A0A061HWZ6_CRIGR Loading...

Zinc finger protein 879

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A061HWZ6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Znf879, Length 563 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	34.9	Very low	31.6	Very low	249 Å²	249	167.3 Å²	167.3	100%	1.227	89%	0.888	S	S	*	*				0	108.2	0	-73	176.6	174.8	0	0	108.3
2	A	29.7	Very low	32.1	Very low	109 Å²	109	167.9 Å²	167.9	90%	0.901	88%	0.882	S	S	*	*			trans	-73.6	124.8	-177.6	0	0	0	0	0	110.6
3	Q	30.3	Very low	33.7	Very low	194 Å²	194	163 Å²	163	91%	0.907	87%	0.866	S	S	*	*			trans	-101.6	112.8	173.2	-149.8	165.3	11.3	0	0	108.9	L5	Q3-L5 PolarHBondContact O-N 3.14Å
4	R	30.7	Very low	34.8	Very low	241 Å²	241	156.5 Å²	156.5	91%	0.909	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-56.3	122	-178.9	-73.5	174.8	173.6	172.4	-2.7	111
5	L	31.8	Very low	36.4	Very low	173 Å²	173	150.5 Å²	150.5	91%	0.906	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.8	124.7	163.2	-71.4	165.6	0	0	0	108.7	Q3	Q3-L5 PolarHBondContact O-N 3.14Å
6	L	31.4	Very low	37.5	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-74.2	144	169.7	-74.1	165.4	0	0	0	109.9
7	P	30.4	Very low	38.6	Very low	119 Å²	119	142.8 Å²	142.8	77%	0.773	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70	142.3	-177.5	27	-31.9	0	0	0	112	Q9	P7-Q9 PolarHBondContact O-N 3.26Å
8	A	30.3	Very low	39.9	Very low	94 Å²	94	140.9 Å²	140.9	78%	0.777	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-56.4	130	174.7	0	0	0	0	0	110.9	V10	A8-V10 PolarHBondContact O-N 3.02Å
9	Q	32.9	Very low	41	Very low	177 Å²	177	136.1 Å²	136.1	83%	0.827	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.1	172.2	-78.3	-178.4	-16.3	0	0	109.6	P7 Q11	P7-Q9 PolarHBondContact O-N 3.26Å; Q9-Q11 PolarHBondContact O-N 3.35Å
10	V	29.5	Very low	42.2	Very low	137 Å²	137	130.4 Å²	130.4	83%	0.83	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-57.5	117.4	168.3	179.7	0	0	0	0	107.8	A8 E12	A8-V10 PolarHBondContact O-N 3.02Å; V10-E12 PolarHBondContact O-N 3.24Å
11	Q	36	Very low	43.3	Very low	185 Å²	185	127.4 Å²	127.4	86%	0.864	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-69.1	119.1	172.1	-78	-177.9	0.6	0	0	108.6	Q9	Q9-Q11 PolarHBondContact O-N 3.35Å
12	E	36.9	Very low	44.2	Very low	175 Å²	175	119.4 Å²	119.4	82%	0.818	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-59.9	142.5	173.2	-71.8	-178.3	155.5	0	0	110.7	V10	V10-E12 PolarHBondContact O-N 3.24Å
13	P	53	Low	45.5	Very low	104 Å²	104	116.7 Å²	116.7	68%	0.675	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-62.9	136.1	177.3	23.7	-30.8	0	0	0	111.2	T15	P13-T15 PolarHBondContact O-N 3.32Å
14	V	49.9	Very low	46.6	Very low	72 Å²	72	109.8 Å²	109.8	44%	0.436	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-58.8	119.8	-179.7	179.1	0	0	0	0	110.4	D18 V19 L50 I55	V14-D18 HydrophobicContact CG1-CB 3.97Å; V14-V19 HydrophobicContact CG1-CG1 4.1Å; V14-L50 HydrophobicContact CG1-CD2 4.46Å; V14-I55 WeakPolarHBondContact O-CG2 3.31Å
15	T	57.4	Low	47.3	Very low	66 Å²	66	101.8 Å²	101.8	41%	0.405	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-92.4	165.3	180	70.4	0	0	0	0	111.9	P13 R17 D18	P13-T15 PolarHBondContact O-N 3.32Å; T15-R17 PolarHBondContact O-N 2.78Å; T15-R17 VanDerWaalsContact O-N 3.15Å; T15-R17 PolarHBondContact OG1-N 2.78Å; T15-D18 WeakPolarHBondContact CA-OD2 3.44Å; T15-D18 WeakPolarHBondContact CB-OD2 3.44Å; T15-D18 PolarHBondContact N-OD2 3.34Å; T15-D18 WeakPolarHBondContact O-CB 3.35Å; T15-D18 PolarHBondContact O-N 3.49Å; T15-D18 PolarHBondContact OG1-OD2 2.94Å
16	F	54	Low	48.2	Very low	8 Å²	8	99 Å²	99	4%	0.035	55%	0.546	C	S	.	.	H	α-helix	trans	-55.9	-31.4	173.3	-176.6	-102.3	0	0	0	112.4	D18 V19 A20 M43 N46 Y47 L50 L56 P60 V62 I63 F91	F16-D18 VanDerWaalsContact C-N 3.27Å; F16-D18 PolarHBondContact O-N 3.47Å; F16-V19 HydrophobicContact CD2-CG2 4.49Å; F16-V19 WeakPolarHBondContact O-CG2 3.4Å; F16-V19 PolarHBondContact O-N 3.11Å; F16-A20 HydrophobicContact CD1-CB 4.27Å; F16-A20 HydrophobicContact CE1-CB 3.96Å; F16-A20 HydrophobicContact CZ-CB 4.37Å; F16-A20 WeakPolarHBondContact O-CB 3.39Å; F16-A20 PolarHBondContact O-N 2.9Å; F16-M43 HydrophobicContact CE1-CE 3.86Å; F16-M43 HydrophobicContact CZ-CE 3.65Å; F16-N46 HydrophobicContact CE2-CB 4.45Å; F16-Y47 HydrophobicContact CD2-CD2 4.26Å; F16-Y47 HydrophobicContact CE2-CD2 4.45Å; F16-L50 VanDerWaalsContact CA-CD1 3.49Å; F16-L50 HydrophobicContact CB-CD1 4.15Å; F16-L50 HydrophobicContact CD2-CD1 4.02Å; F16-L56 HydrophobicContact CB-CD1 4.06Å; F16-L56 HydrophobicContact CB-CD2 3.85Å; F16-L56 HydrophobicContact CD2-CD1 4.15Å; F16-L56 HydrophobicContact CG-CD1 4.49Å; F16-P60 HydrophobicContact CB-CG 4.16Å; F16-P60 HydrophobicContact CD1-CB 4.21Å; F16-P60 HydrophobicContact CD1-CG 3.73Å; F16-P60 HydrophobicContact CE1-CG 4.39Å; F16-P60 HydrophobicContact CG-CG 3.92Å; F16-V62 HydrophobicContact CE1-CG1 4.02Å; F16-I63 HydrophobicContact CE1-CD1 4.2Å; F16-I63 HydrophobicContact CE1-CG1 4.06Å; F16-I63 HydrophobicContact CE2-CD1 4.02Å; F16-I63 HydrophobicContact CE2-CG1 4.23Å; F16-I63 HydrophobicContact CZ-CD1 3.52Å; F16-I63 HydrophobicContact CZ-CG1 3.79Å; F16-F91 HydrophobicContact CD1-CD1 4.23Å; F16-F91 HydrophobicContact CD1-CE1 4.45Å; F16-F91 HydrophobicContact CE1-CD1 4.26Å; F16-F91 HydrophobicContact CE1-CE1 4.06Å
17	R	57.3	Low	49.3	Very low	163 Å²	163	96.1 Å²	96.1	62%	0.615	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-29.7	177.8	-170.2	176.8	178.7	-169.2	-4.3	112.9	T15 V19	T15-R17 PolarHBondContact O-N 2.78Å; T15-R17 VanDerWaalsContact O-N 3.15Å; T15-R17 PolarHBondContact OG1-N 2.78Å; R17-V19 VanDerWaalsContact C-N 3.25Å; R17-V19 PolarHBondContact O-N 3.07Å
18	D	62	Low	50.8	Low	108 Å²	108	92 Å²	92	58%	0.578	50%	0.497	S	S	*	.	H	α-helix	trans	-76.4	-15.5	-177.6	-58.1	-47.9	0	0	0	113	V14 T15 F16	V14-D18 HydrophobicContact CG1-CB 3.97Å; T15-D18 WeakPolarHBondContact CA-OD2 3.44Å; T15-D18 WeakPolarHBondContact CB-OD2 3.44Å; T15-D18 PolarHBondContact N-OD2 3.34Å; T15-D18 WeakPolarHBondContact O-CB 3.35Å; T15-D18 PolarHBondContact O-N 3.49Å; T15-D18 PolarHBondContact OG1-OD2 2.94Å; F16-D18 VanDerWaalsContact C-N 3.27Å; F16-D18 PolarHBondContact O-N 3.47Å
19	V	60.3	Low	52.1	Low	50 Å²	50	93 Å²	93	30%	0.303	49%	0.489	S	S	.	.	H	α-helix	trans	-119.7	-1.9	177.5	-56.6	0	0	0	0	112.8	V14 F16 R17 N46 L50	V14-V19 HydrophobicContact CG1-CG1 4.1Å; F16-V19 HydrophobicContact CD2-CG2 4.49Å; F16-V19 WeakPolarHBondContact O-CG2 3.4Å; F16-V19 PolarHBondContact O-N 3.11Å; R17-V19 VanDerWaalsContact C-N 3.25Å; R17-V19 PolarHBondContact O-N 3.07Å; V19-N46 HydrophobicContact CG2-CB 4.27Å; V19-N46 PolarHBondContact O-ND2 3.41Å; V19-L50 HydrophobicContact CG2-CD1 3.29Å; V19-L50 HydrophobicContact CG2-CG 3.97Å
20	A	64.8	Low	53.5	Low	22 Å²	22	92.3 Å²	92.3	18%	0.182	49%	0.485	C	S	.	.			trans	-76.4	135.2	176.3	0	0	0	0	0	110.2	F16 M43 F91	F16-A20 HydrophobicContact CD1-CB 4.27Å; F16-A20 HydrophobicContact CE1-CB 3.96Å; F16-A20 HydrophobicContact CZ-CB 4.37Å; F16-A20 WeakPolarHBondContact O-CB 3.39Å; F16-A20 PolarHBondContact O-N 2.9Å; A20-M43 HydrophobicContact CB-CE 3.56Å; A20-M43 HydrophobicContact CB-SD 4.39Å; A20-F91 HydrophobicContact CB-CD1 4.39Å; A20-F91 HydrophobicContact CB-CE1 3.74Å; A20-F91 HydrophobicContact CB-CZ 4.46Å
21	V	65.9	Low	54.9	Low	67 Å²	67	87 Å²	87	41%	0.406	45%	0.452	S	S	.	.			trans	-88.3	131.1	166.2	-178.6	0	0	0	0	107.2	F23 Y39 M43	V21-F23 HydrophobicContact CG1-CE2 4.24Å; V21-F23 HydrophobicContact CG1-CZ 4.31Å; V21-Y39 HydrophobicContact CB-CD2 4.46Å; V21-Y39 HydrophobicContact CB-CE2 3.99Å; V21-Y39 HydrophobicContact CG1-CE2 4.2Å; V21-Y39 WeakPolarHBondContact O-CE2 2.84Å; V21-Y39 PolarHBondContact O-OH 3Å; V21-M43 HydrophobicContact CB-SD 4.24Å; V21-M43 PolarHBondContact N-SD 3.37Å
22	S	54.1	Low	56	Low	81 Å²	81	82 Å²	82	57%	0.566	43%	0.431	S	S	*	.			trans	-119.5	138.6	177.3	58.7	0	0	0	0	110
23	F	56.9	Low	56.8	Low	53 Å²	53	78.7 Å²	78.7	23%	0.232	43%	0.427	C	S	.	.			trans	-110.7	153.2	171.1	-68.8	-73.7	0	0	0	109.6	V21 E27 W28 L31 Y39 W87	V21-F23 HydrophobicContact CG1-CE2 4.24Å; V21-F23 HydrophobicContact CG1-CZ 4.31Å; F23-E27 WeakPolarHBondContact CA-OE2 3.49Å; F23-E27 HydrophobicContact CB-CB 4.13Å; F23-E27 HydrophobicContact CD1-CB 4.01Å; F23-W28 HydrophobicContact CB-CB 4.41Å; F23-W28 HydrophobicContact CB-CE3 4.06Å; F23-W28 AromaticContact CD2-CE3 3.63Å; F23-W28 HydrophobicContact CD2-CE3 3.63Å; F23-W28 AromaticContact CD2-CZ3 3.76Å; F23-W28 HydrophobicContact CD2-CZ3 3.76Å; F23-W28 HydrophobicContact CE2-CE3 4.44Å; F23-W28 HydrophobicContact CE2-CZ3 4.3Å; F23-W28 HydrophobicContact CG-CE3 4.15Å; F23-L31 HydrophobicContact CD1-CD1 4.43Å; F23-L31 HydrophobicContact CD2-CD1 3.9Å; F23-L31 HydrophobicContact CE1-CD1 4.27Å; F23-L31 HydrophobicContact CE1-CD2 4.33Å; F23-L31 HydrophobicContact CE2-CD1 3.67Å; F23-L31 HydrophobicContact CG-CD1 4.26Å; F23-L31 HydrophobicContact CZ-CD1 3.88Å; F23-L31 HydrophobicContact CZ-CD2 4.31Å; F23-Y39 AromaticContact CD2-CD2 3.86Å; F23-Y39 HydrophobicContact CD2-CD2 3.86Å; F23-Y39 AromaticContact CD2-CE2 3.71Å; F23-Y39 HydrophobicContact CD2-CE2 3.71Å; F23-Y39 AromaticContact CE2-CD2 3.34Å; F23-Y39 HydrophobicContact CE2-CD2 3.34Å; F23-Y39 AromaticContact CE2-CE2 3.65Å; F23-Y39 HydrophobicContact CE2-CE2 3.65Å; F23-Y39 HydrophobicContact CE2-CG 4.08Å; F23-Y39 HydrophobicContact CZ-CD2 4.45Å; F23-W87 HydrophobicContact CB-CH2 3.86Å; F23-W87 HydrophobicContact CB-CZ3 4.28Å; F23-W87 VanDerWaalsContact N-CZ3 3.26Å; F23-W87 VanDerWaalsContact O-CD2 3.32Å; F23-W87 WeakPolarHBondContact O-CH2 3.45Å; F23-W87 WeakPolarHBondContact O-CZ2 3.27Å; F23-W87 WeakPolarHBondContact O-CZ3 3.38Å
24	S	53.8	Low	56.8	Low	48 Å²	48	77.1 Å²	77.1	34%	0.336	42%	0.423	S	S	.	.			trans	-72.8	165.9	161.4	77.1	0	0	0	0	110.2	D26 E27 W28	S24-D26 VanDerWaalsContact C-N 3.28Å; S24-D26 PolarHBondContact O-N 3.41Å; S24-E27 PolarHBondContact N-OE2 2.8Å; S24-E27 PolarHBondContact O-N 3.16Å; S24-E27 WeakPolarHBondContact OG-CB 3.2Å; S24-E27 VanDerWaalsContact OG-CG 3.23Å; S24-E27 WeakPolarHBondContact OG-CG 3.46Å; S24-E27 PolarHBondContact OG-N 2.97Å; S24-W28 WeakPolarHBondContact O-CB 3.33Å; S24-W28 PolarHBondContact O-N 3.39Å
25	Q	44.9	Very low	57.1	Low	73 Å²	73	77.8 Å²	77.8	34%	0.341	42%	0.421	S	S	.	.	H	α-helix	trans	-63.7	-37.6	177.4	-173.3	148.3	-15.3	0	0	111.7	W28 L29 M74	Q25-W28 PolarHBondContact O-N 2.93Å; Q25-L29 WeakPolarHBondContact O-CG 3.4Å; Q25-L29 PolarHBondContact O-N 3.29Å; Q25-M74 PolarHBondContact NE2-SD 2.91Å
26	D	49.6	Very low	57.4	Low	114 Å²	114	78.8 Å²	78.8	61%	0.61	42%	0.418	S	S	*	.	H	α-helix	trans	-66.6	-43.7	175.2	-57.7	-37.2	0	0	0	111.1	S24 W28 L29 H30	S24-D26 VanDerWaalsContact C-N 3.28Å; S24-D26 PolarHBondContact O-N 3.41Å; D26-W28 VanDerWaalsContact C-N 3.32Å; D26-W28 PolarHBondContact O-N 3.38Å; D26-L29 PolarHBondContact O-N 3.3Å; D26-H30 PolarHBondContact O-N 3.42Å; D26-H30 PolarHBondContact O-ND1 2.78Å
27	E	55.4	Low	57.5	Low	103 Å²	103	81.2 Å²	81.2	48%	0.481	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-38.2	176	-73.2	167.9	169.4	0	0	112.1	F23 S24 L29 H30	F23-E27 WeakPolarHBondContact CA-OE2 3.49Å; F23-E27 HydrophobicContact CB-CB 4.13Å; F23-E27 HydrophobicContact CD1-CB 4.01Å; S24-E27 PolarHBondContact N-OE2 2.8Å; S24-E27 PolarHBondContact O-N 3.16Å; S24-E27 WeakPolarHBondContact OG-CB 3.2Å; S24-E27 VanDerWaalsContact OG-CG 3.23Å; S24-E27 WeakPolarHBondContact OG-CG 3.46Å; S24-E27 PolarHBondContact OG-N 2.97Å; E27-L29 PolarHBondContact O-N 2.86Å; E27-H30 PolarHBondContact O-N 3.26Å
28	W	62.3	Low	57.6	Low	32 Å²	32	77.9 Å²	77.9	12%	0.121	43%	0.43	C	S	.	.	H	α-helix	trans	-66	-36.9	179.5	-171.2	-95.4	0	0	0	112.8	F23 S24 Q25 D26 H30 L31 R36 Y39 F72 W87	F23-W28 HydrophobicContact CB-CB 4.41Å; F23-W28 HydrophobicContact CB-CE3 4.06Å; F23-W28 AromaticContact CD2-CE3 3.63Å; F23-W28 HydrophobicContact CD2-CE3 3.63Å; F23-W28 AromaticContact CD2-CZ3 3.76Å; F23-W28 HydrophobicContact CD2-CZ3 3.76Å; F23-W28 HydrophobicContact CE2-CE3 4.44Å; F23-W28 HydrophobicContact CE2-CZ3 4.3Å; F23-W28 HydrophobicContact CG-CE3 4.15Å; S24-W28 WeakPolarHBondContact O-CB 3.33Å; S24-W28 PolarHBondContact O-N 3.39Å; Q25-W28 PolarHBondContact O-N 2.93Å; D26-W28 VanDerWaalsContact C-N 3.32Å; D26-W28 PolarHBondContact O-N 3.38Å; W28-H30 PolarHBondContact O-N 3.19Å; W28-L31 HydrophobicContact CD2-CD1 4.34Å; W28-L31 HydrophobicContact CE3-CD1 3.77Å; W28-L31 HydrophobicContact CZ3-CD1 4.14Å; W28-L31 PolarHBondContact O-N 2.93Å; W28-R36 HydrophobicContact CZ2-CG 4.34Å; W28-R36 PolarHBondContact O-NE 3.37Å; W28-R36 PolarHBondContact O-NH2 2.97Å; W28-Y39 AromaticContact CH2-CD1 3.28Å; W28-Y39 HydrophobicContact CH2-CD1 3.28Å; W28-Y39 AromaticContact CH2-CE1 3.53Å; W28-Y39 HydrophobicContact CH2-CE1 3.53Å; W28-Y39 AromaticContact CH2-CG 3.99Å; W28-Y39 HydrophobicContact CH2-CG 3.99Å; W28-Y39 AromaticContact CZ3-CD1 3.35Å; W28-Y39 HydrophobicContact CZ3-CD1 3.35Å; W28-Y39 HydrophobicContact CZ3-CD2 4.23Å; W28-Y39 AromaticContact CZ3-CE1 3.43Å; W28-Y39 HydrophobicContact CZ3-CE1 3.43Å; W28-Y39 VanDerWaalsContact CZ3-CE1 3.43Å; W28-Y39 HydrophobicContact CZ3-CE2 4.28Å; W28-Y39 AromaticContact CZ3-CG 3.72Å; W28-Y39 HydrophobicContact CZ3-CG 3.72Å; W28-Y39 AromaticContact CZ3-CZ 3.91Å; W28-F72 HydrophobicContact CZ2-CD2 4.17Å; W28-F72 HydrophobicContact CZ2-CE2 4.44Å; W28-W87 HydrophobicContact CD2-CH2 4.5Å; W28-W87 HydrophobicContact CE3-CH2 4.05Å
29	L	57.1	Low	58	Low	115 Å²	115	73.4 Å²	73.4	60%	0.602	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-27.3	176.9	-72.8	170.9	0	0	0	112.6	Q25 D26 E27 R36	Q25-L29 WeakPolarHBondContact O-CG 3.4Å; Q25-L29 PolarHBondContact O-N 3.29Å; D26-L29 PolarHBondContact O-N 3.3Å; E27-L29 PolarHBondContact O-N 2.86Å; L29-R36 PolarHBondContact O-NH2 3.28Å
30	H	62.1	Low	58	Low	163 Å²	163	75 Å²	75	76%	0.755	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.4	177.3	-68.6	82.5	0	0	0	114.1	D26 E27 W28	D26-H30 PolarHBondContact O-N 3.42Å; D26-H30 PolarHBondContact O-ND1 2.78Å; E27-H30 PolarHBondContact O-N 3.26Å; W28-H30 PolarHBondContact O-N 3.19Å
31	L	59.6	Low	57.5	Low	26 Å²	26	80 Å²	80	14%	0.136	43%	0.425	C	S	.	.			trans	-77.5	130.4	176.5	-61.2	178.9	0	0	0	111.2	F23 W28 Q35 R36	F23-L31 HydrophobicContact CD1-CD1 4.43Å; F23-L31 HydrophobicContact CD2-CD1 3.9Å; F23-L31 HydrophobicContact CE1-CD1 4.27Å; F23-L31 HydrophobicContact CE1-CD2 4.33Å; F23-L31 HydrophobicContact CE2-CD1 3.67Å; F23-L31 HydrophobicContact CG-CD1 4.26Å; F23-L31 HydrophobicContact CZ-CD1 3.88Å; F23-L31 HydrophobicContact CZ-CD2 4.31Å; W28-L31 HydrophobicContact CD2-CD1 4.34Å; W28-L31 HydrophobicContact CE3-CD1 3.77Å; W28-L31 HydrophobicContact CZ3-CD1 4.14Å; W28-L31 PolarHBondContact O-N 2.93Å; L31-Q35 HydrophobicContact CB-CB 4.15Å; L31-Q35 HydrophobicContact CD2-CB 4.19Å; L31-R36 HydrophobicContact CB-CG 3.73Å; L31-R36 HydrophobicContact CD1-CG 4.4Å; L31-R36 VanDerWaalsContact O-CZ 3.31Å; L31-R36 PolarHBondContact O-NE 2.8Å; L31-R36 VanDerWaalsContact O-NE 3.11Å; L31-R36 PolarHBondContact O-NH2 3.37Å
32	D	58.9	Low	57.2	Low	80 Å²	80	79.1 Å²	79.1	43%	0.428	42%	0.42	S	S	.	.			trans	-71.9	169	171.5	70	49.2	0	0	0	112.1	A34 Q35 R36	D32-A34 VanDerWaalsContact C-N 3.27Å; D32-A34 PolarHBondContact O-N 3.19Å; D32-A34 WeakPolarHBondContact OD1-CA 3.33Å; D32-A34 WeakPolarHBondContact OD1-CB 3.47Å; D32-A34 PolarHBondContact OD1-N 3.09Å; D32-Q35 VanDerWaalsContact N-OE1 3.11Å; D32-Q35 PolarHBondContact O-N 3.49Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.25Å; D32-Q35 PolarHBondContact OD1-N 3.43Å; D32-Q35 VanDerWaalsContact OD2-CD 3.27Å; D32-R36 WeakPolarHBondContact O-CG 3.39Å; D32-R36 PolarHBondContact O-N 3.33Å
33	S	54	Low	58	Low	104 Å²	104	75.3 Å²	75.3	73%	0.727	39%	0.393	S	S	*	.	H	α-helix	trans	-58.5	-36.2	-178.1	-178.7	0	0	0	0	113	S37	S33-S37 WeakPolarHBondContact O-CB 3.28Å; S33-S37 PolarHBondContact O-N 3.26Å
34	A	53	Low	58	Low	71 Å²	71	73.6 Å²	73.6	59%	0.587	39%	0.386	S	S	*	.	H	α-helix	trans	-72.2	-38	179.3	0	0	0	0	0	111.5	D32 S37 L38	D32-A34 VanDerWaalsContact C-N 3.27Å; D32-A34 PolarHBondContact O-N 3.19Å; D32-A34 WeakPolarHBondContact OD1-CA 3.33Å; D32-A34 WeakPolarHBondContact OD1-CB 3.47Å; D32-A34 PolarHBondContact OD1-N 3.09Å; A34-S37 PolarHBondContact O-N 3.19Å; A34-L38 WeakPolarHBondContact O-CB 3.49Å; A34-L38 PolarHBondContact O-N 3.09Å
35	Q	55.3	Low	58.2	Low	86 Å²	86	75.4 Å²	75.4	40%	0.402	39%	0.389	S	S	.	.	H	α-helix	trans	-68.2	-39.3	175.6	-69	172.3	-14.8	0	0	112.3	L31 D32 L38 Y39	L31-Q35 HydrophobicContact CB-CB 4.15Å; L31-Q35 HydrophobicContact CD2-CB 4.19Å; D32-Q35 VanDerWaalsContact N-OE1 3.11Å; D32-Q35 PolarHBondContact O-N 3.49Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.25Å; D32-Q35 PolarHBondContact OD1-N 3.43Å; D32-Q35 VanDerWaalsContact OD2-CD 3.27Å; Q35-L38 PolarHBondContact O-N 3.17Å; Q35-Y39 WeakPolarHBondContact O-CB 3.37Å; Q35-Y39 PolarHBondContact O-N 3.16Å
36	R	62.9	Low	58.7	Low	87 Å²	87	74 Å²	74	33%	0.328	38%	0.384	S	S	.	.	H	α-helix	trans	-66.1	-39.5	174	-69.5	180	-178	163.7	8.3	111.6	W28 L29 L31 D32 Y39 R40	W28-R36 HydrophobicContact CZ2-CG 4.34Å; W28-R36 PolarHBondContact O-NE 3.37Å; W28-R36 PolarHBondContact O-NH2 2.97Å; L29-R36 PolarHBondContact O-NH2 3.28Å; L31-R36 HydrophobicContact CB-CG 3.73Å; L31-R36 HydrophobicContact CD1-CG 4.4Å; L31-R36 VanDerWaalsContact O-CZ 3.31Å; L31-R36 PolarHBondContact O-NE 2.8Å; L31-R36 VanDerWaalsContact O-NE 3.11Å; L31-R36 PolarHBondContact O-NH2 3.37Å; D32-R36 WeakPolarHBondContact O-CG 3.39Å; D32-R36 PolarHBondContact O-N 3.33Å; R36-Y39 PolarHBondContact O-N 3.3Å; R36-R40 WeakPolarHBondContact O-CB 3.5Å; R36-R40 PolarHBondContact O-N 2.86Å
37	S	57.4	Low	59.2	Low	59 Å²	59	70.4 Å²	70.4	41%	0.413	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-45	172.8	-171	0	0	0	0	111.7	S33 A34 Y39 R40 E41	S33-S37 WeakPolarHBondContact O-CB 3.28Å; S33-S37 PolarHBondContact O-N 3.26Å; A34-S37 PolarHBondContact O-N 3.19Å; S37-Y39 PolarHBondContact O-N 3.44Å; S37-R40 WeakPolarHBondContact O-CB 3.32Å; S37-R40 PolarHBondContact O-N 3.18Å; S37-E41 PolarHBondContact O-N 2.93Å
38	L	59.9	Low	59.2	Low	93 Å²	93	72 Å²	72	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-42.4	176.4	-179.1	63.3	0	0	0	112	A34 Q35 R40 E41 V42	A34-L38 WeakPolarHBondContact O-CB 3.49Å; A34-L38 PolarHBondContact O-N 3.09Å; Q35-L38 PolarHBondContact O-N 3.17Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 3.02Å; L38-E41 PolarHBondContact O-N 3.15Å; L38-V42 HydrophobicContact CD1-CG2 4.18Å; L38-V42 HydrophobicContact CG-CG2 4.38Å; L38-V42 WeakPolarHBondContact O-CB 3.34Å; L38-V42 VanDerWaalsContact O-CG2 3.27Å; L38-V42 WeakPolarHBondContact O-CG2 3.31Å; L38-V42 PolarHBondContact O-N 3.31Å
39	Y	69.4	Low	58.6	Low	14 Å²	14	74 Å²	74	6%	0.055	38%	0.377	C	S	.	.	H	α-helix	trans	-58.2	-46.2	174.5	175.4	-95.9	0	0	0	111.4	V21 F23 W28 Q35 R36 S37 E41 V42 M43 L66	V21-Y39 HydrophobicContact CB-CD2 4.46Å; V21-Y39 HydrophobicContact CB-CE2 3.99Å; V21-Y39 HydrophobicContact CG1-CE2 4.2Å; V21-Y39 WeakPolarHBondContact O-CE2 2.84Å; V21-Y39 PolarHBondContact O-OH 3Å; F23-Y39 AromaticContact CD2-CD2 3.86Å; F23-Y39 HydrophobicContact CD2-CD2 3.86Å; F23-Y39 AromaticContact CD2-CE2 3.71Å; F23-Y39 HydrophobicContact CD2-CE2 3.71Å; F23-Y39 AromaticContact CE2-CD2 3.34Å; F23-Y39 HydrophobicContact CE2-CD2 3.34Å; F23-Y39 AromaticContact CE2-CE2 3.65Å; F23-Y39 HydrophobicContact CE2-CE2 3.65Å; F23-Y39 HydrophobicContact CE2-CG 4.08Å; F23-Y39 HydrophobicContact CZ-CD2 4.45Å; W28-Y39 AromaticContact CH2-CD1 3.28Å; W28-Y39 HydrophobicContact CH2-CD1 3.28Å; W28-Y39 AromaticContact CH2-CE1 3.53Å; W28-Y39 HydrophobicContact CH2-CE1 3.53Å; W28-Y39 AromaticContact CH2-CG 3.99Å; W28-Y39 HydrophobicContact CH2-CG 3.99Å; W28-Y39 AromaticContact CZ3-CD1 3.35Å; W28-Y39 HydrophobicContact CZ3-CD1 3.35Å; W28-Y39 HydrophobicContact CZ3-CD2 4.23Å; W28-Y39 AromaticContact CZ3-CE1 3.43Å; W28-Y39 HydrophobicContact CZ3-CE1 3.43Å; W28-Y39 VanDerWaalsContact CZ3-CE1 3.43Å; W28-Y39 HydrophobicContact CZ3-CE2 4.28Å; W28-Y39 AromaticContact CZ3-CG 3.72Å; W28-Y39 HydrophobicContact CZ3-CG 3.72Å; W28-Y39 AromaticContact CZ3-CZ 3.91Å; Q35-Y39 WeakPolarHBondContact O-CB 3.37Å; Q35-Y39 PolarHBondContact O-N 3.16Å; R36-Y39 PolarHBondContact O-N 3.3Å; S37-Y39 PolarHBondContact O-N 3.44Å; Y39-E41 PolarHBondContact O-N 2.79Å; Y39-V42 PolarHBondContact O-N 3.26Å; Y39-M43 HydrophobicContact CD1-CG 4.05Å; Y39-M43 HydrophobicContact CD2-CG 3.96Å; Y39-M43 HydrophobicContact CE1-CG 3.75Å; Y39-M43 HydrophobicContact CE2-CG 3.66Å; Y39-M43 HydrophobicContact CE2-SD 4.08Å; Y39-M43 HydrophobicContact CG-CG 4.21Å; Y39-M43 WeakPolarHBondContact O-CB 3.43Å; Y39-M43 VanDerWaalsContact O-CG 3.22Å; Y39-M43 WeakPolarHBondContact O-CG 3.33Å; Y39-M43 PolarHBondContact O-N 3.15Å; Y39-L66 HydrophobicContact CE1-CD1 4.24Å
40	R	60.1	Low	58.3	Low	83 Å²	83	69 Å²	69	31%	0.313	35%	0.351	S	S	.	.	H	α-helix	trans	-56.8	-49.1	176	180	-175.9	-175.6	-175.2	3.7	111	R36 S37 L38 M43 L44 L66 E67	R36-R40 WeakPolarHBondContact O-CB 3.5Å; R36-R40 PolarHBondContact O-N 2.86Å; S37-R40 WeakPolarHBondContact O-CB 3.32Å; S37-R40 PolarHBondContact O-N 3.18Å; L38-R40 VanDerWaalsContact C-N 3.32Å; L38-R40 PolarHBondContact O-N 3.02Å; R40-M43 PolarHBondContact O-N 3.44Å; R40-L44 HydrophobicContact CG-CD1 4.08Å; R40-L44 WeakPolarHBondContact O-CB 3.34Å; R40-L44 WeakPolarHBondContact O-CG 3.23Å; R40-L44 PolarHBondContact O-N 3.39Å; R40-L44 VanDerWaalsContact O-N 3.07Å; R40-L66 HydrophobicContact CB-CD2 4.21Å; R40-L66 HydrophobicContact CG-CB 4.28Å; R40-L66 HydrophobicContact CG-CD2 4.15Å; R40-L66 PolarHBondContact NE-O 2.82Å; R40-L66 PolarHBondContact NH2-O 3Å; R40-E67 PolarHBondContact NH2-O 3.08Å
41	E	55.1	Low	57.7	Low	127 Å²	127	63.1 Å²	63.1	59%	0.593	33%	0.33	S	S	*	.	H	α-helix	trans	-60.6	-47.3	178.4	-71.7	-173.6	175.5	0	0	112.4	S37 L38 Y39 M43 L44 E45	S37-E41 PolarHBondContact O-N 2.93Å; L38-E41 PolarHBondContact O-N 3.15Å; Y39-E41 PolarHBondContact O-N 2.79Å; E41-M43 PolarHBondContact O-N 3.09Å; E41-L44 PolarHBondContact O-N 3.28Å; E41-E45 VanDerWaalsContact O-CB 3.25Å; E41-E45 WeakPolarHBondContact O-CB 3.45Å; E41-E45 PolarHBondContact O-N 3.5Å
42	V	60.2	Low	57.1	Low	50 Å²	50	64.8 Å²	64.8	30%	0.303	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-43.4	-178.8	170.2	0	0	0	0	111.4	L38 Y39 E45 N46	L38-V42 HydrophobicContact CD1-CG2 4.18Å; L38-V42 HydrophobicContact CG-CG2 4.38Å; L38-V42 WeakPolarHBondContact O-CB 3.34Å; L38-V42 VanDerWaalsContact O-CG2 3.27Å; L38-V42 WeakPolarHBondContact O-CG2 3.31Å; L38-V42 PolarHBondContact O-N 3.31Å; Y39-V42 PolarHBondContact O-N 3.26Å; V42-E45 PolarHBondContact O-N 3.06Å; V42-N46 WeakPolarHBondContact O-CB 3.38Å; V42-N46 PolarHBondContact O-N 3.41Å; V42-N46 PolarHBondContact O-OD1 3.19Å
43	M	69.5	Low	56.5	Low	0 Å²	0	66 Å²	66	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.5	-38.6	-179.3	-69.4	-60.7	-78.4	0	0	112.1	F16 A20 V21 Y39 R40 E41 Y47 I63 L66 F91	F16-M43 HydrophobicContact CE1-CE 3.86Å; F16-M43 HydrophobicContact CZ-CE 3.65Å; A20-M43 HydrophobicContact CB-CE 3.56Å; A20-M43 HydrophobicContact CB-SD 4.39Å; V21-M43 HydrophobicContact CB-SD 4.24Å; V21-M43 PolarHBondContact N-SD 3.37Å; Y39-M43 HydrophobicContact CD1-CG 4.05Å; Y39-M43 HydrophobicContact CD2-CG 3.96Å; Y39-M43 HydrophobicContact CE1-CG 3.75Å; Y39-M43 HydrophobicContact CE2-CG 3.66Å; Y39-M43 HydrophobicContact CE2-SD 4.08Å; Y39-M43 HydrophobicContact CG-CG 4.21Å; Y39-M43 WeakPolarHBondContact O-CB 3.43Å; Y39-M43 VanDerWaalsContact O-CG 3.22Å; Y39-M43 WeakPolarHBondContact O-CG 3.33Å; Y39-M43 PolarHBondContact O-N 3.15Å; R40-M43 PolarHBondContact O-N 3.44Å; E41-M43 PolarHBondContact O-N 3.09Å; M43-Y47 WeakPolarHBondContact O-CB 3.25Å; M43-Y47 PolarHBondContact O-N 3.43Å; M43-I63 HydrophobicContact CB-CD1 4.34Å; M43-I63 WeakPolarHBondContact O-CD1 3.41Å; M43-L66 HydrophobicContact CB-CD1 3.75Å; M43-L66 HydrophobicContact CG-CD1 4.39Å; M43-F91 HydrophobicContact CE-CE1 4.27Å
44	L	57.8	Low	56	Low	18 Å²	18	63.4 Å²	63.4	9%	0.094	34%	0.34	C	S	.	.	H	α-helix	trans	-67.6	-38.3	173.6	-67.4	177.7	0	0	0	111.9	R40 E41 Y47 R48 I63 L66 E67	R40-L44 HydrophobicContact CG-CD1 4.08Å; R40-L44 WeakPolarHBondContact O-CB 3.34Å; R40-L44 WeakPolarHBondContact O-CG 3.23Å; R40-L44 PolarHBondContact O-N 3.39Å; R40-L44 VanDerWaalsContact O-N 3.07Å; E41-L44 PolarHBondContact O-N 3.28Å; L44-Y47 PolarHBondContact O-N 3.04Å; L44-R48 WeakPolarHBondContact O-CB 3.41Å; L44-R48 VanDerWaalsContact O-CG 3.23Å; L44-R48 WeakPolarHBondContact O-CG 3.39Å; L44-R48 PolarHBondContact O-N 2.92Å; L44-I63 HydrophobicContact CD2-CD1 4.22Å; L44-I63 HydrophobicContact CD2-CG2 3.93Å; L44-L66 HydrophobicContact CD2-CB 4.2Å; L44-E67 HydrophobicContact CD1-CG 4.47Å; L44-E67 HydrophobicContact CD2-CG 3.6Å
45	E	57.4	Low	55.7	Low	86 Å²	86	62.8 Å²	62.8	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-41.2	177.3	-170.9	57.4	-152	0	0	111.7	E41 V42 Y47 R48 N49	E41-E45 VanDerWaalsContact O-CB 3.25Å; E41-E45 WeakPolarHBondContact O-CB 3.45Å; E41-E45 PolarHBondContact O-N 3.5Å; V42-E45 PolarHBondContact O-N 3.06Å; E45-Y47 VanDerWaalsContact C-N 3.32Å; E45-Y47 PolarHBondContact O-N 2.99Å; E45-R48 PolarHBondContact O-N 3.19Å; E45-R48 IonicContact OE2-NH1 3.09Å; E45-N49 WeakPolarHBondContact O-CB 3.44Å; E45-N49 VanDerWaalsContact O-CG 3.32Å; E45-N49 PolarHBondContact O-N 2.87Å; E45-N49 PolarHBondContact O-ND2 3.35Å; E45-N49 PolarHBondContact OE1-ND2 2.9Å
46	N	56.3	Low	55.2	Low	42 Å²	42	60.7 Å²	60.7	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-41.8	173.7	-73.3	-6.9	0	0	0	111.5	F16 V19 V42 N49 L50	F16-N46 HydrophobicContact CE2-CB 4.45Å; V19-N46 HydrophobicContact CG2-CB 4.27Å; V19-N46 PolarHBondContact O-ND2 3.41Å; V42-N46 WeakPolarHBondContact O-CB 3.38Å; V42-N46 PolarHBondContact O-N 3.41Å; V42-N46 PolarHBondContact O-OD1 3.19Å; N46-N49 PolarHBondContact O-N 2.9Å; N46-L50 PolarHBondContact O-N 2.94Å
47	Y	59.8	Low	54.5	Low	39 Å²	39	66 Å²	66	15%	0.153	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-47.1	174.1	175.3	-106.4	0	0	0	111.7	F16 M43 L44 E45 N49 L50 A51 L56 K59 I63	F16-Y47 HydrophobicContact CD2-CD2 4.26Å; F16-Y47 HydrophobicContact CE2-CD2 4.45Å; M43-Y47 WeakPolarHBondContact O-CB 3.25Å; M43-Y47 PolarHBondContact O-N 3.43Å; L44-Y47 PolarHBondContact O-N 3.04Å; E45-Y47 VanDerWaalsContact C-N 3.32Å; E45-Y47 PolarHBondContact O-N 2.99Å; Y47-N49 VanDerWaalsContact C-N 3.3Å; Y47-N49 PolarHBondContact O-N 3.46Å; Y47-L50 PolarHBondContact O-N 3.1Å; Y47-A51 WeakPolarHBondContact O-CB 3.46Å; Y47-A51 PolarHBondContact O-N 3.4Å; Y47-L56 HydrophobicContact CD2-CD1 3.65Å; Y47-L56 HydrophobicContact CE2-CD1 3.84Å; Y47-K59 HydrophobicContact CE1-CG 4.33Å; Y47-K59 HydrophobicContact CE2-CB 4.48Å; Y47-K59 HydrophobicContact CE2-CG 4.24Å; Y47-K59 WeakPolarHBondContact OH-CB 3.49Å; Y47-I63 HydrophobicContact CD1-CG2 3.65Å; Y47-I63 HydrophobicContact CD2-CG1 4.14Å; Y47-I63 HydrophobicContact CD2-CG2 4.27Å; Y47-I63 HydrophobicContact CE1-CG2 4.02Å; Y47-I63 HydrophobicContact CG-CB 4.5Å; Y47-I63 HydrophobicContact CG-CD1 4.33Å; Y47-I63 HydrophobicContact CG-CG1 4.06Å; Y47-I63 HydrophobicContact CG-CG2 3.79Å
48	R	55.4	Low	54.2	Low	136 Å²	136	65.5 Å²	65.5	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-37.8	177.1	-73.7	168.5	-175.6	169.6	2.9	112.5	L44 E45 S52	L44-R48 WeakPolarHBondContact O-CB 3.41Å; L44-R48 VanDerWaalsContact O-CG 3.23Å; L44-R48 WeakPolarHBondContact O-CG 3.39Å; L44-R48 PolarHBondContact O-N 2.92Å; E45-R48 PolarHBondContact O-N 3.19Å; E45-R48 IonicContact OE2-NH1 3.09Å; R48-S52 VanDerWaalsContact O-CB 3.3Å; R48-S52 WeakPolarHBondContact O-CB 3.47Å; R48-S52 PolarHBondContact O-N 3.04Å; R48-S52 PolarHBondContact O-OG 2.97Å
49	N	49.8	Very low	53.9	Low	75 Å²	75	64.5 Å²	64.5	40%	0.401	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-45.6	178	-76.4	-44.9	0	0	0	111.7	E45 N46 Y47 A51 S52 L53	E45-N49 WeakPolarHBondContact O-CB 3.44Å; E45-N49 VanDerWaalsContact O-CG 3.32Å; E45-N49 PolarHBondContact O-N 2.87Å; E45-N49 PolarHBondContact O-ND2 3.35Å; E45-N49 PolarHBondContact OE1-ND2 2.9Å; N46-N49 PolarHBondContact O-N 2.9Å; Y47-N49 VanDerWaalsContact C-N 3.3Å; Y47-N49 PolarHBondContact O-N 3.46Å; N49-A51 PolarHBondContact O-N 2.91Å; N49-S52 PolarHBondContact O-N 3.33Å; N49-L53 VanDerWaalsContact O-CG 3.32Å; N49-L53 WeakPolarHBondContact O-CG 3.49Å; N49-L53 PolarHBondContact O-N 2.92Å
50	L	49.2	Very low	53.7	Low	11 Å²	11	64.3 Å²	64.3	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-64.7	-37.8	174.6	-73.7	-177	0	0	0	112.9	V14 F16 V19 N46 Y47 S52 L53 G54 I55 L56	V14-L50 HydrophobicContact CG1-CD2 4.46Å; F16-L50 VanDerWaalsContact CA-CD1 3.49Å; F16-L50 HydrophobicContact CB-CD1 4.15Å; F16-L50 HydrophobicContact CD2-CD1 4.02Å; V19-L50 HydrophobicContact CG2-CD1 3.29Å; V19-L50 HydrophobicContact CG2-CG 3.97Å; N46-L50 PolarHBondContact O-N 2.94Å; Y47-L50 PolarHBondContact O-N 3.1Å; L50-S52 VanDerWaalsContact C-N 3.35Å; L50-L53 PolarHBondContact O-N 3.06Å; L50-G54 PolarHBondContact O-N 3.43Å; L50-I55 HydrophobicContact CD2-CD1 4.19Å; L50-I55 PolarHBondContact O-N 3.04Å; L50-I55 VanDerWaalsContact O-N 3.16Å; L50-L56 HydrophobicContact CB-CD1 3.48Å; L50-L56 VanDerWaalsContact CB-CD1 3.48Å; L50-L56 HydrophobicContact CB-CG 4.12Å; L50-L56 HydrophobicContact CD1-CD1 3.9Å; L50-L56 HydrophobicContact CD1-CG 4.5Å; L50-L56 HydrophobicContact CG-CD1 4.39Å
51	A	51.1	Low	53.6	Low	39 Å²	39	65.8 Å²	65.8	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-63.3	-39.7	172.4	0	0	0	0	0	111.8	Y47 N49 L53 G54	Y47-A51 WeakPolarHBondContact O-CB 3.46Å; Y47-A51 PolarHBondContact O-N 3.4Å; N49-A51 PolarHBondContact O-N 2.91Å; A51-L53 PolarHBondContact O-N 3.23Å; A51-G54 PolarHBondContact O-N 3.16Å
52	S	47.1	Very low	54	Low	61 Å²	61	60.1 Å²	60.1	43%	0.427	32%	0.315	S	S	.	.	H	α-helix	trans	-69.4	-19.3	176.7	-60.5	0	0	0	0	113.8	R48 N49 L50 K211	R48-S52 VanDerWaalsContact O-CB 3.3Å; R48-S52 WeakPolarHBondContact O-CB 3.47Å; R48-S52 PolarHBondContact O-N 3.04Å; R48-S52 PolarHBondContact O-OG 2.97Å; N49-S52 PolarHBondContact O-N 3.33Å; L50-S52 VanDerWaalsContact C-N 3.35Å; S52-K211 PolarHBondContact O-NZ 2.92Å
53	L	46.6	Very low	54.3	Low	105 Å²	105	57.8 Å²	57.8	55%	0.55	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.4	171.9	-66.1	173.5	0	0	0	112.7	N49 L50 A51 I55	N49-L53 VanDerWaalsContact O-CG 3.32Å; N49-L53 WeakPolarHBondContact O-CG 3.49Å; N49-L53 PolarHBondContact O-N 2.92Å; L50-L53 PolarHBondContact O-N 3.06Å; A51-L53 PolarHBondContact O-N 3.23Å; L53-I55 VanDerWaalsContact C-N 3.34Å; L53-I55 HydrophobicContact CB-CD1 3.5Å; L53-I55 VanDerWaalsContact CB-CD1 3.5Å; L53-I55 HydrophobicContact CB-CG1 3.73Å; L53-I55 HydrophobicContact CD1-CD1 3.92Å; L53-I55 HydrophobicContact CG-CD1 4.36Å
54	G	43.6	Very low	54	Low	50 Å²	50	59.6 Å²	59.6	52%	0.515	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	19.9	-179.7	0	0	0	0	0	113.9	L50 A51	L50-G54 PolarHBondContact O-N 3.43Å; A51-G54 PolarHBondContact O-N 3.16Å
55	I	44.9	Very low	54	Low	57 Å²	57	61.3 Å²	61.3	29%	0.292	32%	0.321	S	S	.	.			trans	-94.2	-20.4	-168.9	-57.9	173	0	0	0	112.6	V14 L50 L53	V14-I55 WeakPolarHBondContact O-CG2 3.31Å; L50-I55 HydrophobicContact CD2-CD1 4.19Å; L50-I55 PolarHBondContact O-N 3.04Å; L50-I55 VanDerWaalsContact O-N 3.16Å; L53-I55 VanDerWaalsContact C-N 3.34Å; L53-I55 HydrophobicContact CB-CD1 3.5Å; L53-I55 VanDerWaalsContact CB-CD1 3.5Å; L53-I55 HydrophobicContact CB-CG1 3.73Å; L53-I55 HydrophobicContact CD1-CD1 3.92Å; L53-I55 HydrophobicContact CG-CD1 4.36Å
56	L	46.5	Very low	54.3	Low	42 Å²	42	57.7 Å²	57.7	22%	0.22	30%	0.304	C	S	.	.			trans	-108.8	120.9	-178.5	-76.7	164.7	0	0	0	112.2	F16 Y47 L50	F16-L56 HydrophobicContact CB-CD1 4.06Å; F16-L56 HydrophobicContact CB-CD2 3.85Å; F16-L56 HydrophobicContact CD2-CD1 4.15Å; F16-L56 HydrophobicContact CG-CD1 4.49Å; Y47-L56 HydrophobicContact CD2-CD1 3.65Å; Y47-L56 HydrophobicContact CE2-CD1 3.84Å; L50-L56 HydrophobicContact CB-CD1 3.48Å; L50-L56 VanDerWaalsContact CB-CD1 3.48Å; L50-L56 HydrophobicContact CB-CG 4.12Å; L50-L56 HydrophobicContact CD1-CD1 3.9Å; L50-L56 HydrophobicContact CD1-CG 4.5Å; L50-L56 HydrophobicContact CG-CD1 4.39Å
