; L79-V82 PolarHBondContact O-N 3.14Å; L79-R83 WeakPolarHBondContact O-CB 3.4Å; L79-R83 PolarHBondContact O-N 3.19Å; L79-L110 HydrophobicContact CD1-CD1 3.79Å; L79-L110 HydrophobicContact CD1-CD2 4.46Å; L79-L110 HydrophobicContact CD2-CD1 3.51Å; L79-L110 HydrophobicContact CG-CD1 4.32Å
80	F	60.9	Low	58.1	Low	152 Å²	152	81.9 Å²	81.9	67%	0.667	42%	0.42	S	S	*	.	H	α-helix	trans	-64.3	-44.1	176	-173.8	-94.8	0	0	0	111.6	R76 S77 R83 A84	R76-F80 WeakPolarHBondContact O-CB 3.4Å; R76-F80 PolarHBondContact O-N 2.91Å; S77-F80 PolarHBondContact O-N 2.78Å; F80-R83 PolarHBondContact O-N 3.07Å; F80-A84 WeakPolarHBondContact O-CB 3.08Å; F80-A84 PolarHBondContact O-N 3.49Å
81	L	62.9	Low	59.5	Low	119 Å²	119	86.8 Å²	86.8	62%	0.623	44%	0.435	S	S	*	.	H	α-helix	trans	-63	-42	175.5	-71.6	172.7	0	0	0	112	S77 S78 A84 K85	S77-L81 WeakPolarHBondContact O-CG 3.44Å; S77-L81 PolarHBondContact O-N 3.32Å; S77-L81 VanDerWaalsContact O-N 3.11Å; S78-L81 PolarHBondContact O-N 3.14Å; L81-A84 PolarHBondContact O-N 3.39Å; L81-K85 WeakPolarHBondContact O-CB 3.25Å; L81-K85 PolarHBondContact O-N 3.41Å
82	V	67.1	Low	60.1	Low	41 Å²	41	88.1 Å²	88.1	25%	0.248	44%	0.437	C	S	.	.	H	α-helix	trans	-62.8	-45.1	176.5	171.4	0	0	0	0	110.6	F8 S78 L79 K85 I86	F8-V82 HydrophobicContact CE1-CG2 4.05Å; F8-V82 HydrophobicContact CZ-CG1 4.33Å; F8-V82 HydrophobicContact CZ-CG2 3.7Å; S78-V82 WeakPolarHBondContact O-CB 3.47Å; S78-V82 WeakPolarHBondContact O-CG2 3.5Å; S78-V82 PolarHBondContact O-N 3.49Å; L79-V82 PolarHBondContact O-N 3.14Å; V82-K85 PolarHBondContact O-N 3.39Å; V82-I86 HydrophobicContact CG1-CD1 3.65Å; V82-I86 HydrophobicContact CG1-CG1 4.49Å; V82-I86 WeakPolarHBondContact O-CB 2.99Å; V82-I86 VanDerWaalsContact O-CG1 3.26Å; V82-I86 WeakPolarHBondContact O-CG1 3.16Å; V82-I86 PolarHBondContact O-N 3.32Å
83	R	67.7	Low	60.6	Low	136 Å²	136	92 Å²	92	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-63.3	-45.5	177.8	-168.3	177	-170.6	-176.7	4.2	112.1	L79 F80 K85 I86 Q87	L79-R83 WeakPolarHBondContact O-CB 3.4Å; L79-R83 PolarHBondContact O-N 3.19Å; F80-R83 PolarHBondContact O-N 3.07Å; R83-K85 VanDerWaalsContact C-N 3.32Å; R83-K85 PolarHBondContact O-N 2.89Å; R83-I86 PolarHBondContact O-N 3.12Å; R83-Q87 WeakPolarHBondContact O-CG 3.22Å; R83-Q87 PolarHBondContact O-N 3.46Å
84	A	68.4	Low	61.5	Low	33 Å²	33	96.7 Å²	96.7	27%	0.273	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-41.4	177.1	0	0	0	0	0	111.5	F80 L81 Q87 Q88	F80-A84 WeakPolarHBondContact O-CB 3.08Å; F80-A84 PolarHBondContact O-N 3.49Å; L81-A84 PolarHBondContact O-N 3.39Å; A84-Q87 PolarHBondContact O-N 2.89Å; A84-Q88 WeakPolarHBondContact O-CG 3.39Å; A84-Q88 PolarHBondContact O-N 2.9Å
