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Exonuclease V

Single-stranded DNA (ssDNA) bidirectional exonuclease involved in DNA repair. Probably involved in DNA repair following ultraviolet (UV) irradiation and interstrand cross-links (ICLs) damage. Has both 5'-3' and 3'-5' exonuclease activities with a strong preference for 5'-ends. Acts as a sliding exonuclease that loads at ssDNA ends and then slides along the ssDNA prior to cutting; however the sliding and the 3'-5' exonuclease activities are abolished upon binding to the replication protein A (RPA) complex that enforces 5'-directionality activity.

AlphaFold DB , UniProt , Accession X6RCY3, Species HUMAN (Homo sapiens, Human), Gene EXO5, Length 247 aa.

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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	38.6	Very low	32.1	Very low	251 Å²	251	165.5 Å²	165.5	100%	1.236	87%	0.865	S	S	*	*				0	106.2	0	-80.5	177.1	164	0	0	106.1
2	A	35.2	Very low	32.1	Very low	101 Å²	101	158.8 Å²	158.8	84%	0.835	85%	0.851	S	S	*	*			trans	-87	126.9	176.9	0	0	0	0	0	107.3
3	E	33.7	Very low	32.2	Very low	196 Å²	196	160.8 Å²	160.8	92%	0.916	85%	0.852	S	S	*	*			trans	-114.2	102	168.2	-121.3	175.6	-179	0	0	106.7
4	T	31.1	Very low	32	Very low	128 Å²	128	155.3 Å²	155.3	79%	0.785	84%	0.841	S	S	*	*			trans	-71.6	117.5	170	38.9	0	0	0	0	108.2
5	R	31	Very low	32.4	Very low	243 Å²	243	148.7 Å²	148.7	92%	0.917	81%	0.811	S	S	*	*			trans	-90.6	111.5	168.8	-165.8	175.2	-176.4	167.3	-0.8	107.2	E7	R5-E7 PolarHBondContact O-N 3.41Å
6	E	32.9	Very low	32.3	Very low	182 Å²	182	140 Å²	140	85%	0.85	77%	0.767	S	S	*	*			trans	-65.4	123.4	175.2	-68.7	174.5	161.3	0	0	109.1	E8	E6-E8 PolarHBondContact O-N 3.31Å
7	E	30.3	Very low	32.5	Very low	179 Å²	179	135.6 Å²	135.6	84%	0.836	74%	0.739	S	S	*	*			trans	-77.5	106.3	165	-86.4	178.7	153.1	0	0	107.9	R5 T9	R5-E7 PolarHBondContact O-N 3.41Å; E7-T9 PolarHBondContact O-N 2.94Å; E7-T9 VanDerWaalsContact O-N 3.1Å
8	E	28.8	Very low	32.7	Very low	182 Å²	182	128.5 Å²	128.5	85%	0.85	70%	0.701	S	S	*	*			trans	-74.1	96.9	170.2	-146.2	173.6	-167.7	0	0	108	E6 V10	E6-E8 PolarHBondContact O-N 3.31Å; E8-V10 HydrophobicContact CG-CG2 4.39Å; E8-V10 PolarHBondContact O-N 3.36Å
9	T	31	Very low	32.6	Very low	127 Å²	127	126.2 Å²	126.2	78%	0.779	69%	0.687	S	S	*	*			trans	-79	91.5	174.7	35.1	0	0	0	0	108.8	E7	E7-T9 PolarHBondContact O-N 2.94Å; E7-T9 VanDerWaalsContact O-N 3.1Å
10	V	27.5	Very low	32.7	Very low	115 Å²	115	122.5 Å²	122.5	70%	0.697	67%	0.667	S	S	*	*			trans	-94.9	91.7	169.5	-177.1	0	0	0	0	108.1	E8 A12	E8-V10 HydrophobicContact CG-CG2 4.39Å; E8-V10 PolarHBondContact O-N 3.36Å; V10-A12 HydrophobicContact CG1-CB 4.28Å; V10-A12 PolarHBondContact O-N 2.99Å
11	S	33.5	Very low	33.1	Very low	116 Å²	116	119 Å²	119	81%	0.811	65%	0.652	S	S	*	*			trans	-73.9	95.3	161.5	-71.5	0	0	0	0	108.2
12	A	32	Very low	33.4	Very low	85 Å²	85	107.8 Å²	107.8	70%	0.702	60%	0.597	S	S	*	*			trans	-105.1	93.9	164.8	0	0	0	0	0	107.1	V10 A14	V10-A12 HydrophobicContact CG1-CB 4.28Å; V10-A12 PolarHBondContact O-N 2.99Å; A12-A14 PolarHBondContact O-N 2.96Å
13	E	33.7	Very low	33.5	Very low	185 Å²	185	105.5 Å²	105.5	86%	0.864	57%	0.574	S	S	*	*			trans	-72.9	115.1	169.7	-67.5	-175.9	158.4	0	0	107.4	S15	E13-S15 PolarHBondContact O-N 3.32Å
14	A	29.5	Very low	33.9	Very low	84 Å²	84	98.2 Å²	98.2	69%	0.694	54%	0.54	S	S	*	.			trans	-73	107.1	177.5	0	0	0	0	0	108.5	A12 G16	A12-A14 PolarHBondContact O-N 2.96Å; A14-G16 PolarHBondContact O-N 3.47Å
15	S	37.9	Very low	34.2	Very low	56 Å²	56	93.9 Å²	93.9	39%	0.392	51%	0.511	S	S	.	.			trans	-72.6	98	177.7	64	0	0	0	0	110.3	E13 T133	E13-S15 PolarHBondContact O-N 3.32Å; S15-T133 PolarHBondContact N-OG1 3.3Å; S15-T133 WeakPolarHBondContact OG-CG2 3.47Å; S15-T133 PolarHBondContact OG-OG1 2.82Å
16	G	29.8	Very low	34.4	Very low	10 Å²	10	83.7 Å²	83.7	10%	0.103	47%	0.474	C	S	.	.			trans	-80.2	157.7	170.7	0	0	0	0	0	111.7	A14 S18 D19	A14-G16 PolarHBondContact O-N 3.47Å; G16-S18 PolarHBondContact O-N 3.26Å; G16-D19 PolarHBondContact O-N 2.85Å; G16-D19 VanDerWaalsContact O-N 3.11Å
17	F	36.6	Very low	34.7	Very low	65 Å²	65	81.5 Å²	81.5	29%	0.285	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-60.9	-14.7	176.4	-104.5	-88.8	0	0	0	113.6	E125 L131 I145 N149	F17-E125 VanDerWaalsContact CB-OE1 3.23Å; F17-E125 WeakPolarHBondContact CB-OE1 3.13Å; F17-E125 WeakPolarHBondContact CB-OE2 3.43Å; F17-L131 HydrophobicContact CB-CD2 4.39Å; F17-I145 HydrophobicContact CE2-CG2 4.04Å; F17-I145 HydrophobicContact CZ-CG2 3.63Å; F17-N149 WeakPolarHBondContact CE1-ND2 3.21Å; F17-N149 WeakPolarHBondContact CE2-ND2 3.27Å; F17-N149 WeakPolarHBondContact CZ-ND2 3.1Å
18	S	35.8	Very low	34.7	Very low	8 Å²	8	79.1 Å²	79.1	6%	0.056	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-82.7	-6.4	175.4	64.3	0	0	0	0	116.6	G16 L20 L122	G16-S18 PolarHBondContact O-N 3.26Å; S18-L20 PolarHBondContact O-N 2.97Å; S18-L20 VanDerWaalsContact O-N 3.09Å; S18-L122 VanDerWaalsContact CB-CA 3.4Å; S18-L122 WeakPolarHBondContact OG-CB 3.34Å; S18-L122 WeakPolarHBondContact OG-CD1 3.36Å; S18-L122 WeakPolarHBondContact OG-CD2 3.28Å; S18-L122 WeakPolarHBondContact OG-CG 3.11Å
19	D	30.2	Very low	35	Very low	84 Å²	84	72.5 Å²	72.5	45%	0.449	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-69.5	-2.1	176.5	-74.8	-13.9	0	0	0	111.8	G16	G16-D19 PolarHBondContact O-N 2.85Å; G16-D19 VanDerWaalsContact O-N 3.11Å
20	L	35.8	Very low	35.2	Very low	53 Å²	53	70.3 Å²	70.3	28%	0.277	41%	0.405	S	S	.	.			trans	-137.9	88.1	-174.8	-52.9	170.4	0	0	0	108.8	S18 E24 F25	S18-L20 PolarHBondContact O-N 2.97Å; S18-L20 VanDerWaalsContact O-N 3.09Å; L20-E24 HydrophobicContact CB-CB 4.31Å; L20-E24 HydrophobicContact CD2-CB 3.96Å; L20-E24 WeakPolarHBondContact CD2-O 3.49Å; L20-F25 HydrophobicContact CB-CB 3.95Å; L20-F25 HydrophobicContact CB-CD2 3.91Å; L20-F25 HydrophobicContact CB-CG 4.41Å; L20-F25 HydrophobicContact CD1-CB 4.19Å; L20-F25 HydrophobicContact CD1-CD2 3.25Å; L20-F25 HydrophobicContact CD1-CE2 3.8Å; L20-F25 HydrophobicContact CD1-CG 3.92Å; L20-F25 HydrophobicContact CG-CB 4.47Å; L20-F25 HydrophobicContact CG-CD2 4.16Å
21	S	41.3	Very low	35.7	Very low	50 Å²	50	71.1 Å²	71.1	35%	0.35	40%	0.404	S	S	.	.			trans	-43.8	148.4	148	164.7	0	0	0	0	107.9	S23 E24 F25	S21-S23 CarbonylContact O-C 3.59Å; S21-S23 PolarHBondContact O-N 2.99Å; S21-E24 PolarHBondContact N-OE2 3.24Å; S21-E24 VanDerWaalsContact N-OE2 3.13Å; S21-E24 PolarHBondContact O-N 3.21Å; S21-F25 PolarHBondContact O-N 3.13Å
22	D	43.3	Very low	36	Very low	15 Å²	15	70.5 Å²	70.5	8%	0.08	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44	-22.2	178.3	-88.3	-15	0	0	0	113.6	Y82 T84 Y221	D22-Y82 HydrophobicContact CB-CD1 4.42Å; D22-Y82 HydrophobicContact CB-CG 4.5Å; D22-T84 HydrophobicContact CB-CG2 4.21Å; D22-T84 WeakPolarHBondContact CB-OG1 3.33Å; D22-T84 VanDerWaalsContact OD2-CB 3.24Å; D22-T84 WeakPolarHBondContact OD2-CB 3.34Å; D22-T84 PolarHBondContact OD2-N 3.22Å; D22-T84 PolarHBondContact OD2-OG1 3.19Å; D22-Y221 PolarHBondContact OD2-OH 2.9Å
23	S	38.3	Very low	36.2	Very low	52 Å²	52	69.6 Å²	69.6	36%	0.364	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-22.5	176	-44.1	0	0	0	0	116.4	S21 L26	S21-S23 CarbonylContact O-C 3.59Å; S21-S23 PolarHBondContact O-N 2.99Å; S23-L26 WeakPolarHBondContact O-CB 3.04Å; S23-L26 WeakPolarHBondContact O-CD1 3.5Å
24	E	40.6	Very low	36.3	Very low	44 Å²	44	62.8 Å²	62.8	21%	0.206	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-20.7	-179	-77.1	166.3	175.1	0	0	111.5	L20 S21 L26 E27	L20-E24 HydrophobicContact CB-CB 4.31Å; L20-E24 HydrophobicContact CD2-CB 3.96Å; L20-E24 WeakPolarHBondContact CD2-O 3.49Å; S21-E24 PolarHBondContact N-OE2 3.24Å; S21-E24 VanDerWaalsContact N-OE2 3.13Å; S21-E24 PolarHBondContact O-N 3.21Å; E24-L26 PolarHBondContact O-N 3.21Å; E24-E27 PolarHBondContact O-N 2.91Å
25	F	38.2	Very low	36.5	Very low	36 Å²	36	66 Å²	66	16%	0.158	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-18.5	168.4	-152.3	-86.9	0	0	0	112.6	L20 S21 L29 Y82	L20-F25 HydrophobicContact CB-CB 3.95Å; L20-F25 HydrophobicContact CB-CD2 3.91Å; L20-F25 HydrophobicContact CB-CG 4.41Å; L20-F25 HydrophobicContact CD1-CB 4.19Å; L20-F25 HydrophobicContact CD1-CD2 3.25Å; L20-F25 HydrophobicContact CD1-CE2 3.8Å; L20-F25 HydrophobicContact CD1-CG 3.92Å; L20-F25 HydrophobicContact CG-CB 4.47Å; L20-F25 HydrophobicContact CG-CD2 4.16Å; S21-F25 PolarHBondContact O-N 3.13Å; F25-L29 HydrophobicContact CD1-CD1 3.64Å; F25-L29 HydrophobicContact CD1-CG 3.91Å; F25-L29 HydrophobicContact CE1-CD1 3.4Å; F25-L29 HydrophobicContact CE1-CD2 4.35Å; F25-L29 HydrophobicContact CE1-CG 3.75Å; F25-L29 PolarHBondContact O-N 3.08Å; F25-Y82 WeakPolarHBondContact CD1-OH 3.47Å
26	L	35.8	Very low	36.3	Very low	29 Å²	29	70.6 Å²	70.6	15%	0.152	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-36.1	169.7	-82.1	132.5	0	0	0	112.8	S23 E24 F28 D30 Y82	S23-L26 WeakPolarHBondContact O-CB 3.04Å; S23-L26 WeakPolarHBondContact O-CD1 3.5Å; E24-L26 PolarHBondContact O-N 3.21Å; L26-F28 PolarHBondContact O-N 3.35Å; L26-D30 WeakPolarHBondContact O-CB 3.24Å; L26-D30 PolarHBondContact O-N 3.31Å; L26-Y82 HydrophobicContact CG-CE2 4.47Å
27	E	39.1	Very low	36.6	Very low	137 Å²	137	73.3 Å²	73.3	64%	0.64	38%	0.381	S	S	*	.	H	α-helix	trans	-74.1	-29.4	-175.3	-67.5	-164.2	167.8	0	0	112.8	E24	E24-E27 PolarHBondContact O-N 2.91Å
28	F	30.4	Very low	36.5	Very low	129 Å²	129	77.5 Å²	77.5	57%	0.566	40%	0.399	S	S	*	.	H	α-helix	trans	-80.8	-37.1	177.5	-164.2	-97.9	0	0	0	113.1	L26	L26-F28 PolarHBondContact O-N 3.35Å
29	L	34.2	Very low	36.3	Very low	42 Å²	42	80.9 Å²	80.9	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-82.5	-28.5	178.8	-71.6	-170.6	0	0	0	114.2	F25 L31 Y80	F25-L29 HydrophobicContact CD1-CD1 3.64Å; F25-L29 HydrophobicContact CD1-CG 3.91Å; F25-L29 HydrophobicContact CE1-CD1 3.4Å; F25-L29 HydrophobicContact CE1-CD2 4.35Å; F25-L29 HydrophobicContact CE1-CG 3.75Å; F25-L29 PolarHBondContact O-N 3.08Å; L29-L31 VanDerWaalsContact C-N 3.26Å; L29-L31 PolarHBondContact O-N 2.67Å; L29-Y80 WeakPolarHBondContact CD1-OH 3.44Å
30	D	36.7	Very low	36.5	Very low	82 Å²	82	84.3 Å²	84.3	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-78.5	-10	-180	-70.7	-21.1	0	0	0	112.9	L26 E32 A34	L26-D30 WeakPolarHBondContact O-CB 3.24Å; L26-D30 PolarHBondContact O-N 3.31Å; D30-E32 VanDerWaalsContact C-N 3.26Å; D30-E32 PolarHBondContact O-N 3.43Å; D30-A34 WeakPolarHBondContact O-CB 3.42Å; D30-A34 PolarHBondContact O-N 3.45Å; D30-A34 VanDerWaalsContact O-N 3.08Å
31	L	36.5	Very low	36.4	Very low	131 Å²	131	87 Å²	87	69%	0.686	46%	0.463	S	S	*	.	H	α-helix	trans	-65.3	-31.8	178	-129.7	83	0	0	0	112.2	L29	L29-L31 VanDerWaalsContact C-N 3.26Å; L29-L31 PolarHBondContact O-N 2.67Å
32	E	40.3	Very low	35.7	Very low	103 Å²	103	91.2 Å²	91.2	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-83.6	-41	-178.8	-66.6	-172.3	156	0	0	112.5	D30 A34 Q35	D30-E32 VanDerWaalsContact C-N 3.26Å; D30-E32 PolarHBondContact O-N 3.43Å; E32-A34 VanDerWaalsContact C-N 3.3Å; E32-A34 PolarHBondContact O-N 2.93Å; E32-Q35 PolarHBondContact O-N 3.09Å
33	D	36.2	Very low	35.4	Very low	67 Å²	67	98.2 Å²	98.2	36%	0.358	52%	0.516	S	S	.	.	H	α-helix	trans	-73.2	-23	178.1	-75.1	-2.9	0	0	0	111.5	Q35 S37 K139	D33-Q35 VanDerWaalsContact C-N 3.31Å; D33-Q35 PolarHBondContact O-N 2.85Å; D33-S37 PolarHBondContact O-N 3.29Å; D33-S37 PolarHBondContact O-OG 3.48Å; D33-K139 IonicContact OD1-NZ 2.72Å; D33-K139 PolarHBondContact OD1-NZ 2.95Å; D33-K139 IonicContact OD2-NZ 3.39Å; D33-K139 PolarHBondContact OD2-NZ 3.4Å
34	A	36.1	Very low	35	Very low	41 Å²	41	101.4 Å²	101.4	34%	0.339	54%	0.535	S	S	.	.	H	α-helix	trans	-71.1	-22.4	172.2	0	0	0	0	0	113.6	D30 E32 S37 K38	D30-A34 WeakPolarHBondContact O-CB 3.42Å; D30-A34 PolarHBondContact O-N 3.45Å; D30-A34 VanDerWaalsContact O-N 3.08Å; E32-A34 VanDerWaalsContact C-N 3.3Å; E32-A34 PolarHBondContact O-N 2.93Å; A34-S37 PolarHBondContact O-N 3.08Å; A34-K38 WeakPolarHBondContact O-CG 3.44Å; A34-K38 PolarHBondContact O-N 3.11Å
35	Q	33.6	Very low	34.5	Very low	152 Å²	152	102.3 Å²	102.3	71%	0.71	56%	0.556	S	S	*	*	H	α-helix	trans	-80.6	-32.9	-177.4	-159	157.3	-5.1	0	0	112.2	E32 D33 S37	E32-Q35 PolarHBondContact O-N 3.09Å; D33-Q35 VanDerWaalsContact C-N 3.31Å; D33-Q35 PolarHBondContact O-N 2.85Å; Q35-S37 VanDerWaalsContact C-N 3.35Å
36	E	34.4	Very low	34.3	Very low	153 Å²	153	107.2 Å²	107.2	72%	0.715	59%	0.592	S	S	*	*	H	α-helix	trans	-68.1	-35.9	166.3	-76.6	-168.1	151.7	0	0	111.7	A39	E36-A39 PolarHBondContact O-N 3Å
37	S	36.2	Very low	33.9	Very low	67 Å²	67	111.3 Å²	111.3	47%	0.469	62%	0.623	S	S	.	*	H	α-helix	trans	-70.6	-34.4	-179.5	-56.3	0	0	0	0	113.3	D33 A34 Q35 A39 L40	D33-S37 PolarHBondContact O-N 3.29Å; D33-S37 PolarHBondContact O-OG 3.48Å; A34-S37 PolarHBondContact O-N 3.08Å; Q35-S37 VanDerWaalsContact C-N 3.35Å; S37-A39 VanDerWaalsContact C-N 3.26Å; S37-A39 PolarHBondContact O-N 3.13Å; S37-L40 PolarHBondContact O-N 3.2Å; S37-L40 VanDerWaalsContact O-N 3.16Å
38	K	32.6	Very low	34	Very low	152 Å²	152	110.1 Å²	110.1	66%	0.661	63%	0.63	S	S	*	*	H	α-helix	trans	-67.5	-23	176.9	-81.3	174.1	-178	172	0	113.3	A34 L40	A34-K38 WeakPolarHBondContact O-CG 3.44Å; A34-K38 PolarHBondContact O-N 3.11Å; K38-L40 PolarHBondContact O-N 2.99Å
39	A	32.1	Very low	33.9	Very low	79 Å²	79	113.4 Å²	113.4	65%	0.653	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-23	174	0	0	0	0	0	112.7	E36 S37	E36-A39 PolarHBondContact O-N 3Å; S37-A39 VanDerWaalsContact C-N 3.26Å; S37-A39 PolarHBondContact O-N 3.13Å
40	L	35.9	Very low	33.8	Very low	156 Å²	156	116.7 Å²	116.7	82%	0.817	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-9.5	-179.7	-79.9	159.9	0	0	0	114.1	S37 K38	S37-L40 PolarHBondContact O-N 3.2Å; S37-L40 VanDerWaalsContact O-N 3.16Å; K38-L40 PolarHBondContact O-N 2.99Å
41	V	33	Very low	33.5	Very low	109 Å²	109	121.4 Å²	121.4	66%	0.661	70%	0.698	S	S	*	*			trans	-126.6	57	-176.9	-164.1	0	0	0	0	111.1
42	N	27.3	Very low	33.1	Very low	139 Å²	139	118.8 Å²	118.8	74%	0.743	70%	0.703	S	S	*	*			trans	-92.4	90.8	160.9	-81	-35.7	0	0	0	108.9
43	M	35.7	Very low	33.1	Very low	163 Å²	163	123.6 Å²	123.6	80%	0.803	72%	0.722	S	S	*	*			trans	-104.1	128.3	161.3	-71	-61	-68	0	0	108.9
44	P	30.7	Very low	33.2	Very low	118 Å²	118	127.9 Å²	127.9	77%	0.766	75%	0.745	S	S	*	*			trans	-73.7	141.2	-178.5	28.8	-31.1	0	0	0	111.3
45	G	30	Very low	33.3	Very low	63 Å²	63	133.8 Å²	133.8	65%	0.649	77%	0.771	S	S	*	*			trans	-65.5	162.3	176.4	0	0	0	0	0	113.6	S47	G45-S47 PolarHBondContact O-N 3.3Å
46	P	32.9	Very low	33.7	Very low	139 Å²	139	135.7 Å²	135.7	90%	0.903	78%	0.777	S	S	*	*			trans	-85.1	112.1	-164	33	-30.9	0	0	0	111.4
47	S	28.4	Very low	33.8	Very low	115 Å²	115	134 Å²	134	80%	0.804	78%	0.779	S	S	*	*			trans	-94	125.5	156.1	50.1	0	0	0	0	109.2	G45	G45-S47 PolarHBondContact O-N 3.3Å
48	S	40.6	Very low	34.1	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	80%	0.796	S	S	*	*			trans	-55	125.7	178.2	50.8	0	0	0	0	113.4
49	E	28.1	Very low	34.6	Very low	197 Å²	197	133.3 Å²	133.3	92%	0.921	78%	0.779	S	S	*	*			trans	-172.4	146.4	137.5	-104.9	169.7	-162.3	0	0	111
50	S	32.8	Very low	35.1	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	78%	0.781	S	S	*	*			trans	-84	156.2	-166.9	54.6	0	0	0	0	115
51	L	30.1	Very low	35.6	Very low	181 Å²	181	134.3 Å²	134.3	95%	0.948	77%	0.77	S	S	*	*			trans	119.4	116.6	135.7	-157.3	78.9	0	0	0	115.6
52	G	28.3	Very low	35.9	Very low	77 Å²	77	133.8 Å²	133.8	79%	0.794	76%	0.763	S	S	*	*			trans	140.3	107	159.5	0	0	0	0	0	114.3
53	K	39.2	Very low	36.6	Very low	204 Å²	204	136.6 Å²	136.6	89%	0.887	76%	0.763	S	S	*	*			trans	-69.6	127.7	174.9	-78.1	166.5	167	171.3	0	111.4
54	D	39	Very low	37.1	Very low	157 Å²	157	135.5 Å²	135.5	84%	0.84	75%	0.754	S	S	*	*				173.4	86.7	118.7	-97.5	-19.3	0	0	0	109
55	D	37.5	Very low	37.9	Very low	164 Å²	164	136.5 Å²	136.5	88%	0.877	74%	0.743	S	S	*	*			trans	-127.4	113.4	167.2	-86.9	-42.1	0	0	0	109
56	K	42	Very low	39	Very low	192 Å²	192	135.4 Å²	135.4	84%	0.835	73%	0.731	S	S	*	*			trans	-59.7	133	167.6	-72.8	175.6	179.6	173.6	0	107.4	I58	K56-I58 PolarHBondContact O-N 3.05Å
57	P	37	Very low	39.9	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	71%	0.705	S	S	*	*			trans	-62.6	116.5	175.8	25.9	-31.4	0	0	0	107.9	S59	P57-S59 VanDerWaalsContact C-N 3.34Å; P57-S59 PolarHBondContact O-N 3.24Å
58	I	43.7	Very low	41.3	Very low	160 Å²	160	132.8 Å²	132.8	82%	0.821	70%	0.701	S	S	*	*			trans	-57	107.7	164.4	-67.8	169.4	0	0	0	105.2	K56 L60	K56-I58 PolarHBondContact O-N 3.05Å; I58-L60 PolarHBondContact O-N 3.34Å; I58-L60 VanDerWaalsContact O-N 3.15Å