57	F	47.6	Very low	54.5	Low	199 Å²	199	59.9 Å²	59.9	87%	0.873	31%	0.313	S	S	*	.	S	Bend	trans	-94.4	-13.6	178	-57.9	-78.9	0	0	0	113.5
58	S	49.9	Very low	54.1	Low	49 Å²	49	64.3 Å²	64.3	34%	0.343	34%	0.335	S	S	.	.	S	Bend	trans	-145.5	152.1	175.5	63.1	0	0	0	0	112.5	P60	S58-P60 WeakPolarHBondContact O-CD 3.36Å
59	K	55.1	Low	54	Low	71 Å²	71	60.7 Å²	60.7	31%	0.309	33%	0.334	S	S	.	.			trans	-84.8	121.2	-177.1	-173	178.2	177.2	-159.5	0	110.6	Y47 I63 S64 E67	Y47-K59 HydrophobicContact CE1-CG 4.33Å; Y47-K59 HydrophobicContact CE2-CB 4.48Å; Y47-K59 HydrophobicContact CE2-CG 4.24Å; Y47-K59 WeakPolarHBondContact OH-CB 3.49Å; K59-I63 HydrophobicContact CD-CG2 4.37Å; K59-I63 VanDerWaalsContact CE-CG2 3.47Å; K59-I63 HydrophobicContact CG-CB 4.26Å; K59-I63 HydrophobicContact CG-CG2 4.05Å; K59-S64 WeakPolarHBondContact CD-OG 3.22Å; K59-S64 WeakPolarHBondContact CE-OG 3.44Å; K59-S64 PolarHBondContact NZ-OG 3.36Å; K59-E67 WeakPolarHBondContact CE-OE2 3.4Å; K59-E67 IonicContact NZ-OE1 3.61Å; K59-E67 IonicContact NZ-OE2 2.55Å; K59-E67 PolarHBondContact NZ-OE2 3.23Å
60	P	65	Low	53.6	Low	10 Å²	10	63.9 Å²	63.9	7%	0.065	35%	0.347	C	S	.	.			trans	-64	146.7	177.4	-23.2	34.6	0	0	0	112.8	F16 S58 V62 I63 S64	F16-P60 HydrophobicContact CB-CG 4.16Å; F16-P60 HydrophobicContact CD1-CB 4.21Å; F16-P60 HydrophobicContact CD1-CG 3.73Å; F16-P60 HydrophobicContact CE1-CG 4.39Å; F16-P60 HydrophobicContact CG-CG 3.92Å; S58-P60 WeakPolarHBondContact O-CD 3.36Å; P60-V62 VanDerWaalsContact C-N 3.28Å; P60-V62 HydrophobicContact CB-CG1 4.15Å; P60-V62 PolarHBondContact O-N 3.5Å; P60-I63 HydrophobicContact CB-CG1 4.37Å; P60-I63 HydrophobicContact CG-CG1 4.44Å; P60-I63 WeakPolarHBondContact O-CB 3.09Å; P60-I63 PolarHBondContact O-N 3.22Å; P60-S64 PolarHBondContact O-N 3.01Å
61	K	57.5	Low	53.3	Low	115 Å²	115	70.2 Å²	70.2	50%	0.5	38%	0.381	S	S	.	.	H	α-helix	trans	-57.8	-38.9	-177.2	-170	169.3	179.9	178.4	0	112.6	I63 S64 Q65 L90	K61-I63 VanDerWaalsContact C-N 3.28Å; K61-I63 PolarHBondContact O-N 2.81Å; K61-S64 PolarHBondContact O-N 3.14Å; K61-Q65 WeakPolarHBondContact O-CG 3.44Å; K61-Q65 PolarHBondContact O-N 3.3Å; K61-Q65 VanDerWaalsContact O-N 3.11Å; K61-L90 HydrophobicContact CD-CD2 4.04Å; K61-L90 HydrophobicContact CG-CD2 4.35Å
62	V	62.8	Low	52.9	Low	8 Å²	8	73.3 Å²	73.3	5%	0.048	39%	0.387	C	S	.	.	H	α-helix	trans	-59.4	-35.2	175.3	69.6	0	0	0	0	113	F16 P60 L66 F91	F16-V62 HydrophobicContact CE1-CG1 4.02Å; P60-V62 VanDerWaalsContact C-N 3.28Å; P60-V62 HydrophobicContact CB-CG1 4.15Å; P60-V62 PolarHBondContact O-N 3.5Å; V62-L66 HydrophobicContact CG2-CD1 4.2Å; V62-L66 WeakPolarHBondContact O-CB 3.33Å; V62-L66 WeakPolarHBondContact O-CG 3.3Å; V62-L66 PolarHBondContact O-N 3.33Å; V62-F91 HydrophobicContact CG1-CD1 4.15Å; V62-F91 HydrophobicContact CG1-CE1 3.87Å; V62-F91 HydrophobicContact CG1-CZ 4.48Å
63	I	67.6	Low	52.5	Low	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-74.4	-33.9	178.6	-65	-64	0	0	0	111.1	F16 M43 L44 Y47 K59 P60 K61 L66 E67	F16-I63 HydrophobicContact CE1-CD1 4.2Å; F16-I63 HydrophobicContact CE1-CG1 4.06Å; F16-I63 HydrophobicContact CE2-CD1 4.02Å; F16-I63 HydrophobicContact CE2-CG1 4.23Å; F16-I63 HydrophobicContact CZ-CD1 3.52Å; F16-I63 HydrophobicContact CZ-CG1 3.79Å; M43-I63 HydrophobicContact CB-CD1 4.34Å; M43-I63 WeakPolarHBondContact O-CD1 3.41Å; L44-I63 HydrophobicContact CD2-CD1 4.22Å; L44-I63 HydrophobicContact CD2-CG2 3.93Å; Y47-I63 HydrophobicContact CD1-CG2 3.65Å; Y47-I63 HydrophobicContact CD2-CG1 4.14Å; Y47-I63 HydrophobicContact CD2-CG2 4.27Å; Y47-I63 HydrophobicContact CE1-CG2 4.02Å; Y47-I63 HydrophobicContact CG-CB 4.5Å; Y47-I63 HydrophobicContact CG-CD1 4.33Å; Y47-I63 HydrophobicContact CG-CG1 4.06Å; Y47-I63 HydrophobicContact CG-CG2 3.79Å; K59-I63 HydrophobicContact CD-CG2 4.37Å; K59-I63 VanDerWaalsContact CE-CG2 3.47Å; K59-I63 HydrophobicContact CG-CB 4.26Å; K59-I63 HydrophobicContact CG-CG2 4.05Å; P60-I63 HydrophobicContact CB-CG1 4.37Å; P60-I63 HydrophobicContact CG-CG1 4.44Å; P60-I63 WeakPolarHBondContact O-CB 3.09Å; P60-I63 PolarHBondContact O-N 3.22Å; K61-I63 VanDerWaalsContact C-N 3.28Å; K61-I63 PolarHBondContact O-N 2.81Å; I63-L66 HydrophobicContact CD1-CD1 4.49Å; I63-E67 WeakPolarHBondContact O-CG 3.44Å; I63-E67 PolarHBondContact O-N 3.01Å; I63-E67 VanDerWaalsContact O-N 3.09Å
64	S	62.9	Low	51.7	Low	39 Å²	39	80.2 Å²	80.2	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-40.7	173.6	-65.3	0	0	0	0	112.3	K59 P60 K61 E67 Q68	K59-S64 WeakPolarHBondContact CD-OG 3.22Å; K59-S64 WeakPolarHBondContact CE-OG 3.44Å; K59-S64 PolarHBondContact NZ-OG 3.36Å; P60-S64 PolarHBondContact O-N 3.01Å; K61-S64 PolarHBondContact O-N 3.14Å; S64-E67 PolarHBondContact O-N 3.43Å; S64-Q68 WeakPolarHBondContact O-CG 3.5Å; S64-Q68 PolarHBondContact O-N 3.2Å
65	Q	58.7	Low	51.1	Low	53 Å²	53	83.4 Å²	83.4	25%	0.248	42%	0.421	C	S	.	.	H	α-helix	trans	-66.9	-43.9	176.7	-69.3	173.9	-44.8	0	0	111.7	K61 E67 Q68	K61-Q65 WeakPolarHBondContact O-CG 3.44Å; K61-Q65 PolarHBondContact O-N 3.3Å; K61-Q65 VanDerWaalsContact O-N 3.11Å; Q65-E67 VanDerWaalsContact C-N 3.26Å; Q65-E67 PolarHBondContact O-N 2.97Å; Q65-Q68 PolarHBondContact O-N 3.37Å
66	L	63.7	Low	50.7	Low	11 Å²	11	89.8 Å²	89.8	6%	0.058	45%	0.449	C	S	.	.	H	α-helix	trans	-65.6	-24.3	175.9	-70.3	174.4	0	0	0	113.2	Y39 R40 M43 L44 V62 I63 F72	Y39-L66 HydrophobicContact CE1-CD1 4.24Å; R40-L66 HydrophobicContact CB-CD2 4.21Å; R40-L66 HydrophobicContact CG-CB 4.28Å; R40-L66 HydrophobicContact CG-CD2 4.15Å; R40-L66 PolarHBondContact NE-O 2.82Å; R40-L66 PolarHBondContact NH2-O 3Å; M43-L66 HydrophobicContact CB-CD1 3.75Å; M43-L66 HydrophobicContact CG-CD1 4.39Å; L44-L66 HydrophobicContact CD2-CB 4.2Å; V62-L66 HydrophobicContact CG2-CD1 4.2Å; V62-L66 WeakPolarHBondContact O-CB 3.33Å; V62-L66 WeakPolarHBondContact O-CG 3.3Å; V62-L66 PolarHBondContact O-N 3.33Å; I63-L66 HydrophobicContact CD1-CD1 4.49Å; L66-F72 HydrophobicContact CD2-CE2 4.47Å
67	E	60.6	Low	49.7	Very low	87 Å²	87	92.7 Å²	92.7	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-78.5	-29.6	174.5	-77.4	-179.9	-172.7	0	0	113.1	R40 L44 K59 I63 S64 Q65 A69	R40-E67 PolarHBondContact NH2-O 3.08Å; L44-E67 HydrophobicContact CD1-CG 4.47Å; L44-E67 HydrophobicContact CD2-CG 3.6Å; K59-E67 WeakPolarHBondContact CE-OE2 3.4Å; K59-E67 IonicContact NZ-OE1 3.61Å; K59-E67 IonicContact NZ-OE2 2.55Å; K59-E67 PolarHBondContact NZ-OE2 3.23Å; I63-E67 WeakPolarHBondContact O-CG 3.44Å; I63-E67 PolarHBondContact O-N 3.01Å; I63-E67 VanDerWaalsContact O-N 3.09Å; S64-E67 PolarHBondContact O-N 3.43Å; Q65-E67 VanDerWaalsContact C-N 3.26Å; Q65-E67 PolarHBondContact O-N 2.97Å; E67-A69 VanDerWaalsContact C-N 3.31Å; E67-A69 PolarHBondContact O-N 2.81Å
68	Q	51.5	Low	48.7	Very low	132 Å²	132	87.1 Å²	87.1	62%	0.617	47%	0.472	S	S	*	.	H	α-helix	trans	-80.1	-5.7	-174.8	-74.3	172.9	-19	0	0	114.7	S64 Q65 E70	S64-Q68 WeakPolarHBondContact O-CG 3.5Å; S64-Q68 PolarHBondContact O-N 3.2Å; Q65-Q68 PolarHBondContact O-N 3.37Å; Q68-E70 PolarHBondContact O-N 3.31Å; Q68-E70 VanDerWaalsContact O-N 3.12Å
69	A	52	Low	47.8	Very low	60 Å²	60	93.5 Å²	93.5	50%	0.496	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	22.6	179	0	0	0	0	0	114.5	E67 D71	E67-A69 VanDerWaalsContact C-N 3.31Å; E67-A69 PolarHBondContact O-N 2.81Å; A69-D71 PolarHBondContact O-N 3.4Å
70	E	42.6	Very low	46.6	Very low	142 Å²	142	96.5 Å²	96.5	66%	0.664	52%	0.517	S	S	*	.			trans	-69.4	114	163.8	-72.1	178.1	175	0	0	106.7	Q68 F72	Q68-E70 PolarHBondContact O-N 3.31Å; Q68-E70 VanDerWaalsContact O-N 3.12Å; E70-F72 PolarHBondContact O-N 3.43Å
71	D	42.4	Very low	44.8	Very low	144 Å²	144	106.9 Å²	106.9	77%	0.77	56%	0.555	S	S	*	*			trans	-52.7	135.9	162.1	-87.1	-32.6	0	0	0	107.4	A69 Q73	A69-D71 PolarHBondContact O-N 3.4Å; D71-Q73 PolarHBondContact O-N 3.33Å
72	F	42.5	Very low	43.3	Very low	104 Å²	104	105 Å²	105	46%	0.456	57%	0.568	S	S	.	*			trans	-65.2	72	172	-84.2	-93	0	0	0	109.3	W28 L66 E70 M74	W28-F72 HydrophobicContact CZ2-CD2 4.17Å; W28-F72 HydrophobicContact CZ2-CE2 4.44Å; L66-F72 HydrophobicContact CD2-CE2 4.47Å; E70-F72 PolarHBondContact O-N 3.43Å; F72-M74 VanDerWaalsContact C-N 3.3Å; F72-M74 PolarHBondContact O-N 3.24Å; F72-M74 VanDerWaalsContact O-N 3.09Å
73	Q	38.1	Very low	41.5	Very low	172 Å²	172	111 Å²	111	80%	0.804	61%	0.605	S	S	*	*			trans	-77	87.9	164.8	-85.7	-176	-12.1	0	0	107.1	D71 V75	D71-Q73 PolarHBondContact O-N 3.33Å; Q73-V75 PolarHBondContact O-N 3.49Å
74	M	31.3	Very low	39.6	Very low	140 Å²	140	120.1 Å²	120.1	69%	0.69	64%	0.64	S	S	*	*			trans	-67.1	108.7	150.2	-90.9	-167.1	66	0	0	106.3	Q25 F72 E76	Q25-M74 PolarHBondContact NE2-SD 2.91Å; F72-M74 VanDerWaalsContact C-N 3.3Å; F72-M74 PolarHBondContact O-N 3.24Å; F72-M74 VanDerWaalsContact O-N 3.09Å; M74-E76 PolarHBondContact O-N 3.13Å; M74-E76 VanDerWaalsContact O-N 3.1Å
75	V	30	Very low	38.2	Very low	117 Å²	117	125.2 Å²	125.2	71%	0.709	66%	0.664	S	S	*	*			trans	-45.4	115.9	171.8	174.5	0	0	0	0	109.5	Q73 S77	Q73-V75 PolarHBondContact O-N 3.49Å; V75-S77 PolarHBondContact O-N 2.81Å; V75-S77 VanDerWaalsContact O-N 3.09Å
76	E	35.8	Very low	37.1	Very low	191 Å²	191	124.1 Å²	124.1	89%	0.893	67%	0.667	S	S	*	*			trans	-64.5	92.9	161.3	-126.4	179.8	171.4	0	0	107.4	M74	M74-E76 PolarHBondContact O-N 3.13Å; M74-E76 VanDerWaalsContact O-N 3.1Å
77	S	26.6	Very low	35.8	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	68%	0.678	S	S	*	*			trans	-170.9	115.8	164.7	-74.8	0	0	0	0	112.3	V75	V75-S77 PolarHBondContact O-N 2.81Å; V75-S77 VanDerWaalsContact O-N 3.09Å
78	G	25.8	Very low	34.7	Very low	82 Å²	82	131 Å²	131	85%	0.845	69%	0.693	S	S	*	*			trans	75.4	106.7	139.3	0	0	0	0	0	120.2
79	M	31.2	Very low	34.2	Very low	184 Å²	184	127.2 Å²	127.2	91%	0.906	68%	0.681	S	S	*	*			trans	-37.4	132.5	164.7	-113.8	-178.6	-171.3	0	0	117.4
80	L	29.7	Very low	33.7	Very low	134 Å²	134	126.1 Å²	126.1	70%	0.702	67%	0.667	S	S	*	*				155.1	129.7	115.6	-89.8	160.6	0	0	0	113.7
81	R	27.8	Very low	33.6	Very low	227 Å²	227	121.1 Å²	121.1	86%	0.857	64%	0.643	S	S	*	*			trans	66.1	116.6	158.7	-79.8	-179.6	-96	-119.3	-2.6	119.1
82	G	24.9	Very low	33.4	Very low	75 Å²	75	121.4 Å²	121.4	77%	0.773	64%	0.637	S	S	*	*			trans	135.7	99.1	145.1	0	0	0	0	0	116.6
83	V	26.4	Very low	33.2	Very low	135 Å²	135	120.7 Å²	120.7	82%	0.818	64%	0.643	S	S	*	*			trans	43.3	100.2	156.3	-167.4	0	0	0	0	117.8	L85	V83-L85 PolarHBondContact O-N 2.97Å
84	Y	27.1	Very low	33.2	Very low	192 Å²	192	119.2 Å²	119.2	75%	0.753	64%	0.639	S	S	*	*			trans	-64.4	104	175	-153.2	-101.3	0	0	0	112.6	G86	Y84-G86 PolarHBondContact O-N 2.94Å
85	L	34	Very low	33.2	Very low	146 Å²	146	117.5 Å²	117.5	76%	0.764	64%	0.636	S	S	*	*			trans	-92.8	81.4	168.6	-75.2	172.6	0	0	0	110.2	V83	V83-L85 PolarHBondContact O-N 2.97Å
86	G	35.1	Very low	33.3	Very low	30 Å²	30	115.4 Å²	115.4	31%	0.309	63%	0.627	S	S	.	*			trans	-58.4	165.1	-175.8	0	0	0	0	0	115.7	Y84 K88 S89	Y84-G86 PolarHBondContact O-N 2.94Å; G86-K88 PolarHBondContact O-N 3.5Å; G86-S89 PolarHBondContact O-N 3.22Å; G86-S89 PolarHBondContact O-OG 3.2Å
87	W	37.2	Very low	33	Very low	77 Å²	77	115 Å²	115	29%	0.292	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-37.6	-25.1	-179.9	-87.1	48	0	0	0	116.3	F23 W28 S89 L90 F91	F23-W87 HydrophobicContact CB-CH2 3.86Å; F23-W87 HydrophobicContact CB-CZ3 4.28Å; F23-W87 VanDerWaalsContact N-CZ3 3.26Å; F23-W87 VanDerWaalsContact O-CD2 3.32Å; F23-W87 WeakPolarHBondContact O-CH2 3.45Å; F23-W87 WeakPolarHBondContact O-CZ2 3.27Å; F23-W87 WeakPolarHBondContact O-CZ3 3.38Å; W28-W87 HydrophobicContact CD2-CH2 4.5Å; W28-W87 HydrophobicContact CE3-CH2 4.05Å; W87-S89 PolarHBondContact O-N 2.87Å; W87-L90 PolarHBondContact O-N 3.35Å; W87-F91 HydrophobicContact CE3-CE2 4.41Å; W87-F91 VanDerWaalsContact O-CD2 3.29Å; W87-F91 WeakPolarHBondContact O-CD2 3.42Å
88	K	36.4	Very low	33.3	Very low	164 Å²	164	116.9 Å²	116.9	71%	0.713	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-59.2	-23.2	172.3	-68.5	179.3	-179	173.3	0	114.1	G86	G86-K88 PolarHBondContact O-N 3.5Å
89	S	41.8	Very low	33.4	Very low	54 Å²	54	119.2 Å²	119.2	38%	0.378	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-76	-27.5	179.1	75.1	0	0	0	0	113.1	G86 W87 F91	G86-S89 PolarHBondContact O-N 3.22Å; G86-S89 PolarHBondContact O-OG 3.2Å; W87-S89 PolarHBondContact O-N 2.87Å; S89-F91 VanDerWaalsContact C-N 3.34Å; S89-F91 PolarHBondContact O-N 3.17Å
90	L	41.8	Very low	33.4	Very low	37 Å²	37	116.5 Å²	116.5	19%	0.194	60%	0.598	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-15.7	-176.3	-64.4	174	0	0	0	113.9	K61 W87	K61-L90 HydrophobicContact CD-CD2 4.04Å; K61-L90 HydrophobicContact CG-CD2 4.35Å; W87-L90 PolarHBondContact O-N 3.35Å
91	F	40.9	Very low	33.6	Very low	37 Å²	37	118.4 Å²	118.4	16%	0.162	60%	0.601	C	S	.	*	T	Hydrogen-bonded Turn	trans	-97	3.2	178	-68.1	-80.7	0	0	0	113.9	F16 A20 M43 V62 W87 S89	F16-F91 HydrophobicContact CD1-CD1 4.23Å; F16-F91 HydrophobicContact CD1-CE1 4.45Å; F16-F91 HydrophobicContact CE1-CD1 4.26Å; F16-F91 HydrophobicContact CE1-CE1 4.06Å; A20-F91 HydrophobicContact CB-CD1 4.39Å; A20-F91 HydrophobicContact CB-CE1 3.74Å; A20-F91 HydrophobicContact CB-CZ 4.46Å; M43-F91 HydrophobicContact CE-CE1 4.27Å; V62-F91 HydrophobicContact CG1-CD1 4.15Å; V62-F91 HydrophobicContact CG1-CE1 3.87Å; V62-F91 HydrophobicContact CG1-CZ 4.48Å; W87-F91 HydrophobicContact CE3-CE2 4.41Å; W87-F91 VanDerWaalsContact O-CD2 3.29Å; W87-F91 WeakPolarHBondContact O-CD2 3.42Å; S89-F91 VanDerWaalsContact C-N 3.34Å; S89-F91 PolarHBondContact O-N 3.17Å
92	K	37.7	Very low	33.7	Very low	149 Å²	149	114.9 Å²	114.9	65%	0.648	59%	0.594	S	S	*	*	S	Bend	trans	-79.9	136.6	175.3	-73.1	-173.9	178.5	-179.7	0	111.1
93	P	37.8	Very low	34	Very low	89 Å²	89	116 Å²	116	58%	0.578	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-60.2	146.8	163.5	-20	32.3	0	0	0	110.9
94	I	38.4	Very low	34.2	Very low	141 Å²	141	116.7 Å²	116.7	72%	0.723	58%	0.584	S	S	*	*	S	Bend	trans	-80.7	121.3	165.2	-57	172.6	0	0	0	106.6
95	V	30.3	Very low	34.4	Very low	104 Å²	104	115.8 Å²	115.8	63%	0.63	58%	0.584	S	S	*	*	S	Bend	trans	136.7	138.6	163.9	174.7	0	0	0	0	112.5	E99	V95-E99 VanDerWaalsContact CG1-OE2 3.27Å; V95-E99 WeakPolarHBondContact CG1-OE2 3.33Å
96	S	32.3	Very low	34.2	Very low	74 Å²	74	115.5 Å²	115.5	52%	0.517	58%	0.583	S	S	.	*			trans	-72.4	163.9	-171.1	54.5	0	0	0	0	114.4	E98	S96-E98 PolarHBondContact O-N 2.82Å; S96-E98 VanDerWaalsContact O-N 3.17Å
97	K	30.5	Very low	34	Very low	182 Å²	182	122.1 Å²	122.1	79%	0.791	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-8.3	-167.2	-90.9	178.7	171.2	180	0	114.6
98	E	31.8	Very low	33.8	Very low	141 Å²	141	129.7 Å²	129.7	66%	0.659	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-22.4	-167.3	-73.6	61.6	-135.9	0	0	113.8	S96	S96-E98 PolarHBondContact O-N 2.82Å; S96-E98 VanDerWaalsContact O-N 3.17Å
99	E	29.5	Very low	33.4	Very low	131 Å²	131	125.9 Å²	125.9	61%	0.612	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-13.9	-179.2	-70.2	179.5	151.5	0	0	114.3	V95 K101	V95-E99 VanDerWaalsContact CG1-OE2 3.27Å; V95-E99 WeakPolarHBondContact CG1-OE2 3.33Å; E99-K101 VanDerWaalsContact C-N 3.29Å; E99-K101 PolarHBondContact O-N 3.49Å
100	N	30	Very low	32.7	Very low	128 Å²	128	130.7 Å²	130.7	68%	0.684	65%	0.654	S	S	*	*	H	α-helix	trans	-76.3	-10.5	178.2	-89.1	-44.8	0	0	0	114.2
101	K	33.8	Very low	31.9	Very low	174 Å²	174	136.7 Å²	136.7	76%	0.757	69%	0.687	S	S	*	*	H	α-helix	trans	-83.4	-22.4	-179.6	-86.8	-178.7	176.1	175.6	0	113.9	E99	E99-K101 VanDerWaalsContact C-N 3.29Å; E99-K101 PolarHBondContact O-N 3.49Å
102	E	29.5	Very low	31.4	Very low	153 Å²	153	140.3 Å²	140.3	72%	0.715	71%	0.711	S	S	*	*	H	α-helix	trans	-86.9	-31.4	-177	-105.7	171.3	160.9	0	0	113.6	L104 K105	E102-L104 VanDerWaalsContact C-N 3.27Å; E102-L104 PolarHBondContact O-N 3.02Å; E102-K105 PolarHBondContact O-N 3.48Å
103	V	31.2	Very low	30.6	Very low	98 Å²	98	142.7 Å²	142.7	59%	0.594	72%	0.722	S	S	*	*	H	α-helix	trans	-69.4	-26.6	177	-178.3	0	0	0	0	112	K105	V103-K105 VanDerWaalsContact C-N 3.34Å; V103-K105 PolarHBondContact O-N 3.39Å
104	L	30.4	Very low	30.1	Very low	149 Å²	149	144.4 Å²	144.4	78%	0.78	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-11.7	-179.8	-129.7	82.6	0	0	0	114.3	E102	E102-L104 VanDerWaalsContact C-N 3.27Å; E102-L104 PolarHBondContact O-N 3.02Å
105	K	31.9	Very low	29.4	Very low	174 Å²	174	147 Å²	147	76%	0.757	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-23.3	177.3	-92.4	-176	174.8	-179	0	113.8	E102 V103	E102-K105 PolarHBondContact O-N 3.48Å; V103-K105 VanDerWaalsContact C-N 3.34Å; V103-K105 PolarHBondContact O-N 3.39Å
106	N	30.3	Very low	29.5	Very low	140 Å²	140	148.4 Å²	148.4	75%	0.749	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	13	-172.6	-68.8	-11.6	0	0	0	115
107	H	30.3	Very low	29.2	Very low	169 Å²	169	152.9 Å²	152.9	78%	0.782	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	30.6	178.9	-87	-60.4	0	0	0	114.3
108	R	33.1	Very low	29.1	Very low	236 Å²	236	147.6 Å²	147.6	89%	0.891	75%	0.75	S	S	*	*			trans	-121.3	83.2	163.8	-79.4	-167.5	-178.6	-168.7	1	110.4
109	A	27.8	Very low	28.9	Very low	84 Å²	84	150 Å²	150	69%	0.694	76%	0.758	S	S	*	*	S	Bend	trans	-174.5	121.7	144.3	0	0	0	0	0	109
110	D	27.6	Very low	28.8	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	77%	0.769	S	S	*	*	S	Bend	trans	97.6	100.9	149.6	-50.7	-17.2	0	0	0	119.5
111	D	26.1	Very low	28.6	Very low	163 Å²	163	155 Å²	155	87%	0.872	78%	0.779	S	S	*	*			trans	84.8	85.5	157.5	-59.9	-11.9	0	0	0	120.6
112	V	28.5	Very low	28.5	Very low	113 Å²	113	152.4 Å²	152.4	69%	0.685	78%	0.777	S	S	*	*			trans	-82.7	128.2	175.7	173	0	0	0	0	111	D114	V112-D114 HydrophobicContact CG1-CB 3.68Å
113	F	22.5	Very low	28.3	Very low	200 Å²	200	152.5 Å²	152.5	88%	0.877	78%	0.783	S	S	*	*			trans	-91.8	102.6	152.9	-165.9	-94	0	0	0	107.2
114	D	26.8	Very low	28.5	Very low	125 Å²	125	157 Å²	157	67%	0.668	80%	0.798	S	S	*	*			trans	-89.5	118.1	-170.7	-121.6	-23.5	0	0	0	111.2	V112 I116	V112-D114 HydrophobicContact CG1-CB 3.68Å; D114-I116 PolarHBondContact O-N 3.13Å
115	F	23.5	Very low	28.7	Very low	196 Å²	196	159 Å²	159	86%	0.86	80%	0.803	S	S	*	*			trans	-86.1	21.6	179.1	-165.5	-100.3	0	0	0	112.8
116	I	31.6	Very low	28.7	Very low	132 Å²	132	160 Å²	160	68%	0.677	81%	0.81	S	S	*	*			trans	-128.6	95.5	-173.3	-55.8	-169	0	0	0	110.1	D114	D114-I116 PolarHBondContact O-N 3.13Å
117	L	27.5	Very low	29	Very low	168 Å²	168	159.3 Å²	159.3	88%	0.88	81%	0.806	S	S	*	*			trans	171.2	103.9	136.9	-94.2	151.6	0	0	0	110.5
118	G	28.6	Very low	29.3	Very low	72 Å²	72	159.9 Å²	159.9	74%	0.742	81%	0.809	S	S	*	*			trans	-86.6	107.8	157.4	0	0	0	0	0	109.6
119	K	26.8	Very low	29.4	Very low	190 Å²	190	157.4 Å²	157.4	83%	0.826	81%	0.808	S	S	*	*			trans	-176.5	142.6	138.4	-97.9	166	-167.9	-175.6	0	111
120	T	26.8	Very low	29.7	Very low	136 Å²	136	161.2 Å²	161.2	83%	0.834	81%	0.811	S	S	*	*			trans	-55.9	139.9	177.3	45	0	0	0	0	113.8
121	Y	27	Very low	30.1	Very low	229 Å²	229	159.8 Å²	159.8	90%	0.898	80%	0.799	S	S	*	*			trans	-104.4	138.4	162.4	-82.3	-89.6	0	0	0	111
122	V	30	Very low	30.6	Very low	119 Å²	119	155 Å²	155	72%	0.721	79%	0.789	S	S	*	*			trans	-94.4	144.8	166.6	164.8	0	0	0	0	106.9
123	N	26.4	Very low	31.1	Very low	156 Å²	156	158.1 Å²	158.1	83%	0.834	79%	0.793	S	S	*	*			trans	101.5	116.3	170.7	-63	-20	0	0	0	117.2
124	E	35.1	Very low	31.8	Very low	192 Å²	192	154.1 Å²	154.1	90%	0.897	78%	0.781	S	S	*	*			trans	-95.2	6	-169.5	-107.3	174.7	169.5	0	0	114.3
125	E	34.3	Very low	32.3	Very low	191 Å²	191	153.8 Å²	153.8	89%	0.893	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	14.1	-164.4	-110.1	175.5	174.9	0	0	116.4
126	Q	33.3	Very low	33	Very low	194 Å²	194	152.9 Å²	152.9	91%	0.907	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	16.3	174.1	-69.3	-161.7	-21.9	0	0	114.6
127	L	35.4	Very low	33.2	Very low	127 Å²	127	153.2 Å²	153.2	67%	0.665	78%	0.777	S	S	*	*	S	Bend	trans	-90.6	-7.1	-179.9	-159.1	67.8	0	0	0	114.3
128	E	36.3	Very low	33.5	Very low	180 Å²	180	151 Å²	151	84%	0.841	76%	0.761	S	S	*	*	S	Bend	trans	-96.9	-10	-169.9	-69.9	-167.4	149.9	0	0	116.2
129	E	36.6	Very low	33.6	Very low	185 Å²	185	150.7 Å²	150.7	86%	0.864	75%	0.747	S	S	*	*	S	Bend	trans	-98.1	-5.6	-175.8	-120.2	179.7	173.5	0	0	115.9
130	Q	33.9	Very low	34.1	Very low	164 Å²	164	149.4 Å²	149.4	77%	0.766	74%	0.742	S	S	*	*	S	Bend	trans	-106.8	-8.6	175.6	-74.1	-145.3	-19.1	0	0	115.2	G132	Q130-G132 VanDerWaalsContact C-N 3.32Å; Q130-G132 PolarHBondContact O-N 3.46Å
131	Q	34.7	Very low	34.3	Very low	123 Å²	123	148.2 Å²	148.2	58%	0.575	73%	0.728	S	S	*	*	H	α-helix	trans	-79.3	-12	178	-70	-175.2	-8.8	0	0	113.8
132	G	37.9	Very low	34.6	Very low	64 Å²	64	141.9 Å²	141.9	66%	0.66	71%	0.709	S	S	*	*	H	α-helix	trans	-81.3	-21.7	179.5	0	0	0	0	0	116.2	Q130	Q130-G132 VanDerWaalsContact C-N 3.32Å; Q130-G132 PolarHBondContact O-N 3.46Å
133	K	37.6	Very low	34.8	Very low	177 Å²	177	141.3 Å²	141.3	77%	0.77	70%	0.702	S	S	*	*	H	α-helix	trans	-98.4	-30.7	-175.7	-74.3	177.7	-179.6	170.4	0	114
134	N	37.2	Very low	35.2	Very low	116 Å²	116	137.4 Å²	137.4	62%	0.62	69%	0.686	S	S	*	*	H	α-helix	trans	-76.4	-22.5	-179.8	-78.2	-16.6	0	0	0	113.9	K136 F138	N134-K136 VanDerWaalsContact C-N 3.32Å; N134-K136 PolarHBondContact O-N 2.87Å; N134-F138 WeakPolarHBondContact O-CB 3.5Å; N134-F138 PolarHBondContact O-N 2.99Å
135	N	37.6	Very low	35.2	Very low	119 Å²	119	133 Å²	133	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-74.4	-16.4	177.1	-84	-22.7	0	0	0	114.4	S139	N135-S139 WeakPolarHBondContact O-CB 3.39Å; N135-S139 PolarHBondContact O-N 3.18Å
136	K	37.9	Very low	35	Very low	176 Å²	176	132.8 Å²	132.8	77%	0.765	66%	0.659	S	S	*	*	H	α-helix	trans	-86	-29.3	177.4	-147.7	172.9	-173.6	176.6	0	113	N134 K140	N134-K136 VanDerWaalsContact C-N 3.32Å; N134-K136 PolarHBondContact O-N 2.87Å; K136-K140 PolarHBondContact O-N 3.35Å
137	L	36.7	Very low	35	Very low	139 Å²	139	130.8 Å²	130.8	73%	0.728	65%	0.647	S	S	*	*	H	α-helix	trans	-79.6	-37.5	172.8	-108.3	112.1	0	0	0	112.2	S139 K140 M141	L137-S139 VanDerWaalsContact C-N 3.33Å; L137-S139 PolarHBondContact O-N 2.89Å; L137-K140 PolarHBondContact O-N 3.14Å; L137-M141 PolarHBondContact O-N 3.45Å
138	F	32.4	Very low	34.9	Very low	122 Å²	122	131.3 Å²	131.3	54%	0.535	65%	0.651	S	S	.	*	H	α-helix	trans	-67	-34.4	176.9	-144.6	-100	0	0	0	112.2	N134 M141 L142	N134-F138 WeakPolarHBondContact O-CB 3.5Å; N134-F138 PolarHBondContact O-N 2.99Å; F138-M141 HydrophobicContact CE2-CE 4.4Å; F138-L142 HydrophobicContact CD1-CD1 3.76Å; F138-L142 HydrophobicContact CD1-CG 4.45Å; F138-L142 HydrophobicContact CE1-CD1 3.92Å; F138-L142 WeakPolarHBondContact O-CB 3.48Å; F138-L142 WeakPolarHBondContact O-CG 3.3Å; F138-L142 PolarHBondContact O-N 3.14Å; F138-L142 VanDerWaalsContact O-N 3.08Å
139	S	32.1	Very low	34.6	Very low	65 Å²	65	132.5 Å²	132.5	46%	0.455	65%	0.649	S	S	.	*	H	α-helix	trans	-68.5	-37.2	173.4	179.9	0	0	0	0	113.3	N135 L137 L143	N135-S139 WeakPolarHBondContact O-CB 3.39Å; N135-S139 PolarHBondContact O-N 3.18Å; L137-S139 VanDerWaalsContact C-N 3.33Å; L137-S139 PolarHBondContact O-N 2.89Å; S139-L143 WeakPolarHBondContact O-CG 3.36Å; S139-L143 PolarHBondContact O-N 3.06Å; S139-L143 VanDerWaalsContact O-N 3.1Å
140	K	36.3	Very low	34.3	Very low	163 Å²	163	128.4 Å²	128.4	71%	0.709	64%	0.636	S	S	*	*	H	α-helix	trans	-72	-34.9	176.2	-116.5	-178.6	178.7	-176.1	0	113.1	K136 L137 L143 S144	K136-K140 PolarHBondContact O-N 3.35Å; L137-K140 PolarHBondContact O-N 3.14Å; K140-L143 PolarHBondContact O-N 3.3Å; K140-S144 PolarHBondContact O-N 2.91Å; K140-S144 PolarHBondContact O-OG 3.47Å
141	M	32.5	Very low	34.4	Very low	111 Å²	111	128.8 Å²	128.8	55%	0.547	64%	0.638	S	S	.	*	H	α-helix	trans	-71	-39	176.7	-165.1	161.6	78	0	0	111.7	L137 F138 S144 I145	L137-M141 PolarHBondContact O-N 3.45Å; F138-M141 HydrophobicContact CE2-CE 4.4Å; M141-S144 PolarHBondContact O-N 2.92Å; M141-I145 HydrophobicContact CG-CD1 4.23Å; M141-I145 WeakPolarHBondContact O-CG1 3.3Å; M141-I145 PolarHBondContact O-N 3.39Å; M141-I145 VanDerWaalsContact O-N 3.08Å
142	L	32.8	Very low	34.3	Very low	97 Å²	97	131.4 Å²	131.4	51%	0.508	65%	0.651	S	S	.	*	H	α-helix	trans	-70.9	-26.5	173.7	-75.3	170	0	0	0	113.5	F138 R146	F138-L142 HydrophobicContact CD1-CD1 3.76Å; F138-L142 HydrophobicContact CD1-CG 4.45Å; F138-L142 HydrophobicContact CE1-CD1 3.92Å; F138-L142 WeakPolarHBondContact O-CB 3.48Å; F138-L142 WeakPolarHBondContact O-CG 3.3Å; F138-L142 PolarHBondContact O-N 3.14Å; F138-L142 VanDerWaalsContact O-N 3.08Å; L142-R146 WeakPolarHBondContact O-CB 3.45Å; L142-R146 PolarHBondContact O-N 3.21Å
143	L	34.4	Very low	34	Very low	107 Å²	107	140 Å²	140	56%	0.56	66%	0.663	S	S	*	*	H	α-helix	trans	-77.8	-23.5	172.9	-76.7	167.3	0	0	0	113.8	S139 K140 K147	S139-L143 WeakPolarHBondContact O-CG 3.36Å; S139-L143 PolarHBondContact O-N 3.06Å; S139-L143 VanDerWaalsContact O-N 3.1Å; K140-L143 PolarHBondContact O-N 3.3Å; L143-K147 PolarHBondContact O-N 2.98Å
144	S	34.4	Very low	33.4	Very low	73 Å²	73	134.6 Å²	134.6	51%	0.51	66%	0.657	S	S	.	*	H	α-helix	trans	-79.5	-43	170.3	-66.4	0	0	0	0	111.7	K140 M141 R146 K147 D148	K140-S144 PolarHBondContact O-N 2.91Å; K140-S144 PolarHBondContact O-OG 3.47Å; M141-S144 PolarHBondContact O-N 2.92Å; S144-R146 PolarHBondContact O-N 3.27Å; S144-K147 PolarHBondContact O-N 3.41Å; S144-D148 PolarHBondContact O-N 3.42Å
145	I	34.5	Very low	32.8	Very low	100 Å²	100	137 Å²	137	51%	0.513	67%	0.669	S	S	.	*	H	α-helix	trans	-64.4	-28.3	175.2	-65.3	169.3	0	0	0	111.3	M141	M141-I145 HydrophobicContact CG-CD1 4.23Å; M141-I145 WeakPolarHBondContact O-CG1 3.3Å; M141-I145 PolarHBondContact O-N 3.39Å; M141-I145 VanDerWaalsContact O-N 3.08Å
146	R	30.4	Very low	32.2	Very low	187 Å²	187	137.3 Å²	137.3	71%	0.706	68%	0.676	S	S	*	*	H	α-helix	trans	-77.7	-19.4	173.8	-166.1	171	-174.1	171.9	1.4	114.1	L142 S144 T150	L142-R146 WeakPolarHBondContact O-CB 3.45Å; L142-R146 PolarHBondContact O-N 3.21Å; S144-R146 PolarHBondContact O-N 3.27Å; R146-T150 PolarHBondContact O-OG1 3.06Å
147	K	33.6	Very low	31.5	Very low	152 Å²	152	132.3 Å²	132.3	66%	0.661	67%	0.674	S	S	*	*	H	α-helix	trans	-82	-38	175.6	-114.6	-179.5	177	-176.8	0	111.9	L143 S144 Y149 T150	L143-K147 PolarHBondContact O-N 2.98Å; S144-K147 PolarHBondContact O-N 3.41Å; K147-Y149 VanDerWaalsContact C-N 3.31Å; K147-Y149 PolarHBondContact O-N 2.83Å; K147-T150 PolarHBondContact O-N 3.45Å; K147-T150 PolarHBondContact O-OG1 3.38Å
148	D	33	Very low	30.8	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	68%	0.681	S	S	*	*	H	α-helix	trans	-76.9	-18.2	-178.5	-63	-18.8	0	0	0	113.2	S144	S144-D148 PolarHBondContact O-N 3.42Å
149	Y	30.4	Very low	30.4	Very low	206 Å²	206	136.8 Å²	136.8	81%	0.808	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	2.7	174.4	-121.6	-92.7	0	0	0	114.6	K147	K147-Y149 VanDerWaalsContact C-N 3.31Å; K147-Y149 PolarHBondContact O-N 2.83Å
150	T	31.3	Very low	30	Very low	98 Å²	98	141.6 Å²	141.6	60%	0.601	72%	0.716	S	S	*	*	S	Bend	trans	-126.2	19.2	178.7	47.4	0	0	0	0	114.3	R146 K147	R146-T150 PolarHBondContact O-OG1 3.06Å; K147-T150 PolarHBondContact O-N 3.45Å; K147-T150 PolarHBondContact O-OG1 3.38Å
151	Q	35.4	Very low	29.4	Very low	172 Å²	172	140.5 Å²	140.5	80%	0.804	72%	0.723	S	S	*	*	S	Bend	trans	-111.6	-3.7	172.6	-156.5	153.3	-10.6	0	0	113.9
152	E	33.1	Very low	29	Very low	179 Å²	179	146.4 Å²	146.4	84%	0.836	74%	0.739	S	S	*	*	S	Bend	trans	-116	102.5	158.9	-78.4	-166.2	160.7	0	0	110
153	R	29.8	Very low	28.6	Very low	244 Å²	244	149.1 Å²	149.1	92%	0.921	75%	0.754	S	S	*	*	S	Bend	trans	86.8	97.3	-178.6	-59.8	-171.1	171.6	-174.3	-2.3	116.2
154	G	25.4	Very low	28.5	Very low	63 Å²	63	150 Å²	150	65%	0.649	77%	0.766	S	S	*	*			trans	-76.6	151.7	169	0	0	0	0	0	114.1
155	L	25.5	Very low	28	Very low	166 Å²	166	149.4 Å²	149.4	87%	0.869	77%	0.772	S	S	*	*			trans	68.9	138.7	149.2	-50.6	172.8	0	0	0	116.5
156	T	24.2	Very low	27.6	Very low	127 Å²	127	152.2 Å²	152.2	78%	0.779	79%	0.787	S	S	*	*			cis	-173.2	141.1	-0.5	17.3	0	0	0	0	106.2
157	G	23.1	Very low	27.3	Very low	70 Å²	70	152.5 Å²	152.5	72%	0.722	79%	0.793	S	S	*	*			trans	71.4	118.9	146.2	0	0	0	0	0	119.1
158	I	22.8	Very low	26.7	Very low	171 Å²	171	150.5 Å²	150.5	88%	0.877	80%	0.798	S	S	*	*				-164.1	128.1	105.2	-87.4	151.4	0	0	0	108.1
159	E	22.9	Very low	27.1	Very low	184 Å²	184	148.7 Å²	148.7	86%	0.86	79%	0.794	S	S	*	*			trans	-69	150.8	169.9	-73.6	177.5	132.9	0	0	112.2
160	L	23.4	Very low	26.7	Very low	166 Å²	166	147.4 Å²	147.4	87%	0.869	79%	0.793	S	S	*	*			trans	-45.6	136.7	157.2	-69.1	142.9	0	0	0	111.7
161	V	23.9	Very low	26.3	Very low	141 Å²	141	147.5 Å²	147.5	86%	0.855	79%	0.794	S	S	*	*				-149.1	143.3	128.6	-174.6	0	0	0	0	110.9
162	R	24.8	Very low	25.6	Very low	234 Å²	234	150.3 Å²	150.3	88%	0.883	80%	0.797	S	S	*	*			trans	-41.6	153.7	171.9	-71.7	169.9	169.9	168.5	-3.9	115.6
163	N	23.7	Very low	25.2	Very low	154 Å²	154	151.2 Å²	151.2	82%	0.824	80%	0.798	S	S	*	*			trans	-34	146.9	160.6	-118.5	-10.9	0	0	0	114
164	P	33	Very low	25.5	Very low	125 Å²	125	145.5 Å²	145.5	81%	0.812	79%	0.793	S	S	*	*				-148.5	153.6	71.8	36.4	-16.9	0	0	0	118
165	G	23.7	Very low	25.4	Very low	62 Å²	62	145.9 Å²	145.9	64%	0.639	80%	0.796	S	S	*	*			trans	91.9	112.3	142.3	0	0	0	0	0	121.9
166	I	27.4	Very low	25.4	Very low	158 Å²	158	143.8 Å²	143.8	81%	0.81	79%	0.79	S	S	*	*			trans	67.5	129.6	135.4	-56.7	-179.4	0	0	0	122.4
167	K	22.5	Very low	25.4	Very low	194 Å²	194	144.9 Å²	144.9	84%	0.843	79%	0.79	S	S	*	*			trans	87.2	98.4	156.7	-79.4	163.6	-169.4	-172.5	0	121.8
168	S	22.4	Very low	25.4	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	79%	0.785	S	S	*	*				23.2	161	116.2	179.9	0	0	0	0	121.8
169	P	39.7	Very low	25.5	Very low	100 Å²	100	149.5 Å²	149.5	65%	0.649	79%	0.788	S	S	*	*			cis	-132.9	-165.6	-43.8	35.6	-14.1	0	0	0	112.4
170	F	22	Very low	25.6	Very low	178 Å²	178	144.3 Å²	144.3	78%	0.781	78%	0.783	S	S	*	*			trans	113.2	108.5	159.2	-85.1	-93.1	0	0	0	121
171	T	23.6	Very low	25.7	Very low	101 Å²	101	148.3 Å²	148.3	62%	0.62	79%	0.787	S	S	*	*				81.7	125.2	129.5	46.3	0	0	0	0	126
172	R	21.8	Very low	26.2	Very low	231 Å²	231	151.5 Å²	151.5	87%	0.872	79%	0.789	S	S	*	*			trans	81.4	107.2	130.1	-76.1	174.4	-174.8	-170.3	2.8	119.7
173	K	23.4	Very low	26.4	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.857	79%	0.787	S	S	*	*				-13.9	167.1	127.7	-68.2	-176.4	179.8	-180	0	115.5
174	P	35.8	Very low	26.5	Very low	125 Å²	125	150.9 Å²	150.9	81%	0.812	79%	0.792	S	S	*	*			cis	-142.2	165.8	20.5	28.1	-2.7	0	0	0	115.7
175	G	23.2	Very low	26.1	Very low	70 Å²	70	150 Å²	150	72%	0.722	79%	0.79	S	S	*	*				108.9	154.6	109.8	0	0	0	0	0	110.1
176	V	25.7	Very low	26.3	Very low	122 Å²	122	155.1 Å²	155.1	74%	0.739	80%	0.797	S	S	*	*			cis	-175.5	136.6	5.8	119.9	0	0	0	0	104.4
177	I	24.7	Very low	26.2	Very low	151 Å²	151	154.5 Å²	154.5	77%	0.774	79%	0.79	S	S	*	*			trans	62.8	134.8	142.4	-55.4	-179.9	0	0	0	116.5
178	S	23.8	Very low	26.4	Very low	90 Å²	90	154.8 Å²	154.8	63%	0.629	79%	0.788	S	S	*	*			cis	-177.8	151.9	26.5	28.1	0	0	0	0	111.3
179	R	24.8	Very low	26.4	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	79%	0.79	S	S	*	*			trans	64.4	128.8	132.3	-66.5	174.4	177.4	-170.6	-0.3	122.4
180	G	25.2	Very low	25.9	Very low	74 Å²	74	156 Å²	156	76%	0.763	79%	0.793	S	S	*	*			trans	91.1	140	143.9	0	0	0	0	0	114.1
181	R	23.7	Very low	26	Very low	250 Å²	250	155 Å²	155	94%	0.943	80%	0.795	S	S	*	*			cis	-156.5	157.9	16.5	-77.1	175.9	179.3	-179	-1.3	108.6
182	K	35.6	Very low	26.1	Very low	208 Å²	208	159 Å²	159	90%	0.904	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-58.6	143.8	169.3	-71	176.9	175.1	175.9	0	111.9
183	P	27.8	Very low	26.3	Very low	130 Å²	130	157.5 Å²	157.5	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.6	144.9	168.3	-0.3	19.9	0	0	0	113.3
184	R	25.9	Very low	26.9	Very low	245 Å²	245	152.6 Å²	152.6	93%	0.925	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.8	139.4	-177.8	-97.2	165	159	175.4	-6.5	114.2
185	S	25.8	Very low	26.6	Very low	108 Å²	108	155.3 Å²	155.3	76%	0.755	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.8	123.6	162.1	55	0	0	0	0	110.9
