A0A5K4FCT1_SCHMA Loading...

Myosin regulatory light chain ef-hand protein

AlphaFold DB , UniProt , Accession A0A5K4FCT1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 175 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.2	Low	46.3	Very low	253 Å²	253	180.9 Å²	180.9	100%	1.246	90%	0.903	S	S	*	*				0	107.1	0	-66	-144.1	-123.9	0	0	108.1
2	A	39.7	Very low	46.6	Very low	104 Å²	104	177.1 Å²	177.1	86%	0.86	90%	0.897	S	S	*	*			trans	-91	125.9	-173.4	0	0	0	0	0	110.6
3	C	40.1	Very low	46.1	Very low	123 Å²	123	180.1 Å²	180.1	83%	0.831	89%	0.891	S	S	*	*			trans	-107.1	111.8	176.1	-169.3	0	0	0	0	109
4	T	46	Very low	45.9	Very low	130 Å²	130	176.9 Å²	176.9	80%	0.798	89%	0.886	S	S	*	*	P	Polyproline II helix	trans	-84.6	120.7	174	42	0	0	0	0	109.5
5	K	49.4	Very low	46.1	Very low	205 Å²	205	173.3 Å²	173.3	89%	0.891	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-96.5	116.2	171.4	-93	-178.2	176.7	174.7	0	110.3
6	T	49.5	Very low	46.1	Very low	135 Å²	135	177 Å²	177	83%	0.828	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-64.6	132.5	-179.9	-34.7	0	0	0	0	112.1	R8	T6-R8 PolarHBondContact O-N 3.43Å
7	K	48.8	Very low	46.5	Very low	203 Å²	203	172.7 Å²	172.7	88%	0.883	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-64.5	117.6	176.7	-128.4	174.1	-178.3	179.2	0	109.8	R9	K7-R9 PolarHBondContact O-N 3.19Å
8	R	44.2	Very low	46.8	Very low	245 Å²	245	167.4 Å²	167.4	93%	0.925	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-67.8	118.2	171.2	-78.8	-179.4	164.2	173.2	-5	109.5	T6	T6-R8 PolarHBondContact O-N 3.43Å
9	R	45.1	Very low	47.2	Very low	246 Å²	246	163.7 Å²	163.7	93%	0.928	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.3	130.2	167.3	-94.9	179.2	159.3	-171.1	-6.2	109.4	K7 R11	K7-R9 PolarHBondContact O-N 3.19Å; R9-R11 PolarHBondContact O-N 2.8Å
10	A	45.7	Very low	48.4	Very low	98 Å²	98	160.7 Å²	160.7	81%	0.81	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-62.1	125.6	171.8	0	0	0	0	0	109.3	T12	A10-T12 PolarHBondContact O-N 3.28Å
11	R	46	Very low	49.7	Very low	248 Å²	248	153.1 Å²	153.1	94%	0.936	76%	0.763	S	S	*	*			trans	-76.2	107	178.1	-142.1	173.9	169.7	179	-4.7	106.9	R9 R13	R9-R11 PolarHBondContact O-N 2.8Å; R11-R13 PolarHBondContact O-N 3.23Å
12	T	50	Low	50.9	Low	135 Å²	135	145.6 Å²	145.6	83%	0.828	72%	0.724	S	S	*	*			trans	-59.3	121.9	173.1	-15	0	0	0	0	107.9	A10 T14	A10-T12 PolarHBondContact O-N 3.28Å; T12-T14 PolarHBondContact O-N 3.02Å
13	R	39.4	Very low	52.9	Low	216 Å²	216	144.2 Å²	144.2	82%	0.815	71%	0.708	S	S	*	*			trans	-72.1	91.9	-176.8	-177.8	179.6	174.2	-177.3	-3.1	107.9	R11 Q15	R11-R13 PolarHBondContact O-N 3.23Å; R13-Q15 VanDerWaalsContact C-N 3.3Å; R13-Q15 PolarHBondContact O-N 2.66Å
14	T	43.8	Very low	54.7	Low	135 Å²	135	141.5 Å²	141.5	83%	0.828	68%	0.684	S	S	*	*			trans	-59.1	98.6	163	11.6	0	0	0	0	107	T12 R16	T12-T14 PolarHBondContact O-N 3.02Å; T14-R16 PolarHBondContact O-N 3.17Å
15	Q	49.3	Very low	56.6	Low	123 Å²	123	136 Å²	136	58%	0.575	65%	0.649	S	S	*	*			trans	-60.4	135.9	173.2	-76.8	-169.5	-4.5	0	0	108	R13 F17	R13-Q15 VanDerWaalsContact C-N 3.3Å; R13-Q15 PolarHBondContact O-N 2.66Å; Q15-F17 VanDerWaalsContact C-N 3.26Å; Q15-F17 HydrophobicContact CB-CD2 3.87Å; Q15-F17 HydrophobicContact CB-CE2 4Å; Q15-F17 PolarHBondContact O-N 3.01Å
16	R	45.1	Very low	58.3	Low	233 Å²	233	130.5 Å²	130.5	88%	0.879	63%	0.629	S	S	*	*			trans	-65	83.4	176.9	-65.2	173.3	-179.7	161.8	-3.2	108.9	T14	T14-R16 PolarHBondContact O-N 3.17Å
17	F	53	Low	60.2	Low	104 Å²	104	132.3 Å²	132.3	46%	0.456	63%	0.628	S	S	.	*			trans	-79.9	-22.5	-174.9	-107.3	-91.2	0	0	0	113.8	Q15 S19 T87 E91	Q15-F17 VanDerWaalsContact C-N 3.26Å; Q15-F17 HydrophobicContact CB-CD2 3.87Å; Q15-F17 HydrophobicContact CB-CE2 4Å; Q15-F17 PolarHBondContact O-N 3.01Å; F17-S19 PolarHBondContact O-N 3.38Å; F17-T87 HydrophobicContact CB-CG2 4.38Å; F17-T87 HydrophobicContact CD1-CG2 4.4Å; F17-E91 HydrophobicContact CD1-CG 4.23Å; F17-E91 WeakPolarHBondContact CD1-OE1 3.49Å; F17-E91 HydrophobicContact CE1-CG 3.95Å; F17-E91 WeakPolarHBondContact CE1-OE1 3.35Å
18	T	51.6	Low	62.1	Low	77 Å²	77	125.5 Å²	125.5	47%	0.472	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-80.7	-18.5	-169.9	59.4	0	0	0	0	115.1	N20	T18-N20 VanDerWaalsContact C-N 3.31Å; T18-N20 PolarHBondContact O-N 3.42Å
19	S	55.2	Low	64.2	Low	97 Å²	97	116.8 Å²	116.8	68%	0.678	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-79.8	-3.7	-164.1	54.5	0	0	0	0	115.8	F17	F17-S19 PolarHBondContact O-N 3.38Å
20	N	70.5	Confident	66.4	Low	104 Å²	104	106.9 Å²	106.9	56%	0.556	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-135.3	12.8	178	-146.7	30.3	0	0	0	114.4	T18 F22 S23	T18-N20 VanDerWaalsContact C-N 3.31Å; T18-N20 PolarHBondContact O-N 3.42Å; N20-F22 VanDerWaalsContact C-N 3.31Å; N20-F22 PolarHBondContact O-N 3.19Å; N20-S23 PolarHBondContact ND2-OG 3.44Å; N20-S23 VanDerWaalsContact ND2-OG 3.1Å; N20-S23 PolarHBondContact O-N 3.49Å; N20-S23 VanDerWaalsContact O-N 3.11Å; N20-S23 PolarHBondContact O-OG 2.91Å; N20-S23 WeakPolarHBondContact OD1-CB 3.45Å; N20-S23 PolarHBondContact OD1-OG 3.47Å
21	V	76.9	Confident	68.7	Low	1 Å²	1	105.1 Å²	105.1	1%	0.006	53%	0.526	C	S	.	.	G	3₁₀ helix	trans	-63.6	-37.9	-176.5	68.9	0	0	0	0	112.4	S23 M24 F25 T83 L86	V21-S23 PolarHBondContact O-N 3.24Å; V21-M24 HydrophobicContact CG2-SD 4.18Å; V21-M24 VanDerWaalsContact O-CB 3.29Å; V21-M24 WeakPolarHBondContact O-CB 3.49Å; V21-M24 WeakPolarHBondContact O-CG 3.2Å; V21-M24 PolarHBondContact O-N 3.02Å; V21-F25 HydrophobicContact CG2-CE2 4.29Å; V21-T83 HydrophobicContact CG1-CG2 4.14Å; V21-L86 HydrophobicContact CG1-CB 4.4Å; V21-L86 VanDerWaalsContact CG2-C 3.4Å; V21-L86 HydrophobicContact CG2-CB 3.76Å; V21-L86 VanDerWaalsContact CG2-O 3.26Å; V21-L86 WeakPolarHBondContact CG2-O 3.43Å
22	F	79	Confident	70.9	Confident	96 Å²	96	99.5 Å²	99.5	42%	0.421	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-65.8	-18.2	177.4	-72.4	-81.8	0	0	0	113.5	N20 M24 I30 F82 T83 L86	N20-F22 VanDerWaalsContact C-N 3.31Å; N20-F22 PolarHBondContact O-N 3.19Å; F22-M24 VanDerWaalsContact C-N 3.28Å; F22-I30 HydrophobicContact CD1-CD1 4.04Å; F22-I30 HydrophobicContact CD1-CG2 4.45Å; F22-I30 HydrophobicContact CE1-CG2 4.35Å; F22-F82 HydrophobicContact CE1-CE1 4.27Å; F22-T83 HydrophobicContact CE2-CG2 4.25Å; F22-L86 HydrophobicContact CD1-CD1 3.88Å; F22-L86 HydrophobicContact CE1-CD1 3.39Å; F22-L86 HydrophobicContact CE2-CD1 4.46Å; F22-L86 HydrophobicContact CZ-CD1 3.73Å
23	S	83	Confident	73	Confident	75 Å²	75	94.5 Å²	94.5	52%	0.524	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-82.5	-8.5	174.9	82.7	0	0	0	0	113	N20 V21 F25	N20-S23 PolarHBondContact ND2-OG 3.44Å; N20-S23 VanDerWaalsContact ND2-OG 3.1Å; N20-S23 PolarHBondContact O-N 3.49Å; N20-S23 VanDerWaalsContact O-N 3.11Å; N20-S23 PolarHBondContact O-OG 2.91Å; N20-S23 WeakPolarHBondContact OD1-CB 3.45Å; N20-S23 PolarHBondContact OD1-OG 3.47Å; V21-S23 PolarHBondContact O-N 3.24Å; S23-F25 VanDerWaalsContact C-N 3.35Å
24	M	78.1	Confident	75.6	Confident	65 Å²	65	89.9 Å²	89.9	32%	0.32	46%	0.463	S	S	.	.	S	Bend	trans	-82	-20.4	-179.2	-58.7	174.1	-175.9	0	0	112	V21 F22 M94	V21-M24 HydrophobicContact CG2-SD 4.18Å; V21-M24 VanDerWaalsContact O-CB 3.29Å; V21-M24 WeakPolarHBondContact O-CB 3.49Å; V21-M24 WeakPolarHBondContact O-CG 3.2Å; V21-M24 PolarHBondContact O-N 3.02Å; F22-M24 VanDerWaalsContact C-N 3.28Å; M24-M94 HydrophobicContact CE-CE 3.96Å; M24-M94 HydrophobicContact CE-CG 4.34Å; M24-M94 HydrophobicContact CE-SD 3.13Å; M24-M94 WeakPolarHBondContact CE-SD 3.23Å; M24-M94 HydrophobicContact CG-CG 4.39Å; M24-M94 HydrophobicContact CG-SD 4.23Å; M24-M94 HydrophobicContact SD-CE 4.49Å; M24-M94 HydrophobicContact SD-CG 3.74Å; M24-M94 HydrophobicContact SD-SD 3.31Å
25	F	84.2	Confident	78.1	Confident	16 Å²	16	89.3 Å²	89.3	7%	0.07	45%	0.451	C	S	.	.	S	Bend	trans	-123.5	144.6	-173.4	-58.2	-65.9	0	0	0	110	V21 S23 Q29 I30 F33 L86 F89 G90 M93	V21-F25 HydrophobicContact CG2-CE2 4.29Å; S23-F25 VanDerWaalsContact C-N 3.35Å; F25-Q29 HydrophobicContact CB-CB 4.04Å; F25-Q29 HydrophobicContact CD1-CB 4.41Å; F25-I30 HydrophobicContact CB-CD1 4.26Å; F25-I30 HydrophobicContact CB-CG1 3.69Å; F25-F33 HydrophobicContact CD1-CD2 4.42Å; F25-F33 AromaticContact CD1-CE2 3.61Å; F25-F33 HydrophobicContact CD1-CE2 3.61Å; F25-F33 HydrophobicContact CD1-CZ 4.44Å; F25-F33 HydrophobicContact CD2-CE2 4.46Å; F25-F33 AromaticContact CE1-CE2 3.52Å; F25-F33 HydrophobicContact CE1-CE2 3.52Å; F25-F33 AromaticContact CE1-CZ 3.94Å; F25-F33 HydrophobicContact CE1-CZ 3.94Å; F25-F33 HydrophobicContact CE2-CE2 4.39Å; F25-F33 HydrophobicContact CG-CD2 4.45Å; F25-F33 HydrophobicContact CG-CE2 4.07Å; F25-F33 AromaticContact CZ-CE2 3.9Å; F25-F33 HydrophobicContact CZ-CE2 3.9Å; F25-F33 HydrophobicContact CZ-CZ 4.23Å; F25-L86 HydrophobicContact CD2-CD2 4.32Å; F25-L86 HydrophobicContact CE2-CB 4.46Å; F25-L86 HydrophobicContact CE2-CD2 4.32Å; F25-F89 HydrophobicContact CZ-CB 4.41Å; F25-G90 VanDerWaalsContact CZ-CA 3.47Å; F25-M93 HydrophobicContact CE1-SD 3.8Å; F25-M93 HydrophobicContact CZ-SD 4.4Å
26	N	86.6	Confident	80.2	Confident	89 Å²	89	84.9 Å²	84.9	48%	0.476	44%	0.436	S	S	.	.			trans	-76.4	169.6	169.2	69.1	44.1	0	0	0	110.8	A28 Q29 I30	N26-A28 VanDerWaalsContact C-N 3.29Å; N26-A28 PolarHBondContact O-N 3.16Å; N26-A28 WeakPolarHBondContact OD1-CB 3.4Å; N26-A28 PolarHBondContact OD1-N 3.39Å; N26-A28 VanDerWaalsContact OD1-N 3.09Å; N26-Q29 PolarHBondContact ND2-OE1 3.32Å; N26-Q29 PolarHBondContact O-N 2.87Å; N26-Q29 WeakPolarHBondContact OD1-CG 3.47Å; N26-Q29 PolarHBondContact OD1-N 3.22Å; N26-I30 WeakPolarHBondContact O-CG1 3.35Å; N26-I30 PolarHBondContact O-N 3.23Å
27	E	89.3	Confident	82.7	Confident	173 Å²	173	74.2 Å²	74.2	81%	0.808	40%	0.396	S	S	*	.	H	α-helix	trans	-61.5	-35.8	-176.5	-170.6	174	-173.2	0	0	113	I30 S31	E27-I30 PolarHBondContact O-N 2.9Å; E27-S31 PolarHBondContact O-N 2.78Å
28	A	89.2	Confident	84.7	Confident	60 Å²	60	74.1 Å²	74.1	50%	0.496	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-47.4	177.1	0	0	0	0	0	111.3	N26 I30 S31 E32	N26-A28 VanDerWaalsContact C-N 3.29Å; N26-A28 PolarHBondContact O-N 3.16Å; N26-A28 WeakPolarHBondContact OD1-CB 3.4Å; N26-A28 PolarHBondContact OD1-N 3.39Å; N26-A28 VanDerWaalsContact OD1-N 3.09Å; A28-I30 PolarHBondContact O-N 2.94Å; A28-S31 WeakPolarHBondContact O-CB 3.4Å; A28-S31 PolarHBondContact O-N 3.42Å; A28-S31 VanDerWaalsContact O-N 3.13Å; A28-E32 WeakPolarHBondContact O-CG 3.33Å; A28-E32 PolarHBondContact O-N 3.42Å
29	Q	88.1	Confident	86.7	Confident	62 Å²	62	77 Å²	77	29%	0.29	41%	0.409	S	S	.	.	H	α-helix	trans	-60.7	-43.9	175.8	-71.5	173.5	-49.9	0	0	111.6	F25 N26 S31 E32 F33	F25-Q29 HydrophobicContact CB-CB 4.04Å; F25-Q29 HydrophobicContact CD1-CB 4.41Å; N26-Q29 PolarHBondContact ND2-OE1 3.32Å; N26-Q29 PolarHBondContact O-N 2.87Å; N26-Q29 WeakPolarHBondContact OD1-CG 3.47Å; N26-Q29 PolarHBondContact OD1-N 3.22Å; Q29-S31 VanDerWaalsContact C-N 3.26Å; Q29-S31 PolarHBondContact O-N 2.95Å; Q29-E32 PolarHBondContact O-N 2.86Å; Q29-F33 HydrophobicContact CB-CD2 4.43Å; Q29-F33 HydrophobicContact CB-CE2 4.26Å; Q29-F33 WeakPolarHBondContact O-CD2 3.5Å; Q29-F33 PolarHBondContact O-N 2.9Å
30	I	91.6	Very high	88.6	Confident	38 Å²	38	73.8 Å²	73.8	20%	0.195	38%	0.384	C	S	.	.	H	α-helix	trans	-60.5	-39.5	176.7	-66.7	162.9	0	0	0	110.6	F22 F25 N26 E27 A28 K34 F82	F22-I30 HydrophobicContact CD1-CD1 4.04Å; F22-I30 HydrophobicContact CD1-CG2 4.45Å; F22-I30 HydrophobicContact CE1-CG2 4.35Å; F25-I30 HydrophobicContact CB-CD1 4.26Å; F25-I30 HydrophobicContact CB-CG1 3.69Å; N26-I30 WeakPolarHBondContact O-CG1 3.35Å; N26-I30 PolarHBondContact O-N 3.23Å; E27-I30 PolarHBondContact O-N 2.9Å; A28-I30 PolarHBondContact O-N 2.94Å; I30-K34 WeakPolarHBondContact O-CB 3.38Å; I30-K34 PolarHBondContact O-N 2.85Å; I30-F82 HydrophobicContact CG2-CE1 4.44Å; I30-F82 HydrophobicContact CG2-CZ 4.35Å
31	S	92.9	Very high	89.9	Confident	60 Å²	60	69 Å²	69	42%	0.42	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-46.9	175.6	-164.1	0	0	0	0	111.7	E27 A28 Q29 K34 E35	E27-S31 PolarHBondContact O-N 2.78Å; A28-S31 WeakPolarHBondContact O-CB 3.4Å; A28-S31 PolarHBondContact O-N 3.42Å; A28-S31 VanDerWaalsContact O-N 3.13Å; Q29-S31 VanDerWaalsContact C-N 3.26Å; Q29-S31 PolarHBondContact O-N 2.95Å; S31-K34 WeakPolarHBondContact O-CB 3.41Å; S31-K34 PolarHBondContact O-N 2.96Å; S31-K34 VanDerWaalsContact O-N 3.13Å; S31-E35 PolarHBondContact O-N 3.13Å
32	E	92.5	Very high	90.5	Very high	131 Å²	131	71.5 Å²	71.5	61%	0.612	38%	0.376	S	S	*	.	H	α-helix	trans	-60.7	-45.8	176.9	-71.5	173	-171.5	0	0	111.8	A28 Q29 K34 E35 A36	A28-E32 WeakPolarHBondContact O-CG 3.33Å; A28-E32 PolarHBondContact O-N 3.42Å; Q29-E32 PolarHBondContact O-N 2.86Å; E32-K34 PolarHBondContact O-N 2.97Å; E32-E35 PolarHBondContact O-N 2.81Å; E32-A36 PolarHBondContact O-N 3.13Å