59	S	42.9	Very low	42.8	Very low	43 Å²	43	134.2 Å²	134.2	30%	0.301	70%	0.698	S	S	.	*			trans	-60.3	118.5	-170.6	177.1	0	0	0	0	110	P57 Q61 N62	P57-S59 VanDerWaalsContact C-N 3.34Å; P57-S59 PolarHBondContact O-N 3.24Å; S59-Q61 PolarHBondContact O-N 3.34Å; S59-Q61 VanDerWaalsContact OG-CB 3.3Å; S59-Q61 WeakPolarHBondContact OG-CB 3.42Å; S59-Q61 PolarHBondContact OG-N 2.81Å; S59-N62 PolarHBondContact O-N 3.05Å
60	L	43	Very low	45.4	Very low	131 Å²	131	128.9 Å²	128.9	69%	0.686	68%	0.675	S	S	*	*	H	α-helix	trans	-47.9	-21	166.1	-91.1	155.7	0	0	0	112.9	I58 K64	I58-L60 PolarHBondContact O-N 3.34Å; I58-L60 VanDerWaalsContact O-N 3.15Å; L60-K64 WeakPolarHBondContact O-CG 3.4Å; L60-K64 PolarHBondContact O-N 3.49Å
61	Q	44.8	Very low	47.9	Very low	125 Å²	125	125.9 Å²	125.9	58%	0.584	65%	0.654	S	S	*	*	H	α-helix	trans	-73.8	-28.9	175.8	-55.3	-175.4	-10.5	0	0	113.1	S59 R65	S59-Q61 PolarHBondContact O-N 3.34Å; S59-Q61 VanDerWaalsContact OG-CB 3.3Å; S59-Q61 WeakPolarHBondContact OG-CB 3.42Å; S59-Q61 PolarHBondContact OG-N 2.81Å; Q61-R65 WeakPolarHBondContact O-CB 3.43Å; Q61-R65 VanDerWaalsContact O-CG 3.28Å; Q61-R65 WeakPolarHBondContact O-CG 3.35Å; Q61-R65 PolarHBondContact O-N 2.9Å; Q61-R65 VanDerWaalsContact O-N 3.15Å; Q61-R65 PolarHBondContact O-NE 2.96Å
62	N	40.6	Very low	50.5	Low	98 Å²	98	121.6 Å²	121.6	52%	0.524	64%	0.637	S	S	.	*	H	α-helix	trans	-73.6	-34.2	177	-83.1	-7.5	0	0	0	112.3	S59 R65 G66	S59-N62 PolarHBondContact O-N 3.05Å; N62-R65 PolarHBondContact OD1-NE 3.28Å; N62-R65 PolarHBondContact OD1-NH2 3.16Å; N62-G66 PolarHBondContact O-N 3.31Å
63	W	40.8	Very low	53.3	Low	198 Å²	198	119.7 Å²	119.7	75%	0.75	61%	0.608	S	S	*	*	H	α-helix	trans	-70.6	-39.3	178	-142	-21.6	0	0	0	111.9	G66 L67	W63-G66 PolarHBondContact O-N 2.85Å; W63-L67 PolarHBondContact O-N 3.46Å
64	K	47.3	Very low	55.6	Low	141 Å²	141	115 Å²	115	61%	0.613	59%	0.589	S	S	*	*	H	α-helix	trans	-64.5	-43.8	173.6	-70.3	-176.9	177.6	-167.6	0	112.2	L60 G66 L67 D68	L60-K64 WeakPolarHBondContact O-CG 3.4Å; L60-K64 PolarHBondContact O-N 3.49Å; K64-G66 PolarHBondContact O-N 2.99Å; K64-L67 PolarHBondContact O-N 2.73Å; K64-L67 VanDerWaalsContact O-N 3.15Å; K64-D68 VanDerWaalsContact O-CG 3.27Å; K64-D68 PolarHBondContact O-N 3.49Å; K64-D68 VanDerWaalsContact O-N 3.07Å
65	R	47.3	Very low	57.9	Low	138 Å²	138	111.8 Å²	111.8	52%	0.521	57%	0.565	S	S	.	*	H	α-helix	trans	-60.1	-28.5	178.9	-81.6	-172.4	-76.6	-128.2	0.1	114.7	Q61 N62	Q61-R65 WeakPolarHBondContact O-CB 3.43Å; Q61-R65 VanDerWaalsContact O-CG 3.28Å; Q61-R65 WeakPolarHBondContact O-CG 3.35Å; Q61-R65 PolarHBondContact O-N 2.9Å; Q61-R65 VanDerWaalsContact O-N 3.15Å; Q61-R65 PolarHBondContact O-NE 2.96Å; N62-R65 PolarHBondContact OD1-NE 3.28Å; N62-R65 PolarHBondContact OD1-NH2 3.16Å
66	G	51.8	Low	60.1	Low	40 Å²	40	106.4 Å²	106.4	41%	0.412	53%	0.534	S	S	.	.	H	α-helix	trans	-83.5	-31.6	176.4	0	0	0	0	0	113.8	N62 W63 K64	N62-G66 PolarHBondContact O-N 3.31Å; W63-G66 PolarHBondContact O-N 2.85Å; K64-G66 PolarHBondContact O-N 2.99Å
67	L	52.7	Low	62.3	Low	65 Å²	65	105 Å²	105	34%	0.34	53%	0.531	S	S	.	.	H	α-helix	trans	-74.4	-29	176.1	-104.5	72.8	0	0	0	112.8	W63 K64 I69 L70	W63-L67 PolarHBondContact O-N 3.46Å; K64-L67 PolarHBondContact O-N 2.73Å; K64-L67 VanDerWaalsContact O-N 3.15Å; L67-I69 PolarHBondContact O-N 2.83Å; L67-L70 PolarHBondContact O-N 2.83Å
68	D	57.6	Low	64.6	Low	135 Å²	135	101.5 Å²	101.5	72%	0.722	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.6	-180	-70.5	-27.4	0	0	0	113.9	K64	K64-D68 VanDerWaalsContact O-CG 3.27Å; K64-D68 PolarHBondContact O-N 3.49Å; K64-D68 VanDerWaalsContact O-N 3.07Å
69	I	72.9	Confident	66.7	Low	143 Å²	143	96.8 Å²	96.8	73%	0.733	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-21.1	-179.7	-57.4	171	0	0	0	111.8	L67	L67-I69 PolarHBondContact O-N 2.83Å
70	L	81.4	Confident	69.1	Low	85 Å²	85	96 Å²	96	45%	0.445	47%	0.469	S	S	.	.	S	Bend	trans	-83.8	139.4	-178.2	-62.8	177.4	0	0	0	110.9	L67 E74 R75	L67-L70 PolarHBondContact O-N 2.83Å; L70-E74 HydrophobicContact CB-CB 4.22Å; L70-E74 HydrophobicContact CD2-CB 4.35Å; L70-R75 HydrophobicContact CB-CB 4.42Å
71	S	85.8	Confident	71.4	Confident	47 Å²	47	91.2 Å²	91.2	33%	0.329	44%	0.444	S	S	.	.			trans	-62.6	154.4	168.3	66.2	0	0	0	0	110.5	M73 E74 R75	S71-M73 PolarHBondContact O-N 3.46Å; S71-E74 WeakPolarHBondContact CB-OE2 3.15Å; S71-E74 PolarHBondContact N-OE2 3.15Å; S71-E74 PolarHBondContact O-N 2.94Å; S71-E74 VanDerWaalsContact OG-CD 3.25Å; S71-E74 VanDerWaalsContact OG-CG 3.27Å; S71-E74 WeakPolarHBondContact OG-CG 3.44Å; S71-E74 PolarHBondContact OG-N 3.44Å; S71-E74 PolarHBondContact OG-OE2 3.27Å; S71-R75 WeakPolarHBondContact O-CB 3.39Å; S71-R75 PolarHBondContact O-N 3.36Å
72	P	85.9	Confident	73.6	Confident	91 Å²	91	86 Å²	86	59%	0.591	42%	0.419	S	S	*	.	H	α-helix	trans	-53.6	-36.1	174.3	-28.3	35.9	0	0	0	113.3	R75 F76	P72-R75 PolarHBondContact O-N 2.74Å; P72-F76 HydrophobicContact CB-CD2 4.38Å; P72-F76 HydrophobicContact CB-CE2 4.48Å; P72-F76 WeakPolarHBondContact O-CB 3.39Å; P72-F76 WeakPolarHBondContact O-CD2 3.04Å; P72-F76 PolarHBondContact O-N 2.99Å
73	M	86.2	Confident	76.1	Confident	38 Å²	38	81.4 Å²	81.4	19%	0.187	39%	0.394	C	S	.	.	H	α-helix	trans	-59.8	-47.8	175.6	-66.7	-60.8	-69.9	0	0	111.8	S71 H77 L78 L81 V175	S71-M73 PolarHBondContact O-N 3.46Å; M73-H77 CarbonylContact O-C 3.53Å; M73-H77 WeakPolarHBondContact O-CA 3.33Å; M73-H77 PolarHBondContact O-N 2.98Å; M73-L78 HydrophobicContact CE-CB 3.8Å; M73-L78 VanDerWaalsContact CE-O 3.26Å; M73-L78 WeakPolarHBondContact CE-O 3.24Å; M73-L78 PolarHBondContact O-N 3.38Å; M73-L78 HydrophobicContact SD-CB 3.91Å; M73-L78 HydrophobicContact SD-CD1 4.44Å; M73-L81 HydrophobicContact CE-CG 4.48Å; M73-L81 HydrophobicContact SD-CD1 4.11Å; M73-L81 HydrophobicContact SD-CD2 3.62Å; M73-L81 HydrophobicContact SD-CG 3.73Å; M73-V175 HydrophobicContact CE-CG1 3.98Å; M73-V175 HydrophobicContact SD-CG1 4.05Å
74	E	87.4	Confident	78.4	Confident	106 Å²	106	72.9 Å²	72.9	50%	0.495	37%	0.365	S	S	.	.	H	α-helix	trans	-69.4	-43.7	178.3	-68.5	161.4	140.8	0	0	111.6	L70 S71 F76 H77	L70-E74 HydrophobicContact CB-CB 4.22Å; L70-E74 HydrophobicContact CD2-CB 4.35Å; S71-E74 WeakPolarHBondContact CB-OE2 3.15Å; S71-E74 PolarHBondContact N-OE2 3.15Å; S71-E74 PolarHBondContact O-N 2.94Å; S71-E74 VanDerWaalsContact OG-CD 3.25Å; S71-E74 VanDerWaalsContact OG-CG 3.27Å; S71-E74 WeakPolarHBondContact OG-CG 3.44Å; S71-E74 PolarHBondContact OG-N 3.44Å; S71-E74 PolarHBondContact OG-OE2 3.27Å; E74-F76 VanDerWaalsContact C-N 3.29Å; E74-F76 PolarHBondContact O-N 3.41Å; E74-H77 PolarHBondContact O-N 3.12Å; E74-H77 VanDerWaalsContact O-N 3.16Å
75	R	87.3	Confident	80.3	Confident	89 Å²	89	67.1 Å²	67.1	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-40.9	-178.4	-178.5	178.4	-179.8	-160.8	-4.8	112.2	L70 S71 P72 E101	L70-R75 HydrophobicContact CB-CB 4.42Å; S71-R75 WeakPolarHBondContact O-CB 3.39Å; S71-R75 PolarHBondContact O-N 3.36Å; P72-R75 PolarHBondContact O-N 2.74Å; R75-E101 IonicContact CZ-OE1 3.93Å; R75-E101 IonicContact NH1-OE1 2.61Å; R75-E101 PolarHBondContact NH1-OE1 2.87Å; R75-E101 VanDerWaalsContact NH2-CD 3.34Å; R75-E101 IonicContact NH2-OE1 2.69Å; R75-E101 PolarHBondContact NH2-OE1 3.11Å
76	F	84.6	Confident	82.3	Confident	50 Å²	50	61.8 Å²	61.8	22%	0.219	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	9.5	-179	-60.3	-58.3	0	0	0	112.9	P72 E74 L78 K100 E101	P72-F76 HydrophobicContact CB-CD2 4.38Å; P72-F76 HydrophobicContact CB-CE2 4.48Å; P72-F76 WeakPolarHBondContact O-CB 3.39Å; P72-F76 WeakPolarHBondContact O-CD2 3.04Å; P72-F76 PolarHBondContact O-N 2.99Å; E74-F76 VanDerWaalsContact C-N 3.29Å; E74-F76 PolarHBondContact O-N 3.41Å; F76-L78 HydrophobicContact CB-CD1 3.85Å; F76-L78 HydrophobicContact CB-CD2 4.29Å; F76-L78 HydrophobicContact CB-CG 3.69Å; F76-L78 PolarHBondContact O-N 3.14Å; F76-L78 VanDerWaalsContact O-N 3.13Å; F76-K100 HydrophobicContact CD1-CB 3.79Å; F76-K100 HydrophobicContact CD2-CB 4.47Å; F76-K100 HydrophobicContact CE1-CB 3.78Å; F76-K100 HydrophobicContact CE2-CB 4.47Å; F76-K100 HydrophobicContact CG-CB 4.16Å; F76-K100 HydrophobicContact CZ-CB 4.13Å; F76-E101 HydrophobicContact CE1-CG 3.73Å; F76-E101 HydrophobicContact CZ-CG 4.13Å
77	H	86.7	Confident	84.1	Confident	164 Å²	164	59.9 Å²	59.9	76%	0.759	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	32.8	-178.7	-54.9	87.6	0	0	0	113.9	M73 E74	M73-H77 CarbonylContact O-C 3.53Å; M73-H77 WeakPolarHBondContact O-CA 3.33Å; M73-H77 PolarHBondContact O-N 2.98Å; E74-H77 PolarHBondContact O-N 3.12Å; E74-H77 VanDerWaalsContact O-N 3.16Å
78	L	86.4	Confident	85.6	Confident	45 Å²	45	59 Å²	59	24%	0.236	30%	0.3	C	S	.	.			trans	-80.4	138.4	-177.5	-57.4	174.6	0	0	0	110.1	M73 F76 L81	M73-L78 HydrophobicContact CE-CB 3.8Å; M73-L78 VanDerWaalsContact CE-O 3.26Å; M73-L78 WeakPolarHBondContact CE-O 3.24Å; M73-L78 PolarHBondContact O-N 3.38Å; M73-L78 HydrophobicContact SD-CB 3.91Å; M73-L78 HydrophobicContact SD-CD1 4.44Å; F76-L78 HydrophobicContact CB-CD1 3.85Å; F76-L78 HydrophobicContact CB-CD2 4.29Å; F76-L78 HydrophobicContact CB-CG 3.69Å; F76-L78 PolarHBondContact O-N 3.14Å; F76-L78 VanDerWaalsContact O-N 3.13Å; L78-L81 HydrophobicContact CD1-CD2 3.62Å
79	K	88.3	Confident	87	Confident	60 Å²	60	56.3 Å²	56.3	26%	0.261	28%	0.283	S	S	.	.	S	Bend	trans	-93.1	-31.1	171.3	-67.1	-176.3	175.3	-168.2	0	112.4	T242	K79-T242 WeakPolarHBondContact CD-O 3.4Å; K79-T242 PolarHBondContact NZ-O 3.44Å
80	Y	91.4	Very high	87.5	Confident	26 Å²	26	52.5 Å²	52.5	10%	0.102	26%	0.264	C	S	.	.	S	Bend	trans	-152.4	167.2	-179.2	50.5	-98.2	0	0	0	109.3	L29 Y82 W143 L176 V178	L29-Y80 WeakPolarHBondContact CD1-OH 3.44Å; Y80-Y82 AromaticContact CE2-CE1 3.95Å; Y80-Y82 HydrophobicContact CE2-CE1 3.95Å; Y80-Y82 AromaticContact CE2-CE2 3.93Å; Y80-Y82 HydrophobicContact CE2-CE2 3.93Å; Y80-Y82 AromaticContact CE2-CZ 3.53Å; Y80-Y82 WeakPolarHBondContact CE2-OH 3.3Å; Y80-Y82 PolarHBondContact OH-OH 3.47Å; Y80-W143 HydrophobicContact CD1-CZ2 4.47Å; Y80-W143 HydrophobicContact CE1-CZ2 4.4Å; Y80-L176 CarbonylContact C-O 3.54Å; Y80-L176 WeakPolarHBondContact CA-O 3.48Å; Y80-L176 WeakPolarHBondContact CB-O 3.37Å; Y80-L176 HydrophobicContact CD1-CD2 4.42Å; Y80-V178 HydrophobicContact CD1-CG2 4.44Å; Y80-V178 HydrophobicContact CD2-CB 3.91Å; Y80-V178 HydrophobicContact CD2-CG2 3.53Å; Y80-V178 HydrophobicContact CE2-CB 4.26Å; Y80-V178 HydrophobicContact CE2-CG2 4.06Å; Y80-V178 HydrophobicContact CG-CG2 3.74Å
81	L	91.4	Very high	87.4	Confident	32 Å²	32	56.9 Å²	56.9	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.3	178.6	-62.8	178.5	0	0	0	110.8	M73 L78 L86 V175 L176 L177 V178	M73-L81 HydrophobicContact CE-CG 4.48Å; M73-L81 HydrophobicContact SD-CD1 4.11Å; M73-L81 HydrophobicContact SD-CD2 3.62Å; M73-L81 HydrophobicContact SD-CG 3.73Å; L78-L81 HydrophobicContact CD1-CD2 3.62Å; L81-L86 HydrophobicContact CB-CD1 4.29Å; L81-L86 HydrophobicContact CB-CG 4.24Å; L81-L86 HydrophobicContact CD1-CD1 4.42Å; L81-L86 HydrophobicContact CD1-CD2 3.84Å; L81-L86 HydrophobicContact CD1-CG 4.3Å; L81-V175 HydrophobicContact CB-CG1 4.48Å; L81-V175 HydrophobicContact CD1-CG1 3.8Å; L81-V175 HydrophobicContact CG-CG1 3.84Å; L81-L176 PolarHBondContact N-O 3.43Å; L81-L177 HydrophobicContact CB-CD2 3.95Å; L81-L177 CarbonylContact O-C 3.51Å; L81-L177 WeakPolarHBondContact O-CA 3.41Å; L81-V178 PolarHBondContact O-N 3.5Å
82	Y	91.7	Very high	87.3	Confident	16 Å²	16	56.9 Å²	56.9	6%	0.063	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	142.4	171.8	-67.6	-77.9	0	0	0	111.1	D22 F25 L26 Y80 T84 D85 L86 V178	D22-Y82 HydrophobicContact CB-CD1 4.42Å; D22-Y82 HydrophobicContact CB-CG 4.5Å; F25-Y82 WeakPolarHBondContact CD1-OH 3.47Å; L26-Y82 HydrophobicContact CG-CE2 4.47Å; Y80-Y82 AromaticContact CE2-CE1 3.95Å; Y80-Y82 HydrophobicContact CE2-CE1 3.95Å; Y80-Y82 AromaticContact CE2-CE2 3.93Å; Y80-Y82 HydrophobicContact CE2-CE2 3.93Å; Y80-Y82 AromaticContact CE2-CZ 3.53Å; Y80-Y82 WeakPolarHBondContact CE2-OH 3.3Å; Y80-Y82 PolarHBondContact OH-OH 3.47Å; Y82-T84 VanDerWaalsContact C-N 3.25Å; Y82-T84 PolarHBondContact O-N 3.3Å; Y82-D85 WeakPolarHBondContact O-CB 3.24Å; Y82-D85 PolarHBondContact O-N 3.43Å; Y82-D85 VanDerWaalsContact O-N 3.15Å; Y82-L86 PolarHBondContact O-N 2.93Å; Y82-V178 CarbonylContact C-O 3.58Å; Y82-V178 VanDerWaalsContact CA-O 3.26Å; Y82-V178 WeakPolarHBondContact CA-O 3.39Å; Y82-V178 HydrophobicContact CD1-CB 4.43Å; Y82-V178 HydrophobicContact CE1-CB 4.47Å; Y82-V178 HydrophobicContact CE1-CG1 4.27Å
83	V	93.9	Very high	87.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-41.3	175.1	169.9	0	0	0	0	110.8	L86 A87 V178 Q217 L220 Y221 I224	V83-L86 PolarHBondContact O-N 3.14Å; V83-A87 WeakPolarHBondContact O-CB 3.21Å; V83-A87 PolarHBondContact O-N 2.86Å; V83-V178 PolarHBondContact N-O 3.26Å; V83-Q217 HydrophobicContact CG1-CG 3.74Å; V83-L220 HydrophobicContact CG1-CB 3.73Å; V83-L220 HydrophobicContact CG1-CD1 4.17Å; V83-L220 HydrophobicContact CG2-CB 4.26Å; V83-Y221 HydrophobicContact CB-CD1 3.99Å; V83-Y221 HydrophobicContact CB-CE1 3.51Å; V83-Y221 HydrophobicContact CG1-CD1 3.8Å; V83-Y221 HydrophobicContact CG1-CD2 4.19Å; V83-Y221 HydrophobicContact CG1-CE1 3.54Å; V83-Y221 HydrophobicContact CG1-CE2 3.96Å; V83-Y221 HydrophobicContact CG1-CG 4.08Å; V83-Y221 HydrophobicContact CG2-CD1 3.86Å; V83-Y221 HydrophobicContact CG2-CE1 3.81Å; V83-I224 HydrophobicContact CG2-CD1 3.67Å
84	T	88.9	Confident	87.4	Confident	20 Å²	20	63 Å²	63	12%	0.123	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-42.3	175.8	-66	0	0	0	0	112.7	D22 Y82 L86 A87 T88 Q217	D22-T84 HydrophobicContact CB-CG2 4.21Å; D22-T84 WeakPolarHBondContact CB-OG1 3.33Å; D22-T84 VanDerWaalsContact OD2-CB 3.24Å; D22-T84 WeakPolarHBondContact OD2-CB 3.34Å; D22-T84 PolarHBondContact OD2-N 3.22Å; D22-T84 PolarHBondContact OD2-OG1 3.19Å; Y82-T84 VanDerWaalsContact C-N 3.25Å; Y82-T84 PolarHBondContact O-N 3.3Å; T84-L86 PolarHBondContact O-N 2.9Å; T84-A87 PolarHBondContact O-N 3.07Å; T84-A87 VanDerWaalsContact O-N 3.16Å; T84-T88 WeakPolarHBondContact O-CG2 3.39Å; T84-T88 PolarHBondContact O-N 2.91Å; T84-Q217 PolarHBondContact OG1-NE2 3.39Å
85	D	86.7	Confident	87.2	Confident	19 Å²	19	62.8 Å²	62.8	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-58.4	-48.5	176.5	-81.2	-27.8	0	0	0	110.9	Y82 A87 T88 Q89 K100	Y82-D85 WeakPolarHBondContact O-CB 3.24Å; Y82-D85 PolarHBondContact O-N 3.43Å; Y82-D85 VanDerWaalsContact O-N 3.15Å; D85-A87 VanDerWaalsContact C-N 3.32Å; D85-A87 PolarHBondContact O-N 3.21Å; D85-T88 PolarHBondContact O-N 2.83Å; D85-T88 PolarHBondContact O-OG1 3.17Å; D85-Q89 PolarHBondContact O-N 3.42Å; D85-K100 IonicContact OD1-NZ 3.31Å; D85-K100 PolarHBondContact OD1-NZ 2.89Å; D85-K100 WeakPolarHBondContact OD2-CE 3.19Å; D85-K100 IonicContact OD2-NZ 3.31Å; D85-K100 PolarHBondContact OD2-NZ 3.46Å
86	L	89.5	Confident	87	Confident	26 Å²	26	59.3 Å²	59.3	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-40.4	175.7	-74.8	179.6	0	0	0	112	L81 Y82 V83 T84 T88 Q89 L177 L220	L81-L86 HydrophobicContact CB-CD1 4.29Å; L81-L86 HydrophobicContact CB-CG 4.24Å; L81-L86 HydrophobicContact CD1-CD1 4.42Å; L81-L86 HydrophobicContact CD1-CD2 3.84Å; L81-L86 HydrophobicContact CD1-CG 4.3Å; Y82-L86 PolarHBondContact O-N 2.93Å; V83-L86 PolarHBondContact O-N 3.14Å; T84-L86 PolarHBondContact O-N 2.9Å; L86-T88 VanDerWaalsContact C-N 3.29Å; L86-T88 PolarHBondContact O-N 3.47Å; L86-Q89 WeakPolarHBondContact O-CB 3.44Å; L86-Q89 PolarHBondContact O-N 2.76Å; L86-L177 HydrophobicContact CD1-CD1 4.34Å; L86-L177 HydrophobicContact CD1-CD2 3.45Å; L86-L177 VanDerWaalsContact CD1-CD2 3.45Å; L86-L220 HydrophobicContact CB-CD1 3.86Å; L86-L220 HydrophobicContact CD1-CD1 4.27Å
87	A	90.3	Very high	87.1	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-36.6	178.5	0	0	0	0	0	112.1	V83 T84 D85 Q89 N90 K213 F216 Q217	V83-A87 WeakPolarHBondContact O-CB 3.21Å; V83-A87 PolarHBondContact O-N 2.86Å; T84-A87 PolarHBondContact O-N 3.07Å; T84-A87 VanDerWaalsContact O-N 3.16Å; D85-A87 VanDerWaalsContact C-N 3.32Å; D85-A87 PolarHBondContact O-N 3.21Å; A87-Q89 VanDerWaalsContact C-N 3.26Å; A87-Q89 PolarHBondContact O-N 2.92Å; A87-N90 WeakPolarHBondContact O-CB 3.44Å; A87-N90 PolarHBondContact O-N 3.39Å; A87-K213 HydrophobicContact CB-CG 4.49Å; A87-K213 VanDerWaalsContact O-CG 3.23Å; A87-K213 WeakPolarHBondContact O-CG 3.1Å; A87-F216 HydrophobicContact CB-CD1 4.43Å; A87-Q217 HydrophobicContact CB-CB 3.72Å; A87-Q217 HydrophobicContact CB-CG 3.91Å