186	Q	27.6	Very low	27.2	Very low	169 Å²	169	155.2 Å²	155.2	79%	0.79	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.2	131	173.5	-73.1	174.8	-15	0	0	110.8
187	Q	24.8	Very low	27.3	Very low	145 Å²	145	155.4 Å²	155.4	68%	0.678	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-103.1	142.2	179.8	-78.5	178	-19.1	0	0	110.1
188	Y	26.7	Very low	27.6	Very low	200 Å²	200	155.1 Å²	155.1	78%	0.784	80%	0.799	S	S	*	*			trans	-128.7	136.8	162.4	-67.1	-82.9	0	0	0	109.6
189	S	23.7	Very low	27.8	Very low	117 Å²	117	155.8 Å²	155.8	82%	0.818	80%	0.799	S	S	*	*			trans	-105.5	124.4	172.1	47.7	0	0	0	0	109.1
190	V	28.7	Very low	28.4	Very low	117 Å²	117	150.2 Å²	150.2	71%	0.709	79%	0.793	S	S	*	*			trans	-109.5	120.8	171	-178	0	0	0	0	107.7
191	L	24.3	Very low	29.3	Very low	158 Å²	158	156.1 Å²	156.1	83%	0.827	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.9	130	174	-99.2	106.6	0	0	0	110.3
192	F	25.7	Very low	30.4	Very low	184 Å²	184	149.7 Å²	149.7	81%	0.807	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-102.6	136.7	160.1	-87.2	-92	0	0	0	108.5
193	K	24.9	Very low	30.8	Very low	200 Å²	200	143.4 Å²	143.4	87%	0.87	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-86.8	145.1	165.5	-80.8	-176.1	176.8	-179.4	0	109.9
194	P	37.4	Very low	32	Very low	94 Å²	94	141 Å²	141	61%	0.61	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-100.3	145.7	-155.5	36.3	-30.9	0	0	0	114.6
195	L	28.1	Very low	32.8	Very low	182 Å²	182	137.4 Å²	137.4	95%	0.953	71%	0.714	S	S	*	*	S	Bend		-98.7	115.9	129.3	-77.6	166.8	0	0	0	105.2	V197	L195-V197 PolarHBondContact O-N 3.48Å
196	G	36.4	Very low	34.3	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	68%	0.679	S	S	*	*	S	Bend	trans	-52.9	111.3	-152.9	0	0	0	0	0	116.8
197	V	28.5	Very low	35.6	Very low	126 Å²	126	131.2 Å²	131.2	76%	0.764	68%	0.678	S	S	*	*				-154.6	116	125	-178	0	0	0	0	106.5	L195 T199	L195-V197 PolarHBondContact O-N 3.48Å; V197-T199 PolarHBondContact O-N 2.99Å; V197-T199 VanDerWaalsContact O-N 3.14Å
198	N	30.3	Very low	37	Very low	145 Å²	145	129.6 Å²	129.6	78%	0.775	67%	0.673	S	S	*	*			trans	-70.4	104.6	176.9	-90.3	-35.8	0	0	0	110.9
199	T	27.9	Very low	38.6	Very low	103 Å²	103	122.6 Å²	122.6	63%	0.632	65%	0.652	S	S	*	*			trans	-137.9	102.9	152.5	48.8	0	0	0	0	109.9	V197 R201	V197-T199 PolarHBondContact O-N 2.99Å; V197-T199 VanDerWaalsContact O-N 3.14Å; T199-R201 VanDerWaalsContact C-N 3.34Å; T199-R201 PolarHBondContact O-N 2.87Å
200	T	36.3	Very low	39.8	Very low	132 Å²	132	119 Å²	119	81%	0.81	64%	0.635	S	S	*	*			trans	-68.7	84.7	173.4	37.7	0	0	0	0	110.3	K202	T200-K202 PolarHBondContact O-N 3.1Å
201	R	45.2	Very low	40.9	Very low	198 Å²	198	116.9 Å²	116.9	75%	0.747	62%	0.615	S	S	*	*			trans	-78.7	114.3	176.2	-77.2	-174.2	176.3	-168.2	-1.9	110.9	T199 C203	T199-R201 VanDerWaalsContact C-N 3.34Å; T199-R201 PolarHBondContact O-N 2.87Å; R201-C203 PolarHBondContact O-N 3.15Å
202	K	46.4	Very low	41.8	Very low	114 Å²	114	113.2 Å²	113.2	50%	0.496	60%	0.6	S	S	.	*			trans	-65.6	123	173.6	-79	179.2	175.5	174.6	0	110.9	T200 Y204	T200-K202 PolarHBondContact O-N 3.1Å; K202-Y204 HydrophobicContact CB-CE2 4.12Å; K202-Y204 WeakPolarHBondContact O-CE2 3.5Å
203	C	44.4	Very low	43.2	Very low	77 Å²	77	105.5 Å²	105.5	52%	0.52	57%	0.566	S	S	.	*			trans	-107	148	173.4	-66.9	0	0	0	0	111.2	R201 V212 F213	R201-C203 PolarHBondContact O-N 3.15Å; C203-V212 HydrophobicContact CB-CG1 3.89Å; C203-F213 CarbonylContact C-O 3.54Å; C203-F213 WeakPolarHBondContact CA-O 3.33Å
204	Y	53.2	Low	44.1	Very low	79 Å²	79	100.9 Å²	100.9	31%	0.31	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.4	119.7	-171.6	-59.2	-91.9	0	0	0	110.4	K202 F213	K202-Y204 HydrophobicContact CB-CE2 4.12Å; K202-Y204 WeakPolarHBondContact O-CE2 3.5Å; Y204-F213 PolarHBondContact N-O 3.35Å; Y204-F213 PolarHBondContact O-N 3.1Å
205	R	42.3	Very low	44.8	Very low	170 Å²	170	102.1 Å²	102.1	64%	0.642	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	139.6	-176.3	-175.7	-177.4	-75.3	-161	-2.2	111.9	V212 L219	R205-V212 HydrophobicContact CB-CG2 4.37Å; R205-V212 HydrophobicContact CG-CG2 4.23Å; R205-L219 VanDerWaalsContact O-CD2 3.32Å; R205-L219 WeakPolarHBondContact O-CD2 3.32Å
206	C	57.5	Low	45.9	Very low	1 Å²	1	96.1 Å²	96.1	1%	0.007	52%	0.521	C	S	.	.			trans	-81.3	122.8	171.4	-175.1	0	0	0	0	111	I208 G210 K211 F213 L219	C206-I208 PolarHBondContact O-N 3.39Å; C206-G210 WeakPolarHBondContact O-CA 3.38Å; C206-G210 PolarHBondContact O-N 3.5Å; C206-K211 WeakPolarHBondContact CB-O 3.49Å; C206-K211 PolarHBondContact N-O 3.01Å; C206-F213 HydrophobicContact CB-CE2 4.25Å; C206-L219 VanDerWaalsContact CA-CD1 3.44Å; C206-L219 HydrophobicContact CB-CD1 3.49Å; C206-L219 VanDerWaalsContact CB-CD1 3.49Å
207	N	53.7	Low	47	Very low	146 Å²	146	95.7 Å²	95.7	78%	0.781	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-11.6	-177.1	-59.3	-14.2	0	0	0	113.7
208	I	55.8	Low	48.4	Very low	110 Å²	110	91.8 Å²	91.8	56%	0.564	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-40.6	-176.9	-59.3	171.9	0	0	0	111.6	C206 H226	C206-I208 PolarHBondContact O-N 3.39Å; I208-H226 HydrophobicContact CB-CB 4.4Å; I208-H226 HydrophobicContact CD1-CB 3.53Å; I208-H226 HydrophobicContact CG2-CB 4.08Å
209	C	59.8	Low	49.8	Very low	53 Å²	53	85.7 Å²	85.7	36%	0.358	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	12	-177.9	79	0	0	0	0	114.1	K211 H222 H226	C209-K211 PolarHBondContact O-N 3.36Å; C209-H222 PolarHBondContact SG-NE2 2.92Å; C209-H226 PolarHBondContact SG-NE2 3.31Å
210	G	49	Very low	51.4	Low	43 Å²	43	83.4 Å²	83.4	44%	0.443	44%	0.441	S	S	.	.			trans	71.2	-6.3	173.8	0	0	0	0	0	116.8	C206	C206-G210 WeakPolarHBondContact O-CA 3.38Å; C206-G210 PolarHBondContact O-N 3.5Å
211	K	51.4	Low	52.8	Low	71 Å²	71	82.2 Å²	82.2	31%	0.309	42%	0.424	S	S	.	.			trans	-63.7	134.8	-176.2	-73.4	-172.9	175.7	-162.4	0	112.4	S52 C206 C209 F213	S52-K211 PolarHBondContact O-NZ 2.92Å; C206-K211 WeakPolarHBondContact CB-O 3.49Å; C206-K211 PolarHBondContact N-O 3.01Å; C209-K211 PolarHBondContact O-N 3.36Å; K211-F213 HydrophobicContact CB-CE2 3.67Å; K211-F213 HydrophobicContact CB-CZ 3.86Å; K211-F213 WeakPolarHBondContact O-CD2 3.3Å; K211-F213 WeakPolarHBondContact O-CE2 3.39Å
212	V	43.3	Very low	53.6	Low	82 Å²	82	73.9 Å²	73.9	50%	0.497	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.3	-178.6	-175.5	0	0	0	0	110.1	C203 R205	C203-V212 HydrophobicContact CB-CG1 3.89Å; R205-V212 HydrophobicContact CB-CG2 4.37Å; R205-V212 HydrophobicContact CG-CG2 4.23Å
213	F	55.1	Low	54.2	Low	22 Å²	22	71.5 Å²	71.5	10%	0.096	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.2	-177.5	-62.6	-87.9	0	0	0	110.3	C203 Y204 C206 K211 H215 L219 H222	C203-F213 CarbonylContact C-O 3.54Å; C203-F213 WeakPolarHBondContact CA-O 3.33Å; Y204-F213 PolarHBondContact N-O 3.35Å; Y204-F213 PolarHBondContact O-N 3.1Å; C206-F213 HydrophobicContact CB-CE2 4.25Å; K211-F213 HydrophobicContact CB-CE2 3.67Å; K211-F213 HydrophobicContact CB-CZ 3.86Å; K211-F213 WeakPolarHBondContact O-CD2 3.3Å; K211-F213 WeakPolarHBondContact O-CE2 3.39Å; F213-H215 VanDerWaalsContact C-N 3.29Å; F213-H215 PolarHBondContact O-N 3.46Å; F213-L219 HydrophobicContact CB-CB 4.07Å; F213-L219 HydrophobicContact CD2-CB 3.82Å; F213-L219 HydrophobicContact CD2-CD1 3.63Å; F213-L219 HydrophobicContact CD2-CG 4.32Å; F213-L219 HydrophobicContact CE2-CD1 3.86Å; F213-L219 HydrophobicContact CG-CB 4.09Å; F213-H222 HydrophobicContact CE1-CB 3.84Å; F213-H222 HydrophobicContact CE2-CB 3.89Å; F213-H222 AromaticContact CE2-CD2 3.42Å; F213-H222 VanDerWaalsContact CE2-CD2 3.42Å; F213-H222 WeakPolarHBondContact CE2-CD2 3.46Å; F213-H222 AromaticContact CE2-CG 3.63Å; F213-H222 HydrophobicContact CZ-CB 3.39Å; F213-H222 AromaticContact CZ-CD2 3.42Å; F213-H222 VanDerWaalsContact CZ-CD2 3.42Å; F213-H222 WeakPolarHBondContact CZ-CD2 3.39Å; F213-H222 AromaticContact CZ-CG 3.15Å; F213-H222 AromaticContact CZ-ND1 3.61Å; F213-H222 AromaticContact CZ-NE2 4Å
214	L	44.2	Very low	55.4	Low	103 Å²	103	70.6 Å²	70.6	54%	0.539	37%	0.37	S	S	.	.	S	Bend	trans	-71.7	-23.7	178.8	-70.9	159.2	0	0	0	112.8
215	H	51.5	Low	55.8	Low	120 Å²	120	72.1 Å²	72.1	56%	0.556	38%	0.382	S	S	*	.	S	Bend	trans	-130.2	141.6	-179.5	-58.2	148.1	0	0	0	111.2	F213 S217 S218 L219	F213-H215 VanDerWaalsContact C-N 3.29Å; F213-H215 PolarHBondContact O-N 3.46Å; H215-S217 PolarHBondContact O-N 2.86Å; H215-S218 WeakPolarHBondContact O-CB 3.39Å; H215-S218 PolarHBondContact O-N 3.23Å; H215-L219 PolarHBondContact O-N 3.1Å; H215-L219 VanDerWaalsContact O-N 3.17Å
216	S	51.4	Low	56.5	Low	55 Å²	55	67.4 Å²	67.4	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-58.7	-37.7	178	54.9	0	0	0	0	111.6	S218 L219 S220	S216-S218 PolarHBondContact O-N 3.14Å; S216-L219 PolarHBondContact O-N 2.78Å; S216-S220 WeakPolarHBondContact O-CB 3.44Å; S216-S220 PolarHBondContact O-N 3.45Å; S216-S220 PolarHBondContact O-OG 2.81Å; S216-S220 VanDerWaalsContact O-OG 3.05Å
217	S	59.8	Low	56.6	Low	59 Å²	59	71.1 Å²	71.1	41%	0.413	39%	0.39	S	S	.	.	H	α-helix	trans	-58.6	-34.4	174.8	57.3	0	0	0	0	113	H215 K221	H215-S217 PolarHBondContact O-N 2.86Å; S217-K221 WeakPolarHBondContact O-CB 3.3Å; S217-K221 WeakPolarHBondContact O-CG 3.49Å; S217-K221 PolarHBondContact O-N 3.37Å
218	S	57.1	Low	56.9	Low	44 Å²	44	66.4 Å²	66.4	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-76.8	-39.6	178.7	-57.9	0	0	0	0	111.1	H215 S216 K221 H222	H215-S218 WeakPolarHBondContact O-CB 3.39Å; H215-S218 PolarHBondContact O-N 3.23Å; S216-S218 PolarHBondContact O-N 3.14Å; S218-K221 PolarHBondContact O-N 2.83Å; S218-H222 WeakPolarHBondContact O-CB 3.32Å; S218-H222 PolarHBondContact O-N 3.49Å
219	L	60	Low	57.2	Low	17 Å²	17	65.9 Å²	65.9	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-46.4	170.8	173.9	61.5	0	0	0	111.3	R205 C206 F213 H215 S216 K221 H222 Q223	R205-L219 VanDerWaalsContact O-CD2 3.32Å; R205-L219 WeakPolarHBondContact O-CD2 3.32Å; C206-L219 VanDerWaalsContact CA-CD1 3.44Å; C206-L219 HydrophobicContact CB-CD1 3.49Å; C206-L219 VanDerWaalsContact CB-CD1 3.49Å; F213-L219 HydrophobicContact CB-CB 4.07Å; F213-L219 HydrophobicContact CD2-CB 3.82Å; F213-L219 HydrophobicContact CD2-CD1 3.63Å; F213-L219 HydrophobicContact CD2-CG 4.32Å; F213-L219 HydrophobicContact CE2-CD1 3.86Å; F213-L219 HydrophobicContact CG-CB 4.09Å; H215-L219 PolarHBondContact O-N 3.1Å; H215-L219 VanDerWaalsContact O-N 3.17Å; S216-L219 PolarHBondContact O-N 2.78Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.39Å; L219-H222 CarbonylContact O-C 3.52Å; L219-H222 WeakPolarHBondContact O-CB 3.31Å; L219-H222 PolarHBondContact O-N 3.02Å; L219-H222 VanDerWaalsContact O-N 3.11Å; L219-Q223 HydrophobicContact CD1-CG 3.95Å; L219-Q223 HydrophobicContact CG-CG 4.28Å; L219-Q223 WeakPolarHBondContact O-CG 3.35Å; L219-Q223 PolarHBondContact O-N 3.35Å
220	S	62.7	Low	57.6	Low	56 Å²	56	69.7 Å²	69.7	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-64.1	-36.6	179	-59.5	0	0	0	0	112.6	S216 R224	S216-S220 WeakPolarHBondContact O-CB 3.44Å; S216-S220 PolarHBondContact O-N 3.45Å; S216-S220 PolarHBondContact O-OG 2.81Å; S216-S220 VanDerWaalsContact O-OG 3.05Å; S220-R224 WeakPolarHBondContact O-CG 3.49Å
221	K	64.9	Low	58.6	Low	106 Å²	106	72.2 Å²	72.2	46%	0.461	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-39.1	171.8	-75.3	171.4	-173.2	-179.1	0	111.7	S217 S218 L219	S217-K221 WeakPolarHBondContact O-CB 3.3Å; S217-K221 WeakPolarHBondContact O-CG 3.49Å; S217-K221 PolarHBondContact O-N 3.37Å; S218-K221 PolarHBondContact O-N 2.83Å; L219-K221 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 3.39Å
222	H	62.7	Low	59.6	Low	24 Å²	24	73 Å²	73	11%	0.111	39%	0.387	C	S	.	.	H	α-helix	trans	-70.6	-39.7	179	171.8	75.3	0	0	0	112.9	C209 F213 S218 L219 R224 I225 H226	C209-H222 PolarHBondContact SG-NE2 2.92Å; F213-H222 HydrophobicContact CE1-CB 3.84Å; F213-H222 HydrophobicContact CE2-CB 3.89Å; F213-H222 AromaticContact CE2-CD2 3.42Å; F213-H222 VanDerWaalsContact CE2-CD2 3.42Å; F213-H222 WeakPolarHBondContact CE2-CD2 3.46Å; F213-H222 AromaticContact CE2-CG 3.63Å; F213-H222 HydrophobicContact CZ-CB 3.39Å; F213-H222 AromaticContact CZ-CD2 3.42Å; F213-H222 VanDerWaalsContact CZ-CD2 3.42Å; F213-H222 WeakPolarHBondContact CZ-CD2 3.39Å; F213-H222 AromaticContact CZ-CG 3.15Å; F213-H222 AromaticContact CZ-ND1 3.61Å; F213-H222 AromaticContact CZ-NE2 4Å; S218-H222 WeakPolarHBondContact O-CB 3.32Å; S218-H222 PolarHBondContact O-N 3.49Å; L219-H222 CarbonylContact O-C 3.52Å; L219-H222 WeakPolarHBondContact O-CB 3.31Å; L219-H222 PolarHBondContact O-N 3.02Å; L219-H222 VanDerWaalsContact O-N 3.11Å; H222-R224 PolarHBondContact O-N 3.47Å; H222-R224 VanDerWaalsContact O-N 3.17Å; H222-I225 VanDerWaalsContact O-CB 3.26Å; H222-I225 WeakPolarHBondContact O-CB 3.31Å; H222-I225 WeakPolarHBondContact O-CG1 3.38Å; H222-I225 PolarHBondContact O-N 3.11Å; H222-H226 AromaticContact CE1-NE2 3.68Å; H222-H226 AromaticContact NE2-CD2 3.84Å; H222-H226 AromaticContact NE2-NE2 3.18Å; H222-H226 PolarHBondContact NE2-NE2 3.32Å; H222-H226 VanDerWaalsContact NE2-NE2 3.18Å
223	Q	59.2	Low	61	Low	63 Å²	63	76.2 Å²	76.2	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-58.9	-28.4	178	-77.7	173.2	-42.7	0	0	113	L219 I225 H226 T227	L219-Q223 HydrophobicContact CD1-CG 3.95Å; L219-Q223 HydrophobicContact CG-CG 4.28Å; L219-Q223 WeakPolarHBondContact O-CG 3.35Å; L219-Q223 PolarHBondContact O-N 3.35Å; Q223-I225 PolarHBondContact O-N 2.85Å; Q223-H226 PolarHBondContact O-N 3.37Å; Q223-T227 PolarHBondContact O-N 3.48Å; Q223-T227 PolarHBondContact O-OG1 3.19Å
224	R	69.6	Low	62.2	Low	58 Å²	58	75.3 Å²	75.3	22%	0.219	39%	0.39	C	S	.	.	H	α-helix	trans	-63.4	-18	174.8	-64.4	172.6	-172.7	-176.7	-1	114.2	S220 H222 T227 G228 E229 L231 S242	S220-R224 WeakPolarHBondContact O-CG 3.49Å; H222-R224 PolarHBondContact O-N 3.47Å; H222-R224 VanDerWaalsContact O-N 3.17Å; R224-T227 WeakPolarHBondContact CA-OG1 3.48Å; R224-G228 PolarHBondContact O-N 3.48Å; R224-E229 HydrophobicContact CB-CB 4.45Å; R224-E229 HydrophobicContact CG-CB 4.29Å; R224-E229 PolarHBondContact O-N 3.42Å; R224-L231 VanDerWaalsContact CZ-CD1 3.43Å; R224-S242 PolarHBondContact NH1-O 3.37Å
225	I	61.3	Low	63.5	Low	111 Å²	111	80.3 Å²	80.3	57%	0.569	41%	0.408	S	S	*	.	H	α-helix	trans	-72.3	-38.2	173.8	-58.1	173.2	0	0	0	109.8	H222 Q223	H222-I225 VanDerWaalsContact O-CB 3.26Å; H222-I225 WeakPolarHBondContact O-CB 3.31Å; H222-I225 WeakPolarHBondContact O-CG1 3.38Å; H222-I225 PolarHBondContact O-N 3.11Å; Q223-I225 PolarHBondContact O-N 2.85Å
226	H	55.8	Low	64.4	Low	72 Å²	72	81 Å²	81	33%	0.333	41%	0.411	S	S	.	.	H	α-helix	trans	-82	-37.8	-179.3	-60.5	-58.9	0	0	0	112.6	I208 C209 H222 Q223 G228	I208-H226 HydrophobicContact CB-CB 4.4Å; I208-H226 HydrophobicContact CD1-CB 3.53Å; I208-H226 HydrophobicContact CG2-CB 4.08Å; C209-H226 PolarHBondContact SG-NE2 3.31Å; H222-H226 AromaticContact CE1-NE2 3.68Å; H222-H226 AromaticContact NE2-CD2 3.84Å; H222-H226 AromaticContact NE2-NE2 3.18Å; H222-H226 PolarHBondContact NE2-NE2 3.32Å; H222-H226 VanDerWaalsContact NE2-NE2 3.18Å; Q223-H226 PolarHBondContact O-N 3.37Å; H226-G228 VanDerWaalsContact C-N 3.31Å
227	T	60	Low	65.5	Low	78 Å²	78	80.6 Å²	80.6	48%	0.479	41%	0.408	S	S	.	.	H	α-helix	trans	-81.2	-10.1	179.5	60.2	0	0	0	0	113.4	Q223 R224 E229	Q223-T227 PolarHBondContact O-N 3.48Å; Q223-T227 PolarHBondContact O-OG1 3.19Å; R224-T227 WeakPolarHBondContact CA-OG1 3.48Å; T227-E229 PolarHBondContact O-N 3.04Å; T227-E229 WeakPolarHBondContact OG1-CG 3.37Å
228	G	59.8	Low	65.9	Low	48 Å²	48	88.4 Å²	88.4	50%	0.495	43%	0.428	S	S	.	.			trans	67.4	10.9	-176.7	0	0	0	0	0	114.3	R224 H226 K230	R224-G228 PolarHBondContact O-N 3.48Å; H226-G228 VanDerWaalsContact C-N 3.31Å; G228-K230 PolarHBondContact O-N 3.37Å; G228-K230 VanDerWaalsContact O-N 3.08Å
229	E	61.8	Low	66.2	Low	99 Å²	99	92.4 Å²	92.4	46%	0.463	44%	0.44	S	S	.	.			trans	-64.7	108	-177.9	-78.4	-179.1	172.2	0	0	111.9	R224 T227	R224-E229 HydrophobicContact CB-CB 4.45Å; R224-E229 HydrophobicContact CG-CB 4.29Å; R224-E229 PolarHBondContact O-N 3.42Å; T227-E229 PolarHBondContact O-N 3.04Å; T227-E229 WeakPolarHBondContact OG1-CG 3.37Å
230	K	68.1	Low	66.8	Low	132 Å²	132	92.9 Å²	92.9	57%	0.574	45%	0.446	S	S	*	.			trans	-106.5	83.2	177.4	-68.9	168.2	173.8	-178.4	0	110.3	G228 A240 F241	G228-K230 PolarHBondContact O-N 3.37Å; G228-K230 VanDerWaalsContact O-N 3.08Å; K230-A240 HydrophobicContact CB-CB 3.45Å; K230-A240 VanDerWaalsContact CB-CB 3.45Å; K230-A240 HydrophobicContact CD-CB 4.05Å; K230-A240 VanDerWaalsContact CD-O 3.28Å; K230-A240 WeakPolarHBondContact CD-O 3.46Å; K230-A240 HydrophobicContact CG-CB 4.28Å; K230-F241 CarbonylContact C-O 3.31Å; K230-F241 WeakPolarHBondContact CA-O 3.48Å
231	L	71.7	Confident	67.3	Low	97 Å²	97	92.4 Å²	92.4	51%	0.508	44%	0.437	S	S	.	.			trans	-73.3	-25.7	-173.8	-64	172.1	0	0	0	113.8	R224 F241	R224-L231 VanDerWaalsContact CZ-CD1 3.43Å; L231-F241 PolarHBondContact N-O 3.15Å
232	Y	72.5	Confident	67.5	Low	86 Å²	86	89 Å²	89	34%	0.337	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	102.4	-172.4	-59.8	-80.2	0	0	0	110.4	A240 F241	Y232-A240 CarbonylContact O-C 3.59Å; Y232-A240 WeakPolarHBondContact O-CA 3.18Å; Y232-F241 PolarHBondContact N-O 3.17Å; Y232-F241 PolarHBondContact O-N 3.04Å
233	K	72.9	Confident	67.8	Low	151 Å²	151	91.1 Å²	91.1	66%	0.657	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.8	-177.6	-60.9	-178.9	-178.7	177	0	111.1	A240	K233-A240 HydrophobicContact CG-CB 3.84Å
234	C	78.4	Confident	68.3	Low	3 Å²	3	91 Å²	91	2%	0.02	44%	0.442	C	S	.	.			trans	-71.6	125.1	168.3	179.2	0	0	0	0	109.2	E236 R238 K239 L247 H254	C234-E236 VanDerWaalsContact C-N 3.3Å; C234-E236 PolarHBondContact O-N 3.36Å; C234-R238 WeakPolarHBondContact O-CA 3.48Å; C234-R238 PolarHBondContact O-N 3.14Å; C234-K239 WeakPolarHBondContact CB-O 3.4Å; C234-K239 PolarHBondContact N-O 3.29Å; C234-L247 HydrophobicContact CB-CD1 3.69Å; C234-H254 PolarHBondContact SG-NE2 2.98Å; C234-H254 VanDerWaalsContact SG-NE2 3.36Å
235	K	71.8	Confident	68.4	Low	208 Å²	208	91.4 Å²	91.4	90%	0.904	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-27.6	-178.9	-64.9	-177.3	179.1	179.9	0	112.6
236	E	71.8	Confident	68.8	Low	133 Å²	133	88 Å²	88	62%	0.621	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-42.2	-174.5	-68.6	168.9	-168.7	0	0	113.5	C234 H254	C234-E236 VanDerWaalsContact C-N 3.3Å; C234-E236 PolarHBondContact O-N 3.36Å; E236-H254 WeakPolarHBondContact OE2-CB 3.36Å; E236-H254 IonicContact OE2-CD2 3.34Å; E236-H254 PolarHBondContact OE2-CD2 3.45Å; E236-H254 IonicContact OE2-CG 3.97Å; E236-H254 IonicContact OE2-ND1 3.88Å
237	C	74.6	Confident	69.7	Low	47 Å²	47	85.7 Å²	85.7	32%	0.318	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	6.8	-176.7	76.7	0	0	0	0	114.4	K239 H250 H254	C237-K239 PolarHBondContact O-N 3.23Å; C237-H250 PolarHBondContact SG-NE2 3.12Å; C237-H254 PolarHBondContact SG-NE2 3.43Å; C237-H254 VanDerWaalsContact SG-NE2 3.43Å
238	R	66.8	Low	70.3	Confident	224 Å²	224	85.9 Å²	85.9	85%	0.845	43%	0.432	S	S	*	.			trans	57.7	7.9	179.2	-57.5	-178.9	-178.3	169.1	0.5	115.6	C234	C234-R238 WeakPolarHBondContact O-CA 3.48Å; C234-R238 PolarHBondContact O-N 3.14Å
239	K	63.5	Low	70.8	Confident	128 Å²	128	87.4 Å²	87.4	56%	0.557	43%	0.426	S	S	*	.			trans	-66.9	138.5	172.9	-72	-177.8	178.9	178	0	110.5	C234 C237 F241	C234-K239 WeakPolarHBondContact CB-O 3.4Å; C234-K239 PolarHBondContact N-O 3.29Å; C237-K239 PolarHBondContact O-N 3.23Å; K239-F241 HydrophobicContact CB-CE2 3.91Å; K239-F241 HydrophobicContact CB-CZ 4.04Å
240	A	72	Confident	71.3	Confident	26 Å²	26	83.7 Å²	83.7	22%	0.215	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139.6	-175.5	0	0	0	0	0	111.3	K230 Y232 K233	K230-A240 HydrophobicContact CB-CB 3.45Å; K230-A240 VanDerWaalsContact CB-CB 3.45Å; K230-A240 HydrophobicContact CD-CB 4.05Å; K230-A240 VanDerWaalsContact CD-O 3.28Å; K230-A240 WeakPolarHBondContact CD-O 3.46Å; K230-A240 HydrophobicContact CG-CB 4.28Å; Y232-A240 CarbonylContact O-C 3.59Å; Y232-A240 WeakPolarHBondContact O-CA 3.18Å; K233-A240 HydrophobicContact CG-CB 3.84Å
241	F	74.6	Confident	71.5	Confident	47 Å²	47	80.4 Å²	80.4	21%	0.206	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	149	-172.8	-58.1	-90.8	0	0	0	110.5	K230 L231 Y232 K239 Q243 L247 H250	K230-F241 CarbonylContact C-O 3.31Å; K230-F241 WeakPolarHBondContact CA-O 3.48Å; L231-F241 PolarHBondContact N-O 3.15Å; Y232-F241 PolarHBondContact N-O 3.17Å; Y232-F241 PolarHBondContact O-N 3.04Å; K239-F241 HydrophobicContact CB-CE2 3.91Å; K239-F241 HydrophobicContact CB-CZ 4.04Å; F241-Q243 VanDerWaalsContact C-N 3.32Å; F241-L247 HydrophobicContact CB-CB 4.32Å; F241-L247 HydrophobicContact CD2-CB 3.88Å; F241-L247 HydrophobicContact CD2-CD1 3.7Å; F241-L247 HydrophobicContact CD2-CG 4.38Å; F241-L247 HydrophobicContact CE2-CD1 3.83Å; F241-L247 HydrophobicContact CG-CB 4.26Å; F241-H250 HydrophobicContact CE1-CB 3.92Å; F241-H250 HydrophobicContact CE2-CB 3.82Å; F241-H250 AromaticContact CE2-CD2 3.41Å; F241-H250 VanDerWaalsContact CE2-CD2 3.41Å; F241-H250 WeakPolarHBondContact CE2-CD2 3.39Å; F241-H250 AromaticContact CE2-CG 3.6Å; F241-H250 HydrophobicContact CZ-CB 3.39Å; F241-H250 AromaticContact CZ-CD2 3.48Å; F241-H250 VanDerWaalsContact CZ-CD2 3.48Å; F241-H250 WeakPolarHBondContact CZ-CD2 3.44Å; F241-H250 AromaticContact CZ-CG 3.19Å; F241-H250 AromaticContact CZ-ND1 3.72Å
242	S	67.6	Low	71.8	Confident	34 Å²	34	78.4 Å²	78.4	24%	0.238	38%	0.383	C	S	.	.	S	Bend	trans	-77.8	-18.6	177.9	53	0	0	0	0	113	R224	R224-S242 PolarHBondContact NH1-O 3.37Å
243	Q	70.1	Confident	71.7	Confident	69 Å²	69	78.8 Å²	78.8	32%	0.322	39%	0.394	S	S	.	.	S	Bend	trans	-132.1	146	-178.8	-57.2	-175.8	10.3	0	0	111.4	F241 S246 L247	F241-Q243 VanDerWaalsContact C-N 3.32Å; Q243-S246 PolarHBondContact O-N 2.75Å; Q243-L247 PolarHBondContact O-N 3.15Å
244	S	69.4	Low	71.7	Confident	59 Å²	59	74.9 Å²	74.9	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-67.3	-39.4	178	51.7	0	0	0	0	112.1	S246 L247 T248	S244-S246 VanDerWaalsContact C-N 3.29Å; S244-S246 PolarHBondContact O-N 3.25Å; S244-L247 WeakPolarHBondContact O-CB 3.45Å; S244-L247 PolarHBondContact O-N 3.24Å; S244-T248 PolarHBondContact O-N 3.37Å; S244-T248 PolarHBondContact O-OG1 3.04Å; S244-T248 VanDerWaalsContact O-OG1 3.11Å
245	S	71.1	Confident	71.4	Confident	68 Å²	68	78.7 Å²	78.7	48%	0.476	40%	0.401	S	S	.	.	H	α-helix	trans	-56.9	-40.9	175.4	50.8	0	0	0	0	112.5	T248 Q249	S245-T248 PolarHBondContact O-N 3.17Å; S245-Q249 VanDerWaalsContact O-CB 3.3Å; S245-Q249 WeakPolarHBondContact O-CB 3.44Å; S245-Q249 PolarHBondContact O-N 2.96Å
246	S	70.6	Confident	71.3	Confident	38 Å²	38	71 Å²	71	27%	0.266	38%	0.381	S	S	.	.	H	α-helix	trans	-68	-36	175.3	-51.7	0	0	0	0	112.6	Q243 S244 H250	Q243-S246 PolarHBondContact O-N 2.75Å; S244-S246 VanDerWaalsContact C-N 3.29Å; S244-S246 PolarHBondContact O-N 3.25Å; S246-H250 VanDerWaalsContact O-CB 3.28Å; S246-H250 WeakPolarHBondContact O-CB 3.48Å; S246-H250 PolarHBondContact O-N 2.88Å
247	L	74.6	Confident	71.4	Confident	25 Å²	25	70 Å²	70	13%	0.131	38%	0.376	C	S	.	.	H	α-helix	trans	-66.8	-47.8	172.3	174.2	62.5	0	0	0	110.8	C234 F241 Q243 S244 Q249 H250 L251	C234-L247 HydrophobicContact CB-CD1 3.69Å; F241-L247 HydrophobicContact CB-CB 4.32Å; F241-L247 HydrophobicContact CD2-CB 3.88Å; F241-L247 HydrophobicContact CD2-CD1 3.7Å; F241-L247 HydrophobicContact CD2-CG 4.38Å; F241-L247 HydrophobicContact CE2-CD1 3.83Å; F241-L247 HydrophobicContact CG-CB 4.26Å; Q243-L247 PolarHBondContact O-N 3.15Å; S244-L247 WeakPolarHBondContact O-CB 3.45Å; S244-L247 PolarHBondContact O-N 3.24Å; L247-Q249 VanDerWaalsContact C-N 3.28Å; L247-Q249 PolarHBondContact O-N 3.13Å; L247-H250 CarbonylContact O-C 3.58Å; L247-H250 WeakPolarHBondContact O-CA 3.25Å; L247-H250 WeakPolarHBondContact O-CB 3.39Å; L247-H250 PolarHBondContact O-N 3.09Å; L247-L251 HydrophobicContact CD1-CD2 4.35Å; L247-L251 HydrophobicContact CD1-CG 4.3Å; L247-L251 HydrophobicContact CG-CG 4.48Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.39Å
248	T	73	Confident	71.5	Confident	82 Å²	82	73.4 Å²	73.4	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-57.7	-42.4	177.4	-57.2	0	0	0	0	111.6	S244 S245 L251	S244-T248 PolarHBondContact O-N 3.37Å; S244-T248 PolarHBondContact O-OG1 3.04Å; S244-T248 VanDerWaalsContact O-OG1 3.11Å; S245-T248 PolarHBondContact O-N 3.17Å; T248-L251 PolarHBondContact O-N 2.87Å
249	Q	69.3	Low	72	Confident	80 Å²	80	66.2 Å²	66.2	37%	0.374	37%	0.368	S	S	.	.	H	α-helix	trans	-65.8	-38	174.2	-175.8	178.9	67.5	0	0	112.3	S245 L247 R252 F271	S245-Q249 VanDerWaalsContact O-CB 3.3Å; S245-Q249 WeakPolarHBondContact O-CB 3.44Å; S245-Q249 PolarHBondContact O-N 2.96Å; L247-Q249 VanDerWaalsContact C-N 3.28Å; L247-Q249 PolarHBondContact O-N 3.13Å; Q249-R252 WeakPolarHBondContact O-CB 3.07Å; Q249-R252 PolarHBondContact O-N 3.29Å; Q249-F271 VanDerWaalsContact CD-CD1 3.46Å; Q249-F271 HydrophobicContact CG-CD1 3.79Å; Q249-F271 HydrophobicContact CG-CE1 3.25Å; Q249-F271 HydrophobicContact CG-CZ 4.06Å
250	H	73.7	Confident	72.7	Confident	21 Å²	21	63.5 Å²	63.5	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-35.6	175.7	170.6	64.8	0	0	0	113.1	C237 F241 S246 L247 R252 V253 H254	C237-H250 PolarHBondContact SG-NE2 3.12Å; F241-H250 HydrophobicContact CE1-CB 3.92Å; F241-H250 HydrophobicContact CE2-CB 3.82Å; F241-H250 AromaticContact CE2-CD2 3.41Å; F241-H250 VanDerWaalsContact CE2-CD2 3.41Å; F241-H250 WeakPolarHBondContact CE2-CD2 3.39Å; F241-H250 AromaticContact CE2-CG 3.6Å; F241-H250 HydrophobicContact CZ-CB 3.39Å; F241-H250 AromaticContact CZ-CD2 3.48Å; F241-H250 VanDerWaalsContact CZ-CD2 3.48Å; F241-H250 WeakPolarHBondContact CZ-CD2 3.44Å; F241-H250 AromaticContact CZ-CG 3.19Å; F241-H250 AromaticContact CZ-ND1 3.72Å; S246-H250 VanDerWaalsContact O-CB 3.28Å; S246-H250 WeakPolarHBondContact O-CB 3.48Å; S246-H250 PolarHBondContact O-N 2.88Å; L247-H250 CarbonylContact O-C 3.58Å; L247-H250 WeakPolarHBondContact O-CA 3.25Å; L247-H250 WeakPolarHBondContact O-CB 3.39Å; L247-H250 PolarHBondContact O-N 3.09Å; H250-R252 PolarHBondContact O-N 2.9Å; H250-R252 VanDerWaalsContact O-N 3.15Å; H250-V253 VanDerWaalsContact O-CB 3.24Å; H250-V253 WeakPolarHBondContact O-CB 3.39Å; H250-V253 WeakPolarHBondContact O-CG2 3.43Å; H250-V253 PolarHBondContact O-N 3.41Å; H250-H254 AromaticContact CE1-NE2 3.85Å; H250-H254 AromaticContact NE2-NE2 3.3Å; H250-H254 PolarHBondContact NE2-NE2 3.45Å
251	L	71.7	Confident	72.7	Confident	63 Å²	63	67.4 Å²	67.4	33%	0.33	37%	0.371	S	S	.	.	H	α-helix	trans	-59.3	-25.7	178.2	-69.3	174.3	0	0	0	112.5	L247 T248 V253 H254 T255	L247-L251 HydrophobicContact CD1-CD2 4.35Å; L247-L251 HydrophobicContact CD1-CG 4.3Å; L247-L251 HydrophobicContact CG-CG 4.48Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.39Å; T248-L251 PolarHBondContact O-N 2.87Å; L251-V253 PolarHBondContact O-N 2.98Å; L251-V253 VanDerWaalsContact O-N 3.14Å; L251-H254 PolarHBondContact O-N 3.18Å; L251-T255 PolarHBondContact O-N 2.76Å; L251-T255 PolarHBondContact O-OG1 3.48Å
252	R	78.7	Confident	72.9	Confident	54 Å²	54	65.1 Å²	65.1	20%	0.204	36%	0.361	C	S	.	.	H	α-helix	trans	-60.3	-21	172.6	-57.9	178.9	-174.3	173.1	-1.5	113.9	Q249 H250 H254 T255 G256 E257 S270	Q249-R252 WeakPolarHBondContact O-CB 3.07Å; Q249-R252 PolarHBondContact O-N 3.29Å; H250-R252 PolarHBondContact O-N 2.9Å; H250-R252 VanDerWaalsContact O-N 3.15Å; R252-H254 VanDerWaalsContact C-N 3.3Å; R252-T255 WeakPolarHBondContact CA-OG1 3.4Å; R252-G256 WeakPolarHBondContact O-CA 3.18Å; R252-G256 PolarHBondContact O-N 2.87Å; R252-E257 HydrophobicContact CG-CB 4.48Å; R252-S270 PolarHBondContact NH1-O 3.33Å; R252-S270 VanDerWaalsContact NH1-O 3.1Å
253	V	68.9	Low	73.2	Confident	94 Å²	94	68.7 Å²	68.7	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-69.2	-32.5	174.4	179.2	0	0	0	0	111.1	H250 L251	H250-V253 VanDerWaalsContact O-CB 3.24Å; H250-V253 WeakPolarHBondContact O-CB 3.39Å; H250-V253 WeakPolarHBondContact O-CG2 3.43Å; H250-V253 PolarHBondContact O-N 3.41Å; L251-V253 PolarHBondContact O-N 2.98Å; L251-V253 VanDerWaalsContact O-N 3.14Å
254	H	72.7	Confident	73.3	Confident	70 Å²	70	71.3 Å²	71.3	32%	0.324	40%	0.398	S	S	.	.	H	α-helix	trans	-90.5	-40.4	-179.5	-54.8	-51.8	0	0	0	112.1	C234 E236 C237 H250 L251 R252 G256	C234-H254 PolarHBondContact SG-NE2 2.98Å; C234-H254 VanDerWaalsContact SG-NE2 3.36Å; E236-H254 WeakPolarHBondContact OE2-CB 3.36Å; E236-H254 IonicContact OE2-CD2 3.34Å; E236-H254 PolarHBondContact OE2-CD2 3.45Å; E236-H254 IonicContact OE2-CG 3.97Å; E236-H254 IonicContact OE2-ND1 3.88Å; C237-H254 PolarHBondContact SG-NE2 3.43Å; C237-H254 VanDerWaalsContact SG-NE2 3.43Å; H250-H254 AromaticContact CE1-NE2 3.85Å; H250-H254 AromaticContact NE2-NE2 3.3Å; H250-H254 PolarHBondContact NE2-NE2 3.45Å; L251-H254 PolarHBondContact O-N 3.18Å; R252-H254 VanDerWaalsContact C-N 3.3Å; H254-G256 VanDerWaalsContact C-N 3.25Å; H254-G256 PolarHBondContact O-N 2.93Å
255	T	72	Confident	73.6	Confident	82 Å²	82	70.9 Å²	70.9	50%	0.503	40%	0.395	S	S	.	.	H	α-helix	trans	-75.3	-16.2	178	63.1	0	0	0	0	112.9	L251 R252 E257	L251-T255 PolarHBondContact O-N 2.76Å; L251-T255 PolarHBondContact O-OG1 3.48Å; R252-T255 WeakPolarHBondContact CA-OG1 3.4Å; T255-E257 PolarHBondContact O-N 3.05Å; T255-E257 WeakPolarHBondContact OG1-CG 3.49Å
256	G	70.4	Confident	73.7	Confident	47 Å²	47	70.2 Å²	70.2	49%	0.485	40%	0.398	S	S	.	.			trans	70.6	5.7	-177.5	0	0	0	0	0	114	R252 H254 K258	R252-G256 WeakPolarHBondContact O-CA 3.18Å; R252-G256 PolarHBondContact O-N 2.87Å; H254-G256 VanDerWaalsContact C-N 3.25Å; H254-G256 PolarHBondContact O-N 2.93Å; G256-K258 PolarHBondContact O-N 2.93Å
257	E	73.2	Confident	73.8	Confident	112 Å²	112	74.5 Å²	74.5	52%	0.523	41%	0.412	S	S	.	.			trans	-59.3	126.2	179.8	-75.2	178.3	-178.5	0	0	111.3	R252 T255 P259	R252-E257 HydrophobicContact CG-CB 4.48Å; T255-E257 PolarHBondContact O-N 3.05Å; T255-E257 WeakPolarHBondContact OG1-CG 3.49Å; E257-P259 WeakPolarHBondContact O-CD 3.17Å
258	K	77.8	Confident	74	Confident	119 Å²	119	75 Å²	75	52%	0.517	42%	0.42	S	S	.	.			trans	-125.8	75.2	178.6	-72	168.1	175.2	-176.3	0	110	G256 Y260 A268 F269	G256-K258 PolarHBondContact O-N 2.93Å; K258-Y260 PolarHBondContact O-N 3.23Å; K258-Y260 VanDerWaalsContact O-N 3.13Å; K258-A268 HydrophobicContact CB-CB 3.51Å; K258-A268 HydrophobicContact CD-CB 4.13Å; K258-A268 WeakPolarHBondContact CD-O 3.36Å; K258-A268 HydrophobicContact CG-CB 4.44Å; K258-F269 CarbonylContact C-O 3.52Å; K258-F269 VanDerWaalsContact C-O 3.24Å; K258-F269 VanDerWaalsContact CA-O 3.31Å; K258-F269 WeakPolarHBondContact CA-O 3.41Å
259	P	77.6	Confident	74.1	Confident	73 Å²	73	73.1 Å²	73.1	47%	0.474	41%	0.405	S	S	.	.			trans	-66.4	-17	-170.8	-21.7	34.9	0	0	0	114.3	E257	E257-P259 WeakPolarHBondContact O-CD 3.17Å
260	Y	76.8	Confident	74.1	Confident	70 Å²	70	70.8 Å²	70.8	28%	0.275	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	100.6	-172.9	-52.8	-73.4	0	0	0	110.2	K258 A268 F269 F271 T272	K258-Y260 PolarHBondContact O-N 3.23Å; K258-Y260 VanDerWaalsContact O-N 3.13Å; Y260-A268 CarbonylContact O-C 3.39Å; Y260-A268 WeakPolarHBondContact O-CA 3.37Å; Y260-F269 WeakPolarHBondContact CD2-O 3.41Å; Y260-F269 PolarHBondContact N-O 3.16Å; Y260-F269 VanDerWaalsContact N-O 3.12Å; Y260-F269 PolarHBondContact O-N 3.43Å; Y260-F271 VanDerWaalsContact CD2-C 3.46Å; Y260-T272 HydrophobicContact CD1-CG2 4.43Å; Y260-T272 HydrophobicContact CE1-CG2 4.49Å; Y260-T272 WeakPolarHBondContact CE1-OG1 3.36Å; Y260-T272 PolarHBondContact OH-OG1 3.47Å
261	I	72.1	Confident	74	Confident	108 Å²	108	72.6 Å²	72.6	55%	0.554	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.7	-177.1	-57	171.2	0	0	0	109.9	S263 A268	I261-S263 PolarHBondContact O-N 2.74Å; I261-A268 HydrophobicContact CG1-CB 3.95Å
262	C	79.2	Confident	73.9	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.404	C	S	.	.			trans	-76.4	117.6	170.7	-178.4	0	0	0	0	109.7	E264 C265 G266 K267 F269 L275 H282	C262-E264 PolarHBondContact O-N 3Å; C262-C265 VanDerWaalsContact SG-SG 3.66Å; C262-G266 VanDerWaalsContact O-CA 3.24Å; C262-G266 WeakPolarHBondContact O-CA 3.38Å; C262-G266 PolarHBondContact O-N 3.46Å; C262-K267 WeakPolarHBondContact CB-O 3.36Å; C262-K267 PolarHBondContact N-O 2.95Å; C262-F269 HydrophobicContact CB-CE2 4.38Å; C262-L275 HydrophobicContact CB-CD1 3.58Å; C262-H282 PolarHBondContact SG-NE2 2.82Å; C262-H282 VanDerWaalsContact SG-NE2 3.42Å