85	K	63.4	Low	62.1	Low	83 Å²	83	96.2 Å²	96.2	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-70.1	-37.7	179.2	-155	122	-179.2	179	0	112.2	L24 L81 V82 R83 Q88 L89	L24-K85 PolarHBondContact O-NZ 2.75Å; L81-K85 WeakPolarHBondContact O-CB 3.25Å; L81-K85 PolarHBondContact O-N 3.41Å; V82-K85 PolarHBondContact O-N 3.39Å; R83-K85 VanDerWaalsContact C-N 3.32Å; R83-K85 PolarHBondContact O-N 2.89Å; K85-Q88 PolarHBondContact O-N 3.15Å; K85-L89 HydrophobicContact CG-CD1 4.31Å; K85-L89 WeakPolarHBondContact O-CB 3.48Å; K85-L89 VanDerWaalsContact O-CG 3.26Å; K85-L89 WeakPolarHBondContact O-CG 3.31Å; K85-L89 PolarHBondContact O-N 3.33Å
86	I	68.8	Low	62.5	Low	21 Å²	21	97.5 Å²	97.5	11%	0.108	48%	0.475	C	S	.	.	H	α-helix	trans	-64.9	-42	174	-70.9	166.4	0	0	0	110.6	V82 R83 Q88 L89 Q90 L95 H103	V82-I86 HydrophobicContact CG1-CD1 3.65Å; V82-I86 HydrophobicContact CG1-CG1 4.49Å; V82-I86 WeakPolarHBondContact O-CB 2.99Å; V82-I86 VanDerWaalsContact O-CG1 3.26Å; V82-I86 WeakPolarHBondContact O-CG1 3.16Å; V82-I86 PolarHBondContact O-N 3.32Å; R83-I86 PolarHBondContact O-N 3.12Å; I86-Q88 VanDerWaalsContact C-N 3.35Å; I86-Q88 PolarHBondContact O-N 3.29Å; I86-L89 PolarHBondContact O-N 2.97Å; I86-Q90 HydrophobicContact CG2-CG 4.48Å; I86-Q90 WeakPolarHBondContact O-CB 3.45Å; I86-Q90 VanDerWaalsContact O-CG 3.26Å; I86-Q90 WeakPolarHBondContact O-CG 3.22Å; I86-Q90 PolarHBondContact O-N 3.34Å; I86-L95 HydrophobicContact CG2-CD1 4.12Å; I86-L95 VanDerWaalsContact O-CD1 3.31Å; I86-L95 WeakPolarHBondContact O-CD1 3.33Å; I86-H103 HydrophobicContact CD1-CB 3.97Å; I86-H103 WeakPolarHBondContact CD1-CD2 3.49Å
87	Q	66.5	Low	62.8	Low	100 Å²	100	95.8 Å²	95.8	47%	0.467	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-38.7	173.9	-74	179.3	-23.4	0	0	112.5	R83 A84 Q90 K91	R83-Q87 WeakPolarHBondContact O-CG 3.22Å; R83-Q87 PolarHBondContact O-N 3.46Å; A84-Q87 PolarHBondContact O-N 2.89Å; Q87-Q90 PolarHBondContact O-N 3.31Å; Q87-K91 WeakPolarHBondContact O-CG 3.46Å; Q87-K91 PolarHBondContact O-N 3.16Å; Q87-K91 VanDerWaalsContact O-N 3.14Å
88	Q	66.2	Low	62.9	Low	109 Å²	109	96.1 Å²	96.1	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-46.9	175	-77.5	179.7	-24.8	0	0	112	A84 K85 I86 Q90 K91 L92	A84-Q88 WeakPolarHBondContact O-CG 3.39Å; A84-Q88 PolarHBondContact O-N 2.9Å; K85-Q88 PolarHBondContact O-N 3.15Å; I86-Q88 VanDerWaalsContact C-N 3.35Å; I86-Q88 PolarHBondContact O-N 3.29Å; Q88-Q90 VanDerWaalsContact C-N 3.28Å; Q88-Q90 PolarHBondContact O-N 3.32Å; Q88-K91 WeakPolarHBondContact O-CB 3.49Å; Q88-K91 PolarHBondContact O-N 2.94Å; Q88-L92 WeakPolarHBondContact O-CG 3.49Å; Q88-L92 PolarHBondContact O-N 3.16Å; Q88-L92 VanDerWaalsContact O-N 3.08Å