33	F	93.6	Very high	91.1	Very high	30 Å²	30	70.4 Å²	70.4	13%	0.132	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-35.4	175.1	-76.1	-58.2	0	0	0	112.2	F25 Q29 A36 F37 F82 F85 L86 F89 M93	F25-F33 HydrophobicContact CD1-CD2 4.42Å; F25-F33 AromaticContact CD1-CE2 3.61Å; F25-F33 HydrophobicContact CD1-CE2 3.61Å; F25-F33 HydrophobicContact CD1-CZ 4.44Å; F25-F33 HydrophobicContact CD2-CE2 4.46Å; F25-F33 AromaticContact CE1-CE2 3.52Å; F25-F33 HydrophobicContact CE1-CE2 3.52Å; F25-F33 AromaticContact CE1-CZ 3.94Å; F25-F33 HydrophobicContact CE1-CZ 3.94Å; F25-F33 HydrophobicContact CE2-CE2 4.39Å; F25-F33 HydrophobicContact CG-CD2 4.45Å; F25-F33 HydrophobicContact CG-CE2 4.07Å; F25-F33 AromaticContact CZ-CE2 3.9Å; F25-F33 HydrophobicContact CZ-CE2 3.9Å; F25-F33 HydrophobicContact CZ-CZ 4.23Å; Q29-F33 HydrophobicContact CB-CD2 4.43Å; Q29-F33 HydrophobicContact CB-CE2 4.26Å; Q29-F33 WeakPolarHBondContact O-CD2 3.5Å; Q29-F33 PolarHBondContact O-N 2.9Å; F33-A36 PolarHBondContact O-N 3.45Å; F33-F37 VanDerWaalsContact O-CB 3.3Å; F33-F37 WeakPolarHBondContact O-CB 3.35Å; F33-F37 PolarHBondContact O-N 3.32Å; F33-F82 HydrophobicContact CB-CE2 4.18Å; F33-F82 HydrophobicContact CB-CZ 4.42Å; F33-F85 HydrophobicContact CB-CE1 4.34Å; F33-F85 HydrophobicContact CD1-CE1 4.02Å; F33-L86 HydrophobicContact CB-CD2 3.55Å; F33-L86 HydrophobicContact CD2-CD2 3.72Å; F33-L86 HydrophobicContact CG-CD2 3.73Å; F33-F89 HydrophobicContact CD1-CD1 4.46Å; F33-F89 HydrophobicContact CD1-CG 4.3Å; F33-F89 HydrophobicContact CE1-CB 3.99Å; F33-F89 AromaticContact CE1-CD1 3.58Å; F33-F89 HydrophobicContact CE1-CD1 3.58Å; F33-F89 HydrophobicContact CE1-CD2 4.41Å; F33-F89 HydrophobicContact CE1-CE1 4.15Å; F33-F89 AromaticContact CE1-CG 3.72Å; F33-F89 HydrophobicContact CE1-CG 3.72Å; F33-F89 HydrophobicContact CZ-CB 4.23Å; F33-F89 HydrophobicContact CZ-CD1 4.25Å; F33-F89 HydrophobicContact CZ-CG 4.4Å; F33-M93 HydrophobicContact CZ-SD 3.92Å
34	K	94.9	Very high	91.6	Very high	118 Å²	118	75 Å²	75	51%	0.513	39%	0.388	S	S	.	.	H	α-helix	trans	-68	-41.9	177.3	-169.3	178.3	-178.5	-177.4	0	111.5	I30 S31 E32 F37 L38 F82	I30-K34 WeakPolarHBondContact O-CB 3.38Å; I30-K34 PolarHBondContact O-N 2.85Å; S31-K34 WeakPolarHBondContact O-CB 3.41Å; S31-K34 PolarHBondContact O-N 2.96Å; S31-K34 VanDerWaalsContact O-N 3.13Å; E32-K34 PolarHBondContact O-N 2.97Å; K34-F37 PolarHBondContact O-N 2.99Å; K34-L38 HydrophobicContact CG-CD1 4.36Å; K34-L38 WeakPolarHBondContact O-CB 3.5Å; K34-L38 VanDerWaalsContact O-CG 3.23Å; K34-L38 WeakPolarHBondContact O-CG 3.46Å; K34-L38 PolarHBondContact O-N 3.44Å; K34-F82 VanDerWaalsContact CA-CE2 3.42Å; K34-F82 HydrophobicContact CB-CE1 4.41Å; K34-F82 HydrophobicContact CB-CE2 3.9Å; K34-F82 HydrophobicContact CB-CZ 3.66Å; K34-F82 HydrophobicContact CG-CE2 4.36Å; K34-F82 HydrophobicContact CG-CZ 4.18Å
35	E	95.4	Very high	92.4	Very high	124 Å²	124	76.9 Å²	76.9	58%	0.579	40%	0.399	S	S	*	.	H	α-helix	trans	-62.3	-46.2	173.8	-70.8	179.8	-168.7	0	0	111.1	S31 E32 F37 L38 M39	S31-E35 PolarHBondContact O-N 3.13Å; E32-E35 PolarHBondContact O-N 2.81Å; E35-F37 PolarHBondContact O-N 3.28Å; E35-L38 PolarHBondContact O-N 3.36Å; E35-M39 WeakPolarHBondContact O-CG 3.47Å; E35-M39 PolarHBondContact O-N 2.95Å
36	A	94.9	Very high	92.9	Very high	30 Å²	30	77.5 Å²	77.5	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-58.4	-46	175	0	0	0	0	0	112.4	E32 F33 L38 M39 I40	E32-A36 PolarHBondContact O-N 3.13Å; F33-A36 PolarHBondContact O-N 3.45Å; A36-L38 VanDerWaalsContact C-N 3.33Å; A36-L38 PolarHBondContact O-N 2.97Å; A36-M39 HydrophobicContact CB-CE 4.4Å; A36-M39 PolarHBondContact O-N 3.28Å; A36-I40 WeakPolarHBondContact O-CG1 3.3Å; A36-I40 PolarHBondContact O-N 3.09Å
37	F	95.8	Very high	93.4	Very high	8 Å²	8	74.7 Å²	74.7	4%	0.035	40%	0.397	C	S	.	.	H	α-helix	trans	-58.6	-45.2	177	-176.6	-87.7	0	0	0	111.6	F33 K34 E35 M39 I40 D41 G46 I48 F82 F85	F33-F37 VanDerWaalsContact O-CB 3.3Å; F33-F37 WeakPolarHBondContact O-CB 3.35Å; F33-F37 PolarHBondContact O-N 3.32Å; K34-F37 PolarHBondContact O-N 2.99Å; E35-F37 PolarHBondContact O-N 3.28Å; F37-M39 VanDerWaalsContact C-N 3.28Å; F37-M39 PolarHBondContact O-N 3.13Å; F37-I40 PolarHBondContact O-N 3.11Å; F37-I40 VanDerWaalsContact O-N 3.16Å; F37-D41 HydrophobicContact CD1-CB 4.36Å; F37-D41 HydrophobicContact CE1-CB 4.02Å; F37-D41 WeakPolarHBondContact O-CB 3.25Å; F37-D41 PolarHBondContact O-N 3.25Å; F37-G46 WeakPolarHBondContact CZ-O 3.46Å; F37-I48 HydrophobicContact CD2-CD1 3.53Å; F37-I48 HydrophobicContact CD2-CG1 4.14Å; F37-I48 HydrophobicContact CE2-CD1 3.49Å; F37-I48 VanDerWaalsContact CE2-CD1 3.49Å; F37-I48 HydrophobicContact CE2-CG1 3.66Å; F37-I48 HydrophobicContact CG-CD1 4.43Å; F37-I48 HydrophobicContact CZ-CD1 4.35Å; F37-I48 HydrophobicContact CZ-CG1 4.05Å; F37-F82 HydrophobicContact CB-CD2 3.72Å; F37-F82 HydrophobicContact CB-CE2 4.11Å; F37-F82 HydrophobicContact CD1-CB 4.35Å; F37-F82 HydrophobicContact CD1-CD2 4.25Å; F37-F82 HydrophobicContact CD2-CB 4.36Å; F37-F82 AromaticContact CD2-CD2 3.99Å; F37-F82 HydrophobicContact CD2-CD2 3.99Å; F37-F82 HydrophobicContact CE1-CB 4.34Å; F37-F82 HydrophobicContact CE2-CB 4.33Å; F37-F82 HydrophobicContact CG-CB 4.37Å; F37-F82 AromaticContact CG-CD2 3.7Å; F37-F82 HydrophobicContact CG-CD2 3.7Å; F37-F82 HydrophobicContact CG-CG 4.5Å; F37-F82 HydrophobicContact CZ-CB 4.33Å; F37-F85 HydrophobicContact CB-CD1 4.33Å; F37-F85 HydrophobicContact CB-CE1 4.3Å; F37-F85 HydrophobicContact CD2-CB 3.76Å; F37-F85 HydrophobicContact CD2-CD1 4.05Å; F37-F85 AromaticContact CD2-CD2 4Å; F37-F85 HydrophobicContact CD2-CD2 4Å; F37-F85 AromaticContact CD2-CG 3.7Å; F37-F85 HydrophobicContact CD2-CG 3.7Å; F37-F85 HydrophobicContact CE2-CB 4.03Å; F37-F85 HydrophobicContact CE2-CG 4.38Å
38	L	94.8	Very high	93.7	Very high	102 Å²	102	66.8 Å²	66.8	53%	0.534	36%	0.359	S	S	.	.	H	α-helix	trans	-68.9	-23.4	179.1	-69.2	173	0	0	0	113.7	K34 E35 A36	K34-L38 HydrophobicContact CG-CD1 4.36Å; K34-L38 WeakPolarHBondContact O-CB 3.5Å; K34-L38 VanDerWaalsContact O-CG 3.23Å; K34-L38 WeakPolarHBondContact O-CG 3.46Å; K34-L38 PolarHBondContact O-N 3.44Å; E35-L38 PolarHBondContact O-N 3.36Å; A36-L38 VanDerWaalsContact C-N 3.33Å; A36-L38 PolarHBondContact O-N 2.97Å
39	M	94.2	Very high	94	Very high	138 Å²	138	67 Å²	67	68%	0.68	35%	0.352	S	S	*	.	H	α-helix	trans	-74.4	-31.4	171.9	-71.5	-170.6	-65.8	0	0	112.2	E35 A36 F37	E35-M39 WeakPolarHBondContact O-CG 3.47Å; E35-M39 PolarHBondContact O-N 2.95Å; A36-M39 HydrophobicContact CB-CE 4.4Å; A36-M39 PolarHBondContact O-N 3.28Å; F37-M39 VanDerWaalsContact C-N 3.28Å; F37-M39 PolarHBondContact O-N 3.13Å
40	I	96	Very high	94.4	Very high	29 Å²	29	66.8 Å²	66.8	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-82.5	-44.4	179.4	-59.2	163.4	0	0	0	110.7	A36 F37 S42 I48 D52 L53 I56 F85	A36-I40 WeakPolarHBondContact O-CG1 3.3Å; A36-I40 PolarHBondContact O-N 3.09Å; F37-I40 PolarHBondContact O-N 3.11Å; F37-I40 VanDerWaalsContact O-N 3.16Å; I40-S42 PolarHBondContact O-N 2.68Å; I40-I48 HydrophobicContact CB-CD1 4Å; I40-I48 HydrophobicContact CB-CG1 4.33Å; I40-I48 HydrophobicContact CD1-CD1 4.24Å; I40-I48 HydrophobicContact CG2-CB 4.48Å; I40-I48 HydrophobicContact CG2-CD1 3.76Å; I40-I48 HydrophobicContact CG2-CG1 3.87Å; I40-I48 HydrophobicContact CG2-CG2 3.8Å; I40-D52 HydrophobicContact CG2-CB 4.29Å; I40-D52 WeakPolarHBondContact O-CB 3.38Å; I40-L53 HydrophobicContact CG2-CD2 4.25Å; I40-I56 HydrophobicContact CG1-CG1 4.29Å; I40-I56 HydrophobicContact CG2-CG2 4.25Å; I40-F85 HydrophobicContact CD1-CE2 3.99Å; I40-F85 HydrophobicContact CD1-CZ 4.26Å
41	D	96.1	Very high	94.5	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.021	36%	0.363	C	S	.	.			trans	-69.1	76.8	178.1	179.2	12.4	0	0	0	110.9	F37 T43 K44 D45 G46	F37-D41 HydrophobicContact CD1-CB 4.36Å; F37-D41 HydrophobicContact CE1-CB 4.02Å; F37-D41 WeakPolarHBondContact O-CB 3.25Å; F37-D41 PolarHBondContact O-N 3.25Å; D41-T43 VanDerWaalsContact C-N 3.28Å; D41-T43 PolarHBondContact O-N 2.9Å; D41-T43 PolarHBondContact OD1-OG1 3.5Å; D41-K44 PolarHBondContact O-N 3.38Å; D41-K44 WeakPolarHBondContact OD1-CA 3.4Å; D41-K44 PolarHBondContact OD1-N 3.12Å; D41-K44 WeakPolarHBondContact OD2-CA 3.33Å; D41-D45 PolarHBondContact OD1-N 3.08Å; D41-G46 VanDerWaalsContact OD2-CA 3.25Å; D41-G46 WeakPolarHBondContact OD2-CA 3.45Å; D41-G46 PolarHBondContact OD2-N 3.43Å
42	S	91.5	Very high	94.7	Very high	54 Å²	54	66.8 Å²	66.8	38%	0.378	34%	0.343	S	S	.	.	S	Bend	trans	-66.4	-34.8	-176.1	71.7	0	0	0	0	111.3	I40 K44 D52	I40-S42 PolarHBondContact O-N 2.68Å; S42-K44 VanDerWaalsContact C-N 3.33Å; S42-D52 WeakPolarHBondContact CB-OD1 3.43Å; S42-D52 PolarHBondContact N-OD1 3.16Å; S42-D52 PolarHBondContact OG-OD1 3.45Å
43	T	91.3	Very high	94.9	Very high	72 Å²	72	61.2 Å²	61.2	44%	0.442	32%	0.317	S	S	.	.	S	Bend	trans	-78.5	-18.8	179.5	70.6	0	0	0	0	112.8	D41 D45 D52	D41-T43 VanDerWaalsContact C-N 3.28Å; D41-T43 PolarHBondContact O-N 2.9Å; D41-T43 PolarHBondContact OD1-OG1 3.5Å; T43-D45 VanDerWaalsContact C-N 3.25Å; T43-D45 PolarHBondContact O-N 3.09Å; T43-D52 PolarHBondContact N-OD1 2.76Å
44	K	92.7	Very high	95	Very high	171 Å²	171	63.3 Å²	63.3	74%	0.743	33%	0.327	S	S	*	.			trans	60.6	31.5	-179.3	-55.2	-176.7	-179.3	-177.7	0	113.2	D41 S42 G46	D41-K44 PolarHBondContact O-N 3.38Å; D41-K44 WeakPolarHBondContact OD1-CA 3.4Å; D41-K44 PolarHBondContact OD1-N 3.12Å; D41-K44 WeakPolarHBondContact OD2-CA 3.33Å; S42-K44 VanDerWaalsContact C-N 3.33Å; K44-G46 VanDerWaalsContact C-N 3.34Å
45	D	95.2	Very high	94.9	Very high	105 Å²	105	60.5 Å²	60.5	56%	0.561	32%	0.318	S	S	*	.	S	Bend	trans	-89.1	-6.2	178.1	82.7	-4.9	0	0	0	112.7	D41 T43 V47	D41-D45 PolarHBondContact OD1-N 3.08Å; T43-D45 VanDerWaalsContact C-N 3.25Å; T43-D45 PolarHBondContact O-N 3.09Å; D45-V47 WeakPolarHBondContact OD1-CA 3.35Å; D45-V47 WeakPolarHBondContact OD1-CB 3.17Å; D45-V47 PolarHBondContact OD1-N 2.85Å
46	G	95.4	Very high	94.9	Very high	30 Å²	30	56.5 Å²	56.5	31%	0.309	30%	0.3	S	S	.	.	S	Bend	trans	86.4	10.2	179.6	0	0	0	0	0	114.2	F37 D41 K44 N81	F37-G46 WeakPolarHBondContact CZ-O 3.46Å; D41-G46 VanDerWaalsContact OD2-CA 3.25Å; D41-G46 WeakPolarHBondContact OD2-CA 3.45Å; D41-G46 PolarHBondContact OD2-N 3.43Å; K44-G46 VanDerWaalsContact C-N 3.34Å; G46-N81 WeakPolarHBondContact O-CA 3.47Å
47	V	96.5	Very high	94.9	Very high	30 Å²	30	56.6 Å²	56.6	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124.5	179.8	-179.3	0	0	0	0	109.7	D45 D49 Q79 I80	D45-V47 WeakPolarHBondContact OD1-CA 3.35Å; D45-V47 WeakPolarHBondContact OD1-CB 3.17Å; D45-V47 PolarHBondContact OD1-N 2.85Å; V47-D49 PolarHBondContact O-N 3.45Å; V47-Q79 HydrophobicContact CG1-CB 3.87Å; V47-Q79 HydrophobicContact CG1-CG 4.27Å; V47-I80 WeakPolarHBondContact CA-O 3.45Å
48	I	96.3	Very high	94.8	Very high	6 Å²	6	60.6 Å²	60.6	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.5	172.7	-64.7	168.7	0	0	0	109.2	F37 I40 D52 L53 I80 F85	F37-I48 HydrophobicContact CD2-CD1 3.53Å; F37-I48 HydrophobicContact CD2-CG1 4.14Å; F37-I48 HydrophobicContact CE2-CD1 3.49Å; F37-I48 VanDerWaalsContact CE2-CD1 3.49Å; F37-I48 HydrophobicContact CE2-CG1 3.66Å; F37-I48 HydrophobicContact CG-CD1 4.43Å; F37-I48 HydrophobicContact CZ-CD1 4.35Å; F37-I48 HydrophobicContact CZ-CG1 4.05Å; I40-I48 HydrophobicContact CB-CD1 4Å; I40-I48 HydrophobicContact CB-CG1 4.33Å; I40-I48 HydrophobicContact CD1-CD1 4.24Å; I40-I48 HydrophobicContact CG2-CB 4.48Å; I40-I48 HydrophobicContact CG2-CD1 3.76Å; I40-I48 HydrophobicContact CG2-CG1 3.87Å; I40-I48 HydrophobicContact CG2-CG2 3.8Å; I48-D52 HydrophobicContact CG2-CB 4.14Å; I48-L53 HydrophobicContact CG2-CD2 3.74Å; I48-L53 HydrophobicContact CG2-CG 3.81Å; I48-I80 HydrophobicContact CB-CB 4.18Å; I48-I80 HydrophobicContact CB-CG2 4.2Å; I48-I80 HydrophobicContact CD1-CG2 4.33Å; I48-I80 PolarHBondContact N-O 3.41Å; I48-F85 HydrophobicContact CD1-CD2 3.78Å; I48-F85 HydrophobicContact CD1-CE2 4Å
49	D	95.3	Very high	94.7	Very high	65 Å²	65	59.7 Å²	59.7	35%	0.348	32%	0.318	S	S	.	.			trans	-109.4	-170.5	174.4	81.6	9.8	0	0	0	113.1	V47 H51 D52 L53	V47-D49 PolarHBondContact O-N 3.45Å; D49-H51 VanDerWaalsContact C-N 3.34Å; D49-H51 WeakPolarHBondContact OD1-CA 3.29Å; D49-H51 VanDerWaalsContact OD1-CB 3.29Å; D49-H51 WeakPolarHBondContact OD1-CB 3.36Å; D49-H51 PolarHBondContact OD1-N 3.44Å; D49-D52 PolarHBondContact N-OD2 3.01Å; D49-D52 PolarHBondContact OD1-N 2.95Å; D49-L53 WeakPolarHBondContact O-CG 3.44Å; D49-L53 PolarHBondContact O-N 3.38Å
50	K	95.6	Very high	94.6	Very high	57 Å²	57	58.8 Å²	58.8	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-39.1	179.9	-171.7	-170.4	171.1	-147.1	0	111.8	L53 E54 D66 L69 L73	K50-L53 PolarHBondContact O-N 2.89Å; K50-E54 WeakPolarHBondContact O-CB 3.41Å; K50-E54 PolarHBondContact O-N 2.94Å; K50-D66 WeakPolarHBondContact CE-OD1 3.42Å; K50-D66 IonicContact NZ-OD1 2.71Å; K50-D66 PolarHBondContact NZ-OD1 2.74Å; K50-D66 IonicContact NZ-OD2 3.23Å; K50-D66 PolarHBondContact NZ-OD2 3.4Å; K50-L69 HydrophobicContact CG-CB 4.09Å; K50-L69 HydrophobicContact CG-CD1 4.02Å; K50-L73 HydrophobicContact CB-CD1 3.78Å; K50-L73 HydrophobicContact CG-CD1 4.42Å
51	H	94.6	Very high	94.5	Very high	99 Å²	99	60.8 Å²	60.8	46%	0.458	34%	0.343	S	S	.	.	H	α-helix	trans	-68.9	-42	-178.7	-175.3	-20.3	0	0	0	110.4	D49 L53 E54 D55	D49-H51 VanDerWaalsContact C-N 3.34Å; D49-H51 WeakPolarHBondContact OD1-CA 3.29Å; D49-H51 VanDerWaalsContact OD1-CB 3.29Å; D49-H51 WeakPolarHBondContact OD1-CB 3.36Å; D49-H51 PolarHBondContact OD1-N 3.44Å; H51-L53 VanDerWaalsContact C-N 3.29Å; H51-L53 PolarHBondContact O-N 3.47Å; H51-E54 PolarHBondContact O-N 3.24Å; H51-E54 VanDerWaalsContact O-N 3.16Å; H51-D55 IonicContact CE1-OD1 2.91Å; H51-D55 PolarHBondContact CE1-OD1 3.19Å; H51-D55 IonicContact CE1-OD2 3.12Å; H51-D55 PolarHBondContact CE1-OD2 3.07Å; H51-D55 VanDerWaalsContact ND1-CG 3.26Å; H51-D55 IonicContact ND1-OD1 3.08Å; H51-D55 PolarHBondContact ND1-OD1 2.92Å; H51-D55 VanDerWaalsContact ND1-OD1 3.12Å; H51-D55 IonicContact ND1-OD2 3.02Å; H51-D55 PolarHBondContact ND1-OD2 3.24Å; H51-D55 WeakPolarHBondContact O-CB 3.02Å; H51-D55 PolarHBondContact O-N 2.82Å
52	D	96.5	Very high	94.4	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-58.5	-43.2	175	-69.4	-48	0	0	0	111.8	I40 S42 T43 I48 D49 I56	I40-D52 HydrophobicContact CG2-CB 4.29Å; I40-D52 WeakPolarHBondContact O-CB 3.38Å; S42-D52 WeakPolarHBondContact CB-OD1 3.43Å; S42-D52 PolarHBondContact N-OD1 3.16Å; S42-D52 PolarHBondContact OG-OD1 3.45Å; T43-D52 PolarHBondContact N-OD1 2.76Å; I48-D52 HydrophobicContact CG2-CB 4.14Å; D49-D52 PolarHBondContact N-OD2 3.01Å; D49-D52 PolarHBondContact OD1-N 2.95Å; D52-I56 WeakPolarHBondContact O-CG2 3.43Å; D52-I56 PolarHBondContact O-N 3.32Å; D52-I56 VanDerWaalsContact O-N 3.09Å