263	S	73.7	Confident	73.3	Confident	109 Å²	109	74.5 Å²	74.5	76%	0.762	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-30.4	178	45.1	0	0	0	0	113.5	I261	I261-S263 PolarHBondContact O-N 2.74Å
264	E	72	Confident	73.4	Confident	123 Å²	123	72.6 Å²	72.6	58%	0.575	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-27	-174.6	-64.8	177.8	-177.6	0	0	114.4	C262 H282	C262-E264 PolarHBondContact O-N 3Å; E264-H282 WeakPolarHBondContact OE2-CB 3.49Å; E264-H282 IonicContact OE2-CD2 2.92Å; E264-H282 PolarHBondContact OE2-CD2 3.09Å; E264-H282 IonicContact OE2-CG 3.06Å
265	C	75.6	Confident	73.5	Confident	51 Å²	51	70 Å²	70	35%	0.345	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	4	-176.4	76.8	0	0	0	0	114.5	C262 K267 H278 H282	C262-C265 VanDerWaalsContact SG-SG 3.66Å; C265-K267 PolarHBondContact O-N 3.21Å; C265-K267 VanDerWaalsContact O-N 3.1Å; C265-H278 PolarHBondContact SG-NE2 3.42Å; C265-H282 PolarHBondContact SG-NE2 3.24Å; C265-H282 VanDerWaalsContact SG-NE2 3.39Å
266	G	75	Confident	73.5	Confident	54 Å²	54	69.6 Å²	69.6	56%	0.557	40%	0.399	S	S	*	.			trans	68.5	2.6	179.4	0	0	0	0	0	115.3	C262 A268	C262-G266 VanDerWaalsContact O-CA 3.24Å; C262-G266 WeakPolarHBondContact O-CA 3.38Å; C262-G266 PolarHBondContact O-N 3.46Å; G266-A268 PolarHBondContact O-N 3.46Å
267	K	71.8	Confident	73.3	Confident	127 Å²	127	68.9 Å²	68.9	55%	0.552	39%	0.392	S	S	*	.			trans	-72.9	129.5	-178.3	-72.1	-178.8	-178.1	177.2	0	111.4	C262 C265 F269	C262-K267 WeakPolarHBondContact CB-O 3.36Å; C262-K267 PolarHBondContact N-O 2.95Å; C265-K267 PolarHBondContact O-N 3.21Å; C265-K267 VanDerWaalsContact O-N 3.1Å; K267-F269 HydrophobicContact CB-CE2 3.88Å; K267-F269 HydrophobicContact CB-CZ 3.97Å; K267-F269 WeakPolarHBondContact O-CD2 3.47Å; K267-F269 VanDerWaalsContact O-CE2 3.24Å; K267-F269 WeakPolarHBondContact O-CE2 3.33Å
268	A	78.5	Confident	73.2	Confident	35 Å²	35	64.9 Å²	64.9	29%	0.289	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.7	-178.7	0	0	0	0	0	112.4	K258 Y260 I261 G266	K258-A268 HydrophobicContact CB-CB 3.51Å; K258-A268 HydrophobicContact CD-CB 4.13Å; K258-A268 WeakPolarHBondContact CD-O 3.36Å; K258-A268 HydrophobicContact CG-CB 4.44Å; Y260-A268 CarbonylContact O-C 3.39Å; Y260-A268 WeakPolarHBondContact O-CA 3.37Å; I261-A268 HydrophobicContact CG1-CB 3.95Å; G266-A268 PolarHBondContact O-N 3.46Å
269	F	76.1	Confident	72.8	Confident	43 Å²	43	62.2 Å²	62.2	19%	0.189	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	148.5	-178	-58.1	-88.2	0	0	0	111.2	K258 Y260 C262 K267 F271 L275 H278	K258-F269 CarbonylContact C-O 3.52Å; K258-F269 VanDerWaalsContact C-O 3.24Å; K258-F269 VanDerWaalsContact CA-O 3.31Å; K258-F269 WeakPolarHBondContact CA-O 3.41Å; Y260-F269 WeakPolarHBondContact CD2-O 3.41Å; Y260-F269 PolarHBondContact N-O 3.16Å; Y260-F269 VanDerWaalsContact N-O 3.12Å; Y260-F269 PolarHBondContact O-N 3.43Å; C262-F269 HydrophobicContact CB-CE2 4.38Å; K267-F269 HydrophobicContact CB-CE2 3.88Å; K267-F269 HydrophobicContact CB-CZ 3.97Å; K267-F269 WeakPolarHBondContact O-CD2 3.47Å; K267-F269 VanDerWaalsContact O-CE2 3.24Å; K267-F269 WeakPolarHBondContact O-CE2 3.33Å; F269-F271 VanDerWaalsContact C-N 3.34Å; F269-L275 HydrophobicContact CB-CB 4.28Å; F269-L275 HydrophobicContact CD2-CB 3.89Å; F269-L275 HydrophobicContact CD2-CD1 3.67Å; F269-L275 HydrophobicContact CD2-CG 4.38Å; F269-L275 HydrophobicContact CE2-CD1 3.87Å; F269-L275 HydrophobicContact CG-CB 4.26Å; F269-H278 HydrophobicContact CE1-CB 3.9Å; F269-H278 HydrophobicContact CE2-CB 3.78Å; F269-H278 AromaticContact CE2-CD2 3.47Å; F269-H278 VanDerWaalsContact CE2-CD2 3.47Å; F269-H278 WeakPolarHBondContact CE2-CD2 3.28Å; F269-H278 AromaticContact CE2-CG 3.59Å; F269-H278 HydrophobicContact CZ-CB 3.38Å; F269-H278 AromaticContact CZ-CD2 3.48Å; F269-H278 VanDerWaalsContact CZ-CD2 3.48Å; F269-H278 WeakPolarHBondContact CZ-CD2 3.16Å; F269-H278 AromaticContact CZ-CG 3.15Å; F269-H278 AromaticContact CZ-ND1 3.61Å
270	S	69.6	Low	72.6	Confident	32 Å²	32	61.9 Å²	61.9	22%	0.224	35%	0.352	C	S	.	.	S	Bend	trans	-82.1	-14	177.8	53	0	0	0	0	113.4	R252	R252-S270 PolarHBondContact NH1-O 3.33Å; R252-S270 VanDerWaalsContact NH1-O 3.1Å
271	F	70.5	Confident	72.1	Confident	58 Å²	58	63.5 Å²	63.5	25%	0.254	36%	0.363	S	S	.	.	S	Bend	trans	-133.9	138.5	-178.9	-54	-95.8	0	0	0	111.6	Q249 Y260 F269 T273 S274 L275	Q249-F271 VanDerWaalsContact CD-CD1 3.46Å; Q249-F271 HydrophobicContact CG-CD1 3.79Å; Q249-F271 HydrophobicContact CG-CE1 3.25Å; Q249-F271 HydrophobicContact CG-CZ 4.06Å; Y260-F271 VanDerWaalsContact CD2-C 3.46Å; F269-F271 VanDerWaalsContact C-N 3.34Å; F271-T273 VanDerWaalsContact C-N 3.31Å; F271-T273 PolarHBondContact O-N 3.36Å; F271-S274 WeakPolarHBondContact O-CB 3.44Å; F271-S274 PolarHBondContact O-N 2.88Å; F271-S274 VanDerWaalsContact O-N 3.12Å; F271-L275 PolarHBondContact O-N 3.5Å; F271-L275 VanDerWaalsContact O-N 3.16Å
272	T	69.5	Low	71.9	Confident	51 Å²	51	62 Å²	62	31%	0.313	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-39	175.9	-39.2	0	0	0	0	112.3	Y260 S274 L275 I276	Y260-T272 HydrophobicContact CD1-CG2 4.43Å; Y260-T272 HydrophobicContact CE1-CG2 4.49Å; Y260-T272 WeakPolarHBondContact CE1-OG1 3.36Å; Y260-T272 PolarHBondContact OH-OG1 3.47Å; T272-S274 VanDerWaalsContact C-N 3.26Å; T272-S274 PolarHBondContact O-N 3.45Å; T272-L275 PolarHBondContact O-N 3.45Å; T272-L275 VanDerWaalsContact O-N 3.15Å; T272-I276 HydrophobicContact CG2-CD1 4.03Å; T272-I276 HydrophobicContact CG2-CG1 4.47Å; T272-I276 WeakPolarHBondContact O-CG1 3.47Å; T272-I276 PolarHBondContact O-N 3.07Å
273	T	67.3	Low	71.4	Confident	107 Å²	107	65.9 Å²	65.9	66%	0.656	38%	0.377	S	S	*	.	H	α-helix	trans	-63.3	-32.1	177.4	52.8	0	0	0	0	112.8	F271 G277	F271-T273 VanDerWaalsContact C-N 3.31Å; F271-T273 PolarHBondContact O-N 3.36Å; T273-G277 PolarHBondContact O-N 3.41Å
274	S	69.5	Low	71	Confident	53 Å²	53	62.8 Å²	62.8	37%	0.371	36%	0.362	S	S	.	.	H	α-helix	trans	-73.5	-37.7	174.3	-60.6	0	0	0	0	111.8	F271 T272 H278	F271-S274 WeakPolarHBondContact O-CB 3.44Å; F271-S274 PolarHBondContact O-N 2.88Å; F271-S274 VanDerWaalsContact O-N 3.12Å; T272-S274 VanDerWaalsContact C-N 3.26Å; T272-S274 PolarHBondContact O-N 3.45Å; S274-H278 VanDerWaalsContact O-CB 3.25Å; S274-H278 WeakPolarHBondContact O-CB 3.32Å; S274-H278 PolarHBondContact O-N 3.1Å
275	L	74.7	Confident	70.7	Confident	17 Å²	17	62.4 Å²	62.4	9%	0.089	36%	0.361	C	S	.	.	H	α-helix	trans	-64.4	-48.1	172.5	174.4	62	0	0	0	111.4	C262 F269 F271 T272 G277 H278 Q279	C262-L275 HydrophobicContact CB-CD1 3.58Å; F269-L275 HydrophobicContact CB-CB 4.28Å; F269-L275 HydrophobicContact CD2-CB 3.89Å; F269-L275 HydrophobicContact CD2-CD1 3.67Å; F269-L275 HydrophobicContact CD2-CG 4.38Å; F269-L275 HydrophobicContact CE2-CD1 3.87Å; F269-L275 HydrophobicContact CG-CB 4.26Å; F271-L275 PolarHBondContact O-N 3.5Å; F271-L275 VanDerWaalsContact O-N 3.16Å; T272-L275 PolarHBondContact O-N 3.45Å; T272-L275 VanDerWaalsContact O-N 3.15Å; L275-G277 VanDerWaalsContact C-N 3.34Å; L275-G277 PolarHBondContact O-N 3.15Å; L275-H278 CarbonylContact O-C 3.21Å; L275-H278 WeakPolarHBondContact O-CA 3.38Å; L275-H278 WeakPolarHBondContact O-CB 3.33Å; L275-H278 PolarHBondContact O-N 2.92Å; L275-Q279 HydrophobicContact CD1-CG 4.13Å; L275-Q279 HydrophobicContact CG-CG 4.47Å; L275-Q279 WeakPolarHBondContact O-CG 3.35Å; L275-Q279 PolarHBondContact O-N 3Å
276	I	72.1	Confident	70.5	Confident	72 Å²	72	66 Å²	66	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-44.5	177.4	-67	166.6	0	0	0	110.5	T272 H278 Q279 R280	T272-I276 HydrophobicContact CG2-CD1 4.03Å; T272-I276 HydrophobicContact CG2-CG1 4.47Å; T272-I276 WeakPolarHBondContact O-CG1 3.47Å; T272-I276 PolarHBondContact O-N 3.07Å; I276-H278 VanDerWaalsContact C-N 3.26Å; I276-H278 PolarHBondContact O-N 3.11Å; I276-Q279 PolarHBondContact O-N 3.35Å; I276-R280 WeakPolarHBondContact O-CG 3.36Å; I276-R280 PolarHBondContact O-N 3.19Å
277	G	66.5	Low	70.5	Confident	33 Å²	33	67 Å²	67	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-32.7	174.4	0	0	0	0	0	113.2	T273 L275	T273-G277 PolarHBondContact O-N 3.41Å; L275-G277 VanDerWaalsContact C-N 3.34Å; L275-G277 PolarHBondContact O-N 3.15Å
278	H	72.1	Confident	70.6	Confident	27 Å²	27	64.7 Å²	64.7	13%	0.125	35%	0.352	C	S	.	.	H	α-helix	trans	-73.4	-41.5	175	174.5	71	0	0	0	112.8	C265 F269 S274 L275 I276 R280 M281 H282	C265-H278 PolarHBondContact SG-NE2 3.42Å; F269-H278 HydrophobicContact CE1-CB 3.9Å; F269-H278 HydrophobicContact CE2-CB 3.78Å; F269-H278 AromaticContact CE2-CD2 3.47Å; F269-H278 VanDerWaalsContact CE2-CD2 3.47Å; F269-H278 WeakPolarHBondContact CE2-CD2 3.28Å; F269-H278 AromaticContact CE2-CG 3.59Å; F269-H278 HydrophobicContact CZ-CB 3.38Å; F269-H278 AromaticContact CZ-CD2 3.48Å; F269-H278 VanDerWaalsContact CZ-CD2 3.48Å; F269-H278 WeakPolarHBondContact CZ-CD2 3.16Å; F269-H278 AromaticContact CZ-CG 3.15Å; F269-H278 AromaticContact CZ-ND1 3.61Å; S274-H278 VanDerWaalsContact O-CB 3.25Å; S274-H278 WeakPolarHBondContact O-CB 3.32Å; S274-H278 PolarHBondContact O-N 3.1Å; L275-H278 CarbonylContact O-C 3.21Å; L275-H278 WeakPolarHBondContact O-CA 3.38Å; L275-H278 WeakPolarHBondContact O-CB 3.33Å; L275-H278 PolarHBondContact O-N 2.92Å; I276-H278 VanDerWaalsContact C-N 3.26Å; I276-H278 PolarHBondContact O-N 3.11Å; H278-R280 PolarHBondContact O-N 3.47Å; H278-M281 WeakPolarHBondContact O-CA 3.44Å; H278-M281 WeakPolarHBondContact O-CB 3.44Å; H278-M281 VanDerWaalsContact O-CG 3.24Å; H278-M281 WeakPolarHBondContact O-CG 3.49Å; H278-M281 PolarHBondContact O-N 3.47Å; H278-H282 AromaticContact NE2-CE1 3.95Å; H278-H282 AromaticContact NE2-NE2 3.36Å; H278-H282 PolarHBondContact NE2-NE2 3.08Å
279	Q	69.1	Low	70.4	Confident	63 Å²	63	69.6 Å²	69.6	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-59.9	-31.6	178.1	-76.6	171	-41.2	0	0	112.2	L275 I276 M281 H282 T283	L275-Q279 HydrophobicContact CD1-CG 4.13Å; L275-Q279 HydrophobicContact CG-CG 4.47Å; L275-Q279 WeakPolarHBondContact O-CG 3.35Å; L275-Q279 PolarHBondContact O-N 3Å; I276-Q279 PolarHBondContact O-N 3.35Å; Q279-M281 PolarHBondContact O-N 3.1Å; Q279-H282 PolarHBondContact O-N 2.88Å; Q279-T283 PolarHBondContact O-N 3.4Å; Q279-T283 PolarHBondContact O-OG1 3.21Å
280	R	73.6	Confident	70.7	Confident	66 Å²	66	67.6 Å²	67.6	25%	0.249	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-12	169.8	-64.6	173.7	-173.8	177.3	1.4	114.2	I276 H278 K298	I276-R280 WeakPolarHBondContact O-CG 3.36Å; I276-R280 PolarHBondContact O-N 3.19Å; H278-R280 PolarHBondContact O-N 3.47Å; R280-K298 PolarHBondContact NH1-O 2.99Å
281	M	64.6	Low	71.1	Confident	104 Å²	104	75.2 Å²	75.2	51%	0.512	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-32.3	171.9	-62.9	-68.4	-54.8	0	0	112.4	H278 Q279 K298	H278-M281 WeakPolarHBondContact O-CA 3.44Å; H278-M281 WeakPolarHBondContact O-CB 3.44Å; H278-M281 VanDerWaalsContact O-CG 3.24Å; H278-M281 WeakPolarHBondContact O-CG 3.49Å; H278-M281 PolarHBondContact O-N 3.47Å; Q279-M281 PolarHBondContact O-N 3.1Å; M281-K298 HydrophobicContact SD-CD 3.45Å; M281-K298 WeakPolarHBondContact SD-CD 3.4Å; M281-K298 PolarHBondContact SD-NZ 2.95Å
282	H	69.8	Low	71.4	Confident	78 Å²	78	78.5 Å²	78.5	36%	0.361	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-43.1	-176.9	-56.4	-50.6	0	0	0	111.8	C262 E264 C265 H278 Q279 G284	C262-H282 PolarHBondContact SG-NE2 2.82Å; C262-H282 VanDerWaalsContact SG-NE2 3.42Å; E264-H282 WeakPolarHBondContact OE2-CB 3.49Å; E264-H282 IonicContact OE2-CD2 2.92Å; E264-H282 PolarHBondContact OE2-CD2 3.09Å; E264-H282 IonicContact OE2-CG 3.06Å; C265-H282 PolarHBondContact SG-NE2 3.24Å; C265-H282 VanDerWaalsContact SG-NE2 3.39Å; H278-H282 AromaticContact NE2-CE1 3.95Å; H278-H282 AromaticContact NE2-NE2 3.36Å; H278-H282 PolarHBondContact NE2-NE2 3.08Å; Q279-H282 PolarHBondContact O-N 2.88Å; H282-G284 PolarHBondContact O-N 3.09Å
283	T	67.8	Low	71.9	Confident	80 Å²	80	78.6 Å²	78.6	49%	0.491	41%	0.405	S	S	.	.	S	Bend	trans	-72.4	-12.5	177.1	61.3	0	0	0	0	113.5	Q279 E285	Q279-T283 PolarHBondContact O-N 3.4Å; Q279-T283 PolarHBondContact O-OG1 3.21Å; T283-E285 PolarHBondContact O-N 3.34Å; T283-E285 VanDerWaalsContact O-N 3.13Å; T283-E285 WeakPolarHBondContact OG1-CG 3.47Å
284	G	64.4	Low	72.3	Confident	44 Å²	44	75.1 Å²	75.1	45%	0.454	39%	0.391	S	S	.	.			trans	69.8	2.7	-176.8	0	0	0	0	0	114.4	H282 R286	H282-G284 PolarHBondContact O-N 3.09Å; G284-R286 WeakPolarHBondContact O-CG 3.4Å; G284-R286 PolarHBondContact O-N 2.92Å
285	E	66.6	Low	72.6	Confident	116 Å²	116	78.7 Å²	78.7	54%	0.542	40%	0.4	S	S	.	.			trans	-59.6	126.4	-179.6	-74.2	-172.8	168.8	0	0	111.8	T283	T283-E285 PolarHBondContact O-N 3.34Å; T283-E285 VanDerWaalsContact O-N 3.13Å; T283-E285 WeakPolarHBondContact OG1-CG 3.47Å
286	R	70.7	Confident	72.7	Confident	127 Å²	127	80.3 Å²	80.3	48%	0.479	41%	0.411	S	S	.	.			trans	-128.9	75.8	178.9	-68.5	166.1	100	141.2	7.1	108.7	G284 Y288 T296 F297 K298	G284-R286 WeakPolarHBondContact O-CG 3.4Å; G284-R286 PolarHBondContact O-N 2.92Å; R286-Y288 PolarHBondContact O-N 2.85Å; R286-T296 VanDerWaalsContact CB-CB 3.42Å; R286-T296 WeakPolarHBondContact CB-OG1 3.38Å; R286-T296 WeakPolarHBondContact CD-OG1 3.4Å; R286-T296 PolarHBondContact NE-O 3.47Å; R286-T296 PolarHBondContact NH2-O 3.28Å; R286-F297 CarbonylContact C-O 3.58Å; R286-F297 VanDerWaalsContact CA-O 3.28Å; R286-F297 WeakPolarHBondContact CA-O 3.46Å; R286-K298 HydrophobicContact CG-CG 3.91Å
287	P	75	Confident	72.8	Confident	74 Å²	74	78.5 Å²	78.5	48%	0.481	40%	0.4	S	S	.	.			trans	-61.5	-21	-168.9	-24.3	35.2	0	0	0	113.9
288	Y	74.3	Confident	72.9	Confident	78 Å²	78	80 Å²	80	31%	0.306	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	98	-173.2	-56.2	-79.5	0	0	0	110.5	R286 T296 F297 G299	R286-Y288 PolarHBondContact O-N 2.85Å; Y288-T296 CarbonylContact O-C 3.35Å; Y288-T296 WeakPolarHBondContact O-CA 3.41Å; Y288-F297 PolarHBondContact N-O 3.43Å; Y288-F297 WeakPolarHBondContact O-CD2 3.43Å; Y288-F297 PolarHBondContact O-N 3.37Å; Y288-G299 VanDerWaalsContact CD2-CA 3.47Å
289	K	74.9	Confident	72.7	Confident	139 Å²	139	79.9 Å²	79.9	60%	0.604	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.5	178.9	-172.7	174.9	179.2	-178.4	0	111.8	K291 T296	K289-K291 PolarHBondContact O-N 3.08Å; K289-T296 HydrophobicContact CB-CG2 4.05Å; K289-T296 HydrophobicContact CD-CG2 4.44Å; K289-T296 HydrophobicContact CG-CG2 3.95Å
290	C	82.4	Confident	72.9	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	41%	0.407	C	S	.	.			trans	-72.1	123.9	168.6	177.5	0	0	0	0	109.7	E292 C293 G294 K295 F297 L303	C290-E292 VanDerWaalsContact C-N 3.32Å; C290-E292 PolarHBondContact O-N 3.2Å; C290-C293 VanDerWaalsContact SG-SG 3.62Å; C290-G294 WeakPolarHBondContact O-CA 3.34Å; C290-G294 PolarHBondContact O-N 2.82Å; C290-K295 WeakPolarHBondContact CB-O 3.39Å; C290-K295 PolarHBondContact N-O 3.09Å; C290-F297 HydrophobicContact CB-CE2 4.15Å; C290-L303 HydrophobicContact CB-CD1 3.69Å
291	K	77.6	Confident	72.7	Confident	193 Å²	193	80.2 Å²	80.2	84%	0.839	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.8	-179.7	-64.7	-175.4	177.8	-177.5	0	113	K289	K289-K291 PolarHBondContact O-N 3.08Å
292	E	77.9	Confident	73.1	Confident	127 Å²	127	78.2 Å²	78.2	59%	0.593	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-38.6	-173.9	-66.8	169.7	151.4	0	0	113.9	C290 H310	C290-E292 VanDerWaalsContact C-N 3.32Å; C290-E292 PolarHBondContact O-N 3.2Å; E292-H310 WeakPolarHBondContact OE2-CB 3.36Å; E292-H310 IonicContact OE2-CD2 3.91Å; E292-H310 PolarHBondContact OE2-CD2 2.85Å; E292-H310 IonicContact OE2-CG 3.82Å
293	C	78.8	Confident	73.5	Confident	52 Å²	52	75.6 Å²	75.6	35%	0.351	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	4.7	-177.6	74.4	0	0	0	0	114.2	C290 K295 H306 H310	C290-C293 VanDerWaalsContact SG-SG 3.62Å; C293-K295 PolarHBondContact O-N 3.14Å; C293-H306 PolarHBondContact SG-NE2 3.15Å; C293-H310 PolarHBondContact SG-NE2 2.93Å; C293-H310 VanDerWaalsContact SG-NE2 3.4Å
294	G	76.7	Confident	73.8	Confident	35 Å²	35	75.8 Å²	75.8	36%	0.361	40%	0.404	S	S	.	.			trans	70.7	-5.6	177.7	0	0	0	0	0	115.8	C290	C290-G294 WeakPolarHBondContact O-CA 3.34Å; C290-G294 PolarHBondContact O-N 2.82Å
295	K	75	Confident	74.2	Confident	127 Å²	127	76.2 Å²	76.2	55%	0.552	40%	0.396	S	S	*	.			trans	-63.7	139.1	-179.5	-71.7	-179.1	-178.7	176	0	111.8	C290 C293 F297	C290-K295 WeakPolarHBondContact CB-O 3.39Å; C290-K295 PolarHBondContact N-O 3.09Å; C293-K295 PolarHBondContact O-N 3.14Å; K295-F297 HydrophobicContact CB-CE2 3.91Å; K295-F297 HydrophobicContact CB-CZ 4Å; K295-F297 WeakPolarHBondContact O-CE2 3.4Å
296	T	76.1	Confident	74.8	Confident	52 Å²	52	71.5 Å²	71.5	32%	0.319	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	144	-176.2	58.6	0	0	0	0	112	R286 Y288 K289	R286-T296 VanDerWaalsContact CB-CB 3.42Å; R286-T296 WeakPolarHBondContact CB-OG1 3.38Å; R286-T296 WeakPolarHBondContact CD-OG1 3.4Å; R286-T296 PolarHBondContact NE-O 3.47Å; R286-T296 PolarHBondContact NH2-O 3.28Å; Y288-T296 CarbonylContact O-C 3.35Å; Y288-T296 WeakPolarHBondContact O-CA 3.41Å; K289-T296 HydrophobicContact CB-CG2 4.05Å; K289-T296 HydrophobicContact CD-CG2 4.44Å; K289-T296 HydrophobicContact CG-CG2 3.95Å
297	F	74.9	Confident	75.1	Confident	34 Å²	34	69 Å²	69	15%	0.149	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.1	-173.9	-60	-89.2	0	0	0	111.6	R286 Y288 C290 K295 L303 H306	R286-F297 CarbonylContact C-O 3.58Å; R286-F297 VanDerWaalsContact CA-O 3.28Å; R286-F297 WeakPolarHBondContact CA-O 3.46Å; Y288-F297 PolarHBondContact N-O 3.43Å; Y288-F297 WeakPolarHBondContact O-CD2 3.43Å; Y288-F297 PolarHBondContact O-N 3.37Å; C290-F297 HydrophobicContact CB-CE2 4.15Å; K295-F297 HydrophobicContact CB-CE2 3.91Å; K295-F297 HydrophobicContact CB-CZ 4Å; K295-F297 WeakPolarHBondContact O-CE2 3.4Å; F297-L303 HydrophobicContact CB-CB 4.21Å; F297-L303 HydrophobicContact CD2-CB 3.95Å; F297-L303 HydrophobicContact CD2-CD1 3.66Å; F297-L303 HydrophobicContact CD2-CG 4.4Å; F297-L303 HydrophobicContact CE2-CD1 3.88Å; F297-L303 HydrophobicContact CG-CB 4.18Å; F297-H306 HydrophobicContact CD1-CB 4.48Å; F297-H306 HydrophobicContact CE1-CB 3.66Å; F297-H306 AromaticContact CE1-CG 3.83Å; F297-H306 HydrophobicContact CE2-CB 3.9Å; F297-H306 AromaticContact CE2-CD2 3.36Å; F297-H306 WeakPolarHBondContact CE2-CD2 3.42Å; F297-H306 AromaticContact CE2-CG 3.6Å; F297-H306 HydrophobicContact CZ-CB 3.36Å; F297-H306 AromaticContact CZ-CD2 3.3Å; F297-H306 WeakPolarHBondContact CZ-CD2 3.46Å; F297-H306 AromaticContact CZ-CE1 3.96Å; F297-H306 AromaticContact CZ-CG 3.06Å; F297-H306 AromaticContact CZ-ND1 3.52Å; F297-H306 AromaticContact CZ-NE2 3.84Å
298	K	67.9	Low	75.3	Confident	65 Å²	65	67.7 Å²	67.7	28%	0.283	35%	0.353	S	S	.	.	S	Bend	trans	-79.5	-21.5	-177.9	-62.7	-176.7	172.6	-177.1	0	113.3	R280 M281 R286	R280-K298 PolarHBondContact NH1-O 2.99Å; M281-K298 HydrophobicContact SD-CD 3.45Å; M281-K298 WeakPolarHBondContact SD-CD 3.4Å; M281-K298 PolarHBondContact SD-NZ 2.95Å; R286-K298 HydrophobicContact CG-CG 3.91Å
299	G	69.5	Low	75.5	Confident	23 Å²	23	69.6 Å²	69.6	24%	0.237	37%	0.368	C	S	.	.	S	Bend	trans	-142	152.6	179.3	0	0	0	0	0	112.5	Y288 S301 S302 L303	Y288-G299 VanDerWaalsContact CD2-CA 3.47Å; G299-S301 PolarHBondContact O-N 3.39Å; G299-S302 WeakPolarHBondContact O-CB 3.49Å; G299-S302 PolarHBondContact O-N 3.12Å; G299-L303 PolarHBondContact O-N 3.16Å
300	S	71.5	Confident	75.6	Confident	55 Å²	55	66.6 Å²	66.6	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-41.5	180	56.5	0	0	0	0	112.4	S302 L303 I304	S300-S302 VanDerWaalsContact C-N 3.25Å; S300-S302 PolarHBondContact O-N 2.89Å; S300-L303 WeakPolarHBondContact O-CB 3.48Å; S300-L303 PolarHBondContact O-N 3.47Å; S300-L303 VanDerWaalsContact O-N 3.11Å; S300-I304 WeakPolarHBondContact O-CG1 3.47Å; S300-I304 PolarHBondContact O-N 3.11Å
301	S	69.4	Low	75.3	Confident	82 Å²	82	70.4 Å²	70.4	57%	0.573	38%	0.379	S	S	*	.	H	α-helix	trans	-60.9	-34	177.4	-42	0	0	0	0	112.6	G299 N305	G299-S301 PolarHBondContact O-N 3.39Å; S301-N305 WeakPolarHBondContact O-CB 3.34Å; S301-N305 VanDerWaalsContact O-CG 3.31Å; S301-N305 PolarHBondContact O-N 3.47Å; S301-N305 PolarHBondContact O-ND2 3.43Å
302	S	74.2	Confident	75.2	Confident	62 Å²	62	63.5 Å²	63.5	43%	0.434	36%	0.362	S	S	.	.	H	α-helix	trans	-70.7	-38.6	175.5	-55.3	0	0	0	0	112	G299 S300 H306	G299-S302 WeakPolarHBondContact O-CB 3.49Å; G299-S302 PolarHBondContact O-N 3.12Å; S300-S302 VanDerWaalsContact C-N 3.25Å; S300-S302 PolarHBondContact O-N 2.89Å; S302-H306 WeakPolarHBondContact O-CB 3.36Å; S302-H306 PolarHBondContact O-N 2.96Å
303	L	77.9	Confident	75.1	Confident	22 Å²	22	62.8 Å²	62.8	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-46	173.3	172.4	62.2	0	0	0	111.2	C290 F297 G299 S300 N305 H306 Q307	C290-L303 HydrophobicContact CB-CD1 3.69Å; F297-L303 HydrophobicContact CB-CB 4.21Å; F297-L303 HydrophobicContact CD2-CB 3.95Å; F297-L303 HydrophobicContact CD2-CD1 3.66Å; F297-L303 HydrophobicContact CD2-CG 4.4Å; F297-L303 HydrophobicContact CE2-CD1 3.88Å; F297-L303 HydrophobicContact CG-CB 4.18Å; G299-L303 PolarHBondContact O-N 3.16Å; S300-L303 WeakPolarHBondContact O-CB 3.48Å; S300-L303 PolarHBondContact O-N 3.47Å; S300-L303 VanDerWaalsContact O-N 3.11Å; L303-N305 VanDerWaalsContact C-N 3.35Å; L303-N305 PolarHBondContact O-N 2.83Å; L303-H306 CarbonylContact O-C 3.59Å; L303-H306 WeakPolarHBondContact O-CA 3.4Å; L303-H306 WeakPolarHBondContact O-CB 3.5Å; L303-H306 PolarHBondContact O-N 2.91Å; L303-H306 VanDerWaalsContact O-N 3.07Å; L303-Q307 HydrophobicContact CD1-CG 4.19Å; L303-Q307 WeakPolarHBondContact O-CG 3.26Å; L303-Q307 PolarHBondContact O-N 3.29Å
304	I	74.9	Confident	74.9	Confident	85 Å²	85	66 Å²	66	44%	0.436	37%	0.367	S	S	.	.	H	α-helix	trans	-59.3	-46.5	177.5	-67.5	166.6	0	0	0	110.6	S300 H306 Q307 R308	S300-I304 WeakPolarHBondContact O-CG1 3.47Å; S300-I304 PolarHBondContact O-N 3.11Å; I304-H306 VanDerWaalsContact C-N 3.25Å; I304-H306 PolarHBondContact O-N 3.13Å; I304-Q307 PolarHBondContact O-N 3.12Å; I304-R308 PolarHBondContact O-N 3.42Å
305	N	72.8	Confident	74.7	Confident	52 Å²	52	67.8 Å²	67.8	28%	0.278	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-32.5	176	-76.2	-29	0	0	0	112.8	S301 L303 R308	S301-N305 WeakPolarHBondContact O-CB 3.34Å; S301-N305 VanDerWaalsContact O-CG 3.31Å; S301-N305 PolarHBondContact O-N 3.47Å; S301-N305 PolarHBondContact O-ND2 3.43Å; L303-N305 VanDerWaalsContact C-N 3.35Å; L303-N305 PolarHBondContact O-N 2.83Å; N305-R308 PolarHBondContact OD1-NH1 3.33Å
306	H	78.8	Confident	74.6	Confident	18 Å²	18	65.4 Å²	65.4	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-72.1	-39.6	175.6	169.8	71.3	0	0	0	112.6	C293 F297 S302 L303 I304 R308 I309 H310	C293-H306 PolarHBondContact SG-NE2 3.15Å; F297-H306 HydrophobicContact CD1-CB 4.48Å; F297-H306 HydrophobicContact CE1-CB 3.66Å; F297-H306 AromaticContact CE1-CG 3.83Å; F297-H306 HydrophobicContact CE2-CB 3.9Å; F297-H306 AromaticContact CE2-CD2 3.36Å; F297-H306 WeakPolarHBondContact CE2-CD2 3.42Å; F297-H306 AromaticContact CE2-CG 3.6Å; F297-H306 HydrophobicContact CZ-CB 3.36Å; F297-H306 AromaticContact CZ-CD2 3.3Å; F297-H306 WeakPolarHBondContact CZ-CD2 3.46Å; F297-H306 AromaticContact CZ-CE1 3.96Å; F297-H306 AromaticContact CZ-CG 3.06Å; F297-H306 AromaticContact CZ-ND1 3.52Å; F297-H306 AromaticContact CZ-NE2 3.84Å; S302-H306 WeakPolarHBondContact O-CB 3.36Å; S302-H306 PolarHBondContact O-N 2.96Å; L303-H306 CarbonylContact O-C 3.59Å; L303-H306 WeakPolarHBondContact O-CA 3.4Å; L303-H306 WeakPolarHBondContact O-CB 3.5Å; L303-H306 PolarHBondContact O-N 2.91Å; L303-H306 VanDerWaalsContact O-N 3.07Å; I304-H306 VanDerWaalsContact C-N 3.25Å; I304-H306 PolarHBondContact O-N 3.13Å; H306-R308 PolarHBondContact O-N 3.02Å; H306-I309 VanDerWaalsContact O-CB 3.23Å; H306-I309 WeakPolarHBondContact O-CB 3.41Å; H306-I309 WeakPolarHBondContact O-CG1 3.49Å; H306-I309 PolarHBondContact O-N 2.79Å; H306-H310 AromaticContact CD2-NE2 3.89Å; H306-H310 AromaticContact CE1-NE2 3.58Å; H306-H310 AromaticContact NE2-CD2 3.94Å; H306-H310 AromaticContact NE2-CE1 3.99Å; H306-H310 AromaticContact NE2-NE2 3.08Å; H306-H310 PolarHBondContact NE2-NE2 3.11Å
307	Q	76.1	Confident	73.9	Confident	73 Å²	73	69.8 Å²	69.8	34%	0.341	38%	0.375	S	S	.	.	H	α-helix	trans	-58.6	-30.3	177.2	-76.4	172.8	-34.9	0	0	112.3	L303 I304 I309 H310 T311	L303-Q307 HydrophobicContact CD1-CG 4.19Å; L303-Q307 WeakPolarHBondContact O-CG 3.26Å; L303-Q307 PolarHBondContact O-N 3.29Å; I304-Q307 PolarHBondContact O-N 3.12Å; Q307-I309 PolarHBondContact O-N 2.78Å; Q307-H310 PolarHBondContact O-N 3.02Å; Q307-T311 PolarHBondContact O-N 3.27Å; Q307-T311 VanDerWaalsContact O-N 3.11Å; Q307-T311 PolarHBondContact O-OG1 3.14Å
308	R	80.3	Confident	73.8	Confident	47 Å²	47	68.2 Å²	68.2	18%	0.177	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-17.8	172.6	-64.3	178.3	-175.8	169.1	2.9	114.3	I304 N305 H306 T311 G312 E313 S326	I304-R308 PolarHBondContact O-N 3.42Å; N305-R308 PolarHBondContact OD1-NH1 3.33Å; H306-R308 PolarHBondContact O-N 3.02Å; R308-T311 WeakPolarHBondContact CA-OG1 3.47Å; R308-G312 CarbonylContact O-C 3.56Å; R308-G312 WeakPolarHBondContact O-CA 3.44Å; R308-G312 PolarHBondContact O-N 3.5Å; R308-G312 VanDerWaalsContact O-N 3.11Å; R308-E313 HydrophobicContact CG-CB 4.43Å; R308-E313 PolarHBondContact O-N 3.3Å; R308-S326 PolarHBondContact NH1-O 3.12Å
309	I	77.4	Confident	74	Confident	119 Å²	119	72.5 Å²	72.5	61%	0.61	39%	0.394	S	S	*	.	H	α-helix	trans	-72.8	-38.8	174.1	-59.4	175.8	0	0	0	110.5	H306 Q307	H306-I309 VanDerWaalsContact O-CB 3.23Å; H306-I309 WeakPolarHBondContact O-CB 3.41Å; H306-I309 WeakPolarHBondContact O-CG1 3.49Å; H306-I309 PolarHBondContact O-N 2.79Å; Q307-I309 PolarHBondContact O-N 2.78Å
310	H	76.9	Confident	74.1	Confident	76 Å²	76	77.1 Å²	77.1	35%	0.352	41%	0.409	S	S	.	.	H	α-helix	trans	-79.8	-41.4	-178.4	-57	-54.7	0	0	0	111.6	E292 C293 H306 Q307 G312	E292-H310 WeakPolarHBondContact OE2-CB 3.36Å; E292-H310 IonicContact OE2-CD2 3.91Å; E292-H310 PolarHBondContact OE2-CD2 2.85Å; E292-H310 IonicContact OE2-CG 3.82Å; C293-H310 PolarHBondContact SG-NE2 2.93Å; C293-H310 VanDerWaalsContact SG-NE2 3.4Å; H306-H310 AromaticContact CD2-NE2 3.89Å; H306-H310 AromaticContact CE1-NE2 3.58Å; H306-H310 AromaticContact NE2-CD2 3.94Å; H306-H310 AromaticContact NE2-CE1 3.99Å; H306-H310 AromaticContact NE2-NE2 3.08Å; H306-H310 PolarHBondContact NE2-NE2 3.11Å; Q307-H310 PolarHBondContact O-N 3.02Å; H310-G312 VanDerWaalsContact C-N 3.26Å; H310-G312 PolarHBondContact O-N 3.17Å
311	T	76	Confident	74.4	Confident	80 Å²	80	77.4 Å²	77.4	49%	0.491	41%	0.411	S	S	.	.	H	α-helix	trans	-76	-16	176.8	63.7	0	0	0	0	113.1	Q307 R308 E313	Q307-T311 PolarHBondContact O-N 3.27Å; Q307-T311 VanDerWaalsContact O-N 3.11Å; Q307-T311 PolarHBondContact O-OG1 3.14Å; R308-T311 WeakPolarHBondContact CA-OG1 3.47Å; T311-E313 PolarHBondContact O-N 3.39Å; T311-E313 WeakPolarHBondContact OG1-CG 3.27Å; T311-E313 PolarHBondContact OG1-N 2.89Å
312	G	77	Confident	74.7	Confident	47 Å²	47	76.3 Å²	76.3	49%	0.485	41%	0.412	S	S	.	.			trans	68.6	6.7	-174.5	0	0	0	0	0	114.2	R308 H310 K314	R308-G312 CarbonylContact O-C 3.56Å; R308-G312 WeakPolarHBondContact O-CA 3.44Å; R308-G312 PolarHBondContact O-N 3.5Å; R308-G312 VanDerWaalsContact O-N 3.11Å; H310-G312 VanDerWaalsContact C-N 3.26Å; H310-G312 PolarHBondContact O-N 3.17Å; G312-K314 PolarHBondContact O-N 3.13Å
313	E	74.3	Confident	74.6	Confident	113 Å²	113	80.8 Å²	80.8	53%	0.528	42%	0.42	S	S	.	.			trans	-61.9	123.9	-178.3	-76.1	-178.6	177.5	0	0	111.7	R308 T311 P315	R308-E313 HydrophobicContact CG-CB 4.43Å; R308-E313 PolarHBondContact O-N 3.3Å; T311-E313 PolarHBondContact O-N 3.39Å; T311-E313 WeakPolarHBondContact OG1-CG 3.27Å; T311-E313 PolarHBondContact OG1-N 2.89Å; E313-P315 WeakPolarHBondContact O-CD 3.24Å
314	K	75.6	Confident	74.3	Confident	119 Å²	119	81 Å²	81	52%	0.517	42%	0.424	S	S	.	.			trans	-125.2	79.8	176.5	-70.3	167	175.5	-178.1	0	109.3	G312 Y316 A324 F325	G312-K314 PolarHBondContact O-N 3.13Å; K314-Y316 PolarHBondContact O-N 3.13Å; K314-A324 HydrophobicContact CB-CB 3.46Å; K314-A324 VanDerWaalsContact CB-CB 3.46Å; K314-A324 HydrophobicContact CD-CB 4.04Å; K314-A324 WeakPolarHBondContact CD-O 3.44Å; K314-A324 HydrophobicContact CG-CB 4.36Å; K314-F325 CarbonylContact C-O 3.57Å; K314-F325 VanDerWaalsContact C-O 3.28Å; K314-F325 VanDerWaalsContact CA-O 3.31Å; K314-F325 WeakPolarHBondContact CA-O 3.37Å
315	P	72.3	Confident	74.1	Confident	72 Å²	72	78.7 Å²	78.7	47%	0.468	41%	0.411	S	S	.	.			trans	-64.3	-22.5	-172.7	-22.8	34.7	0	0	0	113.8	E313	E313-P315 WeakPolarHBondContact O-CD 3.24Å
316	Y	72.9	Confident	73.9	Confident	78 Å²	78	78.1 Å²	78.1	31%	0.306	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	98.4	-172	-54.9	-76.7	0	0	0	110.1	K314 A324 F325 C328	K314-Y316 PolarHBondContact O-N 3.13Å; Y316-A324 CarbonylContact O-C 3.53Å; Y316-A324 WeakPolarHBondContact O-CA 3.39Å; Y316-F325 PolarHBondContact N-O 2.92Å; Y316-F325 VanDerWaalsContact N-O 3.15Å; Y316-F325 PolarHBondContact O-N 3.4Å; Y316-C328 HydrophobicContact CD1-CB 3.85Å; Y316-C328 HydrophobicContact CD2-CB 4.49Å; Y316-C328 HydrophobicContact CE1-CB 3.61Å; Y316-C328 HydrophobicContact CE2-CB 4.26Å; Y316-C328 HydrophobicContact CG-CB 4.28Å
317	K	61.2	Low	73.4	Confident	144 Å²	144	80.8 Å²	80.8	63%	0.626	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.3	-179.8	-62.5	-177.6	-179.8	178.4	0	111	A324	K317-A324 HydrophobicContact CG-CB 3.84Å
318	C	72.1	Confident	72.9	Confident	1 Å²	1	80 Å²	80	1%	0.007	43%	0.426	C	S	.	.			trans	-82.9	124.2	168.5	-177.4	0	0	0	0	109	E320 G322 R323 L331	C318-E320 VanDerWaalsContact C-N 3.28Å; C318-E320 PolarHBondContact O-N 3.42Å; C318-G322 WeakPolarHBondContact O-CA 3.02Å; C318-G322 PolarHBondContact O-N 2.81Å; C318-R323 WeakPolarHBondContact CB-O 3.33Å; C318-R323 PolarHBondContact N-O 3.42Å; C318-L331 HydrophobicContact CB-CD1 3.7Å
319	N	72.1	Confident	72.2	Confident	154 Å²	154	81.3 Å²	81.3	82%	0.824	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-20.4	-178.5	-64.7	-17.4	0	0	0	112.9
320	E	73.6	Confident	71.8	Confident	120 Å²	120	77.4 Å²	77.4	56%	0.561	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-36.6	-175.6	-65	178.6	-133.8	0	0	113.8	C318 H335 H338	C318-E320 VanDerWaalsContact C-N 3.28Å; C318-E320 PolarHBondContact O-N 3.42Å; E320-H335 IonicContact OE1-ND1 3.84Å; E320-H338 WeakPolarHBondContact OE2-CB 3.43Å; E320-H338 IonicContact OE2-CD2 2.97Å; E320-H338 IonicContact OE2-CG 3.08Å; E320-H338 IonicContact OE2-ND1 3.84Å; E320-H338 PolarHBondContact OE2-ND1 3.44Å
321	C	77.8	Confident	71.5	Confident	62 Å²	62	74.8 Å²	74.8	42%	0.419	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	5.7	179.4	67.3	0	0	0	0	114.2	R323 H334 H338	C321-R323 PolarHBondContact O-N 2.99Å; C321-R323 WeakPolarHBondContact SG-CB 3.28Å; C321-H334 PolarHBondContact SG-NE2 3Å; C321-H338 PolarHBondContact SG-NE2 2.98Å; C321-H338 VanDerWaalsContact SG-NE2 3.44Å
322	G	75.4	Confident	71	Confident	58 Å²	58	75.4 Å²	75.4	60%	0.598	41%	0.413	S	S	*	.			trans	68.1	0.9	-178.9	0	0	0	0	0	114.8	C318	C318-G322 WeakPolarHBondContact O-CA 3.02Å; C318-G322 PolarHBondContact O-N 2.81Å
323	R	71.9	Confident	70.4	Confident	157 Å²	157	76.5 Å²	76.5	59%	0.592	41%	0.406	S	S	*	.			trans	-74	132	-174.4	-160.3	172.8	-171.4	176.1	4.6	111.1	C318 C321 F325	C318-R323 WeakPolarHBondContact CB-O 3.33Å; C318-R323 PolarHBondContact N-O 3.42Å; C321-R323 PolarHBondContact O-N 2.99Å; C321-R323 WeakPolarHBondContact SG-CB 3.28Å; R323-F325 HydrophobicContact CB-CE2 4.25Å; R323-F325 HydrophobicContact CB-CZ 4.39Å; R323-F325 HydrophobicContact CG-CE2 4.28Å; R323-F325 HydrophobicContact CG-CZ 4.05Å; R323-F325 WeakPolarHBondContact O-CE2 3.39Å
