A0A3Q0KEC1_SCHMA Loading...

Transmembrane protein 242

Scaffold protein that participates in the c-ring assembly of mitochondrial ATP synthase (F(1)F(0) ATP synthase or complex V) by facilitating the membrane insertion and oligomer formation of the subunit c/ATP5MC3. Participates in the incorporation of the c-ring into vestigial complexes. Additionally influences the incorporation of subunits MT-ATP6, MT-ATP8, ATP5MJ, and ATP5MK in the ATP synthase.

AlphaFold DB , UniProt , Accession A0A3Q0KEC1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 140 aa.

						>A0A3Q0KEC1_SCHMA|A0A3Q0KEC1
MTEHEDKKNRKIPNYFVLGAFIGISGLSLMAGFTYRISSFKKINPLPFMQAINQDKNMQESGIHFAARALGVATIITTSSLGALSLFMWYIINPVDRNDFNERMRNVFPSRWKIKPSDSHSEIRTFEEFSALINDSVNKK
					

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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	41.3	Very low	45.3	Very low	243 Å²	243	175.2 Å²	175.2	100%	1.197	82%	0.824	S	S	*	*				0	108.2	0	-138.4	116.4	160.2	0	0	105.7	E3	M1-E3 PolarHBondContact O-N 2.82Å
2	T	47.1	Very low	46.3	Very low	131 Å²	131	169.9 Å²	169.9	80%	0.804	80%	0.803	S	S	*	*			trans	-17.1	105.6	-166.9	51.2	0	0	0	0	119.3
3	E	44.8	Very low	47.2	Very low	188 Å²	188	161.8 Å²	161.8	88%	0.879	77%	0.774	S	S	*	*			trans	-81.6	101.4	153.8	-70	-170.6	129.3	0	0	108.7	M1	M1-E3 PolarHBondContact O-N 2.82Å
4	H	51.9	Low	48.8	Very low	171 Å²	171	158.9 Å²	158.9	79%	0.792	77%	0.765	S	S	*	*			trans	-134	92.7	163.6	-91.2	-68.2	0	0	0	108.9
5	E	45.7	Very low	50.2	Low	166 Å²	166	156.7 Å²	156.7	78%	0.776	75%	0.747	S	S	*	*			trans	37.1	94.7	144.2	-56.3	-139.1	151	0	0	117.5	K7	E5-K7 PolarHBondContact O-N 2.99Å
6	D	41.7	Very low	51.6	Low	146 Å²	146	156.6 Å²	156.6	78%	0.781	74%	0.743	S	S	*	*			trans	-57	81.7	155.9	-171.4	0.1	0	0	0	110.2	K8	D6-K8 PolarHBondContact O-N 3.19Å; D6-K8 PolarHBondContact OD1-N 3.16Å
7	K	44	Very low	53.1	Low	183 Å²	183	152.2 Å²	152.2	80%	0.796	73%	0.728	S	S	*	*			trans	-67.9	79.2	156.6	-84.5	-166.9	179.3	179.6	0	107.5	E5 N9	E5-K7 PolarHBondContact O-N 2.99Å; K7-N9 PolarHBondContact O-N 3.26Å
8	K	42	Very low	54.4	Low	167 Å²	167	150.1 Å²	150.1	73%	0.726	72%	0.721	S	S	*	*			trans	-60.2	78	163.6	-171.9	175.4	-177.7	176.8	0	108.5	D6 R10	D6-K8 PolarHBondContact O-N 3.19Å; D6-K8 PolarHBondContact OD1-N 3.16Å; K8-R10 VanDerWaalsContact C-N 3.34Å; K8-R10 PolarHBondContact O-N 2.81Å
9	N	42.5	Very low	55.7	Low	131 Å²	131	144.5 Å²	144.5	70%	0.701	71%	0.707	S	S	*	*			trans	-61.3	99.8	173	-163	-39	0	0	0	105.6	K7 K11	K7-N9 PolarHBondContact O-N 3.26Å; N9-K11 PolarHBondContact O-N 3.35Å
10	R	46.1	Very low	57	Low	219 Å²	219	139.5 Å²	139.5	83%	0.826	69%	0.69	S	S	*	*			trans	-63.5	81	176.5	-68.4	-176.7	-71.3	163.4	-2	107.1	K8 I12	K8-R10 VanDerWaalsContact C-N 3.34Å; K8-R10 PolarHBondContact O-N 2.81Å; R10-I12 VanDerWaalsContact C-N 3.29Å; R10-I12 PolarHBondContact O-N 3.28Å
11	K	51	Low	58.4	Low	182 Å²	182	139.5 Å²	139.5	79%	0.791	69%	0.686	S	S	*	*			trans	-61.5	98.4	170.5	-73.1	-170.6	179	-172.4	0	105.9	N9 P13	N9-K11 PolarHBondContact O-N 3.35Å; K11-P13 WeakPolarHBondContact O-CD 3.45Å; K11-P13 VanDerWaalsContact O-N 3.12Å
12	I	57.4	Low	60.5	Low	112 Å²	112	133 Å²	133	57%	0.574	66%	0.655	S	S	*	*			trans	-54.1	121.4	171.6	-51.2	168.8	0	0	0	104.6	R10 N14 V17	R10-I12 VanDerWaalsContact C-N 3.29Å; R10-I12 PolarHBondContact O-N 3.28Å; I12-N14 PolarHBondContact O-N 2.98Å; I12-V17 HydrophobicContact CG2-CG2 4.31Å
13	P	58	Low	62.3	Low	65 Å²	65	128.6 Å²	128.6	42%	0.422	64%	0.636	S	S	.	*			trans	-57.5	117.7	-175.6	17.2	-27.5	0	0	0	108.6	K11 Y15 F16	K11-P13 WeakPolarHBondContact O-CD 3.45Å; K11-P13 VanDerWaalsContact O-N 3.12Å; P13-Y15 HydrophobicContact CB-CD2 3.34Å; P13-Y15 HydrophobicContact CB-CE2 3.24Å; P13-Y15 HydrophobicContact CB-CG 4.43Å; P13-Y15 HydrophobicContact CG-CD2 4.47Å; P13-Y15 PolarHBondContact O-N 3.25Å; P13-F16 HydrophobicContact CG-CB 4.42Å; P13-F16 WeakPolarHBondContact O-CB 3.38Å; P13-F16 PolarHBondContact O-N 3.44Å
14	N	69.3	Low	64.3	Low	121 Å²	121	125.1 Å²	125.1	65%	0.647	62%	0.622	S	S	*	*	H	α-helix	trans	-51.5	-23.3	-175.1	-75.4	-3.7	0	0	0	113.2	I12 F16 V17 L18	I12-N14 PolarHBondContact O-N 2.98Å; N14-F16 VanDerWaalsContact C-N 3.32Å; N14-F16 PolarHBondContact O-N 3.08Å; N14-V17 PolarHBondContact O-N 2.84Å; N14-L18 WeakPolarHBondContact O-CB 3.32Å; N14-L18 PolarHBondContact O-N 2.86Å
15	Y	69.4	Low	66.1	Low	125 Å²	125	119.4 Å²	119.4	49%	0.49	60%	0.601	S	S	.	*	H	α-helix	trans	-64.4	-32	175	-9.3	-80.3	0	0	0	113	P13 G19	P13-Y15 HydrophobicContact CB-CD2 3.34Å; P13-Y15 HydrophobicContact CB-CE2 3.24Å; P13-Y15 HydrophobicContact CB-CG 4.43Å; P13-Y15 HydrophobicContact CG-CD2 4.47Å; P13-Y15 PolarHBondContact O-N 3.25Å; Y15-G19 PolarHBondContact O-N 3.47Å
16	F	72.8	Confident	68	Low	155 Å²	155	113.2 Å²	113.2	68%	0.68	58%	0.582	S	S	*	*	H	α-helix	trans	-70.7	-40.3	177.6	-162.6	-92.9	0	0	0	111.2	P13 N14 G19 A20	P13-F16 HydrophobicContact CG-CB 4.42Å; P13-F16 WeakPolarHBondContact O-CB 3.38Å; P13-F16 PolarHBondContact O-N 3.44Å; N14-F16 VanDerWaalsContact C-N 3.32Å; N14-F16 PolarHBondContact O-N 3.08Å; F16-G19 PolarHBondContact O-N 2.76Å; F16-A20 WeakPolarHBondContact O-CB 3.39Å; F16-A20 PolarHBondContact O-N 3.42Å
17	V	78	Confident	70.3	Confident	83 Å²	83	112.1 Å²	112.1	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-67.4	-43.1	175.7	-174.5	0	0	0	0	110.5	I12 N14 A20 F21	I12-V17 HydrophobicContact CG2-CG2 4.31Å; N14-V17 PolarHBondContact O-N 2.84Å; V17-A20 PolarHBondContact O-N 3.12Å; V17-F21 WeakPolarHBondContact O-CB 3.22Å; V17-F21 PolarHBondContact O-N 3.28Å
18	L	76.8	Confident	72.5	Confident	114 Å²	114	107.4 Å²	107.4	60%	0.597	57%	0.565	S	S	*	*	H	α-helix	trans	-64.5	-42.6	176.6	-158.8	79.8	0	0	0	111.8	N14 F21 I22	N14-L18 WeakPolarHBondContact O-CB 3.32Å; N14-L18 PolarHBondContact O-N 2.86Å; L18-F21 PolarHBondContact O-N 3.15Å; L18-I22 HydrophobicContact CG-CD1 4.33Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.89Å
19	G	78.4	Confident	74.8	Confident	43 Å²	43	105.8 Å²	105.8	44%	0.443	56%	0.564	S	S	.	*	H	α-helix	trans	-62.9	-42.5	176	0	0	0	0	0	112.4	Y15 F16 G23	Y15-G19 PolarHBondContact O-N 3.47Å; F16-G19 PolarHBondContact O-N 2.76Å; G19-G23 PolarHBondContact O-N 3.4Å
20	A	81	Confident	77.1	Confident	45 Å²	45	105.6 Å²	105.6	37%	0.372	56%	0.56	S	S	.	*	H	α-helix	trans	-62.3	-43.1	173.6	0	0	0	0	0	111.6	F16 V17 G23 I24	F16-A20 WeakPolarHBondContact O-CB 3.39Å; F16-A20 PolarHBondContact O-N 3.42Å; V17-A20 PolarHBondContact O-N 3.12Å; A20-G23 PolarHBondContact O-N 3.1Å; A20-I24 WeakPolarHBondContact O-CB 3.1Å; A20-I24 VanDerWaalsContact O-CD1 3.31Å; A20-I24 WeakPolarHBondContact O-CD1 3.42Å; A20-I24 WeakPolarHBondContact O-CG1 3.45Å; A20-I24 PolarHBondContact O-N 3.4Å
21	F	86.8	Confident	79.3	Confident	140 Å²	140	98.2 Å²	98.2	61%	0.614	55%	0.546	S	S	*	.	H	α-helix	trans	-64.1	-45.8	179.9	-157.5	-92.2	0	0	0	112.2	V17 L18 G23 I24 S25	V17-F21 WeakPolarHBondContact O-CB 3.22Å; V17-F21 PolarHBondContact O-N 3.28Å; L18-F21 PolarHBondContact O-N 3.15Å; F21-G23 VanDerWaalsContact C-N 3.31Å; F21-G23 PolarHBondContact O-N 2.9Å; F21-I24 PolarHBondContact O-N 3.27Å; F21-S25 WeakPolarHBondContact O-CB 3.38Å; F21-S25 PolarHBondContact O-N 2.91Å; F21-S25 PolarHBondContact O-OG 3.03Å
