G4VHC2_SCHMA Loading...

Small acidic protein

AlphaFold DB , UniProt , Accession G4VHC2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 129 aa.

						>G4VHC2_SCHMA|G4VHC2
MENCENDDFKLANVKSPNDWEHADLGSKDRNKKFLKLMGGNPVRDHKGKLVIGENIDSVHGQNKDTSIINKELENQYLQGLEKSMQPNRHHGLGCHANSSSNPVNSLDYANTEKLKQQYKSSFIPEKDS
					

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(Predicted Aligned Error values between residue pairs)

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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	45.8	Very low	52.4	Low	238 Å²	238	165.4 Å²	165.4	100%	1.172	84%	0.835	S	S	*	*				0	93.4	0	-65	179.5	-174	0	0	105
2	E	44.7	Very low	53.3	Low	197 Å²	197	159.3 Å²	159.3	92%	0.921	83%	0.829	S	S	*	*			trans	-73.8	131.5	179.6	-87.9	174	153	0	0	109	C4	E2-C4 PolarHBondContact O-N 2.81Å
3	N	44.4	Very low	54.3	Low	157 Å²	157	156.6 Å²	156.6	84%	0.84	82%	0.816	S	S	*	*			trans	-69.7	117.3	-176.7	-58.6	-45.4	0	0	0	108.6	E5	N3-E5 PolarHBondContact O-N 3.01Å
4	C	42.9	Very low	54.9	Low	119 Å²	119	153.6 Å²	153.6	80%	0.804	81%	0.807	S	S	*	*			trans	-66.1	105.4	163.2	-66.4	0	0	0	0	107.1	E2 N6	E2-C4 PolarHBondContact O-N 2.81Å; C4-N6 PolarHBondContact O-N 2.91Å
5	E	50.3	Low	55.6	Low	178 Å²	178	152.4 Å²	152.4	83%	0.832	79%	0.793	S	S	*	*			trans	-54.2	122.7	170	-107.2	170.7	161.3	0	0	108.3	N3 D7	N3-E5 PolarHBondContact O-N 3.01Å; E5-D7 VanDerWaalsContact C-N 3.27Å; E5-D7 PolarHBondContact O-N 3.38Å
6	N	53.5	Low	56.7	Low	146 Å²	146	147.4 Å²	147.4	78%	0.781	78%	0.775	S	S	*	*			trans	-68.2	93	172.4	-64.6	-51.9	0	0	0	106.6	C4 D8	C4-N6 PolarHBondContact O-N 2.91Å; N6-D8 PolarHBondContact O-N 3.31Å
7	D	56.7	Low	57.7	Low	130 Å²	130	145.6 Å²	145.6	70%	0.695	77%	0.774	S	S	*	*			trans	-61	94.1	165.3	-83	-35.3	0	0	0	107.2	E5 F9	E5-D7 VanDerWaalsContact C-N 3.27Å; E5-D7 PolarHBondContact O-N 3.38Å; D7-F9 HydrophobicContact CB-CE2 4.31Å; D7-F9 VanDerWaalsContact O-CD2 3.24Å; D7-F9 WeakPolarHBondContact O-CD2 3.41Å; D7-F9 PolarHBondContact O-N 3.23Å
8	D	58.6	Low	58.8	Low	150 Å²	150	143.7 Å²	143.7	80%	0.802	76%	0.764	S	S	*	*			trans	-56.8	93.2	167.8	-78.3	-30.3	0	0	0	107.4	N6 K10	N6-D8 PolarHBondContact O-N 3.31Å; D8-K10 PolarHBondContact O-N 3.28Å
9	F	58.8	Low	59.9	Low	185 Å²	185	138.7 Å²	138.7	81%	0.811	74%	0.738	S	S	*	*			trans	-64.5	81.5	171.9	-81.3	-86.1	0	0	0	108.6	D7 L11	D7-F9 HydrophobicContact CB-CE2 4.31Å; D7-F9 VanDerWaalsContact O-CD2 3.24Å; D7-F9 WeakPolarHBondContact O-CD2 3.41Å; D7-F9 PolarHBondContact O-N 3.23Å; F9-L11 PolarHBondContact O-N 3.34Å
10	K	60.1	Low	61.1	Low	165 Å²	165	136.3 Å²	136.3	72%	0.717	72%	0.718	S	S	*	*			trans	-62.9	110.1	176.9	-153.4	175.8	-170.4	176.5	0	107	D8 A12 N13	D8-K10 PolarHBondContact O-N 3.28Å; K10-A12 HydrophobicContact CG-CB 4.28Å; K10-A12 PolarHBondContact O-N 3.49Å; K10-N13 PolarHBondContact O-N 2.99Å
11	L	60.5	Low	62	Low	154 Å²	154	133.5 Å²	133.5	81%	0.806	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-50.3	-25.1	179.1	-67.4	171.9	0	0	0	113.1	F9 N13 V14	F9-L11 PolarHBondContact O-N 3.34Å; L11-N13 PolarHBondContact O-N 3.34Å; L11-N13 VanDerWaalsContact O-N 3.17Å; L11-V14 WeakPolarHBondContact O-CG2 3.38Å; L11-V14 PolarHBondContact O-N 3.27Å; L11-V14 VanDerWaalsContact O-N 3.15Å
12	A	63.3	Low	63.6	Low	93 Å²	93	128.2 Å²	128.2	77%	0.769	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-62.1	-14.2	173.7	0	0	0	0	0	114.9	K10	K10-A12 HydrophobicContact CG-CB 4.28Å; K10-A12 PolarHBondContact O-N 3.49Å
13	N	66.2	Low	65.4	Low	124 Å²	124	119.8 Å²	119.8	66%	0.663	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-99.1	5.1	177.1	-161.2	17.3	0	0	0	113.2	K10 L11 K15	K10-N13 PolarHBondContact O-N 2.99Å; L11-N13 PolarHBondContact O-N 3.34Å; L11-N13 VanDerWaalsContact O-N 3.17Å; N13-K15 PolarHBondContact O-N 3.47Å
14	V	63	Low	67.4	Low	114 Å²	114	118.5 Å²	118.5	69%	0.691	63%	0.631	S	S	*	*			trans	-75.7	93.8	174.7	-177.7	0	0	0	0	108.4	L11 S16	L11-V14 WeakPolarHBondContact O-CG2 3.38Å; L11-V14 PolarHBondContact O-N 3.27Å; L11-V14 VanDerWaalsContact O-N 3.15Å; V14-S16 PolarHBondContact O-N 3Å
15	K	65.6	Low	69.5	Low	136 Å²	136	115.3 Å²	115.3	59%	0.591	61%	0.605	S	S	*	*			trans	-73.5	121.6	174	-64.1	-173	-179.2	-169.8	0	109.3	N13	N13-K15 PolarHBondContact O-N 3.47Å
16	S	73	Confident	71.4	Confident	73 Å²	73	109.9 Å²	109.9	51%	0.51	60%	0.597	S	S	.	*			trans	-63.3	141.6	169.4	173.3	0	0	0	0	109.1	V14 N18 D19	V14-S16 PolarHBondContact O-N 3Å; S16-N18 PolarHBondContact O-N 2.93Å; S16-N18 PolarHBondContact OG-N 3.24Å; S16-D19 WeakPolarHBondContact O-CB 3.47Å; S16-D19 PolarHBondContact O-N 3.38Å
17	P	74.2	Confident	73.1	Confident	116 Å²	116	105.5 Å²	105.5	75%	0.753	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-19.1	175.8	-26.9	34.9	0	0	0	114.3	W20	P17-W20 VanDerWaalsContact O-CZ2 3.23Å; P17-W20 WeakPolarHBondContact O-CZ2 3.5Å
18	N	77.1	Confident	74.6	Confident	111 Å²	111	107.6 Å²	107.6	59%	0.594	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	10	177.9	-160.9	45.5	0	0	0	113.6	S16 W20	S16-N18 PolarHBondContact O-N 2.93Å; S16-N18 PolarHBondContact OG-N 3.24Å; N18-W20 PolarHBondContact O-N 3.41Å; N18-W20 VanDerWaalsContact O-N 3.07Å
19	D	80.2	Confident	76.1	Confident	50 Å²	50	106.1 Å²	106.1	27%	0.267	57%	0.573	S	S	.	*			trans	-86.6	48.5	-175.6	-164	31.2	0	0	0	113.3	S16 E21 H22	S16-D19 WeakPolarHBondContact O-CB 3.47Å; S16-D19 PolarHBondContact O-N 3.38Å; D19-E21 PolarHBondContact O-N 3.24Å; D19-H22 VanDerWaalsContact CG-ND1 3.33Å; D19-H22 PolarHBondContact O-N 2.92Å; D19-H22 IonicContact OD1-CE1 2.78Å; D19-H22 PolarHBondContact OD1-CE1 2.75Å; D19-H22 IonicContact OD1-CG 3.8Å; D19-H22 IonicContact OD1-ND1 3.5Å; D19-H22 PolarHBondContact OD1-ND1 3.46Å; D19-H22 IonicContact OD2-CG 3.31Å; D19-H22 IonicContact OD2-ND1 2.68Å; D19-H22 PolarHBondContact OD2-ND1 3.01Å
20	W	83.3	Confident	77.8	Confident	90 Å²	90	104.5 Å²	104.5	34%	0.341	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-65.9	-22.3	-176.9	-58.5	123.9	0	0	0	113.3	P17 N18 H22 A23 F34 L35 M38	P17-W20 VanDerWaalsContact O-CZ2 3.23Å; P17-W20 WeakPolarHBondContact O-CZ2 3.5Å; N18-W20 PolarHBondContact O-N 3.41Å; N18-W20 VanDerWaalsContact O-N 3.07Å; W20-H22 VanDerWaalsContact C-N 3.3Å; W20-H22 PolarHBondContact O-N 3.45Å; W20-A23 WeakPolarHBondContact O-CB 3.44Å; W20-A23 PolarHBondContact O-N 2.95Å; W20-F34 HydrophobicContact CB-CE1 3.96Å; W20-F34 HydrophobicContact CD2-CE1 4.04Å; W20-F34 HydrophobicContact CD2-CZ 4.02Å; W20-F34 AromaticContact CE3-CE1 3.55Å; W20-F34 HydrophobicContact CE3-CE1 3.55Å; W20-F34 AromaticContact CE3-CZ 3.4Å; W20-F34 HydrophobicContact CE3-CZ 3.4Å; W20-F34 VanDerWaalsContact CE3-CZ 3.4Å; W20-F34 HydrophobicContact CG-CE1 4.24Å; W20-F34 HydrophobicContact CZ3-CE1 4.36Å; W20-F34 AromaticContact CZ3-CZ 3.79Å; W20-F34 HydrophobicContact CZ3-CZ 3.79Å; W20-L35 WeakPolarHBondContact O-CD1 3.3Å; W20-M38 HydrophobicContact CD2-CE 4.36Å; W20-M38 HydrophobicContact CD2-CG 4.42Å; W20-M38 HydrophobicContact CG-CB 4.18Å; W20-M38 HydrophobicContact CG-CG 4.37Å; W20-M38 HydrophobicContact CH2-CE 4.42Å; W20-M38 HydrophobicContact CZ2-CE 3.71Å