53	L	95.5	Very high	94.4	Very high	14 Å²	14	69.6 Å²	69.6	7%	0.073	39%	0.389	C	S	.	.	H	α-helix	trans	-65.2	-44.6	174.5	-67	179.5	0	0	0	111.8	I40 I48 D49 K50 H51 D55 I56 F57 L69 M72 L73	I40-L53 HydrophobicContact CG2-CD2 4.25Å; I48-L53 HydrophobicContact CG2-CD2 3.74Å; I48-L53 HydrophobicContact CG2-CG 3.81Å; D49-L53 WeakPolarHBondContact O-CG 3.44Å; D49-L53 PolarHBondContact O-N 3.38Å; K50-L53 PolarHBondContact O-N 2.89Å; H51-L53 VanDerWaalsContact C-N 3.29Å; H51-L53 PolarHBondContact O-N 3.47Å; L53-D55 VanDerWaalsContact C-N 3.34Å; L53-D55 PolarHBondContact O-N 3.5Å; L53-I56 WeakPolarHBondContact O-CG2 3.48Å; L53-I56 PolarHBondContact O-N 3.02Å; L53-F57 WeakPolarHBondContact O-CD2 3.29Å; L53-F57 PolarHBondContact O-N 2.76Å; L53-L69 HydrophobicContact CB-CD2 3.79Å; L53-M72 HydrophobicContact CD1-CB 4.17Å; L53-M72 HydrophobicContact CD1-CE 4.34Å; L53-M72 HydrophobicContact CD2-CE 4.13Å; L53-L73 HydrophobicContact CD1-CD2 3.62Å; L53-L73 HydrophobicContact CD1-CG 3.86Å
54	E	95.7	Very high	94.5	Very high	73 Å²	73	67.6 Å²	67.6	34%	0.341	38%	0.377	S	S	.	.	H	α-helix	trans	-58.4	-46.5	177.8	-170.3	170.7	-177.3	0	0	111.4	K50 H51 F57 I58 L69	K50-E54 WeakPolarHBondContact O-CB 3.41Å; K50-E54 PolarHBondContact O-N 2.94Å; H51-E54 PolarHBondContact O-N 3.24Å; H51-E54 VanDerWaalsContact O-N 3.16Å; E54-F57 PolarHBondContact O-N 3.36Å; E54-I58 HydrophobicContact CG-CD1 3.85Å; E54-I58 WeakPolarHBondContact O-CB 3.48Å; E54-I58 VanDerWaalsContact O-CG1 3.25Å; E54-I58 WeakPolarHBondContact O-CG1 3.37Å; E54-I58 PolarHBondContact O-N 3.03Å; E54-L69 HydrophobicContact CB-CD1 3.9Å; E54-L69 HydrophobicContact CG-CD1 4.35Å
55	D	94.4	Very high	94.6	Very high	59 Å²	59	62.5 Å²	62.5	32%	0.316	36%	0.364	S	S	.	.	H	α-helix	trans	-61.9	-45.8	179.5	-80.5	2.9	0	0	0	112.2	H51 L53 I58 S59	H51-D55 IonicContact CE1-OD1 2.91Å; H51-D55 PolarHBondContact CE1-OD1 3.19Å; H51-D55 IonicContact CE1-OD2 3.12Å; H51-D55 PolarHBondContact CE1-OD2 3.07Å; H51-D55 VanDerWaalsContact ND1-CG 3.26Å; H51-D55 IonicContact ND1-OD1 3.08Å; H51-D55 PolarHBondContact ND1-OD1 2.92Å; H51-D55 VanDerWaalsContact ND1-OD1 3.12Å; H51-D55 IonicContact ND1-OD2 3.02Å; H51-D55 PolarHBondContact ND1-OD2 3.24Å; H51-D55 WeakPolarHBondContact O-CB 3.02Å; H51-D55 PolarHBondContact O-N 2.82Å; L53-D55 VanDerWaalsContact C-N 3.34Å; L53-D55 PolarHBondContact O-N 3.5Å; D55-I58 PolarHBondContact O-N 3.01Å; D55-S59 WeakPolarHBondContact O-CB 3.38Å; D55-S59 PolarHBondContact O-N 2.92Å
56	I	94.9	Very high	94.6	Very high	41 Å²	41	61.9 Å²	61.9	21%	0.21	36%	0.36	C	S	.	.	H	α-helix	trans	-65.4	-41.5	178.9	-168.7	69	0	0	0	111	I40 D52 L53 I58 S59 L60	I40-I56 HydrophobicContact CG1-CG1 4.29Å; I40-I56 HydrophobicContact CG2-CG2 4.25Å; D52-I56 WeakPolarHBondContact O-CG2 3.43Å; D52-I56 PolarHBondContact O-N 3.32Å; D52-I56 VanDerWaalsContact O-N 3.09Å; L53-I56 WeakPolarHBondContact O-CG2 3.48Å; L53-I56 PolarHBondContact O-N 3.02Å; I56-I58 PolarHBondContact O-N 3.18Å; I56-S59 PolarHBondContact O-N 3.11Å; I56-S59 PolarHBondContact O-OG 3.23Å; I56-L60 HydrophobicContact CG1-CD1 4.46Å; I56-L60 WeakPolarHBondContact O-CG 3.44Å; I56-L60 PolarHBondContact O-N 3.46Å; I56-L60 VanDerWaalsContact O-N 3.11Å
57	F	94.6	Very high	94.7	Very high	31 Å²	31	68.3 Å²	68.3	14%	0.136	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-40.8	177.1	-83.2	-74.6	0	0	0	112.2	L53 E54 S59 L60 G61 K62 P64 Y68 L69 M72	L53-F57 WeakPolarHBondContact O-CD2 3.29Å; L53-F57 PolarHBondContact O-N 2.76Å; E54-F57 PolarHBondContact O-N 3.36Å; F57-S59 VanDerWaalsContact C-N 3.3Å; F57-S59 PolarHBondContact O-N 3.37Å; F57-L60 CarbonylContact O-C 3.58Å; F57-L60 PolarHBondContact O-N 3.29Å; F57-L60 VanDerWaalsContact O-N 3.13Å; F57-G61 PolarHBondContact O-N 3.38Å; F57-K62 CarbonylContact C-O 3.51Å; F57-K62 VanDerWaalsContact C-O 3.27Å; F57-K62 HydrophobicContact CB-CB 4.35Å; F57-K62 HydrophobicContact CD1-CB 4.07Å; F57-K62 HydrophobicContact CD1-CD 4.26Å; F57-K62 WeakPolarHBondContact O-CA 3.48Å; F57-K62 PolarHBondContact O-N 2.88Å; F57-K62 VanDerWaalsContact O-O 3.07Å; F57-P64 HydrophobicContact CB-CB 4.4Å; F57-P64 HydrophobicContact CB-CG 3.63Å; F57-P64 HydrophobicContact CD2-CB 4.2Å; F57-P64 HydrophobicContact CD2-CG 3.95Å; F57-P64 HydrophobicContact CG-CB 4.19Å; F57-P64 HydrophobicContact CG-CG 3.88Å; F57-Y68 HydrophobicContact CE1-CE1 4.18Å; F57-Y68 HydrophobicContact CE2-CE1 4.06Å; F57-Y68 AromaticContact CZ-CE1 3.65Å; F57-Y68 HydrophobicContact CZ-CE1 3.65Å; F57-L69 HydrophobicContact CD2-CD2 3.88Å; F57-L69 HydrophobicContact CE2-CD2 4.03Å; F57-M72 HydrophobicContact CE2-CE 3.92Å; F57-M72 HydrophobicContact CE2-SD 3.63Å; F57-M72 HydrophobicContact CZ-CE 4.08Å; F57-M72 HydrophobicContact CZ-SD 3.85Å
58	I	93.9	Very high	94.6	Very high	93 Å²	93	72.9 Å²	72.9	48%	0.477	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-42.2	174.4	-70.9	168.9	0	0	0	110.4	E54 D55 I56 L60 G61 K62	E54-I58 HydrophobicContact CG-CD1 3.85Å; E54-I58 WeakPolarHBondContact O-CB 3.48Å; E54-I58 VanDerWaalsContact O-CG1 3.25Å; E54-I58 WeakPolarHBondContact O-CG1 3.37Å; E54-I58 PolarHBondContact O-N 3.03Å; D55-I58 PolarHBondContact O-N 3.01Å; I56-I58 PolarHBondContact O-N 3.18Å; I58-L60 PolarHBondContact O-N 3.1Å; I58-G61 PolarHBondContact O-N 3.01Å; I58-K62 WeakPolarHBondContact CA-O 3.49Å; I58-K62 PolarHBondContact N-O 2.92Å
59	S	92.3	Very high	94.5	Very high	83 Å²	83	72.7 Å²	72.7	58%	0.58	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-28.2	177.3	82.8	0	0	0	0	113.1	D55 I56 F57 G61	D55-S59 WeakPolarHBondContact O-CB 3.38Å; D55-S59 PolarHBondContact O-N 2.92Å; I56-S59 PolarHBondContact O-N 3.11Å; I56-S59 PolarHBondContact O-OG 3.23Å; F57-S59 VanDerWaalsContact C-N 3.3Å; F57-S59 PolarHBondContact O-N 3.37Å; S59-G61 VanDerWaalsContact C-N 3.28Å
60	L	93.2	Very high	94.5	Very high	118 Å²	118	73.5 Å²	73.5	62%	0.618	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	6.3	174.3	-64.2	173.3	0	0	0	113.1	I56 F57 I58 K62	I56-L60 HydrophobicContact CG1-CD1 4.46Å; I56-L60 WeakPolarHBondContact O-CG 3.44Å; I56-L60 PolarHBondContact O-N 3.46Å; I56-L60 VanDerWaalsContact O-N 3.11Å; F57-L60 CarbonylContact O-C 3.58Å; F57-L60 PolarHBondContact O-N 3.29Å; F57-L60 VanDerWaalsContact O-N 3.13Å; I58-L60 PolarHBondContact O-N 3.1Å; L60-K62 VanDerWaalsContact C-N 3.3Å; L60-K62 PolarHBondContact O-N 3.46Å
61	G	93.6	Very high	94.4	Very high	71 Å²	71	72.2 Å²	72.2	73%	0.732	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	13.8	-179.6	0	0	0	0	0	114.5	F57 I58 S59	F57-G61 PolarHBondContact O-N 3.38Å; I58-G61 PolarHBondContact O-N 3.01Å; S59-G61 VanDerWaalsContact C-N 3.28Å
62	K	93	Very high	94.3	Very high	126 Å²	126	70.4 Å²	70.4	55%	0.548	40%	0.396	S	S	.	.			trans	-103	150.1	178.3	-61.2	-166	177.9	-169.3	0	110.8	F57 I58 L60	F57-K62 CarbonylContact C-O 3.51Å; F57-K62 VanDerWaalsContact C-O 3.27Å; F57-K62 HydrophobicContact CB-CB 4.35Å; F57-K62 HydrophobicContact CD1-CB 4.07Å; F57-K62 HydrophobicContact CD1-CD 4.26Å; F57-K62 WeakPolarHBondContact O-CA 3.48Å; F57-K62 PolarHBondContact O-N 2.88Å; F57-K62 VanDerWaalsContact O-O 3.07Å; I58-K62 WeakPolarHBondContact CA-O 3.49Å; I58-K62 PolarHBondContact N-O 2.92Å; L60-K62 VanDerWaalsContact C-N 3.3Å; L60-K62 PolarHBondContact O-N 3.46Å
63	S	92.7	Very high	94.1	Very high	118 Å²	118	72.4 Å²	72.4	83%	0.825	41%	0.406	S	S	*	.			trans	-119.8	89.1	174.3	-59.8	0	0	0	0	109.1
64	P	93.3	Very high	94	Very high	29 Å²	29	75.8 Å²	75.8	19%	0.188	43%	0.431	C	S	.	.			trans	-71.3	149.6	-176.5	32.6	-35.5	0	0	0	110.1	F57 Y68 L69	F57-P64 HydrophobicContact CB-CB 4.4Å; F57-P64 HydrophobicContact CB-CG 3.63Å; F57-P64 HydrophobicContact CD2-CB 4.2Å; F57-P64 HydrophobicContact CD2-CG 3.95Å; F57-P64 HydrophobicContact CG-CB 4.19Å; F57-P64 HydrophobicContact CG-CG 3.88Å; P64-Y68 HydrophobicContact CB-CD1 3.91Å; P64-L69 HydrophobicContact CB-CD1 4.45Å; P64-L69 HydrophobicContact CB-CD2 3.76Å; P64-L69 HydrophobicContact CB-CG 3.95Å; P64-L69 HydrophobicContact CG-CD1 3.96Å; P64-L69 HydrophobicContact CG-CD2 3.73Å; P64-L69 HydrophobicContact CG-CG 3.95Å
65	S	95.3	Very high	93.6	Very high	65 Å²	65	78.9 Å²	78.9	46%	0.455	45%	0.445	S	S	.	.			trans	-78.6	152.7	172.1	70.5	0	0	0	0	110.9	E67 Y68 L69	S65-E67 PolarHBondContact O-N 3.33Å; S65-Y68 WeakPolarHBondContact O-CB 3.25Å; S65-Y68 PolarHBondContact O-N 3.06Å; S65-Y68 WeakPolarHBondContact OG-CB 3.44Å; S65-Y68 PolarHBondContact OG-N 3.28Å; S65-Y68 VanDerWaalsContact OG-N 3.15Å; S65-L69 PolarHBondContact O-N 2.86Å
66	D	95.1	Very high	93.4	Very high	91 Å²	91	76.7 Å²	76.7	49%	0.487	44%	0.435	S	S	.	.	H	α-helix	trans	-53.1	-40	172.4	-85.8	13.3	0	0	0	112.6	K50 L69 N70	K50-D66 WeakPolarHBondContact CE-OD1 3.42Å; K50-D66 IonicContact NZ-OD1 2.71Å; K50-D66 PolarHBondContact NZ-OD1 2.74Å; K50-D66 IonicContact NZ-OD2 3.23Å; K50-D66 PolarHBondContact NZ-OD2 3.4Å; D66-L69 PolarHBondContact O-N 3.02Å; D66-N70 VanDerWaalsContact O-CB 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.13Å; D66-N70 PolarHBondContact O-N 2.91Å; D66-N70 PolarHBondContact O-ND2 2.91Å
67	E	96.2	Very high	93	Very high	165 Å²	165	80.4 Å²	80.4	77%	0.771	46%	0.462	S	S	*	.	H	α-helix	trans	-63.4	-42.3	177.8	-174.9	173.7	-170.7	0	0	111.6	S65 G71	S65-E67 PolarHBondContact O-N 3.33Å; E67-G71 PolarHBondContact O-N 3.05Å
68	Y	94	Very high	92.8	Very high	127 Å²	127	81 Å²	81	50%	0.498	48%	0.477	S	S	.	.	H	α-helix	trans	-63.9	-47.6	177.2	179.7	-102.6	0	0	0	111.7	F57 P64 S65 N70 G71 M72	F57-Y68 HydrophobicContact CE1-CE1 4.18Å; F57-Y68 HydrophobicContact CE2-CE1 4.06Å; F57-Y68 AromaticContact CZ-CE1 3.65Å; F57-Y68 HydrophobicContact CZ-CE1 3.65Å; P64-Y68 HydrophobicContact CB-CD1 3.91Å; S65-Y68 WeakPolarHBondContact O-CB 3.25Å; S65-Y68 PolarHBondContact O-N 3.06Å; S65-Y68 WeakPolarHBondContact OG-CB 3.44Å; S65-Y68 PolarHBondContact OG-N 3.28Å; S65-Y68 VanDerWaalsContact OG-N 3.15Å; Y68-N70 PolarHBondContact O-N 3.24Å; Y68-G71 WeakPolarHBondContact O-CA 3.39Å; Y68-G71 PolarHBondContact O-N 2.81Å; Y68-G71 VanDerWaalsContact O-N 3.15Å; Y68-M72 HydrophobicContact CD1-SD 3.98Å; Y68-M72 HydrophobicContact CE1-CG 4.25Å; Y68-M72 HydrophobicContact CE1-SD 3.41Å; Y68-M72 WeakPolarHBondContact CE1-SD 3.26Å; Y68-M72 WeakPolarHBondContact O-CG 3.26Å; Y68-M72 PolarHBondContact O-N 2.71Å
69	L	95.4	Very high	92.7	Very high	1 Å²	1	83.5 Å²	83.5	1%	0.005	49%	0.487	C	S	.	.	H	α-helix	trans	-62.3	-45	178.1	-65.1	-177.8	0	0	0	112.2	K50 L53 E54 F57 P64 S65 D66 G71 M72 L73	K50-L69 HydrophobicContact CG-CB 4.09Å; K50-L69 HydrophobicContact CG-CD1 4.02Å; L53-L69 HydrophobicContact CB-CD2 3.79Å; E54-L69 HydrophobicContact CB-CD1 3.9Å; E54-L69 HydrophobicContact CG-CD1 4.35Å; F57-L69 HydrophobicContact CD2-CD2 3.88Å; F57-L69 HydrophobicContact CE2-CD2 4.03Å; P64-L69 HydrophobicContact CB-CD1 4.45Å; P64-L69 HydrophobicContact CB-CD2 3.76Å; P64-L69 HydrophobicContact CB-CG 3.95Å; P64-L69 HydrophobicContact CG-CD1 3.96Å; P64-L69 HydrophobicContact CG-CD2 3.73Å; P64-L69 HydrophobicContact CG-CG 3.95Å; S65-L69 PolarHBondContact O-N 2.86Å; D66-L69 PolarHBondContact O-N 3.02Å; L69-G71 VanDerWaalsContact C-N 3.27Å; L69-G71 PolarHBondContact O-N 2.83Å; L69-M72 HydrophobicContact CD2-SD 4.45Å; L69-M72 WeakPolarHBondContact O-CB 3.38Å; L69-M72 PolarHBondContact O-N 3.02Å; L69-L73 WeakPolarHBondContact O-CG 3.41Å; L69-L73 PolarHBondContact O-N 3.25Å
70	N	94.7	Very high	92.8	Very high	83 Å²	83	80.2 Å²	80.2	44%	0.444	46%	0.463	S	S	.	.	H	α-helix	trans	-63.1	-37	175.1	-73.3	-47.2	0	0	0	111.5	D66 Y68 L73 S74	D66-N70 VanDerWaalsContact O-CB 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.13Å; D66-N70 PolarHBondContact O-N 2.91Å; D66-N70 PolarHBondContact O-ND2 2.91Å; Y68-N70 PolarHBondContact O-N 3.24Å; N70-L73 PolarHBondContact O-N 3.25Å; N70-S74 WeakPolarHBondContact O-CB 3.38Å; N70-S74 PolarHBondContact O-N 2.87Å; N70-S74 PolarHBondContact O-OG 2.95Å
71	G	94	Very high	92.9	Very high	29 Å²	29	77.8 Å²	77.8	30%	0.299	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-44.9	173	0	0	0	0	0	112.2	E67 Y68 L69 S74	E67-G71 PolarHBondContact O-N 3.05Å; Y68-G71 WeakPolarHBondContact O-CA 3.39Å; Y68-G71 PolarHBondContact O-N 2.81Å; Y68-G71 VanDerWaalsContact O-N 3.15Å; L69-G71 VanDerWaalsContact C-N 3.27Å; L69-G71 PolarHBondContact O-N 2.83Å; G71-S74 PolarHBondContact O-N 3.05Å; G71-S74 PolarHBondContact O-OG 3.49Å
72	M	92	Very high	93	Very high	62 Å²	62	76.3 Å²	76.3	31%	0.305	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-49.7	175.3	-68.1	177.3	67.4	0	0	111.9	L53 F57 Y68 L69 S74 Q75	L53-M72 HydrophobicContact CD1-CB 4.17Å; L53-M72 HydrophobicContact CD1-CE 4.34Å; L53-M72 HydrophobicContact CD2-CE 4.13Å; F57-M72 HydrophobicContact CE2-CE 3.92Å; F57-M72 HydrophobicContact CE2-SD 3.63Å; F57-M72 HydrophobicContact CZ-CE 4.08Å; F57-M72 HydrophobicContact CZ-SD 3.85Å; Y68-M72 HydrophobicContact CD1-SD 3.98Å; Y68-M72 HydrophobicContact CE1-CG 4.25Å; Y68-M72 HydrophobicContact CE1-SD 3.41Å; Y68-M72 WeakPolarHBondContact CE1-SD 3.26Å; Y68-M72 WeakPolarHBondContact O-CG 3.26Å; Y68-M72 PolarHBondContact O-N 2.71Å; L69-M72 HydrophobicContact CD2-SD 4.45Å; L69-M72 WeakPolarHBondContact O-CB 3.38Å; L69-M72 PolarHBondContact O-N 3.02Å; M72-S74 PolarHBondContact O-N 3.23Å; M72-Q75 WeakPolarHBondContact O-CB 3.35Å; M72-Q75 WeakPolarHBondContact O-CG 3.41Å; M72-Q75 PolarHBondContact O-N 2.8Å
73	L	93.3	Very high	93	Very high	41 Å²	41	72.6 Å²	72.6	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-33.1	179.9	-66.8	175.1	0	0	0	112.3	K50 L53 L69 N70 Q75 A76 I80	K50-L73 HydrophobicContact CB-CD1 3.78Å; K50-L73 HydrophobicContact CG-CD1 4.42Å; L53-L73 HydrophobicContact CD1-CD2 3.62Å; L53-L73 HydrophobicContact CD1-CG 3.86Å; L69-L73 WeakPolarHBondContact O-CG 3.41Å; L69-L73 PolarHBondContact O-N 3.25Å; N70-L73 PolarHBondContact O-N 3.25Å; L73-Q75 PolarHBondContact O-N 2.94Å; L73-A76 PolarHBondContact O-N 3.49Å; L73-I80 HydrophobicContact CD2-CD1 3.75Å