22	I	86.5	Confident	81.2	Confident	107 Å²	107	91.5 Å²	91.5	55%	0.549	53%	0.529	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.4	-67	167.7	0	0	0	110.5	L18 S25 G26	L18-I22 HydrophobicContact CG-CD1 4.33Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.89Å; I22-S25 PolarHBondContact O-N 3.35Å; I22-G26 PolarHBondContact O-N 3.46Å
23	G	84.7	Confident	82.7	Confident	38 Å²	38	91.5 Å²	91.5	39%	0.392	53%	0.525	S	S	.	.	H	α-helix	trans	-60.5	-46.7	176.2	0	0	0	0	0	112.7	G19 A20 F21 G26 L27	G19-G23 PolarHBondContact O-N 3.4Å; A20-G23 PolarHBondContact O-N 3.1Å; F21-G23 VanDerWaalsContact C-N 3.31Å; F21-G23 PolarHBondContact O-N 2.9Å; G23-G26 PolarHBondContact O-N 3.39Å; G23-L27 PolarHBondContact O-N 3.35Å
24	I	86.6	Confident	84.1	Confident	114 Å²	114	92.5 Å²	92.5	59%	0.585	53%	0.53	S	S	*	.	H	α-helix	trans	-66.3	-44.8	179.2	-66.5	157.7	0	0	0	110.9	A20 F21 G26 L27 S28	A20-I24 WeakPolarHBondContact O-CB 3.1Å; A20-I24 VanDerWaalsContact O-CD1 3.31Å; A20-I24 WeakPolarHBondContact O-CD1 3.42Å; A20-I24 WeakPolarHBondContact O-CG1 3.45Å; A20-I24 PolarHBondContact O-N 3.4Å; F21-I24 PolarHBondContact O-N 3.27Å; I24-G26 VanDerWaalsContact C-N 3.32Å; I24-G26 PolarHBondContact O-N 3.45Å; I24-L27 PolarHBondContact O-N 2.84Å; I24-S28 WeakPolarHBondContact O-CB 3.33Å; I24-S28 PolarHBondContact O-N 3.31Å
25	S	88.5	Confident	85.2	Confident	51 Å²	51	94.9 Å²	94.9	36%	0.357	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-40.3	175.3	-68.8	0	0	0	0	112	F21 I22 S28 L29	F21-S25 WeakPolarHBondContact O-CB 3.38Å; F21-S25 PolarHBondContact O-N 2.91Å; F21-S25 PolarHBondContact O-OG 3.03Å; I22-S25 PolarHBondContact O-N 3.35Å; S25-S28 PolarHBondContact O-N 3.16Å; S25-L29 PolarHBondContact O-N 3.47Å
26	G	87	Confident	86.1	Confident	36 Å²	36	98 Å²	98	37%	0.371	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-46.3	175.5	0	0	0	0	0	112.5	I22 G23 I24 S28 L29 M30	I22-G26 PolarHBondContact O-N 3.46Å; G23-G26 PolarHBondContact O-N 3.39Å; I24-G26 VanDerWaalsContact C-N 3.32Å; I24-G26 PolarHBondContact O-N 3.45Å; G26-S28 VanDerWaalsContact C-N 3.35Å; G26-S28 PolarHBondContact O-N 3.32Å; G26-L29 PolarHBondContact O-N 3.02Å; G26-M30 WeakPolarHBondContact O-CB 3.1Å; G26-M30 PolarHBondContact O-N 3.32Å
27	L	90.1	Very high	86.7	Confident	124 Å²	124	94 Å²	94	65%	0.649	53%	0.526	S	S	*	.	H	α-helix	trans	-60.7	-41.8	174.7	-95.5	150.4	0	0	0	112.2	G23 I24 M30 A31	G23-L27 PolarHBondContact O-N 3.35Å; I24-L27 PolarHBondContact O-N 2.84Å; L27-M30 PolarHBondContact O-N 3.48Å; L27-A31 WeakPolarHBondContact O-CB 3.23Å; L27-A31 PolarHBondContact O-N 2.88Å
28	S	90.1	Very high	87.1	Confident	83 Å²	83	92.6 Å²	92.6	58%	0.58	52%	0.521	S	S	*	.	H	α-helix	trans	-63.3	-44.3	177.2	-172.6	0	0	0	0	112	I24 S25 G26 A31 G32	I24-S28 WeakPolarHBondContact O-CB 3.33Å; I24-S28 PolarHBondContact O-N 3.31Å; S25-S28 PolarHBondContact O-N 3.16Å; G26-S28 VanDerWaalsContact C-N 3.35Å; G26-S28 PolarHBondContact O-N 3.32Å; S28-A31 PolarHBondContact O-N 3.4Å; S28-G32 PolarHBondContact O-N 2.93Å
29	L	90.7	Very high	87.5	Confident	134 Å²	134	88.8 Å²	88.8	70%	0.702	50%	0.503	S	S	*	.	H	α-helix	trans	-62	-44	175.4	-96.8	162.1	0	0	0	111.4	S25 G26 G32 F33	S25-L29 PolarHBondContact O-N 3.47Å; G26-L29 PolarHBondContact O-N 3.02Å; L29-G32 PolarHBondContact O-N 2.89Å; L29-F33 WeakPolarHBondContact O-CB 3.43Å; L29-F33 PolarHBondContact O-N 2.7Å
30	M	89.7	Confident	87.7	Confident	127 Å²	127	92.1 Å²	92.1	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-41.5	179.4	-162.5	115.3	69.5	0	0	112.1	G26 L27 F33 T34	G26-M30 WeakPolarHBondContact O-CB 3.1Å; G26-M30 PolarHBondContact O-N 3.32Å; L27-M30 PolarHBondContact O-N 3.48Å; M30-F33 PolarHBondContact O-N 2.98Å; M30-T34 WeakPolarHBondContact O-CB 3.16Å; M30-T34 PolarHBondContact O-N 3.5Å; M30-T34 PolarHBondContact O-OG1 2.94Å
31	A	92.1	Very high	87.7	Confident	63 Å²	63	94.8 Å²	94.8	52%	0.521	51%	0.509	S	S	.	.	H	α-helix	trans	-62.6	-46.2	174.9	0	0	0	0	0	111.3	L27 S28 F33 T34 Y35	L27-A31 WeakPolarHBondContact O-CB 3.23Å; L27-A31 PolarHBondContact O-N 2.88Å; S28-A31 PolarHBondContact O-N 3.4Å; A31-F33 PolarHBondContact O-N 2.83Å; A31-T34 PolarHBondContact O-N 3.45Å; A31-Y35 WeakPolarHBondContact O-CB 3.46Å; A31-Y35 PolarHBondContact O-N 3.48Å
32	G	91.4	Very high	87.4	Confident	42 Å²	42	96.3 Å²	96.3	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-41.9	176.8	0	0	0	0	0	113.1	S28 L29 Y35 R36	S28-G32 PolarHBondContact O-N 2.93Å; L29-G32 PolarHBondContact O-N 2.89Å; G32-Y35 PolarHBondContact O-N 2.86Å; G32-R36 WeakPolarHBondContact O-CB 3.42Å; G32-R36 PolarHBondContact O-N 3.01Å
33	F	88.4	Confident	87.1	Confident	112 Å²	112	97.1 Å²	97.1	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-45.9	177.6	-173.1	-107.5	0	0	0	111.9	L29 M30 A31 Y35 R36 I37	L29-F33 WeakPolarHBondContact O-CB 3.43Å; L29-F33 PolarHBondContact O-N 2.7Å; M30-F33 PolarHBondContact O-N 2.98Å; A31-F33 PolarHBondContact O-N 2.83Å; F33-Y35 PolarHBondContact O-N 2.92Å; F33-R36 PolarHBondContact O-N 3.49Å; F33-I37 HydrophobicContact CD1-CD1 3.81Å; F33-I37 HydrophobicContact CE1-CD1 3.27Å; F33-I37 HydrophobicContact CE1-CG1 4.23Å; F33-I37 HydrophobicContact CE2-CD1 4.46Å; F33-I37 HydrophobicContact CZ-CD1 3.65Å; F33-I37 HydrophobicContact CZ-CG1 4.33Å; F33-I37 PolarHBondContact O-N 3.43Å
34	T	88.7	Confident	86.3	Confident	86 Å²	86	98.7 Å²	98.7	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-62	-43.6	177.2	-56.2	0	0	0	0	111.4	M30 A31 R36 I37 S38	M30-T34 WeakPolarHBondContact O-CB 3.16Å; M30-T34 PolarHBondContact O-N 3.5Å; M30-T34 PolarHBondContact O-OG1 2.94Å; A31-T34 PolarHBondContact O-N 3.45Å; T34-R36 VanDerWaalsContact C-N 3.3Å; T34-R36 PolarHBondContact O-N 3.44Å; T34-I37 PolarHBondContact O-N 3.27Å; T34-S38 WeakPolarHBondContact O-CB 3.47Å; T34-S38 PolarHBondContact O-N 3.24Å
35	Y	91.5	Very high	85.6	Confident	170 Å²	170	96.2 Å²	96.2	67%	0.667	51%	0.51	S	S	*	.	H	α-helix	trans	-59.9	-41.2	175.8	-178.6	-97.9	0	0	0	112	A31 G32 F33 S38 S39	A31-Y35 WeakPolarHBondContact O-CB 3.46Å; A31-Y35 PolarHBondContact O-N 3.48Å; G32-Y35 PolarHBondContact O-N 2.86Å; F33-Y35 PolarHBondContact O-N 2.92Å; Y35-S38 PolarHBondContact O-N 3.43Å; Y35-S39 WeakPolarHBondContact O-CB 3.39Å; Y35-S39 PolarHBondContact O-N 3.29Å; Y35-S39 PolarHBondContact O-OG 3.2Å
36	R	88.7	Confident	84.8	Confident	192 Å²	192	100.4 Å²	100.4	73%	0.725	53%	0.528	S	S	*	.	H	α-helix	trans	-66.8	-43.6	177.5	-176	159.9	-78.7	-167.9	-4.1	112.2	G32 F33 T34 S38 S39 F40	G32-R36 WeakPolarHBondContact O-CB 3.42Å; G32-R36 PolarHBondContact O-N 3.01Å; F33-R36 PolarHBondContact O-N 3.49Å; T34-R36 VanDerWaalsContact C-N 3.3Å; T34-R36 PolarHBondContact O-N 3.44Å; R36-S38 PolarHBondContact O-N 2.83Å; R36-S39 PolarHBondContact O-N 3.48Å; R36-F40 WeakPolarHBondContact O-CB 3.49Å; R36-F40 PolarHBondContact O-N 3.34Å
37	I	86.1	Confident	83.8	Confident	69 Å²	69	100.5 Å²	100.5	35%	0.354	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-45.2	174.5	-68.2	179.2	0	0	0	110.9	F33 T34 S39 F40 K41 F48	F33-I37 HydrophobicContact CD1-CD1 3.81Å; F33-I37 HydrophobicContact CE1-CD1 3.27Å; F33-I37 HydrophobicContact CE1-CG1 4.23Å; F33-I37 HydrophobicContact CE2-CD1 4.46Å; F33-I37 HydrophobicContact CZ-CD1 3.65Å; F33-I37 HydrophobicContact CZ-CG1 4.33Å; F33-I37 PolarHBondContact O-N 3.43Å; T34-I37 PolarHBondContact O-N 3.27Å; I37-S39 PolarHBondContact O-N 3.48Å; I37-F40 PolarHBondContact O-N 2.89Å; I37-K41 WeakPolarHBondContact O-CB 3.34Å; I37-K41 PolarHBondContact O-N 3.16Å; I37-F48 HydrophobicContact CG2-CZ 4.45Å