21	E	79.3	Confident	79.2	Confident	77 Å²	77	98.5 Å²	98.5	36%	0.36	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-66.4	-30.3	-177.1	-60.1	-176.5	156.9	0	0	112.9	D19 L35 R44	D19-E21 PolarHBondContact O-N 3.24Å; E21-L35 HydrophobicContact CG-CD2 4.21Å; E21-R44 WeakPolarHBondContact OE1-CD 3.12Å; E21-R44 WeakPolarHBondContact OE1-CG 3.31Å
22	H	80.9	Confident	80.4	Confident	127 Å²	127	97 Å²	97	59%	0.588	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-100.9	10.5	-179.7	-55.5	98.2	0	0	0	113.1	D19 W20 D24	D19-H22 VanDerWaalsContact CG-ND1 3.33Å; D19-H22 PolarHBondContact O-N 2.92Å; D19-H22 IonicContact OD1-CE1 2.78Å; D19-H22 PolarHBondContact OD1-CE1 2.75Å; D19-H22 IonicContact OD1-CG 3.8Å; D19-H22 IonicContact OD1-ND1 3.5Å; D19-H22 PolarHBondContact OD1-ND1 3.46Å; D19-H22 IonicContact OD2-CG 3.31Å; D19-H22 IonicContact OD2-ND1 2.68Å; D19-H22 PolarHBondContact OD2-ND1 3.01Å; W20-H22 VanDerWaalsContact C-N 3.3Å; W20-H22 PolarHBondContact O-N 3.45Å; H22-D24 PolarHBondContact O-N 2.79Å; H22-D24 VanDerWaalsContact O-N 3.16Å
23	A	80.9	Confident	81.7	Confident	21 Å²	21	100.5 Å²	100.5	17%	0.174	52%	0.522	C	S	.	.			trans	-69.3	110.5	173.9	0	0	0	0	0	109.9	W20 L25 N31 F34	W20-A23 WeakPolarHBondContact O-CB 3.44Å; W20-A23 PolarHBondContact O-N 2.95Å; A23-L25 PolarHBondContact O-N 3.2Å; A23-N31 PolarHBondContact O-ND2 3.41Å; A23-N31 PolarHBondContact O-OD1 3.25Å; A23-F34 HydrophobicContact CB-CD1 4.35Å; A23-F34 HydrophobicContact CB-CE1 4Å
24	D	86.4	Confident	82.8	Confident	130 Å²	130	97 Å²	97	70%	0.695	50%	0.501	S	S	*	.			trans	-85.3	102.5	173.2	-174.3	16.3	0	0	0	110.6	H22 G26	H22-D24 PolarHBondContact O-N 2.79Å; H22-D24 VanDerWaalsContact O-N 3.16Å; D24-G26 PolarHBondContact OD1-N 3.06Å
25	L	86.9	Confident	83.9	Confident	52 Å²	52	92.2 Å²	92.2	27%	0.272	47%	0.471	S	S	.	.			trans	-100.4	30.8	170.3	-42	172.2	0	0	0	110.2	A23 S27 R30 N31 F34	A23-L25 PolarHBondContact O-N 3.2Å; L25-S27 PolarHBondContact O-N 3.21Å; L25-R30 HydrophobicContact CB-CB 4.41Å; L25-R30 HydrophobicContact CB-CG 3.96Å; L25-R30 HydrophobicContact CD1-CG 4.02Å; L25-R30 PolarHBondContact O-NE 2.94Å; L25-R30 PolarHBondContact O-NH2 3.49Å; L25-N31 VanDerWaalsContact CA-OD1 3.26Å; L25-N31 WeakPolarHBondContact CA-OD1 3.37Å; L25-N31 WeakPolarHBondContact CB-OD1 3.48Å; L25-N31 WeakPolarHBondContact CG-OD1 3.3Å; L25-N31 PolarHBondContact N-OD1 2.94Å; L25-F34 HydrophobicContact CD1-CB 3.47Å; L25-F34 VanDerWaalsContact CD1-CB 3.47Å; L25-F34 HydrophobicContact CD1-CD1 4.1Å; L25-F34 HydrophobicContact CD1-CD2 4.05Å; L25-F34 HydrophobicContact CD1-CG 3.61Å
26	G	90.9	Very high	84.8	Confident	64 Å²	64	94.1 Å²	94.1	66%	0.66	48%	0.48	S	S	*	.	S	Bend	trans	63.3	0.8	167.6	0	0	0	0	0	117.3	D24	D24-G26 PolarHBondContact OD1-N 3.06Å
27	S	89.6	Confident	85.7	Confident	54 Å²	54	97.4 Å²	97.4	38%	0.378	49%	0.491	S	S	.	.	S	Bend	trans	-150.9	134	174.2	170.2	0	0	0	0	110.1	L25 D29 R30 N31	L25-S27 PolarHBondContact O-N 3.21Å; S27-D29 VanDerWaalsContact C-N 3.27Å; S27-D29 PolarHBondContact O-N 2.9Å; S27-D29 PolarHBondContact OG-N 3.16Å; S27-R30 PolarHBondContact O-N 3.45Å; S27-R30 VanDerWaalsContact O-N 3.17Å; S27-N31 PolarHBondContact O-N 2.95Å; S27-N31 PolarHBondContact O-OD1 3.26Å
28	K	88.4	Confident	86.3	Confident	173 Å²	173	95.8 Å²	95.8	75%	0.752	47%	0.474	S	S	*	.	H	α-helix	trans	-59	-39	-179.5	-67.4	-176.5	180	179.3	0	112.1	N31 K32	K28-N31 PolarHBondContact O-N 3.49Å; K28-K32 WeakPolarHBondContact O-CG 3.45Å; K28-K32 PolarHBondContact O-N 3.12Å
29	D	90.6	Very high	86.4	Confident	119 Å²	119	93.6 Å²	93.6	64%	0.636	48%	0.478	S	S	*	.	H	α-helix	trans	-71.4	-36.4	-179.8	-64.8	-36.5	0	0	0	111.7	S27 K32 K33	S27-D29 VanDerWaalsContact C-N 3.27Å; S27-D29 PolarHBondContact O-N 2.9Å; S27-D29 PolarHBondContact OG-N 3.16Å; D29-K32 PolarHBondContact O-N 3.42Å; D29-K33 WeakPolarHBondContact O-CB 3.48Å; D29-K33 PolarHBondContact O-N 3Å
30	R	92.7	Very high	85.9	Confident	152 Å²	152	91.9 Å²	91.9	57%	0.574	47%	0.472	S	S	*	.	H	α-helix	trans	-65.9	-43.7	174.9	-168.1	161.5	66.3	177.5	5.4	111.1	L25 S27 K33 F34	L25-R30 HydrophobicContact CB-CB 4.41Å; L25-R30 HydrophobicContact CB-CG 3.96Å; L25-R30 HydrophobicContact CD1-CG 4.02Å; L25-R30 PolarHBondContact O-NE 2.94Å; L25-R30 PolarHBondContact O-NH2 3.49Å; S27-R30 PolarHBondContact O-N 3.45Å; S27-R30 VanDerWaalsContact O-N 3.17Å; R30-K33 PolarHBondContact O-N 2.98Å; R30-F34 VanDerWaalsContact O-CB 3.31Å; R30-F34 WeakPolarHBondContact O-CB 3.45Å; R30-F34 PolarHBondContact O-N 3.37Å
31	N	90.1	Very high	85.1	Confident	38 Å²	38	92.8 Å²	92.8	20%	0.203	48%	0.484	C	S	.	.	H	α-helix	trans	-61.3	-45.8	175.8	-66.7	-0.8	0	0	0	111.4	A23 L25 S27 K28 K33 F34 L35	A23-N31 PolarHBondContact O-ND2 3.41Å; A23-N31 PolarHBondContact O-OD1 3.25Å; L25-N31 VanDerWaalsContact CA-OD1 3.26Å; L25-N31 WeakPolarHBondContact CA-OD1 3.37Å; L25-N31 WeakPolarHBondContact CB-OD1 3.48Å; L25-N31 WeakPolarHBondContact CG-OD1 3.3Å; L25-N31 PolarHBondContact N-OD1 2.94Å; S27-N31 PolarHBondContact O-N 2.95Å; S27-N31 PolarHBondContact O-OD1 3.26Å; K28-N31 PolarHBondContact O-N 3.49Å; N31-K33 PolarHBondContact O-N 3.3Å; N31-F34 PolarHBondContact O-N 3.2Å; N31-L35 WeakPolarHBondContact O-CD1 3.44Å; N31-L35 PolarHBondContact O-N 3.25Å
32	K	86.4	Confident	84.3	Confident	124 Å²	124	93.4 Å²	93.4	54%	0.539	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-44.3	176.8	-75.1	175.3	-176.7	175.6	0	112.7	K28 D29 F34 L35 K36	K28-K32 WeakPolarHBondContact O-CG 3.45Å; K28-K32 PolarHBondContact O-N 3.12Å; D29-K32 PolarHBondContact O-N 3.42Å; K32-F34 VanDerWaalsContact C-N 3.33Å; K32-L35 PolarHBondContact O-N 3.47Å; K32-K36 WeakPolarHBondContact O-CB 3.23Å; K32-K36 PolarHBondContact O-N 3.14Å
33	K	90.3	Very high	83.5	Confident	166 Å²	166	92.1 Å²	92.1	72%	0.722	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-42.2	177.8	-172.8	176.1	-178.5	178.6	0	111	D29 R30 N31 K36 L37	D29-K33 WeakPolarHBondContact O-CB 3.48Å; D29-K33 PolarHBondContact O-N 3Å; R30-K33 PolarHBondContact O-N 2.98Å; N31-K33 PolarHBondContact O-N 3.3Å; K33-K36 PolarHBondContact O-N 3.29Å; K33-L37 WeakPolarHBondContact O-CB 3.31Å; K33-L37 PolarHBondContact O-N 2.94Å