74	S	92.3	Very high	93	Very high	85 Å²	85	68.2 Å²	68.2	59%	0.594	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.2	179.9	76.3	0	0	0	0	114.6	N70 G71 M72 A76	N70-S74 WeakPolarHBondContact O-CB 3.38Å; N70-S74 PolarHBondContact O-N 2.87Å; N70-S74 PolarHBondContact O-OG 2.95Å; G71-S74 PolarHBondContact O-N 3.05Å; G71-S74 PolarHBondContact O-OG 3.49Å; M72-S74 PolarHBondContact O-N 3.23Å; S74-A76 PolarHBondContact O-N 3.2Å
75	Q	88.1	Confident	93	Very high	139 Å²	139	67.5 Å²	67.5	65%	0.65	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-25.1	173.9	-59.4	-59.1	-30	0	0	111.8	M72 L73	M72-Q75 WeakPolarHBondContact O-CB 3.35Å; M72-Q75 WeakPolarHBondContact O-CG 3.41Å; M72-Q75 PolarHBondContact O-N 2.8Å; L73-Q75 PolarHBondContact O-N 2.94Å
76	A	89.1	Confident	92.8	Very high	12 Å²	12	64.4 Å²	64.4	10%	0.099	35%	0.351	C	S	.	.	S	Bend	trans	-85	133.2	176.9	0	0	0	0	0	110.9	L73 S74 G78 I80 M84 L88	L73-A76 PolarHBondContact O-N 3.49Å; S74-A76 PolarHBondContact O-N 3.2Å; A76-G78 VanDerWaalsContact CB-O 3.25Å; A76-G78 WeakPolarHBondContact CB-O 3.25Å; A76-G78 PolarHBondContact O-N 2.94Å; A76-I80 HydrophobicContact CB-CD1 3.97Å; A76-I80 HydrophobicContact CB-CG1 3.55Å; A76-M84 HydrophobicContact CB-CG 4.19Å; A76-L88 HydrophobicContact CB-CD1 4.12Å
77	P	87.2	Confident	92.5	Very high	119 Å²	119	60.3 Å²	60.3	77%	0.773	33%	0.329	S	S	*	.	S	Bend	trans	-70.5	1.1	174.8	30.3	-36.4	0	0	0	113.5	M84	P77-M84 HydrophobicContact CG-CE 3.73Å; P77-M84 HydrophobicContact CG-SD 4.08Å
78	G	89.9	Confident	92.1	Very high	44 Å²	44	54.4 Å²	54.4	45%	0.454	30%	0.302	S	S	.	.	S	Bend	trans	-172.5	-161.9	-177.7	0	0	0	0	0	111	A76	A76-G78 VanDerWaalsContact CB-O 3.25Å; A76-G78 WeakPolarHBondContact CB-O 3.25Å; A76-G78 PolarHBondContact O-N 2.94Å
79	Q	92.7	Very high	91.8	Very high	145 Å²	145	52.4 Å²	52.4	68%	0.678	30%	0.296	S	S	*	.			trans	-59.9	139.5	177.6	-70.8	176.4	-2.7	0	0	111.8	V47 N81	V47-Q79 HydrophobicContact CG1-CB 3.87Å; V47-Q79 HydrophobicContact CG1-CG 4.27Å; Q79-N81 VanDerWaalsContact C-N 3.31Å; Q79-N81 PolarHBondContact O-N 3.15Å; Q79-N81 VanDerWaalsContact O-N 3.07Å
80	I	94.9	Very high	91.2	Very high	15 Å²	15	52.4 Å²	52.4	8%	0.077	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	74.2	179.7	-51.8	-177.9	0	0	0	109.3	V47 I48 L73 A76 F85 L88	V47-I80 WeakPolarHBondContact CA-O 3.45Å; I48-I80 HydrophobicContact CB-CB 4.18Å; I48-I80 HydrophobicContact CB-CG2 4.2Å; I48-I80 HydrophobicContact CD1-CG2 4.33Å; I48-I80 PolarHBondContact N-O 3.41Å; L73-I80 HydrophobicContact CD2-CD1 3.75Å; A76-I80 HydrophobicContact CB-CD1 3.97Å; A76-I80 HydrophobicContact CB-CG1 3.55Å; I80-F85 HydrophobicContact CG2-CB 4.13Å; I80-F85 HydrophobicContact CG2-CD2 4.38Å; I80-L88 HydrophobicContact CD1-CD1 4.32Å; I80-L88 HydrophobicContact CG2-CD1 4.39Å
81	N	95.1	Very high	90.4	Very high	66 Å²	66	52.9 Å²	52.9	35%	0.353	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	173.2	164.5	64.2	32.5	0	0	0	110.9	G46 Q79 T83 M84 F85	G46-N81 WeakPolarHBondContact O-CA 3.47Å; Q79-N81 VanDerWaalsContact C-N 3.31Å; Q79-N81 PolarHBondContact O-N 3.15Å; Q79-N81 VanDerWaalsContact O-N 3.07Å; N81-T83 VanDerWaalsContact C-N 3.28Å; N81-T83 PolarHBondContact O-N 2.87Å; N81-T83 PolarHBondContact OD1-N 3.02Å; N81-M84 WeakPolarHBondContact O-CB 3.32Å; N81-M84 PolarHBondContact O-N 2.93Å; N81-M84 PolarHBondContact OD1-N 3.42Å; N81-F85 WeakPolarHBondContact O-CB 3.36Å; N81-F85 PolarHBondContact O-N 3.2Å
82	F	94.8	Very high	89.4	Confident	40 Å²	40	60 Å²	60	18%	0.175	32%	0.319	C	S	.	.	H	α-helix	trans	-54.9	-39.9	-177.5	-176.2	-119.5	0	0	0	114	F22 I30 F33 K34 F37 M84 F85 L86	F22-F82 HydrophobicContact CE1-CE1 4.27Å; I30-F82 HydrophobicContact CG2-CE1 4.44Å; I30-F82 HydrophobicContact CG2-CZ 4.35Å; F33-F82 HydrophobicContact CB-CE2 4.18Å; F33-F82 HydrophobicContact CB-CZ 4.42Å; K34-F82 VanDerWaalsContact CA-CE2 3.42Å; K34-F82 HydrophobicContact CB-CE1 4.41Å; K34-F82 HydrophobicContact CB-CE2 3.9Å; K34-F82 HydrophobicContact CB-CZ 3.66Å; K34-F82 HydrophobicContact CG-CE2 4.36Å; K34-F82 HydrophobicContact CG-CZ 4.18Å; F37-F82 HydrophobicContact CB-CD2 3.72Å; F37-F82 HydrophobicContact CB-CE2 4.11Å; F37-F82 HydrophobicContact CD1-CB 4.35Å; F37-F82 HydrophobicContact CD1-CD2 4.25Å; F37-F82 HydrophobicContact CD2-CB 4.36Å; F37-F82 AromaticContact CD2-CD2 3.99Å; F37-F82 HydrophobicContact CD2-CD2 3.99Å; F37-F82 HydrophobicContact CE1-CB 4.34Å; F37-F82 HydrophobicContact CE2-CB 4.33Å; F37-F82 HydrophobicContact CG-CB 4.37Å; F37-F82 AromaticContact CG-CD2 3.7Å; F37-F82 HydrophobicContact CG-CD2 3.7Å; F37-F82 HydrophobicContact CG-CG 4.5Å; F37-F82 HydrophobicContact CZ-CB 4.33Å; F82-M84 PolarHBondContact O-N 3.48Å; F82-F85 HydrophobicContact CD2-CD1 4.44Å; F82-F85 HydrophobicContact CE2-CD1 4.5Å; F82-F85 WeakPolarHBondContact O-CB 3.41Å; F82-F85 PolarHBondContact O-N 3.31Å; F82-L86 HydrophobicContact CD1-CD1 4.24Å; F82-L86 HydrophobicContact CE1-CD1 3.68Å; F82-L86 HydrophobicContact CE1-CG 4.2Å; F82-L86 HydrophobicContact CE2-CD1 4.43Å; F82-L86 HydrophobicContact CE2-CD2 4.15Å; F82-L86 HydrophobicContact CE2-CG 4.08Å; F82-L86 HydrophobicContact CZ-CD1 3.79Å; F82-L86 HydrophobicContact CZ-CD2 3.99Å; F82-L86 HydrophobicContact CZ-CG 3.91Å; F82-L86 WeakPolarHBondContact O-CG 3.48Å; F82-L86 PolarHBondContact O-N 2.73Å
83	T	93	Very high	88.4	Confident	48 Å²	48	61.4 Å²	61.4	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-66	-39.7	177.4	-54.3	0	0	0	0	111.9	V21 F22 N81 T87	V21-T83 HydrophobicContact CG1-CG2 4.14Å; F22-T83 HydrophobicContact CE2-CG2 4.25Å; N81-T83 VanDerWaalsContact C-N 3.28Å; N81-T83 PolarHBondContact O-N 2.87Å; N81-T83 PolarHBondContact OD1-N 3.02Å; T83-T87 PolarHBondContact O-N 3.5Å; T83-T87 PolarHBondContact O-OG1 3.5Å
84	M	92.6	Very high	87	Confident	27 Å²	27	65.3 Å²	65.3	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-68.2	-41.6	175.4	-175.5	57.2	68.1	0	0	111.1	A76 P77 N81 F82 L86 T87 L88	A76-M84 HydrophobicContact CB-CG 4.19Å; P77-M84 HydrophobicContact CG-CE 3.73Å; P77-M84 HydrophobicContact CG-SD 4.08Å; N81-M84 WeakPolarHBondContact O-CB 3.32Å; N81-M84 PolarHBondContact O-N 2.93Å; N81-M84 PolarHBondContact OD1-N 3.42Å; F82-M84 PolarHBondContact O-N 3.48Å; M84-L86 PolarHBondContact O-N 3.13Å; M84-T87 CarbonylContact O-C 3.27Å; M84-T87 WeakPolarHBondContact O-CA 3.43Å; M84-T87 WeakPolarHBondContact O-CB 3.13Å; M84-T87 PolarHBondContact O-N 3.24Å; M84-L88 HydrophobicContact CG-CD1 4.43Å; M84-L88 HydrophobicContact CG-CG 4.5Å; M84-L88 WeakPolarHBondContact O-CG 3.32Å; M84-L88 PolarHBondContact O-N 2.86Å
85	F	93	Very high	85.6	Confident	13 Å²	13	64.8 Å²	64.8	6%	0.057	35%	0.353	C	S	.	.	H	α-helix	trans	-55.1	-51.2	173.7	-178.1	-97.5	0	0	0	111.1	F33 F37 I40 I48 I80 N81 F82 T87 L88 F89	F33-F85 HydrophobicContact CB-CE1 4.34Å; F33-F85 HydrophobicContact CD1-CE1 4.02Å; F37-F85 HydrophobicContact CB-CD1 4.33Å; F37-F85 HydrophobicContact CB-CE1 4.3Å; F37-F85 HydrophobicContact CD2-CB 3.76Å; F37-F85 HydrophobicContact CD2-CD1 4.05Å; F37-F85 AromaticContact CD2-CD2 4Å; F37-F85 HydrophobicContact CD2-CD2 4Å; F37-F85 AromaticContact CD2-CG 3.7Å; F37-F85 HydrophobicContact CD2-CG 3.7Å; F37-F85 HydrophobicContact CE2-CB 4.03Å; F37-F85 HydrophobicContact CE2-CG 4.38Å; I40-F85 HydrophobicContact CD1-CE2 3.99Å; I40-F85 HydrophobicContact CD1-CZ 4.26Å; I48-F85 HydrophobicContact CD1-CD2 3.78Å; I48-F85 HydrophobicContact CD1-CE2 4Å; I80-F85 HydrophobicContact CG2-CB 4.13Å; I80-F85 HydrophobicContact CG2-CD2 4.38Å; N81-F85 WeakPolarHBondContact O-CB 3.36Å; N81-F85 PolarHBondContact O-N 3.2Å; F82-F85 HydrophobicContact CD2-CD1 4.44Å; F82-F85 HydrophobicContact CE2-CD1 4.5Å; F82-F85 WeakPolarHBondContact O-CB 3.41Å; F82-F85 PolarHBondContact O-N 3.31Å; F85-T87 PolarHBondContact O-N 3.39Å; F85-L88 PolarHBondContact O-N 3.19Å; F85-F89 HydrophobicContact CD1-CD2 4.06Å; F85-F89 HydrophobicContact CD1-CE2 4.32Å; F85-F89 HydrophobicContact CD2-CD2 4.22Å; F85-F89 AromaticContact CD2-CE2 3.96Å; F85-F89 HydrophobicContact CD2-CE2 3.96Å; F85-F89 AromaticContact CE1-CD2 3.84Å; F85-F89 HydrophobicContact CE1-CD2 3.84Å; F85-F89 AromaticContact CE1-CE2 3.77Å; F85-F89 HydrophobicContact CE1-CE2 3.77Å; F85-F89 HydrophobicContact CE2-CD2 4.02Å; F85-F89 AromaticContact CE2-CE2 3.37Å; F85-F89 HydrophobicContact CE2-CE2 3.37Å; F85-F89 HydrophobicContact CE2-CZ 4.32Å; F85-F89 HydrophobicContact CG-CD2 4.25Å; F85-F89 HydrophobicContact CG-CE2 4.4Å; F85-F89 AromaticContact CZ-CD2 3.82Å; F85-F89 HydrophobicContact CZ-CD2 3.82Å; F85-F89 AromaticContact CZ-CE2 3.26Å; F85-F89 HydrophobicContact CZ-CE2 3.26Å; F85-F89 HydrophobicContact CZ-CZ 4.01Å; F85-F89 WeakPolarHBondContact O-CD2 3.48Å; F85-F89 PolarHBondContact O-N 3.17Å
86	L	92.1	Very high	84.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-58.6	-34.3	172.8	-70.5	-179.5	0	0	0	112.4	V21 F22 F25 F33 F82 M84 G90	V21-L86 HydrophobicContact CG1-CB 4.4Å; V21-L86 VanDerWaalsContact CG2-C 3.4Å; V21-L86 HydrophobicContact CG2-CB 3.76Å; V21-L86 VanDerWaalsContact CG2-O 3.26Å; V21-L86 WeakPolarHBondContact CG2-O 3.43Å; F22-L86 HydrophobicContact CD1-CD1 3.88Å; F22-L86 HydrophobicContact CE1-CD1 3.39Å; F22-L86 HydrophobicContact CE2-CD1 4.46Å; F22-L86 HydrophobicContact CZ-CD1 3.73Å; F25-L86 HydrophobicContact CD2-CD2 4.32Å; F25-L86 HydrophobicContact CE2-CB 4.46Å; F25-L86 HydrophobicContact CE2-CD2 4.32Å; F33-L86 HydrophobicContact CB-CD2 3.55Å; F33-L86 HydrophobicContact CD2-CD2 3.72Å; F33-L86 HydrophobicContact CG-CD2 3.73Å; F82-L86 HydrophobicContact CD1-CD1 4.24Å; F82-L86 HydrophobicContact CE1-CD1 3.68Å; F82-L86 HydrophobicContact CE1-CG 4.2Å; F82-L86 HydrophobicContact CE2-CD1 4.43Å; F82-L86 HydrophobicContact CE2-CD2 4.15Å; F82-L86 HydrophobicContact CE2-CG 4.08Å; F82-L86 HydrophobicContact CZ-CD1 3.79Å; F82-L86 HydrophobicContact CZ-CD2 3.99Å; F82-L86 HydrophobicContact CZ-CG 3.91Å; F82-L86 WeakPolarHBondContact O-CG 3.48Å; F82-L86 PolarHBondContact O-N 2.73Å; M84-L86 PolarHBondContact O-N 3.13Å; L86-G90 WeakPolarHBondContact O-CA 3.31Å; L86-G90 PolarHBondContact O-N 3.44Å
87	T	88.5	Confident	84.2	Confident	5 Å²	5	65 Å²	65	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-69.7	-43.9	-179.6	-56.1	0	0	0	0	110.5	F17 T83 M84 F85 G90 E91	F17-T87 HydrophobicContact CB-CG2 4.38Å; F17-T87 HydrophobicContact CD1-CG2 4.4Å; T83-T87 PolarHBondContact O-N 3.5Å; T83-T87 PolarHBondContact O-OG1 3.5Å; M84-T87 CarbonylContact O-C 3.27Å; M84-T87 WeakPolarHBondContact O-CA 3.43Å; M84-T87 WeakPolarHBondContact O-CB 3.13Å; M84-T87 PolarHBondContact O-N 3.24Å; F85-T87 PolarHBondContact O-N 3.39Å; T87-G90 PolarHBondContact O-N 3.03Å; T87-E91 HydrophobicContact CG2-CG 4.44Å; T87-E91 WeakPolarHBondContact O-CB 3.47Å; T87-E91 WeakPolarHBondContact O-CG 3.46Å; T87-E91 PolarHBondContact O-N 3.04Å
88	L	88.3	Confident	84	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.215	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-45.9	176.2	-66.4	171.8	0	0	0	111.5	A76 I80 M84 F85 K92	A76-L88 HydrophobicContact CB-CD1 4.12Å; I80-L88 HydrophobicContact CD1-CD1 4.32Å; I80-L88 HydrophobicContact CG2-CD1 4.39Å; M84-L88 HydrophobicContact CG-CD1 4.43Å; M84-L88 HydrophobicContact CG-CG 4.5Å; M84-L88 WeakPolarHBondContact O-CG 3.32Å; M84-L88 PolarHBondContact O-N 2.86Å; F85-L88 PolarHBondContact O-N 3.19Å; L88-K92 WeakPolarHBondContact O-CB 3.47Å; L88-K92 PolarHBondContact O-N 2.72Å; L88-K92 VanDerWaalsContact O-N 3.11Å
89	F	86.2	Confident	83.8	Confident	85 Å²	85	65.1 Å²	65.1	37%	0.373	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-41.1	174.6	-86.4	-86.3	0	0	0	111.8	F25 F33 F85 K92 M93	F25-F89 HydrophobicContact CZ-CB 4.41Å; F33-F89 HydrophobicContact CD1-CD1 4.46Å; F33-F89 HydrophobicContact CD1-CG 4.3Å; F33-F89 HydrophobicContact CE1-CB 3.99Å; F33-F89 AromaticContact CE1-CD1 3.58Å; F33-F89 HydrophobicContact CE1-CD1 3.58Å; F33-F89 HydrophobicContact CE1-CD2 4.41Å; F33-F89 HydrophobicContact CE1-CE1 4.15Å; F33-F89 AromaticContact CE1-CG 3.72Å; F33-F89 HydrophobicContact CE1-CG 3.72Å; F33-F89 HydrophobicContact CZ-CB 4.23Å; F33-F89 HydrophobicContact CZ-CD1 4.25Å; F33-F89 HydrophobicContact CZ-CG 4.4Å; F85-F89 HydrophobicContact CD1-CD2 4.06Å; F85-F89 HydrophobicContact CD1-CE2 4.32Å; F85-F89 HydrophobicContact CD2-CD2 4.22Å; F85-F89 AromaticContact CD2-CE2 3.96Å; F85-F89 HydrophobicContact CD2-CE2 3.96Å; F85-F89 AromaticContact CE1-CD2 3.84Å; F85-F89 HydrophobicContact CE1-CD2 3.84Å; F85-F89 AromaticContact CE1-CE2 3.77Å; F85-F89 HydrophobicContact CE1-CE2 3.77Å; F85-F89 HydrophobicContact CE2-CD2 4.02Å; F85-F89 AromaticContact CE2-CE2 3.37Å; F85-F89 HydrophobicContact CE2-CE2 3.37Å; F85-F89 HydrophobicContact CE2-CZ 4.32Å; F85-F89 HydrophobicContact CG-CD2 4.25Å; F85-F89 HydrophobicContact CG-CE2 4.4Å; F85-F89 AromaticContact CZ-CD2 3.82Å; F85-F89 HydrophobicContact CZ-CD2 3.82Å; F85-F89 AromaticContact CZ-CE2 3.26Å; F85-F89 HydrophobicContact CZ-CE2 3.26Å; F85-F89 HydrophobicContact CZ-CZ 4.01Å; F85-F89 WeakPolarHBondContact O-CD2 3.48Å; F85-F89 PolarHBondContact O-N 3.17Å; F89-K92 PolarHBondContact O-N 3.11Å; F89-M93 WeakPolarHBondContact O-CB 3.37Å; F89-M93 VanDerWaalsContact O-CG 3.26Å; F89-M93 WeakPolarHBondContact O-CG 3.39Å; F89-M93 PolarHBondContact O-N 3.32Å
90	G	83.5	Confident	83.7	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-58.9	-52	176.9	0	0	0	0	0	111.4	F25 L86 T87 K92 M93 M94	F25-G90 VanDerWaalsContact CZ-CA 3.47Å; L86-G90 WeakPolarHBondContact O-CA 3.31Å; L86-G90 PolarHBondContact O-N 3.44Å; T87-G90 PolarHBondContact O-N 3.03Å; G90-K92 VanDerWaalsContact C-N 3.27Å; G90-K92 PolarHBondContact O-N 2.97Å; G90-M93 PolarHBondContact O-N 2.89Å; G90-M93 VanDerWaalsContact O-N 3.17Å; G90-M94 WeakPolarHBondContact O-CA 3.3Å; G90-M94 WeakPolarHBondContact O-CB 3.42Å; G90-M94 WeakPolarHBondContact O-CG 3.17Å; G90-M94 PolarHBondContact O-N 3.48Å