38	S	84.7	Confident	82.8	Confident	54 Å²	54	97.5 Å²	97.5	38%	0.378	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-46.2	176.8	171.5	0	0	0	0	111.8	T34 Y35 R36 F40 K41 K42	T34-S38 WeakPolarHBondContact O-CB 3.47Å; T34-S38 PolarHBondContact O-N 3.24Å; Y35-S38 PolarHBondContact O-N 3.43Å; R36-S38 PolarHBondContact O-N 2.83Å; S38-F40 VanDerWaalsContact C-N 3.35Å; S38-F40 PolarHBondContact O-N 3.46Å; S38-K41 WeakPolarHBondContact O-CB 3.27Å; S38-K41 PolarHBondContact O-N 2.86Å; S38-K42 WeakPolarHBondContact O-CG 3.21Å; S38-K42 PolarHBondContact O-N 2.89Å
39	S	87	Confident	81.7	Confident	34 Å²	34	98.8 Å²	98.8	24%	0.238	50%	0.502	C	S	.	.	H	α-helix	trans	-63.6	-41.7	177.7	-63	0	0	0	0	111.6	Y35 R36 I37 K41 K42 I43	Y35-S39 WeakPolarHBondContact O-CB 3.39Å; Y35-S39 PolarHBondContact O-N 3.29Å; Y35-S39 PolarHBondContact O-OG 3.2Å; R36-S39 PolarHBondContact O-N 3.48Å; I37-S39 PolarHBondContact O-N 3.48Å; S39-K41 VanDerWaalsContact C-N 3.34Å; S39-K41 PolarHBondContact O-N 3.36Å; S39-K42 WeakPolarHBondContact O-CB 3.33Å; S39-K42 PolarHBondContact O-N 2.96Å; S39-I43 WeakPolarHBondContact O-CG1 3.42Å; S39-I43 PolarHBondContact O-N 2.9Å; S39-I43 VanDerWaalsContact O-N 3.16Å
40	F	82.2	Confident	80.3	Confident	114 Å²	114	98.6 Å²	98.6	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-38.6	176.8	-161.4	-94.5	0	0	0	112.1	R36 I37 S38 K42 I43 N44 F48	R36-F40 WeakPolarHBondContact O-CB 3.49Å; R36-F40 PolarHBondContact O-N 3.34Å; I37-F40 PolarHBondContact O-N 2.89Å; S38-F40 VanDerWaalsContact C-N 3.35Å; S38-F40 PolarHBondContact O-N 3.46Å; F40-K42 VanDerWaalsContact C-N 3.31Å; F40-K42 PolarHBondContact O-N 2.69Å; F40-I43 PolarHBondContact O-N 2.89Å; F40-N44 HydrophobicContact CE1-CB 4.38Å; F40-N44 PolarHBondContact O-N 2.86Å; F40-F48 HydrophobicContact CD1-CE2 4.09Å
41	K	79.5	Confident	79	Confident	101 Å²	101	93.4 Å²	93.4	44%	0.439	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-35.1	173.5	-178.3	177.7	173.3	-175.3	0	112.4	I37 S38 S39 N44 P45 F48	I37-K41 WeakPolarHBondContact O-CB 3.34Å; I37-K41 PolarHBondContact O-N 3.16Å; S38-K41 WeakPolarHBondContact O-CB 3.27Å; S38-K41 PolarHBondContact O-N 2.86Å; S39-K41 VanDerWaalsContact C-N 3.34Å; S39-K41 PolarHBondContact O-N 3.36Å; K41-N44 CarbonylContact O-C 3.55Å; K41-P45 WeakPolarHBondContact O-CA 3.41Å; K41-F48 HydrophobicContact CB-CD2 4.1Å; K41-F48 HydrophobicContact CB-CE2 4.22Å; K41-F48 HydrophobicContact CB-CG 4.36Å; K41-F48 HydrophobicContact CD-CB 4.47Å; K41-F48 HydrophobicContact CD-CD1 4.4Å; K41-F48 HydrophobicContact CD-CG 4.34Å; K41-F48 HydrophobicContact CG-CB 4.14Å; K41-F48 HydrophobicContact CG-CD1 4.44Å; K41-F48 HydrophobicContact CG-CD2 4.1Å; K41-F48 HydrophobicContact CG-CG 3.97Å
42	K	81	Confident	77.7	Confident	171 Å²	171	95.9 Å²	95.9	74%	0.743	48%	0.478	S	S	*	.	H	α-helix	trans	-67.4	-37.7	174.9	-70.2	-178.8	-178.4	-165.4	0	112.3	S38 S39 F40	S38-K42 WeakPolarHBondContact O-CG 3.21Å; S38-K42 PolarHBondContact O-N 2.89Å; S39-K42 WeakPolarHBondContact O-CB 3.33Å; S39-K42 PolarHBondContact O-N 2.96Å; F40-K42 VanDerWaalsContact C-N 3.31Å; F40-K42 PolarHBondContact O-N 2.69Å
43	I	80.5	Confident	76.4	Confident	124 Å²	124	99.6 Å²	99.6	64%	0.636	49%	0.488	S	S	*	.	H	α-helix	trans	-78.4	-41.8	-178	-59.5	162.1	0	0	0	110.9	S39 F40 P45	S39-I43 WeakPolarHBondContact O-CG1 3.42Å; S39-I43 PolarHBondContact O-N 2.9Å; S39-I43 VanDerWaalsContact O-N 3.16Å; F40-I43 PolarHBondContact O-N 2.89Å; I43-P45 WeakPolarHBondContact O-CD 3.41Å
44	N	68.8	Low	74.9	Confident	72 Å²	72	96.8 Å²	96.8	39%	0.385	48%	0.477	S	S	.	.			trans	-124.1	80.8	-178	-69.7	-61.2	0	0	0	110.8	F40 K41 P47	F40-N44 HydrophobicContact CE1-CB 4.38Å; F40-N44 PolarHBondContact O-N 2.86Å; K41-N44 CarbonylContact O-C 3.55Å; N44-P47 HydrophobicContact CB-CG 4.13Å; N44-P47 WeakPolarHBondContact O-CD 3.44Å; N44-P47 WeakPolarHBondContact O-CG 3.43Å
45	P	71.7	Confident	73.2	Confident	61 Å²	61	98.4 Å²	98.4	40%	0.396	48%	0.482	S	S	.	.	H	α-helix	trans	-76.1	-31.4	-176.6	28.7	-34.4	0	0	0	113.3	K41 I43 F48 M49	K41-P45 WeakPolarHBondContact O-CA 3.41Å; I43-P45 WeakPolarHBondContact O-CD 3.41Å; P45-F48 PolarHBondContact O-N 2.83Å; P45-F48 VanDerWaalsContact O-N 3.1Å; P45-M49 PolarHBondContact O-N 3.04Å
46	L	70.9	Confident	71.7	Confident	140 Å²	140	100 Å²	100	73%	0.733	49%	0.492	S	S	*	.	H	α-helix	trans	-49.4	-54.2	-177.6	-80.5	164.6	0	0	0	113.9	F48 M49 Q50	L46-F48 VanDerWaalsContact C-N 3.29Å; L46-F48 PolarHBondContact O-N 3.3Å; L46-M49 PolarHBondContact O-N 2.97Å; L46-Q50 PolarHBondContact O-N 3.19Å; L46-Q50 VanDerWaalsContact O-N 3.15Å
47	P	66.9	Low	70	Confident	38 Å²	38	98.3 Å²	98.3	25%	0.247	50%	0.498	C	S	.	.	H	α-helix	trans	-61.9	-32.9	179.2	18	-30	0	0	0	114	N44 A51 I63	N44-P47 HydrophobicContact CB-CG 4.13Å; N44-P47 WeakPolarHBondContact O-CD 3.44Å; N44-P47 WeakPolarHBondContact O-CG 3.43Å; P47-A51 PolarHBondContact O-N 3.46Å; P47-I63 HydrophobicContact CB-CD1 3.13Å
48	F	69.1	Low	68.3	Low	60 Å²	60	102.1 Å²	102.1	26%	0.263	52%	0.516	S	S	.	.	H	α-helix	trans	-80.6	-36.3	179.9	-77.6	-87	0	0	0	112.9	I37 F40 K41 P45 L46 Q50 A51 I52	I37-F48 HydrophobicContact CG2-CZ 4.45Å; F40-F48 HydrophobicContact CD1-CE2 4.09Å; K41-F48 HydrophobicContact CB-CD2 4.1Å; K41-F48 HydrophobicContact CB-CE2 4.22Å; K41-F48 HydrophobicContact CB-CG 4.36Å; K41-F48 HydrophobicContact CD-CB 4.47Å; K41-F48 HydrophobicContact CD-CD1 4.4Å; K41-F48 HydrophobicContact CD-CG 4.34Å; K41-F48 HydrophobicContact CG-CB 4.14Å; K41-F48 HydrophobicContact CG-CD1 4.44Å; K41-F48 HydrophobicContact CG-CD2 4.1Å; K41-F48 HydrophobicContact CG-CG 3.97Å; P45-F48 PolarHBondContact O-N 2.83Å; P45-F48 VanDerWaalsContact O-N 3.1Å; L46-F48 VanDerWaalsContact C-N 3.29Å; L46-F48 PolarHBondContact O-N 3.3Å; F48-Q50 VanDerWaalsContact C-N 3.31Å; F48-A51 PolarHBondContact O-N 3.46Å; F48-I52 WeakPolarHBondContact O-CG1 3.33Å; F48-I52 PolarHBondContact O-N 3.5Å; F48-I52 VanDerWaalsContact O-N 3.12Å
49	M	65.8	Low	66.9	Low	111 Å²	111	108.7 Å²	108.7	55%	0.547	54%	0.541	S	S	.	.	H	α-helix	trans	-65.8	-37.5	175.8	-75.3	-177.2	66	0	0	111.5	P45 L46 A51 I52 N53	P45-M49 PolarHBondContact O-N 3.04Å; L46-M49 PolarHBondContact O-N 2.97Å; M49-A51 VanDerWaalsContact C-N 3.27Å; M49-A51 PolarHBondContact O-N 3.44Å; M49-I52 PolarHBondContact O-N 2.95Å; M49-N53 WeakPolarHBondContact O-CB 3.37Å; M49-N53 PolarHBondContact O-N 3.34Å
50	Q	62.6	Low	65.4	Low	130 Å²	130	111.7 Å²	111.7	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-68.4	-28.6	176.4	-159.1	160.9	22.9	0	0	112.5	L46 F48	L46-Q50 PolarHBondContact O-N 3.19Å; L46-Q50 VanDerWaalsContact O-N 3.15Å; F48-Q50 VanDerWaalsContact C-N 3.31Å
51	A	62.4	Low	64.7	Low	18 Å²	18	107.2 Å²	107.2	15%	0.149	53%	0.534	C	S	.	.	H	α-helix	trans	-76.3	-27.5	173.1	0	0	0	0	0	113.6	P47 F48 M49 I63 H64	P47-A51 PolarHBondContact O-N 3.46Å; F48-A51 PolarHBondContact O-N 3.46Å; M49-A51 VanDerWaalsContact C-N 3.27Å; M49-A51 PolarHBondContact O-N 3.44Å; A51-I63 HydrophobicContact CB-CB 4.46Å; A51-I63 HydrophobicContact CB-CG2 4.16Å; A51-H64 HydrophobicContact CB-CB 4.41Å
52	I	64.2	Low	64.5	Low	115 Å²	115	105.1 Å²	105.1	59%	0.59	54%	0.541	S	S	*	.	H	α-helix	trans	-87.1	-38.6	-179.2	-65.1	165.1	0	0	0	111.9	F48 M49 Q54	F48-I52 WeakPolarHBondContact O-CG1 3.33Å; F48-I52 PolarHBondContact O-N 3.5Å; F48-I52 VanDerWaalsContact O-N 3.12Å; M49-I52 PolarHBondContact O-N 2.95Å; I52-Q54 PolarHBondContact O-N 2.88Å