34	F	89.7	Confident	82.5	Confident	49 Å²	49	99 Å²	99	22%	0.215	52%	0.516	C	S	.	.	H	α-helix	trans	-61.4	-49.8	176	178.1	-102.1	0	0	0	111.8	W20 A23 L25 R30 N31 K32 K36 L37 M38	W20-F34 HydrophobicContact CB-CE1 3.96Å; W20-F34 HydrophobicContact CD2-CE1 4.04Å; W20-F34 HydrophobicContact CD2-CZ 4.02Å; W20-F34 AromaticContact CE3-CE1 3.55Å; W20-F34 HydrophobicContact CE3-CE1 3.55Å; W20-F34 AromaticContact CE3-CZ 3.4Å; W20-F34 HydrophobicContact CE3-CZ 3.4Å; W20-F34 VanDerWaalsContact CE3-CZ 3.4Å; W20-F34 HydrophobicContact CG-CE1 4.24Å; W20-F34 HydrophobicContact CZ3-CE1 4.36Å; W20-F34 AromaticContact CZ3-CZ 3.79Å; W20-F34 HydrophobicContact CZ3-CZ 3.79Å; A23-F34 HydrophobicContact CB-CD1 4.35Å; A23-F34 HydrophobicContact CB-CE1 4Å; L25-F34 HydrophobicContact CD1-CB 3.47Å; L25-F34 VanDerWaalsContact CD1-CB 3.47Å; L25-F34 HydrophobicContact CD1-CD1 4.1Å; L25-F34 HydrophobicContact CD1-CD2 4.05Å; L25-F34 HydrophobicContact CD1-CG 3.61Å; R30-F34 VanDerWaalsContact O-CB 3.31Å; R30-F34 WeakPolarHBondContact O-CB 3.45Å; R30-F34 PolarHBondContact O-N 3.37Å; N31-F34 PolarHBondContact O-N 3.2Å; K32-F34 VanDerWaalsContact C-N 3.33Å; F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.31Å; F34-L37 WeakPolarHBondContact O-CB 3.44Å; F34-L37 PolarHBondContact O-N 3.08Å; F34-L37 VanDerWaalsContact O-N 3.13Å; F34-M38 HydrophobicContact CD1-CG 4.37Å; F34-M38 HydrophobicContact CD2-CG 4.15Å; F34-M38 HydrophobicContact CE1-CG 3.97Å; F34-M38 HydrophobicContact CE2-CG 3.73Å; F34-M38 HydrophobicContact CE2-SD 4.18Å; F34-M38 HydrophobicContact CG-CG 4.45Å; F34-M38 HydrophobicContact CZ-CG 3.63Å; F34-M38 HydrophobicContact CZ-SD 4.38Å; F34-M38 WeakPolarHBondContact O-CG 3.46Å; F34-M38 PolarHBondContact O-N 3.23Å
35	L	86.6	Confident	81.3	Confident	14 Å²	14	97.6 Å²	97.6	7%	0.073	51%	0.509	C	S	.	.	H	α-helix	trans	-55.1	-50.6	174.7	-102.7	71.6	0	0	0	111.2	W20 E21 N31 K32 L37 M38 G39 G40	W20-L35 WeakPolarHBondContact O-CD1 3.3Å; E21-L35 HydrophobicContact CG-CD2 4.21Å; N31-L35 WeakPolarHBondContact O-CD1 3.44Å; N31-L35 PolarHBondContact O-N 3.25Å; K32-L35 PolarHBondContact O-N 3.47Å; L35-L37 VanDerWaalsContact C-N 3.26Å; L35-L37 PolarHBondContact O-N 2.97Å; L35-M38 CarbonylContact O-C 3.56Å; L35-M38 PolarHBondContact O-N 3.26Å; L35-M38 VanDerWaalsContact O-N 3.16Å; L35-G39 PolarHBondContact O-N 3.25Å; L35-G40 CarbonylContact C-O 3.28Å; L35-G40 VanDerWaalsContact C-O 3.28Å; L35-G40 WeakPolarHBondContact O-CA 3.49Å; L35-G40 PolarHBondContact O-N 3.15Å; L35-G40 VanDerWaalsContact O-O 3.12Å
36	K	84.3	Confident	79.9	Confident	177 Å²	177	103 Å²	103	77%	0.77	53%	0.533	S	S	*	.	H	α-helix	trans	-58.2	-39.1	179.1	-174.3	172.3	-177.6	176.1	0	112.3	K32 K33 F34 G39	K32-K36 WeakPolarHBondContact O-CB 3.23Å; K32-K36 PolarHBondContact O-N 3.14Å; K33-K36 PolarHBondContact O-N 3.29Å; F34-K36 VanDerWaalsContact C-N 3.34Å; F34-K36 PolarHBondContact O-N 3.31Å; K36-G39 PolarHBondContact O-N 3.48Å
37	L	90.5	Very high	78.1	Confident	141 Å²	141	108.9 Å²	108.9	74%	0.738	54%	0.54	S	S	*	.	H	α-helix	trans	-68.8	-41.3	178	-178.5	62.8	0	0	0	112.1	K33 F34 L35 G39	K33-L37 WeakPolarHBondContact O-CB 3.31Å; K33-L37 PolarHBondContact O-N 2.94Å; F34-L37 WeakPolarHBondContact O-CB 3.44Å; F34-L37 PolarHBondContact O-N 3.08Å; F34-L37 VanDerWaalsContact O-N 3.13Å; L35-L37 VanDerWaalsContact C-N 3.26Å; L35-L37 PolarHBondContact O-N 2.97Å; L37-G39 PolarHBondContact O-N 3.46Å
38	M	87	Confident	76.5	Confident	83 Å²	83	108.6 Å²	108.6	41%	0.409	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	0.8	178	-61.7	-52.4	-65.4	0	0	113.2	W20 F34 L35 G40	W20-M38 HydrophobicContact CD2-CE 4.36Å; W20-M38 HydrophobicContact CD2-CG 4.42Å; W20-M38 HydrophobicContact CG-CB 4.18Å; W20-M38 HydrophobicContact CG-CG 4.37Å; W20-M38 HydrophobicContact CH2-CE 4.42Å; W20-M38 HydrophobicContact CZ2-CE 3.71Å; F34-M38 HydrophobicContact CD1-CG 4.37Å; F34-M38 HydrophobicContact CD2-CG 4.15Å; F34-M38 HydrophobicContact CE1-CG 3.97Å; F34-M38 HydrophobicContact CE2-CG 3.73Å; F34-M38 HydrophobicContact CE2-SD 4.18Å; F34-M38 HydrophobicContact CG-CG 4.45Å; F34-M38 HydrophobicContact CZ-CG 3.63Å; F34-M38 HydrophobicContact CZ-SD 4.38Å; F34-M38 WeakPolarHBondContact O-CG 3.46Å; F34-M38 PolarHBondContact O-N 3.23Å; L35-M38 CarbonylContact O-C 3.56Å; L35-M38 PolarHBondContact O-N 3.26Å; L35-M38 VanDerWaalsContact O-N 3.16Å; M38-G40 PolarHBondContact O-N 3.49Å
39	G	78.7	Confident	75.4	Confident	65 Å²	65	109.3 Å²	109.3	67%	0.67	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	11.9	-174.8	0	0	0	0	0	114	L35 K36 L37	L35-G39 PolarHBondContact O-N 3.25Å; K36-G39 PolarHBondContact O-N 3.48Å; L37-G39 PolarHBondContact O-N 3.46Å
40	G	71.1	Confident	73.9	Confident	14 Å²	14	111 Å²	111	14%	0.144	56%	0.557	C	S	.	*			trans	-74.4	132	170.8	0	0	0	0	0	110.9	L35 M38	L35-G40 CarbonylContact C-O 3.28Å; L35-G40 VanDerWaalsContact C-O 3.28Å; L35-G40 WeakPolarHBondContact O-CA 3.49Å; L35-G40 PolarHBondContact O-N 3.15Å; L35-G40 VanDerWaalsContact O-O 3.12Å; M38-G40 PolarHBondContact O-N 3.49Å
41	N	65.7	Low	72.3	Confident	109 Å²	109	106.6 Å²	106.6	58%	0.583	55%	0.547	S	S	*	.			trans	-83.7	133.1	172.3	-79.7	-31.6	0	0	0	109.3	V43 R44	N41-V43 PolarHBondContact O-N 3.16Å; N41-V43 VanDerWaalsContact O-N 3.09Å; N41-R44 HydrophobicContact CB-CG 4.03Å
42	P	63.2	Low	70.8	Confident	89 Å²	89	112.8 Å²	112.8	58%	0.578	58%	0.578	S	S	*	*	S	Bend	trans	-60.4	-23.2	179.2	-22	32.3	0	0	0	113.9
43	V	62.9	Low	69.5	Low	101 Å²	101	109.5 Å²	109.5	61%	0.612	58%	0.579	S	S	*	*			trans	-136.4	84.9	179.2	-174	0	0	0	0	105.8	N41 D45	N41-V43 PolarHBondContact O-N 3.16Å; N41-V43 VanDerWaalsContact O-N 3.09Å; V43-D45 WeakPolarHBondContact CG1-OD1 3.49Å; V43-D45 PolarHBondContact O-N 3.08Å
44	R	60.7	Low	68.1	Low	165 Å²	165	108 Å²	108	62%	0.623	58%	0.575	S	S	*	*			trans	-73.4	82.8	155.5	-67.4	-179.1	78.6	-176.9	1.2	105.7	E21 N41 H46	E21-R44 WeakPolarHBondContact OE1-CD 3.12Å; E21-R44 WeakPolarHBondContact OE1-CG 3.31Å; N41-R44 HydrophobicContact CB-CG 4.03Å; R44-H46 VanDerWaalsContact C-N 3.25Å; R44-H46 PolarHBondContact O-N 2.87Å
45	D	61	Low	66.6	Low	100 Å²	100	110 Å²	110	54%	0.535	59%	0.588	S	S	.	*			trans	-54.8	107.1	155.5	-74.8	-24.5	0	0	0	104.1	V43 K47	V43-D45 WeakPolarHBondContact CG1-OD1 3.49Å; V43-D45 PolarHBondContact O-N 3.08Å; D45-K47 HydrophobicContact CB-CD 4.38Å; D45-K47 HydrophobicContact CB-CG 3.68Å; D45-K47 PolarHBondContact O-N 3.18Å; D45-K47 WeakPolarHBondContact OD2-CE 3.16Å
46	H	57.2	Low	65.2	Low	167 Å²	167	115.4 Å²	115.4	77%	0.773	62%	0.616	S	S	*	*			trans	-64.4	76.3	170	45	34.4	0	0	0	106.9	R44 G48	R44-H46 VanDerWaalsContact C-N 3.25Å; R44-H46 PolarHBondContact O-N 2.87Å; H46-G48 PolarHBondContact O-N 2.97Å