88	T	84.5	Confident	86.9	Confident	45 Å²	45	56.8 Å²	56.8	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-30.7	177.6	66.6	0	0	0	0	113.1	T84 D85 L86 N90 W91 T96	T84-T88 WeakPolarHBondContact O-CG2 3.39Å; T84-T88 PolarHBondContact O-N 2.91Å; D85-T88 PolarHBondContact O-N 2.83Å; D85-T88 PolarHBondContact O-OG1 3.17Å; L86-T88 VanDerWaalsContact C-N 3.29Å; L86-T88 PolarHBondContact O-N 3.47Å; T88-N90 PolarHBondContact O-N 3.19Å; T88-W91 PolarHBondContact O-N 3.32Å; T88-W91 VanDerWaalsContact O-N 3.16Å; T88-T96 PolarHBondContact OG1-OG1 2.95Å
89	Q	85.4	Confident	86.7	Confident	80 Å²	80	56.9 Å²	56.9	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-30.8	179.4	-64.8	178.3	-19.6	0	0	112.5	D85 L86 A87 W91 C92 E93 T96	D85-Q89 PolarHBondContact O-N 3.42Å; L86-Q89 WeakPolarHBondContact O-CB 3.44Å; L86-Q89 PolarHBondContact O-N 2.76Å; A87-Q89 VanDerWaalsContact C-N 3.26Å; A87-Q89 PolarHBondContact O-N 2.92Å; Q89-W91 PolarHBondContact O-N 2.86Å; Q89-C92 CarbonylContact O-C 3.49Å; Q89-C92 PolarHBondContact O-N 3.03Å; Q89-E93 HydrophobicContact CB-CG 4.45Å; Q89-T96 HydrophobicContact CG-CG2 3.78Å; Q89-T96 WeakPolarHBondContact CG-OG1 3.36Å; Q89-T96 PolarHBondContact N-OG1 2.91Å
90	N	83.8	Confident	86.4	Confident	63 Å²	63	56.1 Å²	56.1	34%	0.337	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.2	179	178.2	72.3	0	0	0	113.2	A87 T88 F216	A87-N90 WeakPolarHBondContact O-CB 3.44Å; A87-N90 PolarHBondContact O-N 3.39Å; T88-N90 PolarHBondContact O-N 3.19Å; N90-F216 HydrophobicContact CB-CD1 4.1Å
91	W	80.3	Confident	86	Confident	177 Å²	177	58.5 Å²	58.5	67%	0.67	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-52.7	169.6	178.9	-103.3	0	0	0	112.6	T88 Q89 A209	T88-W91 PolarHBondContact O-N 3.32Å; T88-W91 VanDerWaalsContact O-N 3.16Å; Q89-W91 PolarHBondContact O-N 2.86Å; W91-A209 HydrophobicContact CE3-CB 4.04Å; W91-A209 HydrophobicContact CZ3-CB 3.53Å
92	C	83.6	Confident	85.6	Confident	46 Å²	46	61.9 Å²	61.9	31%	0.311	31%	0.313	S	S	.	.			trans	-158.4	110.1	-178.9	-177.9	0	0	0	0	111.4	Q89 L94 Q95 T96	Q89-C92 CarbonylContact O-C 3.49Å; Q89-C92 PolarHBondContact O-N 3.03Å; C92-L94 VanDerWaalsContact C-N 3.31Å; C92-L94 PolarHBondContact O-N 2.94Å; C92-Q95 HydrophobicContact CB-CB 3.86Å; C92-Q95 WeakPolarHBondContact O-CB 3.35Å; C92-Q95 PolarHBondContact O-N 3.44Å; C92-T96 PolarHBondContact O-N 3Å
93	E	87.3	Confident	84.5	Confident	148 Å²	148	66.4 Å²	66.4	69%	0.692	34%	0.344	S	S	*	.	H	α-helix	trans	-59.4	-39.6	178.5	-63.8	171.4	-171.7	0	0	112.7	Q89 Q95 T96 A97	Q89-E93 HydrophobicContact CB-CG 4.45Å; E93-Q95 VanDerWaalsContact C-N 3.25Å; E93-Q95 PolarHBondContact O-N 3.41Å; E93-T96 PolarHBondContact O-N 3.41Å; E93-A97 PolarHBondContact O-N 3.03Å
94	L	86.8	Confident	83.1	Confident	111 Å²	111	69.6 Å²	69.6	58%	0.581	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-33.4	176.6	-80.3	102.1	0	0	0	112.1	C92 A97 Y98	C92-L94 VanDerWaalsContact C-N 3.31Å; C92-L94 PolarHBondContact O-N 2.94Å; L94-A97 PolarHBondContact O-N 2.84Å; L94-Y98 HydrophobicContact CB-CD2 4.43Å; L94-Y98 HydrophobicContact CB-CE2 4.42Å; L94-Y98 HydrophobicContact CD2-CE2 4.16Å; L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 WeakPolarHBondContact O-CD2 3.29Å; L94-Y98 PolarHBondContact O-N 3.14Å
95	Q	83.3	Confident	82.1	Confident	101 Å²	101	77.5 Å²	77.5	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-44.6	177.7	-177.9	-179.7	16	0	0	110.8	C92 E93 Y98 G99	C92-Q95 HydrophobicContact CB-CB 3.86Å; C92-Q95 WeakPolarHBondContact O-CB 3.35Å; C92-Q95 PolarHBondContact O-N 3.44Å; E93-Q95 VanDerWaalsContact C-N 3.25Å; E93-Q95 PolarHBondContact O-N 3.41Å; Q95-Y98 PolarHBondContact O-N 2.97Å; Q95-G99 PolarHBondContact O-N 3.35Å
96	T	83.4	Confident	81	Confident	15 Å²	15	81.7 Å²	81.7	9%	0.092	43%	0.432	C	S	.	.	H	α-helix	trans	-64	-44.6	176.5	-53.2	0	0	0	0	110.9	T88 Q89 C92 E93 Y98 G99 K100	T88-T96 PolarHBondContact OG1-OG1 2.95Å; Q89-T96 HydrophobicContact CG-CG2 3.78Å; Q89-T96 WeakPolarHBondContact CG-OG1 3.36Å; Q89-T96 PolarHBondContact N-OG1 2.91Å; C92-T96 PolarHBondContact O-N 3Å; E93-T96 PolarHBondContact O-N 3.41Å; T96-Y98 PolarHBondContact O-N 3.48Å; T96-G99 PolarHBondContact O-N 3.28Å; T96-K100 PolarHBondContact O-N 2.92Å; T96-K100 VanDerWaalsContact O-N 3.07Å
97	A	85	Confident	80	Confident	31 Å²	31	82.8 Å²	82.8	26%	0.256	45%	0.445	S	S	.	.	H	α-helix	trans	-58.9	-48.1	176.6	0	0	0	0	0	111.8	E93 L94 G99 K100 E101	E93-A97 PolarHBondContact O-N 3.03Å; L94-A97 PolarHBondContact O-N 2.84Å; A97-G99 VanDerWaalsContact C-N 3.31Å; A97-G99 PolarHBondContact O-N 2.95Å; A97-K100 PolarHBondContact O-N 2.92Å; A97-K100 VanDerWaalsContact O-N 3.16Å; A97-E101 WeakPolarHBondContact O-CG 3.47Å; A97-E101 PolarHBondContact O-N 2.88Å
98	Y	84.1	Confident	78.9	Confident	131 Å²	131	88.1 Å²	88.1	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-34.4	175.7	-77.9	-52.6	0	0	0	113.1	L94 Q95 T96 K100 E101 L102	L94-Y98 HydrophobicContact CB-CD2 4.43Å; L94-Y98 HydrophobicContact CB-CE2 4.42Å; L94-Y98 HydrophobicContact CD2-CE2 4.16Å; L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 WeakPolarHBondContact O-CD2 3.29Å; L94-Y98 PolarHBondContact O-N 3.14Å; Q95-Y98 PolarHBondContact O-N 2.97Å; T96-Y98 PolarHBondContact O-N 3.48Å; Y98-K100 VanDerWaalsContact C-N 3.26Å; Y98-K100 PolarHBondContact O-N 2.73Å; Y98-E101 PolarHBondContact O-N 3.21Å; Y98-L102 WeakPolarHBondContact O-CB 3.41Å; Y98-L102 PolarHBondContact O-N 2.79Å
99	G	81.8	Confident	78.1	Confident	46 Å²	46	92.3 Å²	92.3	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-36.4	173.9	0	0	0	0	0	112.6	Q95 T96 A97	Q95-G99 PolarHBondContact O-N 3.35Å; T96-G99 PolarHBondContact O-N 3.28Å; A97-G99 VanDerWaalsContact C-N 3.31Å; A97-G99 PolarHBondContact O-N 2.95Å
100	K	81.8	Confident	77.4	Confident	44 Å²	44	94.2 Å²	94.2	19%	0.191	50%	0.503	C	S	.	.	H	α-helix	trans	-79	-33	174.7	-62.3	-61.6	-175.6	-174.4	0	113.2	F76 D85 T96 A97 Y98	F76-K100 HydrophobicContact CD1-CB 3.79Å; F76-K100 HydrophobicContact CD2-CB 4.47Å; F76-K100 HydrophobicContact CE1-CB 3.78Å; F76-K100 HydrophobicContact CE2-CB 4.47Å; F76-K100 HydrophobicContact CG-CB 4.16Å; F76-K100 HydrophobicContact CZ-CB 4.13Å; D85-K100 IonicContact OD1-NZ 3.31Å; D85-K100 PolarHBondContact OD1-NZ 2.89Å; D85-K100 WeakPolarHBondContact OD2-CE 3.19Å; D85-K100 IonicContact OD2-NZ 3.31Å; D85-K100 PolarHBondContact OD2-NZ 3.46Å; T96-K100 PolarHBondContact O-N 2.92Å; T96-K100 VanDerWaalsContact O-N 3.07Å; A97-K100 PolarHBondContact O-N 2.92Å; A97-K100 VanDerWaalsContact O-N 3.16Å; Y98-K100 VanDerWaalsContact C-N 3.26Å; Y98-K100 PolarHBondContact O-N 2.73Å
101	E	83.5	Confident	77.1	Confident	77 Å²	77	92.8 Å²	92.8	36%	0.36	50%	0.5	S	S	.	.	H	α-helix	trans	-75.3	-29.8	178.1	-71	177.3	-166.2	0	0	113.4	R75 F76 A97 Y98 P103	R75-E101 IonicContact CZ-OE1 3.93Å; R75-E101 IonicContact NH1-OE1 2.61Å; R75-E101 PolarHBondContact NH1-OE1 2.87Å; R75-E101 VanDerWaalsContact NH2-CD 3.34Å; R75-E101 IonicContact NH2-OE1 2.69Å; R75-E101 PolarHBondContact NH2-OE1 3.11Å; F76-E101 HydrophobicContact CE1-CG 3.73Å; F76-E101 HydrophobicContact CZ-CG 4.13Å; A97-E101 WeakPolarHBondContact O-CG 3.47Å; A97-E101 PolarHBondContact O-N 2.88Å; Y98-E101 PolarHBondContact O-N 3.21Å; E101-P103 VanDerWaalsContact C-CD 3.45Å; E101-P103 WeakPolarHBondContact O-CD 3.3Å
102	L	81.2	Confident	77.2	Confident	102 Å²	102	86.9 Å²	86.9	53%	0.534	49%	0.488	S	S	.	.	S	Bend	trans	-128.1	66.7	-173.9	-62.8	170.9	0	0	0	110.9	Y98 G104 F105	Y98-L102 WeakPolarHBondContact O-CB 3.41Å; Y98-L102 PolarHBondContact O-N 2.79Å; L102-G104 PolarHBondContact O-N 3.37Å; L102-F105 HydrophobicContact CB-CB 4.49Å; L102-F105 PolarHBondContact O-N 2.97Å
103	P	69.3	Low	77.1	Confident	112 Å²	112	87.9 Å²	87.9	73%	0.727	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	135.5	175.4	24.7	-32	0	0	0	110.2	E101	E101-P103 VanDerWaalsContact C-CD 3.45Å; E101-P103 WeakPolarHBondContact O-CD 3.3Å
104	G	65.6	Low	76.9	Confident	67 Å²	67	84.9 Å²	84.9	69%	0.691	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	-2.9	179.9	0	0	0	0	0	116.2	L102 L106	L102-G104 PolarHBondContact O-N 3.37Å; G104-L106 PolarHBondContact O-N 3.43Å
105	F	66.9	Low	76.9	Confident	186 Å²	186	84 Å²	84	82%	0.816	48%	0.477	S	S	*	.			trans	-81	49	170.9	-161.6	-99.5	0	0	0	112.1	L102	L102-F105 HydrophobicContact CB-CB 4.49Å; L102-F105 PolarHBondContact O-N 2.97Å
106	L	64.2	Low	77.2	Confident	107 Å²	107	83.4 Å²	83.4	56%	0.56	48%	0.48	S	S	*	.			trans	-96.2	127.4	171.3	-72.9	173.4	0	0	0	109.5	G104	G104-L106 PolarHBondContact O-N 3.43Å
107	A	67.1	Low	77.4	Confident	49 Å²	49	83 Å²	83	41%	0.405	48%	0.479	S	S	.	.			trans	-64.2	137.1	174.5	0	0	0	0	0	109.5	E109 K110 A111	A107-E109 PolarHBondContact O-N 3.26Å; A107-E109 VanDerWaalsContact O-N 3.09Å; A107-K110 HydrophobicContact CB-CD 4.45Å; A107-K110 HydrophobicContact CB-CG 4.35Å; A107-K110 WeakPolarHBondContact O-CA 3.5Å; A107-K110 WeakPolarHBondContact O-CB 3.1Å; A107-K110 PolarHBondContact O-N 3.4Å; A107-A111 PolarHBondContact O-N 3.32Å
108	P	68.1	Low	77.6	Confident	112 Å²	112	82.6 Å²	82.6	73%	0.727	48%	0.476	S	S	*	.	H	α-helix	trans	-54.5	-33.4	-177.4	-29.1	34.6	0	0	0	114.7	K110 A111 A112	P108-K110 VanDerWaalsContact C-N 3.29Å; P108-K110 PolarHBondContact O-N 3.5Å; P108-A111 PolarHBondContact O-N 3.13Å; P108-A112 PolarHBondContact O-N 3.44Å; P108-A112 VanDerWaalsContact O-N 3.15Å
109	E	67.4	Low	77.9	Confident	133 Å²	133	80 Å²	80	62%	0.621	48%	0.477	S	S	*	.	H	α-helix	trans	-64.6	-33.8	175.3	-174.1	-178.9	-172.4	0	0	112.4	A107 V113 R201	A107-E109 PolarHBondContact O-N 3.26Å; A107-E109 VanDerWaalsContact O-N 3.09Å; E109-V113 WeakPolarHBondContact O-CG2 3.42Å; E109-V113 PolarHBondContact O-N 2.9Å; E109-R201 IonicContact OE1-NH1 3.98Å; E109-R201 PolarHBondContact OE1-NH1 3.42Å; E109-R201 VanDerWaalsContact OE1-NH1 3.07Å
110	K	72	Confident	78.4	Confident	121 Å²	121	81.2 Å²	81.2	53%	0.526	47%	0.472	S	S	.	.	H	α-helix	trans	-71.3	-41.2	176.7	-67.4	-177.2	178.8	179	0	110.9	A107 P108 V113 L114	A107-K110 HydrophobicContact CB-CD 4.45Å; A107-K110 HydrophobicContact CB-CG 4.35Å; A107-K110 WeakPolarHBondContact O-CA 3.5Å; A107-K110 WeakPolarHBondContact O-CB 3.1Å; A107-K110 PolarHBondContact O-N 3.4Å; P108-K110 VanDerWaalsContact C-N 3.29Å; P108-K110 PolarHBondContact O-N 3.5Å; K110-V113 PolarHBondContact O-N 2.87Å; K110-L114 WeakPolarHBondContact O-CG 3.16Å; K110-L114 PolarHBondContact O-N 2.87Å; K110-L114 VanDerWaalsContact O-N 3.07Å
111	A	77.1	Confident	78.9	Confident	33 Å²	33	80.6 Å²	80.6	27%	0.273	47%	0.47	S	S	.	.	H	α-helix	trans	-56.7	-54	176.2	0	0	0	0	0	110.9	A107 P108 V113 L114 D115	A107-A111 PolarHBondContact O-N 3.32Å; P108-A111 PolarHBondContact O-N 3.13Å; A111-V113 VanDerWaalsContact C-N 3.25Å; A111-V113 PolarHBondContact O-N 3.38Å; A111-V113 VanDerWaalsContact O-N 3.09Å; A111-L114 CarbonylContact O-C 3.58Å; A111-L114 WeakPolarHBondContact O-CA 3.32Å; A111-L114 WeakPolarHBondContact O-CB 3.46Å; A111-L114 PolarHBondContact O-N 2.93Å; A111-D115 PolarHBondContact O-N 2.88Å
112	A	82	Confident	79.3	Confident	52 Å²	52	79 Å²	79	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-58	-33.8	-179.2	0	0	0	0	0	114.5	P108 T116	P108-A112 PolarHBondContact O-N 3.44Å; P108-A112 VanDerWaalsContact O-N 3.15Å; A112-T116 PolarHBondContact O-N 3.23Å; A112-T116 VanDerWaalsContact O-N 3.16Å; A112-T116 PolarHBondContact O-OG1 2.88Å
113	V	82.3	Confident	79.9	Confident	67 Å²	67	76.7 Å²	76.7	41%	0.406	46%	0.459	S	S	.	.	H	α-helix	trans	-72.1	-38.2	175.7	173.2	0	0	0	0	111.3	E109 K110 A111 G117	E109-V113 WeakPolarHBondContact O-CG2 3.42Å; E109-V113 PolarHBondContact O-N 2.9Å; K110-V113 PolarHBondContact O-N 2.87Å; A111-V113 VanDerWaalsContact C-N 3.25Å; A111-V113 PolarHBondContact O-N 3.38Å; A111-V113 VanDerWaalsContact O-N 3.09Å; V113-G117 PolarHBondContact O-N 3.06Å; V113-G117 VanDerWaalsContact O-N 3.12Å
114	L	83.3	Confident	81.1	Confident	86 Å²	86	73.9 Å²	73.9	45%	0.45	43%	0.434	S	S	.	.	H	α-helix	trans	-66.7	-46.7	175.3	-68.4	172.5	0	0	0	110.7	K110 A111 T116 G117 A118	K110-L114 WeakPolarHBondContact O-CG 3.16Å; K110-L114 PolarHBondContact O-N 2.87Å; K110-L114 VanDerWaalsContact O-N 3.07Å; A111-L114 CarbonylContact O-C 3.58Å; A111-L114 WeakPolarHBondContact O-CA 3.32Å; A111-L114 WeakPolarHBondContact O-CB 3.46Å; A111-L114 PolarHBondContact O-N 2.93Å; L114-T116 VanDerWaalsContact C-N 3.27Å; L114-T116 PolarHBondContact O-N 2.85Å; L114-G117 CarbonylContact O-C 3.58Å; L114-G117 VanDerWaalsContact O-CA 3.29Å; L114-G117 WeakPolarHBondContact O-CA 3.34Å; L114-G117 PolarHBondContact O-N 3.5Å; L114-A118 PolarHBondContact O-N 2.89Å
115	D	85.6	Confident	82.4	Confident	91 Å²	91	71.1 Å²	71.1	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-57.1	-42	177.3	-55.5	-15.9	0	0	0	111.5	A111 G117 A118 S119	A111-D115 PolarHBondContact O-N 2.88Å; D115-G117 VanDerWaalsContact C-N 3.29Å; D115-G117 PolarHBondContact O-N 3.16Å; D115-A118 PolarHBondContact O-N 3.27Å; D115-S119 WeakPolarHBondContact O-CB 3.48Å; D115-S119 PolarHBondContact O-N 2.91Å
116	T	88.8	Confident	83.7	Confident	89 Å²	89	66.5 Å²	66.5	55%	0.546	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-39.1	175.4	-55.3	0	0	0	0	111.2	A112 L114 I120	A112-T116 PolarHBondContact O-N 3.23Å; A112-T116 VanDerWaalsContact O-N 3.16Å; A112-T116 PolarHBondContact O-OG1 2.88Å; L114-T116 VanDerWaalsContact C-N 3.27Å; L114-T116 PolarHBondContact O-N 2.85Å; T116-I120 HydrophobicContact CG2-CD1 4.39Å; T116-I120 WeakPolarHBondContact O-CD1 3.26Å; T116-I120 WeakPolarHBondContact O-CG1 3.41Å; T116-I120 PolarHBondContact O-N 3.01Å
117	G	88.9	Confident	85.1	Confident	7 Å²	7	67.7 Å²	67.7	7%	0.072	39%	0.389	C	S	.	.	H	α-helix	trans	-62.4	-52.5	173.9	0	0	0	0	0	111.5	V113 L114 D115 S119 I120 H121 T199	V113-G117 PolarHBondContact O-N 3.06Å; V113-G117 VanDerWaalsContact O-N 3.12Å; L114-G117 CarbonylContact O-C 3.58Å; L114-G117 VanDerWaalsContact O-CA 3.29Å; L114-G117 WeakPolarHBondContact O-CA 3.34Å; L114-G117 PolarHBondContact O-N 3.5Å; D115-G117 VanDerWaalsContact C-N 3.29Å; D115-G117 PolarHBondContact O-N 3.16Å; G117-S119 VanDerWaalsContact C-N 3.31Å; G117-S119 PolarHBondContact O-N 3.15Å; G117-I120 WeakPolarHBondContact O-CB 3.39Å; G117-I120 PolarHBondContact O-N 3.41Å; G117-H121 PolarHBondContact O-CD2 3Å; G117-H121 VanDerWaalsContact O-CD2 3.29Å; G117-H121 PolarHBondContact O-N 3.13Å; G117-T199 WeakPolarHBondContact CA-OG1 3.4Å
118	A	88.1	Confident	86.3	Confident	23 Å²	23	67.4 Å²	67.4	19%	0.19	38%	0.38	C	S	.	.	H	α-helix	trans	-56	-44.3	178.5	0	0	0	0	0	111.5	L114 D115 I120 H121 L122	L114-A118 PolarHBondContact O-N 2.89Å; D115-A118 PolarHBondContact O-N 3.27Å; A118-I120 VanDerWaalsContact C-N 3.28Å; A118-I120 PolarHBondContact O-N 3.34Å; A118-H121 PolarHBondContact O-N 3.41Å; A118-H121 VanDerWaalsContact O-N 3.1Å; A118-L122 PolarHBondContact O-N 3.23Å
119	S	91.4	Very high	87.4	Confident	75 Å²	75	63.4 Å²	63.4	52%	0.524	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-35.2	175.2	177.1	0	0	0	0	113.4	D115 G117 A123	D115-S119 WeakPolarHBondContact O-CB 3.48Å; D115-S119 PolarHBondContact O-N 2.91Å; G117-S119 VanDerWaalsContact C-N 3.31Å; G117-S119 PolarHBondContact O-N 3.15Å; S119-A123 WeakPolarHBondContact O-CB 3.47Å; S119-A123 PolarHBondContact O-N 3.47Å
120	I	92.5	Very high	88.5	Confident	73 Å²	73	64.5 Å²	64.5	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-70.9	-40.8	175.2	-68.1	163.9	0	0	0	110.8	T116 G117 A118 A123 R124 L197 T199	T116-I120 HydrophobicContact CG2-CD1 4.39Å; T116-I120 WeakPolarHBondContact O-CD1 3.26Å; T116-I120 WeakPolarHBondContact O-CG1 3.41Å; T116-I120 PolarHBondContact O-N 3.01Å; G117-I120 WeakPolarHBondContact O-CB 3.39Å; G117-I120 PolarHBondContact O-N 3.41Å; A118-I120 VanDerWaalsContact C-N 3.28Å; A118-I120 PolarHBondContact O-N 3.34Å; I120-A123 PolarHBondContact O-N 2.81Å; I120-R124 WeakPolarHBondContact O-CG 3.2Å; I120-R124 PolarHBondContact O-N 2.95Å; I120-R124 VanDerWaalsContact O-N 3.11Å; I120-L197 HydrophobicContact CG2-CD2 4.25Å; I120-T199 HydrophobicContact CB-CG2 4.06Å; I120-T199 HydrophobicContact CD1-CG2 3.82Å; I120-T199 HydrophobicContact CG2-CG2 3.9Å