53	N	64.3	Low	64.1	Low	120 Å²	120	100.1 Å²	100.1	64%	0.642	52%	0.522	S	S	*	.	S	Bend	trans	-85.1	9.1	-177.8	-70.2	-27.8	0	0	0	113.5	M49 D55	M49-N53 WeakPolarHBondContact O-CB 3.37Å; M49-N53 PolarHBondContact O-N 3.34Å; N53-D55 PolarHBondContact O-N 3.34Å
54	Q	56.8	Low	63.7	Low	52 Å²	52	97 Å²	97	24%	0.243	51%	0.505	C	S	.	.			trans	-74.2	103.5	-175.5	-123	-175	-29.1	0	0	111	I52 Q59 S61	I52-Q54 PolarHBondContact O-N 2.88Å; Q54-Q59 PolarHBondContact NE2-O 2.96Å; Q54-S61 PolarHBondContact OE1-OG 3.41Å
55	D	53.4	Low	64.2	Low	120 Å²	120	100 Å²	100	64%	0.642	51%	0.514	S	S	*	.			trans	-58.4	139	173.9	-156.7	-12	0	0	0	109.9	N53 N57 M58	N53-D55 PolarHBondContact O-N 3.34Å; D55-N57 PolarHBondContact O-N 3.41Å; D55-M58 PolarHBondContact O-N 3Å; D55-M58 VanDerWaalsContact O-N 3.16Å
56	K	58.5	Low	64.9	Low	203 Å²	203	99.6 Å²	99.6	88%	0.883	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-5.3	-166	-66.2	176.3	175.2	175.3	0	114.3
57	N	54.3	Low	65.4	Low	157 Å²	157	95.8 Å²	95.8	84%	0.84	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-1.2	-175.6	-75	-8.9	0	0	0	114.8	D55	D55-N57 PolarHBondContact O-N 3.41Å
58	M	49.5	Very low	66.3	Low	150 Å²	150	101.8 Å²	101.8	74%	0.739	52%	0.523	S	S	*	.	S	Bend	trans	-112.4	132.2	176.4	-109.1	153.9	66.5	0	0	111	D55 E60	D55-M58 PolarHBondContact O-N 3Å; D55-M58 VanDerWaalsContact O-N 3.16Å; M58-E60 PolarHBondContact O-N 3.46Å
59	Q	55.1	Low	67.3	Low	191 Å²	191	101.3 Å²	101.3	89%	0.893	53%	0.53	S	S	*	.			trans	-31.8	117	178.4	-128.4	172.7	7.7	0	0	111.2	Q54 S61	Q54-Q59 PolarHBondContact NE2-O 2.96Å; Q59-S61 PolarHBondContact O-N 2.9Å
60	E	57.1	Low	68.3	Low	97 Å²	97	100.9 Å²	100.9	45%	0.453	53%	0.529	S	S	.	.			trans	-47.7	129.3	-175	-73.3	-170.7	146.6	0	0	110.5	M58 G62 H64	M58-E60 PolarHBondContact O-N 3.46Å; E60-G62 PolarHBondContact O-N 2.95Å; E60-H64 IonicContact OE1-CE1 3.58Å; E60-H64 IonicContact OE1-ND1 3.28Å; E60-H64 PolarHBondContact OE1-ND1 3.39Å
61	S	66.2	Low	69.6	Low	20 Å²	20	96.3 Å²	96.3	14%	0.14	52%	0.517	C	S	.	.			trans	-63.8	140.6	179.3	65	0	0	0	0	106	Q54 Q59 I63 H64 F65	Q54-S61 PolarHBondContact OE1-OG 3.41Å; Q59-S61 PolarHBondContact O-N 2.9Å; S61-I63 PolarHBondContact O-N 2.82Å; S61-H64 PolarHBondContact O-N 3.28Å; S61-H64 PolarHBondContact OG-N 2.85Å; S61-F65 PolarHBondContact O-N 3.43Å; S61-F65 VanDerWaalsContact O-N 3.08Å
62	G	75.6	Confident	70.9	Confident	58 Å²	58	99.5 Å²	99.5	60%	0.598	54%	0.535	S	S	*	.	H	α-helix	trans	-52.8	-23.3	-178.6	0	0	0	0	0	112.9	E60 A66	E60-G62 PolarHBondContact O-N 2.95Å; G62-A66 WeakPolarHBondContact O-CB 3.42Å; G62-A66 PolarHBondContact O-N 2.9Å
63	I	73	Confident	72.2	Confident	65 Å²	65	96.2 Å²	96.2	33%	0.333	53%	0.525	S	S	.	.	H	α-helix	trans	-74.3	-42.2	176.3	-51.3	-169.1	0	0	0	112	P47 A51 S61 A66 A67	P47-I63 HydrophobicContact CB-CD1 3.13Å; A51-I63 HydrophobicContact CB-CB 4.46Å; A51-I63 HydrophobicContact CB-CG2 4.16Å; S61-I63 PolarHBondContact O-N 2.82Å; I63-A66 PolarHBondContact O-N 2.95Å; I63-A67 VanDerWaalsContact O-CB 3.22Å; I63-A67 WeakPolarHBondContact O-CB 3.31Å; I63-A67 PolarHBondContact O-N 3.34Å
64	H	72.1	Confident	73.5	Confident	60 Å²	60	93.8 Å²	93.8	28%	0.278	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-42.8	174.6	-171.5	-104.5	0	0	0	111.1	A51 E60 S61 A67 R68	A51-H64 HydrophobicContact CB-CB 4.41Å; E60-H64 IonicContact OE1-CE1 3.58Å; E60-H64 IonicContact OE1-ND1 3.28Å; E60-H64 PolarHBondContact OE1-ND1 3.39Å; S61-H64 PolarHBondContact O-N 3.28Å; S61-H64 PolarHBondContact OG-N 2.85Å; H64-A67 PolarHBondContact O-N 3.36Å; H64-R68 PolarHBondContact O-N 2.92Å
65	F	79.5	Confident	75.2	Confident	134 Å²	134	97.3 Å²	97.3	59%	0.588	53%	0.533	S	S	*	.	H	α-helix	trans	-60.5	-48.1	174.2	-173.2	-95.8	0	0	0	111.5	S61 A67 R68 A69	S61-F65 PolarHBondContact O-N 3.43Å; S61-F65 VanDerWaalsContact O-N 3.08Å; F65-A67 PolarHBondContact O-N 2.96Å; F65-R68 PolarHBondContact O-N 3.36Å; F65-A69 WeakPolarHBondContact O-CB 3.38Å; F65-A69 PolarHBondContact O-N 3.46Å
66	A	85.9	Confident	77.1	Confident	53 Å²	53	96.4 Å²	96.4	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177.8	0	0	0	0	0	112.6	G62 I63 A69 L70	G62-A66 WeakPolarHBondContact O-CB 3.42Å; G62-A66 PolarHBondContact O-N 2.9Å; I63-A66 PolarHBondContact O-N 2.95Å; A66-A69 PolarHBondContact O-N 2.86Å; A66-L70 VanDerWaalsContact O-CB 3.23Å; A66-L70 WeakPolarHBondContact O-CB 3.37Å; A66-L70 PolarHBondContact O-N 2.94Å
67	A	82.4	Confident	78.8	Confident	60 Å²	60	90.9 Å²	90.9	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-42.9	177.5	0	0	0	0	0	111.6	I63 H64 F65 G71	I63-A67 VanDerWaalsContact O-CB 3.22Å; I63-A67 WeakPolarHBondContact O-CB 3.31Å; I63-A67 PolarHBondContact O-N 3.34Å; H64-A67 PolarHBondContact O-N 3.36Å; F65-A67 PolarHBondContact O-N 2.96Å; A67-G71 PolarHBondContact O-N 2.98Å
68	R	84.6	Confident	80.4	Confident	163 Å²	163	87.8 Å²	87.8	62%	0.615	50%	0.498	S	S	*	.	H	α-helix	trans	-65.4	-44.7	173.5	-98.8	-173.1	168.7	-172.9	-3.6	112.1	H64 F65 L70 G71 V72	H64-R68 PolarHBondContact O-N 2.92Å; F65-R68 PolarHBondContact O-N 3.36Å; R68-L70 VanDerWaalsContact C-N 3.33Å; R68-L70 PolarHBondContact O-N 3.47Å; R68-G71 PolarHBondContact O-N 3.34Å; R68-V72 WeakPolarHBondContact O-CG2 3.46Å; R68-V72 PolarHBondContact O-N 2.88Å
69	A	91.3	Very high	82.5	Confident	51 Å²	51	84.5 Å²	84.5	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-44.6	176.9	0	0	0	0	0	111.4	F65 A66 A73	F65-A69 WeakPolarHBondContact O-CB 3.38Å; F65-A69 PolarHBondContact O-N 3.46Å; A66-A69 PolarHBondContact O-N 2.86Å; A69-A73 WeakPolarHBondContact O-CB 3.4Å; A69-A73 PolarHBondContact O-N 3.15Å
70	L	86.9	Confident	84.3	Confident	101 Å²	101	78.8 Å²	78.8	53%	0.529	47%	0.471	S	S	.	.	H	α-helix	trans	-64.3	-42.1	176.9	-170.3	73.5	0	0	0	111.8	A66 R68 T74	A66-L70 VanDerWaalsContact O-CB 3.23Å; A66-L70 WeakPolarHBondContact O-CB 3.37Å; A66-L70 PolarHBondContact O-N 2.94Å; R68-L70 VanDerWaalsContact C-N 3.33Å; R68-L70 PolarHBondContact O-N 3.47Å; L70-T74 WeakPolarHBondContact O-CB 3.35Å; L70-T74 PolarHBondContact O-N 3.34Å; L70-T74 PolarHBondContact O-OG1 3.35Å
71	G	88.6	Confident	85.9	Confident	34 Å²	34	79.9 Å²	79.9	35%	0.351	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-52.4	176.5	0	0	0	0	0	112.7	A67 R68 T74 I75	A67-G71 PolarHBondContact O-N 2.98Å; R68-G71 PolarHBondContact O-N 3.34Å; G71-T74 PolarHBondContact O-N 2.98Å; G71-I75 WeakPolarHBondContact O-CG1 3.37Å; G71-I75 PolarHBondContact O-N 2.98Å; G71-I75 VanDerWaalsContact O-N 3.16Å
72	V	89.9	Confident	87	Confident	85 Å²	85	80.6 Å²	80.6	52%	0.515	49%	0.49	S	S	.	.	H	α-helix	trans	-65.6	-42	180	177	0	0	0	0	110.9	R68 T74 I75 I76	R68-V72 WeakPolarHBondContact O-CG2 3.46Å; R68-V72 PolarHBondContact O-N 2.88Å; V72-T74 VanDerWaalsContact C-N 3.32Å; V72-T74 PolarHBondContact O-N 3.44Å; V72-I75 PolarHBondContact O-N 3.32Å; V72-I76 HydrophobicContact CG1-CD1 3.64Å; V72-I76 HydrophobicContact CG1-CG1 4.34Å; V72-I76 WeakPolarHBondContact O-CG1 2.98Å; V72-I76 PolarHBondContact O-N 3.45Å
73	A	91.8	Very high	87.8	Confident	47 Å²	47	80.6 Å²	80.6	39%	0.388	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-39.4	176.7	0	0	0	0	0	112.2	A69 T77	A69-A73 WeakPolarHBondContact O-CB 3.4Å; A69-A73 PolarHBondContact O-N 3.15Å; A73-T77 WeakPolarHBondContact O-CB 3.48Å; A73-T77 PolarHBondContact O-N 2.92Å; A73-T77 PolarHBondContact O-OG1 3.48Å