47	K	52.8	Low	63.9	Low	186 Å²	186	113.2 Å²	113.2	81%	0.809	61%	0.612	S	S	*	*			trans	-78	78.1	175.4	-62	-152.6	-177.8	-171.5	0	106.3	D45	D45-K47 HydrophobicContact CB-CD 4.38Å; D45-K47 HydrophobicContact CB-CG 3.68Å; D45-K47 PolarHBondContact O-N 3.18Å; D45-K47 WeakPolarHBondContact OD2-CE 3.16Å
48	G	56.7	Low	62.4	Low	49 Å²	49	110.5 Å²	110.5	51%	0.505	61%	0.605	S	S	.	*	S	Bend	trans	161.4	119.1	-178.3	0	0	0	0	0	109.4	H46 L50	H46-G48 PolarHBondContact O-N 2.97Å; G48-L50 PolarHBondContact O-N 3.27Å
49	K	65	Low	61.1	Low	188 Å²	188	112 Å²	112	82%	0.817	62%	0.618	S	S	*	*			trans	-64	105.1	162.5	-176.7	-173.4	179.3	-167	0	105.9	V51	K49-V51 VanDerWaalsContact C-N 3.26Å; K49-V51 HydrophobicContact CB-CG2 4.45Å; K49-V51 HydrophobicContact CD-CG2 3.76Å; K49-V51 HydrophobicContact CG-CG2 3.82Å; K49-V51 PolarHBondContact O-N 3.02Å
50	L	59.7	Low	60.1	Low	155 Å²	155	115.8 Å²	115.8	81%	0.812	62%	0.618	S	S	*	*			trans	-66.3	93.2	169	-72	172.3	0	0	0	107.1	G48 I52	G48-L50 PolarHBondContact O-N 3.27Å; L50-I52 PolarHBondContact O-N 3.27Å; L50-I52 VanDerWaalsContact O-N 3.16Å
51	V	59.1	Low	59.4	Low	59 Å²	59	116.5 Å²	116.5	36%	0.358	63%	0.626	S	S	.	*			trans	-81	93.6	170.1	-169.9	0	0	0	0	107.2	K49 G53 E54	K49-V51 VanDerWaalsContact C-N 3.26Å; K49-V51 HydrophobicContact CB-CG2 4.45Å; K49-V51 HydrophobicContact CD-CG2 3.76Å; K49-V51 HydrophobicContact CG-CG2 3.82Å; K49-V51 PolarHBondContact O-N 3.02Å; V51-G53 PolarHBondContact O-N 3.18Å; V51-G53 VanDerWaalsContact O-N 3.16Å; V51-E54 HydrophobicContact CB-CG 4.17Å; V51-E54 HydrophobicContact CG1-CB 4.32Å; V51-E54 HydrophobicContact CG1-CG 3.61Å; V51-E54 WeakPolarHBondContact CG1-OE1 3.42Å
52	I	59	Low	59.1	Low	168 Å²	168	118.7 Å²	118.7	86%	0.862	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	106.3	173.8	-56.7	171.5	0	0	0	106.6	L50	L50-I52 PolarHBondContact O-N 3.27Å; L50-I52 VanDerWaalsContact O-N 3.16Å
53	G	59	Low	58.9	Low	54 Å²	54	121.7 Å²	121.7	56%	0.557	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	125.4	-10.1	162.7	0	0	0	0	0	118.2	V51	V51-G53 PolarHBondContact O-N 3.18Å; V51-G53 VanDerWaalsContact O-N 3.16Å
54	E	59.7	Low	59	Low	136 Å²	136	123.6 Å²	123.6	64%	0.636	64%	0.644	S	S	*	*	S	Bend	trans	-96.6	-2.3	-175.7	72.4	-173	177.9	0	0	115.7	V51	V51-E54 HydrophobicContact CB-CG 4.17Å; V51-E54 HydrophobicContact CG1-CB 4.32Å; V51-E54 HydrophobicContact CG1-CG 3.61Å; V51-E54 WeakPolarHBondContact CG1-OE1 3.42Å
55	N	58	Low	59.9	Low	89 Å²	89	121 Å²	121	48%	0.476	64%	0.643	S	S	.	*			trans	-142.5	26.4	-178.6	-87.1	-60	0	0	0	115.1	D57 S58 V59	N55-D57 PolarHBondContact O-N 3.1Å; N55-S58 PolarHBondContact O-N 3.16Å; N55-S58 VanDerWaalsContact O-N 3.14Å; N55-S58 WeakPolarHBondContact OD1-CB 3.31Å; N55-V59 PolarHBondContact O-N 2.89Å
56	I	58.2	Low	61.1	Low	129 Å²	129	121.4 Å²	121.4	66%	0.662	65%	0.649	S	S	*	*	H	α-helix	trans	-59.4	-34.8	172.4	56	169.7	0	0	0	111.3
57	D	57.6	Low	62.5	Low	131 Å²	131	117 Å²	117	70%	0.701	64%	0.637	S	S	*	*	H	α-helix	trans	-78.5	-19.7	178.9	-58.5	-29.9	0	0	0	113	N55 G61	N55-D57 PolarHBondContact O-N 3.1Å; D57-G61 WeakPolarHBondContact O-CA 3.38Å; D57-G61 PolarHBondContact O-N 3.24Å
58	S	57.6	Low	64.2	Low	83 Å²	83	112.5 Å²	112.5	58%	0.58	62%	0.621	S	S	*	*	H	α-helix	trans	-87	-30.8	-180	-174.4	0	0	0	0	113.4	N55	N55-S58 PolarHBondContact O-N 3.16Å; N55-S58 VanDerWaalsContact O-N 3.14Å; N55-S58 WeakPolarHBondContact OD1-CB 3.31Å
59	V	60.1	Low	65.8	Low	114 Å²	114	113.2 Å²	113.2	69%	0.691	61%	0.612	S	S	*	*	H	α-helix	trans	-80.1	-36.8	-173.7	-179.7	0	0	0	0	111.8	N55	N55-V59 PolarHBondContact O-N 2.89Å
60	H	57.1	Low	67.1	Low	145 Å²	145	108.5 Å²	108.5	67%	0.671	60%	0.596	S	S	*	*	S	Bend	trans	-109.7	17	175.8	-82.5	56.7	0	0	0	112.6	Q62	H60-Q62 PolarHBondContact O-N 3.15Å; H60-Q62 PolarHBondContact O-NE2 3.34Å
61	G	57.9	Low	68.7	Low	30 Å²	30	107.7 Å²	107.7	31%	0.309	59%	0.586	S	S	.	*			trans	-46.1	104.8	176.7	0	0	0	0	0	109.1	D57 N63	D57-G61 WeakPolarHBondContact O-CA 3.38Å; D57-G61 PolarHBondContact O-N 3.24Å; G61-N63 PolarHBondContact O-N 3.04Å
62	Q	59.6	Low	70.4	Confident	154 Å²	154	109.2 Å²	109.2	72%	0.72	59%	0.589	S	S	*	*			trans	-65.9	22.9	178.8	-61	-74	-58.6	0	0	111.2	H60 K64	H60-Q62 PolarHBondContact O-N 3.15Å; H60-Q62 PolarHBondContact O-NE2 3.34Å; Q62-K64 PolarHBondContact O-N 2.88Å
63	N	57.7	Low	72.1	Confident	152 Å²	152	105.7 Å²	105.7	81%	0.813	57%	0.571	S	S	*	*			trans	-78	21.8	-178.5	-65.2	-31.6	0	0	0	112.4	G61	G61-N63 PolarHBondContact O-N 3.04Å
64	K	65.3	Low	73.9	Confident	142 Å²	142	109.2 Å²	109.2	62%	0.617	57%	0.573	S	S	*	*	S	Bend	trans	-93.6	114.5	159.8	-67.1	-177.1	-178.2	179.1	0	104.9	Q62 T66 I69	Q62-K64 PolarHBondContact O-N 2.88Å; K64-T66 PolarHBondContact O-N 3.15Å; K64-I69 HydrophobicContact CB-CD1 4.13Å; K64-I69 HydrophobicContact CB-CG1 3.89Å; K64-I69 WeakPolarHBondContact O-CD1 3.41Å
65	D	80.4	Confident	75.6	Confident	111 Å²	111	105.7 Å²	105.7	59%	0.594	56%	0.559	S	S	*	*			trans	-43.1	133.5	173.3	-70.5	-40.1	0	0	0	109.3	S67 I68 I69	D65-S67 PolarHBondContact O-N 3.27Å; D65-I68 HydrophobicContact CB-CD1 4.07Å; D65-I68 HydrophobicContact CB-CG1 4.14Å; D65-I68 WeakPolarHBondContact O-CA 3.1Å; D65-I68 WeakPolarHBondContact O-CB 3.42Å; D65-I68 PolarHBondContact O-N 3.38Å; D65-I69 PolarHBondContact O-N 3.16Å
66	T	84.2	Confident	77.4	Confident	108 Å²	108	106.3 Å²	106.3	66%	0.663	56%	0.559	S	S	*	*	H	α-helix	trans	-54.1	-29.1	-177.8	52.2	0	0	0	0	112.1	K64 I69 N70	K64-T66 PolarHBondContact O-N 3.15Å; T66-I69 PolarHBondContact O-N 2.84Å; T66-N70 WeakPolarHBondContact O-CB 3.13Å; T66-N70 PolarHBondContact O-N 2.88Å; T66-N70 PolarHBondContact O-ND2 2.93Å
67	S	87.9	Confident	79.1	Confident	74 Å²	74	107.7 Å²	107.7	52%	0.517	56%	0.557	S	S	.	*	H	α-helix	trans	-61.4	-40.5	172.2	60.2	0	0	0	0	113.5	D65 K71	D65-S67 PolarHBondContact O-N 3.27Å; S67-K71 WeakPolarHBondContact O-CB 3.41Å; S67-K71 PolarHBondContact O-N 3.2Å
68	I	89.2	Confident	80.9	Confident	92 Å²	92	106.4 Å²	106.4	47%	0.472	55%	0.55	S	S	.	.	H	α-helix	trans	-68.2	-43.4	177	-61.2	171.9	0	0	0	109.6	D65 K71 E72	D65-I68 HydrophobicContact CB-CD1 4.07Å; D65-I68 HydrophobicContact CB-CG1 4.14Å; D65-I68 WeakPolarHBondContact O-CA 3.1Å; D65-I68 WeakPolarHBondContact O-CB 3.42Å; D65-I68 PolarHBondContact O-N 3.38Å; I68-K71 PolarHBondContact O-N 2.9Å; I68-E72 WeakPolarHBondContact O-CB 3.37Å; I68-E72 PolarHBondContact O-N 2.66Å