91	E	78.3	Confident	83.5	Confident	93 Å²	93	67.3 Å²	67.3	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-59.1	-38.8	176.6	-73.7	175.9	-175.7	0	0	112.4	F17 T87	F17-E91 HydrophobicContact CD1-CG 4.23Å; F17-E91 WeakPolarHBondContact CD1-OE1 3.49Å; F17-E91 HydrophobicContact CE1-CG 3.95Å; F17-E91 WeakPolarHBondContact CE1-OE1 3.35Å; T87-E91 HydrophobicContact CG2-CG 4.44Å; T87-E91 WeakPolarHBondContact O-CB 3.47Å; T87-E91 WeakPolarHBondContact O-CG 3.46Å; T87-E91 PolarHBondContact O-N 3.04Å
92	K	73.1	Confident	83.4	Confident	178 Å²	178	65.2 Å²	65.2	77%	0.774	35%	0.349	S	S	*	.	H	α-helix	trans	-69.2	-36.5	177.7	-170.5	66	178.8	-174.2	0	112.5	L88 F89 G90	L88-K92 WeakPolarHBondContact O-CB 3.47Å; L88-K92 PolarHBondContact O-N 2.72Å; L88-K92 VanDerWaalsContact O-N 3.11Å; F89-K92 PolarHBondContact O-N 3.11Å; G90-K92 VanDerWaalsContact C-N 3.27Å; G90-K92 PolarHBondContact O-N 2.97Å
93	M	70.3	Confident	83.3	Confident	92 Å²	92	65.2 Å²	65.2	45%	0.453	35%	0.351	S	S	.	.	H	α-helix	trans	-87.7	-28.8	-178.4	-65.8	-176.8	90.1	0	0	113.4	F25 F33 F89 G90 G95 C96	F25-M93 HydrophobicContact CE1-SD 3.8Å; F25-M93 HydrophobicContact CZ-SD 4.4Å; F33-M93 HydrophobicContact CZ-SD 3.92Å; F89-M93 WeakPolarHBondContact O-CB 3.37Å; F89-M93 VanDerWaalsContact O-CG 3.26Å; F89-M93 WeakPolarHBondContact O-CG 3.39Å; F89-M93 PolarHBondContact O-N 3.32Å; G90-M93 PolarHBondContact O-N 2.89Å; G90-M93 VanDerWaalsContact O-N 3.17Å; M93-G95 PolarHBondContact O-N 3.09Å; M93-C96 PolarHBondContact O-N 3.02Å
94	M	64	Low	83.4	Confident	123 Å²	123	67.2 Å²	67.2	61%	0.606	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.4	-177.3	-87	-170.3	86.2	0	0	114.3	M24 G90	M24-M94 HydrophobicContact CE-CE 3.96Å; M24-M94 HydrophobicContact CE-CG 4.34Å; M24-M94 HydrophobicContact CE-SD 3.13Å; M24-M94 WeakPolarHBondContact CE-SD 3.23Å; M24-M94 HydrophobicContact CG-CG 4.39Å; M24-M94 HydrophobicContact CG-SD 4.23Å; M24-M94 HydrophobicContact SD-CE 4.49Å; M24-M94 HydrophobicContact SD-CG 3.74Å; M24-M94 HydrophobicContact SD-SD 3.31Å; G90-M94 WeakPolarHBondContact O-CA 3.3Å; G90-M94 WeakPolarHBondContact O-CB 3.42Å; G90-M94 WeakPolarHBondContact O-CG 3.17Å; G90-M94 PolarHBondContact O-N 3.48Å
95	G	62.3	Low	83.4	Confident	75 Å²	75	68.5 Å²	68.5	77%	0.773	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-5.8	175.1	0	0	0	0	0	114.7	M93	M93-G95 PolarHBondContact O-N 3.09Å
96	C	68	Low	83.5	Confident	55 Å²	55	69.3 Å²	69.3	37%	0.372	38%	0.378	S	S	.	.			trans	-111.8	116.3	-174.3	-149.7	0	0	0	0	109.7	M93	M93-C96 PolarHBondContact O-N 3.02Å
97	D	81.1	Confident	83.6	Confident	101 Å²	101	71.1 Å²	71.1	54%	0.54	39%	0.394	S	S	.	.			trans	-63.6	155.5	169.4	-73.9	-54.2	0	0	0	110.1	T101 I102	D97-T101 HydrophobicContact CB-CG2 3.87Å; D97-I102 HydrophobicContact CB-CD1 4.39Å; D97-I102 HydrophobicContact CB-CG1 3.8Å; D97-I102 WeakPolarHBondContact O-CD1 3.42Å
98	P	81.8	Confident	83.8	Confident	85 Å²	85	75.8 Å²	75.8	55%	0.552	43%	0.425	S	S	*	.			trans	-52.5	147.5	172.6	-25.1	33.2	0	0	0	111.9	E100 T101 I102	P98-E100 PolarHBondContact O-N 2.76Å; P98-E100 VanDerWaalsContact O-N 3.13Å; P98-T101 WeakPolarHBondContact O-CA 3.12Å; P98-T101 VanDerWaalsContact O-CB 3.3Å; P98-T101 WeakPolarHBondContact O-CB 3.16Å; P98-T101 PolarHBondContact O-N 2.98Å; P98-I102 PolarHBondContact O-N 2.79Å
99	E	86.3	Confident	84.1	Confident	79 Å²	79	78.8 Å²	78.8	37%	0.369	44%	0.437	S	S	.	.	H	α-helix	trans	-41.2	-54.1	176.9	177.4	148.7	-156.8	0	0	112.5	T101 I102 L103 T158 M162	E99-T101 VanDerWaalsContact C-N 3.28Å; E99-T101 PolarHBondContact O-N 2.79Å; E99-I102 PolarHBondContact O-N 2.86Å; E99-I102 VanDerWaalsContact O-N 3.14Å; E99-L103 HydrophobicContact CG-CD1 3.67Å; E99-L103 HydrophobicContact CG-CG 4.18Å; E99-L103 WeakPolarHBondContact O-CB 3.38Å; E99-L103 VanDerWaalsContact O-CG 3.3Å; E99-L103 WeakPolarHBondContact O-CG 3.13Å; E99-L103 PolarHBondContact O-N 2.88Å; E99-T158 HydrophobicContact CG-CG2 4.17Å; E99-M162 WeakPolarHBondContact CA-SD 3.31Å; E99-M162 HydrophobicContact CB-CE 3.19Å; E99-M162 HydrophobicContact CB-SD 3.49Å; E99-M162 WeakPolarHBondContact CB-SD 3.33Å; E99-M162 HydrophobicContact CG-CE 3.3Å; E99-M162 HydrophobicContact CG-SD 4.25Å; E99-M162 PolarHBondContact N-SD 2.78Å; E99-M162 WeakPolarHBondContact OE2-CE 3.45Å
100	E	90.2	Very high	84.5	Confident	140 Å²	140	75.3 Å²	75.3	65%	0.654	42%	0.422	S	S	*	.	H	α-helix	trans	-60	-38.8	-177.8	-174.2	180	174.9	0	0	112	P98 N104	P98-E100 PolarHBondContact O-N 2.76Å; P98-E100 VanDerWaalsContact O-N 3.13Å; E100-N104 WeakPolarHBondContact O-CB 3.49Å; E100-N104 PolarHBondContact O-N 3.28Å; E100-N104 PolarHBondContact O-ND2 2.95Å
101	T	91.5	Very high	84.8	Confident	67 Å²	67	81.2 Å²	81.2	41%	0.411	46%	0.46	S	S	.	.	H	α-helix	trans	-65.8	-43.6	176.9	-58.4	0	0	0	0	111.1	D97 P98 E99 N104 A105	D97-T101 HydrophobicContact CB-CG2 3.87Å; P98-T101 WeakPolarHBondContact O-CA 3.12Å; P98-T101 VanDerWaalsContact O-CB 3.3Å; P98-T101 WeakPolarHBondContact O-CB 3.16Å; P98-T101 PolarHBondContact O-N 2.98Å; E99-T101 VanDerWaalsContact C-N 3.28Å; E99-T101 PolarHBondContact O-N 2.79Å; T101-N104 PolarHBondContact O-N 3.42Å; T101-A105 WeakPolarHBondContact O-CB 3.18Å; T101-A105 PolarHBondContact O-N 3.02Å
102	I	91.8	Very high	85.6	Confident	21 Å²	21	84.9 Å²	84.9	11%	0.108	48%	0.478	C	S	.	.	H	α-helix	trans	-65	-47.6	178.2	-60.1	172.8	0	0	0	110.1	D97 P98 E99 N104 A105 F106 T158 I161 M162	D97-I102 HydrophobicContact CB-CD1 4.39Å; D97-I102 HydrophobicContact CB-CG1 3.8Å; D97-I102 WeakPolarHBondContact O-CD1 3.42Å; P98-I102 PolarHBondContact O-N 2.79Å; E99-I102 PolarHBondContact O-N 2.86Å; E99-I102 VanDerWaalsContact O-N 3.14Å; I102-N104 PolarHBondContact O-N 2.91Å; I102-A105 WeakPolarHBondContact O-CB 2.97Å; I102-A105 PolarHBondContact O-N 3.35Å; I102-A105 VanDerWaalsContact O-N 3.17Å; I102-F106 HydrophobicContact CG2-CD2 3.95Å; I102-F106 HydrophobicContact CG2-CE2 3.76Å; I102-F106 WeakPolarHBondContact O-CD2 3.36Å; I102-F106 PolarHBondContact O-N 3.15Å; I102-F106 VanDerWaalsContact O-N 3.1Å; I102-T158 HydrophobicContact CB-CG2 3.92Å; I102-T158 HydrophobicContact CD1-CG2 4.43Å; I102-T158 HydrophobicContact CG2-CG2 3.8Å; I102-T158 WeakPolarHBondContact CG2-OG1 3.41Å; I102-I161 HydrophobicContact CD1-CD1 4.06Å; I102-I161 HydrophobicContact CG2-CD1 4.37Å; I102-M162 HydrophobicContact CD1-SD 4.39Å
103	L	94.1	Very high	86.6	Confident	41 Å²	41	78.9 Å²	78.9	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-59.3	-45.5	177.6	-70.1	176	0	0	0	111.6	E99 A105 F106 A107 Y154 K155 T158	E99-L103 HydrophobicContact CG-CD1 3.67Å; E99-L103 HydrophobicContact CG-CG 4.18Å; E99-L103 WeakPolarHBondContact O-CB 3.38Å; E99-L103 VanDerWaalsContact O-CG 3.3Å; E99-L103 WeakPolarHBondContact O-CG 3.13Å; E99-L103 PolarHBondContact O-N 2.88Å; L103-A105 VanDerWaalsContact C-N 3.29Å; L103-A105 PolarHBondContact O-N 3.24Å; L103-F106 PolarHBondContact O-N 2.99Å; L103-A107 WeakPolarHBondContact O-CB 3.4Å; L103-A107 PolarHBondContact O-N 3.46Å; L103-Y154 HydrophobicContact CD2-CD2 4.03Å; L103-Y154 HydrophobicContact CD2-CE2 4.31Å; L103-K155 HydrophobicContact CD2-CB 4.33Å; L103-K155 HydrophobicContact CD2-CG 4.01Å; L103-T158 HydrophobicContact CD2-CG2 4.04Å; L103-T158 HydrophobicContact CG-CG2 4.06Å
104	N	93.8	Very high	87.8	Confident	89 Å²	89	78.1 Å²	78.1	48%	0.476	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-35	177.6	-73.6	-26.2	0	0	0	112	E100 T101 I102 A107 C108	E100-N104 WeakPolarHBondContact O-CB 3.49Å; E100-N104 PolarHBondContact O-N 3.28Å; E100-N104 PolarHBondContact O-ND2 2.95Å; T101-N104 PolarHBondContact O-N 3.42Å; I102-N104 PolarHBondContact O-N 2.91Å; N104-A107 PolarHBondContact O-N 3.23Å; N104-C108 PolarHBondContact O-N 3.47Å; N104-C108 PolarHBondContact O-SG 3.01Å
105	A	93.3	Very high	89.3	Confident	55 Å²	55	72.4 Å²	72.4	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-64.4	-43.4	175.6	0	0	0	0	0	111.7	T101 I102 L103 C108	T101-A105 WeakPolarHBondContact O-CB 3.18Å; T101-A105 PolarHBondContact O-N 3.02Å; I102-A105 WeakPolarHBondContact O-CB 2.97Å; I102-A105 PolarHBondContact O-N 3.35Å; I102-A105 VanDerWaalsContact O-N 3.17Å; L103-A105 VanDerWaalsContact C-N 3.29Å; L103-A105 PolarHBondContact O-N 3.24Å; A105-C108 WeakPolarHBondContact O-CB 3.15Å
106	F	94.9	Very high	90.9	Very high	29 Å²	29	70.9 Å²	70.9	13%	0.127	42%	0.415	C	S	.	.	H	α-helix	trans	-68.2	-40.3	173.9	-77.2	-68	0	0	0	112.7	I102 L103 C108 F109 I117 L122 F152 Y154 F157	I102-F106 HydrophobicContact CG2-CD2 3.95Å; I102-F106 HydrophobicContact CG2-CE2 3.76Å; I102-F106 WeakPolarHBondContact O-CD2 3.36Å; I102-F106 PolarHBondContact O-N 3.15Å; I102-F106 VanDerWaalsContact O-N 3.1Å; L103-F106 PolarHBondContact O-N 2.99Å; F106-C108 PolarHBondContact O-N 3.42Å; F106-C108 VanDerWaalsContact O-N 3.09Å; F106-F109 PolarHBondContact O-N 3.04Å; F106-I117 HydrophobicContact CB-CD1 4.09Å; F106-I117 HydrophobicContact CD1-CD1 3.7Å; F106-I117 HydrophobicContact CG-CD1 4.36Å; F106-L122 HydrophobicContact CE1-CD1 4.32Å; F106-F152 AromaticContact CE1-CE1 3.9Å; F106-F152 HydrophobicContact CE1-CE1 3.9Å; F106-F152 HydrophobicContact CZ-CE1 4.04Å; F106-F152 HydrophobicContact CZ-CZ 4.37Å; F106-Y154 HydrophobicContact CB-CD1 4.03Å; F106-Y154 HydrophobicContact CB-CD2 3.46Å; F106-Y154 VanDerWaalsContact CB-CD2 3.46Å; F106-Y154 HydrophobicContact CB-CE1 4.48Å; F106-Y154 HydrophobicContact CB-CE2 4.01Å; F106-Y154 HydrophobicContact CB-CG 3.48Å; F106-Y154 VanDerWaalsContact CB-CG 3.48Å; F106-Y154 HydrophobicContact CD1-CG 4.46Å; F106-Y154 HydrophobicContact CD2-CD2 4.3Å; F106-Y154 HydrophobicContact CD2-CG 4.29Å; F106-Y154 HydrophobicContact CG-CD2 4.11Å; F106-Y154 AromaticContact CG-CG 3.87Å; F106-Y154 HydrophobicContact CG-CG 3.87Å; F106-F157 HydrophobicContact CE2-CD1 4.38Å; F106-F157 HydrophobicContact CZ-CD1 4.28Å
107	A	94.6	Very high	92.3	Very high	39 Å²	39	68.6 Å²	68.6	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-58.2	-25.4	179	0	0	0	0	0	112.9	L103 N104 F109 D110	L103-A107 WeakPolarHBondContact O-CB 3.4Å; L103-A107 PolarHBondContact O-N 3.46Å; N104-A107 PolarHBondContact O-N 3.23Å; A107-F109 PolarHBondContact O-N 2.89Å; A107-F109 VanDerWaalsContact O-N 3.12Å; A107-D110 CarbonylContact O-C 3.5Å; A107-D110 PolarHBondContact O-N 3.44Å; A107-D110 VanDerWaalsContact O-N 3.11Å
108	C	93.7	Very high	93	Very high	102 Å²	102	67.3 Å²	67.3	69%	0.689	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.1	171.9	-65.4	0	0	0	0	113.7	N104 A105 F106	N104-C108 PolarHBondContact O-N 3.47Å; N104-C108 PolarHBondContact O-SG 3.01Å; A105-C108 WeakPolarHBondContact O-CB 3.15Å; F106-C108 PolarHBondContact O-N 3.42Å; F106-C108 VanDerWaalsContact O-N 3.09Å
109	F	92.7	Very high	93.7	Very high	104 Å²	104	65.8 Å²	65.8	46%	0.456	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.3	179	-57.6	-71.3	0	0	0	113.8	F106 A107 P111 I117 L125	F106-F109 PolarHBondContact O-N 3.04Å; A107-F109 PolarHBondContact O-N 2.89Å; A107-F109 VanDerWaalsContact O-N 3.12Å; F109-P111 VanDerWaalsContact C-CD 3.48Å; F109-P111 WeakPolarHBondContact O-CD 3.45Å; F109-I117 HydrophobicContact CB-CD1 4.04Å; F109-L125 HydrophobicContact CB-CD1 4.34Å; F109-L125 HydrophobicContact CD1-CD1 3.41Å; F109-L125 VanDerWaalsContact CD1-CD1 3.41Å; F109-L125 HydrophobicContact CD1-CD2 4.23Å; F109-L125 HydrophobicContact CD1-CG 4.47Å; F109-L125 HydrophobicContact CD2-CD1 4.39Å; F109-L125 HydrophobicContact CE1-CD1 3.68Å; F109-L125 HydrophobicContact CE1-CD2 3.88Å; F109-L125 HydrophobicContact CE1-CG 4.38Å; F109-L125 HydrophobicContact CG-CD1 3.79Å; F109-L125 HydrophobicContact CZ-CD1 4.28Å
110	D	94.8	Very high	94.1	Very high	12 Å²	12	69.8 Å²	69.8	6%	0.064	39%	0.393	C	S	.	.			trans	-120.9	72.6	179.1	173.6	26.5	0	0	0	109	A107 E112 G113 T114 G115 I117 Y154	A107-D110 CarbonylContact O-C 3.5Å; A107-D110 PolarHBondContact O-N 3.44Å; A107-D110 VanDerWaalsContact O-N 3.11Å; D110-E112 PolarHBondContact O-N 2.86Å; D110-E112 VanDerWaalsContact O-N 3.1Å; D110-G113 PolarHBondContact O-N 3.07Å; D110-G113 PolarHBondContact OD1-N 3.32Å; D110-G113 VanDerWaalsContact OD2-C 3.27Å; D110-G113 WeakPolarHBondContact OD2-CA 3.2Å; D110-T114 VanDerWaalsContact CG-N 3.32Å; D110-T114 PolarHBondContact OD1-N 2.97Å; D110-T114 PolarHBondContact OD1-OG1 3.39Å; D110-T114 PolarHBondContact OD2-N 3.22Å; D110-T114 PolarHBondContact OD2-OG1 2.87Å; D110-G115 PolarHBondContact OD2-N 2.88Å; D110-I117 HydrophobicContact CB-CG1 4.26Å; D110-Y154 HydrophobicContact CB-CE1 4.03Å; D110-Y154 WeakPolarHBondContact OD2-CE1 3.41Å; D110-Y154 PolarHBondContact OD2-OH 3.48Å
111	P	91.4	Very high	94.3	Very high	126 Å²	126	68.2 Å²	68.2	82%	0.818	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.6	-174.7	26.6	-35.8	0	0	0	113.5	F109	F109-P111 VanDerWaalsContact C-CD 3.48Å; F109-P111 WeakPolarHBondContact O-CD 3.45Å
112	E	93.5	Very high	94.5	Very high	170 Å²	170	65.3 Å²	65.3	79%	0.794	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.6	176.9	-65.8	-177	-178.8	0	0	112.4	D110 T114	D110-E112 PolarHBondContact O-N 2.86Å; D110-E112 VanDerWaalsContact O-N 3.1Å; E112-T114 VanDerWaalsContact C-N 3.27Å; E112-T114 HydrophobicContact CB-CG2 3.85Å; E112-T114 PolarHBondContact O-N 3.3Å
113	G	93.9	Very high	94.6	Very high	51 Å²	51	66.6 Å²	66.6	53%	0.526	37%	0.367	S	S	.	.			trans	66.3	28.3	178.3	0	0	0	0	0	113.5	D110 G115	D110-G113 PolarHBondContact O-N 3.07Å; D110-G113 PolarHBondContact OD1-N 3.32Å; D110-G113 VanDerWaalsContact OD2-C 3.27Å; D110-G113 WeakPolarHBondContact OD2-CA 3.2Å; G113-G115 PolarHBondContact O-N 3.14Å