74	T	90.6	Very high	88.6	Confident	69 Å²	69	82.7 Å²	82.7	42%	0.423	50%	0.495	S	S	.	.	H	α-helix	trans	-64.4	-46.7	177.7	-57	0	0	0	0	110.8	L70 G71 V72 I76 T77 T78	L70-T74 WeakPolarHBondContact O-CB 3.35Å; L70-T74 PolarHBondContact O-N 3.34Å; L70-T74 PolarHBondContact O-OG1 3.35Å; G71-T74 PolarHBondContact O-N 2.98Å; V72-T74 VanDerWaalsContact C-N 3.32Å; V72-T74 PolarHBondContact O-N 3.44Å; T74-I76 PolarHBondContact O-N 3.27Å; T74-T77 PolarHBondContact O-N 3.44Å; T74-T78 WeakPolarHBondContact O-CB 3.47Å; T74-T78 PolarHBondContact O-N 3.31Å; T74-T78 PolarHBondContact O-OG1 2.85Å
75	I	92.8	Very high	89.3	Confident	125 Å²	125	83.3 Å²	83.3	64%	0.641	51%	0.507	S	S	*	.	H	α-helix	trans	-61.2	-47.8	179.5	-65.3	168.7	0	0	0	110.9	G71 V72 S79	G71-I75 WeakPolarHBondContact O-CG1 3.37Å; G71-I75 PolarHBondContact O-N 2.98Å; G71-I75 VanDerWaalsContact O-N 3.16Å; V72-I75 PolarHBondContact O-N 3.32Å; I75-S79 WeakPolarHBondContact O-CB 3.49Å; I75-S79 PolarHBondContact O-N 3.49Å
76	I	94.4	Very high	89.6	Confident	101 Å²	101	82.2 Å²	82.2	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-45.8	180	-64.5	169.4	0	0	0	110.2	V72 T74 S79 S80	V72-I76 HydrophobicContact CG1-CD1 3.64Å; V72-I76 HydrophobicContact CG1-CG1 4.34Å; V72-I76 WeakPolarHBondContact O-CG1 2.98Å; V72-I76 PolarHBondContact O-N 3.45Å; T74-I76 PolarHBondContact O-N 3.27Å; I76-S79 PolarHBondContact O-N 2.84Å; I76-S80 WeakPolarHBondContact O-CB 3.31Å; I76-S80 PolarHBondContact O-N 3.4Å
77	T	93.7	Very high	89.7	Confident	88 Å²	88	86.2 Å²	86.2	54%	0.54	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-47.1	-178.4	-56.2	0	0	0	0	111.5	A73 T74 S79 S80 L81	A73-T77 WeakPolarHBondContact O-CB 3.48Å; A73-T77 PolarHBondContact O-N 2.92Å; A73-T77 PolarHBondContact O-OG1 3.48Å; T74-T77 PolarHBondContact O-N 3.44Å; T77-S79 VanDerWaalsContact C-N 3.34Å; T77-S79 PolarHBondContact O-N 3.28Å; T77-S80 PolarHBondContact O-N 2.92Å; T77-L81 VanDerWaalsContact O-CB 3.27Å; T77-L81 WeakPolarHBondContact O-CB 3.43Å; T77-L81 PolarHBondContact O-N 2.85Å
78	T	88.5	Confident	89.7	Confident	92 Å²	92	88.5 Å²	88.5	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-65.2	-39.7	179	-56.3	0	0	0	0	111.2	T74 G82	T74-T78 WeakPolarHBondContact O-CB 3.47Å; T74-T78 PolarHBondContact O-N 3.31Å; T74-T78 PolarHBondContact O-OG1 2.85Å; T78-G82 PolarHBondContact O-N 3.45Å
79	S	93.2	Very high	89.3	Confident	81 Å²	81	86.8 Å²	86.8	57%	0.566	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-47	176	-172.1	0	0	0	0	111.8	I75 I76 T77 L81 G82 A83	I75-S79 WeakPolarHBondContact O-CB 3.49Å; I75-S79 PolarHBondContact O-N 3.49Å; I76-S79 PolarHBondContact O-N 2.84Å; T77-S79 VanDerWaalsContact C-N 3.34Å; T77-S79 PolarHBondContact O-N 3.28Å; S79-L81 PolarHBondContact O-N 2.99Å; S79-G82 PolarHBondContact O-N 3.43Å; S79-A83 WeakPolarHBondContact O-CB 3.39Å; S79-A83 PolarHBondContact O-N 2.89Å
80	S	93.4	Very high	88.7	Confident	70 Å²	70	93.4 Å²	93.4	49%	0.49	53%	0.525	S	S	.	.	H	α-helix	trans	-60.8	-43.7	175.8	-93.9	0	0	0	0	112.2	I76 T77 A83 L84	I76-S80 WeakPolarHBondContact O-CB 3.31Å; I76-S80 PolarHBondContact O-N 3.4Å; T77-S80 PolarHBondContact O-N 2.92Å; S80-A83 PolarHBondContact O-N 3.49Å; S80-L84 WeakPolarHBondContact O-CB 3.2Å; S80-L84 PolarHBondContact O-N 3.26Å
81	L	89.8	Confident	88.3	Confident	120 Å²	120	92.6 Å²	92.6	63%	0.628	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-39.7	179.6	-172.2	65.9	0	0	0	111.6	T77 S79 L84 S85	T77-L81 VanDerWaalsContact O-CB 3.27Å; T77-L81 WeakPolarHBondContact O-CB 3.43Å; T77-L81 PolarHBondContact O-N 2.85Å; S79-L81 PolarHBondContact O-N 2.99Å; L81-L84 PolarHBondContact O-N 2.88Å; L81-S85 WeakPolarHBondContact O-CB 3.49Å; L81-S85 PolarHBondContact O-N 3.3Å
82	G	89	Confident	87.5	Confident	35 Å²	35	92.9 Å²	92.9	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-62.2	-46.1	173.9	0	0	0	0	0	112	T78 S79 S85 L86	T78-G82 PolarHBondContact O-N 3.45Å; S79-G82 PolarHBondContact O-N 3.43Å; G82-S85 PolarHBondContact O-N 2.96Å; G82-L86 WeakPolarHBondContact O-CG 3.48Å; G82-L86 PolarHBondContact O-N 3.23Å
83	A	92.1	Very high	86.3	Confident	58 Å²	58	93.3 Å²	93.3	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-44.5	175.4	0	0	0	0	0	111.8	S79 S80 S85 L86 F87	S79-A83 WeakPolarHBondContact O-CB 3.39Å; S79-A83 PolarHBondContact O-N 2.89Å; S80-A83 PolarHBondContact O-N 3.49Å; A83-S85 VanDerWaalsContact C-N 3.32Å; A83-S85 PolarHBondContact O-N 2.86Å; A83-L86 PolarHBondContact O-N 3.02Å; A83-F87 VanDerWaalsContact O-CB 3.31Å; A83-F87 WeakPolarHBondContact O-CB 3.3Å; A83-F87 PolarHBondContact O-N 2.85Å
84	L	90.6	Very high	84.7	Confident	109 Å²	109	96.2 Å²	96.2	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-60.4	-41.4	175.9	-112.5	162.7	0	0	0	111.9	S80 L81 F87 M88	S80-L84 WeakPolarHBondContact O-CB 3.2Å; S80-L84 PolarHBondContact O-N 3.26Å; L81-L84 PolarHBondContact O-N 2.88Å; L84-F87 PolarHBondContact O-N 2.87Å; L84-M88 WeakPolarHBondContact O-CB 3.31Å; L84-M88 PolarHBondContact O-N 3.41Å
85	S	86	Confident	83.3	Confident	74 Å²	74	95 Å²	95	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-45	177.3	-178.2	0	0	0	0	111.7	L81 G82 A83 F87 M88 W89	L81-S85 WeakPolarHBondContact O-CB 3.49Å; L81-S85 PolarHBondContact O-N 3.3Å; G82-S85 PolarHBondContact O-N 2.96Å; A83-S85 VanDerWaalsContact C-N 3.32Å; A83-S85 PolarHBondContact O-N 2.86Å; S85-F87 VanDerWaalsContact C-N 3.35Å; S85-M88 PolarHBondContact O-N 3.47Å; S85-W89 WeakPolarHBondContact O-CB 3.35Å; S85-W89 PolarHBondContact O-N 2.81Å
86	L	85.1	Confident	81.8	Confident	111 Å²	111	94.6 Å²	94.6	58%	0.581	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-37.7	175.5	-67.7	177.7	0	0	0	112.1	G82 A83 W89 Y90	G82-L86 WeakPolarHBondContact O-CG 3.48Å; G82-L86 PolarHBondContact O-N 3.23Å; A83-L86 PolarHBondContact O-N 3.02Å; L86-W89 HydrophobicContact CD2-CE3 4.09Å; L86-W89 WeakPolarHBondContact O-CB 3.43Å; L86-W89 PolarHBondContact O-N 2.94Å; L86-Y90 PolarHBondContact O-N 3.27Å
87	F	88.2	Confident	80.3	Confident	137 Å²	137	95.9 Å²	95.9	60%	0.601	52%	0.517	S	S	*	.	H	α-helix	trans	-64.1	-44.8	176.9	-163.2	-101.1	0	0	0	111.2	A83 L84 S85 W89 Y90 I91	A83-F87 VanDerWaalsContact O-CB 3.31Å; A83-F87 WeakPolarHBondContact O-CB 3.3Å; A83-F87 PolarHBondContact O-N 2.85Å; L84-F87 PolarHBondContact O-N 2.87Å; S85-F87 VanDerWaalsContact C-N 3.35Å; F87-W89 VanDerWaalsContact C-N 3.3Å; F87-W89 PolarHBondContact O-N 2.98Å; F87-Y90 WeakPolarHBondContact O-CB 3.17Å; F87-Y90 PolarHBondContact O-N 3.39Å; F87-Y90 VanDerWaalsContact O-N 3.15Å; F87-I91 HydrophobicContact CD1-CD1 3.63Å; F87-I91 HydrophobicContact CD1-CG1 4.45Å; F87-I91 HydrophobicContact CE1-CD1 3.48Å; F87-I91 VanDerWaalsContact CE1-CD1 3.48Å; F87-I91 HydrophobicContact CE1-CG1 4.36Å; F87-I91 HydrophobicContact CZ-CD1 4.39Å; F87-I91 WeakPolarHBondContact O-CG1 3.39Å; F87-I91 PolarHBondContact O-N 3.18Å
88	M	83.6	Confident	78.9	Confident	108 Å²	108	97.9 Å²	97.9	53%	0.532	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-39.8	174.8	-153.4	71.7	170.8	0	0	111	L84 S85 Y90 I91 I92	L84-M88 WeakPolarHBondContact O-CB 3.31Å; L84-M88 PolarHBondContact O-N 3.41Å; S85-M88 PolarHBondContact O-N 3.47Å; M88-Y90 VanDerWaalsContact C-N 3.33Å; M88-Y90 PolarHBondContact O-N 3.24Å; M88-I91 PolarHBondContact O-N 2.79Å; M88-I92 HydrophobicContact CG-CD1 3.76Å; M88-I92 WeakPolarHBondContact O-CB 3.44Å; M88-I92 WeakPolarHBondContact O-CD1 3.39Å; M88-I92 WeakPolarHBondContact O-CG1 3.32Å; M88-I92 PolarHBondContact O-N 3Å