89	L	64.5	Low	62.8	Low	61 Å²	61	95.1 Å²	95.1	32%	0.319	48%	0.477	S	S	.	.	H	α-helix	trans	-70.6	-25.7	-179.7	-62.6	166	0	0	0	112	K85 I86 L92 K93 L94 L95	K85-L89 HydrophobicContact CG-CD1 4.31Å; K85-L89 WeakPolarHBondContact O-CB 3.48Å; K85-L89 VanDerWaalsContact O-CG 3.26Å; K85-L89 WeakPolarHBondContact O-CG 3.31Å; K85-L89 PolarHBondContact O-N 3.33Å; I86-L89 PolarHBondContact O-N 2.97Å; L89-L92 PolarHBondContact O-N 2.91Å; L89-K93 PolarHBondContact O-N 2.93Å; L89-L94 PolarHBondContact O-N 3.48Å; L89-L95 HydrophobicContact CB-CD1 3.52Å; L89-L95 HydrophobicContact CB-CD2 3.93Å; L89-L95 HydrophobicContact CB-CG 3.44Å; L89-L95 VanDerWaalsContact CB-CG 3.44Å; L89-L95 HydrophobicContact CD1-CD2 4Å; L89-L95 HydrophobicContact CD1-CG 4.45Å
90	Q	65.8	Low	62.7	Low	92 Å²	92	93.7 Å²	93.7	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-43.3	170.1	-81.7	178.5	-22.1	0	0	110.8	I86 Q87 Q88 L92 K93 L95 V100	I86-Q90 HydrophobicContact CG2-CG 4.48Å; I86-Q90 WeakPolarHBondContact O-CB 3.45Å; I86-Q90 VanDerWaalsContact O-CG 3.26Å; I86-Q90 WeakPolarHBondContact O-CG 3.22Å; I86-Q90 PolarHBondContact O-N 3.34Å; Q87-Q90 PolarHBondContact O-N 3.31Å; Q88-Q90 VanDerWaalsContact C-N 3.28Å; Q88-Q90 PolarHBondContact O-N 3.32Å; Q90-L92 VanDerWaalsContact C-N 3.28Å; Q90-L92 PolarHBondContact O-N 3.28Å; Q90-K93 PolarHBondContact O-N 3.09Å; Q90-L95 HydrophobicContact CB-CD1 4.38Å; Q90-L95 HydrophobicContact CG-CD1 3.67Å; Q90-V100 HydrophobicContact CG-CG2 4.33Å
91	K	69.6	Low	62.6	Low	183 Å²	183	89.4 Å²	89.4	80%	0.796	46%	0.463	S	S	*	.	H	α-helix	trans	-63.6	-34.1	175.2	-72.7	179.8	178.6	-174.5	0	112.5	Q87 Q88 K93	Q87-K91 WeakPolarHBondContact O-CG 3.46Å; Q87-K91 PolarHBondContact O-N 3.16Å; Q87-K91 VanDerWaalsContact O-N 3.14Å; Q88-K91 WeakPolarHBondContact O-CB 3.49Å; Q88-K91 PolarHBondContact O-N 2.94Å; K91-K93 PolarHBondContact O-N 2.07Å
92	L	63.3	Low	62.5	Low	110 Å²	110	86.2 Å²	86.2	58%	0.576	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	2.7	179	-68.9	169.6	0	0	0	113.9	Q88 L89 Q90 L94	Q88-L92 WeakPolarHBondContact O-CG 3.49Å; Q88-L92 PolarHBondContact O-N 3.16Å; Q88-L92 VanDerWaalsContact O-N 3.08Å; L89-L92 PolarHBondContact O-N 2.91Å; Q90-L92 VanDerWaalsContact C-N 3.28Å; Q90-L92 PolarHBondContact O-N 3.28Å; L92-L94 HydrophobicContact CB-CB 4.21Å; L92-L94 HydrophobicContact CB-CD1 3.92Å; L92-L94 PolarHBondContact O-N 3.4Å