324	A	71.4	Confident	70.4	Confident	26 Å²	26	71.9 Å²	71.9	22%	0.215	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.3	-176.2	0	0	0	0	0	112.9	K314 Y316 K317	K314-A324 HydrophobicContact CB-CB 3.46Å; K314-A324 VanDerWaalsContact CB-CB 3.46Å; K314-A324 HydrophobicContact CD-CB 4.04Å; K314-A324 WeakPolarHBondContact CD-O 3.44Å; K314-A324 HydrophobicContact CG-CB 4.36Å; Y316-A324 CarbonylContact O-C 3.53Å; Y316-A324 WeakPolarHBondContact O-CA 3.39Å; K317-A324 HydrophobicContact CG-CB 3.84Å
325	F	71.2	Confident	69.9	Low	36 Å²	36	68.9 Å²	68.9	16%	0.158	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149.3	-177	-57.8	-90.3	0	0	0	111.2	K314 Y316 R323 Q327 L331 H334	K314-F325 CarbonylContact C-O 3.57Å; K314-F325 VanDerWaalsContact C-O 3.28Å; K314-F325 VanDerWaalsContact CA-O 3.31Å; K314-F325 WeakPolarHBondContact CA-O 3.37Å; Y316-F325 PolarHBondContact N-O 2.92Å; Y316-F325 VanDerWaalsContact N-O 3.15Å; Y316-F325 PolarHBondContact O-N 3.4Å; R323-F325 HydrophobicContact CB-CE2 4.25Å; R323-F325 HydrophobicContact CB-CZ 4.39Å; R323-F325 HydrophobicContact CG-CE2 4.28Å; R323-F325 HydrophobicContact CG-CZ 4.05Å; R323-F325 WeakPolarHBondContact O-CE2 3.39Å; F325-Q327 VanDerWaalsContact C-N 3.32Å; F325-L331 HydrophobicContact CB-CB 4.43Å; F325-L331 HydrophobicContact CD2-CB 3.94Å; F325-L331 HydrophobicContact CD2-CD1 3.69Å; F325-L331 HydrophobicContact CD2-CG 4.43Å; F325-L331 HydrophobicContact CE2-CD1 3.86Å; F325-L331 HydrophobicContact CG-CB 4.36Å; F325-H334 HydrophobicContact CE1-CB 4.02Å; F325-H334 HydrophobicContact CE2-CB 3.83Å; F325-H334 AromaticContact CE2-CD2 3.36Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.4Å; F325-H334 AromaticContact CE2-CG 3.61Å; F325-H334 HydrophobicContact CZ-CB 3.41Å; F325-H334 VanDerWaalsContact CZ-CB 3.41Å; F325-H334 AromaticContact CZ-CD2 3.43Å; F325-H334 VanDerWaalsContact CZ-CD2 3.43Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.38Å; F325-H334 AromaticContact CZ-CG 3.21Å; F325-H334 AromaticContact CZ-ND1 3.72Å; F325-H334 AromaticContact CZ-NE2 3.97Å
326	S	67.5	Low	70	Confident	40 Å²	40	68 Å²	68	28%	0.28	36%	0.359	S	S	.	.	S	Bend	trans	-80.6	-12.9	176.2	55.9	0	0	0	0	113.4	R308	R308-S326 PolarHBondContact NH1-O 3.12Å
327	Q	67.7	Low	70.2	Confident	75 Å²	75	69.6 Å²	69.6	35%	0.35	37%	0.372	S	S	.	.	S	Bend	trans	-135.7	142.2	-178.9	-62.9	179.2	5.5	0	0	111.1	F325 S330 L331	F325-Q327 VanDerWaalsContact C-N 3.32Å; Q327-S330 WeakPolarHBondContact O-CB 3.5Å; Q327-S330 PolarHBondContact O-N 2.87Å; Q327-L331 PolarHBondContact O-N 3.07Å
328	C	65.9	Low	70.7	Confident	56 Å²	56	66.1 Å²	66.1	38%	0.378	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-40.9	178.8	-174.4	0	0	0	0	112.6	Y316 S330 L331 I332	Y316-C328 HydrophobicContact CD1-CB 3.85Å; Y316-C328 HydrophobicContact CD2-CB 4.49Å; Y316-C328 HydrophobicContact CE1-CB 3.61Å; Y316-C328 HydrophobicContact CE2-CB 4.26Å; Y316-C328 HydrophobicContact CG-CB 4.28Å; C328-S330 VanDerWaalsContact C-N 3.25Å; C328-S330 PolarHBondContact O-N 3.49Å; C328-L331 WeakPolarHBondContact O-CB 3.44Å; C328-L331 PolarHBondContact O-N 3.44Å; C328-I332 PolarHBondContact O-N 3.44Å
329	S	65.4	Low	70.7	Confident	74 Å²	74	69.8 Å²	69.8	52%	0.517	38%	0.38	S	S	.	.	H	α-helix	trans	-56.9	-39	176.8	50.3	0	0	0	0	112.6	I332 Q333	S329-I332 PolarHBondContact O-N 2.95Å; S329-Q333 PolarHBondContact O-N 3.46Å
330	S	68.8	Low	71	Confident	38 Å²	38	64.7 Å²	64.7	27%	0.266	36%	0.364	S	S	.	.	H	α-helix	trans	-67.2	-38.3	176	-57.9	0	0	0	0	112.4	Q327 C328 H334	Q327-S330 WeakPolarHBondContact O-CB 3.5Å; Q327-S330 PolarHBondContact O-N 2.87Å; C328-S330 VanDerWaalsContact C-N 3.25Å; C328-S330 PolarHBondContact O-N 3.49Å; S330-H334 VanDerWaalsContact O-CB 3.28Å; S330-H334 WeakPolarHBondContact O-CB 3.4Å; S330-H334 PolarHBondContact O-N 3.1Å
331	L	70.8	Confident	71.1	Confident	21 Å²	21	64.2 Å²	64.2	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-46.9	173.9	176	63.9	0	0	0	110.8	C318 F325 Q327 C328 Q333 H334 H335	C318-L331 HydrophobicContact CB-CD1 3.7Å; F325-L331 HydrophobicContact CB-CB 4.43Å; F325-L331 HydrophobicContact CD2-CB 3.94Å; F325-L331 HydrophobicContact CD2-CD1 3.69Å; F325-L331 HydrophobicContact CD2-CG 4.43Å; F325-L331 HydrophobicContact CE2-CD1 3.86Å; F325-L331 HydrophobicContact CG-CB 4.36Å; Q327-L331 PolarHBondContact O-N 3.07Å; C328-L331 WeakPolarHBondContact O-CB 3.44Å; C328-L331 PolarHBondContact O-N 3.44Å; L331-Q333 VanDerWaalsContact C-N 3.33Å; L331-Q333 PolarHBondContact O-N 3.4Å; L331-H334 CarbonylContact O-C 3.53Å; L331-H334 WeakPolarHBondContact O-CA 3.41Å; L331-H334 WeakPolarHBondContact O-CB 3.26Å; L331-H334 PolarHBondContact O-N 3.4Å; L331-H335 WeakPolarHBondContact CD1-NE2 3.28Å; L331-H335 PolarHBondContact O-CD2 2.76Å; L331-H335 PolarHBondContact O-N 3.24Å
332	I	66.1	Low	71.2	Confident	92 Å²	92	67 Å²	67	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-44	177	-66.7	163.6	0	0	0	111	C328 S329 H334 H335	C328-I332 PolarHBondContact O-N 3.44Å; S329-I332 PolarHBondContact O-N 2.95Å; I332-H334 VanDerWaalsContact C-N 3.27Å; I332-H334 PolarHBondContact O-N 3.46Å; I332-H335 PolarHBondContact O-N 3.31Å
333	Q	64.2	Low	71.3	Confident	71 Å²	71	67.8 Å²	67.8	33%	0.332	36%	0.361	S	S	.	.	H	α-helix	trans	-64.2	-34.5	175.8	-172.7	-177.2	33.8	0	0	112.1	S329 L331 R336 S355	S329-Q333 PolarHBondContact O-N 3.46Å; L331-Q333 VanDerWaalsContact C-N 3.33Å; L331-Q333 PolarHBondContact O-N 3.4Å; Q333-R336 WeakPolarHBondContact O-CB 3.47Å; Q333-S355 PolarHBondContact NE2-OG 3.36Å
334	H	73.7	Confident	71.7	Confident	16 Å²	16	63.9 Å²	63.9	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-71.4	-39.4	177.9	171.5	67.1	0	0	0	112.8	C321 F325 S330 L331 I332 R336 I337 H338	C321-H334 PolarHBondContact SG-NE2 3Å; F325-H334 HydrophobicContact CE1-CB 4.02Å; F325-H334 HydrophobicContact CE2-CB 3.83Å; F325-H334 AromaticContact CE2-CD2 3.36Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.4Å; F325-H334 AromaticContact CE2-CG 3.61Å; F325-H334 HydrophobicContact CZ-CB 3.41Å; F325-H334 VanDerWaalsContact CZ-CB 3.41Å; F325-H334 AromaticContact CZ-CD2 3.43Å; F325-H334 VanDerWaalsContact CZ-CD2 3.43Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.38Å; F325-H334 AromaticContact CZ-CG 3.21Å; F325-H334 AromaticContact CZ-ND1 3.72Å; F325-H334 AromaticContact CZ-NE2 3.97Å; S330-H334 VanDerWaalsContact O-CB 3.28Å; S330-H334 WeakPolarHBondContact O-CB 3.4Å; S330-H334 PolarHBondContact O-N 3.1Å; L331-H334 CarbonylContact O-C 3.53Å; L331-H334 WeakPolarHBondContact O-CA 3.41Å; L331-H334 WeakPolarHBondContact O-CB 3.26Å; L331-H334 PolarHBondContact O-N 3.4Å; I332-H334 VanDerWaalsContact C-N 3.27Å; I332-H334 PolarHBondContact O-N 3.46Å; H334-R336 PolarHBondContact O-N 3.28Å; H334-R336 VanDerWaalsContact O-N 3.12Å; H334-I337 VanDerWaalsContact O-CB 3.24Å; H334-I337 WeakPolarHBondContact O-CB 3.39Å; H334-I337 WeakPolarHBondContact O-CG1 3.26Å; H334-I337 PolarHBondContact O-N 3.07Å; H334-H338 AromaticContact CE1-NE2 3.85Å; H334-H338 AromaticContact NE2-NE2 3.49Å; H334-H338 PolarHBondContact NE2-NE2 3.41Å
335	H	66.3	Low	72.2	Confident	55 Å²	55	68.8 Å²	68.8	26%	0.255	37%	0.365	S	S	.	.	H	α-helix	trans	-56	-29.3	175.6	-84.5	-75.4	0	0	0	113	E320 L331 I332 I337 H338 T339	E320-H335 IonicContact OE1-ND1 3.84Å; L331-H335 WeakPolarHBondContact CD1-NE2 3.28Å; L331-H335 PolarHBondContact O-CD2 2.76Å; L331-H335 PolarHBondContact O-N 3.24Å; I332-H335 PolarHBondContact O-N 3.31Å; H335-I337 PolarHBondContact O-N 3.32Å; H335-I337 VanDerWaalsContact O-N 3.09Å; H335-H338 WeakPolarHBondContact O-CB 3.25Å; H335-H338 PolarHBondContact O-N 2.92Å; H335-T339 PolarHBondContact O-N 3.39Å; H335-T339 VanDerWaalsContact O-N 3.1Å; H335-T339 PolarHBondContact O-OG1 3.46Å
336	R	74.9	Confident	73.1	Confident	55 Å²	55	67.1 Å²	67.1	21%	0.208	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-16.9	173.6	-63.4	-179.3	179.7	158.5	4.4	114.5	Q333 H334 G340 E341 T354	Q333-R336 WeakPolarHBondContact O-CB 3.47Å; H334-R336 PolarHBondContact O-N 3.28Å; H334-R336 VanDerWaalsContact O-N 3.12Å; R336-G340 WeakPolarHBondContact O-CA 3.25Å; R336-G340 PolarHBondContact O-N 3.13Å; R336-E341 HydrophobicContact CG-CB 4.48Å; R336-E341 PolarHBondContact O-N 3.04Å; R336-T354 HydrophobicContact CB-CG2 4.23Å; R336-T354 PolarHBondContact NH1-O 3.05Å
337	I	75.8	Confident	74	Confident	111 Å²	111	70.6 Å²	70.6	57%	0.569	38%	0.382	S	S	*	.	H	α-helix	trans	-72.8	-36.9	173.2	-59.2	178.4	0	0	0	110.2	H334 H335	H334-I337 VanDerWaalsContact O-CB 3.24Å; H334-I337 WeakPolarHBondContact O-CB 3.39Å; H334-I337 WeakPolarHBondContact O-CG1 3.26Å; H334-I337 PolarHBondContact O-N 3.07Å; H335-I337 PolarHBondContact O-N 3.32Å; H335-I337 VanDerWaalsContact O-N 3.09Å
338	H	72.9	Confident	74.9	Confident	71 Å²	71	72.8 Å²	72.8	33%	0.329	39%	0.392	S	S	.	.	H	α-helix	trans	-78.1	-46	-179.8	-67.1	-66.5	0	0	0	112.2	E320 C321 H334 H335 G340	E320-H338 WeakPolarHBondContact OE2-CB 3.43Å; E320-H338 IonicContact OE2-CD2 2.97Å; E320-H338 IonicContact OE2-CG 3.08Å; E320-H338 IonicContact OE2-ND1 3.84Å; E320-H338 PolarHBondContact OE2-ND1 3.44Å; C321-H338 PolarHBondContact SG-NE2 2.98Å; C321-H338 VanDerWaalsContact SG-NE2 3.44Å; H334-H338 AromaticContact CE1-NE2 3.85Å; H334-H338 AromaticContact NE2-NE2 3.49Å; H334-H338 PolarHBondContact NE2-NE2 3.41Å; H335-H338 WeakPolarHBondContact O-CB 3.25Å; H335-H338 PolarHBondContact O-N 2.92Å; H338-G340 PolarHBondContact O-N 2.94Å
339	T	71.1	Confident	75.9	Confident	78 Å²	78	72.7 Å²	72.7	48%	0.479	39%	0.392	S	S	.	.	S	Bend	trans	-75.3	-13.9	179.2	62.8	0	0	0	0	113.1	H335 E341	H335-T339 PolarHBondContact O-N 3.39Å; H335-T339 VanDerWaalsContact O-N 3.1Å; H335-T339 PolarHBondContact O-OG1 3.46Å; T339-E341 PolarHBondContact O-N 3.33Å; T339-E341 VanDerWaalsContact O-N 3.15Å; T339-E341 WeakPolarHBondContact OG1-CG 3.46Å; T339-E341 PolarHBondContact OG1-N 3.06Å
340	G	77.8	Confident	76.8	Confident	46 Å²	46	71.1 Å²	71.1	47%	0.474	39%	0.387	S	S	.	.			trans	69.8	1.5	-174.6	0	0	0	0	0	114.3	R336 H338 K342	R336-G340 WeakPolarHBondContact O-CA 3.25Å; R336-G340 PolarHBondContact O-N 3.13Å; H338-G340 PolarHBondContact O-N 2.94Å; G340-K342 PolarHBondContact O-N 2.96Å
341	E	75.9	Confident	77.6	Confident	111 Å²	111	75.3 Å²	75.3	52%	0.519	40%	0.401	S	S	.	.			trans	-60.8	123.8	-177.9	-74.8	-179.9	-177.3	0	0	111.8	R336 T339 P343	R336-E341 HydrophobicContact CG-CB 4.48Å; R336-E341 PolarHBondContact O-N 3.04Å; T339-E341 PolarHBondContact O-N 3.33Å; T339-E341 VanDerWaalsContact O-N 3.15Å; T339-E341 WeakPolarHBondContact OG1-CG 3.46Å; T339-E341 PolarHBondContact OG1-N 3.06Å; E341-P343 WeakPolarHBondContact O-CD 3.39Å
342	K	80.7	Confident	78.3	Confident	120 Å²	120	76 Å²	76	52%	0.522	41%	0.41	S	S	.	.			trans	-126.1	78.1	176.3	-70.3	166.1	179.6	179.9	0	109.5	G340 Y344 A352 F353 T354	G340-K342 PolarHBondContact O-N 2.96Å; K342-Y344 PolarHBondContact O-N 3.22Å; K342-A352 HydrophobicContact CB-CB 3.44Å; K342-A352 VanDerWaalsContact CB-CB 3.44Å; K342-A352 HydrophobicContact CD-CB 4.06Å; K342-A352 WeakPolarHBondContact CD-O 2.97Å; K342-A352 HydrophobicContact CG-CB 4.37Å; K342-F353 CarbonylContact C-O 3.59Å; K342-F353 VanDerWaalsContact C-O 3.31Å; K342-F353 WeakPolarHBondContact CA-O 3.44Å; K342-T354 HydrophobicContact CG-CG2 4.01Å
343	P	76.3	Confident	79	Confident	75 Å²	75	73.7 Å²	73.7	49%	0.487	40%	0.396	S	S	.	.			trans	-67.1	-7.5	-170.8	-21.6	34.1	0	0	0	115.1	E341	E341-P343 WeakPolarHBondContact O-CD 3.39Å
344	Y	80.3	Confident	79.5	Confident	75 Å²	75	71 Å²	71	29%	0.294	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	98.7	-171.2	-55.5	-78.1	0	0	0	110	K342 A352 F353 S355 V356	K342-Y344 PolarHBondContact O-N 3.22Å; Y344-A352 CarbonylContact O-C 3.54Å; Y344-A352 WeakPolarHBondContact O-CA 3.41Å; Y344-F353 WeakPolarHBondContact CD2-O 3.47Å; Y344-F353 PolarHBondContact N-O 2.97Å; Y344-F353 PolarHBondContact O-N 2.8Å; Y344-S355 VanDerWaalsContact CD2-CA 3.45Å; Y344-V356 HydrophobicContact CD1-CB 4.48Å; Y344-V356 HydrophobicContact CD1-CG2 3.52Å; Y344-V356 HydrophobicContact CE1-CB 4.41Å; Y344-V356 HydrophobicContact CE1-CG2 3.13Å; Y344-V356 HydrophobicContact CE2-CG2 4.42Å; Y344-V356 HydrophobicContact CG-CG2 4.28Å
345	E	83.8	Confident	79.4	Confident	129 Å²	129	70.9 Å²	70.9	60%	0.603	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	141	-178.7	-166.2	174.8	168.7	0	0	112.4	G350	E345-G350 WeakPolarHBondContact OE1-CA 3.36Å
346	C	88.8	Confident	79.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	40%	0.395	C	S	.	.			trans	-81	115.7	171.3	-177.1	0	0	0	0	109.9	Q348 C349 G350 K351 F353 L359 H366	C346-Q348 PolarHBondContact O-N 3.04Å; C346-Q348 VanDerWaalsContact O-N 3.11Å; C346-C349 PolarHBondContact O-N 3.41Å; C346-G350 WeakPolarHBondContact O-CA 3.47Å; C346-G350 PolarHBondContact O-N 2.97Å; C346-K351 WeakPolarHBondContact CB-O 3.3Å; C346-K351 PolarHBondContact N-O 3.1Å; C346-F353 HydrophobicContact CB-CE2 4.33Å; C346-L359 HydrophobicContact CB-CD1 3.69Å; C346-H366 PolarHBondContact SG-NE2 3.3Å
347	S	86.3	Confident	79.7	Confident	113 Å²	113	73.7 Å²	73.7	79%	0.79	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.7	179.5	54.7	0	0	0	0	114.2
348	Q	86.6	Confident	80	Confident	121 Å²	121	73.3 Å²	73.3	57%	0.565	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-22	-176.5	-62.6	-174	8	0	0	114.5	C346	C346-Q348 PolarHBondContact O-N 3.04Å; C346-Q348 VanDerWaalsContact O-N 3.11Å
349	C	88.5	Confident	80.5	Confident	55 Å²	55	71 Å²	71	37%	0.372	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	8.1	-179.4	68.5	0	0	0	0	115	C346 K351 H362 H366	C346-C349 PolarHBondContact O-N 3.41Å; C349-K351 PolarHBondContact O-N 3.05Å; C349-H362 PolarHBondContact SG-NE2 3.06Å; C349-H366 PolarHBondContact SG-NE2 3.15Å
350	G	83.8	Confident	81	Confident	40 Å²	40	70.4 Å²	70.4	41%	0.412	40%	0.397	S	S	.	.			trans	66	4.8	179.8	0	0	0	0	0	114.7	E345 C346 A352	E345-G350 WeakPolarHBondContact OE1-CA 3.36Å; C346-G350 WeakPolarHBondContact O-CA 3.47Å; C346-G350 PolarHBondContact O-N 2.97Å; G350-A352 PolarHBondContact O-N 3.2Å
351	K	84.2	Confident	81.2	Confident	127 Å²	127	74.2 Å²	74.2	55%	0.552	40%	0.397	S	S	*	.			trans	-72.1	122.1	179.6	-76.8	-178.6	-179	172.8	0	110.3	C346 C349 F353	C346-K351 WeakPolarHBondContact CB-O 3.3Å; C346-K351 PolarHBondContact N-O 3.1Å; C349-K351 PolarHBondContact O-N 3.05Å; K351-F353 HydrophobicContact CB-CE2 3.93Å; K351-F353 HydrophobicContact CB-CZ 4.07Å; K351-F353 WeakPolarHBondContact O-CD2 3.35Å; K351-F353 WeakPolarHBondContact O-CE2 3.47Å
352	A	85.6	Confident	81.7	Confident	36 Å²	36	69.8 Å²	69.8	30%	0.298	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	144.5	178.7	0	0	0	0	0	112.9	K342 Y344 G350	K342-A352 HydrophobicContact CB-CB 3.44Å; K342-A352 VanDerWaalsContact CB-CB 3.44Å; K342-A352 HydrophobicContact CD-CB 4.06Å; K342-A352 WeakPolarHBondContact CD-O 2.97Å; K342-A352 HydrophobicContact CG-CB 4.37Å; Y344-A352 CarbonylContact O-C 3.54Å; Y344-A352 WeakPolarHBondContact O-CA 3.41Å; G350-A352 PolarHBondContact O-N 3.2Å
353	F	82	Confident	81.7	Confident	42 Å²	42	67.1 Å²	67.1	18%	0.184	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.8	-177	-61.1	-88	0	0	0	111.8	K342 Y344 C346 K351 S355 R358 L359 H362	K342-F353 CarbonylContact C-O 3.59Å; K342-F353 VanDerWaalsContact C-O 3.31Å; K342-F353 WeakPolarHBondContact CA-O 3.44Å; Y344-F353 WeakPolarHBondContact CD2-O 3.47Å; Y344-F353 PolarHBondContact N-O 2.97Å; Y344-F353 PolarHBondContact O-N 2.8Å; C346-F353 HydrophobicContact CB-CE2 4.33Å; K351-F353 HydrophobicContact CB-CE2 3.93Å; K351-F353 HydrophobicContact CB-CZ 4.07Å; K351-F353 WeakPolarHBondContact O-CD2 3.35Å; K351-F353 WeakPolarHBondContact O-CE2 3.47Å; F353-S355 VanDerWaalsContact C-N 3.32Å; F353-S355 PolarHBondContact O-N 3.47Å; F353-R358 HydrophobicContact CB-CB 4.24Å; F353-R358 HydrophobicContact CD1-CB 4.05Å; F353-R358 HydrophobicContact CG-CB 4.41Å; F353-L359 HydrophobicContact CB-CB 4.34Å; F353-L359 HydrophobicContact CD2-CB 4.01Å; F353-L359 HydrophobicContact CD2-CD1 3.59Å; F353-L359 HydrophobicContact CD2-CG 4.43Å; F353-L359 HydrophobicContact CE2-CD1 3.84Å; F353-L359 HydrophobicContact CG-CB 4.33Å; F353-H362 HydrophobicContact CE1-CB 3.87Å; F353-H362 HydrophobicContact CE2-CB 3.8Å; F353-H362 AromaticContact CE2-CD2 3.32Å; F353-H362 WeakPolarHBondContact CE2-CD2 3.37Å; F353-H362 AromaticContact CE2-CG 3.54Å; F353-H362 AromaticContact CE2-NE2 3.97Å; F353-H362 HydrophobicContact CZ-CB 3.37Å; F353-H362 AromaticContact CZ-CD2 3.38Å; F353-H362 WeakPolarHBondContact CZ-CD2 3.39Å; F353-H362 AromaticContact CZ-CG 3.12Å; F353-H362 AromaticContact CZ-ND1 3.56Å; F353-H362 AromaticContact CZ-NE2 3.9Å
354	T	74.1	Confident	82.1	Confident	14 Å²	14	67 Å²	67	9%	0.086	36%	0.355	C	S	.	.	S	Bend	trans	-82.6	-5.5	-179.7	63.5	0	0	0	0	114.1	R336 K342 R358	R336-T354 HydrophobicContact CB-CG2 4.23Å; R336-T354 PolarHBondContact NH1-O 3.05Å; K342-T354 HydrophobicContact CG-CG2 4.01Å; T354-R358 PolarHBondContact OG1-NH1 2.93Å
355	S	71.4	Confident	82.3	Confident	14 Å²	14	68.8 Å²	68.8	10%	0.098	37%	0.368	C	S	.	.	S	Bend	trans	-158.1	146	179.5	62.5	0	0	0	0	112.5	Q333 Y344 F353 S357 R358 L359	Q333-S355 PolarHBondContact NE2-OG 3.36Å; Y344-S355 VanDerWaalsContact CD2-CA 3.45Å; F353-S355 VanDerWaalsContact C-N 3.32Å; F353-S355 PolarHBondContact O-N 3.47Å; S355-S357 VanDerWaalsContact C-N 3.31Å; S355-S357 PolarHBondContact O-N 3.04Å; S355-R358 WeakPolarHBondContact O-CB 3.46Å; S355-R358 PolarHBondContact O-N 3.43Å; S355-R358 WeakPolarHBondContact OG-CD 3.5Å; S355-R358 VanDerWaalsContact OG-CG 3.26Å; S355-R358 WeakPolarHBondContact OG-CG 3.39Å; S355-L359 PolarHBondContact O-N 3.27Å
356	V	72.9	Confident	82.3	Confident	75 Å²	75	66 Å²	66	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-49.5	-48	175	-177.1	0	0	0	0	112.2	Y344 R358 L359 S360	Y344-V356 HydrophobicContact CD1-CB 4.48Å; Y344-V356 HydrophobicContact CD1-CG2 3.52Å; Y344-V356 HydrophobicContact CE1-CB 4.41Å; Y344-V356 HydrophobicContact CE1-CG2 3.13Å; Y344-V356 HydrophobicContact CE2-CG2 4.42Å; Y344-V356 HydrophobicContact CG-CG2 4.28Å; V356-R358 PolarHBondContact O-N 3.3Å; V356-R358 VanDerWaalsContact O-N 3.14Å; V356-L359 CarbonylContact O-C 3.55Å; V356-L359 WeakPolarHBondContact O-CA 3.37Å; V356-L359 WeakPolarHBondContact O-CB 3.41Å; V356-L359 PolarHBondContact O-N 3.35Å; V356-S360 PolarHBondContact O-N 2.75Å; V356-S360 PolarHBondContact O-OG 3.46Å; V356-S360 VanDerWaalsContact O-OG 3.11Å
357	S	76.1	Confident	82	Confident	94 Å²	94	69.6 Å²	69.6	66%	0.657	38%	0.378	S	S	*	.	H	α-helix	trans	-61.5	-29.2	-177.3	-45.1	0	0	0	0	113.4	S355 R361	S355-S357 VanDerWaalsContact C-N 3.31Å; S355-S357 PolarHBondContact O-N 3.04Å; S357-R361 VanDerWaalsContact O-CB 3.28Å; S357-R361 WeakPolarHBondContact O-CB 3.47Å; S357-R361 PolarHBondContact O-N 3.1Å; S357-R361 VanDerWaalsContact O-N 3.16Å
358	R	80.1	Confident	81.7	Confident	104 Å²	104	66.4 Å²	66.4	39%	0.392	36%	0.363	S	S	.	.	H	α-helix	trans	-75.9	-38.5	174.8	-72.2	176.6	-178.8	177.6	-2.4	111.1	F353 T354 S355 V356 R361 H362	F353-R358 HydrophobicContact CB-CB 4.24Å; F353-R358 HydrophobicContact CD1-CB 4.05Å; F353-R358 HydrophobicContact CG-CB 4.41Å; T354-R358 PolarHBondContact OG1-NH1 2.93Å; S355-R358 WeakPolarHBondContact O-CB 3.46Å; S355-R358 PolarHBondContact O-N 3.43Å; S355-R358 WeakPolarHBondContact OG-CD 3.5Å; S355-R358 VanDerWaalsContact OG-CG 3.26Å; S355-R358 WeakPolarHBondContact OG-CG 3.39Å; V356-R358 PolarHBondContact O-N 3.3Å; V356-R358 VanDerWaalsContact O-N 3.14Å; R358-R361 PolarHBondContact O-N 3.4Å; R358-H362 WeakPolarHBondContact O-CB 3.3Å; R358-H362 PolarHBondContact O-N 3.14Å
359	L	83.9	Confident	81.5	Confident	22 Å²	22	65.9 Å²	65.9	12%	0.115	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-50.5	173.2	176.1	65.2	0	0	0	111.2	C346 F353 S355 V356 R361 H362 H363	C346-L359 HydrophobicContact CB-CD1 3.69Å; F353-L359 HydrophobicContact CB-CB 4.34Å; F353-L359 HydrophobicContact CD2-CB 4.01Å; F353-L359 HydrophobicContact CD2-CD1 3.59Å; F353-L359 HydrophobicContact CD2-CG 4.43Å; F353-L359 HydrophobicContact CE2-CD1 3.84Å; F353-L359 HydrophobicContact CG-CB 4.33Å; S355-L359 PolarHBondContact O-N 3.27Å; V356-L359 CarbonylContact O-C 3.55Å; V356-L359 WeakPolarHBondContact O-CA 3.37Å; V356-L359 WeakPolarHBondContact O-CB 3.41Å; V356-L359 PolarHBondContact O-N 3.35Å; L359-R361 PolarHBondContact O-N 3.32Å; L359-H362 CarbonylContact O-C 3.53Å; L359-H362 WeakPolarHBondContact O-CA 3.45Å; L359-H362 WeakPolarHBondContact O-CB 3.42Å; L359-H362 PolarHBondContact O-N 3.4Å; L359-H363 WeakPolarHBondContact CD1-NE2 3.36Å; L359-H363 PolarHBondContact O-CD2 3.41Å; L359-H363 PolarHBondContact O-N 2.87Å
360	S	82.1	Confident	81.3	Confident	65 Å²	65	68.1 Å²	68.1	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-57.7	-37.8	176.3	-50.3	0	0	0	0	111.9	V356	V356-S360 PolarHBondContact O-N 2.75Å; V356-S360 PolarHBondContact O-OG 3.46Å; V356-S360 VanDerWaalsContact O-OG 3.11Å
361	R	82.5	Confident	81.3	Confident	127 Å²	127	69 Å²	69	48%	0.479	36%	0.362	S	S	.	.	H	α-helix	trans	-66.8	-38.6	174.3	-173.1	176	65.4	-169.4	0.8	112.1	S357 R358 L359 R364 Y383	S357-R361 VanDerWaalsContact O-CB 3.28Å; S357-R361 WeakPolarHBondContact O-CB 3.47Å; S357-R361 PolarHBondContact O-N 3.1Å; S357-R361 VanDerWaalsContact O-N 3.16Å; R358-R361 PolarHBondContact O-N 3.4Å; L359-R361 PolarHBondContact O-N 3.32Å; R361-R364 WeakPolarHBondContact O-CB 3.49Å; R361-R364 PolarHBondContact O-N 2.77Å; R361-Y383 HydrophobicContact CG-CD1 4.29Å; R361-Y383 HydrophobicContact CG-CE1 3.42Å; R361-Y383 VanDerWaalsContact CG-CE1 3.42Å
362	H	85.6	Confident	81.5	Confident	17 Å²	17	65.7 Å²	65.7	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-68.7	-36.1	177.3	170	70.3	0	0	0	112.7	C349 F353 R358 L359 R364 I365 H366	C349-H362 PolarHBondContact SG-NE2 3.06Å; F353-H362 HydrophobicContact CE1-CB 3.87Å; F353-H362 HydrophobicContact CE2-CB 3.8Å; F353-H362 AromaticContact CE2-CD2 3.32Å; F353-H362 WeakPolarHBondContact CE2-CD2 3.37Å; F353-H362 AromaticContact CE2-CG 3.54Å; F353-H362 AromaticContact CE2-NE2 3.97Å; F353-H362 HydrophobicContact CZ-CB 3.37Å; F353-H362 AromaticContact CZ-CD2 3.38Å; F353-H362 WeakPolarHBondContact CZ-CD2 3.39Å; F353-H362 AromaticContact CZ-CG 3.12Å; F353-H362 AromaticContact CZ-ND1 3.56Å; F353-H362 AromaticContact CZ-NE2 3.9Å; R358-H362 WeakPolarHBondContact O-CB 3.3Å; R358-H362 PolarHBondContact O-N 3.14Å; L359-H362 CarbonylContact O-C 3.53Å; L359-H362 WeakPolarHBondContact O-CA 3.45Å; L359-H362 WeakPolarHBondContact O-CB 3.42Å; L359-H362 PolarHBondContact O-N 3.4Å; H362-R364 PolarHBondContact O-N 2.78Å; H362-I365 WeakPolarHBondContact ND1-CD1 3.43Å; H362-I365 VanDerWaalsContact O-CB 3.28Å; H362-I365 WeakPolarHBondContact O-CB 3.21Å; H362-I365 WeakPolarHBondContact O-CG1 3.28Å; H362-I365 PolarHBondContact O-N 2.76Å; H362-H366 AromaticContact CE1-NE2 3.85Å; H362-H366 AromaticContact NE2-NE2 3.32Å; H362-H366 PolarHBondContact NE2-NE2 3.18Å
363	H	81.6	Confident	81.7	Confident	65 Å²	65	69.7 Å²	69.7	30%	0.301	36%	0.36	S	S	.	.	H	α-helix	trans	-54.1	-28.9	176.3	-77.8	-162	0	0	0	113	L359 I365 H366 T367	L359-H363 WeakPolarHBondContact CD1-NE2 3.36Å; L359-H363 PolarHBondContact O-CD2 3.41Å; L359-H363 PolarHBondContact O-N 2.87Å; H363-I365 PolarHBondContact O-N 2.93Å; H363-I365 VanDerWaalsContact O-N 3.13Å; H363-H366 PolarHBondContact O-N 3.15Å; H363-T367 PolarHBondContact O-N 3.29Å; H363-T367 PolarHBondContact O-OG1 3.3Å
364	R	84.9	Confident	82.1	Confident	73 Å²	73	67.8 Å²	67.8	28%	0.275	35%	0.352	S	S	.	.	H	α-helix	trans	-60.3	-21.6	174.9	-59.2	-179	-178.1	-177	-2.7	114.3	R361 H362 H366 T367 G368 S382	R361-R364 WeakPolarHBondContact O-CB 3.49Å; R361-R364 PolarHBondContact O-N 2.77Å; H362-R364 PolarHBondContact O-N 2.78Å; R364-H366 VanDerWaalsContact C-N 3.3Å; R364-T367 WeakPolarHBondContact CA-OG1 3.33Å; R364-G368 WeakPolarHBondContact O-CA 3.45Å; R364-G368 PolarHBondContact O-N 3.12Å; R364-G368 VanDerWaalsContact O-N 3.09Å; R364-S382 PolarHBondContact NH1-O 3.23Å
365	I	83.7	Confident	82.8	Confident	111 Å²	111	75.9 Å²	75.9	57%	0.569	39%	0.388	S	S	*	.	H	α-helix	trans	-69.7	-34.7	175.3	-58.4	178.7	0	0	0	110.2	H362 H363	H362-I365 WeakPolarHBondContact ND1-CD1 3.43Å; H362-I365 VanDerWaalsContact O-CB 3.28Å; H362-I365 WeakPolarHBondContact O-CB 3.21Å; H362-I365 WeakPolarHBondContact O-CG1 3.28Å; H362-I365 PolarHBondContact O-N 2.76Å; H363-I365 PolarHBondContact O-N 2.93Å; H363-I365 VanDerWaalsContact O-N 3.13Å
366	H	83.9	Confident	83.6	Confident	71 Å²	71	81.7 Å²	81.7	33%	0.329	42%	0.416	S	S	.	.	H	α-helix	trans	-85.9	-42.6	-179.6	-60.3	-66.5	0	0	0	112.6	C346 C349 H362 H363 R364 G368	C346-H366 PolarHBondContact SG-NE2 3.3Å; C349-H366 PolarHBondContact SG-NE2 3.15Å; H362-H366 AromaticContact CE1-NE2 3.85Å; H362-H366 AromaticContact NE2-NE2 3.32Å; H362-H366 PolarHBondContact NE2-NE2 3.18Å; H363-H366 PolarHBondContact O-N 3.15Å; R364-H366 VanDerWaalsContact C-N 3.3Å; H366-G368 PolarHBondContact O-N 2.82Å
367	T	81.9	Confident	84.4	Confident	76 Å²	76	80.7 Å²	80.7	47%	0.466	41%	0.411	S	S	.	.	H	α-helix	trans	-73.9	-16.2	178.4	62.7	0	0	0	0	112.7	H363 R364 E369	H363-T367 PolarHBondContact O-N 3.29Å; H363-T367 PolarHBondContact O-OG1 3.3Å; R364-T367 WeakPolarHBondContact CA-OG1 3.33Å; T367-E369 PolarHBondContact O-N 2.84Å; T367-E369 WeakPolarHBondContact OG1-CG 3.18Å; T367-E369 PolarHBondContact OG1-N 3.13Å
368	G	81	Confident	84.8	Confident	46 Å²	46	78.9 Å²	78.9	47%	0.474	41%	0.408	S	S	.	.			trans	69.2	5.7	-175.3	0	0	0	0	0	113.8	R364 H366 K370	R364-G368 WeakPolarHBondContact O-CA 3.45Å; R364-G368 PolarHBondContact O-N 3.12Å; R364-G368 VanDerWaalsContact O-N 3.09Å; H366-G368 PolarHBondContact O-N 2.82Å; G368-K370 PolarHBondContact O-N 2.76Å
369	E	81.1	Confident	85.2	Confident	110 Å²	110	80 Å²	80	51%	0.514	42%	0.415	S	S	.	.			trans	-58.1	123.4	-178.5	-78	175.7	-164.3	0	0	111.6	T367	T367-E369 PolarHBondContact O-N 2.84Å; T367-E369 WeakPolarHBondContact OG1-CG 3.18Å; T367-E369 PolarHBondContact OG1-N 3.13Å
370	K	84.1	Confident	85.4	Confident	102 Å²	102	81.8 Å²	81.8	44%	0.443	43%	0.427	S	S	.	.			trans	-125.1	78	175.5	-70.6	176.9	-176	175.7	0	110.1	G368 F372 V380 F381 S382	G368-K370 PolarHBondContact O-N 2.76Å; K370-F372 PolarHBondContact O-N 3.05Å; K370-F372 VanDerWaalsContact O-N 3.08Å; K370-V380 HydrophobicContact CB-CB 3.81Å; K370-V380 HydrophobicContact CB-CG2 3.97Å; K370-V380 HydrophobicContact CD-CB 4.28Å; K370-V380 HydrophobicContact CD-CG2 3.65Å; K370-V380 HydrophobicContact CG-CG2 4.47Å; K370-F381 CarbonylContact C-O 3.53Å; K370-F381 WeakPolarHBondContact CA-O 2.91Å; K370-S382 WeakPolarHBondContact CG-OG 3.24Å
371	P	84.5	Confident	85.6	Confident	59 Å²	59	80.6 Å²	80.6	38%	0.383	41%	0.414	S	S	.	.			trans	-67.2	-13.7	-170.5	-21.7	34.4	0	0	0	114.7	H373	P371-H373 PolarHBondContact O-CE1 3.42Å; P371-H373 PolarHBondContact O-ND1 3.39Å
372	F	88.3	Confident	85.7	Confident	57 Å²	57	76 Å²	76	25%	0.25	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.3	-170.3	-54.9	-74.1	0	0	0	110.7	K370 V380 F381 H384 L387	K370-F372 PolarHBondContact O-N 3.05Å; K370-F372 VanDerWaalsContact O-N 3.08Å; F372-V380 CarbonylContact O-C 3.52Å; F372-V380 WeakPolarHBondContact O-CA 3.49Å; F372-F381 HydrophobicContact CB-CB 4.35Å; F372-F381 WeakPolarHBondContact CD2-O 3.42Å; F372-F381 PolarHBondContact N-O 3.36Å; F372-F381 PolarHBondContact O-N 3.37Å; F372-H384 HydrophobicContact CD1-CB 3.93Å; F372-H384 AromaticContact CD1-CD2 3.95Å; F372-H384 HydrophobicContact CD2-CB 4.46Å; F372-H384 VanDerWaalsContact CD2-N 3.27Å; F372-H384 HydrophobicContact CE1-CB 3.74Å; F372-H384 HydrophobicContact CE2-CB 4.27Å; F372-H384 HydrophobicContact CG-CB 4.28Å; F372-H384 HydrophobicContact CZ-CB 3.91Å; F372-L387 HydrophobicContact CB-CB 4.15Å; F372-L387 HydrophobicContact CB-CD2 3.94Å
373	H	89.1	Confident	85.5	Confident	120 Å²	120	79.5 Å²	79.5	56%	0.556	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	136	-170.6	-53.4	63	0	0	0	109.7	P371 V380 L387	P371-H373 PolarHBondContact O-CE1 3.42Å; P371-H373 PolarHBondContact O-ND1 3.39Å; H373-V380 HydrophobicContact CB-CG1 4.49Å; H373-V380 VanDerWaalsContact CD2-CG1 3.49Å; H373-V380 WeakPolarHBondContact CD2-CG1 3.37Å; H373-L387 WeakPolarHBondContact O-CD2 3.35Å
374	C	91.9	Very high	85.6	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.007	42%	0.423	C	S	.	.			trans	-85.1	113.9	170.1	-177.4	0	0	0	0	109.7	M376 C377 G378 K379 F381 L387 H394	C374-M376 PolarHBondContact O-N 3.02Å; C374-C377 PolarHBondContact O-N 3.1Å; C374-C377 VanDerWaalsContact SG-SG 3.67Å; C374-G378 VanDerWaalsContact O-CA 3.28Å; C374-G378 WeakPolarHBondContact O-CA 3.19Å; C374-G378 PolarHBondContact O-N 3.15Å; C374-K379 WeakPolarHBondContact CB-O 3.44Å; C374-K379 PolarHBondContact N-O 2.91Å; C374-F381 HydrophobicContact CB-CE2 4.17Å; C374-L387 HydrophobicContact CB-CD1 3.7Å; C374-H394 PolarHBondContact SG-NE2 2.94Å; C374-H394 VanDerWaalsContact SG-NE2 3.43Å
375	H	88.6	Confident	85.7	Confident	184 Å²	184	81.4 Å²	81.4	85%	0.852	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.8	178.4	-175.5	62.8	0	0	0	113.2
376	M	87.3	Confident	85.9	Confident	137 Å²	137	77.6 Å²	77.6	68%	0.675	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-29.4	-176.7	-59.8	-57.6	-67.1	0	0	114.6	C374 H394	C374-M376 PolarHBondContact O-N 3.02Å; M376-H394 HydrophobicContact CG-CB 4.39Å
377	C	89.8	Confident	86.2	Confident	53 Å²	53	74.9 Å²	74.9	36%	0.358	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.7	8.4	-174.3	70.5	0	0	0	0	114.4	C374 K379 H390 H394	C374-C377 PolarHBondContact O-N 3.1Å; C374-C377 VanDerWaalsContact SG-SG 3.67Å; C377-K379 PolarHBondContact O-N 3.12Å; C377-H390 PolarHBondContact SG-NE2 2.99Å; C377-H394 PolarHBondContact SG-NE2 3.16Å; C377-H394 VanDerWaalsContact SG-NE2 3.37Å
378	G	85.9	Confident	86.6	Confident	57 Å²	57	74.1 Å²	74.1	59%	0.588	40%	0.4	S	S	*	.			trans	67.6	-3.9	-179.7	0	0	0	0	0	115.5	C374 V380	C374-G378 VanDerWaalsContact O-CA 3.28Å; C374-G378 WeakPolarHBondContact O-CA 3.19Å; C374-G378 PolarHBondContact O-N 3.15Å; G378-V380 PolarHBondContact O-N 3.37Å
379	K	87.4	Confident	87	Confident	126 Å²	126	74.6 Å²	74.6	55%	0.548	39%	0.391	S	S	.	.			trans	-64.3	135.4	-178.5	-73.5	-177.4	-179.5	176.9	0	111.5	C374 C377 F381	C374-K379 WeakPolarHBondContact CB-O 3.44Å; C374-K379 PolarHBondContact N-O 2.91Å; C377-K379 PolarHBondContact O-N 3.12Å; K379-F381 HydrophobicContact CB-CE2 3.87Å; K379-F381 HydrophobicContact CB-CZ 3.98Å; K379-F381 WeakPolarHBondContact O-CE2 3.24Å
380	V	88.7	Confident	87.4	Confident	61 Å²	61	70.2 Å²	70.2	37%	0.37	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	143.5	-177.7	-66.7	0	0	0	0	112.4	K370 F372 H373 G378	K370-V380 HydrophobicContact CB-CB 3.81Å; K370-V380 HydrophobicContact CB-CG2 3.97Å; K370-V380 HydrophobicContact CD-CB 4.28Å; K370-V380 HydrophobicContact CD-CG2 3.65Å; K370-V380 HydrophobicContact CG-CG2 4.47Å; F372-V380 CarbonylContact O-C 3.52Å; F372-V380 WeakPolarHBondContact O-CA 3.49Å; H373-V380 HydrophobicContact CB-CG1 4.49Å; H373-V380 VanDerWaalsContact CD2-CG1 3.49Å; H373-V380 WeakPolarHBondContact CD2-CG1 3.37Å; G378-V380 PolarHBondContact O-N 3.37Å
381	F	86.8	Confident	87.7	Confident	40 Å²	40	68.8 Å²	68.8	18%	0.175	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.4	-174.2	-59.9	-87.6	0	0	0	111.6	K370 F372 C374 K379 Y383 A386 L387 H390	K370-F381 CarbonylContact C-O 3.53Å; K370-F381 WeakPolarHBondContact CA-O 2.91Å; F372-F381 HydrophobicContact CB-CB 4.35Å; F372-F381 WeakPolarHBondContact CD2-O 3.42Å; F372-F381 PolarHBondContact N-O 3.36Å; F372-F381 PolarHBondContact O-N 3.37Å; C374-F381 HydrophobicContact CB-CE2 4.17Å; K379-F381 HydrophobicContact CB-CE2 3.87Å; K379-F381 HydrophobicContact CB-CZ 3.98Å; K379-F381 WeakPolarHBondContact O-CE2 3.24Å; F381-Y383 VanDerWaalsContact C-N 3.28Å; F381-Y383 PolarHBondContact O-N 3.04Å; F381-A386 HydrophobicContact CB-CB 4.3Å; F381-A386 HydrophobicContact CD1-CB 3.98Å; F381-A386 HydrophobicContact CG-CB 4.44Å; F381-L387 HydrophobicContact CB-CB 4.36Å; F381-L387 HydrophobicContact CD2-CB 4.01Å; F381-L387 HydrophobicContact CD2-CD1 3.82Å; F381-L387 HydrophobicContact CE2-CD1 4.01Å; F381-L387 HydrophobicContact CG-CB 4.3Å; F381-H390 HydrophobicContact CE1-CB 3.79Å; F381-H390 AromaticContact CE1-CG 3.96Å; F381-H390 HydrophobicContact CE2-CB 3.93Å; F381-H390 AromaticContact CE2-CD2 3.44Å; F381-H390 VanDerWaalsContact CE2-CD2 3.44Å; F381-H390 WeakPolarHBondContact CE2-CD2 3.44Å; F381-H390 AromaticContact CE2-CG 3.65Å; F381-H390 HydrophobicContact CZ-CB 3.39Å; F381-H390 AromaticContact CZ-CD2 3.39Å; F381-H390 WeakPolarHBondContact CZ-CD2 3.38Å; F381-H390 AromaticContact CZ-CG 3.12Å; F381-H390 AromaticContact CZ-ND1 3.59Å; F381-H390 AromaticContact CZ-NE2 3.96Å