89	W	75.1	Confident	77.9	Confident	126 Å²	126	97.2 Å²	97.2	48%	0.477	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-41.5	173.4	178.6	43.5	0	0	0	111.9	S85 L86 F87 I91 I92 N93	S85-W89 WeakPolarHBondContact O-CB 3.35Å; S85-W89 PolarHBondContact O-N 2.81Å; L86-W89 HydrophobicContact CD2-CE3 4.09Å; L86-W89 WeakPolarHBondContact O-CB 3.43Å; L86-W89 PolarHBondContact O-N 2.94Å; F87-W89 VanDerWaalsContact C-N 3.3Å; F87-W89 PolarHBondContact O-N 2.98Å; W89-I91 VanDerWaalsContact C-N 3.33Å; W89-I91 PolarHBondContact O-N 2.86Å; W89-I92 PolarHBondContact O-N 3.04Å; W89-N93 VanDerWaalsContact O-CB 3.31Å; W89-N93 WeakPolarHBondContact O-CB 3.35Å; W89-N93 PolarHBondContact O-N 3.48Å
90	Y	80	Confident	76.8	Confident	190 Å²	190	97 Å²	97	75%	0.745	51%	0.507	S	S	*	.	H	α-helix	trans	-64.7	-35.9	177.6	-155.5	-89.7	0	0	0	112.5	L86 F87 M88 P94	L86-Y90 PolarHBondContact O-N 3.27Å; F87-Y90 WeakPolarHBondContact O-CB 3.17Å; F87-Y90 PolarHBondContact O-N 3.39Å; F87-Y90 VanDerWaalsContact O-N 3.15Å; M88-Y90 VanDerWaalsContact C-N 3.33Å; M88-Y90 PolarHBondContact O-N 3.24Å; Y90-P94 WeakPolarHBondContact O-CD 3.46Å
91	I	78.4	Confident	75.6	Confident	85 Å²	85	98.8 Å²	98.8	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-72.4	-38.1	174.5	-66.8	169.4	0	0	0	111.6	F87 M88 W89 P94	F87-I91 HydrophobicContact CD1-CD1 3.63Å; F87-I91 HydrophobicContact CD1-CG1 4.45Å; F87-I91 HydrophobicContact CE1-CD1 3.48Å; F87-I91 VanDerWaalsContact CE1-CD1 3.48Å; F87-I91 HydrophobicContact CE1-CG1 4.36Å; F87-I91 HydrophobicContact CZ-CD1 4.39Å; F87-I91 WeakPolarHBondContact O-CG1 3.39Å; F87-I91 PolarHBondContact O-N 3.18Å; M88-I91 PolarHBondContact O-N 2.79Å; W89-I91 VanDerWaalsContact C-N 3.33Å; W89-I91 PolarHBondContact O-N 2.86Å; I91-P94 VanDerWaalsContact O-CD 3.3Å; I91-P94 WeakPolarHBondContact O-CD 3.45Å; I91-P94 WeakPolarHBondContact O-CG 3.43Å
92	I	71.6	Confident	74.7	Confident	39 Å²	39	97.9 Å²	97.9	20%	0.2	50%	0.503	C	S	.	.	H	α-helix	trans	-76.5	-32.9	-177.8	-69.8	164.4	0	0	0	111.6	M88 W89 V95 F100	M88-I92 HydrophobicContact CG-CD1 3.76Å; M88-I92 WeakPolarHBondContact O-CB 3.44Å; M88-I92 WeakPolarHBondContact O-CD1 3.39Å; M88-I92 WeakPolarHBondContact O-CG1 3.32Å; M88-I92 PolarHBondContact O-N 3Å; W89-I92 PolarHBondContact O-N 3.04Å; I92-V95 PolarHBondContact O-N 3.5Å; I92-F100 HydrophobicContact CD1-CE2 4.02Å; I92-F100 HydrophobicContact CD1-CZ 4.1Å; I92-F100 HydrophobicContact CG1-CD2 4.36Å; I92-F100 HydrophobicContact CG1-CE2 3.94Å; I92-F100 HydrophobicContact CG2-CD2 4.26Å; I92-F100 HydrophobicContact CG2-CE2 4.48Å; I92-F100 HydrophobicContact CG2-CG 4.48Å
93	N	64.9	Low	73.7	Confident	95 Å²	95	104 Å²	104	51%	0.508	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-36.1	-176.2	-157.7	51.8	0	0	0	115.5	W89 V95	W89-N93 VanDerWaalsContact O-CB 3.31Å; W89-N93 WeakPolarHBondContact O-CB 3.35Å; W89-N93 PolarHBondContact O-N 3.48Å; N93-V95 VanDerWaalsContact C-N 3.35Å
94	P	58.1	Low	72.7	Confident	107 Å²	107	105.4 Å²	105.4	70%	0.695	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.8	172.2	29.3	-35.4	0	0	0	113.9	Y90 I91 D96	Y90-P94 WeakPolarHBondContact O-CD 3.46Å; I91-P94 VanDerWaalsContact O-CD 3.3Å; I91-P94 WeakPolarHBondContact O-CD 3.45Å; I91-P94 WeakPolarHBondContact O-CG 3.43Å; P94-D96 PolarHBondContact O-N 3.3Å
95	V	60.3	Low	71.5	Confident	43 Å²	43	108.1 Å²	108.1	26%	0.261	52%	0.516	S	S	.	.	S	Bend	trans	-82.3	112.6	173.3	-178.9	0	0	0	0	107.1	I92 N93 R97 D99	I92-V95 PolarHBondContact O-N 3.5Å; N93-V95 VanDerWaalsContact C-N 3.35Å; V95-R97 PolarHBondContact O-N 3.05Å; V95-D99 HydrophobicContact CG1-CB 4.26Å
96	D	61.8	Low	70.7	Confident	118 Å²	118	110.5 Å²	110.5	63%	0.631	52%	0.523	S	S	*	.			trans	-45	129.4	-178.4	-161.3	-11.1	0	0	0	110.1	P94 N98 D99 F100	P94-D96 PolarHBondContact O-N 3.3Å; D96-N98 PolarHBondContact O-N 3.21Å; D96-D99 HydrophobicContact CB-CB 4.28Å; D96-D99 WeakPolarHBondContact O-CA 3.42Å; D96-D99 VanDerWaalsContact O-CB 3.27Å; D96-D99 WeakPolarHBondContact O-CB 3.27Å; D96-D99 PolarHBondContact O-N 3.49Å; D96-F100 PolarHBondContact O-N 2.88Å
97	R	62.1	Low	70.1	Confident	128 Å²	128	110.7 Å²	110.7	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-23.2	-166.3	-62.8	-106.9	-90.3	-169.7	-2.1	111.5	V95 N101	V95-R97 PolarHBondContact O-N 3.05Å; R97-N101 PolarHBondContact O-N 2.85Å
98	N	64.7	Low	69.1	Low	129 Å²	129	109.9 Å²	109.9	69%	0.69	53%	0.525	S	S	*	.	H	α-helix	trans	-67.4	-42.1	170.1	-97.8	9.6	0	0	0	112.6	D96 F100 N101 E102	D96-N98 PolarHBondContact O-N 3.21Å; N98-F100 VanDerWaalsContact C-N 3.34Å; N98-F100 PolarHBondContact O-N 3.33Å; N98-N101 PolarHBondContact O-N 2.85Å; N98-E102 PolarHBondContact O-N 3.33Å
99	D	68.1	Low	68.2	Low	79 Å²	79	107.5 Å²	107.5	42%	0.422	52%	0.518	S	S	.	.	H	α-helix	trans	-70.8	-33.2	-175.8	-142	22.2	0	0	0	111.1	V95 D96 E102 R103	V95-D99 HydrophobicContact CG1-CB 4.26Å; D96-D99 HydrophobicContact CB-CB 4.28Å; D96-D99 WeakPolarHBondContact O-CA 3.42Å; D96-D99 VanDerWaalsContact O-CB 3.27Å; D96-D99 WeakPolarHBondContact O-CB 3.27Å; D96-D99 PolarHBondContact O-N 3.49Å; D99-E102 PolarHBondContact O-N 3.36Å; D99-R103 VanDerWaalsContact O-CB 3.3Å; D99-R103 WeakPolarHBondContact O-CB 3.36Å; D99-R103 PolarHBondContact O-N 2.9Å
100	F	68.9	Low	67.5	Low	76 Å²	76	106 Å²	106	33%	0.333	53%	0.526	S	S	.	.	H	α-helix	trans	-67	-41.2	173.3	-167.6	-95.7	0	0	0	112.5	I92 D96 N98 M104	I92-F100 HydrophobicContact CD1-CE2 4.02Å; I92-F100 HydrophobicContact CD1-CZ 4.1Å; I92-F100 HydrophobicContact CG1-CD2 4.36Å; I92-F100 HydrophobicContact CG1-CE2 3.94Å; I92-F100 HydrophobicContact CG2-CD2 4.26Å; I92-F100 HydrophobicContact CG2-CE2 4.48Å; I92-F100 HydrophobicContact CG2-CG 4.48Å; D96-F100 PolarHBondContact O-N 2.88Å; N98-F100 VanDerWaalsContact C-N 3.34Å; N98-F100 PolarHBondContact O-N 3.33Å; F100-M104 HydrophobicContact CD1-CG 3.96Å; F100-M104 HydrophobicContact CE1-CE 3.7Å; F100-M104 HydrophobicContact CE1-CG 3.6Å; F100-M104 HydrophobicContact CE1-SD 4.38Å; F100-M104 HydrophobicContact CZ-CE 4Å; F100-M104 HydrophobicContact CZ-CG 4.06Å; F100-M104 VanDerWaalsContact O-CB 3.29Å; F100-M104 WeakPolarHBondContact O-CB 3.22Å; F100-M104 WeakPolarHBondContact O-CG 3.3Å; F100-M104 PolarHBondContact O-N 2.97Å
101	N	69.6	Low	66.6	Low	108 Å²	108	107.8 Å²	107.8	58%	0.578	53%	0.532	S	S	*	.	H	α-helix	trans	-66.4	-40.9	177.1	-169.1	37	0	0	0	111	R97 N98 R105	R97-N101 PolarHBondContact O-N 2.85Å; N98-N101 PolarHBondContact O-N 2.85Å; N101-R105 VanDerWaalsContact O-CB 3.3Å; N101-R105 WeakPolarHBondContact O-CB 3.42Å; N101-R105 PolarHBondContact O-N 2.87Å
102	E	70	Confident	65.6	Low	101 Å²	101	112.8 Å²	112.8	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-68.3	-40.8	177.7	-167.4	161.6	-160.3	0	0	112.3	N98 D99 R105 N106	N98-E102 PolarHBondContact O-N 3.33Å; D99-E102 PolarHBondContact O-N 3.36Å; E102-R105 PolarHBondContact O-N 3.03Å; E102-N106 PolarHBondContact O-N 3.34Å