69	I	88.4	Confident	82.4	Confident	63 Å²	63	106.8 Å²	106.8	32%	0.323	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-48.1	177.5	-61.1	173.8	0	0	0	110	K64 D65 T66 K71 E72 L73	K64-I69 HydrophobicContact CB-CD1 4.13Å; K64-I69 HydrophobicContact CB-CG1 3.89Å; K64-I69 WeakPolarHBondContact O-CD1 3.41Å; D65-I69 PolarHBondContact O-N 3.16Å; T66-I69 PolarHBondContact O-N 2.84Å; I69-K71 PolarHBondContact O-N 3.47Å; I69-E72 PolarHBondContact O-N 2.85Å; I69-L73 HydrophobicContact CG2-CD1 4.01Å; I69-L73 HydrophobicContact CG2-CG 4.42Å; I69-L73 VanDerWaalsContact O-CG 3.3Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.07Å
70	N	92.6	Very high	83.7	Confident	89 Å²	89	103.2 Å²	103.2	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-60	-45.9	178.3	-72.2	-21	0	0	0	112	T66 E72 L73 E74	T66-N70 WeakPolarHBondContact O-CB 3.13Å; T66-N70 PolarHBondContact O-N 2.88Å; T66-N70 PolarHBondContact O-ND2 2.93Å; N70-E72 VanDerWaalsContact C-N 3.32Å; N70-E72 PolarHBondContact O-N 3.5Å; N70-L73 PolarHBondContact O-N 3.44Å; N70-E74 WeakPolarHBondContact O-CG 3.38Å; N70-E74 PolarHBondContact O-N 3.03Å
71	K	94.6	Very high	85.1	Confident	139 Å²	139	99.6 Å²	99.6	60%	0.604	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-40.8	177.1	-174.9	178.1	-179.8	179.3	0	112.2	S67 I68 I69 E74 N75	S67-K71 WeakPolarHBondContact O-CB 3.41Å; S67-K71 PolarHBondContact O-N 3.2Å; I68-K71 PolarHBondContact O-N 2.9Å; I69-K71 PolarHBondContact O-N 3.47Å; K71-E74 PolarHBondContact O-N 3.03Å; K71-N75 WeakPolarHBondContact O-CB 3.5Å; K71-N75 PolarHBondContact O-N 3.19Å; K71-N75 PolarHBondContact O-ND2 3Å
72	E	94.1	Very high	86.3	Confident	91 Å²	91	104.1 Å²	104.1	43%	0.425	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-39.4	177.5	-178.4	55.5	-156.1	0	0	111.8	I68 I69 N70 N75 Q76	I68-E72 WeakPolarHBondContact O-CB 3.37Å; I68-E72 PolarHBondContact O-N 2.66Å; I69-E72 PolarHBondContact O-N 2.85Å; N70-E72 VanDerWaalsContact C-N 3.32Å; N70-E72 PolarHBondContact O-N 3.5Å; E72-N75 PolarHBondContact O-N 2.67Å; E72-Q76 VanDerWaalsContact O-CG 3.31Å; E72-Q76 WeakPolarHBondContact O-CG 3.16Å; E72-Q76 PolarHBondContact O-N 2.88Å; E72-Q76 PolarHBondContact OE1-NE2 3.34Å; E72-Q76 VanDerWaalsContact OE1-NE2 3.12Å
73	L	95.3	Very high	87.1	Confident	94 Å²	94	103.7 Å²	103.7	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-63.1	-44.2	174.2	-71.4	170.8	0	0	0	112	I69 N70 N75 Q76 Y77	I69-L73 HydrophobicContact CG2-CD1 4.01Å; I69-L73 HydrophobicContact CG2-CG 4.42Å; I69-L73 VanDerWaalsContact O-CG 3.3Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.07Å; N70-L73 PolarHBondContact O-N 3.44Å; L73-N75 VanDerWaalsContact C-N 3.34Å; L73-N75 PolarHBondContact O-N 2.8Å; L73-Q76 PolarHBondContact O-N 3.18Å; L73-Y77 PolarHBondContact O-N 3.35Å
74	E	96.1	Very high	87.8	Confident	128 Å²	128	100.7 Å²	100.7	60%	0.598	51%	0.513	S	S	*	.	H	α-helix	trans	-60.3	-43.9	174.6	-74.3	175.4	-169.8	0	0	111.6	N70 K71 Q76 Y77 L78	N70-E74 WeakPolarHBondContact O-CG 3.38Å; N70-E74 PolarHBondContact O-N 3.03Å; K71-E74 PolarHBondContact O-N 3.03Å; E74-Q76 PolarHBondContact O-N 3.12Å; E74-Y77 WeakPolarHBondContact O-CB 3.38Å; E74-Y77 PolarHBondContact O-N 2.78Å; E74-L78 WeakPolarHBondContact O-CG 3.2Å; E74-L78 PolarHBondContact O-N 3.34Å
75	N	96.3	Very high	87.9	Confident	62 Å²	62	101.4 Å²	101.4	33%	0.332	52%	0.52	S	S	.	.	H	α-helix	trans	-61.1	-44.1	176.1	-72.6	-22	0	0	0	112	K71 E72 L73 Y77 L78 Q79	K71-N75 WeakPolarHBondContact O-CB 3.5Å; K71-N75 PolarHBondContact O-N 3.19Å; K71-N75 PolarHBondContact O-ND2 3Å; E72-N75 PolarHBondContact O-N 2.67Å; L73-N75 VanDerWaalsContact C-N 3.34Å; L73-N75 PolarHBondContact O-N 2.8Å; N75-Y77 VanDerWaalsContact C-N 3.31Å; N75-Y77 PolarHBondContact O-N 3.3Å; N75-L78 PolarHBondContact O-N 3.22Å; N75-Q79 WeakPolarHBondContact O-CB 3.19Å; N75-Q79 VanDerWaalsContact O-CG 3.3Å; N75-Q79 WeakPolarHBondContact O-CG 3.45Å; N75-Q79 PolarHBondContact O-N 3.06Å
76	Q	95	Very high	86.9	Confident	102 Å²	102	100.5 Å²	100.5	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-40.1	177.2	-74	175.2	22.6	0	0	111.8	E72 L73 E74 G80	E72-Q76 VanDerWaalsContact O-CG 3.31Å; E72-Q76 WeakPolarHBondContact O-CG 3.16Å; E72-Q76 PolarHBondContact O-N 2.88Å; E72-Q76 PolarHBondContact OE1-NE2 3.34Å; E72-Q76 VanDerWaalsContact OE1-NE2 3.12Å; L73-Q76 PolarHBondContact O-N 3.18Å; E74-Q76 PolarHBondContact O-N 3.12Å; Q76-G80 PolarHBondContact O-N 3.48Å
77	Y	95	Very high	85.9	Confident	157 Å²	157	100.7 Å²	100.7	62%	0.616	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-48.9	175.5	175.7	-104.3	0	0	0	111.8	L73 E74 N75 Q79 G80 L81	L73-Y77 PolarHBondContact O-N 3.35Å; E74-Y77 WeakPolarHBondContact O-CB 3.38Å; E74-Y77 PolarHBondContact O-N 2.78Å; N75-Y77 VanDerWaalsContact C-N 3.31Å; N75-Y77 PolarHBondContact O-N 3.3Å; Y77-Q79 PolarHBondContact O-N 3.35Å; Y77-G80 PolarHBondContact O-N 2.94Å; Y77-G80 VanDerWaalsContact O-N 3.16Å; Y77-L81 HydrophobicContact CD1-CD1 4.07Å; Y77-L81 HydrophobicContact CE1-CD1 3.43Å; Y77-L81 VanDerWaalsContact CE1-CD1 3.43Å; Y77-L81 HydrophobicContact CE1-CG 4.19Å; Y77-L81 HydrophobicContact CE2-CD1 4.43Å; Y77-L81 HydrophobicContact CE2-CG 4.4Å; Y77-L81 PolarHBondContact O-N 3.44Å
78	L	94	Very high	84.7	Confident	105 Å²	105	104.1 Å²	104.1	55%	0.55	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-43	178.4	-69	174.7	0	0	0	112.3	E74 N75 G80 L81 E82	E74-L78 WeakPolarHBondContact O-CG 3.2Å; E74-L78 PolarHBondContact O-N 3.34Å; N75-L78 PolarHBondContact O-N 3.22Å; L78-G80 VanDerWaalsContact C-N 3.29Å; L78-G80 PolarHBondContact O-N 3.42Å; L78-L81 WeakPolarHBondContact O-CB 3.43Å; L78-L81 PolarHBondContact O-N 3.17Å; L78-E82 PolarHBondContact O-N 3.09Å
79	Q	90.1	Very high	83.3	Confident	91 Å²	91	107.6 Å²	107.6	43%	0.425	54%	0.536	S	S	.	.	H	α-helix	trans	-62.1	-38.2	173.9	-73.3	177.1	39.8	0	0	112	N75 Y77 E82 K83	N75-Q79 WeakPolarHBondContact O-CB 3.19Å; N75-Q79 VanDerWaalsContact O-CG 3.3Å; N75-Q79 WeakPolarHBondContact O-CG 3.45Å; N75-Q79 PolarHBondContact O-N 3.06Å; Y77-Q79 PolarHBondContact O-N 3.35Å; Q79-E82 PolarHBondContact O-N 3.46Å; Q79-K83 WeakPolarHBondContact O-CB 2.85Å; Q79-K83 VanDerWaalsContact O-CG 3.23Å; Q79-K83 WeakPolarHBondContact O-CG 3.3Å; Q79-K83 PolarHBondContact O-N 2.93Å
80	G	87.3	Confident	82	Confident	38 Å²	38	112.9 Å²	112.9	39%	0.392	56%	0.558	S	S	.	*	H	α-helix	trans	-63	-42.5	175.3	0	0	0	0	0	112.2	Q76 Y77 L78 K83 S84	Q76-G80 PolarHBondContact O-N 3.48Å; Y77-G80 PolarHBondContact O-N 2.94Å; Y77-G80 VanDerWaalsContact O-N 3.16Å; L78-G80 VanDerWaalsContact C-N 3.29Å; L78-G80 PolarHBondContact O-N 3.42Å; G80-K83 PolarHBondContact O-N 3.05Å; G80-S84 WeakPolarHBondContact O-CB 3.36Å; G80-S84 PolarHBondContact O-N 3.36Å