93	K	61.2	Low	62.3	Low	199 Å²	199	85.7 Å²	85.7	87%	0.865	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	18.7	-173.1	-64.4	-176.1	178.7	178	0	114.1	L89 Q90 K91	L89-K93 PolarHBondContact O-N 2.93Å; Q90-K93 PolarHBondContact O-N 3.09Å; K91-K93 PolarHBondContact O-N 2.07Å
94	L	58.8	Low	62.2	Low	125 Å²	125	87 Å²	87	65%	0.654	45%	0.449	S	S	*	.			trans	-93.7	-3.5	-174	-107	131.3	0	0	0	112.7	L89 L92 P96	L89-L94 PolarHBondContact O-N 3.48Å; L92-L94 HydrophobicContact CB-CB 4.21Å; L92-L94 HydrophobicContact CB-CD1 3.92Å; L92-L94 PolarHBondContact O-N 3.4Å; L94-P96 VanDerWaalsContact O-CD 3.23Å; L94-P96 WeakPolarHBondContact O-CD 3.44Å
95	L	57.4	Low	62.1	Low	30 Å²	30	89.7 Å²	89.7	16%	0.157	46%	0.458	C	S	.	.			trans	-90.9	113.5	174.7	-75.2	167.7	0	0	0	110.9	I86 L89 Q90 L97 V99	I86-L95 HydrophobicContact CG2-CD1 4.12Å; I86-L95 VanDerWaalsContact O-CD1 3.31Å; I86-L95 WeakPolarHBondContact O-CD1 3.33Å; L89-L95 HydrophobicContact CB-CD1 3.52Å; L89-L95 HydrophobicContact CB-CD2 3.93Å; L89-L95 HydrophobicContact CB-CG 3.44Å; L89-L95 VanDerWaalsContact CB-CG 3.44Å; L89-L95 HydrophobicContact CD1-CD2 4Å; L89-L95 HydrophobicContact CD1-CG 4.45Å; Q90-L95 HydrophobicContact CB-CD1 4.38Å; Q90-L95 HydrophobicContact CG-CD1 3.67Å; L95-L97 PolarHBondContact O-N 3.18Å; L95-V99 HydrophobicContact CD2-CB 3.54Å; L95-V99 HydrophobicContact CD2-CG1 3.55Å; L95-V99 HydrophobicContact CD2-CG2 3.82Å
96	P	57.7	Low	62.1	Low	86 Å²	86	87.7 Å²	87.7	56%	0.558	45%	0.451	S	S	*	.			trans	-58.4	139.3	159.7	22.7	-28	0	0	0	108.5	L94 A98 V99	L94-P96 VanDerWaalsContact O-CD 3.23Å; L94-P96 WeakPolarHBondContact O-CD 3.44Å; P96-A98 PolarHBondContact O-N 2.92Å; P96-V99 HydrophobicContact CG-CG2 4.34Å; P96-V99 PolarHBondContact O-N 3.27Å
97	L	55.5	Low	61.9	Low	153 Å²	153	90.5 Å²	90.5	80%	0.801	46%	0.464	S	S	*	.	H	α-helix	trans	-45.6	-26.6	-179.7	-74.8	157.7	0	0	0	113.5	L95 V99 V100 A101	L95-L97 PolarHBondContact O-N 3.18Å; L97-V99 VanDerWaalsContact C-N 3.3Å; L97-V99 PolarHBondContact O-N 3.2Å; L97-V100 PolarHBondContact O-N 3.04Å; L97-A101 PolarHBondContact O-N 3.45Å; L97-A101 VanDerWaalsContact O-N 3.08Å
98	A	55.3	Low	61.9	Low	65 Å²	65	94 Å²	94	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-52.3	-40.1	173.1	0	0	0	0	0	113.9	P96 A101 T102	P96-A98 PolarHBondContact O-N 2.92Å; A98-A101 PolarHBondContact O-N 3.47Å; A98-T102 WeakPolarHBondContact O-CG2 3.34Å; A98-T102 PolarHBondContact O-N 3.11Å; A98-T102 VanDerWaalsContact O-N 3.08Å; A98-T102 PolarHBondContact O-OG1 3.43Å