103	R	68.6	Low	64.8	Low	162 Å²	162	118.9 Å²	118.9	61%	0.611	57%	0.57	S	S	*	*	H	α-helix	trans	-64.5	-45.6	171.8	-86.4	173.1	165.5	-164.2	-4.1	112.9	D99 R105 N106 V107	D99-R103 VanDerWaalsContact O-CB 3.3Å; D99-R103 WeakPolarHBondContact O-CB 3.36Å; D99-R103 PolarHBondContact O-N 2.9Å; R103-R105 VanDerWaalsContact C-N 3.27Å; R103-R105 PolarHBondContact O-N 3.1Å; R103-N106 CarbonylContact O-C 3.59Å; R103-N106 PolarHBondContact O-N 3.37Å; R103-N106 VanDerWaalsContact O-N 3.1Å; R103-V107 VanDerWaalsContact O-CG2 3.27Å; R103-V107 WeakPolarHBondContact O-CG2 3.29Å; R103-V107 PolarHBondContact O-N 2.94Å
104	M	70.2	Confident	64.2	Low	89 Å²	89	121 Å²	121	44%	0.438	58%	0.58	S	S	.	*	H	α-helix	trans	-56.5	-44.2	173.7	-86.4	-82.5	-131.2	0	0	110.9	F100 N106 V107 F108	F100-M104 HydrophobicContact CD1-CG 3.96Å; F100-M104 HydrophobicContact CE1-CE 3.7Å; F100-M104 HydrophobicContact CE1-CG 3.6Å; F100-M104 HydrophobicContact CE1-SD 4.38Å; F100-M104 HydrophobicContact CZ-CE 4Å; F100-M104 HydrophobicContact CZ-CG 4.06Å; F100-M104 VanDerWaalsContact O-CB 3.29Å; F100-M104 WeakPolarHBondContact O-CB 3.22Å; F100-M104 WeakPolarHBondContact O-CG 3.3Å; F100-M104 PolarHBondContact O-N 2.97Å; M104-N106 VanDerWaalsContact C-N 3.25Å; M104-N106 PolarHBondContact O-N 3.25Å; M104-V107 PolarHBondContact O-N 3.25Å; M104-F108 VanDerWaalsContact O-CD2 3.31Å; M104-F108 WeakPolarHBondContact O-CD2 3.4Å; M104-F108 PolarHBondContact O-N 3.32Å
105	R	66	Low	64	Low	165 Å²	165	123.7 Å²	123.7	62%	0.623	58%	0.581	S	S	*	*	H	α-helix	trans	-64.8	-28.2	178.4	-153.8	176.9	70.8	-169.3	-1.5	113.1	N101 E102 R103	N101-R105 VanDerWaalsContact O-CB 3.3Å; N101-R105 WeakPolarHBondContact O-CB 3.42Å; N101-R105 PolarHBondContact O-N 2.87Å; E102-R105 PolarHBondContact O-N 3.03Å; R103-R105 VanDerWaalsContact C-N 3.27Å; R103-R105 PolarHBondContact O-N 3.1Å
106	N	69	Low	63.6	Low	125 Å²	125	128.3 Å²	128.3	67%	0.668	61%	0.612	S	S	*	*	H	α-helix	trans	-87.3	-23.9	175.9	-80.3	-3.8	0	0	0	114.1	E102 R103 M104	E102-N106 PolarHBondContact O-N 3.34Å; R103-N106 CarbonylContact O-C 3.59Å; R103-N106 PolarHBondContact O-N 3.37Å; R103-N106 VanDerWaalsContact O-N 3.1Å; M104-N106 VanDerWaalsContact C-N 3.25Å; M104-N106 PolarHBondContact O-N 3.25Å
107	V	73.3	Confident	62.9	Low	115 Å²	115	126.4 Å²	126.4	70%	0.697	61%	0.607	S	S	*	*	H	α-helix	trans	-72.8	-32.1	174.4	171.2	0	0	0	0	110.9	R103 M104 P109	R103-V107 VanDerWaalsContact O-CG2 3.27Å; R103-V107 WeakPolarHBondContact O-CG2 3.29Å; R103-V107 PolarHBondContact O-N 2.94Å; M104-V107 PolarHBondContact O-N 3.25Å; V107-P109 VanDerWaalsContact O-CD 3.22Å; V107-P109 WeakPolarHBondContact O-CD 3.46Å
108	F	66.8	Low	62.3	Low	120 Å²	120	127.2 Å²	127.2	53%	0.526	62%	0.621	S	S	.	*	S	Bend	trans	-70.2	115.2	171.3	-80.9	-76.6	0	0	0	110	M104 S110	M104-F108 VanDerWaalsContact O-CD2 3.31Å; M104-F108 WeakPolarHBondContact O-CD2 3.4Å; M104-F108 PolarHBondContact O-N 3.32Å; F108-S110 PolarHBondContact O-N 2.63Å
109	P	64.4	Low	61.6	Low	58 Å²	58	125.9 Å²	125.9	38%	0.377	62%	0.622	S	S	.	*			trans	-60.3	130.7	177.7	23.2	-30.7	0	0	0	108.8	V107 R111 W112	V107-P109 VanDerWaalsContact O-CD 3.22Å; V107-P109 WeakPolarHBondContact O-CD 3.46Å; P109-R111 PolarHBondContact O-N 3.02Å; P109-W112 HydrophobicContact CG-CG 4.34Å; P109-W112 PolarHBondContact O-N 3.27Å
110	S	61.5	Low	60.8	Low	93 Å²	93	131 Å²	131	65%	0.65	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-49.4	-19.7	-179.3	-168.3	0	0	0	0	114.1	F108 W112 K113	F108-S110 PolarHBondContact O-N 2.63Å; S110-W112 PolarHBondContact O-N 2.96Å; S110-K113 WeakPolarHBondContact O-CB 3.26Å; S110-K113 PolarHBondContact O-N 3.49Å
111	R	59.8	Low	60.2	Low	229 Å²	229	132.5 Å²	132.5	86%	0.864	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-61	-16.1	173.2	-61	-163.6	-76	-136.3	1.9	114.8	P109	P109-R111 PolarHBondContact O-N 3.02Å
112	W	58.7	Low	59.6	Low	189 Å²	189	131.7 Å²	131.7	72%	0.716	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-97.9	4.2	-179.6	-69.4	40.6	0	0	0	112.6	P109 S110 I114	P109-W112 HydrophobicContact CG-CG 4.34Å; P109-W112 PolarHBondContact O-N 3.27Å; S110-W112 PolarHBondContact O-N 2.96Å; W112-I114 VanDerWaalsContact C-N 3.33Å; W112-I114 PolarHBondContact O-N 3.04Å
113	K	53	Low	59.3	Low	168 Å²	168	130.9 Å²	130.9	73%	0.73	65%	0.654	S	S	*	*	S	Bend	trans	-64.5	101	162	-75	-177.5	173.4	-176.1	0	107.3	S110 K115	S110-K113 WeakPolarHBondContact O-CB 3.26Å; S110-K113 PolarHBondContact O-N 3.49Å; K113-K115 PolarHBondContact O-N 3.37Å
114	I	54.3	Low	59.1	Low	139 Å²	139	131.3 Å²	131.3	71%	0.713	66%	0.656	S	S	*	*			trans	-51.3	107	170.6	-58	168.6	0	0	0	106	W112	W112-I114 VanDerWaalsContact C-N 3.33Å; W112-I114 PolarHBondContact O-N 3.04Å
115	K	52.3	Low	59.1	Low	163 Å²	163	130.8 Å²	130.8	71%	0.709	66%	0.657	S	S	*	*			trans	-60.4	135.2	164.3	-89.4	-178.3	174.4	-177.2	0	105.5	K113 S117	K113-K115 PolarHBondContact O-N 3.37Å; K115-S117 PolarHBondContact O-N 3.37Å
116	P	52.8	Low	59.5	Low	141 Å²	141	130.5 Å²	130.5	92%	0.916	66%	0.661	S	S	*	*	S	Bend	trans	-68.5	25.1	178	27.8	-33.1	0	0	0	113.7
117	S	47.2	Very low	60.1	Low	77 Å²	77	131.7 Å²	131.7	54%	0.538	66%	0.662	S	S	.	*			trans	-122.4	86.6	177.2	66.5	0	0	0	0	108.9	K115	K115-S117 PolarHBondContact O-N 3.37Å
118	D	48.3	Very low	60.3	Low	145 Å²	145	130.7 Å²	130.7	78%	0.775	65%	0.65	S	S	*	*			trans	174.6	77.4	141.8	-85.1	-17.6	0	0	0	107.9	H120	D118-H120 PolarHBondContact O-N 3.26Å
119	S	51.8	Low	61	Low	102 Å²	102	129.5 Å²	129.5	71%	0.713	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	38.4	-176.5	54.4	0	0	0	0	114.1
120	H	51.2	Low	61.9	Low	185 Å²	185	129.5 Å²	129.5	86%	0.856	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	6.6	-173.6	-127.7	-76.1	0	0	0	115.8	D118	D118-H120 PolarHBondContact O-N 3.26Å
121	S	54.9	Low	62.9	Low	108 Å²	108	127.8 Å²	127.8	76%	0.755	64%	0.638	S	S	*	*	S	Bend	trans	-134.1	6.4	179.6	62.1	0	0	0	0	116.3
122	E	57.2	Low	64	Low	91 Å²	91	121.5 Å²	121.5	43%	0.425	62%	0.621	S	S	.	*			trans	-97.6	104.5	-179	-68.4	179.9	167.5	0	0	110.6	R124	E122-R124 VanDerWaalsContact C-N 3.26Å; E122-R124 HydrophobicContact CB-CG 3.71Å; E122-R124 PolarHBondContact O-N 3.21Å; E122-R124 IonicContact OE2-CZ 3.32Å; E122-R124 VanDerWaalsContact OE2-CZ 3.32Å; E122-R124 IonicContact OE2-NE 2.89Å; E122-R124 PolarHBondContact OE2-NE 3.41Å; E122-R124 IonicContact OE2-NH2 2.85Å; E122-R124 PolarHBondContact OE2-NH2 3.26Å
123	I	63.2	Low	65.3	Low	84 Å²	84	116.4 Å²	116.4	43%	0.431	61%	0.607	S	S	.	*			trans	-63.9	96	153.6	-59.2	-179.7	0	0	0	105.6	E128 F129 L132	I123-E128 HydrophobicContact CG2-CB 4.03Å; I123-F129 HydrophobicContact CD1-CD2 3.92Å; I123-F129 HydrophobicContact CG2-CB 3.6Å; I123-F129 VanDerWaalsContact CG2-N 3.34Å; I123-L132 HydrophobicContact CD1-CD1 3.97Å; I123-L132 HydrophobicContact CG1-CD1 4.25Å
124	R	66	Low	66.9	Low	172 Å²	172	113.6 Å²	113.6	65%	0.649	60%	0.6	S	S	*	*			trans	-83.4	-24.3	-172.3	-76.1	-178.6	166	170.1	-2.7	112.4	E122 E128	E122-R124 VanDerWaalsContact C-N 3.26Å; E122-R124 HydrophobicContact CB-CG 3.71Å; E122-R124 PolarHBondContact O-N 3.21Å; E122-R124 IonicContact OE2-CZ 3.32Å; E122-R124 VanDerWaalsContact OE2-CZ 3.32Å; E122-R124 IonicContact OE2-NE 2.89Å; E122-R124 PolarHBondContact OE2-NE 3.41Å; E122-R124 IonicContact OE2-NH2 2.85Å; E122-R124 PolarHBondContact OE2-NH2 3.26Å; R124-E128 PolarHBondContact N-OE2 2.88Å