121	H	92.5	Very high	89.2	Confident	31 Å²	31	61 Å²	61	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-44.1	174.7	-77.4	-109.9	0	0	0	110.8	G117 A118 A123 R124 E125 D182 L197	G117-H121 PolarHBondContact O-CD2 3Å; G117-H121 VanDerWaalsContact O-CD2 3.29Å; G117-H121 PolarHBondContact O-N 3.13Å; A118-H121 PolarHBondContact O-N 3.41Å; A118-H121 VanDerWaalsContact O-N 3.1Å; H121-A123 PolarHBondContact O-N 3.01Å; H121-R124 CarbonylContact O-C 3.54Å; H121-R124 WeakPolarHBondContact O-CB 3.14Å; H121-R124 PolarHBondContact O-N 3.49Å; H121-R124 VanDerWaalsContact O-N 3.11Å; H121-E125 PolarHBondContact O-N 2.76Å; H121-D182 IonicContact CE1-OD1 2.62Å; H121-D182 PolarHBondContact CE1-OD1 3.1Å; H121-D182 IonicContact CE1-OD2 3.81Å; H121-D182 PolarHBondContact CE1-OD2 3.27Å; H121-D182 VanDerWaalsContact CE1-OD2 3.31Å; H121-D182 IonicContact ND1-OD1 3.27Å; H121-D182 PolarHBondContact ND1-OD1 3.29Å; H121-D182 IonicContact ND1-OD2 3.41Å; H121-L197 PolarHBondContact CE1-O 2.98Å; H121-L197 VanDerWaalsContact CE1-O 3.29Å; H121-L197 PolarHBondContact NE2-O 2.72Å
122	L	92.1	Very high	89.8	Confident	44 Å²	44	64.9 Å²	64.9	23%	0.23	37%	0.369	C	S	.	.	H	α-helix	trans	-54.8	-51.7	173.6	-179.6	46	0	0	0	112.3	S18 A118 R124 E125 L126 L131	S18-L122 VanDerWaalsContact CB-CA 3.4Å; S18-L122 WeakPolarHBondContact OG-CB 3.34Å; S18-L122 WeakPolarHBondContact OG-CD1 3.36Å; S18-L122 WeakPolarHBondContact OG-CD2 3.28Å; S18-L122 WeakPolarHBondContact OG-CG 3.11Å; A118-L122 PolarHBondContact O-N 3.23Å; L122-R124 PolarHBondContact O-N 3.02Å; L122-E125 PolarHBondContact O-N 2.92Å; L122-E125 VanDerWaalsContact O-N 3.12Å; L122-L126 HydrophobicContact CD1-CD1 3.7Å; L122-L126 HydrophobicContact CD1-CD2 4.47Å; L122-L126 HydrophobicContact CD1-CG 3.79Å; L122-L126 HydrophobicContact CG-CD1 3.95Å; L122-L126 HydrophobicContact CG-CG 4.45Å; L122-L126 WeakPolarHBondContact O-CB 3.29Å; L122-L126 WeakPolarHBondContact O-CG 3.34Å; L122-L126 PolarHBondContact O-N 2.99Å; L122-L131 HydrophobicContact CD1-CD1 3.41Å; L122-L131 VanDerWaalsContact CD1-CD1 3.41Å
123	A	93.9	Very high	90.2	Very high	53 Å²	53	66.2 Å²	66.2	44%	0.438	37%	0.372	S	S	.	.	H	α-helix	trans	-59	-37.2	-179.3	0	0	0	0	0	111.1	S119 I120 H121 E127	S119-A123 WeakPolarHBondContact O-CB 3.47Å; S119-A123 PolarHBondContact O-N 3.47Å; I120-A123 PolarHBondContact O-N 2.81Å; H121-A123 PolarHBondContact O-N 3.01Å; A123-E127 WeakPolarHBondContact O-CG 3.36Å; A123-E127 PolarHBondContact O-N 3.14Å
124	R	94.1	Very high	90.4	Very high	53 Å²	53	66.6 Å²	66.6	20%	0.2	37%	0.374	C	S	.	.	H	α-helix	trans	-69.8	-43.2	174.8	-73.2	-173.5	83.6	-137.4	1.2	111.9	I120 H121 L122 L126 E127 R164 E183	I120-R124 WeakPolarHBondContact O-CG 3.2Å; I120-R124 PolarHBondContact O-N 2.95Å; I120-R124 VanDerWaalsContact O-N 3.11Å; H121-R124 CarbonylContact O-C 3.54Å; H121-R124 WeakPolarHBondContact O-CB 3.14Å; H121-R124 PolarHBondContact O-N 3.49Å; H121-R124 VanDerWaalsContact O-N 3.11Å; L122-R124 PolarHBondContact O-N 3.02Å; R124-L126 VanDerWaalsContact C-N 3.28Å; R124-L126 PolarHBondContact O-N 3.42Å; R124-E127 WeakPolarHBondContact O-CB 3.47Å; R124-E127 PolarHBondContact O-N 3.42Å; R124-R164 VanDerWaalsContact C-NH1 3.26Å; R124-R164 VanDerWaalsContact CA-NH1 3.27Å; R124-R164 VanDerWaalsContact CB-NH1 3.29Å; R124-R164 VanDerWaalsContact NH2-NH2 3.17Å; R124-R164 WeakPolarHBondContact O-CD 3.41Å; R124-R164 PolarHBondContact O-NH1 3.05Å; R124-E183 IonicContact CZ-OE2 3.43Å; R124-E183 IonicContact NH1-OE2 2.71Å; R124-E183 IonicContact NH2-OE2 3.21Å; R124-E183 PolarHBondContact NH2-OE2 3.01Å
125	E	92.8	Very high	90.8	Very high	9 Å²	9	67.6 Å²	67.6	4%	0.042	39%	0.386	C	S	.	.	H	α-helix	trans	-57.6	-45.9	176.4	-174	178.9	-164.9	0	0	111	F17 H121 L122 E127 L128 H129 L131 E165	F17-E125 VanDerWaalsContact CB-OE1 3.23Å; F17-E125 WeakPolarHBondContact CB-OE1 3.13Å; F17-E125 WeakPolarHBondContact CB-OE2 3.43Å; H121-E125 PolarHBondContact O-N 2.76Å; L122-E125 PolarHBondContact O-N 2.92Å; L122-E125 VanDerWaalsContact O-N 3.12Å; E125-E127 PolarHBondContact O-N 3.21Å; E125-E127 VanDerWaalsContact O-N 3.16Å; E125-L128 PolarHBondContact O-N 3.23Å; E125-H129 PolarHBondContact O-N 3.22Å; E125-L131 HydrophobicContact CG-CD2 4.2Å; E125-L131 WeakPolarHBondContact OE1-CD2 3.45Å; E125-E165 HydrophobicContact CB-CG 3.95Å; E125-E165 VanDerWaalsContact CD-CG 3.49Å; E125-E165 HydrophobicContact CG-CB 4.34Å; E125-E165 HydrophobicContact CG-CG 3.72Å
126	L	94.1	Very high	91	Very high	89 Å²	89	65.3 Å²	65.3	47%	0.466	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.3	178.8	-70.3	174.2	0	0	0	114.8	L122 R124 H129 L131	L122-L126 HydrophobicContact CD1-CD1 3.7Å; L122-L126 HydrophobicContact CD1-CD2 4.47Å; L122-L126 HydrophobicContact CD1-CG 3.79Å; L122-L126 HydrophobicContact CG-CD1 3.95Å; L122-L126 HydrophobicContact CG-CG 4.45Å; L122-L126 WeakPolarHBondContact O-CB 3.29Å; L122-L126 WeakPolarHBondContact O-CG 3.34Å; L122-L126 PolarHBondContact O-N 2.99Å; R124-L126 VanDerWaalsContact C-N 3.28Å; R124-L126 PolarHBondContact O-N 3.42Å; L126-H129 WeakPolarHBondContact CA-O 3.39Å; L126-L131 HydrophobicContact CD2-CB 4.33Å; L126-L131 HydrophobicContact CD2-CD1 3.63Å; L126-L131 HydrophobicContact CD2-CG 3.71Å; L126-L131 HydrophobicContact CG-CD1 4.12Å
127	E	94.3	Very high	91.1	Very high	131 Å²	131	65.7 Å²	65.7	61%	0.612	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.1	170.8	-72.5	169.2	-168.8	0	0	111.8	A123 R124 E125 R164	A123-E127 WeakPolarHBondContact O-CG 3.36Å; A123-E127 PolarHBondContact O-N 3.14Å; R124-E127 WeakPolarHBondContact O-CB 3.47Å; R124-E127 PolarHBondContact O-N 3.42Å; E125-E127 PolarHBondContact O-N 3.21Å; E125-E127 VanDerWaalsContact O-N 3.16Å; E127-R164 IonicContact OE2-CZ 3.57Å; E127-R164 IonicContact OE2-NH1 3.49Å; E127-R164 PolarHBondContact OE2-NH1 3.04Å; E127-R164 IonicContact OE2-NH2 3.9Å; E127-R164 PolarHBondContact OE2-NH2 3.35Å
128	L	90.8	Very high	91.2	Very high	44 Å²	44	68 Å²	68	23%	0.23	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-30.1	-173.3	-58.5	-176.8	0	0	0	113.7	E125 H162 R164	E125-L128 PolarHBondContact O-N 3.23Å; L128-H162 VanDerWaalsContact CD1-CD2 3.48Å; L128-H162 WeakPolarHBondContact CD1-CD2 3.15Å; L128-H162 WeakPolarHBondContact CD2-NE2 3.39Å; L128-R164 HydrophobicContact CD1-CB 4.34Å; L128-R164 HydrophobicContact CD1-CG 3.73Å
129	H	90.6	Very high	91.1	Very high	28 Å²	28	70.1 Å²	70.1	13%	0.13	40%	0.395	C	S	.	.			trans	-127.2	141.9	-173.3	-42.5	125.9	0	0	0	111.9	E125 L126 L153 R164	E125-H129 PolarHBondContact O-N 3.22Å; L126-H129 WeakPolarHBondContact CA-O 3.39Å; H129-L153 WeakPolarHBondContact NE2-CD2 3.47Å; H129-R164 PolarHBondContact CE1-N 3.16Å; H129-R164 VanDerWaalsContact CE1-N 3.27Å; H129-R164 PolarHBondContact CE1-O 3.13Å
130	D	90.8	Very high	91.1	Very high	155 Å²	155	69.5 Å²	69.5	83%	0.829	38%	0.384	S	S	*	.			trans	-85.2	124.9	166.9	-67.7	-40.5	0	0	0	109.6
131	L	88.5	Confident	91	Very high	48 Å²	48	68.6 Å²	68.6	25%	0.251	38%	0.38	S	S	.	.			trans	-86.3	130.3	179.1	-59.5	177.6	0	0	0	110.9	F17 L122 E125 L126	F17-L131 HydrophobicContact CB-CD2 4.39Å; L122-L131 HydrophobicContact CD1-CD1 3.41Å; L122-L131 VanDerWaalsContact CD1-CD1 3.41Å; E125-L131 HydrophobicContact CG-CD2 4.2Å; E125-L131 WeakPolarHBondContact OE1-CD2 3.45Å; L126-L131 HydrophobicContact CD2-CB 4.33Å; L126-L131 HydrophobicContact CD2-CD1 3.63Å; L126-L131 HydrophobicContact CD2-CG 3.71Å; L126-L131 HydrophobicContact CG-CD1 4.12Å
132	V	89.6	Confident	90.9	Very high	114 Å²	114	67.7 Å²	67.7	69%	0.691	38%	0.377	S	S	*	.			trans	-118.4	120.4	178.3	-179.2	0	0	0	0	108.7	V134	V132-V134 HydrophobicContact CG1-CG2 4.41Å; V132-V134 PolarHBondContact O-N 2.74Å
133	T	89.5	Confident	90.8	Very high	80 Å²	80	66.1 Å²	66.1	49%	0.491	37%	0.369	S	S	.	.			trans	-70.1	118.4	173.4	-61.1	0	0	0	0	109.9	S15	S15-T133 PolarHBondContact N-OG1 3.3Å; S15-T133 WeakPolarHBondContact OG-CG2 3.47Å; S15-T133 PolarHBondContact OG-OG1 2.82Å
134	V	87.3	Confident	90.8	Very high	76 Å²	76	66.1 Å²	66.1	46%	0.461	37%	0.369	S	S	.	.			trans	-114.6	126.2	175	-178.5	0	0	0	0	108.2	V132 V136 I145	V132-V134 HydrophobicContact CG1-CG2 4.41Å; V132-V134 PolarHBondContact O-N 2.74Å; V134-V136 PolarHBondContact O-N 3.29Å; V134-I145 HydrophobicContact CB-CD1 3.96Å; V134-I145 HydrophobicContact CG1-CD1 3.88Å; V134-I145 HydrophobicContact CG1-CG1 4.34Å
135	P	90.1	Very high	90.7	Very high	107 Å²	107	64.9 Å²	64.9	70%	0.695	37%	0.366	S	S	*	.			trans	-65.8	126.6	175.2	27.7	-33	0	0	0	109.8
136	V	90.6	Very high	90.7	Very high	42 Å²	42	65.1 Å²	65.1	26%	0.255	37%	0.366	S	S	.	.			trans	-107.7	120.9	176.9	179.2	0	0	0	0	107.8	V134 D141 A142 I145	V134-V136 PolarHBondContact O-N 3.29Å; V136-D141 HydrophobicContact CG1-CB 3.98Å; V136-A142 HydrophobicContact CG1-CB 3.94Å; V136-I145 HydrophobicContact CG2-CD1 3.4Å
137	T	91	Very high	90.7	Very high	98 Å²	98	64.3 Å²	64.3	60%	0.601	36%	0.359	S	S	*	.			trans	-118.3	-18.4	-179.7	60.8	0	0	0	0	113.2	D141	T137-D141 PolarHBondContact N-OD2 3.06Å; T137-D141 PolarHBondContact OG1-OD2 3.15Å
138	T	90	Very high	90.8	Very high	54 Å²	54	62.6 Å²	62.6	33%	0.331	35%	0.354	S	S	.	.	S	Bend	trans	-133.8	162.9	-176.9	65.3	0	0	0	0	111.4	E140 D141 A142	T138-E140 PolarHBondContact O-N 3.16Å; T138-D141 PolarHBondContact N-OD2 2.96Å; T138-D141 WeakPolarHBondContact O-CB 3.14Å; T138-D141 PolarHBondContact O-N 3.17Å; T138-D141 PolarHBondContact OG1-N 3.06Å; T138-D141 PolarHBondContact OG1-OD1 3.4Å; T138-D141 PolarHBondContact OG1-OD2 3.16Å; T138-A142 PolarHBondContact O-N 3.35Å
139	K	87.1	Confident	90.9	Very high	68 Å²	68	62 Å²	62	30%	0.296	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-32.6	175.1	-61.7	179.8	-175.6	-178.5	0	109.6	D33 A142 W143 L244	D33-K139 IonicContact OD1-NZ 2.72Å; D33-K139 PolarHBondContact OD1-NZ 2.95Å; D33-K139 IonicContact OD2-NZ 3.39Å; D33-K139 PolarHBondContact OD2-NZ 3.4Å; K139-A142 PolarHBondContact O-N 3.33Å; K139-W143 VanDerWaalsContact O-CD1 3.32Å; K139-W143 PolarHBondContact O-N 3.18Å; K139-W143 VanDerWaalsContact O-N 3.14Å; K139-L244 HydrophobicContact CB-CD2 4.5Å
140	E	90.6	Very high	91.2	Very high	63 Å²	63	61.5 Å²	61.5	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-61.2	-45.8	172	-67	66	-156.5	0	0	111.6	T138 A142 W143 A144 L244 C245	T138-E140 PolarHBondContact O-N 3.16Å; E140-A142 VanDerWaalsContact C-N 3.33Å; E140-A142 PolarHBondContact O-N 3.12Å; E140-W143 PolarHBondContact O-N 2.84Å; E140-A144 VanDerWaalsContact O-CB 3.29Å; E140-A144 WeakPolarHBondContact O-CB 2.91Å; E140-A144 PolarHBondContact O-N 2.95Å; E140-L244 HydrophobicContact CB-CD2 4.29Å; E140-L244 HydrophobicContact CG-CD2 3.78Å; E140-L244 WeakPolarHBondContact OE1-CA 3.48Å; E140-C245 PolarHBondContact OE1-N 3.35Å
141	D	90.6	Very high	91.4	Very high	53 Å²	53	59.9 Å²	59.9	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-46	175.9	-63.3	-27.2	0	0	0	110.9	V136 T137 T138 W143 A144 I145	V136-D141 HydrophobicContact CG1-CB 3.98Å; T137-D141 PolarHBondContact N-OD2 3.06Å; T137-D141 PolarHBondContact OG1-OD2 3.15Å; T138-D141 PolarHBondContact N-OD2 2.96Å; T138-D141 WeakPolarHBondContact O-CB 3.14Å; T138-D141 PolarHBondContact O-N 3.17Å; T138-D141 PolarHBondContact OG1-N 3.06Å; T138-D141 PolarHBondContact OG1-OD1 3.4Å; T138-D141 PolarHBondContact OG1-OD2 3.16Å; D141-W143 VanDerWaalsContact C-N 3.32Å; D141-W143 PolarHBondContact O-N 3.35Å; D141-A144 PolarHBondContact O-N 3.01Å; D141-I145 WeakPolarHBondContact O-CG1 3.28Å; D141-I145 PolarHBondContact O-N 3.45Å
142	A	89.9	Confident	91.8	Very high	12 Å²	12	62.4 Å²	62.4	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-40.6	180	0	0	0	0	0	112.1	V136 T138 K139 E140 K146	V136-A142 HydrophobicContact CG1-CB 3.94Å; T138-A142 PolarHBondContact O-N 3.35Å; K139-A142 PolarHBondContact O-N 3.33Å; E140-A142 VanDerWaalsContact C-N 3.33Å; E140-A142 PolarHBondContact O-N 3.12Å; A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.26Å
143	W	91.6	Very high	92.1	Very high	12 Å²	12	57.8 Å²	57.8	5%	0.045	32%	0.324	C	S	.	.	H	α-helix	trans	-72.4	-38.7	175.1	-86.2	94.1	0	0	0	112.5	Y80 K139 E140 D141 I145 K146 F147 F169 L176 V178 L238 T242 L244	Y80-W143 HydrophobicContact CD1-CZ2 4.47Å; Y80-W143 HydrophobicContact CE1-CZ2 4.4Å; K139-W143 VanDerWaalsContact O-CD1 3.32Å; K139-W143 PolarHBondContact O-N 3.18Å; K139-W143 VanDerWaalsContact O-N 3.14Å; E140-W143 PolarHBondContact O-N 2.84Å; D141-W143 VanDerWaalsContact C-N 3.32Å; D141-W143 PolarHBondContact O-N 3.35Å; W143-I145 VanDerWaalsContact C-N 3.3Å; W143-I145 PolarHBondContact O-N 3.31Å; W143-K146 WeakPolarHBondContact O-CB 3.26Å; W143-K146 PolarHBondContact O-N 2.87Å; W143-K146 VanDerWaalsContact O-N 3.13Å; W143-F147 HydrophobicContact CB-CE2 4.07Å; W143-F147 HydrophobicContact CE3-CE1 4.05Å; W143-F147 HydrophobicContact CE3-CE2 4.12Å; W143-F147 AromaticContact CE3-CZ 3.58Å; W143-F147 HydrophobicContact CE3-CZ 3.58Å; W143-F147 HydrophobicContact CZ3-CE1 4.34Å; W143-F147 HydrophobicContact CZ3-CZ 4.18Å; W143-F147 WeakPolarHBondContact O-CD2 3.31Å; W143-F147 WeakPolarHBondContact O-CG 3.22Å; W143-F147 PolarHBondContact O-N 3.11Å; W143-F169 HydrophobicContact CH2-CB 4.26Å; W143-F169 HydrophobicContact CH2-CD1 4.28Å; W143-F169 HydrophobicContact CH2-CG 4.12Å; W143-F169 AromaticContact CZ3-CD1 3.77Å; W143-F169 HydrophobicContact CZ3-CD1 3.77Å; W143-F169 HydrophobicContact CZ3-CD2 4.25Å; W143-F169 HydrophobicContact CZ3-CE1 4Å; W143-F169 HydrophobicContact CZ3-CE2 4.48Å; W143-F169 AromaticContact CZ3-CG 3.92Å; W143-F169 HydrophobicContact CZ3-CG 3.92Å; W143-F169 HydrophobicContact CZ3-CZ 4.38Å; W143-L176 HydrophobicContact CH2-CD2 4.04Å; W143-L176 HydrophobicContact CZ2-CD2 4.04Å; W143-V178 HydrophobicContact CH2-CG2 4.17Å; W143-V178 HydrophobicContact CZ2-CG2 4.33Å; W143-L238 HydrophobicContact CH2-CD2 3.76Å; W143-L238 HydrophobicContact CZ3-CD2 3.69Å; W143-T242 HydrophobicContact CD2-CG2 4.31Å; W143-T242 VanDerWaalsContact CE2-CG2 3.42Å; W143-T242 HydrophobicContact CH2-CG2 4.05Å; W143-T242 HydrophobicContact CZ2-CG2 3.28Å; W143-L244 HydrophobicContact CB-CD1 4.27Å; W143-L244 HydrophobicContact CB-CD2 4.47Å; W143-L244 HydrophobicContact CG-CD1 4.06Å; W143-L244 HydrophobicContact CG-CD2 4.36Å
144	A	92.3	Very high	92.4	Very high	53 Å²	53	57.2 Å²	57.2	44%	0.438	32%	0.318	S	S	.	.	H	α-helix	trans	-58.9	-42.7	176.9	0	0	0	0	0	111.3	E140 D141 K146 F147 L148	E140-A144 VanDerWaalsContact O-CB 3.29Å; E140-A144 WeakPolarHBondContact O-CB 2.91Å; E140-A144 PolarHBondContact O-N 2.95Å; D141-A144 PolarHBondContact O-N 3.01Å; A144-K146 PolarHBondContact O-N 2.6Å; A144-F147 PolarHBondContact O-N 3.42Å; A144-L148 WeakPolarHBondContact O-CB 3.46Å; A144-L148 PolarHBondContact O-N 3.39Å
145	I	92.8	Very high	92.9	Very high	27 Å²	27	56.8 Å²	56.8	14%	0.138	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.3	-64.8	167.6	0	0	0	110.9	F17 V134 V136 D141 W143 F147 L148 N149	F17-I145 HydrophobicContact CE2-CG2 4.04Å; F17-I145 HydrophobicContact CZ-CG2 3.63Å; V134-I145 HydrophobicContact CB-CD1 3.96Å; V134-I145 HydrophobicContact CG1-CD1 3.88Å; V134-I145 HydrophobicContact CG1-CG1 4.34Å; V136-I145 HydrophobicContact CG2-CD1 3.4Å; D141-I145 WeakPolarHBondContact O-CG1 3.28Å; D141-I145 PolarHBondContact O-N 3.45Å; W143-I145 VanDerWaalsContact C-N 3.3Å; W143-I145 PolarHBondContact O-N 3.31Å; I145-F147 VanDerWaalsContact C-N 3.33Å; I145-F147 PolarHBondContact O-N 2.65Å; I145-L148 PolarHBondContact O-N 3.11Å; I145-N149 WeakPolarHBondContact O-CB 3.33Å; I145-N149 PolarHBondContact O-N 3.26Å; I145-N149 PolarHBondContact O-OD1 3.29Å
146	K	93.3	Very high	93.1	Very high	13 Å²	13	53.3 Å²	53.3	6%	0.057	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-44.3	176.7	-68.4	176.9	-168.8	-61	0	111.7	A142 W143 A144 N149 I150 P167	A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.26Å; W143-K146 WeakPolarHBondContact O-CB 3.26Å; W143-K146 PolarHBondContact O-N 2.87Å; W143-K146 VanDerWaalsContact O-N 3.13Å; A144-K146 PolarHBondContact O-N 2.6Å; K146-N149 PolarHBondContact O-N 3.34Å; K146-I150 WeakPolarHBondContact O-CG1 3.44Å; K146-I150 PolarHBondContact O-N 3.31Å; K146-P167 HydrophobicContact CB-CB 4.45Å
147	F	94.3	Very high	93.4	Very high	72 Å²	72	52 Å²	52	32%	0.316	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-42	176.4	-61.6	-48.8	0	0	0	112.1	W143 A144 I145 N149 I150 L151 F169 L238	W143-F147 HydrophobicContact CB-CE2 4.07Å; W143-F147 HydrophobicContact CE3-CE1 4.05Å; W143-F147 HydrophobicContact CE3-CE2 4.12Å; W143-F147 AromaticContact CE3-CZ 3.58Å; W143-F147 HydrophobicContact CE3-CZ 3.58Å; W143-F147 HydrophobicContact CZ3-CE1 4.34Å; W143-F147 HydrophobicContact CZ3-CZ 4.18Å; W143-F147 WeakPolarHBondContact O-CD2 3.31Å; W143-F147 WeakPolarHBondContact O-CG 3.22Å; W143-F147 PolarHBondContact O-N 3.11Å; A144-F147 PolarHBondContact O-N 3.42Å; I145-F147 VanDerWaalsContact C-N 3.33Å; I145-F147 PolarHBondContact O-N 2.65Å; F147-N149 VanDerWaalsContact C-N 3.35Å; F147-N149 PolarHBondContact O-N 3.19Å; F147-I150 PolarHBondContact O-N 2.69Å; F147-L151 WeakPolarHBondContact O-CG 3.27Å; F147-L151 PolarHBondContact O-N 2.61Å; F147-F169 HydrophobicContact CD1-CE1 4.35Å; F147-F169 AromaticContact CD1-CZ 3.98Å; F147-F169 HydrophobicContact CD1-CZ 3.98Å; F147-F169 HydrophobicContact CE1-CE1 4.05Å; F147-F169 HydrophobicContact CE1-CE2 4.2Å; F147-F169 AromaticContact CE1-CZ 3.5Å; F147-F169 HydrophobicContact CE1-CZ 3.5Å; F147-F169 VanDerWaalsContact CE1-CZ 3.5Å; F147-L238 HydrophobicContact CE1-CD1 4.21Å; F147-L238 HydrophobicContact CZ-CD1 4.08Å