99	V	57.5	Low	61.8	Low	37 Å²	37	94.3 Å²	94.3	22%	0.224	47%	0.472	C	S	.	.	H	α-helix	trans	-76.5	-28.8	-178.1	-173.3	0	0	0	0	112	L95 P96 L97 T102 H103	L95-V99 HydrophobicContact CD2-CB 3.54Å; L95-V99 HydrophobicContact CD2-CG1 3.55Å; L95-V99 HydrophobicContact CD2-CG2 3.82Å; P96-V99 HydrophobicContact CG-CG2 4.34Å; P96-V99 PolarHBondContact O-N 3.27Å; L97-V99 VanDerWaalsContact C-N 3.3Å; L97-V99 PolarHBondContact O-N 3.2Å; V99-T102 WeakPolarHBondContact CA-OG1 3.47Å; V99-T102 PolarHBondContact O-OG1 3.48Å; V99-H103 WeakPolarHBondContact O-CB 3.37Å; V99-H103 PolarHBondContact O-N 3.21Å
100	V	58.1	Low	61.6	Low	33 Å²	33	93.6 Å²	93.6	20%	0.2	47%	0.469	C	S	.	.	H	α-helix	trans	-72.1	-38.2	174.7	-177.7	0	0	0	0	110.5	Q90 L97 H103 R104	Q90-V100 HydrophobicContact CG-CG2 4.33Å; L97-V100 PolarHBondContact O-N 3.04Å; V100-H103 PolarHBondContact O-N 3.3Å; V100-R104 PolarHBondContact O-N 3.1Å; V100-R104 VanDerWaalsContact O-N 3.11Å
101	A	57.9	Low	61.5	Low	61 Å²	61	91.8 Å²	91.8	50%	0.504	47%	0.466	S	S	.	.	H	α-helix	trans	-64.7	-41.8	174.6	0	0	0	0	0	111.8	L97 A98 R104 N105	L97-A101 PolarHBondContact O-N 3.45Å; L97-A101 VanDerWaalsContact O-N 3.08Å; A98-A101 PolarHBondContact O-N 3.47Å; A101-R104 PolarHBondContact O-N 3.1Å; A101-N105 PolarHBondContact O-N 3.33Å; A101-N105 VanDerWaalsContact O-N 3.08Å
102	T	62.5	Low	61	Low	53 Å²	53	87.7 Å²	87.7	33%	0.325	45%	0.453	S	S	.	.	H	α-helix	trans	-67.9	-37.7	176	53.5	0	0	0	0	112.1	A98 V99 R104 N105 I106	A98-T102 WeakPolarHBondContact O-CG2 3.34Å; A98-T102 PolarHBondContact O-N 3.11Å; A98-T102 VanDerWaalsContact O-N 3.08Å; A98-T102 PolarHBondContact O-OG1 3.43Å; V99-T102 WeakPolarHBondContact CA-OG1 3.47Å; V99-T102 PolarHBondContact O-OG1 3.48Å; T102-R104 PolarHBondContact O-N 2.95Å; T102-N105 PolarHBondContact O-N 3.09Å; T102-I106 WeakPolarHBondContact O-CB 3.38Å; T102-I106 VanDerWaalsContact O-CG1 3.22Å; T102-I106 WeakPolarHBondContact O-CG1 3.21Å; T102-I106 PolarHBondContact O-N 3.36Å
103	H	62.4	Low	60.6	Low	30 Å²	30	87.8 Å²	87.8	14%	0.139	45%	0.452	C	S	.	.	H	α-helix	trans	-59	-47.9	173.3	-174.8	-103.1	0	0	0	112.3	I86 V99 V100 N105 I106 E107	I86-H103 HydrophobicContact CD1-CB 3.97Å; I86-H103 WeakPolarHBondContact CD1-CD2 3.49Å; V99-H103 WeakPolarHBondContact O-CB 3.37Å; V99-H103 PolarHBondContact O-N 3.21Å; V100-H103 PolarHBondContact O-N 3.3Å; H103-N105 VanDerWaalsContact C-N 3.29Å; H103-N105 PolarHBondContact O-N 3Å; H103-I106 PolarHBondContact O-N 3.43Å; H103-E107 IonicContact CE1-OE1 3.08Å; H103-E107 PolarHBondContact CE1-OE1 3.15Å; H103-E107 IonicContact CE1-OE2 3.45Å; H103-E107 PolarHBondContact CE1-OE2 3.06Å; H103-E107 IonicContact ND1-OE1 3.86Å; H103-E107 IonicContact ND1-OE2 3.41Å; H103-E107 PolarHBondContact ND1-OE2 3.04Å; H103-E107 IonicContact NE2-OE1 3.83Å; H103-E107 WeakPolarHBondContact O-CB 3.46Å; H103-E107 WeakPolarHBondContact O-CG 3.26Å; H103-E107 PolarHBondContact O-N 3.08Å