382	S	84.1	Confident	88	Confident	31 Å²	31	68.2 Å²	68.2	22%	0.217	36%	0.356	C	S	.	.	S	Bend	trans	-75.3	-17.7	176.3	-52.2	0	0	0	0	113.4	R364 K370	R364-S382 PolarHBondContact NH1-O 3.23Å; K370-S382 WeakPolarHBondContact CG-OG 3.24Å
383	Y	81.6	Confident	88.1	Confident	89 Å²	89	71.2 Å²	71.2	35%	0.349	37%	0.373	S	S	.	.	S	Bend	trans	-132.9	137.4	-175.8	-52.2	-58.5	0	0	0	111.6	R361 F381 S385 A386 L387	R361-Y383 HydrophobicContact CG-CD1 4.29Å; R361-Y383 HydrophobicContact CG-CE1 3.42Å; R361-Y383 VanDerWaalsContact CG-CE1 3.42Å; F381-Y383 VanDerWaalsContact C-N 3.28Å; F381-Y383 PolarHBondContact O-N 3.04Å; Y383-S385 VanDerWaalsContact C-N 3.31Å; Y383-S385 PolarHBondContact O-N 2.97Å; Y383-A386 WeakPolarHBondContact O-CB 3.42Å; Y383-A386 PolarHBondContact O-N 2.84Å; Y383-A386 VanDerWaalsContact O-N 3.12Å; Y383-L387 PolarHBondContact O-N 3Å; Y383-L387 VanDerWaalsContact O-N 3.16Å
384	H	83.9	Confident	88.1	Confident	103 Å²	103	69.2 Å²	69.2	48%	0.477	36%	0.364	S	S	.	.	H	α-helix	trans	-59.2	-41	174.5	-175.5	-94.2	0	0	0	112.1	F372 A386 L387 I388	F372-H384 HydrophobicContact CD1-CB 3.93Å; F372-H384 AromaticContact CD1-CD2 3.95Å; F372-H384 HydrophobicContact CD2-CB 4.46Å; F372-H384 VanDerWaalsContact CD2-N 3.27Å; F372-H384 HydrophobicContact CE1-CB 3.74Å; F372-H384 HydrophobicContact CE2-CB 4.27Å; F372-H384 HydrophobicContact CG-CB 4.28Å; F372-H384 HydrophobicContact CZ-CB 3.91Å; H384-A386 VanDerWaalsContact C-N 3.26Å; H384-A386 PolarHBondContact O-N 3.25Å; H384-L387 WeakPolarHBondContact O-CB 3.31Å; H384-L387 PolarHBondContact O-N 3.47Å; H384-L387 VanDerWaalsContact O-N 3.11Å; H384-I388 WeakPolarHBondContact O-CG1 3.37Å; H384-I388 PolarHBondContact O-N 3.45Å
385	S	86.1	Confident	88	Confident	75 Å²	75	73.2 Å²	73.2	52%	0.524	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-35.6	176.6	54	0	0	0	0	112.9	Y383 I388 I389	Y383-S385 VanDerWaalsContact C-N 3.31Å; Y383-S385 PolarHBondContact O-N 2.97Å; S385-I388 PolarHBondContact O-N 3.01Å; S385-I389 WeakPolarHBondContact O-CD1 3.43Å; S385-I389 VanDerWaalsContact O-CG1 3.25Å; S385-I389 WeakPolarHBondContact O-CG1 3.47Å; S385-I389 PolarHBondContact O-N 3.11Å
386	A	88.2	Confident	88	Confident	32 Å²	32	66.7 Å²	66.7	26%	0.264	37%	0.371	S	S	.	.	H	α-helix	trans	-68.9	-38.3	175.8	0	0	0	0	0	111.4	F381 Y383 H384 I389 H390	F381-A386 HydrophobicContact CB-CB 4.3Å; F381-A386 HydrophobicContact CD1-CB 3.98Å; F381-A386 HydrophobicContact CG-CB 4.44Å; Y383-A386 WeakPolarHBondContact O-CB 3.42Å; Y383-A386 PolarHBondContact O-N 2.84Å; Y383-A386 VanDerWaalsContact O-N 3.12Å; H384-A386 VanDerWaalsContact C-N 3.26Å; H384-A386 PolarHBondContact O-N 3.25Å; A386-I389 PolarHBondContact O-N 2.93Å; A386-H390 VanDerWaalsContact O-CB 3.26Å; A386-H390 WeakPolarHBondContact O-CB 3.45Å; A386-H390 PolarHBondContact O-N 3.35Å
387	L	90.9	Very high	88.2	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-60.9	-48.1	172	172.9	62.6	0	0	0	111.5	F372 H373 C374 F381 Y383 H384 I389 H390 Q391	F372-L387 HydrophobicContact CB-CB 4.15Å; F372-L387 HydrophobicContact CB-CD2 3.94Å; H373-L387 WeakPolarHBondContact O-CD2 3.35Å; C374-L387 HydrophobicContact CB-CD1 3.7Å; F381-L387 HydrophobicContact CB-CB 4.36Å; F381-L387 HydrophobicContact CD2-CB 4.01Å; F381-L387 HydrophobicContact CD2-CD1 3.82Å; F381-L387 HydrophobicContact CE2-CD1 4.01Å; F381-L387 HydrophobicContact CG-CB 4.3Å; Y383-L387 PolarHBondContact O-N 3Å; Y383-L387 VanDerWaalsContact O-N 3.16Å; H384-L387 WeakPolarHBondContact O-CB 3.31Å; H384-L387 PolarHBondContact O-N 3.47Å; H384-L387 VanDerWaalsContact O-N 3.11Å; L387-I389 VanDerWaalsContact C-N 3.35Å; L387-I389 PolarHBondContact O-N 2.84Å; L387-H390 CarbonylContact O-C 3.28Å; L387-H390 WeakPolarHBondContact O-CB 3.48Å; L387-H390 PolarHBondContact O-N 3.28Å; L387-H390 VanDerWaalsContact O-N 3.12Å; L387-Q391 HydrophobicContact CD1-CG 4.13Å; L387-Q391 HydrophobicContact CG-CG 4.47Å; L387-Q391 WeakPolarHBondContact O-CG 3.37Å; L387-Q391 PolarHBondContact O-N 3.28Å
388	I	88.4	Confident	88.3	Confident	60 Å²	60	69 Å²	69	31%	0.308	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-45.2	178.5	-63.2	-55.8	0	0	0	111.3	H384 S385 H390 Q391 R392	H384-I388 WeakPolarHBondContact O-CG1 3.37Å; H384-I388 PolarHBondContact O-N 3.45Å; S385-I388 PolarHBondContact O-N 3.01Å; I388-H390 VanDerWaalsContact C-N 3.28Å; I388-H390 PolarHBondContact O-N 3.35Å; I388-Q391 VanDerWaalsContact CD1-OE1 3.3Å; I388-Q391 PolarHBondContact O-N 3.03Å; I388-R392 PolarHBondContact O-N 3.07Å
389	I	89.3	Confident	88.6	Confident	56 Å²	56	69.8 Å²	69.8	29%	0.287	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-39.4	176.5	-69.4	165.9	0	0	0	110.8	S385 A386 L387 R392 Q411	S385-I389 WeakPolarHBondContact O-CD1 3.43Å; S385-I389 VanDerWaalsContact O-CG1 3.25Å; S385-I389 WeakPolarHBondContact O-CG1 3.47Å; S385-I389 PolarHBondContact O-N 3.11Å; A386-I389 PolarHBondContact O-N 2.93Å; L387-I389 VanDerWaalsContact C-N 3.35Å; L387-I389 PolarHBondContact O-N 2.84Å; I389-R392 WeakPolarHBondContact O-CB 3.41Å; I389-R392 PolarHBondContact O-N 2.97Å; I389-Q411 HydrophobicContact CG2-CG 3.73Å
390	H	90.6	Very high	88.9	Confident	18 Å²	18	67.5 Å²	67.5	8%	0.083	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-39.7	176.9	170.7	71	0	0	0	112.5	C377 F381 A386 L387 I388 R392 I393 H394	C377-H390 PolarHBondContact SG-NE2 2.99Å; F381-H390 HydrophobicContact CE1-CB 3.79Å; F381-H390 AromaticContact CE1-CG 3.96Å; F381-H390 HydrophobicContact CE2-CB 3.93Å; F381-H390 AromaticContact CE2-CD2 3.44Å; F381-H390 VanDerWaalsContact CE2-CD2 3.44Å; F381-H390 WeakPolarHBondContact CE2-CD2 3.44Å; F381-H390 AromaticContact CE2-CG 3.65Å; F381-H390 HydrophobicContact CZ-CB 3.39Å; F381-H390 AromaticContact CZ-CD2 3.39Å; F381-H390 WeakPolarHBondContact CZ-CD2 3.38Å; F381-H390 AromaticContact CZ-CG 3.12Å; F381-H390 AromaticContact CZ-ND1 3.59Å; F381-H390 AromaticContact CZ-NE2 3.96Å; A386-H390 VanDerWaalsContact O-CB 3.26Å; A386-H390 WeakPolarHBondContact O-CB 3.45Å; A386-H390 PolarHBondContact O-N 3.35Å; L387-H390 CarbonylContact O-C 3.28Å; L387-H390 WeakPolarHBondContact O-CB 3.48Å; L387-H390 PolarHBondContact O-N 3.28Å; L387-H390 VanDerWaalsContact O-N 3.12Å; I388-H390 VanDerWaalsContact C-N 3.28Å; I388-H390 PolarHBondContact O-N 3.35Å; H390-R392 PolarHBondContact O-N 2.95Å; H390-R392 VanDerWaalsContact O-N 3.15Å; H390-I393 VanDerWaalsContact O-CB 3.25Å; H390-I393 WeakPolarHBondContact O-CB 3.43Å; H390-I393 WeakPolarHBondContact O-CG1 3.28Å; H390-I393 PolarHBondContact O-N 3.1Å; H390-H394 AromaticContact CD2-NE2 3.91Å; H390-H394 AromaticContact CE1-NE2 3.67Å; H390-H394 AromaticContact NE2-CD2 3.87Å; H390-H394 AromaticContact NE2-NE2 3.09Å; H390-H394 PolarHBondContact NE2-NE2 3.18Å
391	Q	89.6	Confident	89.1	Confident	72 Å²	72	67.4 Å²	67.4	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-58.1	-28.7	178	-77.7	173	-33.8	0	0	112.6	L387 I388 I393 H394 T395	L387-Q391 HydrophobicContact CD1-CG 4.13Å; L387-Q391 HydrophobicContact CG-CG 4.47Å; L387-Q391 WeakPolarHBondContact O-CG 3.37Å; L387-Q391 PolarHBondContact O-N 3.28Å; I388-Q391 VanDerWaalsContact CD1-OE1 3.3Å; I388-Q391 PolarHBondContact O-N 3.03Å; Q391-I393 PolarHBondContact O-N 3.08Å; Q391-I393 VanDerWaalsContact O-N 3.13Å; Q391-H394 PolarHBondContact O-N 3.4Å; Q391-T395 PolarHBondContact O-N 3.28Å; Q391-T395 VanDerWaalsContact O-N 3.1Å
392	R	91.6	Very high	89.4	Confident	48 Å²	48	65.6 Å²	65.6	18%	0.181	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-19.7	173.3	-62.2	178.3	-179.2	165.9	0.6	114.1	I388 I389 H390 T395 G396 E397 S410	I388-R392 PolarHBondContact O-N 3.07Å; I389-R392 WeakPolarHBondContact O-CB 3.41Å; I389-R392 PolarHBondContact O-N 2.97Å; H390-R392 PolarHBondContact O-N 2.95Å; H390-R392 VanDerWaalsContact O-N 3.15Å; R392-T395 WeakPolarHBondContact CA-OG1 3.34Å; R392-G396 CarbonylContact O-C 3.51Å; R392-G396 WeakPolarHBondContact O-CA 3.28Å; R392-G396 PolarHBondContact O-N 3.07Å; R392-E397 HydrophobicContact CB-CB 4.43Å; R392-E397 HydrophobicContact CG-CB 4.27Å; R392-E397 PolarHBondContact O-N 3.34Å; R392-S410 WeakPolarHBondContact CD-O 3.36Å; R392-S410 PolarHBondContact NH1-O 3.08Å
393	I	89.4	Confident	89.8	Confident	119 Å²	119	74.1 Å²	74.1	61%	0.61	39%	0.387	S	S	*	.	H	α-helix	trans	-70.6	-37.4	173.7	-58.9	175.6	0	0	0	110.2	H390 Q391	H390-I393 VanDerWaalsContact O-CB 3.25Å; H390-I393 WeakPolarHBondContact O-CB 3.43Å; H390-I393 WeakPolarHBondContact O-CG1 3.28Å; H390-I393 PolarHBondContact O-N 3.1Å; Q391-I393 PolarHBondContact O-N 3.08Å; Q391-I393 VanDerWaalsContact O-N 3.13Å
394	H	89.9	Confident	90.2	Very high	78 Å²	78	75.6 Å²	75.6	36%	0.361	40%	0.397	S	S	.	.	H	α-helix	trans	-77.7	-41.2	179.4	-60.1	-58.2	0	0	0	111.7	C374 M376 C377 H390 Q391 G396	C374-H394 PolarHBondContact SG-NE2 2.94Å; C374-H394 VanDerWaalsContact SG-NE2 3.43Å; M376-H394 HydrophobicContact CG-CB 4.39Å; C377-H394 PolarHBondContact SG-NE2 3.16Å; C377-H394 VanDerWaalsContact SG-NE2 3.37Å; H390-H394 AromaticContact CD2-NE2 3.91Å; H390-H394 AromaticContact CE1-NE2 3.67Å; H390-H394 AromaticContact NE2-CD2 3.87Å; H390-H394 AromaticContact NE2-NE2 3.09Å; H390-H394 PolarHBondContact NE2-NE2 3.18Å; Q391-H394 PolarHBondContact O-N 3.4Å; H394-G396 VanDerWaalsContact C-N 3.33Å
395	T	89.4	Confident	90.5	Very high	86 Å²	86	73.1 Å²	73.1	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-80.6	-15.5	179.9	62.8	0	0	0	0	113.3	Q391 R392 E397	Q391-T395 PolarHBondContact O-N 3.28Å; Q391-T395 VanDerWaalsContact O-N 3.1Å; R392-T395 WeakPolarHBondContact CA-OG1 3.34Å; T395-E397 PolarHBondContact O-N 2.92Å; T395-E397 WeakPolarHBondContact OG1-CG 3.36Å; T395-E397 PolarHBondContact OG1-N 3.06Å
396	G	89.1	Confident	90.7	Very high	46 Å²	46	72.3 Å²	72.3	47%	0.474	39%	0.394	S	S	.	.			trans	71	4.5	-173.6	0	0	0	0	0	114.2	R392 H394 K398	R392-G396 CarbonylContact O-C 3.51Å; R392-G396 WeakPolarHBondContact O-CA 3.28Å; R392-G396 PolarHBondContact O-N 3.07Å; H394-G396 VanDerWaalsContact C-N 3.33Å; G396-K398 PolarHBondContact O-N 3.4Å
397	E	90.7	Very high	90.8	Very high	110 Å²	110	77 Å²	77	51%	0.514	41%	0.409	S	S	.	.			trans	-59.5	124.5	-179	-78.5	-179.6	-169.1	0	0	111.9	R392 T395	R392-E397 HydrophobicContact CB-CB 4.43Å; R392-E397 HydrophobicContact CG-CB 4.27Å; R392-E397 PolarHBondContact O-N 3.34Å; T395-E397 PolarHBondContact O-N 2.92Å; T395-E397 WeakPolarHBondContact OG1-CG 3.36Å; T395-E397 PolarHBondContact OG1-N 3.06Å
398	K	92.6	Very high	90.9	Very high	128 Å²	128	78.2 Å²	78.2	56%	0.557	42%	0.421	S	S	*	.			trans	-127	76.9	177.2	-71.1	168.7	176.9	-176.8	0	110.3	G396 Y400 A408 F409	G396-K398 PolarHBondContact O-N 3.4Å; K398-Y400 PolarHBondContact O-N 3.11Å; K398-A408 HydrophobicContact CB-CB 3.61Å; K398-A408 HydrophobicContact CD-CB 4.32Å; K398-A408 WeakPolarHBondContact CD-O 3.49Å; K398-F409 CarbonylContact C-O 3.31Å; K398-F409 VanDerWaalsContact C-O 3.24Å; K398-F409 VanDerWaalsContact CA-O 3.3Å; K398-F409 WeakPolarHBondContact CA-O 3.31Å
399	P	91.6	Very high	91.1	Very high	74 Å²	74	77.5 Å²	77.5	48%	0.481	42%	0.415	S	S	.	.			trans	-65.6	-14.3	-171.9	-22.1	34.4	0	0	0	114.7
400	Y	93.6	Very high	91.2	Very high	78 Å²	78	76.6 Å²	76.6	31%	0.306	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	94.4	-171.2	-54.1	-76.5	0	0	0	110.6	K398 A408 F409 S412	K398-Y400 PolarHBondContact O-N 3.11Å; Y400-A408 CarbonylContact O-C 3.24Å; Y400-A408 WeakPolarHBondContact O-CA 3.43Å; Y400-F409 PolarHBondContact N-O 3.42Å; Y400-F409 VanDerWaalsContact N-O 3.13Å; Y400-F409 PolarHBondContact O-N 3.26Å; Y400-S412 VanDerWaalsContact CD2-N 3.34Å
401	A	93.5	Very high	91.2	Very high	59 Å²	59	79.4 Å²	79.4	49%	0.488	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	137.1	178.3	0	0	0	0	0	112.6	A408	A401-A408 HydrophobicContact CB-CB 4.37Å
402	C	94.2	Very high	91.3	Very high	2 Å²	2	78.8 Å²	78.8	1%	0.014	43%	0.43	C	S	.	.			trans	-76.6	123.9	169.5	177.8	0	0	0	0	109.8	E404 C405 G406 K407 F409 L415	C402-E404 VanDerWaalsContact C-N 3.31Å; C402-E404 PolarHBondContact O-N 3.21Å; C402-C405 VanDerWaalsContact SG-SG 3.62Å; C402-G406 WeakPolarHBondContact O-CA 3.45Å; C402-G406 PolarHBondContact O-N 2.98Å; C402-K407 VanDerWaalsContact CB-O 3.3Å; C402-K407 WeakPolarHBondContact CB-O 3.24Å; C402-K407 PolarHBondContact N-O 3.2Å; C402-F409 HydrophobicContact CB-CE2 4.46Å; C402-L415 HydrophobicContact CB-CD1 3.64Å
403	K	90.9	Very high	91.2	Very high	210 Å²	210	79.6 Å²	79.6	91%	0.913	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-28.8	-179.8	-63.6	-174	179.2	-175.9	0	113.4
404	E	89.9	Confident	91.2	Very high	120 Å²	120	75.3 Å²	75.3	56%	0.561	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-32.9	-174	-67.5	166	146.1	0	0	113.3	C402 H422	C402-E404 VanDerWaalsContact C-N 3.31Å; C402-E404 PolarHBondContact O-N 3.21Å; E404-H422 WeakPolarHBondContact OE2-CB 3.47Å; E404-H422 IonicContact OE2-CD2 3.06Å; E404-H422 PolarHBondContact OE2-CD2 2.78Å; E404-H422 IonicContact OE2-CG 3.96Å; E404-H422 IonicContact OE2-NE2 2.91Å
405	C	91.3	Very high	91.3	Very high	52 Å²	52	72.8 Å²	72.8	35%	0.351	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	5.6	-176.8	72.3	0	0	0	0	114.6	C402 K407 H418 H422	C402-C405 VanDerWaalsContact SG-SG 3.62Å; C405-K407 PolarHBondContact O-N 3.45Å; C405-H418 PolarHBondContact SG-NE2 3.32Å; C405-H422 PolarHBondContact SG-NE2 3.11Å; C405-H422 VanDerWaalsContact SG-NE2 3.42Å
406	G	89.2	Confident	91.3	Very high	58 Å²	58	73.2 Å²	73.2	60%	0.598	41%	0.413	S	S	*	.			trans	69.4	-7.1	-179.8	0	0	0	0	0	115.5	C402 A408	C402-G406 WeakPolarHBondContact O-CA 3.45Å; C402-G406 PolarHBondContact O-N 2.98Å; G406-A408 PolarHBondContact O-N 3.45Å
407	K	91.6	Very high	91.2	Very high	131 Å²	131	75 Å²	75	57%	0.57	41%	0.409	S	S	*	.			trans	-64	127.4	-178.9	-72.4	-178	179.7	175.7	0	111.3	C402 C405 F409	C402-K407 VanDerWaalsContact CB-O 3.3Å; C402-K407 WeakPolarHBondContact CB-O 3.24Å; C402-K407 PolarHBondContact N-O 3.2Å; C405-K407 PolarHBondContact O-N 3.45Å; K407-F409 HydrophobicContact CB-CE2 4.09Å; K407-F409 HydrophobicContact CB-CZ 4.21Å; K407-F409 WeakPolarHBondContact O-CE2 3.48Å
408	A	93.4	Very high	91.2	Very high	38 Å²	38	70.7 Å²	70.7	31%	0.314	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	146.1	-179.8	0	0	0	0	0	113	K398 Y400 A401 G406	K398-A408 HydrophobicContact CB-CB 3.61Å; K398-A408 HydrophobicContact CD-CB 4.32Å; K398-A408 WeakPolarHBondContact CD-O 3.49Å; Y400-A408 CarbonylContact O-C 3.24Å; Y400-A408 WeakPolarHBondContact O-CA 3.43Å; A401-A408 HydrophobicContact CB-CB 4.37Å; G406-A408 PolarHBondContact O-N 3.45Å
409	F	92.3	Very high	91.1	Very high	45 Å²	45	68.1 Å²	68.1	20%	0.197	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149	-176.5	-59.3	-88.7	0	0	0	111.2	K398 Y400 C402 K407 Q411 A414 L415 H418	K398-F409 CarbonylContact C-O 3.31Å; K398-F409 VanDerWaalsContact C-O 3.24Å; K398-F409 VanDerWaalsContact CA-O 3.3Å; K398-F409 WeakPolarHBondContact CA-O 3.31Å; Y400-F409 PolarHBondContact N-O 3.42Å; Y400-F409 VanDerWaalsContact N-O 3.13Å; Y400-F409 PolarHBondContact O-N 3.26Å; C402-F409 HydrophobicContact CB-CE2 4.46Å; K407-F409 HydrophobicContact CB-CE2 4.09Å; K407-F409 HydrophobicContact CB-CZ 4.21Å; K407-F409 WeakPolarHBondContact O-CE2 3.48Å; F409-Q411 VanDerWaalsContact C-N 3.3Å; F409-A414 HydrophobicContact CB-CB 4.18Å; F409-A414 HydrophobicContact CD1-CB 3.94Å; F409-A414 HydrophobicContact CG-CB 4.28Å; F409-L415 HydrophobicContact CB-CB 4.45Å; F409-L415 HydrophobicContact CD2-CB 3.96Å; F409-L415 HydrophobicContact CD2-CD1 3.89Å; F409-L415 HydrophobicContact CE2-CD1 4.06Å; F409-L415 HydrophobicContact CG-CB 4.41Å; F409-H418 HydrophobicContact CE1-CB 4.04Å; F409-H418 HydrophobicContact CE2-CB 3.77Å; F409-H418 AromaticContact CE2-CD2 3.5Å; F409-H418 AromaticContact CE2-CG 3.58Å; F409-H418 HydrophobicContact CZ-CB 3.41Å; F409-H418 VanDerWaalsContact CZ-CB 3.41Å; F409-H418 AromaticContact CZ-CD2 3.6Å; F409-H418 AromaticContact CZ-CG 3.22Å; F409-H418 AromaticContact CZ-ND1 3.63Å
410	S	90.6	Very high	91	Very high	36 Å²	36	67.3 Å²	67.3	25%	0.252	37%	0.366	S	S	.	.	S	Bend	trans	-78.7	-13.3	177	58.3	0	0	0	0	113.4	R392	R392-S410 WeakPolarHBondContact CD-O 3.36Å; R392-S410 PolarHBondContact NH1-O 3.08Å
411	Q	90.9	Very high	90.7	Very high	78 Å²	78	69.1 Å²	69.1	36%	0.364	38%	0.38	S	S	.	.	S	Bend	trans	-135.8	143.3	-179.5	-60.4	179.2	32.4	0	0	110.9	I389 F409 A414 L415	I389-Q411 HydrophobicContact CG2-CG 3.73Å; F409-Q411 VanDerWaalsContact C-N 3.3Å; Q411-A414 HydrophobicContact CB-CB 4.38Å; Q411-A414 PolarHBondContact O-N 3.2Å; Q411-L415 PolarHBondContact O-N 3.43Å
412	S	91.7	Very high	90.5	Very high	58 Å²	58	69.9 Å²	69.9	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-35.7	178.5	56.4	0	0	0	0	112.9	Y400 A414 L415 I416	Y400-S412 VanDerWaalsContact CD2-N 3.34Å; S412-A414 VanDerWaalsContact C-N 3.28Å; S412-A414 PolarHBondContact O-N 3.13Å; S412-L415 WeakPolarHBondContact O-CB 3.43Å; S412-L415 PolarHBondContact O-N 3.26Å; S412-L415 VanDerWaalsContact O-N 3.17Å; S412-I416 WeakPolarHBondContact O-CG1 3.47Å; S412-I416 PolarHBondContact O-N 3.32Å
413	S	89.3	Confident	90.1	Very high	66 Å²	66	73.4 Å²	73.4	46%	0.462	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-39.4	175.5	51.9	0	0	0	0	112.2	I416 Q417	S413-I416 PolarHBondContact O-N 3.45Å; S413-Q417 WeakPolarHBondContact O-CB 3.35Å; S413-Q417 PolarHBondContact O-N 3.36Å
414	A	90	Very high	89.9	Confident	29 Å²	29	65.7 Å²	65.7	24%	0.24	38%	0.375	C	S	.	.	H	α-helix	trans	-67.5	-38.6	176.2	0	0	0	0	0	111.6	F409 Q411 S412 Q417 H418	F409-A414 HydrophobicContact CB-CB 4.18Å; F409-A414 HydrophobicContact CD1-CB 3.94Å; F409-A414 HydrophobicContact CG-CB 4.28Å; Q411-A414 HydrophobicContact CB-CB 4.38Å; Q411-A414 PolarHBondContact O-N 3.2Å; S412-A414 VanDerWaalsContact C-N 3.28Å; S412-A414 PolarHBondContact O-N 3.13Å; A414-Q417 PolarHBondContact O-N 2.81Å; A414-H418 VanDerWaalsContact O-CB 3.26Å; A414-H418 WeakPolarHBondContact O-CB 3.44Å; A414-H418 PolarHBondContact O-N 3.22Å
415	L	92.6	Very high	89.9	Confident	24 Å²	24	65.2 Å²	65.2	13%	0.126	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-49	172.9	172.8	61.9	0	0	0	111.5	C402 F409 Q411 S412 Q417 H418 Q419	C402-L415 HydrophobicContact CB-CD1 3.64Å; F409-L415 HydrophobicContact CB-CB 4.45Å; F409-L415 HydrophobicContact CD2-CB 3.96Å; F409-L415 HydrophobicContact CD2-CD1 3.89Å; F409-L415 HydrophobicContact CE2-CD1 4.06Å; F409-L415 HydrophobicContact CG-CB 4.41Å; Q411-L415 PolarHBondContact O-N 3.43Å; S412-L415 WeakPolarHBondContact O-CB 3.43Å; S412-L415 PolarHBondContact O-N 3.26Å; S412-L415 VanDerWaalsContact O-N 3.17Å; L415-Q417 VanDerWaalsContact C-N 3.28Å; L415-Q417 PolarHBondContact O-N 3.34Å; L415-H418 WeakPolarHBondContact O-CA 3.43Å; L415-H418 WeakPolarHBondContact O-CB 3.45Å; L415-H418 PolarHBondContact O-N 3.43Å; L415-Q419 HydrophobicContact CD1-CG 4.22Å; L415-Q419 WeakPolarHBondContact O-CG 3.25Å; L415-Q419 PolarHBondContact O-N 3.49Å
416	I	88.4	Confident	89.8	Confident	96 Å²	96	68.4 Å²	68.4	49%	0.492	38%	0.38	S	S	.	.	H	α-helix	trans	-59	-43.1	178.3	-67	165.9	0	0	0	110.5	S412 S413 H418 Q419	S412-I416 WeakPolarHBondContact O-CG1 3.47Å; S412-I416 PolarHBondContact O-N 3.32Å; S413-I416 PolarHBondContact O-N 3.45Å; I416-H418 VanDerWaalsContact C-N 3.32Å; I416-H418 PolarHBondContact O-N 3.5Å; I416-Q419 PolarHBondContact O-N 2.86Å
417	Q	87.9	Confident	89.8	Confident	82 Å²	82	68.9 Å²	68.9	38%	0.383	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-38.2	176.3	-174.3	-178.6	23.6	0	0	112	S413 A414 L415 R420 W439	S413-Q417 WeakPolarHBondContact O-CB 3.35Å; S413-Q417 PolarHBondContact O-N 3.36Å; A414-Q417 PolarHBondContact O-N 2.81Å; L415-Q417 VanDerWaalsContact C-N 3.28Å; L415-Q417 PolarHBondContact O-N 3.34Å; Q417-R420 WeakPolarHBondContact O-CB 3.3Å; Q417-R420 PolarHBondContact O-N 3.49Å; Q417-W439 VanDerWaalsContact CG-NE1 3.3Å; Q417-W439 VanDerWaalsContact NE2-CE2 3.3Å
418	H	90.2	Very high	89.8	Confident	21 Å²	21	66.2 Å²	66.2	10%	0.097	36%	0.36	C	S	.	.	H	α-helix	trans	-67	-39.3	177.4	171.1	70.8	0	0	0	112.5	C405 F409 A414 L415 I416 R420 I421 H422	C405-H418 PolarHBondContact SG-NE2 3.32Å; F409-H418 HydrophobicContact CE1-CB 4.04Å; F409-H418 HydrophobicContact CE2-CB 3.77Å; F409-H418 AromaticContact CE2-CD2 3.5Å; F409-H418 AromaticContact CE2-CG 3.58Å; F409-H418 HydrophobicContact CZ-CB 3.41Å; F409-H418 VanDerWaalsContact CZ-CB 3.41Å; F409-H418 AromaticContact CZ-CD2 3.6Å; F409-H418 AromaticContact CZ-CG 3.22Å; F409-H418 AromaticContact CZ-ND1 3.63Å; A414-H418 VanDerWaalsContact O-CB 3.26Å; A414-H418 WeakPolarHBondContact O-CB 3.44Å; A414-H418 PolarHBondContact O-N 3.22Å; L415-H418 WeakPolarHBondContact O-CA 3.43Å; L415-H418 WeakPolarHBondContact O-CB 3.45Å; L415-H418 PolarHBondContact O-N 3.43Å; I416-H418 VanDerWaalsContact C-N 3.32Å; I416-H418 PolarHBondContact O-N 3.5Å; H418-R420 PolarHBondContact O-N 3.24Å; H418-R420 VanDerWaalsContact O-N 3.11Å; H418-I421 VanDerWaalsContact O-CB 3.27Å; H418-I421 WeakPolarHBondContact O-CB 3.24Å; H418-I421 WeakPolarHBondContact O-CG1 3.07Å; H418-I421 PolarHBondContact O-N 3.21Å; H418-H422 AromaticContact CD2-NE2 3.93Å; H418-H422 AromaticContact CE1-NE2 3.73Å; H418-H422 AromaticContact NE2-CD2 3.93Å; H418-H422 AromaticContact NE2-NE2 3.13Å; H418-H422 PolarHBondContact NE2-NE2 2.98Å; H418-H422 VanDerWaalsContact NE2-NE2 3.13Å
419	Q	89.4	Confident	89.6	Confident	74 Å²	74	71.2 Å²	71.2	35%	0.346	38%	0.375	S	S	.	.	H	α-helix	trans	-57.4	-27.1	178.2	-75.2	175.9	-52	0	0	113	L415 I416 I421 H422 T423	L415-Q419 HydrophobicContact CD1-CG 4.22Å; L415-Q419 WeakPolarHBondContact O-CG 3.25Å; L415-Q419 PolarHBondContact O-N 3.49Å; I416-Q419 PolarHBondContact O-N 2.86Å; Q419-I421 PolarHBondContact O-N 2.76Å; Q419-I421 VanDerWaalsContact O-N 3.1Å; Q419-H422 PolarHBondContact O-N 3.47Å; Q419-T423 PolarHBondContact O-N 2.82Å; Q419-T423 VanDerWaalsContact O-N 3.08Å; Q419-T423 PolarHBondContact O-OG1 3.45Å
420	R	89.8	Confident	89.7	Confident	56 Å²	56	69.1 Å²	69.1	21%	0.211	37%	0.366	C	S	.	.	H	α-helix	trans	-60.8	-18.9	173.9	-59.6	-178.9	-176.6	179.8	-1	114	Q417 H418 T423 G424 S438	Q417-R420 WeakPolarHBondContact O-CB 3.3Å; Q417-R420 PolarHBondContact O-N 3.49Å; H418-R420 PolarHBondContact O-N 3.24Å; H418-R420 VanDerWaalsContact O-N 3.11Å; R420-T423 WeakPolarHBondContact CA-OG1 3.47Å; R420-G424 WeakPolarHBondContact O-CA 3.47Å; R420-G424 PolarHBondContact O-N 3.24Å; R420-G424 VanDerWaalsContact O-N 3.09Å; R420-S438 PolarHBondContact NH1-O 3.02Å
421	I	87.9	Confident	89.7	Confident	117 Å²	117	74.7 Å²	74.7	60%	0.6	39%	0.393	S	S	*	.	H	α-helix	trans	-72.6	-36.6	175.4	-59.4	175.3	0	0	0	110.4	H418 Q419	H418-I421 VanDerWaalsContact O-CB 3.27Å; H418-I421 WeakPolarHBondContact O-CB 3.24Å; H418-I421 WeakPolarHBondContact O-CG1 3.07Å; H418-I421 PolarHBondContact O-N 3.21Å; Q419-I421 PolarHBondContact O-N 2.76Å; Q419-I421 VanDerWaalsContact O-N 3.1Å
422	H	88	Confident	89.6	Confident	74 Å²	74	77.1 Å²	77.1	34%	0.343	40%	0.404	S	S	.	.	H	α-helix	trans	-81.4	-43.8	-179.7	-58.4	-56	0	0	0	111.4	E404 C405 H418 Q419 G424	E404-H422 WeakPolarHBondContact OE2-CB 3.47Å; E404-H422 IonicContact OE2-CD2 3.06Å; E404-H422 PolarHBondContact OE2-CD2 2.78Å; E404-H422 IonicContact OE2-CG 3.96Å; E404-H422 IonicContact OE2-NE2 2.91Å; C405-H422 PolarHBondContact SG-NE2 3.11Å; C405-H422 VanDerWaalsContact SG-NE2 3.42Å; H418-H422 AromaticContact CD2-NE2 3.93Å; H418-H422 AromaticContact CE1-NE2 3.73Å; H418-H422 AromaticContact NE2-CD2 3.93Å; H418-H422 AromaticContact NE2-NE2 3.13Å; H418-H422 PolarHBondContact NE2-NE2 2.98Å; H418-H422 VanDerWaalsContact NE2-NE2 3.13Å; Q419-H422 PolarHBondContact O-N 3.47Å; H422-G424 VanDerWaalsContact C-N 3.26Å; H422-G424 PolarHBondContact O-N 3.01Å
423	T	87.5	Confident	89.5	Confident	77 Å²	77	77 Å²	77	47%	0.472	40%	0.402	S	S	.	.	H	α-helix	trans	-74.8	-17.4	178.5	63.9	0	0	0	0	113.3	Q419 R420 E425	Q419-T423 PolarHBondContact O-N 2.82Å; Q419-T423 VanDerWaalsContact O-N 3.08Å; Q419-T423 PolarHBondContact O-OG1 3.45Å; R420-T423 WeakPolarHBondContact CA-OG1 3.47Å; T423-E425 PolarHBondContact O-N 3.29Å; T423-E425 WeakPolarHBondContact OG1-CG 3.3Å; T423-E425 PolarHBondContact OG1-N 2.91Å
424	G	86.4	Confident	89.5	Confident	47 Å²	47	76.5 Å²	76.5	49%	0.485	41%	0.408	S	S	.	.			trans	67.8	8.3	-174.4	0	0	0	0	0	114.1	R420 H422 K426	R420-G424 WeakPolarHBondContact O-CA 3.47Å; R420-G424 PolarHBondContact O-N 3.24Å; R420-G424 VanDerWaalsContact O-N 3.09Å; H422-G424 VanDerWaalsContact C-N 3.26Å; H422-G424 PolarHBondContact O-N 3.01Å; G424-K426 PolarHBondContact O-N 3.11Å
425	E	88.6	Confident	89.4	Confident	111 Å²	111	81.2 Å²	81.2	52%	0.519	42%	0.423	S	S	.	.			trans	-59.6	127.6	-178.5	-78.5	-179.5	-173.2	0	0	111.8	T423 P427	T423-E425 PolarHBondContact O-N 3.29Å; T423-E425 WeakPolarHBondContact OG1-CG 3.3Å; T423-E425 PolarHBondContact OG1-N 2.91Å; E425-P427 WeakPolarHBondContact O-CD 3.42Å
426	K	89.8	Confident	89.4	Confident	118 Å²	118	81.6 Å²	81.6	51%	0.513	43%	0.43	S	S	.	.			trans	-125.4	78.9	176.8	-71.2	166.4	173.3	-175.6	0	109.7	G424 Y428 A436 F437	G424-K426 PolarHBondContact O-N 3.11Å; K426-Y428 PolarHBondContact O-N 3.44Å; K426-Y428 VanDerWaalsContact O-N 3.15Å; K426-A436 HydrophobicContact CB-CB 3.53Å; K426-A436 HydrophobicContact CD-CB 4.15Å; K426-A436 WeakPolarHBondContact CD-O 3.23Å; K426-A436 HydrophobicContact CG-CB 4.45Å; K426-F437 CarbonylContact C-O 3.55Å; K426-F437 WeakPolarHBondContact CA-O 3.4Å
427	P	89.7	Confident	89.4	Confident	69 Å²	69	79.1 Å²	79.1	45%	0.448	42%	0.416	S	S	.	.			trans	-65.6	-19	-172.5	-22.3	34.5	0	0	0	114	E425	E425-P427 WeakPolarHBondContact O-CD 3.42Å
428	Y	91.4	Very high	89.3	Confident	74 Å²	74	77 Å²	77	29%	0.29	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	104.3	-171.2	-52.6	-67.9	0	0	0	109.8	K426 A436 F437 S438 W439 V440	K426-Y428 PolarHBondContact O-N 3.44Å; K426-Y428 VanDerWaalsContact O-N 3.15Å; Y428-A436 CarbonylContact O-C 3.39Å; Y428-A436 WeakPolarHBondContact O-CA 3.43Å; Y428-F437 PolarHBondContact N-O 3.17Å; Y428-F437 PolarHBondContact O-N 2.98Å; Y428-S438 WeakPolarHBondContact CE2-O 3.34Å; Y428-W439 VanDerWaalsContact CD2-C 3.47Å; Y428-V440 HydrophobicContact CD1-CG2 3.56Å; Y428-V440 HydrophobicContact CD2-CG2 4.12Å; Y428-V440 HydrophobicContact CE1-CG2 3.2Å; Y428-V440 HydrophobicContact CE2-CG2 3.79Å; Y428-V440 HydrophobicContact CG-CG2 4Å
429	K	90.3	Very high	89.2	Confident	143 Å²	143	79.9 Å²	79.9	62%	0.622	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.2	179.3	-62.1	-178.6	-179.4	179.6	0	110.1	A436	K429-A436 HydrophobicContact CG-CB 3.98Å
430	C	93.1	Very high	89.1	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.007	42%	0.422	C	S	.	.			trans	-81.4	123.2	168.5	179.9	0	0	0	0	108.4	E432 G434 K435 F437 L443	C430-E432 VanDerWaalsContact C-N 3.28Å; C430-E432 PolarHBondContact O-N 2.85Å; C430-G434 WeakPolarHBondContact O-CA 3.4Å; C430-G434 PolarHBondContact O-N 3.32Å; C430-K435 WeakPolarHBondContact CB-O 3.47Å; C430-K435 PolarHBondContact N-O 3.05Å; C430-F437 HydrophobicContact CB-CE2 4.47Å; C430-L443 HydrophobicContact CB-CD1 3.77Å
431	D	90.1	Very high	89	Confident	154 Å²	154	80 Å²	80	82%	0.824	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-28	-177.7	-59.8	-37.4	0	0	0	111.7
432	E	88.9	Confident	89	Confident	129 Å²	129	80.8 Å²	80.8	60%	0.603	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-35.7	-177.9	-65.2	-173.2	-145.3	0	0	114.2	C430 H450	C430-E432 VanDerWaalsContact C-N 3.28Å; C430-E432 PolarHBondContact O-N 2.85Å; E432-H450 WeakPolarHBondContact OE2-CB 3.39Å; E432-H450 IonicContact OE2-CE1 3.95Å; E432-H450 IonicContact OE2-CG 3.11Å; E432-H450 IonicContact OE2-ND1 3.02Å; E432-H450 PolarHBondContact OE2-ND1 3.4Å
433	C	90.5	Very high	89.1	Confident	54 Å²	54	78.1 Å²	78.1	37%	0.365	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	6.8	-175.1	84.3	0	0	0	0	114.5	K435 H446	C433-K435 PolarHBondContact O-N 2.97Å; C433-K435 VanDerWaalsContact SG-CB 3.55Å; C433-K435 WeakPolarHBondContact SG-CG 3.49Å; C433-H446 PolarHBondContact SG-NE2 3.11Å
434	G	88.1	Confident	89.2	Confident	57 Å²	57	78.5 Å²	78.5	59%	0.588	42%	0.417	S	S	*	.			trans	66.6	0.8	179.3	0	0	0	0	0	115.5	C430 A436	C430-G434 WeakPolarHBondContact O-CA 3.4Å; C430-G434 PolarHBondContact O-N 3.32Å; G434-A436 PolarHBondContact O-N 3.18Å
435	K	89.4	Confident	89.2	Confident	127 Å²	127	78.9 Å²	78.9	55%	0.552	41%	0.407	S	S	*	.			trans	-69.5	129.2	-177.6	-77	178.9	-175.7	170.3	0	110.3	C430 C433 F437	C430-K435 WeakPolarHBondContact CB-O 3.47Å; C430-K435 PolarHBondContact N-O 3.05Å; C433-K435 PolarHBondContact O-N 2.97Å; C433-K435 VanDerWaalsContact SG-CB 3.55Å; C433-K435 WeakPolarHBondContact SG-CG 3.49Å; K435-F437 HydrophobicContact CB-CE2 3.87Å; K435-F437 HydrophobicContact CB-CZ 4.06Å; K435-F437 WeakPolarHBondContact O-CE2 3.45Å
436	A	91.6	Very high	89.3	Confident	32 Å²	32	74.3 Å²	74.3	26%	0.264	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	142.3	-179.8	0	0	0	0	0	112	K426 Y428 K429 G434	K426-A436 HydrophobicContact CB-CB 3.53Å; K426-A436 HydrophobicContact CD-CB 4.15Å; K426-A436 WeakPolarHBondContact CD-O 3.23Å; K426-A436 HydrophobicContact CG-CB 4.45Å; Y428-A436 CarbonylContact O-C 3.39Å; Y428-A436 WeakPolarHBondContact O-CA 3.43Å; K429-A436 HydrophobicContact CG-CB 3.98Å; G434-A436 PolarHBondContact O-N 3.18Å
437	F	88.8	Confident	89.2	Confident	45 Å²	45	71.4 Å²	71.4	20%	0.197	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.2	-178.6	-59.6	-89	0	0	0	111.1	K426 Y428 C430 K435 W439 R442 L443 H446	K426-F437 CarbonylContact C-O 3.55Å; K426-F437 WeakPolarHBondContact CA-O 3.4Å; Y428-F437 PolarHBondContact N-O 3.17Å; Y428-F437 PolarHBondContact O-N 2.98Å; C430-F437 HydrophobicContact CB-CE2 4.47Å; K435-F437 HydrophobicContact CB-CE2 3.87Å; K435-F437 HydrophobicContact CB-CZ 4.06Å; K435-F437 WeakPolarHBondContact O-CE2 3.45Å; F437-W439 VanDerWaalsContact C-N 3.34Å; F437-R442 HydrophobicContact CB-CB 4.18Å; F437-R442 HydrophobicContact CD1-CB 3.9Å; F437-R442 HydrophobicContact CG-CB 4.28Å; F437-L443 HydrophobicContact CD2-CB 4.16Å; F437-L443 HydrophobicContact CD2-CD1 3.58Å; F437-L443 HydrophobicContact CE2-CD1 3.92Å; F437-H446 HydrophobicContact CE1-CB 4.06Å; F437-H446 HydrophobicContact CE2-CB 3.87Å; F437-H446 AromaticContact CE2-CD2 3.3Å; F437-H446 WeakPolarHBondContact CE2-CD2 3.36Å; F437-H446 AromaticContact CE2-CG 3.6Å; F437-H446 AromaticContact CE2-NE2 3.96Å; F437-H446 HydrophobicContact CZ-CB 3.48Å; F437-H446 VanDerWaalsContact CZ-CB 3.48Å; F437-H446 AromaticContact CZ-CD2 3.44Å; F437-H446 VanDerWaalsContact CZ-CD2 3.44Å; F437-H446 WeakPolarHBondContact CZ-CD2 2.83Å; F437-H446 AromaticContact CZ-CG 3.25Å; F437-H446 AromaticContact CZ-ND1 3.77Å; F437-H446 AromaticContact CZ-NE2 3.98Å
438	S	86.6	Confident	89.2	Confident	37 Å²	37	70.9 Å²	70.9	26%	0.259	36%	0.363	S	S	.	.	S	Bend	trans	-76.8	-21.5	177.9	52.5	0	0	0	0	112.9	R420 Y428	R420-S438 PolarHBondContact NH1-O 3.02Å; Y428-S438 WeakPolarHBondContact CE2-O 3.34Å
439	W	86.8	Confident	89	Confident	82 Å²	82	73 Å²	73	31%	0.311	38%	0.379	S	S	.	.	S	Bend	trans	-133	141.6	-177.1	-50.6	-32.3	0	0	0	112.5	Q417 Y428 F437 S441 R442 L443	Q417-W439 VanDerWaalsContact CG-NE1 3.3Å; Q417-W439 VanDerWaalsContact NE2-CE2 3.3Å; Y428-W439 VanDerWaalsContact CD2-C 3.47Å; F437-W439 VanDerWaalsContact C-N 3.34Å; W439-S441 VanDerWaalsContact C-N 3.31Å; W439-S441 PolarHBondContact O-N 3.05Å; W439-R442 HydrophobicContact CB-CG 4.23Å; W439-R442 HydrophobicContact CD2-CG 4.49Å; W439-R442 HydrophobicContact CE3-CG 3.8Å; W439-R442 WeakPolarHBondContact O-CB 3.11Å; W439-R442 PolarHBondContact O-N 3.08Å; W439-R442 VanDerWaalsContact O-N 3.12Å; W439-L443 PolarHBondContact O-N 3.48Å