148	L	95.4	Very high	93.6	Very high	96 Å²	96	54.1 Å²	54.1	50%	0.503	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-45.2	177.3	-177.2	59.7	0	0	0	111	A144 I145 I150 L151 L152	A144-L148 WeakPolarHBondContact O-CB 3.46Å; A144-L148 PolarHBondContact O-N 3.39Å; I145-L148 PolarHBondContact O-N 3.11Å; L148-I150 PolarHBondContact O-N 3.29Å; L148-L151 PolarHBondContact O-N 2.73Å; L148-L151 VanDerWaalsContact O-N 3.14Å; L148-L152 HydrophobicContact CD1-CD1 4.27Å; L148-L152 HydrophobicContact CD1-CG 4.29Å; L148-L152 HydrophobicContact CG-CD1 3.98Å; L148-L152 HydrophobicContact CG-CG 4.42Å; L148-L152 VanDerWaalsContact O-CG 3.29Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.89Å
149	N	94	Very high	93.9	Very high	31 Å²	31	56 Å²	56	17%	0.166	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-45.3	176.1	-73.4	1.1	0	0	0	111.6	F17 I145 K146 F147 L151 L152 L153 P167	F17-N149 WeakPolarHBondContact CE1-ND2 3.21Å; F17-N149 WeakPolarHBondContact CE2-ND2 3.27Å; F17-N149 WeakPolarHBondContact CZ-ND2 3.1Å; I145-N149 WeakPolarHBondContact O-CB 3.33Å; I145-N149 PolarHBondContact O-N 3.26Å; I145-N149 PolarHBondContact O-OD1 3.29Å; K146-N149 PolarHBondContact O-N 3.34Å; F147-N149 VanDerWaalsContact C-N 3.35Å; F147-N149 PolarHBondContact O-N 3.19Å; N149-L151 VanDerWaalsContact C-N 3.31Å; N149-L151 PolarHBondContact O-N 3.41Å; N149-L152 PolarHBondContact O-N 3.11Å; N149-L153 VanDerWaalsContact O-CB 3.3Å; N149-L153 WeakPolarHBondContact O-CB 3.39Å; N149-L153 WeakPolarHBondContact O-CG 3.37Å; N149-L153 PolarHBondContact O-N 3.45Å; N149-P167 HydrophobicContact CB-CG 4.09Å
150	I	95.9	Very high	94.3	Very high	17 Å²	17	58 Å²	58	9%	0.087	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-46.2	175.2	-70.3	164.7	0	0	0	110.8	K146 F147 L148 L152 L153 I154 F166 P167 F169 M228	K146-I150 WeakPolarHBondContact O-CG1 3.44Å; K146-I150 PolarHBondContact O-N 3.31Å; F147-I150 PolarHBondContact O-N 2.69Å; L148-I150 PolarHBondContact O-N 3.29Å; I150-L152 VanDerWaalsContact C-N 3.29Å; I150-L152 PolarHBondContact O-N 3.11Å; I150-L153 PolarHBondContact O-N 3.36Å; I150-I154 HydrophobicContact CG2-CD1 3.6Å; I150-I154 HydrophobicContact CG2-CG1 4.33Å; I150-I154 WeakPolarHBondContact O-CD1 3.48Å; I150-I154 VanDerWaalsContact O-CG1 3.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.42Å; I150-I154 PolarHBondContact O-N 2.76Å; I150-I154 VanDerWaalsContact O-N 3.09Å; I150-F166 HydrophobicContact CB-CE2 4.45Å; I150-F166 HydrophobicContact CG1-CE2 4.26Å; I150-F166 HydrophobicContact CG1-CZ 4.18Å; I150-F166 HydrophobicContact CG2-CE2 4.22Å; I150-F166 HydrophobicContact CG2-CZ 4.04Å; I150-P167 HydrophobicContact CD1-CB 4.27Å; I150-P167 HydrophobicContact CG1-CB 4.18Å; I150-P167 HydrophobicContact CG1-CG 4.27Å; I150-F169 HydrophobicContact CD1-CE1 3.51Å; I150-F169 HydrophobicContact CD1-CZ 3.96Å; I150-M228 HydrophobicContact CD1-CE 3.8Å
151	L	96.3	Very high	94.5	Very high	121 Å²	121	55.9 Å²	55.9	63%	0.634	31%	0.308	S	S	*	.	H	α-helix	trans	-65	-31	179.8	-69.9	174	0	0	0	113.2	F147 L148 N149 P155	F147-L151 WeakPolarHBondContact O-CG 3.27Å; F147-L151 PolarHBondContact O-N 2.61Å; L148-L151 PolarHBondContact O-N 2.73Å; L148-L151 VanDerWaalsContact O-N 3.14Å; N149-L151 VanDerWaalsContact C-N 3.31Å; N149-L151 PolarHBondContact O-N 3.41Å; L151-P155 WeakPolarHBondContact O-CD 3.47Å
152	L	95	Very high	94.8	Very high	102 Å²	102	56.3 Å²	56.3	53%	0.534	31%	0.309	S	S	.	.	H	α-helix	trans	-79.6	-40.9	176.8	-68.5	173.2	0	0	0	112.2	L148 N149 I150 P155 T156	L148-L152 HydrophobicContact CD1-CD1 4.27Å; L148-L152 HydrophobicContact CD1-CG 4.29Å; L148-L152 HydrophobicContact CG-CD1 3.98Å; L148-L152 HydrophobicContact CG-CG 4.42Å; L148-L152 VanDerWaalsContact O-CG 3.29Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.89Å; N149-L152 PolarHBondContact O-N 3.11Å; I150-L152 VanDerWaalsContact C-N 3.29Å; I150-L152 PolarHBondContact O-N 3.11Å; L152-P155 WeakPolarHBondContact O-CD 3.13Å; L152-T156 PolarHBondContact O-OG1 3.31Å
153	L	96.8	Very high	95.2	Very high	16 Å²	16	55.8 Å²	55.8	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-74.7	-30.9	-176	-68.8	174	0	0	0	113	H129 N149 I150 T156 L157 I163 F166	H129-L153 WeakPolarHBondContact NE2-CD2 3.47Å; N149-L153 VanDerWaalsContact O-CB 3.3Å; N149-L153 WeakPolarHBondContact O-CB 3.39Å; N149-L153 WeakPolarHBondContact O-CG 3.37Å; N149-L153 PolarHBondContact O-N 3.45Å; I150-L153 PolarHBondContact O-N 3.36Å; L153-T156 PolarHBondContact O-N 2.87Å; L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 PolarHBondContact O-N 3.42Å; L153-I163 HydrophobicContact CB-CD1 3.82Å; L153-I163 HydrophobicContact CD2-CB 4.29Å; L153-I163 HydrophobicContact CD2-CG2 4.21Å; L153-F166 HydrophobicContact CB-CD2 3.95Å; L153-F166 HydrophobicContact CB-CE2 4.27Å; L153-F166 HydrophobicContact CD1-CB 4.44Å; L153-F166 HydrophobicContact CD1-CD2 3.86Å
154	I	96.1	Very high	95.4	Very high	69 Å²	69	56.3 Å²	56.3	35%	0.354	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-51.9	179.8	-72.9	164.3	0	0	0	112	I150 T156 L157 Q158 F166	I150-I154 HydrophobicContact CG2-CD1 3.6Å; I150-I154 HydrophobicContact CG2-CG1 4.33Å; I150-I154 WeakPolarHBondContact O-CD1 3.48Å; I150-I154 VanDerWaalsContact O-CG1 3.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.42Å; I150-I154 PolarHBondContact O-N 2.76Å; I150-I154 VanDerWaalsContact O-N 3.09Å; I154-T156 VanDerWaalsContact C-N 3.33Å; I154-T156 PolarHBondContact O-N 3.43Å; I154-L157 PolarHBondContact O-N 3.32Å; I154-Q158 WeakPolarHBondContact O-CG 3.27Å; I154-Q158 PolarHBondContact O-N 2.96Å; I154-F166 HydrophobicContact CG1-CE2 4.2Å; I154-F166 HydrophobicContact CG1-CZ 4.5Å
155	P	96.6	Very high	95.5	Very high	67 Å²	67	54.9 Å²	54.9	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-58.2	-42.1	174.2	-26.1	34.5	0	0	0	113.1	L151 L152 L157 Q158 S159	L151-P155 WeakPolarHBondContact O-CD 3.47Å; L152-P155 WeakPolarHBondContact O-CD 3.13Å; P155-L157 PolarHBondContact O-N 2.72Å; P155-Q158 WeakPolarHBondContact O-CB 3.48Å; P155-Q158 PolarHBondContact O-N 2.93Å; P155-Q158 VanDerWaalsContact O-N 3.08Å; P155-S159 PolarHBondContact O-N 3.46Å; P155-S159 PolarHBondContact O-OG 3.33Å; P155-S159 VanDerWaalsContact O-OG 3.11Å
156	T	95.8	Very high	95.7	Very high	34 Å²	34	54 Å²	54	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-45.1	177.7	-54.6	0	0	0	0	111.3	L152 L153 I154 Q158 S159 E160 I163	L152-T156 PolarHBondContact O-OG1 3.31Å; L153-T156 PolarHBondContact O-N 2.87Å; I154-T156 VanDerWaalsContact C-N 3.33Å; I154-T156 PolarHBondContact O-N 3.43Å; T156-Q158 VanDerWaalsContact C-N 3.27Å; T156-Q158 PolarHBondContact O-N 3.24Å; T156-S159 PolarHBondContact O-N 3.34Å; T156-S159 PolarHBondContact O-OG 3.45Å; T156-E160 HydrophobicContact CG2-CB 4.46Å; T156-E160 HydrophobicContact CG2-CG 4.27Å; T156-E160 WeakPolarHBondContact O-CB 3.46Å; T156-E160 PolarHBondContact O-N 3.24Å; T156-I163 HydrophobicContact CG2-CG2 3.84Å
157	L	96.8	Very high	95.9	Very high	13 Å²	13	53.7 Å²	53.7	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-39	174.1	176.5	59.2	0	0	0	111.4	L153 I154 P155 G161 I163 L184 Y186 L192	L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 PolarHBondContact O-N 3.42Å; I154-L157 PolarHBondContact O-N 3.32Å; P155-L157 PolarHBondContact O-N 2.72Å; L157-G161 WeakPolarHBondContact O-CA 3.14Å; L157-G161 PolarHBondContact O-N 3.4Å; L157-I163 HydrophobicContact CB-CD1 3.97Å; L157-I163 HydrophobicContact CB-CG1 4.08Å; L157-I163 HydrophobicContact CB-CG2 3.86Å; L157-I163 HydrophobicContact CD1-CG1 4.21Å; L157-I163 HydrophobicContact CD2-CD1 4.12Å; L157-I163 HydrophobicContact CD2-CG1 4.41Å; L157-I163 HydrophobicContact CG-CD1 4.49Å; L157-I163 HydrophobicContact CG-CG1 4.45Å; L157-L184 HydrophobicContact CD2-CB 4.45Å; L157-Y186 HydrophobicContact CD1-CD2 4.3Å; L157-Y186 HydrophobicContact CD1-CE2 4.01Å; L157-Y186 HydrophobicContact CG-CE2 4.05Å; L157-Y186 WeakPolarHBondContact O-CE2 3.38Å; L157-L192 HydrophobicContact CD1-CD1 4.08Å; L157-L192 HydrophobicContact CD2-CD1 3.97Å
158	Q	95.6	Very high	96	Very high	143 Å²	143	50.3 Å²	50.3	67%	0.668	27%	0.27	S	S	*	.	H	α-helix	trans	-69	-35.7	178	-70.4	175.8	-18.3	0	0	113.4	I154 P155 T156	I154-Q158 WeakPolarHBondContact O-CG 3.27Å; I154-Q158 PolarHBondContact O-N 2.96Å; P155-Q158 WeakPolarHBondContact O-CB 3.48Å; P155-Q158 PolarHBondContact O-N 2.93Å; P155-Q158 VanDerWaalsContact O-N 3.08Å; T156-Q158 VanDerWaalsContact C-N 3.27Å; T156-Q158 PolarHBondContact O-N 3.24Å
159	S	95.4	Very high	96	Very high	93 Å²	93	46.2 Å²	46.2	65%	0.65	25%	0.248	S	C	*	.	H	α-helix	trans	-88.7	-43.2	-177.4	54.8	0	0	0	0	114	P155 T156	P155-S159 PolarHBondContact O-N 3.46Å; P155-S159 PolarHBondContact O-OG 3.33Å; P155-S159 VanDerWaalsContact O-OG 3.11Å; T156-S159 PolarHBondContact O-N 3.34Å; T156-S159 PolarHBondContact O-OG 3.45Å
160	E	95.2	Very high	96.1	Very high	110 Å²	110	44.8 Å²	44.8	51%	0.514	24%	0.24	S	C	.	.	H	α-helix	trans	-99.8	-14.5	-173.3	-59.8	-177.2	-159.1	0	0	112.5	T156 H162	T156-E160 HydrophobicContact CG2-CB 4.46Å; T156-E160 HydrophobicContact CG2-CG 4.27Å; T156-E160 WeakPolarHBondContact O-CB 3.46Å; T156-E160 PolarHBondContact O-N 3.24Å; E160-H162 PolarHBondContact O-N 2.86Å; E160-H162 PolarHBondContact O-ND1 3.03Å
161	G	95.9	Very high	96	Very high	19 Å²	19	48.1 Å²	48.1	20%	0.196	26%	0.256	C	S	.	.	S	Bend	trans	77.2	4	174	0	0	0	0	0	115.3	L157 H185 Y186	L157-G161 WeakPolarHBondContact O-CA 3.14Å; L157-G161 PolarHBondContact O-N 3.4Å; G161-H185 CarbonylContact O-C 3.51Å; G161-H185 VanDerWaalsContact O-CA 3.24Å; G161-H185 WeakPolarHBondContact O-CA 3.36Å; G161-H185 WeakPolarHBondContact O-CB 3.26Å; G161-Y186 PolarHBondContact O-N 3.46Å
162	H	96	Very high	95.6	Very high	63 Å²	63	42.9 Å²	42.9	29%	0.292	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	147.3	176.9	66.8	-58.7	0	0	0	111.1	L128 E160 L184 H185	L128-H162 VanDerWaalsContact CD1-CD2 3.48Å; L128-H162 WeakPolarHBondContact CD1-CD2 3.15Å; L128-H162 WeakPolarHBondContact CD2-NE2 3.39Å; E160-H162 PolarHBondContact O-N 2.86Å; E160-H162 PolarHBondContact O-ND1 3.03Å; H162-L184 CarbonylContact C-O 3.49Å; H162-L184 VanDerWaalsContact CA-O 3.26Å; H162-L184 WeakPolarHBondContact CA-O 3.25Å; H162-H185 HydrophobicContact CB-CB 3.56Å
163	I	97.5	Very high	95.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	163.9	175.1	56	169.4	0	0	0	109.5	L153 T156 L157 F166 E183 L184	L153-I163 HydrophobicContact CB-CD1 3.82Å; L153-I163 HydrophobicContact CD2-CB 4.29Å; L153-I163 HydrophobicContact CD2-CG2 4.21Å; T156-I163 HydrophobicContact CG2-CG2 3.84Å; L157-I163 HydrophobicContact CB-CD1 3.97Å; L157-I163 HydrophobicContact CB-CG1 4.08Å; L157-I163 HydrophobicContact CB-CG2 3.86Å; L157-I163 HydrophobicContact CD1-CG1 4.21Å; L157-I163 HydrophobicContact CD2-CD1 4.12Å; L157-I163 HydrophobicContact CD2-CG1 4.41Å; L157-I163 HydrophobicContact CG-CD1 4.49Å; L157-I163 HydrophobicContact CG-CG1 4.45Å; I163-F166 HydrophobicContact CD1-CB 4.05Å; I163-F166 HydrophobicContact CD1-CD2 3.48Å; I163-F166 VanDerWaalsContact CD1-CD2 3.48Å; I163-F166 HydrophobicContact CD1-CE2 4.24Å; I163-F166 HydrophobicContact CD1-CG 4.03Å; I163-E183 WeakPolarHBondContact O-CA 3.04Å; I163-L184 HydrophobicContact CD1-CB 4.3Å; I163-L184 HydrophobicContact CD1-CD1 4.18Å; I163-L184 HydrophobicContact CG1-CB 3.85Å; I163-L184 PolarHBondContact N-O 3.36Å; I163-L184 PolarHBondContact O-N 3.24Å
164	R	96.3	Very high	95	Very high	24 Å²	24	48.9 Å²	48.9	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	165.5	175.3	-71.5	175.9	-179.5	161.1	6.1	112.1	R124 E127 L128 H129 F166 D182 E183	R124-R164 VanDerWaalsContact C-NH1 3.26Å; R124-R164 VanDerWaalsContact CA-NH1 3.27Å; R124-R164 VanDerWaalsContact CB-NH1 3.29Å; R124-R164 VanDerWaalsContact NH2-NH2 3.17Å; R124-R164 WeakPolarHBondContact O-CD 3.41Å; R124-R164 PolarHBondContact O-NH1 3.05Å; E127-R164 IonicContact OE2-CZ 3.57Å; E127-R164 IonicContact OE2-NH1 3.49Å; E127-R164 PolarHBondContact OE2-NH1 3.04Å; E127-R164 IonicContact OE2-NH2 3.9Å; E127-R164 PolarHBondContact OE2-NH2 3.35Å; L128-R164 HydrophobicContact CD1-CB 4.34Å; L128-R164 HydrophobicContact CD1-CG 3.73Å; H129-R164 PolarHBondContact CE1-N 3.16Å; H129-R164 VanDerWaalsContact CE1-N 3.27Å; H129-R164 PolarHBondContact CE1-O 3.13Å; R164-F166 VanDerWaalsContact C-N 3.31Å; R164-F166 PolarHBondContact O-N 3.06Å; R164-D182 CarbonylContact C-O 3.58Å; R164-D182 WeakPolarHBondContact CA-O 3.35Å; R164-D182 WeakPolarHBondContact CB-O 3.23Å; R164-D182 WeakPolarHBondContact CG-O 3.44Å; R164-E183 HydrophobicContact CG-CB 4.3Å; R164-E183 HydrophobicContact CG-CG 4.2Å; R164-E183 IonicContact NE-OE2 3.53Å; R164-E183 PolarHBondContact NE-OE2 2.85Å; R164-E183 IonicContact NH2-OE2 2.92Å
165	E	95.3	Very high	94.7	Very high	22 Å²	22	47.2 Å²	47.2	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	45.6	173.4	-57.4	-58.1	147.8	0	0	113.6	E125 P167 V180 I181 D182	E125-E165 HydrophobicContact CB-CG 3.95Å; E125-E165 VanDerWaalsContact CD-CG 3.49Å; E125-E165 HydrophobicContact CG-CB 4.34Å; E125-E165 HydrophobicContact CG-CG 3.72Å; E165-P167 VanDerWaalsContact O-CD 3.28Å; E165-P167 WeakPolarHBondContact O-CD 3.33Å; E165-V180 VanDerWaalsContact C-CG1 3.41Å; E165-V180 HydrophobicContact CB-CG1 4.05Å; E165-V180 VanDerWaalsContact OE2-CG1 3.22Å; E165-V180 WeakPolarHBondContact OE2-CG1 3.38Å; E165-I181 CarbonylContact C-O 3.49Å; E165-I181 VanDerWaalsContact CA-O 3.31Å; E165-I181 WeakPolarHBondContact CA-O 3.5Å; E165-I181 PolarHBondContact N-O 3.11Å; E165-I181 VanDerWaalsContact N-O 3.16Å; E165-D182 PolarHBondContact N-O 3.05Å
166	F	96.8	Very high	94.6	Very high	10 Å²	10	44 Å²	44	4%	0.044	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	117.2	-176.7	-175	-98	0	0	0	111.2	I150 L153 I154 I163 R164 V168 I181 L184 F225	I150-F166 HydrophobicContact CB-CE2 4.45Å; I150-F166 HydrophobicContact CG1-CE2 4.26Å; I150-F166 HydrophobicContact CG1-CZ 4.18Å; I150-F166 HydrophobicContact CG2-CE2 4.22Å; I150-F166 HydrophobicContact CG2-CZ 4.04Å; L153-F166 HydrophobicContact CB-CD2 3.95Å; L153-F166 HydrophobicContact CB-CE2 4.27Å; L153-F166 HydrophobicContact CD1-CB 4.44Å; L153-F166 HydrophobicContact CD1-CD2 3.86Å; I154-F166 HydrophobicContact CG1-CE2 4.2Å; I154-F166 HydrophobicContact CG1-CZ 4.5Å; I163-F166 HydrophobicContact CD1-CB 4.05Å; I163-F166 HydrophobicContact CD1-CD2 3.48Å; I163-F166 VanDerWaalsContact CD1-CD2 3.48Å; I163-F166 HydrophobicContact CD1-CE2 4.24Å; I163-F166 HydrophobicContact CD1-CG 4.03Å; R164-F166 VanDerWaalsContact C-N 3.31Å; R164-F166 PolarHBondContact O-N 3.06Å; F166-V168 HydrophobicContact CD1-CG1 3.65Å; F166-V168 HydrophobicContact CE1-CG1 3.84Å; F166-V168 PolarHBondContact O-N 3.38Å; F166-I181 HydrophobicContact CB-CB 4.35Å; F166-I181 PolarHBondContact N-O 3.18Å; F166-I181 PolarHBondContact O-N 3.25Å; F166-L184 HydrophobicContact CB-CD1 3.76Å; F166-L184 HydrophobicContact CB-CG 4.45Å; F166-L184 HydrophobicContact CD1-CD1 3.59Å; F166-L184 HydrophobicContact CD2-CD1 4.28Å; F166-L184 HydrophobicContact CE1-CD1 4.24Å; F166-L184 HydrophobicContact CG-CD1 3.61Å; F166-F225 HydrophobicContact CD1-CD2 4.34Å; F166-F225 HydrophobicContact CD1-CE2 4.25Å; F166-F225 AromaticContact CE1-CD2 3.99Å; F166-F225 HydrophobicContact CE1-CD2 3.99Å; F166-F225 AromaticContact CE1-CE2 3.79Å; F166-F225 HydrophobicContact CE1-CE2 3.79Å; F166-F225 HydrophobicContact CZ-CE2 4.48Å
167	P	96.9	Very high	94.6	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.032	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	134.9	-179.9	-17.2	31.3	0	0	0	111.6	K146 N149 I150 E165	K146-P167 HydrophobicContact CB-CB 4.45Å; N149-P167 HydrophobicContact CB-CG 4.09Å; I150-P167 HydrophobicContact CD1-CB 4.27Å; I150-P167 HydrophobicContact CG1-CB 4.18Å; I150-P167 HydrophobicContact CG1-CG 4.27Å; E165-P167 VanDerWaalsContact O-CD 3.28Å; E165-P167 WeakPolarHBondContact O-CD 3.33Å