104	R	65	Low	60.3	Low	164 Å²	164	85.5 Å²	85.5	62%	0.619	44%	0.442	S	S	*	.	H	α-helix	trans	-61.5	-37	177.1	-75.1	-177.2	174.8	175.6	-0.6	112.3	V100 A101 T102 R108	V100-R104 PolarHBondContact O-N 3.1Å; V100-R104 VanDerWaalsContact O-N 3.11Å; A101-R104 PolarHBondContact O-N 3.1Å; T102-R104 PolarHBondContact O-N 2.95Å; R104-R108 WeakPolarHBondContact O-CG 3.14Å; R104-R108 PolarHBondContact O-N 3.18Å
105	N	66.6	Low	59.9	Low	89 Å²	89	85.4 Å²	85.4	48%	0.476	44%	0.441	S	S	.	.	H	α-helix	trans	-68.5	-42.1	176.7	-166.3	-1.1	0	0	0	111.7	A101 T102 H103 R108 K109	A101-N105 PolarHBondContact O-N 3.33Å; A101-N105 VanDerWaalsContact O-N 3.08Å; T102-N105 PolarHBondContact O-N 3.09Å; H103-N105 VanDerWaalsContact C-N 3.29Å; H103-N105 PolarHBondContact O-N 3Å; N105-R108 PolarHBondContact O-N 3.11Å; N105-K109 PolarHBondContact O-N 2.91Å
106	I	64.2	Low	59.6	Low	40 Å²	40	90 Å²	90	21%	0.205	47%	0.469	C	S	.	.	H	α-helix	trans	-64.7	-42.3	175.5	-66.1	164.6	0	0	0	110.6	I7 T102 H103 R108 K109 L110	I7-I106 HydrophobicContact CG2-CD1 4.19Å; T102-I106 WeakPolarHBondContact O-CB 3.38Å; T102-I106 VanDerWaalsContact O-CG1 3.22Å; T102-I106 WeakPolarHBondContact O-CG1 3.21Å; T102-I106 PolarHBondContact O-N 3.36Å; H103-I106 PolarHBondContact O-N 3.43Å; I106-R108 PolarHBondContact O-N 3.33Å; I106-K109 PolarHBondContact O-N 2.99Å; I106-L110 HydrophobicContact CG2-CD1 3.85Å; I106-L110 HydrophobicContact CG2-CG 4.44Å; I106-L110 WeakPolarHBondContact O-CB 3.25Å; I106-L110 VanDerWaalsContact O-CG 3.31Å; I106-L110 WeakPolarHBondContact O-CG 3.42Å; I106-L110 PolarHBondContact O-N 3.25Å
107	E	63.8	Low	58.9	Low	81 Å²	81	93.7 Å²	93.7	38%	0.379	48%	0.477	S	S	.	.	H	α-helix	trans	-60.6	-42.7	174.9	-77.7	-172.8	140.5	0	0	112.1	H103 L110 S111	H103-E107 IonicContact CE1-OE1 3.08Å; H103-E107 PolarHBondContact CE1-OE1 3.15Å; H103-E107 IonicContact CE1-OE2 3.45Å; H103-E107 PolarHBondContact CE1-OE2 3.06Å; H103-E107 IonicContact ND1-OE1 3.86Å; H103-E107 IonicContact ND1-OE2 3.41Å; H103-E107 PolarHBondContact ND1-OE2 3.04Å; H103-E107 IonicContact NE2-OE1 3.83Å; H103-E107 WeakPolarHBondContact O-CB 3.46Å; H103-E107 WeakPolarHBondContact O-CG 3.26Å; H103-E107 PolarHBondContact O-N 3.08Å; E107-L110 PolarHBondContact O-N 2.91Å; E107-S111 PolarHBondContact O-N 3.44Å; E107-S111 PolarHBondContact O-OG 2.93Å