81	L	87.1	Confident	80.4	Confident	70 Å²	70	112.9 Å²	112.9	37%	0.366	56%	0.555	S	S	.	*	H	α-helix	trans	-62.4	-46.9	174.2	-75	177.7	0	0	0	111.8	Y77 L78 K83 S84 M85	Y77-L81 HydrophobicContact CD1-CD1 4.07Å; Y77-L81 HydrophobicContact CE1-CD1 3.43Å; Y77-L81 VanDerWaalsContact CE1-CD1 3.43Å; Y77-L81 HydrophobicContact CE1-CG 4.19Å; Y77-L81 HydrophobicContact CE2-CD1 4.43Å; Y77-L81 HydrophobicContact CE2-CG 4.4Å; Y77-L81 PolarHBondContact O-N 3.44Å; L78-L81 WeakPolarHBondContact O-CB 3.43Å; L78-L81 PolarHBondContact O-N 3.17Å; L81-K83 VanDerWaalsContact C-N 3.33Å; L81-K83 PolarHBondContact O-N 2.96Å; L81-S84 WeakPolarHBondContact O-CB 3.2Å; L81-S84 PolarHBondContact O-N 3.42Å; L81-M85 WeakPolarHBondContact O-CG 3.49Å; L81-M85 PolarHBondContact O-N 3.23Å; L81-M85 VanDerWaalsContact O-N 3.08Å
82	E	82.8	Confident	78.7	Confident	125 Å²	125	107.9 Å²	107.9	58%	0.584	54%	0.543	S	S	*	.	H	α-helix	trans	-58.3	-46	178.2	-175.5	-179.3	-173.4	0	0	111.2	L78 Q79 S84 M85 Q86	L78-E82 PolarHBondContact O-N 3.09Å; Q79-E82 PolarHBondContact O-N 3.46Å; E82-S84 PolarHBondContact O-N 2.77Å; E82-M85 PolarHBondContact O-N 3.39Å; E82-Q86 VanDerWaalsContact O-CG 3.31Å; E82-Q86 WeakPolarHBondContact O-CG 3.41Å; E82-Q86 PolarHBondContact O-N 3.16Å; E82-Q86 PolarHBondContact O-NE2 3.07Å
83	K	75.5	Confident	77.2	Confident	145 Å²	145	113 Å²	113	63%	0.63	57%	0.572	S	S	*	*	H	α-helix	trans	-63.7	-38.1	177.3	-72.4	170.8	-173.8	174	0	112.9	Q79 G80 L81 M85 Q86	Q79-K83 WeakPolarHBondContact O-CB 2.85Å; Q79-K83 VanDerWaalsContact O-CG 3.23Å; Q79-K83 WeakPolarHBondContact O-CG 3.3Å; Q79-K83 PolarHBondContact O-N 2.93Å; G80-K83 PolarHBondContact O-N 3.05Å; L81-K83 VanDerWaalsContact C-N 3.33Å; L81-K83 PolarHBondContact O-N 2.96Å; K83-M85 VanDerWaalsContact C-N 3.28Å; K83-M85 PolarHBondContact O-N 3.37Å; K83-Q86 PolarHBondContact O-N 3.42Å
84	S	72.3	Confident	75.1	Confident	89 Å²	89	111.2 Å²	111.2	62%	0.622	58%	0.577	S	S	*	*	H	α-helix	trans	-65.1	-34.3	176.9	-172.6	0	0	0	0	112	G80 L81 E82	G80-S84 WeakPolarHBondContact O-CB 3.36Å; G80-S84 PolarHBondContact O-N 3.36Å; L81-S84 WeakPolarHBondContact O-CB 3.2Å; L81-S84 PolarHBondContact O-N 3.42Å; E82-S84 PolarHBondContact O-N 2.77Å
85	M	67.5	Low	73.1	Confident	156 Å²	156	108.8 Å²	108.8	77%	0.768	57%	0.573	S	S	*	*	H	α-helix	trans	-82.8	-9.3	178	-63.7	-155.1	179.9	0	0	114.1	L81 E82 K83	L81-M85 WeakPolarHBondContact O-CG 3.49Å; L81-M85 PolarHBondContact O-N 3.23Å; L81-M85 VanDerWaalsContact O-N 3.08Å; E82-M85 PolarHBondContact O-N 3.39Å; K83-M85 VanDerWaalsContact C-N 3.28Å; K83-M85 PolarHBondContact O-N 3.37Å
86	Q	60.3	Low	71.1	Confident	92 Å²	92	113.2 Å²	113.2	43%	0.43	59%	0.592	S	S	.	*			trans	-69.8	133.5	178.2	-64.7	-51.7	-55.2	0	0	111.1	E82 K83 N88	E82-Q86 VanDerWaalsContact O-CG 3.31Å; E82-Q86 WeakPolarHBondContact O-CG 3.41Å; E82-Q86 PolarHBondContact O-N 3.16Å; E82-Q86 PolarHBondContact O-NE2 3.07Å; K83-Q86 PolarHBondContact O-N 3.42Å; Q86-N88 PolarHBondContact O-N 3.5Å
87	P	63.1	Low	69.1	Low	112 Å²	112	112 Å²	112	73%	0.727	60%	0.599	S	S	*	*	S	Bend	trans	-66.4	-18.8	179.4	26.9	-34.4	0	0	0	112.9	R89	P87-R89 PolarHBondContact O-N 3.31Å
88	N	62.4	Low	67.2	Low	146 Å²	146	111 Å²	111	78%	0.781	61%	0.605	S	S	*	*			trans	-79.7	55	177	-62	-30.5	0	0	0	111	Q86 H90	Q86-N88 PolarHBondContact O-N 3.5Å; N88-H90 PolarHBondContact O-N 2.68Å; N88-H90 VanDerWaalsContact O-N 3.08Å
89	R	58.9	Low	65.2	Low	166 Å²	166	111.1 Å²	111.1	63%	0.626	61%	0.614	S	S	*	*			trans	-63.5	109.3	172.1	-133.5	179.7	-175.7	-138.2	1.6	107.2	P87 H91	P87-R89 PolarHBondContact O-N 3.31Å; R89-H91 PolarHBondContact O-N 2.89Å; R89-H91 PolarHBondContact O-ND1 3.45Å; R89-H91 VanDerWaalsContact O-ND1 3.15Å
90	H	62.3	Low	63.4	Low	174 Å²	174	112.6 Å²	112.6	81%	0.806	63%	0.634	S	S	*	*			trans	-66.5	91.9	165.2	180	-83.4	0	0	0	106.8	N88 G92	N88-H90 PolarHBondContact O-N 2.68Å; N88-H90 VanDerWaalsContact O-N 3.08Å; H90-G92 PolarHBondContact O-N 3.48Å
91	H	59.5	Low	61.7	Low	88 Å²	88	115.7 Å²	115.7	41%	0.407	65%	0.65	S	S	.	*			trans	-64.3	102.4	171.4	-63.5	96.1	0	0	0	106.3	R89 C95	R89-H91 PolarHBondContact O-N 2.89Å; R89-H91 PolarHBondContact O-ND1 3.45Å; R89-H91 VanDerWaalsContact O-ND1 3.15Å; H91-C95 HydrophobicContact CB-CB 4.4Å; H91-C95 PolarHBondContact CD2-O 2.96Å; H91-C95 VanDerWaalsContact CD2-O 3.27Å
92	G	58.3	Low	60.1	Low	34 Å²	34	117.5 Å²	117.5	35%	0.351	66%	0.66	S	S	.	*			trans	-53.2	165.1	163.7	0	0	0	0	0	109.9	H90 G94 C95	H90-G92 PolarHBondContact O-N 3.48Å; G92-G94 PolarHBondContact O-N 3.42Å; G92-C95 PolarHBondContact O-N 2.98Å
93	L	62.8	Low	58.9	Low	199 Å²	199	115.6 Å²	115.6	100%	1.042	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	19.4	-167.1	-64.1	169.7	0	0	0	117.2
94	G	50.9	Low	58.2	Low	57 Å²	57	112.7 Å²	112.7	59%	0.588	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.4	5.9	174.9	0	0	0	0	0	115.9	G92 H96	G92-G94 PolarHBondContact O-N 3.42Å; G94-H96 PolarHBondContact O-N 3.39Å
95	C	53.2	Low	57.6	Low	77 Å²	77	115.1 Å²	115.1	52%	0.52	66%	0.659	S	S	.	*			trans	-89.5	85.2	177.3	-65.4	0	0	0	0	110.2	H91 G92 A97	H91-C95 HydrophobicContact CB-CB 4.4Å; H91-C95 PolarHBondContact CD2-O 2.96Å; H91-C95 VanDerWaalsContact CD2-O 3.27Å; G92-C95 PolarHBondContact O-N 2.98Å; C95-A97 PolarHBondContact O-N 3.47Å
96	H	54.1	Low	57.3	Low	155 Å²	155	112.2 Å²	112.2	72%	0.718	65%	0.653	S	S	*	*			trans	-61.8	126.3	167.6	-67.2	-75.5	0	0	0	109.3	G94 N98	G94-H96 PolarHBondContact O-N 3.39Å; H96-N98 PolarHBondContact O-N 2.93Å
97	A	53.7	Low	57.5	Low	76 Å²	76	109.9 Å²	109.9	63%	0.628	64%	0.644	S	S	*	*			trans	-71.8	46.6	174.4	0	0	0	0	0	111.7	C95 S99	C95-A97 PolarHBondContact O-N 3.47Å; A97-S99 PolarHBondContact O-N 3.31Å
98	N	55.4	Low	57.8	Low	137 Å²	137	108 Å²	108	73%	0.733	63%	0.628	S	S	*	*			trans	-75.5	86.6	166.8	-62	-0.3	0	0	0	105.9	H96	H96-N98 PolarHBondContact O-N 2.93Å
99	S	51	Low	58.4	Low	106 Å²	106	108.5 Å²	108.5	74%	0.741	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-34.8	140.3	171	49.1	0	0	0	0	113.8	A97	A97-S99 PolarHBondContact O-N 3.31Å
100	S	53.2	Low	59.5	Low	123 Å²	123	105.1 Å²	105.1	86%	0.86	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.4	10.5	147.3	-164.5	0	0	0	0	120.2
101	S	51.4	Low	60.5	Low	102 Å²	102	99.5 Å²	99.5	71%	0.713	60%	0.603	S	S	*	*			trans	-112.6	74.2	162.2	69.6	0	0	0	0	110.6	P103	S101-P103 WeakPolarHBondContact O-CD 3.36Å; S101-P103 VanDerWaalsContact O-N 3.09Å
102	N	54	Low	61.8	Low	109 Å²	109	99.5 Å²	99.5	58%	0.583	61%	0.609	S	S	*	*			trans	-59.4	110.5	153.5	-83.9	-30.6	0	0	0	105.5	V104 N105	N102-V104 PolarHBondContact O-N 3.13Å; N102-N105 HydrophobicContact CB-CB 4.22Å; N102-N105 PolarHBondContact O-N 3.27Å