440	V	87.7	Confident	88.9	Confident	63 Å²	63	69.5 Å²	69.5	38%	0.382	36%	0.364	S	S	.	.	H	α-helix	trans	-57.7	-41.4	175.8	-179.6	0	0	0	0	112	Y428 R442 L443 N444	Y428-V440 HydrophobicContact CD1-CG2 3.56Å; Y428-V440 HydrophobicContact CD2-CG2 4.12Å; Y428-V440 HydrophobicContact CE1-CG2 3.2Å; Y428-V440 HydrophobicContact CE2-CG2 3.79Å; Y428-V440 HydrophobicContact CG-CG2 4Å; V440-R442 PolarHBondContact O-N 2.89Å; V440-L443 WeakPolarHBondContact O-CB 3.36Å; V440-L443 PolarHBondContact O-N 3.1Å; V440-L443 VanDerWaalsContact O-N 3.1Å; V440-N444 PolarHBondContact O-N 3.47Å; V440-N444 PolarHBondContact O-OD1 3.41Å
441	S	87.7	Confident	88.7	Confident	68 Å²	68	73.2 Å²	73.2	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-32	180	56.6	0	0	0	0	112.7	W439 I445	W439-S441 VanDerWaalsContact C-N 3.31Å; W439-S441 PolarHBondContact O-N 3.05Å; S441-I445 WeakPolarHBondContact O-CD1 3.5Å; S441-I445 VanDerWaalsContact O-CG1 3.25Å; S441-I445 WeakPolarHBondContact O-CG1 3.47Å; S441-I445 PolarHBondContact O-N 3.47Å; S441-I445 VanDerWaalsContact O-N 3.1Å
442	R	87.9	Confident	88.5	Confident	135 Å²	135	68.2 Å²	68.2	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-73.3	-39.9	175.3	-66.6	-66.4	-170.9	177	0.8	111.3	F437 W439 V440 I445 H446	F437-R442 HydrophobicContact CB-CB 4.18Å; F437-R442 HydrophobicContact CD1-CB 3.9Å; F437-R442 HydrophobicContact CG-CB 4.28Å; W439-R442 HydrophobicContact CB-CG 4.23Å; W439-R442 HydrophobicContact CD2-CG 4.49Å; W439-R442 HydrophobicContact CE3-CG 3.8Å; W439-R442 WeakPolarHBondContact O-CB 3.11Å; W439-R442 PolarHBondContact O-N 3.08Å; W439-R442 VanDerWaalsContact O-N 3.12Å; V440-R442 PolarHBondContact O-N 2.89Å; R442-I445 PolarHBondContact O-N 3.03Å; R442-H446 VanDerWaalsContact O-CB 3.3Å; R442-H446 WeakPolarHBondContact O-CB 3.38Å; R442-H446 PolarHBondContact O-N 2.97Å
443	L	91.1	Very high	88.5	Confident	18 Å²	18	67.5 Å²	67.5	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-58.9	-49.4	171.5	-176.8	73.9	0	0	0	110.9	C430 F437 W439 V440 I445 H446 H447	C430-L443 HydrophobicContact CB-CD1 3.77Å; F437-L443 HydrophobicContact CD2-CB 4.16Å; F437-L443 HydrophobicContact CD2-CD1 3.58Å; F437-L443 HydrophobicContact CE2-CD1 3.92Å; W439-L443 PolarHBondContact O-N 3.48Å; V440-L443 WeakPolarHBondContact O-CB 3.36Å; V440-L443 PolarHBondContact O-N 3.1Å; V440-L443 VanDerWaalsContact O-N 3.1Å; L443-I445 VanDerWaalsContact C-N 3.33Å; L443-I445 PolarHBondContact O-N 3.26Å; L443-H446 CarbonylContact O-C 3.58Å; L443-H446 WeakPolarHBondContact O-CA 3.47Å; L443-H446 WeakPolarHBondContact O-CB 3.28Å; L443-H446 PolarHBondContact O-N 3.48Å; L443-H447 WeakPolarHBondContact CD1-NE2 3.42Å; L443-H447 PolarHBondContact O-CD2 3.37Å; L443-H447 PolarHBondContact O-N 2.98Å
444	N	88.9	Confident	88.5	Confident	84 Å²	84	70.6 Å²	70.6	45%	0.449	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-38.9	-179.1	-68.6	-2.1	0	0	0	112.6	V440 H446 R448	V440-N444 PolarHBondContact O-N 3.47Å; V440-N444 PolarHBondContact O-OD1 3.41Å; N444-H446 VanDerWaalsContact C-N 3.3Å; N444-R448 WeakPolarHBondContact O-CG 3.36Å
445	I	87.3	Confident	88.6	Confident	55 Å²	55	70.7 Å²	70.7	28%	0.282	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-35.8	173.6	-67.6	164.9	0	0	0	110.6	S441 R442 L443 R448	S441-I445 WeakPolarHBondContact O-CD1 3.5Å; S441-I445 VanDerWaalsContact O-CG1 3.25Å; S441-I445 WeakPolarHBondContact O-CG1 3.47Å; S441-I445 PolarHBondContact O-N 3.47Å; S441-I445 VanDerWaalsContact O-N 3.1Å; R442-I445 PolarHBondContact O-N 3.03Å; L443-I445 VanDerWaalsContact C-N 3.33Å; L443-I445 PolarHBondContact O-N 3.26Å; I445-R448 WeakPolarHBondContact O-CB 3.32Å; I445-R448 PolarHBondContact O-N 3.49Å
446	H	90.2	Very high	88.7	Confident	16 Å²	16	68.7 Å²	68.7	7%	0.074	36%	0.356	C	S	.	.	H	α-helix	trans	-69.2	-39.8	177.2	170.5	64.9	0	0	0	112.6	C433 F437 R442 L443 N444 R448 I449 H450	C433-H446 PolarHBondContact SG-NE2 3.11Å; F437-H446 HydrophobicContact CE1-CB 4.06Å; F437-H446 HydrophobicContact CE2-CB 3.87Å; F437-H446 AromaticContact CE2-CD2 3.3Å; F437-H446 WeakPolarHBondContact CE2-CD2 3.36Å; F437-H446 AromaticContact CE2-CG 3.6Å; F437-H446 AromaticContact CE2-NE2 3.96Å; F437-H446 HydrophobicContact CZ-CB 3.48Å; F437-H446 VanDerWaalsContact CZ-CB 3.48Å; F437-H446 AromaticContact CZ-CD2 3.44Å; F437-H446 VanDerWaalsContact CZ-CD2 3.44Å; F437-H446 WeakPolarHBondContact CZ-CD2 2.83Å; F437-H446 AromaticContact CZ-CG 3.25Å; F437-H446 AromaticContact CZ-ND1 3.77Å; F437-H446 AromaticContact CZ-NE2 3.98Å; R442-H446 VanDerWaalsContact O-CB 3.3Å; R442-H446 WeakPolarHBondContact O-CB 3.38Å; R442-H446 PolarHBondContact O-N 2.97Å; L443-H446 CarbonylContact O-C 3.58Å; L443-H446 WeakPolarHBondContact O-CA 3.47Å; L443-H446 WeakPolarHBondContact O-CB 3.28Å; L443-H446 PolarHBondContact O-N 3.48Å; N444-H446 VanDerWaalsContact C-N 3.3Å; H446-R448 PolarHBondContact O-N 3.18Å; H446-R448 VanDerWaalsContact O-N 3.13Å; H446-I449 WeakPolarHBondContact O-CB 3.36Å; H446-I449 WeakPolarHBondContact O-CG1 3.39Å; H446-I449 PolarHBondContact O-N 3.04Å; H446-H450 AromaticContact CE1-NE2 3.52Å; H446-H450 AromaticContact NE2-CD2 3.94Å; H446-H450 AromaticContact NE2-NE2 3.35Å; H446-H450 PolarHBondContact NE2-NE2 3.29Å
447	H	87.9	Confident	88.7	Confident	57 Å²	57	72.7 Å²	72.7	26%	0.264	37%	0.368	S	S	.	.	H	α-helix	trans	-56	-29.9	174.3	-78.5	-155.2	0	0	0	112.1	L443 I449 H450 T451	L443-H447 WeakPolarHBondContact CD1-NE2 3.42Å; L443-H447 PolarHBondContact O-CD2 3.37Å; L443-H447 PolarHBondContact O-N 2.98Å; H447-I449 PolarHBondContact O-N 3.43Å; H447-H450 VanDerWaalsContact O-CB 3.31Å; H447-H450 WeakPolarHBondContact O-CB 3.48Å; H447-H450 PolarHBondContact O-N 3.43Å; H447-T451 PolarHBondContact O-N 3.38Å; H447-T451 PolarHBondContact O-OG1 3.36Å
448	R	89.3	Confident	88.9	Confident	57 Å²	57	70.6 Å²	70.6	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-65.9	-17	174.8	-64.3	172	-173.3	-159.5	-10.8	114.5	N444 I445 H446 H450 T451 G452 E453 S466	N444-R448 WeakPolarHBondContact O-CG 3.36Å; I445-R448 WeakPolarHBondContact O-CB 3.32Å; I445-R448 PolarHBondContact O-N 3.49Å; H446-R448 PolarHBondContact O-N 3.18Å; H446-R448 VanDerWaalsContact O-N 3.13Å; R448-H450 VanDerWaalsContact C-N 3.33Å; R448-T451 WeakPolarHBondContact CA-OG1 3.47Å; R448-G452 CarbonylContact O-C 3.52Å; R448-G452 WeakPolarHBondContact O-CA 3.43Å; R448-G452 PolarHBondContact O-N 3.43Å; R448-E453 WeakPolarHBondContact CB-O 3.37Å; R448-E453 HydrophobicContact CG-CB 4.36Å; R448-E453 PolarHBondContact O-N 3.08Å; R448-S466 WeakPolarHBondContact CD-O 3.19Å; R448-S466 PolarHBondContact NH1-O 3.28Å
449	I	87.1	Confident	89	Confident	120 Å²	120	77.9 Å²	77.9	62%	0.615	39%	0.386	S	S	*	.	H	α-helix	trans	-71.9	-36.3	172	-59.6	175.7	0	0	0	109.7	H446 H447	H446-I449 WeakPolarHBondContact O-CB 3.36Å; H446-I449 WeakPolarHBondContact O-CG1 3.39Å; H446-I449 PolarHBondContact O-N 3.04Å; H447-I449 PolarHBondContact O-N 3.43Å
450	H	88.3	Confident	89.1	Confident	68 Å²	68	78.8 Å²	78.8	32%	0.315	39%	0.394	S	S	.	.	H	α-helix	trans	-73.8	-48.4	178.3	-68.6	-75.7	0	0	0	111.9	E432 H446 H447 R448 G452	E432-H450 WeakPolarHBondContact OE2-CB 3.39Å; E432-H450 IonicContact OE2-CE1 3.95Å; E432-H450 IonicContact OE2-CG 3.11Å; E432-H450 IonicContact OE2-ND1 3.02Å; E432-H450 PolarHBondContact OE2-ND1 3.4Å; H446-H450 AromaticContact CE1-NE2 3.52Å; H446-H450 AromaticContact NE2-CD2 3.94Å; H446-H450 AromaticContact NE2-NE2 3.35Å; H446-H450 PolarHBondContact NE2-NE2 3.29Å; H447-H450 VanDerWaalsContact O-CB 3.31Å; H447-H450 WeakPolarHBondContact O-CB 3.48Å; H447-H450 PolarHBondContact O-N 3.43Å; R448-H450 VanDerWaalsContact C-N 3.33Å; H450-G452 VanDerWaalsContact C-N 3.27Å; H450-G452 PolarHBondContact O-N 3.28Å
451	T	87.8	Confident	89.2	Confident	80 Å²	80	78.3 Å²	78.3	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-76.8	-13.8	179.7	64.2	0	0	0	0	113.5	H447 R448 E453	H447-T451 PolarHBondContact O-N 3.38Å; H447-T451 PolarHBondContact O-OG1 3.36Å; R448-T451 WeakPolarHBondContact CA-OG1 3.47Å; T451-E453 PolarHBondContact O-N 3.05Å; T451-E453 WeakPolarHBondContact OG1-CB 3.46Å; T451-E453 WeakPolarHBondContact OG1-CG 2.92Å; T451-E453 PolarHBondContact OG1-N 3.37Å
452	G	86.4	Confident	89.2	Confident	49 Å²	49	77.5 Å²	77.5	51%	0.505	40%	0.396	S	S	.	.			trans	70.5	2	-173.6	0	0	0	0	0	114.4	R448 H450 K454	R448-G452 CarbonylContact O-C 3.52Å; R448-G452 WeakPolarHBondContact O-CA 3.43Å; R448-G452 PolarHBondContact O-N 3.43Å; H450-G452 VanDerWaalsContact C-N 3.27Å; H450-G452 PolarHBondContact O-N 3.28Å; G452-K454 PolarHBondContact O-N 3.27Å
453	E	89.5	Confident	89.3	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	40%	0.399	S	S	.	.			trans	-63.1	127.4	-177.4	-74.6	-177.6	178	0	0	112.2	R448 T451 P455	R448-E453 WeakPolarHBondContact CB-O 3.37Å; R448-E453 HydrophobicContact CG-CB 4.36Å; R448-E453 PolarHBondContact O-N 3.08Å; T451-E453 PolarHBondContact O-N 3.05Å; T451-E453 WeakPolarHBondContact OG1-CB 3.46Å; T451-E453 WeakPolarHBondContact OG1-CG 2.92Å; T451-E453 PolarHBondContact OG1-N 3.37Å; E453-P455 WeakPolarHBondContact O-CD 3.41Å
454	K	90.6	Very high	89.3	Confident	119 Å²	119	78 Å²	78	52%	0.517	41%	0.407	S	S	.	.			trans	-126.4	75.9	175.7	-68.4	175.5	-177.7	178.7	0	110.5	G452 Y456 H457 A464 F465	G452-K454 PolarHBondContact O-N 3.27Å; K454-Y456 PolarHBondContact O-N 3.44Å; K454-Y456 VanDerWaalsContact O-N 3.09Å; K454-H457 PolarHBondContact O-CE1 3.5Å; K454-A464 HydrophobicContact CB-CB 3.53Å; K454-A464 HydrophobicContact CD-CB 4.07Å; K454-A464 WeakPolarHBondContact CD-O 3.38Å; K454-A464 HydrophobicContact CG-CB 4.45Å; K454-F465 CarbonylContact C-O 3.33Å; K454-F465 WeakPolarHBondContact CA-O 3.35Å
455	P	90.5	Very high	89.4	Confident	59 Å²	59	76.1 Å²	76.1	38%	0.383	40%	0.395	S	S	.	.			trans	-64.4	-21.3	-170.8	-24.2	35.9	0	0	0	114.2	E453 H457	E453-P455 WeakPolarHBondContact O-CD 3.41Å; P455-H457 PolarHBondContact O-ND1 3.04Å; P455-H457 VanDerWaalsContact O-ND1 3.16Å
456	Y	91.1	Very high	89.4	Confident	85 Å²	85	75.4 Å²	75.4	33%	0.333	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	114.3	-172.1	-54.5	-75.8	0	0	0	110.9	K454 A464 F465 H468 V471	K454-Y456 PolarHBondContact O-N 3.44Å; K454-Y456 VanDerWaalsContact O-N 3.09Å; Y456-A464 CarbonylContact O-C 3.32Å; Y456-A464 WeakPolarHBondContact O-CA 3.44Å; Y456-F465 PolarHBondContact N-O 3.21Å; Y456-F465 PolarHBondContact O-N 3.47Å; Y456-H468 HydrophobicContact CD1-CB 4.12Å; Y456-H468 HydrophobicContact CE1-CB 3.85Å; Y456-H468 HydrophobicContact CE2-CB 4.24Å; Y456-H468 VanDerWaalsContact CE2-N 3.3Å; Y456-H468 HydrophobicContact CG-CB 4.45Å; Y456-V471 HydrophobicContact CG-CG2 4.46Å; Y456-V471 WeakPolarHBondContact O-CG2 3.33Å
457	H	91.3	Very high	89.4	Confident	115 Å²	115	75.9 Å²	75.9	53%	0.532	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137	-176.7	-60.9	78.3	0	0	0	110.8	K454 P455 K459	K454-H457 PolarHBondContact O-CE1 3.5Å; P455-H457 PolarHBondContact O-ND1 3.04Å; P455-H457 VanDerWaalsContact O-ND1 3.16Å; H457-K459 PolarHBondContact O-N 3.31Å
458	C	92.4	Very high	89.4	Confident	2 Å²	2	78 Å²	78	1%	0.014	41%	0.409	C	S	.	.			trans	-74.2	122	166.1	-176	0	0	0	0	108.9	E460 G462 K463 F465 H478	C458-E460 PolarHBondContact O-N 3.46Å; C458-G462 VanDerWaalsContact O-CA 3.25Å; C458-G462 WeakPolarHBondContact O-CA 3.21Å; C458-G462 PolarHBondContact O-N 2.8Å; C458-K463 WeakPolarHBondContact CB-O 3.26Å; C458-K463 PolarHBondContact N-O 2.88Å; C458-F465 HydrophobicContact CB-CE2 4.42Å; C458-H478 PolarHBondContact SG-NE2 2.71Å; C458-H478 VanDerWaalsContact SG-NE2 3.43Å
459	K	88.5	Confident	89.3	Confident	189 Å²	189	79.5 Å²	79.5	82%	0.822	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-27	-179.9	-67.7	-173.1	178.7	-173.4	0	112.9	H457	H457-K459 PolarHBondContact O-N 3.31Å
460	E	88.9	Confident	89.4	Confident	101 Å²	101	75.1 Å²	75.1	47%	0.472	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-32.9	-173.2	-70.5	143.8	-135.6	0	0	113.2	C458 R475 H478	C458-E460 PolarHBondContact O-N 3.46Å; E460-R475 IonicContact OE1-NH1 3.17Å; E460-R475 PolarHBondContact OE1-NH1 3.44Å; E460-H478 WeakPolarHBondContact OE2-CB 3.42Å; E460-H478 IonicContact OE2-CD2 3.1Å; E460-H478 PolarHBondContact OE2-CD2 3.21Å; E460-H478 IonicContact OE2-CG 3.03Å
461	C	90.6	Very high	89.5	Confident	53 Å²	53	72.1 Å²	72.1	36%	0.358	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	4.5	-177.2	72.6	0	0	0	0	114.5	K463 H474 H478	C461-K463 PolarHBondContact O-N 3.28Å; C461-H474 PolarHBondContact SG-NE2 2.9Å; C461-H478 PolarHBondContact SG-NE2 3.48Å
462	G	87.2	Confident	89.6	Confident	52 Å²	52	71.6 Å²	71.6	54%	0.536	39%	0.391	S	S	.	.			trans	69.3	-7.6	-179.9	0	0	0	0	0	115.8	C458 A464	C458-G462 VanDerWaalsContact O-CA 3.25Å; C458-G462 WeakPolarHBondContact O-CA 3.21Å; C458-G462 PolarHBondContact O-N 2.8Å; G462-A464 PolarHBondContact O-N 3.37Å
463	K	90.1	Very high	89.6	Confident	130 Å²	130	72 Å²	72	57%	0.565	38%	0.384	S	S	*	.			trans	-60.2	129.3	-178.3	-72.5	-177.8	-179.3	177.4	0	111.2	C458 C461 F465	C458-K463 WeakPolarHBondContact CB-O 3.26Å; C458-K463 PolarHBondContact N-O 2.88Å; C461-K463 PolarHBondContact O-N 3.28Å; K463-F465 HydrophobicContact CB-CE2 3.71Å; K463-F465 HydrophobicContact CB-CZ 4.09Å; K463-F465 WeakPolarHBondContact O-CD2 3.45Å; K463-F465 VanDerWaalsContact O-CE2 3.28Å; K463-F465 WeakPolarHBondContact O-CE2 3.46Å
464	A	91.6	Very high	89.6	Confident	32 Å²	32	67.6 Å²	67.6	26%	0.264	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.6	-179.9	0	0	0	0	0	111.6	K454 Y456 G462	K454-A464 HydrophobicContact CB-CB 3.53Å; K454-A464 HydrophobicContact CD-CB 4.07Å; K454-A464 WeakPolarHBondContact CD-O 3.38Å; K454-A464 HydrophobicContact CG-CB 4.45Å; Y456-A464 CarbonylContact O-C 3.32Å; Y456-A464 WeakPolarHBondContact O-CA 3.44Å; G462-A464 PolarHBondContact O-N 3.37Å
465	F	90.3	Very high	89.5	Confident	46 Å²	46	65.2 Å²	65.2	20%	0.202	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.2	-177.8	-59.5	-100.9	0	0	0	111.6	K454 Y456 C458 K463 A470 V471 H474	K454-F465 CarbonylContact C-O 3.33Å; K454-F465 WeakPolarHBondContact CA-O 3.35Å; Y456-F465 PolarHBondContact N-O 3.21Å; Y456-F465 PolarHBondContact O-N 3.47Å; C458-F465 HydrophobicContact CB-CE2 4.42Å; K463-F465 HydrophobicContact CB-CE2 3.71Å; K463-F465 HydrophobicContact CB-CZ 4.09Å; K463-F465 WeakPolarHBondContact O-CD2 3.45Å; K463-F465 VanDerWaalsContact O-CE2 3.28Å; K463-F465 WeakPolarHBondContact O-CE2 3.46Å; F465-A470 HydrophobicContact CB-CB 4.2Å; F465-A470 HydrophobicContact CD1-CB 3.94Å; F465-A470 HydrophobicContact CG-CB 4.39Å; F465-V471 HydrophobicContact CB-CG2 3.59Å; F465-V471 HydrophobicContact CD2-CB 4.43Å; F465-V471 HydrophobicContact CD2-CG2 3.54Å; F465-V471 HydrophobicContact CE2-CG2 4.46Å; F465-V471 HydrophobicContact CG-CG2 3.78Å; F465-H474 HydrophobicContact CE1-CB 3.97Å; F465-H474 HydrophobicContact CE2-CB 4.06Å; F465-H474 AromaticContact CE2-CD2 3.59Å; F465-H474 AromaticContact CE2-CG 3.8Å; F465-H474 HydrophobicContact CZ-CB 3.5Å; F465-H474 AromaticContact CZ-CD2 3.52Å; F465-H474 AromaticContact CZ-CG 3.26Å; F465-H474 AromaticContact CZ-ND1 3.74Å
466	S	88	Confident	89.4	Confident	39 Å²	39	64.8 Å²	64.8	27%	0.273	34%	0.343	S	S	.	.	S	Bend	trans	-79.2	-14.6	-179.3	58.1	0	0	0	0	114	R448	R448-S466 WeakPolarHBondContact CD-O 3.19Å; R448-S466 PolarHBondContact NH1-O 3.28Å
467	S	89.1	Confident	89.2	Confident	26 Å²	26	65.6 Å²	65.6	18%	0.182	35%	0.352	C	S	.	.	S	Bend	trans	-139.3	147.7	-179.6	71.6	0	0	0	0	113.2	S469 A470 V471	S467-S469 PolarHBondContact O-N 2.96Å; S467-A470 PolarHBondContact O-N 3.46Å; S467-A470 VanDerWaalsContact OG-CB 3.3Å; S467-A470 WeakPolarHBondContact OG-CB 3.49Å; S467-A470 PolarHBondContact OG-N 2.92Å; S467-V471 PolarHBondContact O-N 2.9Å
468	H	88.8	Confident	88.9	Confident	101 Å²	101	63.9 Å²	63.9	47%	0.468	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-40.9	179.9	-177.1	54.5	0	0	0	112.3	Y456 A470 V471 N472	Y456-H468 HydrophobicContact CD1-CB 4.12Å; Y456-H468 HydrophobicContact CE1-CB 3.85Å; Y456-H468 HydrophobicContact CE2-CB 4.24Å; Y456-H468 VanDerWaalsContact CE2-N 3.3Å; Y456-H468 HydrophobicContact CG-CB 4.45Å; H468-A470 VanDerWaalsContact C-N 3.25Å; H468-A470 PolarHBondContact O-N 3.44Å; H468-V471 PolarHBondContact O-N 2.87Å; H468-V471 VanDerWaalsContact O-N 3.14Å; H468-N472 PolarHBondContact CE1-OD1 2.85Å; H468-N472 PolarHBondContact NE2-ND2 3.47Å; H468-N472 PolarHBondContact O-N 3.28Å
469	S	88.3	Confident	88.6	Confident	89 Å²	89	67.3 Å²	67.3	62%	0.622	37%	0.366	S	S	*	.	H	α-helix	trans	-59.2	-37.1	176.7	-52.4	0	0	0	0	112.2	S467 N472 T473	S467-S469 PolarHBondContact O-N 2.96Å; S469-N472 PolarHBondContact O-N 3.5Å; S469-T473 WeakPolarHBondContact O-CG2 3.22Å; S469-T473 PolarHBondContact O-N 2.96Å; S469-T473 PolarHBondContact O-OG1 3.46Å
470	A	88.7	Confident	88.3	Confident	29 Å²	29	60.6 Å²	60.6	24%	0.24	35%	0.349	C	S	.	.	H	α-helix	trans	-68.1	-35.9	177.3	0	0	0	0	0	112.6	F465 S467 H468 T473 H474	F465-A470 HydrophobicContact CB-CB 4.2Å; F465-A470 HydrophobicContact CD1-CB 3.94Å; F465-A470 HydrophobicContact CG-CB 4.39Å; S467-A470 PolarHBondContact O-N 3.46Å; S467-A470 VanDerWaalsContact OG-CB 3.3Å; S467-A470 WeakPolarHBondContact OG-CB 3.49Å; S467-A470 PolarHBondContact OG-N 2.92Å; H468-A470 VanDerWaalsContact C-N 3.25Å; H468-A470 PolarHBondContact O-N 3.44Å; A470-T473 WeakPolarHBondContact CA-OG1 3.47Å; A470-T473 PolarHBondContact O-OG1 3.21Å; A470-H474 VanDerWaalsContact O-CB 3.25Å; A470-H474 WeakPolarHBondContact O-CB 3.42Å; A470-H474 PolarHBondContact O-N 3.45Å
471	V	90.4	Very high	88.1	Confident	5 Å²	5	61 Å²	61	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-66.8	-43	172.6	-178.6	0	0	0	0	111	Y456 F465 S467 H468 T473 H474 R475	Y456-V471 HydrophobicContact CG-CG2 4.46Å; Y456-V471 WeakPolarHBondContact O-CG2 3.33Å; F465-V471 HydrophobicContact CB-CG2 3.59Å; F465-V471 HydrophobicContact CD2-CB 4.43Å; F465-V471 HydrophobicContact CD2-CG2 3.54Å; F465-V471 HydrophobicContact CE2-CG2 4.46Å; F465-V471 HydrophobicContact CG-CG2 3.78Å; S467-V471 PolarHBondContact O-N 2.9Å; H468-V471 PolarHBondContact O-N 2.87Å; H468-V471 VanDerWaalsContact O-N 3.14Å; V471-T473 PolarHBondContact O-N 3.34Å; V471-H474 WeakPolarHBondContact O-CB 3.46Å; V471-H474 PolarHBondContact O-N 3.44Å; V471-R475 HydrophobicContact CG1-CG 4.3Å; V471-R475 WeakPolarHBondContact O-CG 3.37Å; V471-R475 PolarHBondContact O-N 2.88Å
472	N	88.6	Confident	88	Confident	69 Å²	69	64.3 Å²	64.3	37%	0.369	36%	0.36	S	S	.	.	H	α-helix	trans	-66.3	-38.8	-179.4	-71.5	-3.9	0	0	0	112	H468 S469 H474	H468-N472 PolarHBondContact CE1-OD1 2.85Å; H468-N472 PolarHBondContact NE2-ND2 3.47Å; H468-N472 PolarHBondContact O-N 3.28Å; S469-N472 PolarHBondContact O-N 3.5Å; N472-H474 VanDerWaalsContact C-N 3.34Å
473	T	87.3	Confident	88.1	Confident	57 Å²	57	65.4 Å²	65.4	35%	0.35	36%	0.357	S	S	.	.	H	α-helix	trans	-68	-35.8	173.1	53.9	0	0	0	0	112	S469 A470 V471	S469-T473 WeakPolarHBondContact O-CG2 3.22Å; S469-T473 PolarHBondContact O-N 2.96Å; S469-T473 PolarHBondContact O-OG1 3.46Å; A470-T473 WeakPolarHBondContact CA-OG1 3.47Å; A470-T473 PolarHBondContact O-OG1 3.21Å; V471-T473 PolarHBondContact O-N 3.34Å
474	H	89.8	Confident	88.1	Confident	21 Å²	21	63.1 Å²	63.1	10%	0.097	35%	0.346	C	S	.	.	H	α-helix	trans	-66.1	-42	174.9	174.8	65.6	0	0	0	112.7	C461 F465 A470 V471 N472 K476 I477 H478	C461-H474 PolarHBondContact SG-NE2 2.9Å; F465-H474 HydrophobicContact CE1-CB 3.97Å; F465-H474 HydrophobicContact CE2-CB 4.06Å; F465-H474 AromaticContact CE2-CD2 3.59Å; F465-H474 AromaticContact CE2-CG 3.8Å; F465-H474 HydrophobicContact CZ-CB 3.5Å; F465-H474 AromaticContact CZ-CD2 3.52Å; F465-H474 AromaticContact CZ-CG 3.26Å; F465-H474 AromaticContact CZ-ND1 3.74Å; A470-H474 VanDerWaalsContact O-CB 3.25Å; A470-H474 WeakPolarHBondContact O-CB 3.42Å; A470-H474 PolarHBondContact O-N 3.45Å; V471-H474 WeakPolarHBondContact O-CB 3.46Å; V471-H474 PolarHBondContact O-N 3.44Å; N472-H474 VanDerWaalsContact C-N 3.34Å; H474-K476 PolarHBondContact O-N 3.26Å; H474-K476 VanDerWaalsContact O-N 3.15Å; H474-I477 VanDerWaalsContact O-CB 3.23Å; H474-I477 WeakPolarHBondContact O-CB 3.37Å; H474-I477 WeakPolarHBondContact O-CG1 3.39Å; H474-I477 PolarHBondContact O-N 3Å; H474-H478 AromaticContact CD2-NE2 3.93Å; H474-H478 AromaticContact CE1-NE2 3.85Å; H474-H478 AromaticContact NE2-CE1 3.93Å; H474-H478 AromaticContact NE2-NE2 3.19Å; H474-H478 PolarHBondContact NE2-NE2 3.06Å; H474-H478 VanDerWaalsContact NE2-NE2 3.19Å
475	R	87.6	Confident	88.1	Confident	70 Å²	70	69 Å²	69	26%	0.264	37%	0.365	S	S	.	.	H	α-helix	trans	-54.8	-32.9	178.2	-82.2	174.3	168.5	-90.1	1.4	113	E460 V471 I477 H478 T479	E460-R475 IonicContact OE1-NH1 3.17Å; E460-R475 PolarHBondContact OE1-NH1 3.44Å; V471-R475 HydrophobicContact CG1-CG 4.3Å; V471-R475 WeakPolarHBondContact O-CG 3.37Å; V471-R475 PolarHBondContact O-N 2.88Å; R475-I477 PolarHBondContact O-N 3.38Å; R475-I477 VanDerWaalsContact O-N 3.08Å; R475-H478 PolarHBondContact O-N 3.06Å; R475-T479 PolarHBondContact O-N 3.19Å; R475-T479 VanDerWaalsContact O-N 3.15Å
476	K	88.6	Confident	88.2	Confident	50 Å²	50	67.2 Å²	67.2	22%	0.217	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-19.5	175.8	-62.2	-176	-179.4	-171.3	0	114.1	H474 T479 G480 E481 N494	H474-K476 PolarHBondContact O-N 3.26Å; H474-K476 VanDerWaalsContact O-N 3.15Å; K476-T479 WeakPolarHBondContact CA-OG1 3.37Å; K476-G480 PolarHBondContact O-N 3.34Å; K476-E481 PolarHBondContact O-N 2.91Å; K476-N494 HydrophobicContact CB-CB 4.19Å
477	I	87	Confident	88.3	Confident	102 Å²	102	72.4 Å²	72.4	52%	0.523	38%	0.383	S	S	.	.	H	α-helix	trans	-70.6	-39.4	175.3	-59.3	174.8	0	0	0	110.1	H474 R475	H474-I477 VanDerWaalsContact O-CB 3.23Å; H474-I477 WeakPolarHBondContact O-CB 3.37Å; H474-I477 WeakPolarHBondContact O-CG1 3.39Å; H474-I477 PolarHBondContact O-N 3Å; R475-I477 PolarHBondContact O-N 3.38Å; R475-I477 VanDerWaalsContact O-N 3.08Å
478	H	86.3	Confident	88.3	Confident	78 Å²	78	76 Å²	76	36%	0.361	40%	0.401	S	S	.	.	H	α-helix	trans	-79.1	-39.1	-179	-59.2	-50.4	0	0	0	112.3	C458 E460 C461 H474 R475 G480	C458-H478 PolarHBondContact SG-NE2 2.71Å; C458-H478 VanDerWaalsContact SG-NE2 3.43Å; E460-H478 WeakPolarHBondContact OE2-CB 3.42Å; E460-H478 IonicContact OE2-CD2 3.1Å; E460-H478 PolarHBondContact OE2-CD2 3.21Å; E460-H478 IonicContact OE2-CG 3.03Å; C461-H478 PolarHBondContact SG-NE2 3.48Å; H474-H478 AromaticContact CD2-NE2 3.93Å; H474-H478 AromaticContact CE1-NE2 3.85Å; H474-H478 AromaticContact NE2-CE1 3.93Å; H474-H478 AromaticContact NE2-NE2 3.19Å; H474-H478 PolarHBondContact NE2-NE2 3.06Å; H474-H478 VanDerWaalsContact NE2-NE2 3.19Å; R475-H478 PolarHBondContact O-N 3.06Å; H478-G480 PolarHBondContact O-N 3.05Å
479	T	84.7	Confident	88.5	Confident	75 Å²	75	73 Å²	73	46%	0.46	39%	0.391	S	S	.	.	S	Bend	trans	-73.1	-12.5	176.3	64	0	0	0	0	112.9	R475 K476 E481	R475-T479 PolarHBondContact O-N 3.19Å; R475-T479 VanDerWaalsContact O-N 3.15Å; K476-T479 WeakPolarHBondContact CA-OG1 3.37Å; T479-E481 PolarHBondContact O-N 3.38Å; T479-E481 VanDerWaalsContact O-N 3.09Å; T479-E481 WeakPolarHBondContact OG1-CB 3.38Å; T479-E481 WeakPolarHBondContact OG1-CG 3.48Å; T479-E481 PolarHBondContact OG1-N 2.9Å
480	G	83.2	Confident	88.4	Confident	47 Å²	47	78.4 Å²	78.4	49%	0.485	41%	0.406	S	S	.	.			trans	66	5.4	-174.3	0	0	0	0	0	114.1	K476 H478 K482	K476-G480 PolarHBondContact O-N 3.34Å; H478-G480 PolarHBondContact O-N 3.05Å; G480-K482 PolarHBondContact O-N 3.3Å; G480-K482 VanDerWaalsContact O-N 3.16Å
481	E	85.1	Confident	88.4	Confident	109 Å²	109	83.1 Å²	83.1	51%	0.509	42%	0.421	S	S	.	.			trans	-60.8	119.2	-178.7	-77.4	179.7	-167.8	0	0	110.7	K476 T479 P483	K476-E481 PolarHBondContact O-N 2.91Å; T479-E481 PolarHBondContact O-N 3.38Å; T479-E481 VanDerWaalsContact O-N 3.09Å; T479-E481 WeakPolarHBondContact OG1-CB 3.38Å; T479-E481 WeakPolarHBondContact OG1-CG 3.48Å; T479-E481 PolarHBondContact OG1-N 2.9Å; E481-P483 VanDerWaalsContact C-CD 3.49Å; E481-P483 WeakPolarHBondContact O-CD 3.38Å
482	K	88	Confident	88.5	Confident	123 Å²	123	84.2 Å²	84.2	54%	0.535	43%	0.43	S	S	.	.			trans	-120.3	75.5	174.7	-69.9	166.6	172.7	-176.5	0	110	G480 Y484 A492 F493	G480-K482 PolarHBondContact O-N 3.3Å; G480-K482 VanDerWaalsContact O-N 3.16Å; K482-Y484 PolarHBondContact O-N 2.82Å; K482-Y484 VanDerWaalsContact O-N 3.14Å; K482-A492 HydrophobicContact CB-CB 3.6Å; K482-A492 HydrophobicContact CD-CB 4.13Å; K482-A492 WeakPolarHBondContact CD-O 3.46Å; K482-A492 HydrophobicContact CG-CB 4.42Å; K482-F493 CarbonylContact C-O 3.59Å; K482-F493 VanDerWaalsContact C-O 3.31Å; K482-F493 VanDerWaalsContact CA-O 3.27Å; K482-F493 WeakPolarHBondContact CA-O 3.27Å
483	P	88.7	Confident	88.6	Confident	75 Å²	75	83 Å²	83	49%	0.487	42%	0.422	S	S	.	.			trans	-65.6	-18.2	-174.7	-20.9	34	0	0	0	113.7	E481	E481-P483 VanDerWaalsContact C-CD 3.49Å; E481-P483 WeakPolarHBondContact O-CD 3.38Å
484	Y	91	Very high	88.6	Confident	83 Å²	83	82.4 Å²	82.4	33%	0.325	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	91.3	-172.4	-54.4	-75.6	0	0	0	109.8	K482 A492 F493	K482-Y484 PolarHBondContact O-N 2.82Å; K482-Y484 VanDerWaalsContact O-N 3.14Å; Y484-A492 CarbonylContact O-C 3.56Å; Y484-A492 WeakPolarHBondContact O-CA 3.49Å; Y484-F493 WeakPolarHBondContact CD2-O 3.4Å; Y484-F493 PolarHBondContact N-O 3.21Å; Y484-F493 PolarHBondContact O-N 2.98Å
485	K	90.3	Very high	88.5	Confident	154 Å²	154	85.3 Å²	85.3	67%	0.67	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	141.4	176.8	-60.8	-175.3	179	-177.2	0	110.6	A492 L499	K485-A492 HydrophobicContact CG-CB 3.97Å; K485-L499 WeakPolarHBondContact O-CD2 3.34Å
486	C	93.3	Very high	88.6	Confident	10 Å²	10	84.6 Å²	84.6	7%	0.068	44%	0.436	C	S	.	.			trans	-75.7	142.3	167.3	-172.2	0	0	0	0	109.3	D488 C489 K491 L499	C486-D488 PolarHBondContact SG-N 3.28Å; C486-C489 CarbonylContact C-O 3.53Å; C486-C489 WeakPolarHBondContact CB-O 3.25Å; C486-K491 VanDerWaalsContact CB-O 3.31Å; C486-K491 WeakPolarHBondContact CB-O 3.37Å; C486-K491 PolarHBondContact N-O 3.17Å; C486-L499 HydrophobicContact CB-CD1 3.83Å
487	N	90.2	Very high	88.7	Confident	147 Å²	147	85.1 Å²	85.1	79%	0.786	45%	0.446	S	S	*	.	S	Bend	trans	-85.5	-25.8	176.5	-65.6	-14.5	0	0	0	111.5
488	D	88.5	Confident	88.8	Confident	102 Å²	102	81.6 Å²	81.6	55%	0.545	43%	0.432	S	S	.	.	S	Bend	trans	-92.4	-9.5	-175.5	-49	-47.3	0	0	0	112.6	C486 H506	C486-D488 PolarHBondContact SG-N 3.28Å; D488-H506 HydrophobicContact CB-CB 4.33Å; D488-H506 IonicContact OD2-CD2 3.02Å; D488-H506 IonicContact OD2-CG 3.16Å
489	C	92.2	Very high	89.1	Confident	39 Å²	39	78.9 Å²	78.9	26%	0.264	42%	0.42	S	S	.	.	S	Bend	trans	-157.2	168.3	172.7	72.4	0	0	0	0	112.1	C486 K491 H502	C486-C489 CarbonylContact C-O 3.53Å; C486-C489 WeakPolarHBondContact CB-O 3.25Å; C489-K491 PolarHBondContact O-N 2.82Å; C489-H502 PolarHBondContact SG-NE2 3.31Å
490	E	86.9	Confident	89.3	Confident	201 Å²	201	79.4 Å²	79.4	94%	0.939	42%	0.42	S	S	*	.	S	Bend	trans	-72.5	3.3	-177.8	-61.8	-177.6	166	0	0	114.8
491	K	89.9	Confident	89.7	Confident	129 Å²	129	81.4 Å²	81.4	56%	0.561	42%	0.416	S	S	*	.			trans	-75	132.4	-178	-67.8	-178.1	178.5	175.6	0	111.2	C486 C489 F493	C486-K491 VanDerWaalsContact CB-O 3.31Å; C486-K491 WeakPolarHBondContact CB-O 3.37Å; C486-K491 PolarHBondContact N-O 3.17Å; C489-K491 PolarHBondContact O-N 2.82Å; K491-F493 HydrophobicContact CB-CE2 3.97Å; K491-F493 HydrophobicContact CB-CZ 4.03Å
492	A	91.2	Very high	89.9	Confident	27 Å²	27	77 Å²	77	22%	0.223	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147	175.1	0	0	0	0	0	111.7	K482 Y484 K485	K482-A492 HydrophobicContact CB-CB 3.6Å; K482-A492 HydrophobicContact CD-CB 4.13Å; K482-A492 WeakPolarHBondContact CD-O 3.46Å; K482-A492 HydrophobicContact CG-CB 4.42Å; Y484-A492 CarbonylContact O-C 3.56Å; Y484-A492 WeakPolarHBondContact O-CA 3.49Å; K485-A492 HydrophobicContact CG-CB 3.97Å
493	F	90.1	Very high	90	Very high	45 Å²	45	74.2 Å²	74.2	20%	0.197	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150.8	-173.3	-57	-90.6	0	0	0	111.3	K482 Y484 K491 A498 L499 H502	K482-F493 CarbonylContact C-O 3.59Å; K482-F493 VanDerWaalsContact C-O 3.31Å; K482-F493 VanDerWaalsContact CA-O 3.27Å; K482-F493 WeakPolarHBondContact CA-O 3.27Å; Y484-F493 WeakPolarHBondContact CD2-O 3.4Å; Y484-F493 PolarHBondContact N-O 3.21Å; Y484-F493 PolarHBondContact O-N 2.98Å; K491-F493 HydrophobicContact CB-CE2 3.97Å; K491-F493 HydrophobicContact CB-CZ 4.03Å; F493-A498 HydrophobicContact CB-CB 4.13Å; F493-A498 HydrophobicContact CD1-CB 3.84Å; F493-A498 HydrophobicContact CG-CB 4.21Å; F493-L499 HydrophobicContact CB-CB 4.42Å; F493-L499 HydrophobicContact CD2-CB 3.95Å; F493-L499 HydrophobicContact CD2-CD1 3.88Å; F493-L499 HydrophobicContact CE2-CD1 4.06Å; F493-L499 HydrophobicContact CG-CB 4.39Å; F493-H502 HydrophobicContact CE1-CB 4.07Å; F493-H502 HydrophobicContact CE2-CB 3.76Å; F493-H502 AromaticContact CE2-CD2 3.39Å; F493-H502 WeakPolarHBondContact CE2-CD2 3.44Å; F493-H502 AromaticContact CE2-CG 3.6Å; F493-H502 HydrophobicContact CZ-CB 3.41Å; F493-H502 VanDerWaalsContact CZ-CB 3.41Å; F493-H502 AromaticContact CZ-CD2 3.51Å; F493-H502 AromaticContact CZ-CG 3.25Å; F493-H502 AromaticContact CZ-ND1 3.79Å
494	N	88	Confident	90.1	Very high	44 Å²	44	73.1 Å²	73.1	24%	0.235	37%	0.371	C	S	.	.	S	Bend	trans	-84.2	-12.1	177.1	62.2	7	0	0	0	113.4	K476	K476-N494 HydrophobicContact CB-CB 4.19Å
495	Q	88.6	Confident	90.1	Very high	81 Å²	81	73.2 Å²	73.2	38%	0.379	38%	0.376	S	S	.	.	S	Bend	trans	-132.3	139.7	179.8	-66.1	177.7	26.7	0	0	110.7	S497 A498 L499	Q495-S497 VanDerWaalsContact C-N 3.34Å; Q495-S497 PolarHBondContact O-N 3.32Å; Q495-A498 HydrophobicContact CB-CB 4.36Å; Q495-A498 PolarHBondContact O-N 2.99Å; Q495-L499 PolarHBondContact O-N 3.42Å
496	S	89.4	Confident	90	Very high	56 Å²	56	69.8 Å²	69.8	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-35.2	178.6	56.4	0	0	0	0	112.9	A498 L499 I500	S496-A498 VanDerWaalsContact C-N 3.28Å; S496-A498 PolarHBondContact O-N 2.8Å; S496-L499 PolarHBondContact O-N 3.32Å; S496-I500 WeakPolarHBondContact O-CG1 3.4Å; S496-I500 PolarHBondContact O-N 2.9Å
497	S	89.9	Confident	89.8	Confident	60 Å²	60	73.3 Å²	73.3	42%	0.42	38%	0.383	S	S	.	.	H	α-helix	trans	-61	-37.3	176	51.3	0	0	0	0	112.4	Q495 Q501	Q495-S497 VanDerWaalsContact C-N 3.34Å; Q495-S497 PolarHBondContact O-N 3.32Å; S497-Q501 WeakPolarHBondContact O-CB 3.3Å; S497-Q501 WeakPolarHBondContact O-CG 3.32Å; S497-Q501 PolarHBondContact O-N 3.25Å
498	A	90.4	Very high	89.7	Confident	29 Å²	29	68.1 Å²	68.1	24%	0.24	36%	0.364	C	S	.	.	H	α-helix	trans	-68.4	-40.8	176.1	0	0	0	0	0	111.3	F493 Q495 S496 Q501 H502	F493-A498 HydrophobicContact CB-CB 4.13Å; F493-A498 HydrophobicContact CD1-CB 3.84Å; F493-A498 HydrophobicContact CG-CB 4.21Å; Q495-A498 HydrophobicContact CB-CB 4.36Å; Q495-A498 PolarHBondContact O-N 2.99Å; S496-A498 VanDerWaalsContact C-N 3.28Å; S496-A498 PolarHBondContact O-N 2.8Å; A498-Q501 PolarHBondContact O-N 2.99Å; A498-H502 VanDerWaalsContact O-CB 3.31Å; A498-H502 WeakPolarHBondContact O-CB 3.37Å; A498-H502 PolarHBondContact O-N 3.23Å
499	L	92.1	Very high	89.7	Confident	21 Å²	21	68.6 Å²	68.6	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-48.6	172.6	174.2	62.5	0	0	0	111.5	K485 C486 F493 Q495 S496 Q501 H502 Q503	K485-L499 WeakPolarHBondContact O-CD2 3.34Å; C486-L499 HydrophobicContact CB-CD1 3.83Å; F493-L499 HydrophobicContact CB-CB 4.42Å; F493-L499 HydrophobicContact CD2-CB 3.95Å; F493-L499 HydrophobicContact CD2-CD1 3.88Å; F493-L499 HydrophobicContact CE2-CD1 4.06Å; F493-L499 HydrophobicContact CG-CB 4.39Å; Q495-L499 PolarHBondContact O-N 3.42Å; S496-L499 PolarHBondContact O-N 3.32Å; L499-Q501 VanDerWaalsContact C-N 3.32Å; L499-Q501 PolarHBondContact O-N 3.26Å; L499-H502 CarbonylContact O-C 3.24Å; L499-H502 WeakPolarHBondContact O-CA 3.42Å; L499-H502 WeakPolarHBondContact O-CB 3.46Å; L499-H502 PolarHBondContact O-N 2.95Å; L499-Q503 HydrophobicContact CD1-CG 4.1Å; L499-Q503 HydrophobicContact CG-CG 4.4Å; L499-Q503 WeakPolarHBondContact O-CG 3.32Å; L499-Q503 PolarHBondContact O-N 3.38Å