125	T	68.7	Low	68.3	Low	77 Å²	77	112 Å²	112	47%	0.472	59%	0.593	S	S	.	*	S	Bend	trans	-134.2	144.8	-173.8	-37	0	0	0	0	109.4	E127 E128 F129	T125-E127 HydrophobicContact CG2-CB 4.42Å; T125-E127 HydrophobicContact CG2-CG 4.31Å; T125-E127 PolarHBondContact O-N 2.9Å; T125-E128 PolarHBondContact O-N 2.78Å; T125-F129 PolarHBondContact O-N 2.89Å
126	F	75.8	Confident	69.7	Low	160 Å²	160	108 Å²	108	70%	0.702	59%	0.585	S	S	*	*	H	α-helix	trans	-55	-26.1	175.6	-165.8	-97.3	0	0	0	112.2	F129 S130	F126-F129 HydrophobicContact CE2-CD1 4.36Å; F126-F129 WeakPolarHBondContact O-CB 3.31Å; F126-F129 PolarHBondContact O-N 2.96Å; F126-S130 WeakPolarHBondContact O-CB 3.27Å; F126-S130 PolarHBondContact O-N 3.39Å
127	E	80.5	Confident	71.1	Confident	149 Å²	149	106 Å²	106	70%	0.696	57%	0.571	S	S	*	*	H	α-helix	trans	-63.2	-44.9	173.7	-60.3	-158.2	174.1	0	0	112.8	T125 F129 S130 A131	T125-E127 HydrophobicContact CG2-CB 4.42Å; T125-E127 HydrophobicContact CG2-CG 4.31Å; T125-E127 PolarHBondContact O-N 2.9Å; E127-F129 VanDerWaalsContact C-N 3.32Å; E127-F129 PolarHBondContact O-N 3.04Å; E127-S130 PolarHBondContact O-N 2.82Å; E127-S130 PolarHBondContact O-OG 2.8Å; E127-A131 WeakPolarHBondContact O-CB 3.3Å; E127-A131 PolarHBondContact O-N 2.7Å
128	E	77.9	Confident	72.6	Confident	94 Å²	94	108.6 Å²	108.6	44%	0.439	58%	0.578	S	S	.	*	H	α-helix	trans	-65.2	-37.2	176.6	-68.5	178.4	159	0	0	111.2	I123 R124 T125 L132	I123-E128 HydrophobicContact CG2-CB 4.03Å; R124-E128 PolarHBondContact N-OE2 2.88Å; T125-E128 PolarHBondContact O-N 2.78Å; E128-L132 WeakPolarHBondContact O-CB 3.37Å; E128-L132 PolarHBondContact O-N 3.29Å
129	F	82.6	Confident	73.6	Confident	95 Å²	95	110.5 Å²	110.5	42%	0.417	58%	0.579	S	S	.	*	H	α-helix	trans	-62.4	-46.9	172.9	-174.9	-116.1	0	0	0	111.1	I123 T125 F126 E127 A131 L132 I133	I123-F129 HydrophobicContact CD1-CD2 3.92Å; I123-F129 HydrophobicContact CG2-CB 3.6Å; I123-F129 VanDerWaalsContact CG2-N 3.34Å; T125-F129 PolarHBondContact O-N 2.89Å; F126-F129 HydrophobicContact CE2-CD1 4.36Å; F126-F129 WeakPolarHBondContact O-CB 3.31Å; F126-F129 PolarHBondContact O-N 2.96Å; E127-F129 VanDerWaalsContact C-N 3.32Å; E127-F129 PolarHBondContact O-N 3.04Å; F129-A131 VanDerWaalsContact C-N 3.34Å; F129-L132 PolarHBondContact O-N 2.95Å; F129-I133 HydrophobicContact CD1-CD1 3.86Å; F129-I133 HydrophobicContact CE1-CD1 3.27Å; F129-I133 HydrophobicContact CE1-CG1 4.34Å; F129-I133 HydrophobicContact CE2-CD1 4.04Å; F129-I133 HydrophobicContact CE2-CG1 4.46Å; F129-I133 HydrophobicContact CG-CD1 4.48Å; F129-I133 HydrophobicContact CZ-CD1 3.38Å; F129-I133 HydrophobicContact CZ-CG1 4.26Å; F129-I133 PolarHBondContact O-N 3.46Å
130	S	81.8	Confident	73.7	Confident	58 Å²	58	117.4 Å²	117.4	41%	0.406	60%	0.597	S	S	.	*	H	α-helix	trans	-67	-37.6	-178.5	87.3	0	0	0	0	111.7	F126 E127 I133 N134	F126-S130 WeakPolarHBondContact O-CB 3.27Å; F126-S130 PolarHBondContact O-N 3.39Å; E127-S130 PolarHBondContact O-N 2.82Å; E127-S130 PolarHBondContact O-OG 2.8Å; S130-I133 PolarHBondContact O-N 3Å; S130-N134 VanDerWaalsContact O-CB 3.26Å; S130-N134 WeakPolarHBondContact O-CB 3.41Å; S130-N134 PolarHBondContact O-N 2.9Å
131	A	83.7	Confident	74.8	Confident	57 Å²	57	114 Å²	114	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-64	-43.2	175.9	0	0	0	0	0	110.6	E127 F129 N134 D135	E127-A131 WeakPolarHBondContact O-CB 3.3Å; E127-A131 PolarHBondContact O-N 2.7Å; F129-A131 VanDerWaalsContact C-N 3.34Å; A131-N134 PolarHBondContact O-N 3.28Å; A131-D135 WeakPolarHBondContact O-CB 3.44Å; A131-D135 PolarHBondContact O-N 2.84Å
132	L	82.5	Confident	75.9	Confident	97 Å²	97	114.3 Å²	114.3	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-61.7	-45.3	174.5	-111.3	154.4	0	0	0	112.3	I123 E128 F129 D135 S136	I123-L132 HydrophobicContact CD1-CD1 3.97Å; I123-L132 HydrophobicContact CG1-CD1 4.25Å; E128-L132 WeakPolarHBondContact O-CB 3.37Å; E128-L132 PolarHBondContact O-N 3.29Å; F129-L132 PolarHBondContact O-N 2.95Å; L132-D135 PolarHBondContact O-N 3.01Å; L132-S136 WeakPolarHBondContact O-CB 3.35Å; L132-S136 PolarHBondContact O-N 2.93Å; L132-S136 PolarHBondContact O-OG 2.7Å
133	I	86.3	Confident	76.9	Confident	82 Å²	82	115.6 Å²	115.6	42%	0.421	58%	0.583	S	S	.	*	H	α-helix	trans	-63.4	-43.3	176.3	-71.9	-178.6	0	0	0	110.9	F129 S130 S136 V137	F129-I133 HydrophobicContact CD1-CD1 3.86Å; F129-I133 HydrophobicContact CE1-CD1 3.27Å; F129-I133 HydrophobicContact CE1-CG1 4.34Å; F129-I133 HydrophobicContact CE2-CD1 4.04Å; F129-I133 HydrophobicContact CE2-CG1 4.46Å; F129-I133 HydrophobicContact CG-CD1 4.48Å; F129-I133 HydrophobicContact CZ-CD1 3.38Å; F129-I133 HydrophobicContact CZ-CG1 4.26Å; F129-I133 PolarHBondContact O-N 3.46Å; S130-I133 PolarHBondContact O-N 3Å; I133-S136 WeakPolarHBondContact O-CB 3.35Å; I133-S136 PolarHBondContact O-N 3.2Å; I133-V137 WeakPolarHBondContact O-CG2 3.49Å; I133-V137 PolarHBondContact O-N 3.18Å
134	N	86.3	Confident	77.7	Confident	110 Å²	110	117.5 Å²	117.5	59%	0.588	59%	0.592	S	S	*	*	H	α-helix	trans	-65.3	-41.6	-179.2	-169.7	52.4	0	0	0	111.7	S130 A131 S136 V137 N138	S130-N134 VanDerWaalsContact O-CB 3.26Å; S130-N134 WeakPolarHBondContact O-CB 3.41Å; S130-N134 PolarHBondContact O-N 2.9Å; A131-N134 PolarHBondContact O-N 3.28Å; N134-S136 VanDerWaalsContact C-N 3.33Å; N134-V137 PolarHBondContact O-N 2.85Å; N134-N138 WeakPolarHBondContact O-CB 3.47Å; N134-N138 PolarHBondContact O-N 2.75Å
135	D	84	Confident	78.4	Confident	105 Å²	105	114.1 Å²	114.1	56%	0.561	59%	0.588	S	S	*	*	H	α-helix	trans	-64.6	-38.8	174.8	-163.6	52.2	0	0	0	111.5	A131 L132 V137 N138 K139	A131-D135 WeakPolarHBondContact O-CB 3.44Å; A131-D135 PolarHBondContact O-N 2.84Å; L132-D135 PolarHBondContact O-N 3.01Å; D135-V137 VanDerWaalsContact C-N 3.29Å; D135-V137 PolarHBondContact O-N 2.89Å; D135-N138 PolarHBondContact O-N 2.9Å; D135-K139 PolarHBondContact O-N 2.81Å
136	S	81.5	Confident	79.1	Confident	79 Å²	79	116.5 Å²	116.5	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-62.2	-34.5	174.6	-52.5	0	0	0	0	113.2	L132 I133 N134	L132-S136 WeakPolarHBondContact O-CB 3.35Å; L132-S136 PolarHBondContact O-N 2.93Å; L132-S136 PolarHBondContact O-OG 2.7Å; I133-S136 WeakPolarHBondContact O-CB 3.35Å; I133-S136 PolarHBondContact O-N 3.2Å; N134-S136 VanDerWaalsContact C-N 3.33Å
137	V	82.4	Confident	79.3	Confident	100 Å²	100	113.4 Å²	113.4	61%	0.606	59%	0.588	S	S	*	*	H	α-helix	trans	-78.9	-35.9	-179.9	167.7	0	0	0	0	111.5	I133 N134 D135	I133-V137 WeakPolarHBondContact O-CG2 3.49Å; I133-V137 PolarHBondContact O-N 3.18Å; N134-V137 PolarHBondContact O-N 2.85Å; D135-V137 VanDerWaalsContact C-N 3.29Å; D135-V137 PolarHBondContact O-N 2.89Å
138	N	77.7	Confident	79.2	Confident	130 Å²	130	110.7 Å²	110.7	70%	0.695	58%	0.58	S	S	*	*	H	α-helix	trans	-81.4	-16.6	-175.9	-154.2	6.8	0	0	0	113.5	N134 D135 K140	N134-N138 WeakPolarHBondContact O-CB 3.47Å; N134-N138 PolarHBondContact O-N 2.75Å; D135-N138 PolarHBondContact O-N 2.9Å; N138-K140 PolarHBondContact O-N 3.47Å
139	K	70.2	Confident	79.3	Confident	185 Å²	185	112.1 Å²	112.1	80%	0.804	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	8.9	177	-130.5	-176.1	-173.5	-172.1	0	114.3	D135	D135-K139 PolarHBondContact O-N 2.81Å
140	K	53.2	Low	79.1	Confident	247 Å²	247	113.6 Å²	113.6	100%	1.074	61%	0.608	S	S	*	*			trans	-121	0	-178.4	-153.7	-170.4	-173.3	-156	0	110.6	N138	N138-K140 PolarHBondContact O-N 3.47Å

Retrieved 140 of 140 residues in 221.3 ms (Link to these results)

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