114	T	95.7	Very high	94.7	Very high	76 Å²	76	69.1 Å²	69.1	47%	0.466	38%	0.378	S	S	.	.			trans	-64.7	-24.7	-177.2	61.1	0	0	0	0	113	D110 E112 V116	D110-T114 VanDerWaalsContact CG-N 3.32Å; D110-T114 PolarHBondContact OD1-N 2.97Å; D110-T114 PolarHBondContact OD1-OG1 3.39Å; D110-T114 PolarHBondContact OD2-N 3.22Å; D110-T114 PolarHBondContact OD2-OG1 2.87Å; E112-T114 VanDerWaalsContact C-N 3.27Å; E112-T114 HydrophobicContact CB-CG2 3.85Å; E112-T114 PolarHBondContact O-N 3.3Å; T114-V116 VanDerWaalsContact C-N 3.34Å; T114-V116 WeakPolarHBondContact OG1-CG2 3.2Å; T114-V116 PolarHBondContact OG1-N 2.96Å; T114-V116 PolarHBondContact OG1-O 3.35Å
115	G	96	Very high	94.7	Very high	3 Å²	3	65.4 Å²	65.4	3%	0.031	36%	0.358	C	S	.	.	S	Bend	trans	89.5	-1.1	-171.2	0	0	0	0	0	113.7	D110 G113 Y154	D110-G115 PolarHBondContact OD2-N 2.88Å; G113-G115 PolarHBondContact O-N 3.14Å; G115-Y154 WeakPolarHBondContact CA-OH 3.3Å; G115-Y154 WeakPolarHBondContact O-CD1 3.47Å; G115-Y154 VanDerWaalsContact O-CE1 3.24Å; G115-Y154 WeakPolarHBondContact O-CE1 3.46Å; G115-Y154 PolarHBondContact O-N 3.42Å
116	V	96.8	Very high	94.7	Very high	44 Å²	44	64.6 Å²	64.6	27%	0.267	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153.4	-179.1	-61.7	0	0	0	0	112	T114 N151 F152 D153	T114-V116 VanDerWaalsContact C-N 3.34Å; T114-V116 WeakPolarHBondContact OG1-CG2 3.2Å; T114-V116 PolarHBondContact OG1-N 2.96Å; T114-V116 PolarHBondContact OG1-O 3.35Å; V116-N151 HydrophobicContact CB-CB 4.08Å; V116-N151 HydrophobicContact CG1-CB 4.44Å; V116-N151 HydrophobicContact CG2-CB 4.22Å; V116-F152 CarbonylContact C-O 3.54Å; V116-F152 WeakPolarHBondContact CA-O 3.48Å; V116-D153 HydrophobicContact CG1-CB 4.3Å
117	I	96.2	Very high	94.8	Very high	6 Å²	6	64.9 Å²	64.9	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.7	172.9	-61.3	164.1	0	0	0	108.2	F106 F109 D110 E119 L122 F152 Y154	F106-I117 HydrophobicContact CB-CD1 4.09Å; F106-I117 HydrophobicContact CD1-CD1 3.7Å; F106-I117 HydrophobicContact CG-CD1 4.36Å; F109-I117 HydrophobicContact CB-CD1 4.04Å; D110-I117 HydrophobicContact CB-CG1 4.26Å; I117-E119 PolarHBondContact O-N 3.38Å; I117-L122 HydrophobicContact CG2-CB 4.05Å; I117-F152 PolarHBondContact N-O 3.46Å; I117-F152 WeakPolarHBondContact O-CB 3.42Å; I117-F152 PolarHBondContact O-N 2.96Å; I117-Y154 HydrophobicContact CD1-CD1 3.92Å; I117-Y154 HydrophobicContact CD1-CE1 4.43Å; I117-Y154 HydrophobicContact CG1-CD1 3.93Å; I117-Y154 HydrophobicContact CG1-CE1 4.22Å
118	N	96.3	Very high	94.7	Very high	74 Å²	74	66 Å²	66	40%	0.396	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	126.8	175.2	-176.1	-93.2	0	0	0	110.9	K120 R121 L122 G150	N118-K120 VanDerWaalsContact C-N 3.3Å; N118-K120 PolarHBondContact O-N 2.95Å; N118-K120 WeakPolarHBondContact OD1-CB 3.42Å; N118-K120 PolarHBondContact OD1-N 3.42Å; N118-K120 VanDerWaalsContact OD1-N 3.15Å; N118-R121 HydrophobicContact CB-CB 4.12Å; N118-R121 WeakPolarHBondContact O-CA 3.25Å; N118-R121 WeakPolarHBondContact O-CB 3.35Å; N118-R121 PolarHBondContact O-N 3.14Å; N118-R121 PolarHBondContact OD1-N 3.29Å; N118-L122 PolarHBondContact O-N 3.17Å; N118-G150 PolarHBondContact ND2-O 2.86Å
119	E	95.6	Very high	94.5	Very high	53 Å²	53	66.1 Å²	66.1	25%	0.248	34%	0.344	C	S	.	.	H	α-helix	trans	-54.9	-43.8	-175.4	-178.9	-162.1	150.6	0	0	112	I117 R121 L122 R123 F142 I147 G150	I117-E119 PolarHBondContact O-N 3.38Å; E119-R121 VanDerWaalsContact C-N 3.29Å; E119-R121 PolarHBondContact O-N 3.29Å; E119-L122 PolarHBondContact O-N 3.22Å; E119-R123 WeakPolarHBondContact O-CB 3.36Å; E119-R123 PolarHBondContact O-N 2.91Å; E119-R123 IonicContact OE1-NH2 3.69Å; E119-F142 HydrophobicContact CG-CD2 3.56Å; E119-F142 HydrophobicContact CG-CE2 3.25Å; E119-F142 HydrophobicContact CG-CZ 4.08Å; E119-F142 WeakPolarHBondContact OE1-CD2 3.42Å; E119-I147 HydrophobicContact CB-CG2 4.36Å; E119-I147 HydrophobicContact CG-CD1 4.07Å; E119-G150 WeakPolarHBondContact CB-O 3.42Å; E119-G150 PolarHBondContact N-O 2.62Å
120	K	95.3	Very high	94.3	Very high	163 Å²	163	64.6 Å²	64.6	71%	0.709	36%	0.358	S	S	*	.	H	α-helix	trans	-65	-38.3	-179.6	-61.9	-179.5	179.8	175.7	0	111	N118 E124	N118-K120 VanDerWaalsContact C-N 3.3Å; N118-K120 PolarHBondContact O-N 2.95Å; N118-K120 WeakPolarHBondContact OD1-CB 3.42Å; N118-K120 PolarHBondContact OD1-N 3.42Å; N118-K120 VanDerWaalsContact OD1-N 3.15Å; K120-E124 WeakPolarHBondContact O-CB 3.3Å; K120-E124 PolarHBondContact O-N 2.87Å
121	R	94.3	Very high	94	Very high	107 Å²	107	71.3 Å²	71.3	40%	0.404	39%	0.394	S	S	.	.	H	α-helix	trans	-66.7	-44.1	175.2	-179.4	56.1	179.3	168.9	2.4	111	N118 E119 R123 E124 L125	N118-R121 HydrophobicContact CB-CB 4.12Å; N118-R121 WeakPolarHBondContact O-CA 3.25Å; N118-R121 WeakPolarHBondContact O-CB 3.35Å; N118-R121 PolarHBondContact O-N 3.14Å; N118-R121 PolarHBondContact OD1-N 3.29Å; E119-R121 VanDerWaalsContact C-N 3.29Å; E119-R121 PolarHBondContact O-N 3.29Å; R121-R123 VanDerWaalsContact C-N 3.35Å; R121-R123 PolarHBondContact O-N 2.84Å; R121-E124 IonicContact CZ-OE2 3.84Å; R121-E124 IonicContact NH1-OE1 3.23Å; R121-E124 PolarHBondContact NH1-OE1 3.26Å; R121-E124 IonicContact NH1-OE2 2.77Å; R121-E124 PolarHBondContact NH1-OE2 2.81Å; R121-E124 WeakPolarHBondContact O-CB 3.23Å; R121-E124 PolarHBondContact O-N 3.42Å; R121-L125 HydrophobicContact CG-CD1 4.32Å; R121-L125 VanDerWaalsContact O-CG 3.3Å; R121-L125 WeakPolarHBondContact O-CG 3.46Å; R121-L125 PolarHBondContact O-N 3.1Å
122	L	95.2	Very high	94	Very high	6 Å²	6	74.2 Å²	74.2	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-43.9	177.3	-173.4	59.2	0	0	0	111.6	F106 I117 N118 E119 E124 L125 M126 F142 F152	F106-L122 HydrophobicContact CE1-CD1 4.32Å; I117-L122 HydrophobicContact CG2-CB 4.05Å; N118-L122 PolarHBondContact O-N 3.17Å; E119-L122 PolarHBondContact O-N 3.22Å; L122-E124 PolarHBondContact O-N 3.28Å; L122-L125 WeakPolarHBondContact O-CB 3.42Å; L122-L125 PolarHBondContact O-N 3.35Å; L122-M126 HydrophobicContact CD1-CE 3.86Å; L122-M126 HydrophobicContact CD2-CE 4.15Å; L122-M126 HydrophobicContact CG-CE 3.86Å; L122-M126 HydrophobicContact CG-SD 4.3Å; L122-M126 WeakPolarHBondContact O-CG 3.29Å; L122-M126 PolarHBondContact O-N 3.37Å; L122-F142 HydrophobicContact CB-CZ 4.21Å; L122-F142 HydrophobicContact CD2-CE1 3.86Å; L122-F142 HydrophobicContact CD2-CZ 3.98Å; L122-F142 HydrophobicContact CG-CE1 4.3Å; L122-F142 HydrophobicContact CG-CZ 4.06Å; L122-F152 HydrophobicContact CD2-CB 4.14Å; L122-F152 HydrophobicContact CD2-CD1 3.62Å; L122-F152 HydrophobicContact CD2-CD2 3.91Å; L122-F152 HydrophobicContact CD2-CE1 3.87Å; L122-F152 HydrophobicContact CD2-CE2 4.14Å; L122-F152 HydrophobicContact CD2-CG 3.64Å; L122-F152 HydrophobicContact CD2-CZ 4.11Å
123	R	95.8	Very high	94	Very high	48 Å²	48	70.2 Å²	70.2	18%	0.181	37%	0.366	C	S	.	.	H	α-helix	trans	-59.2	-46	173.4	177.1	-179.8	-60.7	-87.9	2.4	112.4	E119 R121 L125 M126 T127 V138 D139 F142	E119-R123 WeakPolarHBondContact O-CB 3.36Å; E119-R123 PolarHBondContact O-N 2.91Å; E119-R123 IonicContact OE1-NH2 3.69Å; R121-R123 VanDerWaalsContact C-N 3.35Å; R121-R123 PolarHBondContact O-N 2.84Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 3.37Å; R123-M126 PolarHBondContact O-N 3.44Å; R123-T127 HydrophobicContact CG-CG2 4.39Å; R123-T127 WeakPolarHBondContact O-CB 3.42Å; R123-T127 WeakPolarHBondContact O-CG2 3.36Å; R123-T127 PolarHBondContact O-N 3.08Å; R123-T127 PolarHBondContact O-OG1 2.95Å; R123-V138 HydrophobicContact CB-CG1 4.19Å; R123-V138 HydrophobicContact CG-CG1 4.06Å; R123-D139 IonicContact CZ-OD1 3.12Å; R123-D139 IonicContact NH1-OD1 2.7Å; R123-D139 PolarHBondContact NH1-OD1 3.23Å; R123-D139 IonicContact NH2-OD1 2.7Å; R123-D139 PolarHBondContact NH2-OD1 2.81Å; R123-F142 HydrophobicContact CB-CE2 4.13Å; R123-F142 HydrophobicContact CB-CZ 4.41Å
124	E	95.5	Very high	94.1	Very high	95 Å²	95	70.6 Å²	70.6	44%	0.444	36%	0.36	S	S	.	.	H	α-helix	trans	-57.8	-45.7	176.1	-171.4	-165.6	168.4	0	0	110.6	K120 R121 L122 T127 T128	K120-E124 WeakPolarHBondContact O-CB 3.3Å; K120-E124 PolarHBondContact O-N 2.87Å; R121-E124 IonicContact CZ-OE2 3.84Å; R121-E124 IonicContact NH1-OE1 3.23Å; R121-E124 PolarHBondContact NH1-OE1 3.26Å; R121-E124 IonicContact NH1-OE2 2.77Å; R121-E124 PolarHBondContact NH1-OE2 2.81Å; R121-E124 WeakPolarHBondContact O-CB 3.23Å; R121-E124 PolarHBondContact O-N 3.42Å; L122-E124 PolarHBondContact O-N 3.28Å; E124-T127 PolarHBondContact O-N 3.41Å; E124-T127 PolarHBondContact O-OG1 3.01Å; E124-T128 HydrophobicContact CG-CG2 4.34Å; E124-T128 VanDerWaalsContact O-CB 3.31Å; E124-T128 WeakPolarHBondContact O-CB 3.4Å; E124-T128 VanDerWaalsContact O-CG2 3.29Å; E124-T128 WeakPolarHBondContact O-CG2 3.23Å; E124-T128 PolarHBondContact O-N 2.9Å; E124-T128 PolarHBondContact O-OG1 3.16Å
125	L	93.5	Very high	94	Very high	11 Å²	11	71 Å²	71	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-49.3	177.5	-68	169.2	0	0	0	111.6	F109 R121 L122 R123 T127 T128 M129	F109-L125 HydrophobicContact CB-CD1 4.34Å; F109-L125 HydrophobicContact CD1-CD1 3.41Å; F109-L125 VanDerWaalsContact CD1-CD1 3.41Å; F109-L125 HydrophobicContact CD1-CD2 4.23Å; F109-L125 HydrophobicContact CD1-CG 4.47Å; F109-L125 HydrophobicContact CD2-CD1 4.39Å; F109-L125 HydrophobicContact CE1-CD1 3.68Å; F109-L125 HydrophobicContact CE1-CD2 3.88Å; F109-L125 HydrophobicContact CE1-CG 4.38Å; F109-L125 HydrophobicContact CG-CD1 3.79Å; F109-L125 HydrophobicContact CZ-CD1 4.28Å; R121-L125 HydrophobicContact CG-CD1 4.32Å; R121-L125 VanDerWaalsContact O-CG 3.3Å; R121-L125 WeakPolarHBondContact O-CG 3.46Å; R121-L125 PolarHBondContact O-N 3.1Å; L122-L125 WeakPolarHBondContact O-CB 3.42Å; L122-L125 PolarHBondContact O-N 3.35Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 3.37Å; L125-T127 VanDerWaalsContact C-N 3.29Å; L125-T127 PolarHBondContact O-N 2.84Å; L125-T128 PolarHBondContact O-N 2.87Å; L125-M129 HydrophobicContact CD2-CE 3.67Å; L125-M129 HydrophobicContact CD2-CG 4.35Å; L125-M129 HydrophobicContact CD2-SD 3.53Å; L125-M129 VanDerWaalsContact CD2-SD 3.53Å; L125-M129 WeakPolarHBondContact O-CB 3.44Å; L125-M129 PolarHBondContact O-N 3.27Å
126	M	93.9	Very high	94	Very high	38 Å²	38	76.6 Å²	76.6	19%	0.187	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-27.7	-178.4	-70.9	177.6	173.1	0	0	114	L122 R123 W133 V138 L141 F142	L122-M126 HydrophobicContact CD1-CE 3.86Å; L122-M126 HydrophobicContact CD2-CE 4.15Å; L122-M126 HydrophobicContact CG-CE 3.86Å; L122-M126 HydrophobicContact CG-SD 4.3Å; L122-M126 WeakPolarHBondContact O-CG 3.29Å; L122-M126 PolarHBondContact O-N 3.37Å; R123-M126 PolarHBondContact O-N 3.44Å; M126-W133 PolarHBondContact O-N 3.21Å; M126-V138 HydrophobicContact CB-CG2 3.94Å; M126-V138 HydrophobicContact SD-CG1 4.29Å; M126-V138 HydrophobicContact SD-CG2 4.34Å; M126-L141 HydrophobicContact CE-CD2 3.45Å; M126-L141 VanDerWaalsContact CE-CD2 3.45Å; M126-L141 HydrophobicContact SD-CD2 3.71Å; M126-F142 HydrophobicContact SD-CE1 4.28Å
127	T	95.6	Very high	93.8	Very high	35 Å²	35	78.7 Å²	78.7	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-94	-17.2	-178.1	55.3	0	0	0	0	113.2	R123 E124 L125 R132 V138	R123-T127 HydrophobicContact CG-CG2 4.39Å; R123-T127 WeakPolarHBondContact O-CB 3.42Å; R123-T127 WeakPolarHBondContact O-CG2 3.36Å; R123-T127 PolarHBondContact O-N 3.08Å; R123-T127 PolarHBondContact O-OG1 2.95Å; E124-T127 PolarHBondContact O-N 3.41Å; E124-T127 PolarHBondContact O-OG1 3.01Å; L125-T127 VanDerWaalsContact C-N 3.29Å; L125-T127 PolarHBondContact O-N 2.84Å; T127-R132 WeakPolarHBondContact O-CD 3.39Å; T127-R132 WeakPolarHBondContact O-CG 3.24Å; T127-V138 HydrophobicContact CG2-CG2 4.03Å
128	T	93.7	Very high	93.8	Very high	63 Å²	63	78.4 Å²	78.4	39%	0.387	39%	0.389	S	S	.	.	H	α-helix	trans	-115.3	-32.4	-174.4	64.9	0	0	0	0	114.2	E124 L125 R132	E124-T128 HydrophobicContact CG-CG2 4.34Å; E124-T128 VanDerWaalsContact O-CB 3.31Å; E124-T128 WeakPolarHBondContact O-CB 3.4Å; E124-T128 VanDerWaalsContact O-CG2 3.29Å; E124-T128 WeakPolarHBondContact O-CG2 3.23Å; E124-T128 PolarHBondContact O-N 2.9Å; E124-T128 PolarHBondContact O-OG1 3.16Å; L125-T128 PolarHBondContact O-N 2.87Å; T128-R132 PolarHBondContact O-NE 2.93Å
129	M	89	Confident	93.7	Very high	104 Å²	104	78.7 Å²	78.7	51%	0.512	39%	0.391	S	S	.	.	S	Bend	trans	-104.5	147.2	-175	-58.5	-164.7	-179.2	0	0	112.2	L125	L125-M129 HydrophobicContact CD2-CE 3.67Å; L125-M129 HydrophobicContact CD2-CG 4.35Å; L125-M129 HydrophobicContact CD2-SD 3.53Å; L125-M129 VanDerWaalsContact CD2-SD 3.53Å; L125-M129 WeakPolarHBondContact O-CB 3.44Å; L125-M129 PolarHBondContact O-N 3.27Å
130	G	88.8	Confident	93.6	Very high	72 Å²	72	83 Å²	83	74%	0.742	41%	0.411	S	S	*	.	S	Bend	trans	60.3	-138.3	176.9	0	0	0	0	0	113.7	R132	G130-R132 PolarHBondContact O-N 2.95Å; G130-R132 VanDerWaalsContact O-N 3.14Å
131	D	87.6	Confident	93.5	Very high	153 Å²	153	77.4 Å²	77.4	82%	0.818	39%	0.388	S	S	*	.	S	Bend	trans	-73.5	99.5	171.6	-75.9	-16.9	0	0	0	109.5	W133	D131-W133 PolarHBondContact O-N 3.1Å
132	R	91.9	Very high	93.4	Very high	186 Å²	186	73.1 Å²	73.1	70%	0.702	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-69.8	119.5	-172.7	-61.5	178.8	-176.4	165.7	2.8	111.3	T127 T128 G130	T127-R132 WeakPolarHBondContact O-CD 3.39Å; T127-R132 WeakPolarHBondContact O-CG 3.24Å; T128-R132 PolarHBondContact O-NE 2.93Å; G130-R132 PolarHBondContact O-N 2.95Å; G130-R132 VanDerWaalsContact O-N 3.14Å