168	V	96.8	Very high	94.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.9	176.7	-69.7	0	0	0	0	112.4	F166 V178 G179 I181 Y221 I224 F225 M228	F166-V168 HydrophobicContact CD1-CG1 3.65Å; F166-V168 HydrophobicContact CE1-CG1 3.84Å; F166-V168 PolarHBondContact O-N 3.38Å; V168-V178 CarbonylContact O-C 3.56Å; V168-V178 WeakPolarHBondContact O-CA 3.34Å; V168-G179 WeakPolarHBondContact CG2-O 3.49Å; V168-G179 PolarHBondContact N-O 2.67Å; V168-G179 PolarHBondContact O-N 3.5Å; V168-G179 VanDerWaalsContact O-O 3.05Å; V168-I181 HydrophobicContact CB-CD1 4.45Å; V168-I181 HydrophobicContact CG1-CD1 3.45Å; V168-I181 VanDerWaalsContact CG1-CD1 3.45Å; V168-I181 HydrophobicContact CG1-CG1 4.02Å; V168-I181 HydrophobicContact CG2-CD1 4.18Å; V168-I181 HydrophobicContact CG2-CG1 3.94Å; V168-Y221 HydrophobicContact CG2-CD1 3.85Å; V168-Y221 HydrophobicContact CG2-CE1 4.43Å; V168-I224 HydrophobicContact CB-CD1 3.99Å; V168-I224 HydrophobicContact CB-CG1 4.07Å; V168-I224 HydrophobicContact CG2-CD1 3.54Å; V168-I224 HydrophobicContact CG2-CG1 3.97Å; V168-F225 HydrophobicContact CG1-CB 4.31Å; V168-F225 HydrophobicContact CG1-CD2 3.96Å; V168-M228 VanDerWaalsContact CA-SD 3.58Å; V168-M228 HydrophobicContact CB-SD 3.83Å; V168-M228 HydrophobicContact CG1-SD 3.9Å
169	F	96.3	Very high	94.6	Very high	11 Å²	11	35.7 Å²	35.7	5%	0.048	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	150.4	176.2	47.1	-95.8	0	0	0	110.8	W143 F147 I150 L176 L177 V178 M228 V233 L238	W143-F169 HydrophobicContact CH2-CB 4.26Å; W143-F169 HydrophobicContact CH2-CD1 4.28Å; W143-F169 HydrophobicContact CH2-CG 4.12Å; W143-F169 AromaticContact CZ3-CD1 3.77Å; W143-F169 HydrophobicContact CZ3-CD1 3.77Å; W143-F169 HydrophobicContact CZ3-CD2 4.25Å; W143-F169 HydrophobicContact CZ3-CE1 4Å; W143-F169 HydrophobicContact CZ3-CE2 4.48Å; W143-F169 AromaticContact CZ3-CG 3.92Å; W143-F169 HydrophobicContact CZ3-CG 3.92Å; W143-F169 HydrophobicContact CZ3-CZ 4.38Å; F147-F169 HydrophobicContact CD1-CE1 4.35Å; F147-F169 AromaticContact CD1-CZ 3.98Å; F147-F169 HydrophobicContact CD1-CZ 3.98Å; F147-F169 HydrophobicContact CE1-CE1 4.05Å; F147-F169 HydrophobicContact CE1-CE2 4.2Å; F147-F169 AromaticContact CE1-CZ 3.5Å; F147-F169 HydrophobicContact CE1-CZ 3.5Å; F147-F169 VanDerWaalsContact CE1-CZ 3.5Å; I150-F169 HydrophobicContact CD1-CE1 3.51Å; I150-F169 HydrophobicContact CD1-CZ 3.96Å; F169-L176 HydrophobicContact CB-CD1 4.46Å; F169-L177 CarbonylContact C-O 3.51Å; F169-L177 WeakPolarHBondContact CA-O 3.5Å; F169-L177 WeakPolarHBondContact CB-O 3.32Å; F169-V178 HydrophobicContact CB-CG2 4.08Å; F169-M228 HydrophobicContact CD1-CE 4.43Å; F169-M228 HydrophobicContact CE1-CE 4.02Å; F169-M228 HydrophobicContact CE2-CE 4.23Å; F169-M228 HydrophobicContact CZ-CE 3.88Å; F169-M228 PolarHBondContact N-SD 2.71Å; F169-M228 WeakPolarHBondContact O-CG 3.43Å; F169-M228 VanDerWaalsContact O-SD 3.41Å; F169-V233 HydrophobicContact CD2-CG1 3.85Å; F169-V233 HydrophobicContact CE2-CG1 3.79Å; F169-V233 WeakPolarHBondContact O-CG2 3.33Å; F169-L238 HydrophobicContact CD2-CD1 4.49Å; F169-L238 HydrophobicContact CD2-CD2 3.82Å; F169-L238 HydrophobicContact CE2-CD1 3.94Å; F169-L238 HydrophobicContact CE2-CD2 4.08Å
170	G	95.4	Very high	94.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	160.1	179.7	0	0	0	0	0	112.1	L177	G170-L177 PolarHBondContact N-O 3.43Å; G170-L177 WeakPolarHBondContact O-CA 3.24Å; G170-L177 WeakPolarHBondContact O-CB 3.36Å; G170-L177 PolarHBondContact O-N 2.71Å
171	E	92.9	Very high	94.7	Very high	87 Å²	87	27.4 Å²	27.4	41%	0.407	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.2	178.9	-168	-175.9	145.6	0	0	110.5	V175 S237 H241	E171-V175 WeakPolarHBondContact CA-O 3.46Å; E171-S237 PolarHBondContact OE2-OG 2.67Å; E171-H241 IonicContact OE2-NE2 2.72Å
172	G	89.4	Confident	94.7	Very high	12 Å²	12	27 Å²	27	12%	0.124	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.1	171.8	0	0	0	0	0	110.1	G174 V175	G172-G174 PolarHBondContact O-N 3.09Å; G172-G174 VanDerWaalsContact O-N 3.14Å; G172-V175 PolarHBondContact N-O 3.48Å; G172-V175 PolarHBondContact O-N 2.82Å; G172-V175 VanDerWaalsContact O-O 3.14Å
173	E	88.8	Confident	94.8	Very high	196 Å²	196	25.4 Å²	25.4	92%	0.916	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	36.4	-179.8	-58.1	-64.7	163.5	0	0	113.9	V175	E173-V175 VanDerWaalsContact C-N 3.28Å; E173-V175 PolarHBondContact O-N 3.13Å
174	G	88.9	Confident	94.8	Very high	47 Å²	47	25.5 Å²	25.5	49%	0.485	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	15.3	-178.9	0	0	0	0	0	114.7	G172 H241	G172-G174 PolarHBondContact O-N 3.09Å; G172-G174 VanDerWaalsContact O-N 3.14Å; G174-H241 PolarHBondContact O-CE1 3.1Å
175	V	91.3	Very high	94.8	Very high	34 Å²	34	26.4 Å²	26.4	21%	0.206	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.3	176.1	-179	0	0	0	0	109.5	M73 L81 E171 G172 E173 L177	M73-V175 HydrophobicContact CE-CG1 3.98Å; M73-V175 HydrophobicContact SD-CG1 4.05Å; L81-V175 HydrophobicContact CB-CG1 4.48Å; L81-V175 HydrophobicContact CD1-CG1 3.8Å; L81-V175 HydrophobicContact CG-CG1 3.84Å; E171-V175 WeakPolarHBondContact CA-O 3.46Å; G172-V175 PolarHBondContact N-O 3.48Å; G172-V175 PolarHBondContact O-N 2.82Å; G172-V175 VanDerWaalsContact O-O 3.14Å; E173-V175 VanDerWaalsContact C-N 3.28Å; E173-V175 PolarHBondContact O-N 3.13Å; V175-L177 HydrophobicContact CG1-CD2 4.46Å; V175-L177 PolarHBondContact O-N 2.98Å
176	L	94	Very high	95	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	126.3	171.7	-178.5	65.3	0	0	0	109.5	Y80 L81 W143 F169 V178 L238 H241 T242	Y80-L176 CarbonylContact C-O 3.54Å; Y80-L176 WeakPolarHBondContact CA-O 3.48Å; Y80-L176 WeakPolarHBondContact CB-O 3.37Å; Y80-L176 HydrophobicContact CD1-CD2 4.42Å; L81-L176 PolarHBondContact N-O 3.43Å; W143-L176 HydrophobicContact CH2-CD2 4.04Å; W143-L176 HydrophobicContact CZ2-CD2 4.04Å; F169-L176 HydrophobicContact CB-CD1 4.46Å; L176-V178 HydrophobicContact CD2-CG2 4.45Å; L176-V178 HydrophobicContact CG-CG2 4.25Å; L176-L238 HydrophobicContact CD1-CD2 4.22Å; L176-L238 HydrophobicContact CD2-CD2 4.27Å; L176-H241 HydrophobicContact CB-CB 3.63Å; L176-H241 HydrophobicContact CD2-CB 3.74Å; L176-H241 HydrophobicContact CG-CB 4.28Å; L176-T242 HydrophobicContact CD2-CG2 3.63Å
177	L	95.3	Very high	95	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.052	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.6	172.8	-55.9	-174.9	0	0	0	108.9	L81 L86 F169 G170 V175 L220 I224	L81-L177 HydrophobicContact CB-CD2 3.95Å; L81-L177 CarbonylContact O-C 3.51Å; L81-L177 WeakPolarHBondContact O-CA 3.41Å; L86-L177 HydrophobicContact CD1-CD1 4.34Å; L86-L177 HydrophobicContact CD1-CD2 3.45Å; L86-L177 VanDerWaalsContact CD1-CD2 3.45Å; F169-L177 CarbonylContact C-O 3.51Å; F169-L177 WeakPolarHBondContact CA-O 3.5Å; F169-L177 WeakPolarHBondContact CB-O 3.32Å; G170-L177 PolarHBondContact N-O 3.43Å; G170-L177 WeakPolarHBondContact O-CA 3.24Å; G170-L177 WeakPolarHBondContact O-CB 3.36Å; G170-L177 PolarHBondContact O-N 2.71Å; V175-L177 HydrophobicContact CG1-CD2 4.46Å; V175-L177 PolarHBondContact O-N 2.98Å; L177-L220 HydrophobicContact CD1-CD2 4.46Å; L177-I224 HydrophobicContact CB-CG2 3.94Å; L177-I224 HydrophobicContact CD1-CG2 3.92Å; L177-I224 HydrophobicContact CG-CG2 4.49Å
178	V	96	Very high	94.8	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.024	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.2	178.1	-177.8	0	0	0	0	108.7	Y80 L81 Y82 V83 W143 V168 F169 L176	Y80-V178 HydrophobicContact CD1-CG2 4.44Å; Y80-V178 HydrophobicContact CD2-CB 3.91Å; Y80-V178 HydrophobicContact CD2-CG2 3.53Å; Y80-V178 HydrophobicContact CE2-CB 4.26Å; Y80-V178 HydrophobicContact CE2-CG2 4.06Å; Y80-V178 HydrophobicContact CG-CG2 3.74Å; L81-V178 PolarHBondContact O-N 3.5Å; Y82-V178 CarbonylContact C-O 3.58Å; Y82-V178 VanDerWaalsContact CA-O 3.26Å; Y82-V178 WeakPolarHBondContact CA-O 3.39Å; Y82-V178 HydrophobicContact CD1-CB 4.43Å; Y82-V178 HydrophobicContact CE1-CB 4.47Å; Y82-V178 HydrophobicContact CE1-CG1 4.27Å; V83-V178 PolarHBondContact N-O 3.26Å; W143-V178 HydrophobicContact CH2-CG2 4.17Å; W143-V178 HydrophobicContact CZ2-CG2 4.33Å; V168-V178 CarbonylContact O-C 3.56Å; V168-V178 WeakPolarHBondContact O-CA 3.34Å; F169-V178 HydrophobicContact CB-CG2 4.08Å; L176-V178 HydrophobicContact CD2-CG2 4.45Å; L176-V178 HydrophobicContact CG-CG2 4.25Å
179	G	95.7	Very high	94.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-175.3	167.9	0	0	0	0	0	112.1	V168	V168-G179 WeakPolarHBondContact CG2-O 3.49Å; V168-G179 PolarHBondContact N-O 2.67Å; V168-G179 PolarHBondContact O-N 3.5Å; V168-G179 VanDerWaalsContact O-O 3.05Å
180	V	96.3	Very high	94.7	Very high	29 Å²	29	46.5 Å²	46.5	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.6	178.5	-172.7	0	0	0	0	108.5	E165 Y221	E165-V180 VanDerWaalsContact C-CG1 3.41Å; E165-V180 HydrophobicContact CB-CG1 4.05Å; E165-V180 VanDerWaalsContact OE2-CG1 3.22Å; E165-V180 WeakPolarHBondContact OE2-CG1 3.38Å; V180-Y221 WeakPolarHBondContact O-CE1 3.34Å; V180-Y221 VanDerWaalsContact O-CZ 3.26Å; V180-Y221 PolarHBondContact O-OH 3.43Å
181	I	97.2	Very high	94.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.9	175	-68.2	172.1	0	0	0	108.3	E165 F166 V168 E183 L184 L194 Y221 F225	E165-I181 CarbonylContact C-O 3.49Å; E165-I181 VanDerWaalsContact CA-O 3.31Å; E165-I181 WeakPolarHBondContact CA-O 3.5Å; E165-I181 PolarHBondContact N-O 3.11Å; E165-I181 VanDerWaalsContact N-O 3.16Å; F166-I181 HydrophobicContact CB-CB 4.35Å; F166-I181 PolarHBondContact N-O 3.18Å; F166-I181 PolarHBondContact O-N 3.25Å; V168-I181 HydrophobicContact CB-CD1 4.45Å; V168-I181 HydrophobicContact CG1-CD1 3.45Å; V168-I181 VanDerWaalsContact CG1-CD1 3.45Å; V168-I181 HydrophobicContact CG1-CG1 4.02Å; V168-I181 HydrophobicContact CG2-CD1 4.18Å; V168-I181 HydrophobicContact CG2-CG1 3.94Å; I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 WeakPolarHBondContact CG2-O 3.23Å; I181-E183 PolarHBondContact O-N 3.34Å; I181-L184 HydrophobicContact CD1-CD1 4.43Å; I181-L184 HydrophobicContact CD1-CD2 4.23Å; I181-L184 HydrophobicContact CG2-CD2 3.99Å; I181-L184 HydrophobicContact CG2-CG 3.83Å; I181-L194 HydrophobicContact CD1-CD1 3.43Å; I181-L194 VanDerWaalsContact CD1-CD1 3.43Å; I181-L194 HydrophobicContact CD1-CG 4.12Å; I181-L194 HydrophobicContact CG1-CD1 3.84Å; I181-L194 HydrophobicContact CG1-CG 4.29Å; I181-L194 HydrophobicContact CG2-CD1 4.09Å; I181-L194 HydrophobicContact CG2-CD2 4.05Å; I181-L194 HydrophobicContact CG2-CG 3.58Å; I181-Y221 HydrophobicContact CG1-CD1 4.09Å; I181-Y221 HydrophobicContact CG1-CG 4.07Å; I181-F225 HydrophobicContact CD1-CB 4.24Å; I181-F225 HydrophobicContact CD1-CD2 4.01Å; I181-F225 HydrophobicContact CD1-CG 4.36Å
182	D	96.1	Very high	94.8	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.064	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	-45.5	180	-68.7	-23.8	0	0	0	112.5	H121 R164 E165 E196 L197	H121-D182 IonicContact CE1-OD1 2.62Å; H121-D182 PolarHBondContact CE1-OD1 3.1Å; H121-D182 IonicContact CE1-OD2 3.81Å; H121-D182 PolarHBondContact CE1-OD2 3.27Å; H121-D182 VanDerWaalsContact CE1-OD2 3.31Å; H121-D182 IonicContact ND1-OD1 3.27Å; H121-D182 PolarHBondContact ND1-OD1 3.29Å; H121-D182 IonicContact ND1-OD2 3.41Å; R164-D182 CarbonylContact C-O 3.58Å; R164-D182 WeakPolarHBondContact CA-O 3.35Å; R164-D182 WeakPolarHBondContact CB-O 3.23Å; R164-D182 WeakPolarHBondContact CG-O 3.44Å; E165-D182 PolarHBondContact N-O 3.05Å; D182-E196 WeakPolarHBondContact OD2-CA 3.34Å; D182-E196 VanDerWaalsContact OD2-CD 3.24Å; D182-L197 PolarHBondContact OD2-N 2.93Å
183	E	96.9	Very high	95.2	Very high	29 Å²	29	54.5 Å²	54.5	14%	0.136	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	135.3	-178.1	-169.5	179.9	117.8	0	0	113	R124 I163 R164 I181 H185 A195	R124-E183 IonicContact CZ-OE2 3.43Å; R124-E183 IonicContact NH1-OE2 2.71Å; R124-E183 IonicContact NH2-OE2 3.21Å; R124-E183 PolarHBondContact NH2-OE2 3.01Å; I163-E183 WeakPolarHBondContact O-CA 3.04Å; R164-E183 HydrophobicContact CG-CB 4.3Å; R164-E183 HydrophobicContact CG-CG 4.2Å; R164-E183 IonicContact NE-OE2 3.53Å; R164-E183 PolarHBondContact NE-OE2 2.85Å; R164-E183 IonicContact NH2-OE2 2.92Å; I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 WeakPolarHBondContact CG2-O 3.23Å; I181-E183 PolarHBondContact O-N 3.34Å; E183-H185 IonicContact OE1-CE1 2.96Å; E183-H185 IonicContact OE1-CG 3.75Å; E183-H185 IonicContact OE1-ND1 2.73Å; E183-H185 PolarHBondContact OE1-ND1 3.25Å; E183-A195 HydrophobicContact CB-CB 4.24Å; E183-A195 PolarHBondContact N-O 3.05Å; E183-A195 VanDerWaalsContact N-O 3.13Å; E183-A195 PolarHBondContact O-N 3.28Å
184	L	97.8	Very high	95.6	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.3	167.2	-70	172.2	0	0	0	109	L157 H162 I163 F166 I181 L192 E193 L194 F225	L157-L184 HydrophobicContact CD2-CB 4.45Å; H162-L184 CarbonylContact C-O 3.49Å; H162-L184 VanDerWaalsContact CA-O 3.26Å; H162-L184 WeakPolarHBondContact CA-O 3.25Å; I163-L184 HydrophobicContact CD1-CB 4.3Å; I163-L184 HydrophobicContact CD1-CD1 4.18Å; I163-L184 HydrophobicContact CG1-CB 3.85Å; I163-L184 PolarHBondContact N-O 3.36Å; I163-L184 PolarHBondContact O-N 3.24Å; F166-L184 HydrophobicContact CB-CD1 3.76Å; F166-L184 HydrophobicContact CB-CG 4.45Å; F166-L184 HydrophobicContact CD1-CD1 3.59Å; F166-L184 HydrophobicContact CD2-CD1 4.28Å; F166-L184 HydrophobicContact CE1-CD1 4.24Å; F166-L184 HydrophobicContact CG-CD1 3.61Å; I181-L184 HydrophobicContact CD1-CD1 4.43Å; I181-L184 HydrophobicContact CD1-CD2 4.23Å; I181-L184 HydrophobicContact CG2-CD2 3.99Å; I181-L184 HydrophobicContact CG2-CG 3.83Å; L184-L192 HydrophobicContact CB-CD1 4.43Å; L184-E193 WeakPolarHBondContact CA-O 3.43Å; L184-L194 HydrophobicContact CD2-CB 3.92Å; L184-L194 HydrophobicContact CD2-CG 4.12Å; L184-F225 HydrophobicContact CD1-CD2 4.4Å; L184-F225 HydrophobicContact CD1-CE2 3.76Å; L184-F225 HydrophobicContact CD1-CZ 4.34Å
185	H	97.7	Very high	96	Very high	43 Å²	43	46.5 Å²	46.5	20%	0.199	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	157.4	177.1	68.6	-100	0	0	0	112.9	G161 H162 E183 E193	G161-H185 CarbonylContact O-C 3.51Å; G161-H185 VanDerWaalsContact O-CA 3.24Å; G161-H185 WeakPolarHBondContact O-CA 3.36Å; G161-H185 WeakPolarHBondContact O-CB 3.26Å; H162-H185 HydrophobicContact CB-CB 3.56Å; E183-H185 IonicContact OE1-CE1 2.96Å; E183-H185 IonicContact OE1-CG 3.75Å; E183-H185 IonicContact OE1-ND1 2.73Å; E183-H185 PolarHBondContact OE1-ND1 3.25Å; H185-E193 PolarHBondContact N-O 3.34Å; H185-E193 IonicContact NE2-OE2 3.81Å; H185-E193 PolarHBondContact O-N 3.02Å
186	Y	97.9	Very high	96.1	Very high	98 Å²	98	46.7 Å²	46.7	38%	0.384	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.1	171.3	-65.8	-68.5	0	0	0	111.3	L157 G161 E191 L192	L157-Y186 HydrophobicContact CD1-CD2 4.3Å; L157-Y186 HydrophobicContact CD1-CE2 4.01Å; L157-Y186 HydrophobicContact CG-CE2 4.05Å; L157-Y186 WeakPolarHBondContact O-CE2 3.38Å; G161-Y186 PolarHBondContact O-N 3.46Å; Y186-E191 CarbonylContact C-O 3.57Å; Y186-E191 WeakPolarHBondContact CA-O 3.47Å; Y186-L192 HydrophobicContact CD1-CB 4.13Å; Y186-L192 HydrophobicContact CD1-CD1 4.08Å; Y186-L192 HydrophobicContact CE1-CB 3.97Å; Y186-L192 HydrophobicContact CE1-CD1 3.91Å; Y186-L192 HydrophobicContact CE1-CG 4.47Å
187	T	96.8	Very high	96.1	Very high	28 Å²	28	49.2 Å²	49.2	17%	0.172	27%	0.273	C	S	.	.			trans	-70.1	169.2	170.3	69.4	0	0	0	0	111.3	K189 G190 E191 E193	T187-K189 PolarHBondContact O-N 3.07Å; T187-K189 PolarHBondContact OG1-N 3.35Å; T187-G190 PolarHBondContact O-N 3.39Å; T187-E191 HydrophobicContact CG2-CB 4.42Å; T187-E191 PolarHBondContact N-O 2.98Å; T187-E191 PolarHBondContact OG1-N 3.5Å; T187-E191 PolarHBondContact OG1-O 3.17Å; T187-E193 HydrophobicContact CG2-CB 4.18Å; T187-E193 HydrophobicContact CG2-CG 3.47Å; T187-E193 VanDerWaalsContact CG2-CG 3.47Å; T187-E193 VanDerWaalsContact CG2-OE1 3.24Å; T187-E193 WeakPolarHBondContact CG2-OE1 3.31Å; T187-E193 WeakPolarHBondContact CG2-OE2 3.47Å
188	A	94.4	Very high	95.9	Very high	119 Å²	119	52.3 Å²	52.3	98%	0.983	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.6	171.7	0	0	0	0	0	114
189	K	95.8	Very high	95.5	Very high	174 Å²	174	54.7 Å²	54.7	76%	0.757	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-4.6	175.5	-59.4	-179.3	-173.4	167.9	0	113.3	T187 E191	T187-K189 PolarHBondContact O-N 3.07Å; T187-K189 PolarHBondContact OG1-N 3.35Å; K189-E191 VanDerWaalsContact C-N 3.34Å; K189-E191 HydrophobicContact CB-CG 4.25Å
190	G	93.6	Very high	95	Very high	51 Å²	51	59.2 Å²	59.2	53%	0.526	32%	0.318	S	S	.	.	S	Bend	trans	79.5	13.9	-173.5	0	0	0	0	0	114	T187	T187-G190 PolarHBondContact O-N 3.39Å