108	R	66.6	Low	58.4	Low	173 Å²	173	93.7 Å²	93.7	65%	0.653	48%	0.476	S	S	*	.	H	α-helix	trans	-61.7	-47.4	174.1	-75.7	-178.1	-167.7	172	2	112.3	R104 N105 I106 L110 S111 D112	R104-R108 WeakPolarHBondContact O-CG 3.14Å; R104-R108 PolarHBondContact O-N 3.18Å; N105-R108 PolarHBondContact O-N 3.11Å; I106-R108 PolarHBondContact O-N 3.33Å; R108-L110 VanDerWaalsContact C-N 3.25Å; R108-L110 PolarHBondContact O-N 3.5Å; R108-S111 WeakPolarHBondContact CA-OG 3.37Å; R108-S111 PolarHBondContact O-N 3.48Å; R108-S111 VanDerWaalsContact O-N 3.16Å; R108-S111 PolarHBondContact O-OG 3Å; R108-D112 VanDerWaalsContact O-CG 3.28Å; R108-D112 PolarHBondContact O-N 3.34Å
109	K	64.8	Low	57.5	Low	116 Å²	116	104 Å²	104	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-35.4	176.9	-74.1	-170	175.2	-167.4	0	112.5	N105 I106 M113	N105-K109 PolarHBondContact O-N 2.91Å; I106-K109 PolarHBondContact O-N 2.99Å; K109-M113 WeakPolarHBondContact O-CG 3.39Å; K109-M113 PolarHBondContact O-N 3.19Å; K109-M113 VanDerWaalsContact O-N 3.09Å
110	L	60.4	Low	57.5	Low	45 Å²	45	107.3 Å²	107.3	24%	0.236	52%	0.523	C	S	.	.	H	α-helix	trans	-74	-34.2	176.1	-72.8	166.9	0	0	0	112.9	L79 I106 E107 R108 K114	L79-L110 HydrophobicContact CD1-CD1 3.79Å; L79-L110 HydrophobicContact CD1-CD2 4.46Å; L79-L110 HydrophobicContact CD2-CD1 3.51Å; L79-L110 HydrophobicContact CG-CD1 4.32Å; I106-L110 HydrophobicContact CG2-CD1 3.85Å; I106-L110 HydrophobicContact CG2-CG 4.44Å; I106-L110 WeakPolarHBondContact O-CB 3.25Å; I106-L110 VanDerWaalsContact O-CG 3.31Å; I106-L110 WeakPolarHBondContact O-CG 3.42Å; I106-L110 PolarHBondContact O-N 3.25Å; E107-L110 PolarHBondContact O-N 2.91Å; R108-L110 VanDerWaalsContact C-N 3.25Å; R108-L110 PolarHBondContact O-N 3.5Å; L110-K114 WeakPolarHBondContact O-CG 3.33Å; L110-K114 PolarHBondContact O-N 3.21Å; L110-K114 VanDerWaalsContact O-N 3.15Å
111	S	62.4	Low	57.5	Low	54 Å²	54	111.2 Å²	111.2	38%	0.378	54%	0.54	S	S	.	.	H	α-helix	trans	-66.9	-40	172.1	54.8	0	0	0	0	111.4	E107 R108 M113 K114 I115	E107-S111 PolarHBondContact O-N 3.44Å; E107-S111 PolarHBondContact O-OG 2.93Å; R108-S111 WeakPolarHBondContact CA-OG 3.37Å; R108-S111 PolarHBondContact O-N 3.48Å; R108-S111 VanDerWaalsContact O-N 3.16Å; R108-S111 PolarHBondContact O-OG 3Å; S111-M113 VanDerWaalsContact C-N 3.34Å; S111-M113 PolarHBondContact O-N 3.28Å; S111-K114 PolarHBondContact O-N 3.3Å; S111-K114 VanDerWaalsContact O-N 3.12Å; S111-I115 WeakPolarHBondContact O-CG1 3.29Å; S111-I115 PolarHBondContact O-N 3.14Å