103	P	57.5	Low	63.1	Low	85 Å²	85	102.4 Å²	102.4	55%	0.552	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-59.7	-24.4	-177.1	25.2	-33.8	0	0	0	111	S101 L107 Q118	S101-P103 WeakPolarHBondContact O-CD 3.36Å; S101-P103 VanDerWaalsContact O-N 3.09Å; P103-L107 WeakPolarHBondContact O-CD1 3.43Å; P103-Q118 PolarHBondContact O-NE2 3.48Å
104	V	60.1	Low	64.1	Low	84 Å²	84	98.3 Å²	98.3	51%	0.509	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-67.8	-31.1	177.2	-158.8	0	0	0	0	113.2	N102 S106 L107	N102-V104 PolarHBondContact O-N 3.13Å; V104-S106 PolarHBondContact O-N 3.33Å; V104-L107 PolarHBondContact O-N 2.87Å
105	N	60.2	Low	65.6	Low	140 Å²	140	98.4 Å²	98.4	75%	0.749	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-72.1	-17	-177.6	-82.7	-6.5	0	0	0	113.3	N102	N102-N105 HydrophobicContact CB-CB 4.22Å; N102-N105 PolarHBondContact O-N 3.27Å
106	S	61	Low	67.1	Low	94 Å²	94	100.1 Å²	100.1	66%	0.657	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-103.6	10.5	176.9	-169.5	0	0	0	0	113.1	V104 D108	V104-S106 PolarHBondContact O-N 3.33Å; S106-D108 PolarHBondContact O-N 3.29Å
107	L	64.3	Low	68.4	Low	43 Å²	43	99 Å²	99	23%	0.225	57%	0.568	C	S	.	*			trans	-74	108.1	178.5	-105.7	69.1	0	0	0	110.5	P103 V104 Y109 L115	P103-L107 WeakPolarHBondContact O-CD1 3.43Å; V104-L107 PolarHBondContact O-N 2.87Å; L107-Y109 HydrophobicContact CB-CD2 4.38Å; L107-Y109 HydrophobicContact CB-CE1 4.41Å; L107-Y109 HydrophobicContact CB-CE2 3.92Å; L107-Y109 HydrophobicContact CD2-CE1 3.92Å; L107-Y109 VanDerWaalsContact O-CD2 3.31Å; L107-Y109 WeakPolarHBondContact O-CD2 3.39Å; L107-Y109 PolarHBondContact O-N 3.24Å; L107-Y109 VanDerWaalsContact O-N 3.1Å; L107-L115 HydrophobicContact CD1-CD1 4.26Å; L107-L115 HydrophobicContact CD2-CD1 3.28Å; L107-L115 HydrophobicContact CG-CD1 3.42Å; L107-L115 VanDerWaalsContact CG-CD1 3.42Å
108	D	69.6	Low	69.7	Low	74 Å²	74	98.3 Å²	98.3	40%	0.396	55%	0.552	S	S	.	*			trans	-77.8	88.6	168	-176.1	5	0	0	0	109.4	S106 A110 N111 K114	S106-D108 PolarHBondContact O-N 3.29Å; D108-A110 PolarHBondContact O-N 3.3Å; D108-A110 VanDerWaalsContact O-N 3.15Å; D108-A110 WeakPolarHBondContact OD1-CB 3.19Å; D108-A110 PolarHBondContact OD1-N 3.41Å; D108-N111 PolarHBondContact O-N 2.9Å; D108-N111 VanDerWaalsContact O-N 3.16Å; D108-K114 IonicContact OD2-NZ 3.76Å
109	Y	75.6	Confident	71	Confident	156 Å²	156	99.1 Å²	99.1	61%	0.612	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.7	179.5	-67.1	-79.7	0	0	0	113.5	L107 N111	L107-Y109 HydrophobicContact CB-CD2 4.38Å; L107-Y109 HydrophobicContact CB-CE1 4.41Å; L107-Y109 HydrophobicContact CB-CE2 3.92Å; L107-Y109 HydrophobicContact CD2-CE1 3.92Å; L107-Y109 VanDerWaalsContact O-CD2 3.31Å; L107-Y109 WeakPolarHBondContact O-CD2 3.39Å; L107-Y109 PolarHBondContact O-N 3.24Å; L107-Y109 VanDerWaalsContact O-N 3.1Å; Y109-N111 VanDerWaalsContact C-N 3.28Å; Y109-N111 PolarHBondContact O-N 3.24Å
110	A	81.7	Confident	72.4	Confident	95 Å²	95	100.5 Å²	100.5	79%	0.785	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-21	177.9	0	0	0	0	0	112.3	D108	D108-A110 PolarHBondContact O-N 3.3Å; D108-A110 VanDerWaalsContact O-N 3.15Å; D108-A110 WeakPolarHBondContact OD1-CB 3.19Å; D108-A110 PolarHBondContact OD1-N 3.41Å
111	N	83.6	Confident	73.7	Confident	56 Å²	56	98.1 Å²	98.1	30%	0.299	52%	0.522	S	S	.	.			trans	-118.3	96.4	-177.8	-167.9	-40.7	0	0	0	111.9	D108 Y109 E113 K114 L115	D108-N111 PolarHBondContact O-N 2.9Å; D108-N111 VanDerWaalsContact O-N 3.16Å; Y109-N111 VanDerWaalsContact C-N 3.28Å; Y109-N111 PolarHBondContact O-N 3.24Å; N111-E113 PolarHBondContact O-N 3.46Å; N111-E113 PolarHBondContact OD1-N 3.17Å; N111-E113 VanDerWaalsContact OD1-N 3.12Å; N111-K114 HydrophobicContact CB-CB 4.19Å; N111-K114 HydrophobicContact CB-CD 4.04Å; N111-K114 HydrophobicContact CB-CG 4.17Å; N111-K114 PolarHBondContact O-N 2.98Å; N111-K114 PolarHBondContact OD1-N 3.15Å; N111-L115 PolarHBondContact O-N 2.85Å; N111-L115 VanDerWaalsContact O-N 3.15Å
112	T	85.9	Confident	74.9	Confident	87 Å²	87	97.5 Å²	97.5	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-30.6	-179.5	58	0	0	0	0	113.5	K116	T112-K116 WeakPolarHBondContact O-CG 3.35Å; T112-K116 PolarHBondContact O-N 3.09Å; T112-K116 VanDerWaalsContact O-N 3.07Å
113	E	86.8	Confident	76.3	Confident	95 Å²	95	98.9 Å²	98.9	44%	0.444	52%	0.519	S	S	.	.	H	α-helix	trans	-75	-41.4	-178.2	-66.9	-54.1	119.3	0	0	111.6	N111 L115 K116 Q117	N111-E113 PolarHBondContact O-N 3.46Å; N111-E113 PolarHBondContact OD1-N 3.17Å; N111-E113 VanDerWaalsContact OD1-N 3.12Å; E113-L115 VanDerWaalsContact C-N 3.29Å; E113-L115 PolarHBondContact O-N 3.35Å; E113-K116 PolarHBondContact O-N 3.02Å; E113-K116 IonicContact OE1-NZ 3.9Å; E113-K116 PolarHBondContact OE1-NZ 3.17Å; E113-Q117 WeakPolarHBondContact O-CG 3.23Å; E113-Q117 PolarHBondContact O-N 2.91Å
114	K	84	Confident	77.2	Confident	114 Å²	114	100.4 Å²	100.4	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-60.3	-41.8	171	-71.5	-177.4	-175.3	176.2	0	111.4	D108 N111 K116 Q117 Q118	D108-K114 IonicContact OD2-NZ 3.76Å; N111-K114 HydrophobicContact CB-CB 4.19Å; N111-K114 HydrophobicContact CB-CD 4.04Å; N111-K114 HydrophobicContact CB-CG 4.17Å; N111-K114 PolarHBondContact O-N 2.98Å; N111-K114 PolarHBondContact OD1-N 3.15Å; K114-K116 PolarHBondContact O-N 3.01Å; K114-Q117 PolarHBondContact O-N 3.47Å; K114-Q118 WeakPolarHBondContact O-CB 3.45Å; K114-Q118 PolarHBondContact O-N 2.99Å
115	L	82.4	Confident	77.8	Confident	59 Å²	59	101.7 Å²	101.7	31%	0.309	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-44.7	178.4	-176.8	63.4	0	0	0	112.1	L107 N111 E113 Q117 Q118 Y119	L107-L115 HydrophobicContact CD1-CD1 4.26Å; L107-L115 HydrophobicContact CD2-CD1 3.28Å; L107-L115 HydrophobicContact CG-CD1 3.42Å; L107-L115 VanDerWaalsContact CG-CD1 3.42Å; N111-L115 PolarHBondContact O-N 2.85Å; N111-L115 VanDerWaalsContact O-N 3.15Å; E113-L115 VanDerWaalsContact C-N 3.29Å; E113-L115 PolarHBondContact O-N 3.35Å; L115-Q117 PolarHBondContact O-N 3.46Å; L115-Q118 PolarHBondContact O-N 3.31Å; L115-Y119 WeakPolarHBondContact O-CB 3.44Å; L115-Y119 PolarHBondContact O-N 2.9Å
116	K	83.5	Confident	78.4	Confident	113 Å²	113	103.4 Å²	103.4	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-62.6	-41	174.7	-73.3	172.9	-171.7	164.5	0	112	T112 E113 K114 Y119 K120	T112-K116 WeakPolarHBondContact O-CG 3.35Å; T112-K116 PolarHBondContact O-N 3.09Å; T112-K116 VanDerWaalsContact O-N 3.07Å; E113-K116 PolarHBondContact O-N 3.02Å; E113-K116 IonicContact OE1-NZ 3.9Å; E113-K116 PolarHBondContact OE1-NZ 3.17Å; K114-K116 PolarHBondContact O-N 3.01Å; K116-Y119 PolarHBondContact O-N 2.94Å; K116-K120 WeakPolarHBondContact O-CB 3.04Å; K116-K120 VanDerWaalsContact O-CG 3.3Å; K116-K120 WeakPolarHBondContact O-CG 3.26Å; K116-K120 PolarHBondContact O-N 2.85Å