133	W	93.8	Very high	93.3	Very high	86 Å²	86	80.8 Å²	80.8	33%	0.326	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-81.5	152.6	172.9	-70	17.7	0	0	0	110.3	M126 D131 K137 V138 L141	M126-W133 PolarHBondContact O-N 3.21Å; D131-W133 PolarHBondContact O-N 3.1Å; W133-K137 HydrophobicContact CB-CB 4.38Å; W133-K137 HydrophobicContact CB-CD 4.16Å; W133-K137 HydrophobicContact CD2-CD 3.58Å; W133-K137 VanDerWaalsContact CD2-CE 3.49Å; W133-K137 HydrophobicContact CD2-CG 4.03Å; W133-K137 HydrophobicContact CE3-CB 4.38Å; W133-K137 HydrophobicContact CE3-CD 3.71Å; W133-K137 HydrophobicContact CE3-CG 3.62Å; W133-K137 HydrophobicContact CG-CD 3.76Å; W133-K137 HydrophobicContact CG-CG 4.41Å; W133-K137 HydrophobicContact CZ3-CD 4.31Å; W133-K137 HydrophobicContact CZ3-CG 4.13Å; W133-V138 HydrophobicContact CB-CG2 3.94Å; W133-V138 HydrophobicContact CE3-CG2 4.39Å; W133-L141 HydrophobicContact CH2-CD2 4.42Å; W133-L141 HydrophobicContact CZ3-CB 4.13Å; W133-L141 HydrophobicContact CZ3-CD1 4.29Å; W133-L141 HydrophobicContact CZ3-CD2 3.82Å; W133-L141 HydrophobicContact CZ3-CG 4.3Å
134	S	95.3	Very high	92.8	Very high	59 Å²	59	80.8 Å²	80.8	41%	0.413	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-74.4	159.6	169.1	81.2	0	0	0	0	109.7	E136 K137 V138	S134-E136 WeakPolarHBondContact CB-OE2 3.21Å; S134-E136 PolarHBondContact O-N 3.11Å; S134-E136 PolarHBondContact OG-OE2 2.88Å; S134-K137 PolarHBondContact O-N 3.09Å; S134-K137 PolarHBondContact OG-N 3.12Å; S134-V138 PolarHBondContact O-N 2.92Å; S134-V138 VanDerWaalsContact O-N 3.13Å
135	N	94.8	Very high	92.7	Very high	86 Å²	86	77 Å²	77	46%	0.46	41%	0.407	S	S	.	.	H	α-helix	trans	-60	-38	178.2	-75.2	-67.6	0	0	0	111.4	K137 V138 D139	N135-K137 VanDerWaalsContact C-N 3.32Å; N135-K137 PolarHBondContact O-N 2.96Å; N135-V138 PolarHBondContact O-N 3.49Å; N135-V138 VanDerWaalsContact O-N 3.15Å; N135-D139 VanDerWaalsContact O-CG 3.22Å; N135-D139 PolarHBondContact O-N 2.91Å
136	E	95.6	Very high	92.8	Very high	119 Å²	119	77.3 Å²	77.3	56%	0.556	41%	0.411	S	S	*	.	H	α-helix	trans	-61.1	-42.5	178.8	-55.9	74	-159.7	0	0	110.9	S134 V138 D139 E140	S134-E136 WeakPolarHBondContact CB-OE2 3.21Å; S134-E136 PolarHBondContact O-N 3.11Å; S134-E136 PolarHBondContact OG-OE2 2.88Å; E136-V138 VanDerWaalsContact C-N 3.34Å; E136-V138 PolarHBondContact O-N 3.11Å; E136-D139 WeakPolarHBondContact O-CB 3.19Å; E136-D139 PolarHBondContact O-N 2.8Å; E136-E140 WeakPolarHBondContact O-CG 3.36Å; E136-E140 PolarHBondContact O-N 2.93Å
137	K	93.1	Very high	92.8	Very high	89 Å²	89	77.8 Å²	77.8	39%	0.387	41%	0.413	S	S	.	.	H	α-helix	trans	-67.4	-34.3	177.3	-170.9	-179.7	175.2	-170.1	0	112.4	W133 S134 N135 L141	W133-K137 HydrophobicContact CB-CB 4.38Å; W133-K137 HydrophobicContact CB-CD 4.16Å; W133-K137 HydrophobicContact CD2-CD 3.58Å; W133-K137 VanDerWaalsContact CD2-CE 3.49Å; W133-K137 HydrophobicContact CD2-CG 4.03Å; W133-K137 HydrophobicContact CE3-CB 4.38Å; W133-K137 HydrophobicContact CE3-CD 3.71Å; W133-K137 HydrophobicContact CE3-CG 3.62Å; W133-K137 HydrophobicContact CG-CD 3.76Å; W133-K137 HydrophobicContact CG-CG 4.41Å; W133-K137 HydrophobicContact CZ3-CD 4.31Å; W133-K137 HydrophobicContact CZ3-CG 4.13Å; S134-K137 PolarHBondContact O-N 3.09Å; S134-K137 PolarHBondContact OG-N 3.12Å; N135-K137 VanDerWaalsContact C-N 3.32Å; N135-K137 PolarHBondContact O-N 2.96Å; K137-L141 PolarHBondContact O-N 3.35Å; K137-L141 VanDerWaalsContact O-N 3.1Å
138	V	95.1	Very high	92.8	Very high	0 Å²	0	83.1 Å²	83.1	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-70.7	-38.2	174.4	179.2	0	0	0	0	110.8	R123 M126 T127 W133 S134 N135 E136 E140 L141 F142	R123-V138 HydrophobicContact CB-CG1 4.19Å; R123-V138 HydrophobicContact CG-CG1 4.06Å; M126-V138 HydrophobicContact CB-CG2 3.94Å; M126-V138 HydrophobicContact SD-CG1 4.29Å; M126-V138 HydrophobicContact SD-CG2 4.34Å; T127-V138 HydrophobicContact CG2-CG2 4.03Å; W133-V138 HydrophobicContact CB-CG2 3.94Å; W133-V138 HydrophobicContact CE3-CG2 4.39Å; S134-V138 PolarHBondContact O-N 2.92Å; S134-V138 VanDerWaalsContact O-N 3.13Å; N135-V138 PolarHBondContact O-N 3.49Å; N135-V138 VanDerWaalsContact O-N 3.15Å; E136-V138 VanDerWaalsContact C-N 3.34Å; E136-V138 PolarHBondContact O-N 3.11Å; V138-E140 VanDerWaalsContact C-N 3.33Å; V138-E140 PolarHBondContact O-N 3.49Å; V138-L141 WeakPolarHBondContact O-CB 3.44Å; V138-L141 PolarHBondContact O-N 3.44Å; V138-F142 HydrophobicContact CG1-CD1 4.35Å; V138-F142 HydrophobicContact CG1-CD2 4.04Å; V138-F142 HydrophobicContact CG1-CE1 4.04Å; V138-F142 HydrophobicContact CG1-CE2 3.68Å; V138-F142 HydrophobicContact CG1-CG 4.36Å; V138-F142 HydrophobicContact CG1-CZ 3.69Å; V138-F142 WeakPolarHBondContact O-CG 3.3Å; V138-F142 PolarHBondContact O-N 3.5Å
139	D	94.8	Very high	92.8	Very high	79 Å²	79	87.1 Å²	87.1	42%	0.422	46%	0.455	S	S	.	.	H	α-helix	trans	-62.1	-41.8	174.1	-66.4	-24	0	0	0	111.3	R123 N135 E136 L141 F142 H143	R123-D139 IonicContact CZ-OD1 3.12Å; R123-D139 IonicContact NH1-OD1 2.7Å; R123-D139 PolarHBondContact NH1-OD1 3.23Å; R123-D139 IonicContact NH2-OD1 2.7Å; R123-D139 PolarHBondContact NH2-OD1 2.81Å; N135-D139 VanDerWaalsContact O-CG 3.22Å; N135-D139 PolarHBondContact O-N 2.91Å; E136-D139 WeakPolarHBondContact O-CB 3.19Å; E136-D139 PolarHBondContact O-N 2.8Å; D139-L141 VanDerWaalsContact C-N 3.34Å; D139-L141 PolarHBondContact O-N 3.21Å; D139-F142 PolarHBondContact O-N 3.48Å; D139-H143 WeakPolarHBondContact O-CB 3.34Å; D139-H143 PolarHBondContact O-N 3.1Å
140	E	93.6	Very high	93.1	Very high	144 Å²	144	83.4 Å²	83.4	67%	0.673	44%	0.443	S	S	*	.	H	α-helix	trans	-60.5	-41.1	172.9	-74.2	174.3	-170	0	0	112.3	E136 V138 H143	E136-E140 WeakPolarHBondContact O-CG 3.36Å; E136-E140 PolarHBondContact O-N 2.93Å; V138-E140 VanDerWaalsContact C-N 3.33Å; V138-E140 PolarHBondContact O-N 3.49Å; E140-H143 PolarHBondContact O-N 2.93Å
141	L	91.7	Very high	93.4	Very high	46 Å²	46	83.1 Å²	83.1	24%	0.241	43%	0.425	C	S	.	.	H	α-helix	trans	-66	-42.4	177	-176.1	71.8	0	0	0	112	M126 W133 K137 V138 D139 H143 F157	M126-L141 HydrophobicContact CE-CD2 3.45Å; M126-L141 VanDerWaalsContact CE-CD2 3.45Å; M126-L141 HydrophobicContact SD-CD2 3.71Å; W133-L141 HydrophobicContact CH2-CD2 4.42Å; W133-L141 HydrophobicContact CZ3-CB 4.13Å; W133-L141 HydrophobicContact CZ3-CD1 4.29Å; W133-L141 HydrophobicContact CZ3-CD2 3.82Å; W133-L141 HydrophobicContact CZ3-CG 4.3Å; K137-L141 PolarHBondContact O-N 3.35Å; K137-L141 VanDerWaalsContact O-N 3.1Å; V138-L141 WeakPolarHBondContact O-CB 3.44Å; V138-L141 PolarHBondContact O-N 3.44Å; D139-L141 VanDerWaalsContact C-N 3.34Å; D139-L141 PolarHBondContact O-N 3.21Å; L141-H143 VanDerWaalsContact C-N 3.26Å; L141-H143 PolarHBondContact O-N 2.86Å; L141-F157 HydrophobicContact CD1-CE2 4.37Å; L141-F157 HydrophobicContact CD1-CZ 3.79Å; L141-F157 HydrophobicContact CG-CZ 4.4Å
142	F	94	Very high	93.9	Very high	17 Å²	17	75.9 Å²	75.9	8%	0.075	39%	0.386	C	S	.	.	H	α-helix	trans	-75.6	-19.3	-178.7	-70.8	-0	0	0	0	112.1	E119 L122 R123 M126 V138 D139 G144 A145 I147 F152	E119-F142 HydrophobicContact CG-CD2 3.56Å; E119-F142 HydrophobicContact CG-CE2 3.25Å; E119-F142 HydrophobicContact CG-CZ 4.08Å; E119-F142 WeakPolarHBondContact OE1-CD2 3.42Å; L122-F142 HydrophobicContact CB-CZ 4.21Å; L122-F142 HydrophobicContact CD2-CE1 3.86Å; L122-F142 HydrophobicContact CD2-CZ 3.98Å; L122-F142 HydrophobicContact CG-CE1 4.3Å; L122-F142 HydrophobicContact CG-CZ 4.06Å; R123-F142 HydrophobicContact CB-CE2 4.13Å; R123-F142 HydrophobicContact CB-CZ 4.41Å; M126-F142 HydrophobicContact SD-CE1 4.28Å; V138-F142 HydrophobicContact CG1-CD1 4.35Å; V138-F142 HydrophobicContact CG1-CD2 4.04Å; V138-F142 HydrophobicContact CG1-CE1 4.04Å; V138-F142 HydrophobicContact CG1-CE2 3.68Å; V138-F142 HydrophobicContact CG1-CG 4.36Å; V138-F142 HydrophobicContact CG1-CZ 3.69Å; V138-F142 WeakPolarHBondContact O-CG 3.3Å; V138-F142 PolarHBondContact O-N 3.5Å; D139-F142 PolarHBondContact O-N 3.48Å; F142-G144 PolarHBondContact O-N 3.26Å; F142-A145 PolarHBondContact O-N 2.89Å; F142-A145 VanDerWaalsContact O-N 3.08Å; F142-I147 HydrophobicContact CB-CD1 3.73Å; F142-I147 HydrophobicContact CD1-CD1 4.1Å; F142-I147 HydrophobicContact CD2-CD1 3.97Å; F142-I147 HydrophobicContact CG-CD1 3.68Å; F142-F152 HydrophobicContact CE1-CD2 4.44Å; F142-F152 HydrophobicContact CE1-CE2 4.46Å
143	H	91.3	Very high	94.1	Very high	167 Å²	167	69.4 Å²	69.4	77%	0.773	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	97.1	173.4	-174.4	-86.3	0	0	0	110.8	D139 E140 L141	D139-H143 WeakPolarHBondContact O-CB 3.34Å; D139-H143 PolarHBondContact O-N 3.1Å; E140-H143 PolarHBondContact O-N 2.93Å; L141-H143 VanDerWaalsContact C-N 3.26Å; L141-H143 PolarHBondContact O-N 2.86Å
144	G	87	Confident	94.2	Very high	48 Å²	48	65.8 Å²	65.8	50%	0.495	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.5	2.1	-176.8	0	0	0	0	0	114.2	F142 M160	F142-G144 PolarHBondContact O-N 3.26Å; G144-M160 VanDerWaalsContact O-CE 3.23Å; G144-M160 WeakPolarHBondContact O-CE 3.09Å
145	A	92.7	Very high	94.2	Very high	14 Å²	14	67.6 Å²	67.6	12%	0.116	35%	0.352	C	S	.	.	S	Bend	trans	-73.1	152	169.7	0	0	0	0	0	111.1	F142 I147 F152 F157	F142-A145 PolarHBondContact O-N 2.89Å; F142-A145 VanDerWaalsContact O-N 3.08Å; A145-I147 VanDerWaalsContact C-N 3.26Å; A145-I147 HydrophobicContact CB-CD1 4.07Å; A145-I147 HydrophobicContact CB-CG1 4.1Å; A145-I147 PolarHBondContact O-N 3.25Å; A145-F152 HydrophobicContact CB-CD2 4.07Å; A145-F152 HydrophobicContact CB-CE2 3.69Å; A145-F157 HydrophobicContact CB-CD2 4.01Å; A145-F157 HydrophobicContact CB-CE2 4.2Å
146	P	94.8	Very high	94.2	Very high	19 Å²	19	68 Å²	68	12%	0.123	35%	0.351	C	S	.	.			trans	-75.7	80.1	178.1	32.5	-34.6	0	0	0	110.2	D153 E156 F157 M160	P146-D153 HydrophobicContact CB-CB 4.27Å; P146-D153 HydrophobicContact CG-CB 4.22Å; P146-D153 VanDerWaalsContact CG-O 3.23Å; P146-D153 WeakPolarHBondContact CG-O 3.38Å; P146-D153 PolarHBondContact O-N 3.15Å; P146-E156 HydrophobicContact CB-CB 3.99Å; P146-E156 HydrophobicContact CB-CG 3.83Å; P146-E156 VanDerWaalsContact CB-OE2 3.25Å; P146-E156 WeakPolarHBondContact CB-OE2 3.45Å; P146-E156 HydrophobicContact CG-CB 3.8Å; P146-E156 HydrophobicContact CG-CG 3.94Å; P146-F157 HydrophobicContact CG-CB 3.86Å; P146-M160 HydrophobicContact CB-SD 4.46Å; P146-M160 HydrophobicContact CG-SD 4.1Å
147	I	95.3	Very high	94.1	Very high	48 Å²	48	63.6 Å²	63.6	25%	0.246	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.5	178.4	-60	169.2	0	0	0	108.8	E119 F142 A145 N151 F152	E119-I147 HydrophobicContact CB-CG2 4.36Å; E119-I147 HydrophobicContact CG-CD1 4.07Å; F142-I147 HydrophobicContact CB-CD1 3.73Å; F142-I147 HydrophobicContact CD1-CD1 4.1Å; F142-I147 HydrophobicContact CD2-CD1 3.97Å; F142-I147 HydrophobicContact CG-CD1 3.68Å; A145-I147 VanDerWaalsContact C-N 3.26Å; A145-I147 HydrophobicContact CB-CD1 4.07Å; A145-I147 HydrophobicContact CB-CG1 4.1Å; A145-I147 PolarHBondContact O-N 3.25Å; I147-N151 VanDerWaalsContact CA-O 3.3Å; I147-N151 WeakPolarHBondContact CA-O 3.48Å; I147-F152 HydrophobicContact CD1-CD2 4.04Å; I147-F152 HydrophobicContact CG1-CB 4.12Å; I147-F152 HydrophobicContact CG1-CD2 3.71Å; I147-F152 HydrophobicContact CG1-CG 4.38Å
148	Q	94.3	Very high	94	Very high	146 Å²	146	59.3 Å²	59.3	68%	0.682	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.9	175.3	-172.7	175	-5.9	0	0	110	G150 N151	Q148-G150 PolarHBondContact O-N 3.01Å; Q148-G150 VanDerWaalsContact O-N 3.11Å; Q148-N151 PolarHBondContact N-O 3.49Å; Q148-N151 WeakPolarHBondContact O-CB 3.43Å; Q148-N151 PolarHBondContact O-N 3.48Å
149	D	94.2	Very high	93.6	Very high	148 Å²	148	66 Å²	66	79%	0.791	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	33.8	-179.9	-61.1	-46	0	0	0	114.1	N151	D149-N151 VanDerWaalsContact C-N 3.29Å; D149-N151 PolarHBondContact O-N 3.23Å
150	G	94.6	Very high	93.3	Very high	26 Å²	26	64 Å²	64	27%	0.268	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	14.2	-178.7	0	0	0	0	0	114.4	N118 E119 Q148	N118-G150 PolarHBondContact ND2-O 2.86Å; E119-G150 WeakPolarHBondContact CB-O 3.42Å; E119-G150 PolarHBondContact N-O 2.62Å; Q148-G150 PolarHBondContact O-N 3.01Å; Q148-G150 VanDerWaalsContact O-N 3.11Å
151	N	96.8	Very high	92.9	Very high	66 Å²	66	60.9 Å²	60.9	35%	0.353	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.1	173.6	-62.3	-46.8	0	0	0	109.5	V116 I147 Q148 D149	V116-N151 HydrophobicContact CB-CB 4.08Å; V116-N151 HydrophobicContact CG1-CB 4.44Å; V116-N151 HydrophobicContact CG2-CB 4.22Å; I147-N151 VanDerWaalsContact CA-O 3.3Å; I147-N151 WeakPolarHBondContact CA-O 3.48Å; Q148-N151 PolarHBondContact N-O 3.49Å; Q148-N151 WeakPolarHBondContact O-CB 3.43Å; Q148-N151 PolarHBondContact O-N 3.48Å; D149-N151 VanDerWaalsContact C-N 3.29Å; D149-N151 PolarHBondContact O-N 3.23Å
152	F	97.1	Very high	92.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.2	177.1	175.7	-88.9	0	0	0	109.6	F106 V116 I117 L122 F142 A145 I147 Y154 F157	F106-F152 AromaticContact CE1-CE1 3.9Å; F106-F152 HydrophobicContact CE1-CE1 3.9Å; F106-F152 HydrophobicContact CZ-CE1 4.04Å; F106-F152 HydrophobicContact CZ-CZ 4.37Å; V116-F152 CarbonylContact C-O 3.54Å; V116-F152 WeakPolarHBondContact CA-O 3.48Å; I117-F152 PolarHBondContact N-O 3.46Å; I117-F152 WeakPolarHBondContact O-CB 3.42Å; I117-F152 PolarHBondContact O-N 2.96Å; L122-F152 HydrophobicContact CD2-CB 4.14Å; L122-F152 HydrophobicContact CD2-CD1 3.62Å; L122-F152 HydrophobicContact CD2-CD2 3.91Å; L122-F152 HydrophobicContact CD2-CE1 3.87Å; L122-F152 HydrophobicContact CD2-CE2 4.14Å; L122-F152 HydrophobicContact CD2-CG 3.64Å; L122-F152 HydrophobicContact CD2-CZ 4.11Å; F142-F152 HydrophobicContact CE1-CD2 4.44Å; F142-F152 HydrophobicContact CE1-CE2 4.46Å; A145-F152 HydrophobicContact CB-CD2 4.07Å; A145-F152 HydrophobicContact CB-CE2 3.69Å; I147-F152 HydrophobicContact CD1-CD2 4.04Å; I147-F152 HydrophobicContact CG1-CB 4.12Å; I147-F152 HydrophobicContact CG1-CD2 3.71Å; I147-F152 HydrophobicContact CG1-CG 4.38Å; F152-Y154 PolarHBondContact O-N 3.19Å; F152-F157 HydrophobicContact CE1-CB 4.01Å; F152-F157 HydrophobicContact CE1-CD1 4.27Å; F152-F157 HydrophobicContact CE1-CG 4.13Å; F152-F157 HydrophobicContact CE2-CB 4.3Å; F152-F157 AromaticContact CE2-CD2 3.88Å; F152-F157 HydrophobicContact CE2-CD2 3.88Å; F152-F157 HydrophobicContact CE2-CE2 4.33Å; F152-F157 AromaticContact CE2-CG 3.98Å; F152-F157 HydrophobicContact CE2-CG 3.98Å; F152-F157 HydrophobicContact CZ-CB 3.62Å; F152-F157 AromaticContact CZ-CD1 3.57Å; F152-F157 HydrophobicContact CZ-CD1 3.57Å; F152-F157 AromaticContact CZ-CD2 3.7Å; F152-F157 HydrophobicContact CZ-CD2 3.7Å; F152-F157 HydrophobicContact CZ-CE1 4.13Å; F152-F157 HydrophobicContact CZ-CE2 4.24Å; F152-F157 AromaticContact CZ-CG 3.33Å; F152-F157 HydrophobicContact CZ-CG 3.33Å; F152-F157 HydrophobicContact CZ-CZ 4.44Å