500	I	89.4	Confident	89.7	Confident	86 Å²	86	71.9 Å²	71.9	44%	0.441	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-42.8	178.7	-67.1	166.6	0	0	0	111	S496 H502 Q503 R504	S496-I500 WeakPolarHBondContact O-CG1 3.4Å; S496-I500 PolarHBondContact O-N 2.9Å; I500-H502 VanDerWaalsContact C-N 3.29Å; I500-H502 PolarHBondContact O-N 3.2Å; I500-Q503 PolarHBondContact O-N 3.27Å; I500-R504 PolarHBondContact O-N 3.11Å
501	Q	89.8	Confident	89.9	Confident	89 Å²	89	65.3 Å²	65.3	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-36.4	175.2	-77.6	-175.2	8.3	0	0	112.4	S497 A498 L499	S497-Q501 WeakPolarHBondContact O-CB 3.3Å; S497-Q501 WeakPolarHBondContact O-CG 3.32Å; S497-Q501 PolarHBondContact O-N 3.25Å; A498-Q501 PolarHBondContact O-N 2.99Å; L499-Q501 VanDerWaalsContact C-N 3.32Å; L499-Q501 PolarHBondContact O-N 3.26Å
502	H	91.1	Very high	90	Very high	17 Å²	17	62.1 Å²	62.1	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-69.6	-40.5	176.9	173.6	65	0	0	0	112.4	C489 F493 A498 L499 I500 R504 I505 H506	C489-H502 PolarHBondContact SG-NE2 3.31Å; F493-H502 HydrophobicContact CE1-CB 4.07Å; F493-H502 HydrophobicContact CE2-CB 3.76Å; F493-H502 AromaticContact CE2-CD2 3.39Å; F493-H502 WeakPolarHBondContact CE2-CD2 3.44Å; F493-H502 AromaticContact CE2-CG 3.6Å; F493-H502 HydrophobicContact CZ-CB 3.41Å; F493-H502 VanDerWaalsContact CZ-CB 3.41Å; F493-H502 AromaticContact CZ-CD2 3.51Å; F493-H502 AromaticContact CZ-CG 3.25Å; F493-H502 AromaticContact CZ-ND1 3.79Å; A498-H502 VanDerWaalsContact O-CB 3.31Å; A498-H502 WeakPolarHBondContact O-CB 3.37Å; A498-H502 PolarHBondContact O-N 3.23Å; L499-H502 CarbonylContact O-C 3.24Å; L499-H502 WeakPolarHBondContact O-CA 3.42Å; L499-H502 WeakPolarHBondContact O-CB 3.46Å; L499-H502 PolarHBondContact O-N 2.95Å; I500-H502 VanDerWaalsContact C-N 3.29Å; I500-H502 PolarHBondContact O-N 3.2Å; H502-R504 PolarHBondContact O-N 3.48Å; H502-R504 VanDerWaalsContact O-N 3.15Å; H502-I505 WeakPolarHBondContact O-CB 3.18Å; H502-I505 VanDerWaalsContact O-CG1 3.3Å; H502-I505 WeakPolarHBondContact O-CG1 3.43Å; H502-I505 PolarHBondContact O-N 3.49Å; H502-H506 AromaticContact CE1-NE2 3.76Å; H502-H506 AromaticContact NE2-CD2 3.96Å; H502-H506 AromaticContact NE2-NE2 3.35Å; H502-H506 PolarHBondContact NE2-NE2 3.23Å
503	Q	89.6	Confident	90	Very high	63 Å²	63	65.5 Å²	65.5	29%	0.294	35%	0.348	S	S	.	.	H	α-helix	trans	-57.5	-29.9	177	-75.8	174.8	-46.3	0	0	112.7	L499 I500 I505 H506 T507	L499-Q503 HydrophobicContact CD1-CG 4.1Å; L499-Q503 HydrophobicContact CG-CG 4.4Å; L499-Q503 WeakPolarHBondContact O-CG 3.32Å; L499-Q503 PolarHBondContact O-N 3.38Å; I500-Q503 PolarHBondContact O-N 3.27Å; Q503-I505 PolarHBondContact O-N 2.72Å; Q503-I505 VanDerWaalsContact O-N 3.1Å; Q503-H506 PolarHBondContact O-N 3.01Å; Q503-T507 PolarHBondContact O-N 3.03Å; Q503-T507 PolarHBondContact O-OG1 3.44Å
504	R	91.2	Very high	90.1	Very high	53 Å²	53	63.5 Å²	63.5	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-15.2	172.8	-63.1	177	-174.1	176.3	-0.4	114.4	I500 H502 T507 G508 E509 R522	I500-R504 PolarHBondContact O-N 3.11Å; H502-R504 PolarHBondContact O-N 3.48Å; H502-R504 VanDerWaalsContact O-N 3.15Å; R504-T507 WeakPolarHBondContact CA-OG1 3.38Å; R504-G508 WeakPolarHBondContact O-CA 3.48Å; R504-G508 PolarHBondContact O-N 2.81Å; R504-E509 HydrophobicContact CG-CB 4.39Å; R504-E509 PolarHBondContact O-N 3.27Å; R504-R522 PolarHBondContact NH1-O 2.87Å; R504-R522 PolarHBondContact O-NE 3Å
505	I	89.9	Confident	90.3	Very high	85 Å²	85	71.4 Å²	71.4	44%	0.436	37%	0.372	S	S	.	.	H	α-helix	trans	-72.9	-43.5	172.4	-57.9	178.4	0	0	0	109.5	H502 Q503	H502-I505 WeakPolarHBondContact O-CB 3.18Å; H502-I505 VanDerWaalsContact O-CG1 3.3Å; H502-I505 WeakPolarHBondContact O-CG1 3.43Å; H502-I505 PolarHBondContact O-N 3.49Å; Q503-I505 PolarHBondContact O-N 2.72Å; Q503-I505 VanDerWaalsContact O-N 3.1Å
506	H	89.4	Confident	90.3	Very high	81 Å²	81	72.7 Å²	72.7	38%	0.375	38%	0.381	S	S	.	.	H	α-helix	trans	-70.8	-46.4	178.8	-64.7	-73.2	0	0	0	111.7	D488 H502 Q503 G508	D488-H506 HydrophobicContact CB-CB 4.33Å; D488-H506 IonicContact OD2-CD2 3.02Å; D488-H506 IonicContact OD2-CG 3.16Å; H502-H506 AromaticContact CE1-NE2 3.76Å; H502-H506 AromaticContact NE2-CD2 3.96Å; H502-H506 AromaticContact NE2-NE2 3.35Å; H502-H506 PolarHBondContact NE2-NE2 3.23Å; Q503-H506 PolarHBondContact O-N 3.01Å; H506-G508 VanDerWaalsContact C-N 3.26Å; H506-G508 PolarHBondContact O-N 2.68Å
507	T	88.1	Confident	90.5	Very high	85 Å²	85	72.7 Å²	72.7	52%	0.521	38%	0.38	S	S	.	.	S	Bend	trans	-76.3	-14	-179.8	64.5	0	0	0	0	113.5	Q503 R504 E509	Q503-T507 PolarHBondContact O-N 3.03Å; Q503-T507 PolarHBondContact O-OG1 3.44Å; R504-T507 WeakPolarHBondContact CA-OG1 3.38Å; T507-E509 PolarHBondContact O-N 3.35Å; T507-E509 VanDerWaalsContact O-N 3.14Å; T507-E509 WeakPolarHBondContact OG1-CG 3.5Å; T507-E509 PolarHBondContact OG1-N 2.93Å
508	G	87.3	Confident	90.4	Very high	37 Å²	37	72.5 Å²	72.5	38%	0.381	39%	0.388	S	S	.	.			trans	69.6	1.4	-174.5	0	0	0	0	0	114.7	R504 H506 K510	R504-G508 WeakPolarHBondContact O-CA 3.48Å; R504-G508 PolarHBondContact O-N 2.81Å; H506-G508 VanDerWaalsContact C-N 3.26Å; H506-G508 PolarHBondContact O-N 2.68Å; G508-K510 PolarHBondContact O-N 2.92Å
509	E	90.2	Very high	90.4	Very high	113 Å²	113	77.3 Å²	77.3	53%	0.528	40%	0.403	S	S	.	.			trans	-57.3	128.1	-177.4	-77.5	-178.8	-175.6	0	0	112.4	R504 T507 P511	R504-E509 HydrophobicContact CG-CB 4.39Å; R504-E509 PolarHBondContact O-N 3.27Å; T507-E509 PolarHBondContact O-N 3.35Å; T507-E509 VanDerWaalsContact O-N 3.14Å; T507-E509 WeakPolarHBondContact OG1-CG 3.5Å; T507-E509 PolarHBondContact OG1-N 2.93Å; E509-P511 WeakPolarHBondContact O-CD 3.43Å
510	K	91.1	Very high	90.5	Very high	108 Å²	108	78.1 Å²	78.1	47%	0.47	41%	0.413	S	S	.	.			trans	-123.6	79.7	176.4	-69.2	170.8	-178.2	-179.7	0	110.2	G508 F512 A520 F521 R522	G508-K510 PolarHBondContact O-N 2.92Å; K510-F512 PolarHBondContact O-N 2.76Å; K510-F512 VanDerWaalsContact O-N 3.15Å; K510-A520 HydrophobicContact CB-CB 3.58Å; K510-A520 HydrophobicContact CD-CB 4.02Å; K510-A520 HydrophobicContact CG-CB 4.43Å; K510-F521 CarbonylContact C-O 3.51Å; K510-F521 VanDerWaalsContact C-O 3.31Å; K510-F521 WeakPolarHBondContact CA-O 3.17Å; K510-R522 HydrophobicContact CG-CG 3.83Å
511	P	90.3	Very high	90.6	Very high	63 Å²	63	76.1 Å²	76.1	41%	0.409	40%	0.401	S	S	.	.			trans	-68.8	-14.4	-171	-21.1	34	0	0	0	114.9	E509	E509-P511 WeakPolarHBondContact O-CD 3.43Å
512	F	92.5	Very high	90.6	Very high	62 Å²	62	76.6 Å²	76.6	27%	0.272	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	101.2	-170.6	-57.3	-75.2	0	0	0	111.1	K510 A520 F521 R522 S524 L527	K510-F512 PolarHBondContact O-N 2.76Å; K510-F512 VanDerWaalsContact O-N 3.15Å; F512-A520 CarbonylContact O-C 3.59Å; F512-A520 WeakPolarHBondContact O-CA 3.23Å; F512-F521 HydrophobicContact CB-CB 4.38Å; F512-F521 PolarHBondContact N-O 3.37Å; F512-F521 VanDerWaalsContact N-O 3.14Å; F512-F521 PolarHBondContact O-N 3.41Å; F512-R522 WeakPolarHBondContact CE2-O 3.23Å; F512-S524 VanDerWaalsContact CD2-N 3.34Å; F512-S524 VanDerWaalsContact CE2-N 3.33Å; F512-L527 HydrophobicContact CB-CB 4.17Å; F512-L527 HydrophobicContact CB-CD2 3.86Å
513	N	91.3	Very high	90.5	Very high	98 Å²	98	79.2 Å²	79.2	52%	0.524	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.4	-178	-61.2	-49.6	0	0	0	112	K515 A520	N513-K515 PolarHBondContact O-N 2.95Å; N513-A520 WeakPolarHBondContact OD1-CB 3.37Å
514	C	93.2	Very high	90.6	Very high	3 Å²	3	79.1 Å²	79.1	2%	0.02	42%	0.418	C	S	.	.			trans	-74.1	121.9	168	-178.3	0	0	0	0	109.5	I516 G518 K519 F521 L527 H534	C514-I516 VanDerWaalsContact C-N 3.25Å; C514-I516 PolarHBondContact O-N 3.07Å; C514-I516 PolarHBondContact SG-N 3.49Å; C514-G518 WeakPolarHBondContact O-CA 3.43Å; C514-G518 PolarHBondContact O-N 3.44Å; C514-K519 WeakPolarHBondContact CB-O 3.22Å; C514-K519 PolarHBondContact N-O 2.94Å; C514-F521 HydrophobicContact CB-CE2 4.41Å; C514-L527 HydrophobicContact CB-CD1 3.79Å; C514-H534 PolarHBondContact SG-NE2 3.33Å; C514-H534 VanDerWaalsContact SG-NE2 3.39Å
515	K	90.7	Very high	90.5	Very high	210 Å²	210	80 Å²	80	91%	0.913	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-21.4	178.8	-63	-171.4	177.9	-173.7	0	113.7	N513	N513-K515 PolarHBondContact O-N 2.95Å
516	I	90.1	Very high	90.6	Very high	108 Å²	108	78 Å²	78	55%	0.554	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-48	-175.3	-59.4	174.9	0	0	0	110.9	C514 M531 H534	C514-I516 VanDerWaalsContact C-N 3.25Å; C514-I516 PolarHBondContact O-N 3.07Å; C514-I516 PolarHBondContact SG-N 3.49Å; I516-M531 HydrophobicContact CD1-CE 3.7Å; I516-M531 HydrophobicContact CG1-CE 4.33Å; I516-H534 HydrophobicContact CD1-CB 3.59Å
517	C	92.2	Very high	90.7	Very high	55 Å²	55	75.3 Å²	75.3	37%	0.372	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	6.5	-174.6	71.3	0	0	0	0	114.5	K519 H530 H534	C517-K519 PolarHBondContact O-N 3.06Å; C517-H530 PolarHBondContact SG-NE2 3.33Å; C517-H534 PolarHBondContact SG-NE2 3.34Å
518	G	88.4	Confident	90.7	Very high	57 Å²	57	76.9 Å²	76.9	59%	0.588	42%	0.416	S	S	*	.			trans	71.2	-6.8	178.2	0	0	0	0	0	115.8	C514 A520	C514-G518 WeakPolarHBondContact O-CA 3.43Å; C514-G518 PolarHBondContact O-N 3.44Å; G518-A520 PolarHBondContact O-N 3.34Å
519	K	91.6	Very high	90.8	Very high	130 Å²	130	77 Å²	77	57%	0.565	41%	0.41	S	S	*	.			trans	-62.2	129.8	-177.8	-71.2	-176.3	-179.5	-178.3	0	111.8	C514 C517 F521	C514-K519 WeakPolarHBondContact CB-O 3.22Å; C514-K519 PolarHBondContact N-O 2.94Å; C517-K519 PolarHBondContact O-N 3.06Å; K519-F521 HydrophobicContact CB-CE2 3.84Å; K519-F521 HydrophobicContact CB-CZ 4.04Å; K519-F521 WeakPolarHBondContact O-CD2 3.21Å; K519-F521 WeakPolarHBondContact O-CE2 3.44Å
520	A	92.9	Very high	90.9	Very high	37 Å²	37	72.6 Å²	72.6	31%	0.306	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.4	-179.8	0	0	0	0	0	112.1	K510 F512 N513 G518	K510-A520 HydrophobicContact CB-CB 3.58Å; K510-A520 HydrophobicContact CD-CB 4.02Å; K510-A520 HydrophobicContact CG-CB 4.43Å; F512-A520 CarbonylContact O-C 3.59Å; F512-A520 WeakPolarHBondContact O-CA 3.23Å; N513-A520 WeakPolarHBondContact OD1-CB 3.37Å; G518-A520 PolarHBondContact O-N 3.34Å
521	F	91.5	Very high	90.8	Very high	44 Å²	44	69.9 Å²	69.9	19%	0.193	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.2	-178	-60.4	-90.9	0	0	0	111.5	K510 F512 C514 K519 L527 H530	K510-F521 CarbonylContact C-O 3.51Å; K510-F521 VanDerWaalsContact C-O 3.31Å; K510-F521 WeakPolarHBondContact CA-O 3.17Å; F512-F521 HydrophobicContact CB-CB 4.38Å; F512-F521 PolarHBondContact N-O 3.37Å; F512-F521 VanDerWaalsContact N-O 3.14Å; F512-F521 PolarHBondContact O-N 3.41Å; C514-F521 HydrophobicContact CB-CE2 4.41Å; K519-F521 HydrophobicContact CB-CE2 3.84Å; K519-F521 HydrophobicContact CB-CZ 4.04Å; K519-F521 WeakPolarHBondContact O-CD2 3.21Å; K519-F521 WeakPolarHBondContact O-CE2 3.44Å; F521-L527 HydrophobicContact CB-CB 4.29Å; F521-L527 HydrophobicContact CD2-CB 3.95Å; F521-L527 HydrophobicContact CD2-CD1 3.77Å; F521-L527 HydrophobicContact CD2-CG 4.44Å; F521-L527 HydrophobicContact CE2-CD1 3.91Å; F521-L527 HydrophobicContact CG-CB 4.25Å; F521-H530 HydrophobicContact CE1-CB 3.96Å; F521-H530 HydrophobicContact CE2-CB 3.94Å; F521-H530 AromaticContact CE2-CD2 3.54Å; F521-H530 AromaticContact CE2-CG 3.68Å; F521-H530 HydrophobicContact CZ-CB 3.45Å; F521-H530 VanDerWaalsContact CZ-CB 3.45Å; F521-H530 AromaticContact CZ-CD2 3.58Å; F521-H530 AromaticContact CZ-CG 3.24Å; F521-H530 AromaticContact CZ-ND1 3.67Å
522	R	89.3	Confident	90.8	Very high	99 Å²	99	69.5 Å²	69.5	37%	0.374	37%	0.369	S	S	.	.	S	Bend	trans	-75.2	-27.3	177.3	-64	-174	176.7	146.3	-2.6	113.2	R504 K510 F512	R504-R522 PolarHBondContact NH1-O 2.87Å; R504-R522 PolarHBondContact O-NE 3Å; K510-R522 HydrophobicContact CG-CG 3.83Å; F512-R522 WeakPolarHBondContact CE2-O 3.23Å
523	Q	90	Very high	90.6	Very high	73 Å²	73	72.5 Å²	72.5	34%	0.341	39%	0.387	S	S	.	.	S	Bend	trans	-126.2	143.3	-177.5	-63.2	-176.6	-6	0	0	111.5	S525 S526 L527	Q523-S525 VanDerWaalsContact C-N 3.33Å; Q523-S525 PolarHBondContact O-N 3.15Å; Q523-S525 PolarHBondContact OE1-OG 2.88Å; Q523-S526 WeakPolarHBondContact O-CB 3.49Å; Q523-S526 PolarHBondContact O-N 3.25Å; Q523-L527 PolarHBondContact O-N 3.44Å
524	S	90.5	Very high	90.5	Very high	61 Å²	61	71 Å²	71	43%	0.427	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-36.9	176.5	170.8	0	0	0	0	112.1	F512 S526 L527 M528	F512-S524 VanDerWaalsContact CD2-N 3.34Å; F512-S524 VanDerWaalsContact CE2-N 3.33Å; S524-S526 VanDerWaalsContact C-N 3.33Å; S524-S526 PolarHBondContact O-N 2.73Å; S524-L527 PolarHBondContact O-N 2.74Å; S524-M528 WeakPolarHBondContact O-CG 3.2Å; S524-M528 PolarHBondContact O-N 2.76Å
525	S	89.9	Confident	90.2	Very high	71 Å²	71	74.7 Å²	74.7	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-57.2	-45.6	174.5	46.7	0	0	0	0	111.7	Q523 L527 M528 T529	Q523-S525 VanDerWaalsContact C-N 3.33Å; Q523-S525 PolarHBondContact O-N 3.15Å; Q523-S525 PolarHBondContact OE1-OG 2.88Å; S525-L527 PolarHBondContact O-N 3.43Å; S525-M528 PolarHBondContact O-N 2.77Å; S525-T529 PolarHBondContact O-N 3.31Å; S525-T529 PolarHBondContact O-OG1 3.18Å
526	S	91.3	Very high	90	Very high	43 Å²	43	67.1 Å²	67.1	30%	0.301	38%	0.38	S	S	.	.	H	α-helix	trans	-60.8	-44.4	176.8	-52.5	0	0	0	0	111.9	Q523 S524 T529 H530	Q523-S526 WeakPolarHBondContact O-CB 3.49Å; Q523-S526 PolarHBondContact O-N 3.25Å; S524-S526 VanDerWaalsContact C-N 3.33Å; S524-S526 PolarHBondContact O-N 2.73Å; S526-T529 WeakPolarHBondContact CA-OG1 3.33Å; S526-T529 PolarHBondContact O-N 3.16Å; S526-T529 PolarHBondContact O-OG1 3.18Å; S526-H530 WeakPolarHBondContact O-CB 3.46Å; S526-H530 PolarHBondContact O-N 3.35Å
527	L	92.4	Very high	90	Very high	24 Å²	24	67.4 Å²	67.4	13%	0.126	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-46.4	173.5	174.1	61.3	0	0	0	110.9	F512 C514 F521 Q523 S524 S525 T529 H530 M531	F512-L527 HydrophobicContact CB-CB 4.17Å; F512-L527 HydrophobicContact CB-CD2 3.86Å; C514-L527 HydrophobicContact CB-CD1 3.79Å; F521-L527 HydrophobicContact CB-CB 4.29Å; F521-L527 HydrophobicContact CD2-CB 3.95Å; F521-L527 HydrophobicContact CD2-CD1 3.77Å; F521-L527 HydrophobicContact CD2-CG 4.44Å; F521-L527 HydrophobicContact CE2-CD1 3.91Å; F521-L527 HydrophobicContact CG-CB 4.25Å; Q523-L527 PolarHBondContact O-N 3.44Å; S524-L527 PolarHBondContact O-N 2.74Å; S525-L527 PolarHBondContact O-N 3.43Å; L527-T529 PolarHBondContact O-N 3.3Å; L527-H530 CarbonylContact O-C 3.58Å; L527-H530 WeakPolarHBondContact O-CA 3.46Å; L527-H530 WeakPolarHBondContact O-CB 3.48Å; L527-H530 PolarHBondContact O-N 3.41Å; L527-M531 HydrophobicContact CD1-CG 4.15Å; L527-M531 HydrophobicContact CD1-SD 4.08Å; L527-M531 HydrophobicContact CG-CG 4.35Å; L527-M531 WeakPolarHBondContact O-CG 3.49Å; L527-M531 PolarHBondContact O-N 3.42Å
528	M	88.4	Confident	89.8	Confident	119 Å²	119	70.6 Å²	70.6	59%	0.586	39%	0.387	S	S	*	.	H	α-helix	trans	-60.7	-43.1	178.7	-70.6	-59.8	-69.1	0	0	112.5	S524 S525 H530 M531	S524-M528 WeakPolarHBondContact O-CG 3.2Å; S524-M528 PolarHBondContact O-N 2.76Å; S525-M528 PolarHBondContact O-N 2.77Å; M528-H530 VanDerWaalsContact C-N 3.3Å; M528-H530 PolarHBondContact O-N 3.07Å; M528-M531 PolarHBondContact O-N 3.02Å
529	T	89.5	Confident	89.9	Confident	40 Å²	40	71.2 Å²	71.2	25%	0.245	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-35.2	172	28.3	0	0	0	0	112.7	S525 S526 L527 R532 Q551	S525-T529 PolarHBondContact O-N 3.31Å; S525-T529 PolarHBondContact O-OG1 3.18Å; S526-T529 WeakPolarHBondContact CA-OG1 3.33Å; S526-T529 PolarHBondContact O-N 3.16Å; S526-T529 PolarHBondContact O-OG1 3.18Å; L527-T529 PolarHBondContact O-N 3.3Å; T529-R532 WeakPolarHBondContact O-CB 3.38Å; T529-R532 PolarHBondContact O-N 3.44Å; T529-Q551 HydrophobicContact CG2-CG 4.2Å
530	H	91	Very high	89.8	Confident	20 Å²	20	68.8 Å²	68.8	9%	0.093	37%	0.368	C	S	.	.	H	α-helix	trans	-67.6	-38.5	175.3	171.9	71.7	0	0	0	112.2	C517 F521 S526 L527 M528 R532 I533 H534	C517-H530 PolarHBondContact SG-NE2 3.33Å; F521-H530 HydrophobicContact CE1-CB 3.96Å; F521-H530 HydrophobicContact CE2-CB 3.94Å; F521-H530 AromaticContact CE2-CD2 3.54Å; F521-H530 AromaticContact CE2-CG 3.68Å; F521-H530 HydrophobicContact CZ-CB 3.45Å; F521-H530 VanDerWaalsContact CZ-CB 3.45Å; F521-H530 AromaticContact CZ-CD2 3.58Å; F521-H530 AromaticContact CZ-CG 3.24Å; F521-H530 AromaticContact CZ-ND1 3.67Å; S526-H530 WeakPolarHBondContact O-CB 3.46Å; S526-H530 PolarHBondContact O-N 3.35Å; L527-H530 CarbonylContact O-C 3.58Å; L527-H530 WeakPolarHBondContact O-CA 3.46Å; L527-H530 WeakPolarHBondContact O-CB 3.48Å; L527-H530 PolarHBondContact O-N 3.41Å; M528-H530 VanDerWaalsContact C-N 3.3Å; M528-H530 PolarHBondContact O-N 3.07Å; H530-R532 PolarHBondContact O-N 3.22Å; H530-R532 VanDerWaalsContact O-N 3.1Å; H530-I533 VanDerWaalsContact O-CB 3.3Å; H530-I533 WeakPolarHBondContact O-CB 3.42Å; H530-I533 WeakPolarHBondContact O-CG1 3.39Å; H530-I533 PolarHBondContact O-N 3.4Å; H530-H534 AromaticContact CD2-NE2 3.83Å; H530-H534 AromaticContact CE1-NE2 3.65Å; H530-H534 AromaticContact NE2-CD2 3.81Å; H530-H534 AromaticContact NE2-CE1 3.97Å; H530-H534 AromaticContact NE2-NE2 3.02Å; H530-H534 PolarHBondContact NE2-NE2 3.09Å
531	M	89.1	Confident	89.7	Confident	51 Å²	51	74.1 Å²	74.1	25%	0.251	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-22.7	176.9	-68.4	-55.2	-63.5	0	0	113.1	I516 L527 M528 I533 H534 T535	I516-M531 HydrophobicContact CD1-CE 3.7Å; I516-M531 HydrophobicContact CG1-CE 4.33Å; L527-M531 HydrophobicContact CD1-CG 4.15Å; L527-M531 HydrophobicContact CD1-SD 4.08Å; L527-M531 HydrophobicContact CG-CG 4.35Å; L527-M531 WeakPolarHBondContact O-CG 3.49Å; L527-M531 PolarHBondContact O-N 3.42Å; M528-M531 PolarHBondContact O-N 3.02Å; M531-I533 PolarHBondContact O-N 2.86Å; M531-H534 PolarHBondContact O-N 3.33Å; M531-T535 PolarHBondContact O-N 3.34Å; M531-T535 PolarHBondContact O-OG1 3.01Å
532	R	91.1	Very high	89.7	Confident	55 Å²	55	72.1 Å²	72.1	21%	0.208	38%	0.376	C	S	.	.	H	α-helix	trans	-66.6	-20.9	173.1	-63.3	-176	-178.8	149.6	4.7	113.9	T529 H530 T535 G536 E537 S550	T529-R532 WeakPolarHBondContact O-CB 3.38Å; T529-R532 PolarHBondContact O-N 3.44Å; H530-R532 PolarHBondContact O-N 3.22Å; H530-R532 VanDerWaalsContact O-N 3.1Å; R532-T535 WeakPolarHBondContact CA-OG1 2.96Å; R532-G536 CarbonylContact O-C 3.31Å; R532-G536 WeakPolarHBondContact O-CA 3.21Å; R532-G536 PolarHBondContact O-N 3.33Å; R532-E537 HydrophobicContact CG-CB 4.27Å; R532-E537 PolarHBondContact O-N 2.98Å; R532-S550 VanDerWaalsContact CD-O 3.31Å; R532-S550 WeakPolarHBondContact CD-O 3.44Å; R532-S550 PolarHBondContact NH1-O 3.11Å
533	I	88.9	Confident	89.6	Confident	124 Å²	124	77.3 Å²	77.3	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-70.2	-40.7	174.3	-58	175.4	0	0	0	109.7	H530 M531	H530-I533 VanDerWaalsContact O-CB 3.3Å; H530-I533 WeakPolarHBondContact O-CB 3.42Å; H530-I533 WeakPolarHBondContact O-CG1 3.39Å; H530-I533 PolarHBondContact O-N 3.4Å; M531-I533 PolarHBondContact O-N 2.86Å
534	H	88.9	Confident	89.4	Confident	68 Å²	68	77.7 Å²	77.7	32%	0.315	42%	0.417	S	S	.	.	H	α-helix	trans	-76.1	-39	179.9	-59.6	-55.4	0	0	0	112.8	C514 I516 C517 H530 M531	C514-H534 PolarHBondContact SG-NE2 3.33Å; C514-H534 VanDerWaalsContact SG-NE2 3.39Å; I516-H534 HydrophobicContact CD1-CB 3.59Å; C517-H534 PolarHBondContact SG-NE2 3.34Å; H530-H534 AromaticContact CD2-NE2 3.83Å; H530-H534 AromaticContact CE1-NE2 3.65Å; H530-H534 AromaticContact NE2-CD2 3.81Å; H530-H534 AromaticContact NE2-CE1 3.97Å; H530-H534 AromaticContact NE2-NE2 3.02Å; H530-H534 PolarHBondContact NE2-NE2 3.09Å; M531-H534 PolarHBondContact O-N 3.33Å
535	T	87.8	Confident	89.4	Confident	80 Å²	80	77.2 Å²	77.2	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-84.1	-14	-179.4	53.1	0	0	0	0	113.2	M531 R532 E537	M531-T535 PolarHBondContact O-N 3.34Å; M531-T535 PolarHBondContact O-OG1 3.01Å; R532-T535 WeakPolarHBondContact CA-OG1 2.96Å; T535-E537 PolarHBondContact O-N 2.55Å
536	G	85.8	Confident	89.3	Confident	50 Å²	50	76.4 Å²	76.4	52%	0.515	42%	0.416	S	S	.	.			trans	68	5.8	-173.9	0	0	0	0	0	114.4	R532 K538	R532-G536 CarbonylContact O-C 3.31Å; R532-G536 WeakPolarHBondContact O-CA 3.21Å; R532-G536 PolarHBondContact O-N 3.33Å; G536-K538 PolarHBondContact O-N 3.38Å
537	E	89.1	Confident	89.2	Confident	115 Å²	115	80.6 Å²	80.6	54%	0.537	43%	0.429	S	S	.	.			trans	-60.7	123.3	-177.8	-76.6	-174.7	177.1	0	0	111.8	R532 T535 P539	R532-E537 HydrophobicContact CG-CB 4.27Å; R532-E537 PolarHBondContact O-N 2.98Å; T535-E537 PolarHBondContact O-N 2.55Å; E537-P539 WeakPolarHBondContact O-CD 2.99Å
538	K	89.2	Confident	89.1	Confident	122 Å²	122	81 Å²	81	53%	0.53	44%	0.436	S	S	.	.			trans	-122	78.6	175.9	-69.5	172.7	176.1	-174.3	0	110.5	G536 Y540 A548 F549	G536-K538 PolarHBondContact O-N 3.38Å; K538-Y540 PolarHBondContact O-N 3.39Å; K538-A548 HydrophobicContact CB-CB 3.67Å; K538-A548 HydrophobicContact CD-CB 4.26Å; K538-A548 WeakPolarHBondContact CD-O 3.41Å; K538-F549 CarbonylContact C-O 3.56Å; K538-F549 WeakPolarHBondContact CA-O 3.39Å
539	P	89.2	Confident	89.1	Confident	70 Å²	70	77.4 Å²	77.4	46%	0.455	42%	0.417	S	S	.	.			trans	-68.2	-21.7	-172.3	-20.2	33.4	0	0	0	113.9	E537	E537-P539 WeakPolarHBondContact O-CD 2.99Å
540	Y	90.4	Very high	89	Confident	79 Å²	79	77.4 Å²	77.4	31%	0.31	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	100.9	-170.3	-57.7	-75.7	0	0	0	110.5	K538 A548 F549	K538-Y540 PolarHBondContact O-N 3.39Å; Y540-A548 CarbonylContact O-C 3.58Å; Y540-A548 WeakPolarHBondContact O-CA 3.36Å; Y540-F549 PolarHBondContact N-O 3.47Å; Y540-F549 PolarHBondContact O-N 3.21Å
541	K	89.7	Confident	88.8	Confident	148 Å²	148	80.2 Å²	80.2	64%	0.643	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.9	179.9	-63.4	-177.4	-179.9	-178.1	0	111.3	K543 A548	K541-K543 PolarHBondContact O-N 2.67Å; K541-A548 HydrophobicContact CG-CB 3.94Å
542	C	92.1	Very high	88.9	Confident	3 Å²	3	81 Å²	81	2%	0.02	44%	0.443	C	S	.	.			trans	-71	122.6	170.5	-176.1	0	0	0	0	109.5	A544 G546 K547 F549 L555	C542-A544 VanDerWaalsContact C-N 3.31Å; C542-A544 PolarHBondContact O-N 3.39Å; C542-G546 WeakPolarHBondContact O-CA 3.4Å; C542-G546 PolarHBondContact O-N 3.12Å; C542-K547 WeakPolarHBondContact CB-O 3.13Å; C542-K547 PolarHBondContact N-O 3.09Å; C542-F549 HydrophobicContact CB-CE2 4.43Å; C542-L555 HydrophobicContact CB-CD1 3.71Å
543	K	88.1	Confident	88.8	Confident	207 Å²	207	81.2 Å²	81.2	90%	0.9	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-30	178.6	-66.1	-172.1	178.3	-175.6	0	112.8	K541	K541-K543 PolarHBondContact O-N 2.67Å
544	A	85.9	Confident	88.8	Confident	81 Å²	81	77.4 Å²	77.4	67%	0.669	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-41.3	-176.9	0	0	0	0	0	112.9	C542	C542-A544 VanDerWaalsContact C-N 3.31Å; C542-A544 PolarHBondContact O-N 3.39Å
545	C	90.9	Very high	88.9	Confident	51 Å²	51	75.2 Å²	75.2	35%	0.345	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	9.9	-173.3	78.2	0	0	0	0	114.6	K547 H558	C545-K547 PolarHBondContact O-N 3.1Å; C545-H558 PolarHBondContact SG-NE2 3.37Å
546	G	86.4	Confident	88.9	Confident	55 Å²	55	73.4 Å²	73.4	57%	0.567	42%	0.42	S	S	*	.			trans	70.2	-9.8	176.5	0	0	0	0	0	116.5	C542 A548	C542-G546 WeakPolarHBondContact O-CA 3.4Å; C542-G546 PolarHBondContact O-N 3.12Å; G546-A548 PolarHBondContact O-N 3.3Å
547	K	89.6	Confident	89.1	Confident	131 Å²	131	75.6 Å²	75.6	57%	0.57	42%	0.42	S	S	*	.			trans	-60	131.2	-178.5	-73.5	-178	-179.4	177	0	111.2	C542 C545 F549	C542-K547 WeakPolarHBondContact CB-O 3.13Å; C542-K547 PolarHBondContact N-O 3.09Å; C545-K547 PolarHBondContact O-N 3.1Å; K547-F549 HydrophobicContact CB-CE2 3.84Å; K547-F549 HydrophobicContact CB-CZ 3.98Å; K547-F549 WeakPolarHBondContact O-CE2 3.29Å
548	A	89.9	Confident	89.1	Confident	33 Å²	33	71.4 Å²	71.4	27%	0.273	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.2	-178	0	0	0	0	0	111.7	K538 Y540 K541 G546	K538-A548 HydrophobicContact CB-CB 3.67Å; K538-A548 HydrophobicContact CD-CB 4.26Å; K538-A548 WeakPolarHBondContact CD-O 3.41Å; Y540-A548 CarbonylContact O-C 3.58Å; Y540-A548 WeakPolarHBondContact O-CA 3.36Å; K541-A548 HydrophobicContact CG-CB 3.94Å; G546-A548 PolarHBondContact O-N 3.3Å
549	F	88.8	Confident	89.1	Confident	42 Å²	42	69.9 Å²	69.9	18%	0.184	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150.4	-176.6	-58.1	-90.1	0	0	0	111	K538 Y540 C542 K547 L555 H558	K538-F549 CarbonylContact C-O 3.56Å; K538-F549 WeakPolarHBondContact CA-O 3.39Å; Y540-F549 PolarHBondContact N-O 3.47Å; Y540-F549 PolarHBondContact O-N 3.21Å; C542-F549 HydrophobicContact CB-CE2 4.43Å; K547-F549 HydrophobicContact CB-CE2 3.84Å; K547-F549 HydrophobicContact CB-CZ 3.98Å; K547-F549 WeakPolarHBondContact O-CE2 3.29Å; F549-L555 HydrophobicContact CB-CB 4.43Å; F549-L555 HydrophobicContact CD2-CB 4.01Å; F549-L555 HydrophobicContact CD2-CD1 3.87Å; F549-L555 HydrophobicContact CE2-CD1 4.02Å; F549-L555 HydrophobicContact CG-CB 4.4Å; F549-H558 HydrophobicContact CE1-CB 4.07Å; F549-H558 HydrophobicContact CE2-CB 3.96Å; F549-H558 AromaticContact CE2-CD2 3.39Å; F549-H558 WeakPolarHBondContact CE2-CD2 3.47Å; F549-H558 AromaticContact CE2-CG 3.75Å; F549-H558 HydrophobicContact CZ-CB 3.51Å; F549-H558 AromaticContact CZ-CD2 3.4Å; F549-H558 VanDerWaalsContact CZ-CD2 3.4Å; F549-H558 WeakPolarHBondContact CZ-CD2 3.45Å; F549-H558 AromaticContact CZ-CG 3.31Å; F549-H558 AromaticContact CZ-ND1 3.95Å
550	S	86.5	Confident	89.1	Confident	40 Å²	40	73.1 Å²	73.1	28%	0.28	40%	0.402	S	S	.	.	S	Bend	trans	-80.7	-16.9	178.2	57.1	0	0	0	0	113.1	R532	R532-S550 VanDerWaalsContact CD-O 3.31Å; R532-S550 WeakPolarHBondContact CD-O 3.44Å; R532-S550 PolarHBondContact NH1-O 3.11Å
551	Q	88.4	Confident	89	Confident	80 Å²	80	74 Å²	74	37%	0.374	42%	0.416	S	S	.	.	S	Bend	trans	-132.9	147.3	-180	-58.4	-175.8	10.6	0	0	111.6	T529 S554 L555	T529-Q551 HydrophobicContact CG2-CG 4.2Å; Q551-S554 PolarHBondContact O-N 3.26Å; Q551-L555 PolarHBondContact O-N 3.29Å
552	S	89.5	Confident	88.6	Confident	68 Å²	68	71.2 Å²	71.2	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-69.8	-33.1	179.1	55.4	0	0	0	0	112.7	S554 L555 A556	S552-S554 VanDerWaalsContact C-N 3.35Å; S552-L555 PolarHBondContact O-N 3.32Å; S552-A556 WeakPolarHBondContact O-CB 3.49Å; S552-A556 PolarHBondContact O-N 3.24Å
553	S	90	Very high	87	Confident	59 Å²	59	80.3 Å²	80.3	41%	0.413	45%	0.454	S	S	.	.	H	α-helix	trans	-61.8	-41.6	174.2	47.9	0	0	0	0	111.9	A556 N557	S553-A556 PolarHBondContact O-N 3.17Å; S553-N557 PolarHBondContact O-N 2.74Å
554	S	89.3	Confident	86.9	Confident	44 Å²	44	74 Å²	74	31%	0.308	43%	0.431	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175.1	-52.3	0	0	0	0	111.7	Q551 S552 H558	Q551-S554 PolarHBondContact O-N 3.26Å; S552-S554 VanDerWaalsContact C-N 3.35Å; S554-H558 WeakPolarHBondContact O-CB 3.37Å; S554-H558 PolarHBondContact O-N 3.47Å
555	L	89.7	Confident	87	Confident	21 Å²	21	73.6 Å²	73.6	11%	0.11	42%	0.419	C	S	.	.	H	α-helix	trans	-62.5	-46.5	172.5	173.7	63.2	0	0	0	111.2	C542 F549 Q551 S552 N557 H558 Q559	C542-L555 HydrophobicContact CB-CD1 3.71Å; F549-L555 HydrophobicContact CB-CB 4.43Å; F549-L555 HydrophobicContact CD2-CB 4.01Å; F549-L555 HydrophobicContact CD2-CD1 3.87Å; F549-L555 HydrophobicContact CE2-CD1 4.02Å; F549-L555 HydrophobicContact CG-CB 4.4Å; Q551-L555 PolarHBondContact O-N 3.29Å; S552-L555 PolarHBondContact O-N 3.32Å; L555-N557 VanDerWaalsContact C-N 3.33Å; L555-N557 PolarHBondContact O-N 3.44Å; L555-H558 CarbonylContact O-C 3.55Å; L555-H558 WeakPolarHBondContact O-CB 3.5Å; L555-H558 PolarHBondContact O-N 3.46Å; L555-H558 VanDerWaalsContact O-N 3.16Å; L555-Q559 HydrophobicContact CD1-CG 3.96Å; L555-Q559 HydrophobicContact CG-CG 4.28Å; L555-Q559 WeakPolarHBondContact O-CG 3.49Å; L555-Q559 PolarHBondContact O-N 3.1Å
556	A	89.1	Confident	86.8	Confident	42 Å²	42	74.8 Å²	74.8	35%	0.347	42%	0.423	S	S	.	.	H	α-helix	trans	-61.1	-41.6	-179.9	0	0	0	0	0	112	S552 S553 Q559 K560	S552-A556 WeakPolarHBondContact O-CB 3.49Å; S552-A556 PolarHBondContact O-N 3.24Å; S553-A556 PolarHBondContact O-N 3.17Å; A556-Q559 PolarHBondContact O-N 2.9Å; A556-K560 WeakPolarHBondContact O-CG 3.27Å; A556-K560 PolarHBondContact O-N 3.18Å
557	N	89.7	Confident	86.8	Confident	97 Å²	97	76 Å²	76	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-66.5	-38.8	174.8	-73.5	-13.6	0	0	0	112	S553 L555 K560	S553-N557 PolarHBondContact O-N 2.74Å; L555-N557 VanDerWaalsContact C-N 3.33Å; L555-N557 PolarHBondContact O-N 3.44Å; N557-K560 WeakPolarHBondContact O-CB 3.5Å; N557-K560 PolarHBondContact O-N 3.39Å
558	H	89.6	Confident	86.6	Confident	26 Å²	26	72.6 Å²	72.6	12%	0.12	41%	0.405	C	S	.	.	H	α-helix	trans	-67.2	-37.2	174.2	173.1	61.4	0	0	0	112.7	C545 F549 S554 L555 K560 T561 H562	C545-H558 PolarHBondContact SG-NE2 3.37Å; F549-H558 HydrophobicContact CE1-CB 4.07Å; F549-H558 HydrophobicContact CE2-CB 3.96Å; F549-H558 AromaticContact CE2-CD2 3.39Å; F549-H558 WeakPolarHBondContact CE2-CD2 3.47Å; F549-H558 AromaticContact CE2-CG 3.75Å; F549-H558 HydrophobicContact CZ-CB 3.51Å; F549-H558 AromaticContact CZ-CD2 3.4Å; F549-H558 VanDerWaalsContact CZ-CD2 3.4Å; F549-H558 WeakPolarHBondContact CZ-CD2 3.45Å; F549-H558 AromaticContact CZ-CG 3.31Å; F549-H558 AromaticContact CZ-ND1 3.95Å; S554-H558 WeakPolarHBondContact O-CB 3.37Å; S554-H558 PolarHBondContact O-N 3.47Å; L555-H558 CarbonylContact O-C 3.55Å; L555-H558 WeakPolarHBondContact O-CB 3.5Å; L555-H558 PolarHBondContact O-N 3.46Å; L555-H558 VanDerWaalsContact O-N 3.16Å; H558-K560 PolarHBondContact O-N 3.2Å; H558-T561 PolarHBondContact O-N 2.92Å; H558-T561 PolarHBondContact O-OG1 3.36Å; H558-H562 AromaticContact CD2-NE2 3.78Å; H558-H562 AromaticContact CE1-CD2 3.9Å; H558-H562 AromaticContact CE1-NE2 3.11Å; H558-H562 PolarHBondContact CE1-NE2 3.09Å; H558-H562 AromaticContact ND1-NE2 4Å; H558-H562 AromaticContact NE2-CD2 3.72Å; H558-H562 AromaticContact NE2-NE2 2.94Å; H558-H562 PolarHBondContact NE2-NE2 3.2Å; H558-H562 PolarHBondContact O-CD2 3.37Å
559	Q	88.1	Confident	86.4	Confident	90 Å²	90	75.2 Å²	75.2	42%	0.421	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-31.2	176	-76.3	175.9	-44	0	0	112	L555 A556 T561 H562	L555-Q559 HydrophobicContact CD1-CG 3.96Å; L555-Q559 HydrophobicContact CG-CG 4.28Å; L555-Q559 WeakPolarHBondContact O-CG 3.49Å; L555-Q559 PolarHBondContact O-N 3.1Å; A556-Q559 PolarHBondContact O-N 2.9Å; Q559-T561 PolarHBondContact O-N 3.14Å; Q559-H562 PolarHBondContact O-N 3.17Å; Q559-H562 VanDerWaalsContact O-N 3.14Å
560	K	89.3	Confident	86.2	Confident	138 Å²	138	77.6 Å²	77.6	60%	0.6	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.8	173	-66.5	172.8	-176.5	176.8	0	113.9	A556 N557 H558 H562	A556-K560 WeakPolarHBondContact O-CG 3.27Å; A556-K560 PolarHBondContact O-N 3.18Å; N557-K560 WeakPolarHBondContact O-CB 3.5Å; N557-K560 PolarHBondContact O-N 3.39Å; H558-K560 PolarHBondContact O-N 3.2Å; K560-H562 VanDerWaalsContact C-N 3.32Å
561	T	87.8	Confident	86.2	Confident	98 Å²	98	80.5 Å²	80.5	60%	0.601	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.8	176	73.5	0	0	0	0	112.9	H558 Q559	H558-T561 PolarHBondContact O-N 2.92Å; H558-T561 PolarHBondContact O-OG1 3.36Å; Q559-T561 PolarHBondContact O-N 3.14Å
562	H	81.2	Confident	86	Confident	90 Å²	90	80.5 Å²	80.5	42%	0.417	45%	0.447	S	S	.	.			trans	-100.8	-4.8	171.5	-66.7	-80.5	0	0	0	112.3	H558 Q559 K560	H558-H562 AromaticContact CD2-NE2 3.78Å; H558-H562 AromaticContact CE1-CD2 3.9Å; H558-H562 AromaticContact CE1-NE2 3.11Å; H558-H562 PolarHBondContact CE1-NE2 3.09Å; H558-H562 AromaticContact ND1-NE2 4Å; H558-H562 AromaticContact NE2-CD2 3.72Å; H558-H562 AromaticContact NE2-NE2 2.94Å; H558-H562 PolarHBondContact NE2-NE2 3.2Å; H558-H562 PolarHBondContact O-CD2 3.37Å; Q559-H562 PolarHBondContact O-N 3.17Å; Q559-H562 VanDerWaalsContact O-N 3.14Å; K560-H562 VanDerWaalsContact C-N 3.32Å
563	N	59.3	Low	85.7	Confident	193 Å²	193	81.6 Å²	81.6	100%	1.032	44%	0.444	S	S	*	.			trans	-91.2	0	161.2	-66.7	-11.2	0	0	0	107.9

Retrieved 563 of 563 residues in 82.7 ms (Link to these results)

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