191	E	95.4	Very high	94.5	Very high	107 Å²	107	66.7 Å²	66.7	50%	0.5	34%	0.343	S	S	.	.			trans	-81.7	135	174.1	-62.4	171.9	151.9	0	0	108.8	Y186 T187 K189 E193	Y186-E191 CarbonylContact C-O 3.57Å; Y186-E191 WeakPolarHBondContact CA-O 3.47Å; T187-E191 HydrophobicContact CG2-CB 4.42Å; T187-E191 PolarHBondContact N-O 2.98Å; T187-E191 PolarHBondContact OG1-N 3.5Å; T187-E191 PolarHBondContact OG1-O 3.17Å; K189-E191 VanDerWaalsContact C-N 3.34Å; K189-E191 HydrophobicContact CB-CG 4.25Å; E191-E193 PolarHBondContact O-N 3.16Å
192	L	96.7	Very high	94	Very high	67 Å²	67	75 Å²	75	35%	0.351	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119	175.1	-174.7	66.3	0	0	0	109.5	L157 L184 Y186 F225	L157-L192 HydrophobicContact CD1-CD1 4.08Å; L157-L192 HydrophobicContact CD2-CD1 3.97Å; L184-L192 HydrophobicContact CB-CD1 4.43Å; Y186-L192 HydrophobicContact CD1-CB 4.13Å; Y186-L192 HydrophobicContact CD1-CD1 4.08Å; Y186-L192 HydrophobicContact CE1-CB 3.97Å; Y186-L192 HydrophobicContact CE1-CD1 3.91Å; Y186-L192 HydrophobicContact CE1-CG 4.47Å; L192-F225 HydrophobicContact CD2-CE1 3.88Å; L192-F225 HydrophobicContact CD2-CZ 3.65Å
193	E	97.6	Very high	93.7	Very high	94 Å²	94	81.1 Å²	81.1	44%	0.439	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143.5	176.5	-80.6	-175	179.6	0	0	111.2	L184 H185 T187 E191	L184-E193 WeakPolarHBondContact CA-O 3.43Å; H185-E193 PolarHBondContact N-O 3.34Å; H185-E193 IonicContact NE2-OE2 3.81Å; H185-E193 PolarHBondContact O-N 3.02Å; T187-E193 HydrophobicContact CG2-CB 4.18Å; T187-E193 HydrophobicContact CG2-CG 3.47Å; T187-E193 VanDerWaalsContact CG2-CG 3.47Å; T187-E193 VanDerWaalsContact CG2-OE1 3.24Å; T187-E193 WeakPolarHBondContact CG2-OE1 3.31Å; T187-E193 WeakPolarHBondContact CG2-OE2 3.47Å; E191-E193 PolarHBondContact O-N 3.16Å
194	L	97.5	Very high	93.4	Very high	40 Å²	40	85.4 Å²	85.4	21%	0.209	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.2	172.7	-176.5	167.8	0	0	0	107.7	I181 L184 V218	I181-L194 HydrophobicContact CD1-CD1 3.43Å; I181-L194 VanDerWaalsContact CD1-CD1 3.43Å; I181-L194 HydrophobicContact CD1-CG 4.12Å; I181-L194 HydrophobicContact CG1-CD1 3.84Å; I181-L194 HydrophobicContact CG1-CG 4.29Å; I181-L194 HydrophobicContact CG2-CD1 4.09Å; I181-L194 HydrophobicContact CG2-CD2 4.05Å; I181-L194 HydrophobicContact CG2-CG 3.58Å; L184-L194 HydrophobicContact CD2-CB 3.92Å; L184-L194 HydrophobicContact CD2-CG 4.12Å; L194-V218 HydrophobicContact CD2-CG1 4.22Å
195	A	95.9	Very high	93.1	Very high	34 Å²	34	92.6 Å²	92.6	28%	0.281	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.3	177.1	0	0	0	0	0	111	E183	E183-A195 HydrophobicContact CB-CB 4.24Å; E183-A195 PolarHBondContact N-O 3.05Å; E183-A195 VanDerWaalsContact N-O 3.13Å; E183-A195 PolarHBondContact O-N 3.28Å
196	E	94.3	Very high	92.8	Very high	39 Å²	39	92.2 Å²	92.2	18%	0.182	47%	0.474	C	S	.	.			trans	-112.3	125	175	179.1	78.5	179.6	0	0	108.3	D182 K198 Q217 V218 Y221	D182-E196 WeakPolarHBondContact OD2-CA 3.34Å; D182-E196 VanDerWaalsContact OD2-CD 3.24Å; E196-K198 HydrophobicContact CG-CD 4.42Å; E196-K198 HydrophobicContact CG-CG 4.48Å; E196-K198 VanDerWaalsContact OE1-CE 3.25Å; E196-K198 WeakPolarHBondContact OE1-CE 3.46Å; E196-K198 IonicContact OE1-NZ 3.94Å; E196-K198 PolarHBondContact OE1-NZ 3.19Å; E196-Q217 PolarHBondContact OE1-NE2 3.41Å; E196-V218 HydrophobicContact CB-CG2 3.71Å; E196-V218 HydrophobicContact CG-CG2 4.39Å; E196-Y221 VanDerWaalsContact OE2-CE2 3.27Å; E196-Y221 WeakPolarHBondContact OE2-CE2 3.43Å
197	L	93.2	Very high	92.5	Very high	52 Å²	52	93.6 Å²	93.6	27%	0.272	49%	0.488	S	S	.	.			trans	-92.2	130.5	173.8	178.3	65.8	0	0	0	109.9	I120 H121 D182	I120-L197 HydrophobicContact CG2-CD2 4.25Å; H121-L197 PolarHBondContact CE1-O 2.98Å; H121-L197 VanDerWaalsContact CE1-O 3.29Å; H121-L197 PolarHBondContact NE2-O 2.72Å; D182-L197 PolarHBondContact OD2-N 2.93Å
198	K	90.6	Very high	92.2	Very high	75 Å²	75	98.6 Å²	98.6	33%	0.326	51%	0.509	S	S	.	.			trans	-120.6	125.3	167.9	-64.2	-59.4	-174.8	-160.3	0	110.7	E196	E196-K198 HydrophobicContact CG-CD 4.42Å; E196-K198 HydrophobicContact CG-CG 4.48Å; E196-K198 VanDerWaalsContact OE1-CE 3.25Å; E196-K198 WeakPolarHBondContact OE1-CE 3.46Å; E196-K198 IonicContact OE1-NZ 3.94Å; E196-K198 PolarHBondContact OE1-NZ 3.19Å
199	T	89.1	Confident	92	Very high	55 Å²	55	95 Å²	95	34%	0.337	48%	0.48	S	S	.	.			trans	-87.7	148.4	176.3	61.1	0	0	0	0	111.1	G117 I120	G117-T199 WeakPolarHBondContact CA-OG1 3.4Å; I120-T199 HydrophobicContact CB-CG2 4.06Å; I120-T199 HydrophobicContact CD1-CG2 3.82Å; I120-T199 HydrophobicContact CG2-CG2 3.9Å
200	R	84.9	Confident	91.7	Very high	96 Å²	96	90.3 Å²	90.3	36%	0.362	46%	0.46	S	S	.	.			trans	-144.7	138.1	-177.6	-66.4	-178.5	174.7	-97.9	-18.2	110.8	R202 D214	R200-R202 VanDerWaalsContact C-N 3.34Å; R200-R202 PolarHBondContact O-N 2.78Å; R200-D214 IonicContact NH2-OD2 3.07Å
201	R	85.8	Confident	91.6	Very high	186 Å²	186	91.8 Å²	91.8	70%	0.702	45%	0.453	S	S	*	.	S	Bend	trans	-66.1	-33.2	176.7	-176.1	177.3	176.1	-174.1	3	113.6	E109	E109-R201 IonicContact OE1-NH1 3.98Å; E109-R201 PolarHBondContact OE1-NH1 3.42Å; E109-R201 VanDerWaalsContact OE1-NH1 3.07Å
202	R	86.8	Confident	91.4	Very high	174 Å²	174	93.2 Å²	93.2	66%	0.657	46%	0.457	S	S	*	.	S	Bend	trans	-108.2	140.1	-177.4	-63.6	-175.8	-176.9	-179.7	2.8	109.7	R200 M204	R200-R202 VanDerWaalsContact C-N 3.34Å; R200-R202 PolarHBondContact O-N 2.78Å; R202-M204 HydrophobicContact CB-CE 3.96Å; R202-M204 HydrophobicContact CB-CG 4.42Å; R202-M204 HydrophobicContact CG-CE 4.42Å; R202-M204 PolarHBondContact O-N 3.08Å
203	P	88.8	Confident	91.2	Very high	140 Å²	140	92.3 Å²	92.3	91%	0.909	45%	0.45	S	S	*	.	S	Bend	trans	-78.2	55.6	178	35.4	-37.3	0	0	0	110.6
204	M	90.4	Very high	90.9	Very high	119 Å²	119	89 Å²	89	59%	0.586	44%	0.436	S	S	*	.	S	Bend	trans	-125.1	144.1	178.6	-63.2	-173.1	-52.9	0	0	108.9	R202	R202-M204 HydrophobicContact CB-CE 3.96Å; R202-M204 HydrophobicContact CB-CG 4.42Å; R202-M204 HydrophobicContact CG-CE 4.42Å; R202-M204 PolarHBondContact O-N 3.08Å
205	L	91.7	Very high	90.8	Very high	154 Å²	154	90.8 Å²	90.8	81%	0.806	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-62.2	149.2	176.4	-67.9	177.2	0	0	0	111.3
206	P	90.8	Very high	90.8	Very high	34 Å²	34	92.9 Å²	92.9	22%	0.221	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-55.7	145.5	173.2	20.8	-32.3	0	0	0	112.5	Q210 K211	P206-Q210 HydrophobicContact CB-CB 4.12Å; P206-K211 HydrophobicContact CB-CG 3.83Å; P206-K211 HydrophobicContact CG-CD 4.34Å; P206-K211 HydrophobicContact CG-CG 3.66Å; P206-K211 VanDerWaalsContact O-CE 3.31Å; P206-K211 WeakPolarHBondContact O-CE 3.06Å
207	L	91.8	Very high	90.8	Very high	127 Å²	127	91.1 Å²	91.1	67%	0.665	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-67	155.4	166.1	-65	172.8	0	0	0	110.2	A209 Q210 K211	L207-A209 PolarHBondContact O-N 3.23Å; L207-Q210 HydrophobicContact CB-CG 4.44Å; L207-Q210 VanDerWaalsContact N-OE1 3.1Å; L207-Q210 WeakPolarHBondContact O-CA 3.43Å; L207-Q210 WeakPolarHBondContact O-CB 3.47Å; L207-Q210 PolarHBondContact O-N 3.38Å; L207-K211 PolarHBondContact O-N 3.47Å
208	E	92	Very high	91	Very high	134 Å²	134	91 Å²	91	63%	0.626	45%	0.446	S	S	*	.	H	α-helix	trans	-56.3	-36.8	-179.5	-65	-52.4	122.3	0	0	113.4	Q210 K211 K212	E208-Q210 VanDerWaalsContact C-N 3.31Å; E208-Q210 PolarHBondContact O-N 3.46Å; E208-K211 PolarHBondContact O-N 3.38Å; E208-K211 WeakPolarHBondContact OE1-CE 3.42Å; E208-K211 IonicContact OE1-NZ 3.7Å; E208-K211 PolarHBondContact OE1-NZ 3.35Å; E208-K212 WeakPolarHBondContact O-CB 3.16Å; E208-K212 PolarHBondContact O-N 3.49Å
209	A	89.1	Confident	91.3	Very high	44 Å²	44	90.5 Å²	90.5	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-64.5	-36.6	175.6	0	0	0	0	0	112.9	W91 L207 K212 K213	W91-A209 HydrophobicContact CE3-CB 4.04Å; W91-A209 HydrophobicContact CZ3-CB 3.53Å; L207-A209 PolarHBondContact O-N 3.23Å; A209-K212 PolarHBondContact O-N 3.39Å; A209-K213 PolarHBondContact O-N 3.2Å; A209-K213 VanDerWaalsContact O-N 3.11Å
210	Q	89.4	Confident	91.7	Very high	74 Å²	74	89 Å²	89	35%	0.346	44%	0.442	S	S	.	.	H	α-helix	trans	-69.9	-44.2	175.6	-62.8	176.2	-51.5	0	0	110.2	P206 L207 E208 K212 K213 D214	P206-Q210 HydrophobicContact CB-CB 4.12Å; L207-Q210 HydrophobicContact CB-CG 4.44Å; L207-Q210 VanDerWaalsContact N-OE1 3.1Å; L207-Q210 WeakPolarHBondContact O-CA 3.43Å; L207-Q210 WeakPolarHBondContact O-CB 3.47Å; L207-Q210 PolarHBondContact O-N 3.38Å; E208-Q210 VanDerWaalsContact C-N 3.31Å; E208-Q210 PolarHBondContact O-N 3.46Å; Q210-K212 VanDerWaalsContact C-N 3.26Å; Q210-K212 PolarHBondContact O-N 2.99Å; Q210-K213 WeakPolarHBondContact O-CB 3.39Å; Q210-K213 PolarHBondContact O-N 2.87Å; Q210-K213 VanDerWaalsContact O-N 3.11Å; Q210-D214 PolarHBondContact O-N 3.07Å
211	K	91.7	Very high	92.3	Very high	83 Å²	83	84.6 Å²	84.6	36%	0.361	43%	0.425	S	S	.	.	H	α-helix	trans	-57	-40.5	173.7	-65.1	-179.5	-174.1	166.7	0	111.9	P206 L207 E208 D214 C215	P206-K211 HydrophobicContact CB-CG 3.83Å; P206-K211 HydrophobicContact CG-CD 4.34Å; P206-K211 HydrophobicContact CG-CG 3.66Å; P206-K211 VanDerWaalsContact O-CE 3.31Å; P206-K211 WeakPolarHBondContact O-CE 3.06Å; L207-K211 PolarHBondContact O-N 3.47Å; E208-K211 PolarHBondContact O-N 3.38Å; E208-K211 WeakPolarHBondContact OE1-CE 3.42Å; E208-K211 IonicContact OE1-NZ 3.7Å; E208-K211 PolarHBondContact OE1-NZ 3.35Å; K211-D214 PolarHBondContact O-N 3.15Å; K211-C215 WeakPolarHBondContact O-CB 3.44Å; K211-C215 PolarHBondContact O-N 3.15Å
212	K	91.9	Very high	92.8	Very high	137 Å²	137	80.8 Å²	80.8	60%	0.596	41%	0.414	S	S	*	.	H	α-helix	trans	-63	-43	176.6	-171.2	-178.4	177.8	-171.3	0	111.7	E208 A209 Q210 F216	E208-K212 WeakPolarHBondContact O-CB 3.16Å; E208-K212 PolarHBondContact O-N 3.49Å; A209-K212 PolarHBondContact O-N 3.39Å; Q210-K212 VanDerWaalsContact C-N 3.26Å; Q210-K212 PolarHBondContact O-N 2.99Å; K212-F216 WeakPolarHBondContact O-CB 3.05Å; K212-F216 PolarHBondContact O-N 2.62Å
213	K	91.8	Very high	93.3	Very high	48 Å²	48	78.3 Å²	78.3	21%	0.209	41%	0.406	C	S	.	.	H	α-helix	trans	-60.7	-49.6	174.5	-170.7	-164.4	64.9	67.3	0	111.4	A87 A209 Q210 F216 Q217	A87-K213 HydrophobicContact CB-CG 4.49Å; A87-K213 VanDerWaalsContact O-CG 3.23Å; A87-K213 WeakPolarHBondContact O-CG 3.1Å; A209-K213 PolarHBondContact O-N 3.2Å; A209-K213 VanDerWaalsContact O-N 3.11Å; Q210-K213 WeakPolarHBondContact O-CB 3.39Å; Q210-K213 PolarHBondContact O-N 2.87Å; Q210-K213 VanDerWaalsContact O-N 3.11Å; K213-F216 PolarHBondContact O-N 3.27Å; K213-Q217 PolarHBondContact O-N 2.92Å
214	D	92.3	Very high	93.7	Very high	25 Å²	25	71.7 Å²	71.7	13%	0.134	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-37.7	-177.3	-59.5	-23.2	0	0	0	110.9	R200 Q210 K211 F216 Q217 V218	R200-D214 IonicContact NH2-OD2 3.07Å; Q210-D214 PolarHBondContact O-N 3.07Å; K211-D214 PolarHBondContact O-N 3.15Å; D214-F216 PolarHBondContact O-N 3.3Å; D214-Q217 WeakPolarHBondContact O-CB 3.36Å; D214-Q217 PolarHBondContact O-N 3.07Å; D214-V218 WeakPolarHBondContact O-CG2 2.97Å; D214-V218 PolarHBondContact O-N 3.16Å
215	C	94.8	Very high	94.1	Very high	77 Å²	77	67.5 Å²	67.5	52%	0.52	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-41.1	172.2	-179	0	0	0	0	112.2	K211 S219	K211-C215 WeakPolarHBondContact O-CB 3.44Å; K211-C215 PolarHBondContact O-N 3.15Å; C215-S219 WeakPolarHBondContact O-CB 3.17Å; C215-S219 PolarHBondContact O-N 2.9Å; C215-S219 PolarHBondContact O-OG 3.41Å
216	F	95.1	Very high	94.3	Very high	78 Å²	78	62.4 Å²	62.4	34%	0.342	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-41.3	175.5	-178.9	-121.9	0	0	0	111.7	A87 N90 K212 K213 D214 S219 L220	A87-F216 HydrophobicContact CB-CD1 4.43Å; N90-F216 HydrophobicContact CB-CD1 4.1Å; K212-F216 WeakPolarHBondContact O-CB 3.05Å; K212-F216 PolarHBondContact O-N 2.62Å; K213-F216 PolarHBondContact O-N 3.27Å; D214-F216 PolarHBondContact O-N 3.3Å; F216-S219 PolarHBondContact O-N 3.48Å; F216-L220 HydrophobicContact CD1-CD1 4.23Å; F216-L220 HydrophobicContact CD2-CG 4.49Å; F216-L220 HydrophobicContact CE1-CD1 3.73Å; F216-L220 HydrophobicContact CE1-CG 4.44Å; F216-L220 HydrophobicContact CE2-CD1 4.26Å; F216-L220 HydrophobicContact CE2-CD2 4.28Å; F216-L220 HydrophobicContact CE2-CG 4.11Å; F216-L220 HydrophobicContact CZ-CD1 3.74Å; F216-L220 HydrophobicContact CZ-CD2 4.25Å; F216-L220 HydrophobicContact CZ-CG 4.08Å; F216-L220 WeakPolarHBondContact O-CG 3.43Å; F216-L220 PolarHBondContact O-N 3.46Å
217	Q	95.6	Very high	94.6	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-58.2	-52	174.5	-163.1	-170.7	-23.3	0	0	111.4	V83 T84 A87 E196 K213 D214 S219 L220 Y221	V83-Q217 HydrophobicContact CG1-CG 3.74Å; T84-Q217 PolarHBondContact OG1-NE2 3.39Å; A87-Q217 HydrophobicContact CB-CB 3.72Å; A87-Q217 HydrophobicContact CB-CG 3.91Å; E196-Q217 PolarHBondContact OE1-NE2 3.41Å; K213-Q217 PolarHBondContact O-N 2.92Å; D214-Q217 WeakPolarHBondContact O-CB 3.36Å; D214-Q217 PolarHBondContact O-N 3.07Å; Q217-S219 VanDerWaalsContact C-N 3.29Å; Q217-S219 PolarHBondContact O-N 3.47Å; Q217-L220 WeakPolarHBondContact O-CB 3.38Å; Q217-L220 PolarHBondContact O-N 2.98Å; Q217-L220 VanDerWaalsContact O-N 3.14Å; Q217-Y221 HydrophobicContact CG-CD2 4.27Å; Q217-Y221 HydrophobicContact CG-CE2 3.62Å; Q217-Y221 PolarHBondContact NE2-OH 3.28Å; Q217-Y221 WeakPolarHBondContact O-CD2 3.38Å; Q217-Y221 PolarHBondContact O-N 2.85Å
218	V	96.9	Very high	94.7	Very high	49 Å²	49	57 Å²	57	30%	0.297	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-38.9	177.3	171.5	0	0	0	0	111.9	L194 E196 D214 L220 Y221 K222	L194-V218 HydrophobicContact CD2-CG1 4.22Å; E196-V218 HydrophobicContact CB-CG2 3.71Å; E196-V218 HydrophobicContact CG-CG2 4.39Å; D214-V218 WeakPolarHBondContact O-CG2 2.97Å; D214-V218 PolarHBondContact O-N 3.16Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 3.17Å; V218-Y221 PolarHBondContact O-N 2.79Å; V218-K222 WeakPolarHBondContact O-CB 3.46Å; V218-K222 PolarHBondContact O-N 2.91Å
219	S	96.7	Very high	94.9	Very high	65 Å²	65	55.5 Å²	55.5	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-39.5	176.9	-60	0	0	0	0	111.9	C215 F216 Q217 Y223	C215-S219 WeakPolarHBondContact O-CB 3.17Å; C215-S219 PolarHBondContact O-N 2.9Å; C215-S219 PolarHBondContact O-OG 3.41Å; F216-S219 PolarHBondContact O-N 3.48Å; Q217-S219 VanDerWaalsContact C-N 3.29Å; Q217-S219 PolarHBondContact O-N 3.47Å; S219-Y223 WeakPolarHBondContact O-CB 3.39Å; S219-Y223 PolarHBondContact O-N 3.45Å
220	L	96.8	Very high	95.2	Very high	23 Å²	23	59 Å²	59	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-46.4	175.4	-75.3	175.7	0	0	0	111.6	V83 L86 L177 F216 Q217 V218 K222 Y223 I224	V83-L220 HydrophobicContact CG1-CB 3.73Å; V83-L220 HydrophobicContact CG1-CD1 4.17Å; V83-L220 HydrophobicContact CG2-CB 4.26Å; L86-L220 HydrophobicContact CB-CD1 3.86Å; L86-L220 HydrophobicContact CD1-CD1 4.27Å; L177-L220 HydrophobicContact CD1-CD2 4.46Å; F216-L220 HydrophobicContact CD1-CD1 4.23Å; F216-L220 HydrophobicContact CD2-CG 4.49Å; F216-L220 HydrophobicContact CE1-CD1 3.73Å; F216-L220 HydrophobicContact CE1-CG 4.44Å; F216-L220 HydrophobicContact CE2-CD1 4.26Å; F216-L220 HydrophobicContact CE2-CD2 4.28Å; F216-L220 HydrophobicContact CE2-CG 4.11Å; F216-L220 HydrophobicContact CZ-CD1 3.74Å; F216-L220 HydrophobicContact CZ-CD2 4.25Å; F216-L220 HydrophobicContact CZ-CG 4.08Å; F216-L220 WeakPolarHBondContact O-CG 3.43Å; F216-L220 PolarHBondContact O-N 3.46Å; Q217-L220 WeakPolarHBondContact O-CB 3.38Å; Q217-L220 PolarHBondContact O-N 2.98Å; Q217-L220 VanDerWaalsContact O-N 3.14Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 3.17Å; L220-K222 VanDerWaalsContact C-N 3.32Å; L220-K222 PolarHBondContact O-N 2.9Å; L220-Y223 WeakPolarHBondContact O-CB 3.21Å; L220-Y223 PolarHBondContact O-N 3.12Å; L220-I224 WeakPolarHBondContact O-CG1 3.49Å; L220-I224 PolarHBondContact O-N 3.45Å