153	D	96.9	Very high	91.6	Very high	51 Å²	51	66.6 Å²	66.6	27%	0.273	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	99.1	174	-170	-37.3	0	0	0	110	V116 P146 K155 E156 F157	V116-D153 HydrophobicContact CG1-CB 4.3Å; P146-D153 HydrophobicContact CB-CB 4.27Å; P146-D153 HydrophobicContact CG-CB 4.22Å; P146-D153 VanDerWaalsContact CG-O 3.23Å; P146-D153 WeakPolarHBondContact CG-O 3.38Å; P146-D153 PolarHBondContact O-N 3.15Å; D153-K155 VanDerWaalsContact C-N 3.25Å; D153-K155 PolarHBondContact O-N 3.41Å; D153-K155 WeakPolarHBondContact OD1-CA 3.4Å; D153-K155 WeakPolarHBondContact OD1-CB 3.39Å; D153-K155 PolarHBondContact OD1-N 3.13Å; D153-E156 HydrophobicContact CB-CB 4.12Å; D153-E156 PolarHBondContact OD1-N 2.94Å; D153-F157 VanDerWaalsContact O-CB 3.29Å; D153-F157 WeakPolarHBondContact O-CB 3.38Å; D153-F157 PolarHBondContact O-N 3.35Å
154	Y	95.9	Very high	90.5	Very high	9 Å²	9	60.4 Å²	60.4	4%	0.035	32%	0.32	C	S	.	.	H	α-helix	trans	-74.2	-18	-178.2	63.3	-98.1	0	0	0	112.9	L103 F106 D110 G115 I117 F152 T158	L103-Y154 HydrophobicContact CD2-CD2 4.03Å; L103-Y154 HydrophobicContact CD2-CE2 4.31Å; F106-Y154 HydrophobicContact CB-CD1 4.03Å; F106-Y154 HydrophobicContact CB-CD2 3.46Å; F106-Y154 VanDerWaalsContact CB-CD2 3.46Å; F106-Y154 HydrophobicContact CB-CE1 4.48Å; F106-Y154 HydrophobicContact CB-CE2 4.01Å; F106-Y154 HydrophobicContact CB-CG 3.48Å; F106-Y154 VanDerWaalsContact CB-CG 3.48Å; F106-Y154 HydrophobicContact CD1-CG 4.46Å; F106-Y154 HydrophobicContact CD2-CD2 4.3Å; F106-Y154 HydrophobicContact CD2-CG 4.29Å; F106-Y154 HydrophobicContact CG-CD2 4.11Å; F106-Y154 AromaticContact CG-CG 3.87Å; F106-Y154 HydrophobicContact CG-CG 3.87Å; D110-Y154 HydrophobicContact CB-CE1 4.03Å; D110-Y154 WeakPolarHBondContact OD2-CE1 3.41Å; D110-Y154 PolarHBondContact OD2-OH 3.48Å; G115-Y154 WeakPolarHBondContact CA-OH 3.3Å; G115-Y154 WeakPolarHBondContact O-CD1 3.47Å; G115-Y154 VanDerWaalsContact O-CE1 3.24Å; G115-Y154 WeakPolarHBondContact O-CE1 3.46Å; G115-Y154 PolarHBondContact O-N 3.42Å; I117-Y154 HydrophobicContact CD1-CD1 3.92Å; I117-Y154 HydrophobicContact CD1-CE1 4.43Å; I117-Y154 HydrophobicContact CG1-CD1 3.93Å; I117-Y154 HydrophobicContact CG1-CE1 4.22Å; F152-Y154 PolarHBondContact O-N 3.19Å; Y154-T158 WeakPolarHBondContact O-CB 3.49Å; Y154-T158 PolarHBondContact O-N 3.3Å; Y154-T158 PolarHBondContact O-OG1 3.35Å
155	K	94.4	Very high	89.2	Confident	98 Å²	98	64.8 Å²	64.8	43%	0.426	33%	0.328	S	S	.	.	H	α-helix	trans	-75.3	-47.2	177.2	-64.2	174.4	178.6	166.6	0	110	L103 D153 T158 R159	L103-K155 HydrophobicContact CD2-CB 4.33Å; L103-K155 HydrophobicContact CD2-CG 4.01Å; D153-K155 VanDerWaalsContact C-N 3.25Å; D153-K155 PolarHBondContact O-N 3.41Å; D153-K155 WeakPolarHBondContact OD1-CA 3.4Å; D153-K155 WeakPolarHBondContact OD1-CB 3.39Å; D153-K155 PolarHBondContact OD1-N 3.13Å; K155-T158 PolarHBondContact O-N 2.93Å; K155-R159 PolarHBondContact O-N 3.34Å
156	E	94.3	Very high	87.3	Confident	95 Å²	95	71.7 Å²	71.7	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-63.4	-44.4	173	-174.1	178.8	174.8	0	0	110.7	P146 D153 T158 R159 M160	P146-E156 HydrophobicContact CB-CB 3.99Å; P146-E156 HydrophobicContact CB-CG 3.83Å; P146-E156 VanDerWaalsContact CB-OE2 3.25Å; P146-E156 WeakPolarHBondContact CB-OE2 3.45Å; P146-E156 HydrophobicContact CG-CB 3.8Å; P146-E156 HydrophobicContact CG-CG 3.94Å; D153-E156 HydrophobicContact CB-CB 4.12Å; D153-E156 PolarHBondContact OD1-N 2.94Å; E156-T158 VanDerWaalsContact C-N 3.31Å; E156-T158 PolarHBondContact O-N 3.3Å; E156-R159 WeakPolarHBondContact O-CB 3.46Å; E156-R159 PolarHBondContact O-N 3.14Å; E156-R159 VanDerWaalsContact O-N 3.14Å; E156-M160 HydrophobicContact CG-CG 4.42Å; E156-M160 HydrophobicContact CG-SD 4.14Å; E156-M160 VanDerWaalsContact O-CG 3.3Å; E156-M160 WeakPolarHBondContact O-CG 3.4Å; E156-M160 PolarHBondContact O-N 3.26Å
157	F	94	Very high	85.1	Confident	25 Å²	25	78.9 Å²	78.9	11%	0.11	39%	0.389	C	S	.	.	H	α-helix	trans	-59.2	-44.2	177.4	-176.6	-99.6	0	0	0	111.7	F106 L141 A145 P146 F152 D153 R159 M160 I161	F106-F157 HydrophobicContact CE2-CD1 4.38Å; F106-F157 HydrophobicContact CZ-CD1 4.28Å; L141-F157 HydrophobicContact CD1-CE2 4.37Å; L141-F157 HydrophobicContact CD1-CZ 3.79Å; L141-F157 HydrophobicContact CG-CZ 4.4Å; A145-F157 HydrophobicContact CB-CD2 4.01Å; A145-F157 HydrophobicContact CB-CE2 4.2Å; P146-F157 HydrophobicContact CG-CB 3.86Å; F152-F157 HydrophobicContact CE1-CB 4.01Å; F152-F157 HydrophobicContact CE1-CD1 4.27Å; F152-F157 HydrophobicContact CE1-CG 4.13Å; F152-F157 HydrophobicContact CE2-CB 4.3Å; F152-F157 AromaticContact CE2-CD2 3.88Å; F152-F157 HydrophobicContact CE2-CD2 3.88Å; F152-F157 HydrophobicContact CE2-CE2 4.33Å; F152-F157 AromaticContact CE2-CG 3.98Å; F152-F157 HydrophobicContact CE2-CG 3.98Å; F152-F157 HydrophobicContact CZ-CB 3.62Å; F152-F157 AromaticContact CZ-CD1 3.57Å; F152-F157 HydrophobicContact CZ-CD1 3.57Å; F152-F157 AromaticContact CZ-CD2 3.7Å; F152-F157 HydrophobicContact CZ-CD2 3.7Å; F152-F157 HydrophobicContact CZ-CE1 4.13Å; F152-F157 HydrophobicContact CZ-CE2 4.24Å; F152-F157 AromaticContact CZ-CG 3.33Å; F152-F157 HydrophobicContact CZ-CG 3.33Å; F152-F157 HydrophobicContact CZ-CZ 4.44Å; D153-F157 VanDerWaalsContact O-CB 3.29Å; D153-F157 WeakPolarHBondContact O-CB 3.38Å; D153-F157 PolarHBondContact O-N 3.35Å; F157-R159 VanDerWaalsContact C-N 3.33Å; F157-R159 PolarHBondContact O-N 3.39Å; F157-M160 PolarHBondContact O-N 3.41Å; F157-I161 HydrophobicContact CD1-CD1 4.35Å; F157-I161 HydrophobicContact CD1-CG2 4.28Å; F157-I161 HydrophobicContact CE1-CD1 4.12Å; F157-I161 HydrophobicContact CE1-CG2 3.82Å; F157-I161 HydrophobicContact CE2-CG2 4.19Å; F157-I161 HydrophobicContact CZ-CG2 3.75Å; F157-I161 WeakPolarHBondContact O-CG1 3.29Å; F157-I161 PolarHBondContact O-N 2.98Å
158	T	91.4	Very high	82.5	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-61.7	-41.7	177.5	-60.5	0	0	0	0	111.4	E99 I102 L103 Y154 K155 E156 I161 M162	E99-T158 HydrophobicContact CG-CG2 4.17Å; I102-T158 HydrophobicContact CB-CG2 3.92Å; I102-T158 HydrophobicContact CD1-CG2 4.43Å; I102-T158 HydrophobicContact CG2-CG2 3.8Å; I102-T158 WeakPolarHBondContact CG2-OG1 3.41Å; L103-T158 HydrophobicContact CD2-CG2 4.04Å; L103-T158 HydrophobicContact CG-CG2 4.06Å; Y154-T158 WeakPolarHBondContact O-CB 3.49Å; Y154-T158 PolarHBondContact O-N 3.3Å; Y154-T158 PolarHBondContact O-OG1 3.35Å; K155-T158 PolarHBondContact O-N 2.93Å; E156-T158 VanDerWaalsContact C-N 3.31Å; E156-T158 PolarHBondContact O-N 3.3Å; T158-I161 WeakPolarHBondContact O-CG1 3.3Å; T158-I161 PolarHBondContact O-N 3.15Å; T158-M162 HydrophobicContact CG2-CE 3.67Å; T158-M162 HydrophobicContact CG2-SD 4.3Å; T158-M162 WeakPolarHBondContact O-CE 3.48Å; T158-M162 WeakPolarHBondContact O-CG 3.45Å; T158-M162 PolarHBondContact O-N 3.24Å
159	R	87.8	Confident	79.8	Confident	139 Å²	139	86.9 Å²	86.9	53%	0.525	43%	0.426	S	S	.	.	H	α-helix	trans	-60.6	-47.4	173.8	-171.9	-165.4	-52.7	-115.4	-3.8	111.8	K155 E156 F157 I161 M162 H163	K155-R159 PolarHBondContact O-N 3.34Å; E156-R159 WeakPolarHBondContact O-CB 3.46Å; E156-R159 PolarHBondContact O-N 3.14Å; E156-R159 VanDerWaalsContact O-N 3.14Å; F157-R159 VanDerWaalsContact C-N 3.33Å; F157-R159 PolarHBondContact O-N 3.39Å; R159-I161 VanDerWaalsContact C-N 3.35Å; R159-I161 PolarHBondContact O-N 2.7Å; R159-M162 PolarHBondContact O-N 2.7Å; R159-H163 PolarHBondContact O-N 2.97Å
160	M	88.1	Confident	76.9	Confident	38 Å²	38	82.9 Å²	82.9	19%	0.187	42%	0.419	C	S	.	.	H	α-helix	trans	-60.5	-41.1	-179.4	-70.6	169.6	71.2	0	0	112.4	G144 P146 E156 F157 G164 Q165	G144-M160 VanDerWaalsContact O-CE 3.23Å; G144-M160 WeakPolarHBondContact O-CE 3.09Å; P146-M160 HydrophobicContact CB-SD 4.46Å; P146-M160 HydrophobicContact CG-SD 4.1Å; E156-M160 HydrophobicContact CG-CG 4.42Å; E156-M160 HydrophobicContact CG-SD 4.14Å; E156-M160 VanDerWaalsContact O-CG 3.3Å; E156-M160 WeakPolarHBondContact O-CG 3.4Å; E156-M160 PolarHBondContact O-N 3.26Å; F157-M160 PolarHBondContact O-N 3.41Å; M160-G164 CarbonylContact O-C 3.31Å; M160-G164 VanDerWaalsContact O-C 3.31Å; M160-G164 WeakPolarHBondContact O-CA 3.43Å; M160-G164 PolarHBondContact O-N 3.32Å; M160-Q165 HydrophobicContact CE-CG 3.7Å; M160-Q165 VanDerWaalsContact CE-NE2 3.34Å
161	I	84.3	Confident	74.1	Confident	79 Å²	79	89.6 Å²	89.6	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-74.2	-26.1	-179.3	63	177.6	0	0	0	113.1	I102 F157 T158 R159	I102-I161 HydrophobicContact CD1-CD1 4.06Å; I102-I161 HydrophobicContact CG2-CD1 4.37Å; F157-I161 HydrophobicContact CD1-CD1 4.35Å; F157-I161 HydrophobicContact CD1-CG2 4.28Å; F157-I161 HydrophobicContact CE1-CD1 4.12Å; F157-I161 HydrophobicContact CE1-CG2 3.82Å; F157-I161 HydrophobicContact CE2-CG2 4.19Å; F157-I161 HydrophobicContact CZ-CG2 3.75Å; F157-I161 WeakPolarHBondContact O-CG1 3.29Å; F157-I161 PolarHBondContact O-N 2.98Å; T158-I161 WeakPolarHBondContact O-CG1 3.3Å; T158-I161 PolarHBondContact O-N 3.15Å; R159-I161 VanDerWaalsContact C-N 3.35Å; R159-I161 PolarHBondContact O-N 2.7Å
162	M	79.2	Confident	71.1	Confident	53 Å²	53	92.3 Å²	92.3	26%	0.261	46%	0.463	S	S	.	.	H	α-helix	trans	-93	-36.2	-178.8	-66.6	-169.3	-57.9	0	0	114.1	E99 I102 T158 R159	E99-M162 WeakPolarHBondContact CA-SD 3.31Å; E99-M162 HydrophobicContact CB-CE 3.19Å; E99-M162 HydrophobicContact CB-SD 3.49Å; E99-M162 WeakPolarHBondContact CB-SD 3.33Å; E99-M162 HydrophobicContact CG-CE 3.3Å; E99-M162 HydrophobicContact CG-SD 4.25Å; E99-M162 PolarHBondContact N-SD 2.78Å; E99-M162 WeakPolarHBondContact OE2-CE 3.45Å; I102-M162 HydrophobicContact CD1-SD 4.39Å; T158-M162 HydrophobicContact CG2-CE 3.67Å; T158-M162 HydrophobicContact CG2-SD 4.3Å; T158-M162 WeakPolarHBondContact O-CE 3.48Å; T158-M162 WeakPolarHBondContact O-CG 3.45Å; T158-M162 PolarHBondContact O-N 3.24Å; R159-M162 PolarHBondContact O-N 2.7Å
163	H	79	Confident	68.4	Low	130 Å²	130	98.7 Å²	98.7	60%	0.602	50%	0.497	S	S	*	.	H	α-helix	trans	-106.7	-9.5	-176.2	-58.5	-57.5	0	0	0	113.1	R159	R159-H163 PolarHBondContact O-N 2.97Å
164	G	68.7	Low	65.4	Low	37 Å²	37	105 Å²	105	38%	0.381	53%	0.525	S	S	.	.			trans	87	171.2	-169.9	0	0	0	0	0	111.9	M160 E166	M160-G164 CarbonylContact O-C 3.31Å; M160-G164 VanDerWaalsContact O-C 3.31Å; M160-G164 WeakPolarHBondContact O-CA 3.43Å; M160-G164 PolarHBondContact O-N 3.32Å; G164-E166 PolarHBondContact O-N 2.77Å
165	Q	59.3	Low	63	Low	139 Å²	139	114.7 Å²	114.7	65%	0.65	59%	0.586	S	S	*	*			trans	-73.2	115.7	168.4	-73	175.5	-21.3	0	0	107.7	M160 E167	M160-Q165 HydrophobicContact CE-CG 3.7Å; M160-Q165 VanDerWaalsContact CE-NE2 3.34Å; Q165-E167 PolarHBondContact O-N 3.23Å
166	E	53.1	Low	61.4	Low	160 Å²	160	115.6 Å²	115.6	75%	0.748	59%	0.594	S	S	*	*			trans	-63.2	104.4	160.3	-70.3	176.4	-172.3	0	0	105.8	G164 E168	G164-E166 PolarHBondContact O-N 2.77Å; E166-E168 VanDerWaalsContact C-N 3.35Å; E166-E168 PolarHBondContact O-N 3.44Å
167	E	47.9	Very low	59.7	Low	169 Å²	169	116.6 Å²	116.6	79%	0.79	60%	0.601	S	S	*	*			trans	-59.6	106	164	-71	179.6	176.6	0	0	105.4	Q165 E169	Q165-E167 PolarHBondContact O-N 3.23Å; E167-E169 PolarHBondContact O-N 2.63Å
168	E	41.5	Very low	57.8	Low	188 Å²	188	121.7 Å²	121.7	88%	0.879	63%	0.629	S	S	*	*			trans	-58.2	95	166.9	-78.2	-170.5	157.5	0	0	107	E166 G170	E166-E168 VanDerWaalsContact C-N 3.35Å; E166-E168 PolarHBondContact O-N 3.44Å; E168-G170 VanDerWaalsContact C-N 3.31Å; E168-G170 PolarHBondContact O-N 3.03Å
169	E	38.1	Very low	55.8	Low	174 Å²	174	128.9 Å²	128.9	81%	0.813	67%	0.666	S	S	*	*			trans	-58.2	101.6	165.3	-76.9	-171.5	168.8	0	0	106.7	E167 Q171	E167-E169 PolarHBondContact O-N 2.63Å; E169-Q171 VanDerWaalsContact C-N 3.34Å; E169-Q171 PolarHBondContact O-N 3.25Å
170	G	33.2	Very low	53.8	Low	64 Å²	64	128.3 Å²	128.3	66%	0.66	68%	0.675	S	S	*	*			trans	-55.8	97.2	174	0	0	0	0	0	110	E168 T172	E168-G170 VanDerWaalsContact C-N 3.31Å; E168-G170 PolarHBondContact O-N 3.03Å; G170-T172 PolarHBondContact O-N 3.39Å
171	Q	34.5	Very low	51.5	Low	167 Å²	167	134.3 Å²	134.3	78%	0.78	71%	0.707	S	S	*	*			trans	-68.1	78.5	159.9	-74.5	-174.8	10	0	0	108.1	E169 N173	E169-Q171 VanDerWaalsContact C-N 3.34Å; E169-Q171 PolarHBondContact O-N 3.25Å; Q171-N173 PolarHBondContact O-N 2.77Å
172	T	35	Very low	49.2	Very low	124 Å²	124	138.2 Å²	138.2	76%	0.761	73%	0.729	S	S	*	*			trans	-71.4	74.4	154.8	40.1	0	0	0	0	107.9	G170 Q174	G170-T172 PolarHBondContact O-N 3.39Å; T172-Q174 VanDerWaalsContact C-N 3.32Å; T172-Q174 PolarHBondContact O-N 3.02Å; T172-Q174 VanDerWaalsContact O-N 3.09Å
173	N	39.6	Very low	46.9	Very low	134 Å²	134	144.8 Å²	144.8	72%	0.717	77%	0.765	S	S	*	*			trans	-76	93.7	160.8	-82.8	-26.8	0	0	0	107.6	Q171 T175	Q171-N173 PolarHBondContact O-N 2.77Å; N173-T175 PolarHBondContact O-N 2.98Å
174	Q	34	Very low	44.2	Very low	184 Å²	184	146 Å²	146	86%	0.86	78%	0.778	S	S	*	*			trans	-62.3	126.5	159.9	-68.8	-179.1	7.8	0	0	108.7	T172	T172-Q174 VanDerWaalsContact C-N 3.32Å; T172-Q174 PolarHBondContact O-N 3.02Å; T172-Q174 VanDerWaalsContact O-N 3.09Å
175	T	45.4	Very low	42	Very low	212 Å²	212	155.9 Å²	155.9	100%	1.301	81%	0.814	S	S	*	*			trans	-135.3	0	143.5	-46	0	0	0	0	107.3	N173	N173-T175 PolarHBondContact O-N 2.98Å

Retrieved 175 of 175 residues in 73.6 ms (Link to these results)

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