112	D	60.8	Low	57.5	Low	98 Å²	98	114 Å²	114	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.2	-67.2	-23.3	0	0	0	110.9	R108 K114 I115	R108-D112 VanDerWaalsContact O-CG 3.28Å; R108-D112 PolarHBondContact O-N 3.34Å; D112-K114 VanDerWaalsContact C-N 3.28Å; D112-K114 PolarHBondContact O-N 3.5Å; D112-I115 PolarHBondContact O-N 2.79Å
113	M	54.5	Low	57.2	Low	111 Å²	111	117.6 Å²	117.6	55%	0.547	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-29.9	174.8	-75.5	-174	-177.2	0	0	113.7	K109 S111 I115	K109-M113 WeakPolarHBondContact O-CG 3.39Å; K109-M113 PolarHBondContact O-N 3.19Å; K109-M113 VanDerWaalsContact O-N 3.09Å; S111-M113 VanDerWaalsContact C-N 3.34Å; S111-M113 PolarHBondContact O-N 3.28Å; M113-I115 VanDerWaalsContact C-N 3.32Å
114	K	54.2	Low	56.9	Low	151 Å²	151	123.1 Å²	123.1	66%	0.657	58%	0.581	S	S	*	*	H	α-helix	trans	-72.2	-24.4	176.6	-79.2	179.3	-180	174.9	0	113	L110 S111 D112 V116	L110-K114 WeakPolarHBondContact O-CG 3.33Å; L110-K114 PolarHBondContact O-N 3.21Å; L110-K114 VanDerWaalsContact O-N 3.15Å; S111-K114 PolarHBondContact O-N 3.3Å; S111-K114 VanDerWaalsContact O-N 3.12Å; D112-K114 VanDerWaalsContact C-N 3.28Å; D112-K114 PolarHBondContact O-N 3.5Å; K114-V116 VanDerWaalsContact C-N 3.31Å
115	I	51.5	Low	56.3	Low	124 Å²	124	120.3 Å²	120.3	64%	0.636	58%	0.578	S	S	*	*	H	α-helix	trans	-78	-18.1	179.8	-64.3	165.9	0	0	0	111.6	S111 D112 M113 K117	S111-I115 WeakPolarHBondContact O-CG1 3.29Å; S111-I115 PolarHBondContact O-N 3.14Å; D112-I115 PolarHBondContact O-N 2.79Å; M113-I115 VanDerWaalsContact C-N 3.32Å; I115-K117 PolarHBondContact O-N 3.43Å; I115-K117 VanDerWaalsContact O-N 3.14Å
116	V	50.1	Low	55.6	Low	125 Å²	125	122.6 Å²	122.6	76%	0.758	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	4.1	180	-171.7	0	0	0	0	113.5	K114	K114-V116 VanDerWaalsContact C-N 3.31Å
117	K	42.6	Very low	54.9	Low	165 Å²	165	128.9 Å²	128.9	72%	0.717	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	22.1	-175.4	-114.9	-177.1	-179.2	-172.8	0	116.5	I115	I115-K117 PolarHBondContact O-N 3.43Å; I115-K117 VanDerWaalsContact O-N 3.14Å
118	I	44.5	Very low	54.2	Low	153 Å²	153	132.9 Å²	132.9	79%	0.785	63%	0.634	S	S	*	*			trans	-119.5	77.4	173.3	-50	175.9	0	0	0	109.1
119	K	37.8	Very low	53	Low	280 Å²	280	129.3 Å²	129.3	100%	1.217	63%	0.633	S	S	*	*			trans	-161.5	0	152.2	-125.6	-178.6	-177.5	-178.5	0	109.4

Retrieved 119 of 119 residues in 59.2 ms (Link to these results)

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