221	Y	98	Very high	95.4	Very high	4 Å²	4	58 Å²	58	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-57.5	-46.5	175.3	-70.1	-52.6	0	0	0	111.7	D22 V83 V168 V180 I181 E196 Q217 V218 Y223 I224 F225	D22-Y221 PolarHBondContact OD2-OH 2.9Å; V83-Y221 HydrophobicContact CB-CD1 3.99Å; V83-Y221 HydrophobicContact CB-CE1 3.51Å; V83-Y221 HydrophobicContact CG1-CD1 3.8Å; V83-Y221 HydrophobicContact CG1-CD2 4.19Å; V83-Y221 HydrophobicContact CG1-CE1 3.54Å; V83-Y221 HydrophobicContact CG1-CE2 3.96Å; V83-Y221 HydrophobicContact CG1-CG 4.08Å; V83-Y221 HydrophobicContact CG2-CD1 3.86Å; V83-Y221 HydrophobicContact CG2-CE1 3.81Å; V168-Y221 HydrophobicContact CG2-CD1 3.85Å; V168-Y221 HydrophobicContact CG2-CE1 4.43Å; V180-Y221 WeakPolarHBondContact O-CE1 3.34Å; V180-Y221 VanDerWaalsContact O-CZ 3.26Å; V180-Y221 PolarHBondContact O-OH 3.43Å; I181-Y221 HydrophobicContact CG1-CD1 4.09Å; I181-Y221 HydrophobicContact CG1-CG 4.07Å; E196-Y221 VanDerWaalsContact OE2-CE2 3.27Å; E196-Y221 WeakPolarHBondContact OE2-CE2 3.43Å; Q217-Y221 HydrophobicContact CG-CD2 4.27Å; Q217-Y221 HydrophobicContact CG-CE2 3.62Å; Q217-Y221 PolarHBondContact NE2-OH 3.28Å; Q217-Y221 WeakPolarHBondContact O-CD2 3.38Å; Q217-Y221 PolarHBondContact O-N 2.85Å; V218-Y221 PolarHBondContact O-N 2.79Å; Y221-Y223 VanDerWaalsContact C-N 3.34Å; Y221-Y223 PolarHBondContact O-N 3.16Å; Y221-I224 HydrophobicContact CD1-CD1 4.46Å; Y221-I224 VanDerWaalsContact O-CG1 3.32Å; Y221-I224 WeakPolarHBondContact O-CG1 3.28Å; Y221-I224 PolarHBondContact O-N 2.8Å; Y221-F225 WeakPolarHBondContact O-CB 3.44Å; Y221-F225 PolarHBondContact O-N 3.43Å
222	K	97.4	Very high	95.4	Very high	107 Å²	107	60.5 Å²	60.5	47%	0.465	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-43.4	176.8	177.1	154.2	174.9	46.5	0	112.1	V218 L220 I224 F225 D226	V218-K222 WeakPolarHBondContact O-CB 3.46Å; V218-K222 PolarHBondContact O-N 2.91Å; L220-K222 VanDerWaalsContact C-N 3.32Å; L220-K222 PolarHBondContact O-N 2.9Å; K222-I224 PolarHBondContact O-N 3.07Å; K222-F225 PolarHBondContact O-N 2.89Å; K222-D226 IonicContact NZ-OD1 2.93Å; K222-D226 PolarHBondContact NZ-OD1 3Å; K222-D226 IonicContact NZ-OD2 3.46Å; K222-D226 PolarHBondContact NZ-OD2 3.46Å; K222-D226 WeakPolarHBondContact O-CB 3.37Å; K222-D226 PolarHBondContact O-N 3.37Å
223	Y	97.1	Very high	95.4	Very high	122 Å²	122	55.4 Å²	55.4	48%	0.478	29%	0.294	S	S	.	.	H	α-helix	trans	-58	-48.7	178.5	171.5	-99.7	0	0	0	112.2	S219 L220 Y221 A227	S219-Y223 WeakPolarHBondContact O-CB 3.39Å; S219-Y223 PolarHBondContact O-N 3.45Å; L220-Y223 WeakPolarHBondContact O-CB 3.21Å; L220-Y223 PolarHBondContact O-N 3.12Å; Y221-Y223 VanDerWaalsContact C-N 3.34Å; Y221-Y223 PolarHBondContact O-N 3.16Å; Y223-A227 PolarHBondContact O-N 3.17Å; Y223-A227 VanDerWaalsContact O-N 3.16Å
224	I	97.2	Very high	95.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-74.8	-35.5	-179.3	64.1	-177.9	0	0	0	112.4	V83 V168 L177 L220 Y221 K222 A227 M228	V83-I224 HydrophobicContact CG2-CD1 3.67Å; V168-I224 HydrophobicContact CB-CD1 3.99Å; V168-I224 HydrophobicContact CB-CG1 4.07Å; V168-I224 HydrophobicContact CG2-CD1 3.54Å; V168-I224 HydrophobicContact CG2-CG1 3.97Å; L177-I224 HydrophobicContact CB-CG2 3.94Å; L177-I224 HydrophobicContact CD1-CG2 3.92Å; L177-I224 HydrophobicContact CG-CG2 4.49Å; L220-I224 WeakPolarHBondContact O-CG1 3.49Å; L220-I224 PolarHBondContact O-N 3.45Å; Y221-I224 HydrophobicContact CD1-CD1 4.46Å; Y221-I224 VanDerWaalsContact O-CG1 3.32Å; Y221-I224 WeakPolarHBondContact O-CG1 3.28Å; Y221-I224 PolarHBondContact O-N 2.8Å; K222-I224 PolarHBondContact O-N 3.07Å; I224-A227 WeakPolarHBondContact O-CB 3.29Å; I224-A227 PolarHBondContact O-N 3.16Å; I224-M228 WeakPolarHBondContact O-CG 3.12Å; I224-M228 PolarHBondContact O-N 2.66Å
225	F	97.5	Very high	95.2	Very high	31 Å²	31	59.5 Å²	59.5	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-47.8	173.5	179.2	-95.2	0	0	0	111.4	F166 V168 I181 L184 L192 Y221 K222 A227 M228 V229	F166-F225 HydrophobicContact CD1-CD2 4.34Å; F166-F225 HydrophobicContact CD1-CE2 4.25Å; F166-F225 AromaticContact CE1-CD2 3.99Å; F166-F225 HydrophobicContact CE1-CD2 3.99Å; F166-F225 AromaticContact CE1-CE2 3.79Å; F166-F225 HydrophobicContact CE1-CE2 3.79Å; F166-F225 HydrophobicContact CZ-CE2 4.48Å; V168-F225 HydrophobicContact CG1-CB 4.31Å; V168-F225 HydrophobicContact CG1-CD2 3.96Å; I181-F225 HydrophobicContact CD1-CB 4.24Å; I181-F225 HydrophobicContact CD1-CD2 4.01Å; I181-F225 HydrophobicContact CD1-CG 4.36Å; L184-F225 HydrophobicContact CD1-CD2 4.4Å; L184-F225 HydrophobicContact CD1-CE2 3.76Å; L184-F225 HydrophobicContact CD1-CZ 4.34Å; L192-F225 HydrophobicContact CD2-CE1 3.88Å; L192-F225 HydrophobicContact CD2-CZ 3.65Å; Y221-F225 WeakPolarHBondContact O-CB 3.44Å; Y221-F225 PolarHBondContact O-N 3.43Å; K222-F225 PolarHBondContact O-N 2.89Å; F225-A227 PolarHBondContact O-N 3.36Å; F225-M228 WeakPolarHBondContact O-CB 3.42Å; F225-M228 PolarHBondContact O-N 3.36Å; F225-M228 VanDerWaalsContact O-N 3.13Å; F225-V229 HydrophobicContact CD1-CG2 4.07Å; F225-V229 HydrophobicContact CE1-CG2 3.66Å; F225-V229 HydrophobicContact CE2-CG2 4.39Å; F225-V229 HydrophobicContact CZ-CG2 3.84Å; F225-V229 WeakPolarHBondContact O-CG2 3.38Å; F225-V229 PolarHBondContact O-N 3.35Å
226	D	96.8	Very high	94.9	Very high	48 Å²	48	59.2 Å²	59.2	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-60.5	-36.1	176.3	-72.8	-14.6	0	0	0	111.1	K222 V229 Q230	K222-D226 IonicContact NZ-OD1 2.93Å; K222-D226 PolarHBondContact NZ-OD1 3Å; K222-D226 IonicContact NZ-OD2 3.46Å; K222-D226 PolarHBondContact NZ-OD2 3.46Å; K222-D226 WeakPolarHBondContact O-CB 3.37Å; K222-D226 PolarHBondContact O-N 3.37Å; D226-V229 PolarHBondContact O-N 3.4Å; D226-Q230 VanDerWaalsContact O-CB 3.27Å; D226-Q230 WeakPolarHBondContact O-CB 3.4Å; D226-Q230 VanDerWaalsContact O-CD 3.29Å; D226-Q230 WeakPolarHBondContact O-CG 3.33Å; D226-Q230 PolarHBondContact O-N 3.36Å
227	A	95.8	Very high	94.5	Very high	7 Å²	7	56.1 Å²	56.1	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-65.4	-40.2	175.7	0	0	0	0	0	112.6	Y223 I224 F225 G231 K232	Y223-A227 PolarHBondContact O-N 3.17Å; Y223-A227 VanDerWaalsContact O-N 3.16Å; I224-A227 WeakPolarHBondContact O-CB 3.29Å; I224-A227 PolarHBondContact O-N 3.16Å; F225-A227 PolarHBondContact O-N 3.36Å; A227-G231 PolarHBondContact O-N 2.89Å; A227-K232 HydrophobicContact CB-CB 4.23Å; A227-K232 HydrophobicContact CB-CD 4.3Å; A227-K232 WeakPolarHBondContact O-CB 3.49Å; A227-K232 PolarHBondContact O-N 3.25Å
228	M	95.4	Very high	94.1	Very high	40 Å²	40	56.9 Å²	56.9	20%	0.197	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-49.8	173.4	-67.3	172	72.7	0	0	111.2	I150 V168 F169 I224 F225 Q230 G231 V233	I150-M228 HydrophobicContact CD1-CE 3.8Å; V168-M228 VanDerWaalsContact CA-SD 3.58Å; V168-M228 HydrophobicContact CB-SD 3.83Å; V168-M228 HydrophobicContact CG1-SD 3.9Å; F169-M228 HydrophobicContact CD1-CE 4.43Å; F169-M228 HydrophobicContact CE1-CE 4.02Å; F169-M228 HydrophobicContact CE2-CE 4.23Å; F169-M228 HydrophobicContact CZ-CE 3.88Å; F169-M228 PolarHBondContact N-SD 2.71Å; F169-M228 WeakPolarHBondContact O-CG 3.43Å; F169-M228 VanDerWaalsContact O-SD 3.41Å; I224-M228 WeakPolarHBondContact O-CG 3.12Å; I224-M228 PolarHBondContact O-N 2.66Å; F225-M228 WeakPolarHBondContact O-CB 3.42Å; F225-M228 PolarHBondContact O-N 3.36Å; F225-M228 VanDerWaalsContact O-N 3.13Å; M228-Q230 VanDerWaalsContact C-N 3.27Å; M228-Q230 PolarHBondContact O-N 3.42Å; M228-G231 PolarHBondContact O-N 3.37Å; M228-V233 HydrophobicContact CG-CG2 3.97Å
229	V	94.9	Very high	93.8	Very high	103 Å²	103	57.1 Å²	57.1	62%	0.624	32%	0.32	S	S	*	.	H	α-helix	trans	-61.3	-36.9	-179.2	173.9	0	0	0	0	111.5	F225 D226 G231	F225-V229 HydrophobicContact CD1-CG2 4.07Å; F225-V229 HydrophobicContact CE1-CG2 3.66Å; F225-V229 HydrophobicContact CE2-CG2 4.39Å; F225-V229 HydrophobicContact CZ-CG2 3.84Å; F225-V229 WeakPolarHBondContact O-CG2 3.38Å; F225-V229 PolarHBondContact O-N 3.35Å; D226-V229 PolarHBondContact O-N 3.4Å; V229-G231 PolarHBondContact O-N 3.43Å
230	Q	95.5	Very high	93.3	Very high	117 Å²	117	60.6 Å²	60.6	55%	0.547	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.3	177.6	-69.2	165.9	26.7	0	0	113.5	D226 M228 K232	D226-Q230 VanDerWaalsContact O-CB 3.27Å; D226-Q230 WeakPolarHBondContact O-CB 3.4Å; D226-Q230 VanDerWaalsContact O-CD 3.29Å; D226-Q230 WeakPolarHBondContact O-CG 3.33Å; D226-Q230 PolarHBondContact O-N 3.36Å; M228-Q230 VanDerWaalsContact C-N 3.27Å; M228-Q230 PolarHBondContact O-N 3.42Å; Q230-K232 VanDerWaalsContact C-N 3.28Å; Q230-K232 HydrophobicContact CB-CD 4.4Å; Q230-K232 HydrophobicContact CB-CG 4.19Å; Q230-K232 PolarHBondContact O-N 3.34Å
231	G	93.4	Very high	92.8	Very high	52 Å²	52	60.6 Å²	60.6	54%	0.536	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	23.5	-178.4	0	0	0	0	0	113.9	A227 M228 V229 V233	A227-G231 PolarHBondContact O-N 2.89Å; M228-G231 PolarHBondContact O-N 3.37Å; V229-G231 PolarHBondContact O-N 3.43Å; G231-V233 VanDerWaalsContact C-N 3.28Å
232	K	93.3	Very high	92.2	Very high	137 Å²	137	60.5 Å²	60.5	60%	0.596	33%	0.328	S	S	*	.			trans	-74.2	-22.7	176.7	-69.2	176.1	172.5	164.5	0	112.3	A227 Q230 T234	A227-K232 HydrophobicContact CB-CB 4.23Å; A227-K232 HydrophobicContact CB-CD 4.3Å; A227-K232 WeakPolarHBondContact O-CB 3.49Å; A227-K232 PolarHBondContact O-N 3.25Å; Q230-K232 VanDerWaalsContact C-N 3.28Å; Q230-K232 HydrophobicContact CB-CD 4.4Å; Q230-K232 HydrophobicContact CB-CG 4.19Å; Q230-K232 PolarHBondContact O-N 3.34Å; K232-T234 PolarHBondContact O-N 2.79Å
233	V	91.8	Very high	91.6	Very high	29 Å²	29	62.8 Å²	62.8	18%	0.176	34%	0.338	C	S	.	.			trans	-81.3	105.7	174.7	-172.8	0	0	0	0	108.9	F169 M228 G231 L238	F169-V233 HydrophobicContact CD2-CG1 3.85Å; F169-V233 HydrophobicContact CE2-CG1 3.79Å; F169-V233 WeakPolarHBondContact O-CG2 3.33Å; M228-V233 HydrophobicContact CG-CG2 3.97Å; G231-V233 VanDerWaalsContact C-N 3.28Å; V233-L238 HydrophobicContact CG1-CD1 3.82Å; V233-L238 HydrophobicContact CG1-CD2 4.25Å; V233-L238 HydrophobicContact CG1-CG 3.81Å
234	T	90.3	Very high	90.8	Very high	63 Å²	63	58.3 Å²	58.3	39%	0.387	32%	0.322	S	S	.	.			trans	-96.9	151.5	178.5	65	0	0	0	0	110.8	K232 A236 S237 L238	K232-T234 PolarHBondContact O-N 2.79Å; T234-A236 PolarHBondContact O-N 3.43Å; T234-S237 PolarHBondContact O-N 3.2Å; T234-S237 VanDerWaalsContact O-N 3.13Å; T234-S237 WeakPolarHBondContact OG1-CB 3.12Å; T234-S237 PolarHBondContact OG1-N 2.88Å; T234-L238 PolarHBondContact O-N 3.15Å; T234-L238 VanDerWaalsContact O-N 3.08Å
235	P	88.9	Confident	89.9	Confident	97 Å²	97	62.6 Å²	62.6	63%	0.63	35%	0.351	S	S	*	.	H	α-helix	trans	-54.1	-37.7	173.1	-27.3	35.1	0	0	0	112.7	L238 I239	P235-L238 PolarHBondContact O-N 3.09Å; P235-I239 VanDerWaalsContact O-CD1 3.3Å; P235-I239 WeakPolarHBondContact O-CD1 3.44Å; P235-I239 WeakPolarHBondContact O-CG1 3.48Å; P235-I239 PolarHBondContact O-N 3.34Å
236	A	87.8	Confident	88.2	Confident	70 Å²	70	68 Å²	68	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-63.6	-43	178	0	0	0	0	0	112.9	T234 H240	T234-A236 PolarHBondContact O-N 3.43Å; A236-H240 VanDerWaalsContact O-CB 3.28Å; A236-H240 WeakPolarHBondContact O-CB 3.34Å; A236-H240 PolarHBondContact O-N 3.43Å
237	S	86.9	Confident	86.1	Confident	14 Å²	14	78.1 Å²	78.1	10%	0.098	43%	0.426	C	S	.	.	H	α-helix	trans	-62.8	-45	175	168.6	0	0	0	0	110.8	E171 T234 H240 H241	E171-S237 PolarHBondContact OE2-OG 2.67Å; T234-S237 PolarHBondContact O-N 3.2Å; T234-S237 VanDerWaalsContact O-N 3.13Å; T234-S237 WeakPolarHBondContact OG1-CB 3.12Å; T234-S237 PolarHBondContact OG1-N 2.88Å; S237-H240 PolarHBondContact O-N 3.09Å; S237-H241 PolarHBondContact O-CD2 2.92Å; S237-H241 PolarHBondContact O-N 3.42Å; S237-H241 VanDerWaalsContact O-N 3.15Å
238	L	88	Confident	85.7	Confident	17 Å²	17	81.7 Å²	81.7	9%	0.089	45%	0.445	C	S	.	.	H	α-helix	trans	-57.4	-56.2	175.5	-79.2	167.8	0	0	0	111.5	W143 F147 F169 L176 V233 T234 P235 H240 H241 T242	W143-L238 HydrophobicContact CH2-CD2 3.76Å; W143-L238 HydrophobicContact CZ3-CD2 3.69Å; F147-L238 HydrophobicContact CE1-CD1 4.21Å; F147-L238 HydrophobicContact CZ-CD1 4.08Å; F169-L238 HydrophobicContact CD2-CD1 4.49Å; F169-L238 HydrophobicContact CD2-CD2 3.82Å; F169-L238 HydrophobicContact CE2-CD1 3.94Å; F169-L238 HydrophobicContact CE2-CD2 4.08Å; L176-L238 HydrophobicContact CD1-CD2 4.22Å; L176-L238 HydrophobicContact CD2-CD2 4.27Å; V233-L238 HydrophobicContact CG1-CD1 3.82Å; V233-L238 HydrophobicContact CG1-CD2 4.25Å; V233-L238 HydrophobicContact CG1-CG 3.81Å; T234-L238 PolarHBondContact O-N 3.15Å; T234-L238 VanDerWaalsContact O-N 3.08Å; P235-L238 PolarHBondContact O-N 3.09Å; L238-H240 VanDerWaalsContact C-N 3.27Å; L238-H240 PolarHBondContact O-N 2.83Å; L238-H241 PolarHBondContact O-N 3.07Å; L238-H241 VanDerWaalsContact O-N 3.12Å; L238-T242 WeakPolarHBondContact O-CB 3.3Å; L238-T242 WeakPolarHBondContact O-CG2 3.48Å; L238-T242 PolarHBondContact O-N 2.85Å; L238-T242 PolarHBondContact O-OG1 3.15Å
239	I	89.4	Confident	85.1	Confident	54 Å²	54	83.8 Å²	83.8	28%	0.277	46%	0.458	S	S	.	.	H	α-helix	trans	-56.8	-41.8	-178.9	-66.5	157	0	0	0	111.4	P235 H241 K243 L246	P235-I239 VanDerWaalsContact O-CD1 3.3Å; P235-I239 WeakPolarHBondContact O-CD1 3.44Å; P235-I239 WeakPolarHBondContact O-CG1 3.48Å; P235-I239 PolarHBondContact O-N 3.34Å; I239-H241 PolarHBondContact O-N 3.23Å; I239-K243 WeakPolarHBondContact O-CA 3.46Å; I239-K243 PolarHBondContact O-N 2.97Å; I239-L246 HydrophobicContact CD1-CD1 3.52Å; I239-L246 HydrophobicContact CD1-CD2 4.22Å; I239-L246 HydrophobicContact CD1-CG 4.03Å; I239-L246 HydrophobicContact CG1-CD1 4.49Å
240	H	87.4	Confident	84.6	Confident	138 Å²	138	82.8 Å²	82.8	64%	0.639	45%	0.448	S	S	*	.	H	α-helix	trans	-57.8	-46.1	178.1	171.5	-98	0	0	0	112.2	A236 S237 L238	A236-H240 VanDerWaalsContact O-CB 3.28Å; A236-H240 WeakPolarHBondContact O-CB 3.34Å; A236-H240 PolarHBondContact O-N 3.43Å; S237-H240 PolarHBondContact O-N 3.09Å; L238-H240 VanDerWaalsContact C-N 3.27Å; L238-H240 PolarHBondContact O-N 2.83Å
241	H	86.5	Confident	84	Confident	23 Å²	23	80.8 Å²	80.8	11%	0.106	44%	0.443	C	S	.	.	H	α-helix	trans	-79.8	-42.2	-177.7	-72.2	-63.5	0	0	0	113.3	E171 G174 L176 S237 L238 I239	E171-H241 IonicContact OE2-NE2 2.72Å; G174-H241 PolarHBondContact O-CE1 3.1Å; L176-H241 HydrophobicContact CB-CB 3.63Å; L176-H241 HydrophobicContact CD2-CB 3.74Å; L176-H241 HydrophobicContact CG-CB 4.28Å; S237-H241 PolarHBondContact O-CD2 2.92Å; S237-H241 PolarHBondContact O-N 3.42Å; S237-H241 VanDerWaalsContact O-N 3.15Å; L238-H241 PolarHBondContact O-N 3.07Å; L238-H241 VanDerWaalsContact O-N 3.12Å; I239-H241 PolarHBondContact O-N 3.23Å
242	T	84.3	Confident	83.4	Confident	2 Å²	2	82.6 Å²	82.6	1%	0.012	44%	0.437	C	S	.	.	H	α-helix	trans	-83.6	-18.5	-173.1	59.5	0	0	0	0	112.7	K79 W143 L176 L238 L244	K79-T242 WeakPolarHBondContact CD-O 3.4Å; K79-T242 PolarHBondContact NZ-O 3.44Å; W143-T242 HydrophobicContact CD2-CG2 4.31Å; W143-T242 VanDerWaalsContact CE2-CG2 3.42Å; W143-T242 HydrophobicContact CH2-CG2 4.05Å; W143-T242 HydrophobicContact CZ2-CG2 3.28Å; L176-T242 HydrophobicContact CD2-CG2 3.63Å; L238-T242 WeakPolarHBondContact O-CB 3.3Å; L238-T242 WeakPolarHBondContact O-CG2 3.48Å; L238-T242 PolarHBondContact O-N 2.85Å; L238-T242 PolarHBondContact O-OG1 3.15Å; T242-L244 VanDerWaalsContact C-N 3.25Å; T242-L244 PolarHBondContact O-N 3.02Å; T242-L244 WeakPolarHBondContact OG1-CD1 3.45Å; T242-L244 WeakPolarHBondContact OG1-CG 3.36Å
243	K	84.3	Confident	82.7	Confident	154 Å²	154	78.9 Å²	78.9	67%	0.67	43%	0.426	S	S	*	.			trans	55.6	40.6	-174.6	-54	179.8	-179.5	176.5	0	111.8	I239	I239-K243 WeakPolarHBondContact O-CA 3.46Å; I239-K243 PolarHBondContact O-N 2.97Å
244	L	81.9	Confident	82	Confident	28 Å²	28	82.5 Å²	82.5	15%	0.147	44%	0.444	C	S	.	.			trans	-71.4	142.8	177.1	-68.4	165.8	0	0	0	110.7	K139 E140 W143 T242	K139-L244 HydrophobicContact CB-CD2 4.5Å; E140-L244 HydrophobicContact CB-CD2 4.29Å; E140-L244 HydrophobicContact CG-CD2 3.78Å; E140-L244 WeakPolarHBondContact OE1-CA 3.48Å; W143-L244 HydrophobicContact CB-CD1 4.27Å; W143-L244 HydrophobicContact CB-CD2 4.47Å; W143-L244 HydrophobicContact CG-CD1 4.06Å; W143-L244 HydrophobicContact CG-CD2 4.36Å; T242-L244 VanDerWaalsContact C-N 3.25Å; T242-L244 PolarHBondContact O-N 3.02Å; T242-L244 WeakPolarHBondContact OG1-CD1 3.45Å; T242-L244 WeakPolarHBondContact OG1-CG 3.36Å
245	C	77.2	Confident	81.4	Confident	91 Å²	91	84 Å²	84	62%	0.615	45%	0.448	S	S	*	.			trans	-82.1	128.5	173.8	-62.7	0	0	0	0	110.7	E140	E140-C245 PolarHBondContact OE1-N 3.35Å
246	L	62	Low	80.8	Confident	144 Å²	144	82.9 Å²	82.9	75%	0.754	43%	0.433	S	S	*	.			trans	-100.2	90.7	167.9	-71.1	171.4	0	0	0	107.3	I239	I239-L246 HydrophobicContact CD1-CD1 3.52Å; I239-L246 HydrophobicContact CD1-CD2 4.22Å; I239-L246 HydrophobicContact CD1-CG 4.03Å; I239-L246 HydrophobicContact CG1-CD1 4.49Å
247	E	53.7	Low	80.1	Confident	260 Å²	260	84.1 Å²	84.1	100%	1.215	42%	0.42	S	S	*	.			trans	-80.7	0	169	-68.7	-169.1	162.5	0	0	111.9

Retrieved 247 of 247 residues in 112 ms (Link to these results)

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