117	Q	82.1	Confident	78.8	Confident	132 Å²	132	108.3 Å²	108.3	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-63.6	-47.6	177.7	-71.8	176.4	15	0	0	111.2	E113 K114 L115 Y119 K120 S121	E113-Q117 WeakPolarHBondContact O-CG 3.23Å; E113-Q117 PolarHBondContact O-N 2.91Å; K114-Q117 PolarHBondContact O-N 3.47Å; L115-Q117 PolarHBondContact O-N 3.46Å; Q117-Y119 VanDerWaalsContact C-N 3.32Å; Q117-Y119 PolarHBondContact O-N 3.46Å; Q117-K120 PolarHBondContact O-N 3.49Å; Q117-S121 PolarHBondContact O-N 3.43Å; Q117-S121 PolarHBondContact O-OG 3.16Å
118	Q	81.3	Confident	79.1	Confident	61 Å²	61	113.6 Å²	113.6	29%	0.285	57%	0.573	S	S	.	*	H	α-helix	trans	-62.1	-38.9	177.6	-171.2	-177.4	-13.8	0	0	112.3	P103 K114 L115 S121 S122	P103-Q118 PolarHBondContact O-NE2 3.48Å; K114-Q118 WeakPolarHBondContact O-CB 3.45Å; K114-Q118 PolarHBondContact O-N 2.99Å; L115-Q118 PolarHBondContact O-N 3.31Å; Q118-S121 PolarHBondContact O-OG 2.71Å; Q118-S121 VanDerWaalsContact O-OG 3.06Å; Q118-S122 PolarHBondContact O-N 2.78Å; Q118-S122 PolarHBondContact O-OG 2.7Å
119	Y	81.8	Confident	78.7	Confident	153 Å²	153	119.4 Å²	119.4	60%	0.6	62%	0.619	S	S	*	*	H	α-helix	trans	-62.5	-48.7	173	179.6	-92.1	0	0	0	111.1	L115 K116 Q117 S121 S122 F123	L115-Y119 WeakPolarHBondContact O-CB 3.44Å; L115-Y119 PolarHBondContact O-N 2.9Å; K116-Y119 PolarHBondContact O-N 2.94Å; Q117-Y119 VanDerWaalsContact C-N 3.32Å; Q117-Y119 PolarHBondContact O-N 3.46Å; Y119-S121 PolarHBondContact O-N 3.35Å; Y119-S122 WeakPolarHBondContact O-CB 3.24Å; Y119-S122 PolarHBondContact O-N 2.83Å; Y119-F123 HydrophobicContact CD1-CD2 4.28Å; Y119-F123 AromaticContact CD1-CE2 3.94Å; Y119-F123 HydrophobicContact CD1-CE2 3.94Å; Y119-F123 AromaticContact CD2-CE2 3.92Å; Y119-F123 HydrophobicContact CD2-CE2 3.92Å; Y119-F123 AromaticContact CE1-CD2 4Å; Y119-F123 HydrophobicContact CE1-CD2 4Å; Y119-F123 AromaticContact CE1-CE2 3.5Å; Y119-F123 HydrophobicContact CE1-CE2 3.5Å; Y119-F123 VanDerWaalsContact CE1-CE2 3.5Å; Y119-F123 HydrophobicContact CE1-CZ 4.38Å; Y119-F123 AromaticContact CE2-CE2 3.49Å; Y119-F123 HydrophobicContact CE2-CE2 3.49Å; Y119-F123 VanDerWaalsContact CE2-CE2 3.49Å; Y119-F123 AromaticContact CE2-CZ 3.93Å; Y119-F123 HydrophobicContact CE2-CZ 3.93Å; Y119-F123 HydrophobicContact CG-CE2 4.13Å; Y119-F123 AromaticContact CZ-CE2 3.25Å; Y119-F123 AromaticContact CZ-CZ 3.75Å; Y119-F123 WeakPolarHBondContact O-CD2 3.31Å; Y119-F123 WeakPolarHBondContact O-CE2 3.36Å
120	K	80.8	Confident	78.9	Confident	135 Å²	135	117.6 Å²	117.6	59%	0.587	62%	0.619	S	S	*	*	H	α-helix	trans	-63.2	-40.5	-178.9	-75.5	179.4	177.9	-169.5	0	113	K116 Q117 S122 F123 I124	K116-K120 WeakPolarHBondContact O-CB 3.04Å; K116-K120 VanDerWaalsContact O-CG 3.3Å; K116-K120 WeakPolarHBondContact O-CG 3.26Å; K116-K120 PolarHBondContact O-N 2.85Å; Q117-K120 PolarHBondContact O-N 3.49Å; K120-S122 PolarHBondContact O-N 3.36Å; K120-F123 PolarHBondContact O-N 2.8Å; K120-I124 PolarHBondContact O-N 2.6Å
121	S	80.2	Confident	78.7	Confident	74 Å²	74	118.7 Å²	118.7	52%	0.517	61%	0.61	S	S	.	*	H	α-helix	trans	-67.4	-20.7	178	61.6	0	0	0	0	113.1	Q117 Q118 Y119 F123	Q117-S121 PolarHBondContact O-N 3.43Å; Q117-S121 PolarHBondContact O-OG 3.16Å; Q118-S121 PolarHBondContact O-OG 2.71Å; Q118-S121 VanDerWaalsContact O-OG 3.06Å; Y119-S121 PolarHBondContact O-N 3.35Å; S121-F123 VanDerWaalsContact C-N 3.25Å; S121-F123 PolarHBondContact O-N 2.82Å
122	S	77.3	Confident	78.4	Confident	88 Å²	88	122.2 Å²	122.2	62%	0.615	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-18.6	176	-57.6	0	0	0	0	113.5	Q118 Y119 K120	Q118-S122 PolarHBondContact O-N 2.78Å; Q118-S122 PolarHBondContact O-OG 2.7Å; Y119-S122 WeakPolarHBondContact O-CB 3.24Å; Y119-S122 PolarHBondContact O-N 2.83Å; K120-S122 PolarHBondContact O-N 3.36Å
123	F	83.3	Confident	78	Confident	139 Å²	139	124.3 Å²	124.3	61%	0.61	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-18.6	-179.2	-62.8	-80.6	0	0	0	114	Y119 K120 S121	Y119-F123 HydrophobicContact CD1-CD2 4.28Å; Y119-F123 AromaticContact CD1-CE2 3.94Å; Y119-F123 HydrophobicContact CD1-CE2 3.94Å; Y119-F123 AromaticContact CD2-CE2 3.92Å; Y119-F123 HydrophobicContact CD2-CE2 3.92Å; Y119-F123 AromaticContact CE1-CD2 4Å; Y119-F123 HydrophobicContact CE1-CD2 4Å; Y119-F123 AromaticContact CE1-CE2 3.5Å; Y119-F123 HydrophobicContact CE1-CE2 3.5Å; Y119-F123 VanDerWaalsContact CE1-CE2 3.5Å; Y119-F123 HydrophobicContact CE1-CZ 4.38Å; Y119-F123 AromaticContact CE2-CE2 3.49Å; Y119-F123 HydrophobicContact CE2-CE2 3.49Å; Y119-F123 VanDerWaalsContact CE2-CE2 3.49Å; Y119-F123 AromaticContact CE2-CZ 3.93Å; Y119-F123 HydrophobicContact CE2-CZ 3.93Å; Y119-F123 HydrophobicContact CG-CE2 4.13Å; Y119-F123 AromaticContact CZ-CE2 3.25Å; Y119-F123 AromaticContact CZ-CZ 3.75Å; Y119-F123 WeakPolarHBondContact O-CD2 3.31Å; Y119-F123 WeakPolarHBondContact O-CE2 3.36Å; K120-F123 PolarHBondContact O-N 2.8Å; S121-F123 VanDerWaalsContact C-N 3.25Å; S121-F123 PolarHBondContact O-N 2.82Å
124	I	75.7	Confident	77.5	Confident	116 Å²	116	126.1 Å²	126.1	60%	0.595	65%	0.645	S	S	*	*	S	Bend	trans	-109.6	111.3	-176.8	-56.3	174	0	0	0	107.7	K120 E126	K120-I124 PolarHBondContact O-N 2.6Å; I124-E126 PolarHBondContact O-N 2.9Å
125	P	72.5	Confident	77	Confident	112 Å²	112	126.9 Å²	126.9	73%	0.727	66%	0.655	S	S	*	*			trans	-57.8	134.3	172.4	-20.5	31.6	0	0	0	110	K127	P125-K127 PolarHBondContact O-N 3.05Å
126	E	72.3	Confident	76.6	Confident	176 Å²	176	131.8 Å²	131.8	82%	0.822	68%	0.679	S	S	*	*			trans	-57.8	127	170.5	-69.9	-174.6	170.1	0	0	108.3	I124 D128	I124-E126 PolarHBondContact O-N 2.9Å; E126-D128 PolarHBondContact O-N 3.22Å
127	K	70.3	Confident	76.1	Confident	196 Å²	196	133.2 Å²	133.2	85%	0.852	69%	0.694	S	S	*	*			trans	-82.6	107.6	178.3	-164.4	179.9	-179.2	-177.1	0	106.8	P125 S129	P125-K127 PolarHBondContact O-N 3.05Å; K127-S129 PolarHBondContact O-N 3.34Å; K127-S129 VanDerWaalsContact O-N 3.09Å
128	D	70	Confident	75.6	Confident	155 Å²	155	133.3 Å²	133.3	83%	0.829	70%	0.7	S	S	*	*			trans	-53.7	116.8	172.8	-62.5	-37.2	0	0	0	108.4	E126	E126-D128 PolarHBondContact O-N 3.22Å
129	S	61.7	Low	75.1	Confident	195 Å²	195	139.9 Å²	139.9	100%	1.364	74%	0.738	S	S	*	*			trans	-73.9	0	171.7	-72.8	0	0	0	0	111.4	K127	K127-S129 PolarHBondContact O-N 3.34Å; K127-S129 VanDerWaalsContact O-N 3.09Å

Retrieved 129 of 129 residues in 47.4 ms (Link to these results)

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